diff --git a/modules/seq/alg/tests/test_distance_analysis.cc b/modules/seq/alg/tests/test_distance_analysis.cc
index 9be0d6fe0065a55dde64dd980e7ee4214bed49c0..c76ed94eff7c2e5a25d338bcd4e61052cd546b1b 100644
--- a/modules/seq/alg/tests/test_distance_analysis.cc
+++ b/modules/seq/alg/tests/test_distance_analysis.cc
@@ -31,6 +31,7 @@
#include <ost/seq/alg/distance_map.hh>
#include <ost/seq/alg/variance_map.hh>
#include <ost/integrity_error.hh>
+#include <ost/mol/alg/local_dist_diff_test.hh>
using namespace ost;
using namespace ost::seq;
@@ -265,4 +266,54 @@ BOOST_AUTO_TEST_CASE(test_dist_to_mean) {
BOOST_CHECK_EQUAL(std::count(json.begin(), json.end(), ','), 1*8 + 7);
}
+BOOST_AUTO_TEST_CASE(test_avg_lddt) {
+
+ // deliberately load different structures than in other tests
+ // as we need a bit a bigger structure to also test things like the 15A
+ // threshold in lDDT. We compare the ouput of MeanlDDTHA with the classic
+ // lDDT. As there are only two structures in the alignment, there
+ // is no real average and the outputs from the two algorithms should be
+ // consistent.
+
+ mol::EntityView calmodulin_1 =
+ io::LoadEntity("testfiles/calmodulin_01.pdb").Select("aname=CA");
+ mol::EntityView calmodulin_2 =
+ io::LoadEntity("testfiles/calmodulin_02.pdb").Select("aname=CA");
+
+ std::stringstream ss;
+ ost::mol::ResidueViewList r_list = calmodulin_1.GetResidueList();
+ for(auto r_it = r_list.begin(); r_it != r_list.end(); ++r_it) {
+ ss << r_it->GetOneLetterCode();
+ }
+
+ AlignmentHandle aln = CreateAlignment();
+ aln.AddSequence(CreateSequence("ref", ss.str()));
+ aln.AddSequence(CreateSequence("A", ss.str()));
+ aln.AddSequence(CreateSequence("B", ss.str()));
+
+ aln.AttachView(1, calmodulin_1);
+ aln.AttachView(2, calmodulin_2);
+
+ ost::mol::alg::GlobalRDMap dl_1 = mol::alg::CreateDistanceList(calmodulin_1, 15.0);
+ ost::mol::alg::GlobalRDMap dl_2 = mol::alg::CreateDistanceList(calmodulin_2, 15.0);
+
+ ost::mol::alg::LDDTHA(calmodulin_1, dl_2);
+ ost::mol::alg::LDDTHA(calmodulin_2, dl_1);
+
+ alg::DistanceMapPtr dmap = alg::CreateDistanceMap(aln);
+ alg::MeanlDDTPtr mean_lddt = alg::CreateMeanlDDTHA(dmap);
+
+ r_list = calmodulin_1.GetResidueList();
+ int r_idx = 0;
+ for(auto r_it = r_list.begin(); r_it != r_list.end(); ++r_it, ++r_idx) {
+ BOOST_CHECK_CLOSE(r_it->GetFloatProp("locallddt"), mean_lddt->Get(r_idx, 0), 1e-4);
+ }
+
+ r_list = calmodulin_2.GetResidueList();
+ r_idx = 0;
+ for(auto r_it = r_list.begin(); r_it != r_list.end(); ++r_it, ++r_idx) {
+ BOOST_CHECK_CLOSE(r_it->GetFloatProp("locallddt"), mean_lddt->Get(r_idx, 1), 1e-4);
+ }
+}
+
BOOST_AUTO_TEST_SUITE_END();
diff --git a/modules/seq/alg/tests/testfiles/calmodulin_01.pdb b/modules/seq/alg/tests/testfiles/calmodulin_01.pdb
new file mode 100644
index 0000000000000000000000000000000000000000..955db9f781fc1c97d6b392f547e57a04968cc980
--- /dev/null
+++ b/modules/seq/alg/tests/testfiles/calmodulin_01.pdb
@@ -0,0 +1,1088 @@
+ATOM 10 N LEU A 4 19.205 10.386 28.983 1.00 39.18 N
+ATOM 11 CA LEU A 4 18.605 9.290 28.235 1.00 36.31 C
+ATOM 12 C LEU A 4 17.213 9.037 28.801 1.00 35.84 C
+ATOM 13 O LEU A 4 17.018 9.107 30.010 1.00 39.26 O
+ATOM 14 CB LEU A 4 19.456 8.027 28.369 1.00 31.42 C
+ATOM 15 CG LEU A 4 19.313 6.973 27.273 1.00 21.55 C
+ATOM 16 CD1 LEU A 4 19.849 7.528 25.979 1.00 11.27 C
+ATOM 17 CD2 LEU A 4 20.067 5.718 27.664 1.00 25.25 C
+ATOM 18 N THR A 5 16.247 8.750 27.935 1.00 34.52 N
+ATOM 19 CA THR A 5 14.887 8.489 28.398 1.00 40.86 C
+ATOM 20 C THR A 5 14.515 7.018 28.237 1.00 38.94 C
+ATOM 21 O THR A 5 15.133 6.295 27.454 1.00 43.03 O
+ATOM 22 CB THR A 5 13.860 9.355 27.638 1.00 45.64 C
+ATOM 23 OG1 THR A 5 13.657 8.830 26.319 1.00 50.70 O
+ATOM 24 CG2 THR A 5 14.358 10.787 27.536 1.00 52.15 C
+ATOM 25 N GLU A 6 13.510 6.575 28.984 1.00 34.49 N
+ATOM 26 CA GLU A 6 13.069 5.188 28.903 1.00 37.27 C
+ATOM 27 C GLU A 6 12.664 4.867 27.471 1.00 37.31 C
+ATOM 28 O GLU A 6 12.612 3.702 27.073 1.00 39.96 O
+ATOM 29 CB GLU A 6 11.890 4.948 29.844 1.00 31.07 C
+ATOM 30 N GLU A 7 12.384 5.907 26.696 1.00 34.24 N
+ATOM 31 CA GLU A 7 11.978 5.725 25.315 1.00 35.39 C
+ATOM 32 C GLU A 7 13.190 5.453 24.435 1.00 35.49 C
+ATOM 33 O GLU A 7 13.197 4.495 23.657 1.00 34.90 O
+ATOM 34 CB GLU A 7 11.226 6.962 24.820 1.00 40.46 C
+ATOM 35 CG GLU A 7 10.408 6.731 23.559 1.00 50.81 C
+ATOM 36 CD GLU A 7 10.284 7.984 22.707 1.00 59.03 C
+ATOM 37 OE1 GLU A 7 11.013 8.962 22.981 1.00 60.58 O
+ATOM 38 OE2 GLU A 7 9.460 7.994 21.765 1.00 65.06 O
+ATOM 39 N GLN A 8 14.213 6.295 24.555 1.00 30.26 N
+ATOM 40 CA GLN A 8 15.420 6.107 23.767 1.00 25.38 C
+ATOM 41 C GLN A 8 15.960 4.718 24.072 1.00 24.93 C
+ATOM 42 O GLN A 8 16.377 3.985 23.173 1.00 26.03 O
+ATOM 43 CB GLN A 8 16.467 7.149 24.134 1.00 30.51 C
+ATOM 44 CG GLN A 8 16.268 8.496 23.470 1.00 36.95 C
+ATOM 45 CD GLN A 8 16.592 9.644 24.404 1.00 36.97 C
+ATOM 46 OE1 GLN A 8 15.870 9.897 25.365 1.00 39.41 O
+ATOM 47 NE2 GLN A 8 17.685 10.340 24.130 1.00 35.14 N
+ATOM 48 N ILE A 9 15.952 4.366 25.352 1.00 20.08 N
+ATOM 49 CA ILE A 9 16.431 3.063 25.789 1.00 21.15 C
+ATOM 50 C ILE A 9 15.622 1.943 25.137 1.00 23.36 C
+ATOM 51 O ILE A 9 16.178 0.911 24.755 1.00 25.63 O
+ATOM 52 CB ILE A 9 16.327 2.917 27.321 1.00 24.01 C
+ATOM 53 CG1 ILE A 9 17.185 3.985 28.003 1.00 26.50 C
+ATOM 54 CG2 ILE A 9 16.783 1.537 27.748 1.00 20.75 C
+ATOM 55 CD1 ILE A 9 16.676 4.395 29.364 1.00 23.62 C
+ATOM 56 N ALA A 10 14.313 2.146 25.008 1.00 17.93 N
+ATOM 57 CA ALA A 10 13.446 1.141 24.401 1.00 16.57 C
+ATOM 58 C ALA A 10 13.623 1.082 22.892 1.00 16.41 C
+ATOM 59 O ALA A 10 13.408 0.040 22.272 1.00 18.88 O
+ATOM 60 CB ALA A 10 11.989 1.427 24.738 1.00 21.75 C
+ATOM 61 N GLU A 11 14.009 2.196 22.290 1.00 14.14 N
+ATOM 62 CA GLU A 11 14.201 2.207 20.850 1.00 20.13 C
+ATOM 63 C GLU A 11 15.539 1.559 20.542 1.00 23.90 C
+ATOM 64 O GLU A 11 15.757 1.029 19.443 1.00 21.19 O
+ATOM 65 CB GLU A 11 14.159 3.637 20.320 1.00 20.75 C
+ATOM 66 CG GLU A 11 12.803 4.302 20.499 1.00 25.96 C
+ATOM 67 CD GLU A 11 12.751 5.676 19.877 1.00 31.58 C
+ATOM 68 OE1 GLU A 11 13.402 6.593 20.415 1.00 35.52 O
+ATOM 69 OE2 GLU A 11 12.064 5.838 18.848 1.00 41.92 O
+ATOM 70 N PHE A 12 16.418 1.606 21.543 1.00 23.96 N
+ATOM 71 CA PHE A 12 17.753 1.029 21.471 1.00 22.52 C
+ATOM 72 C PHE A 12 17.683 -0.486 21.673 1.00 25.61 C
+ATOM 73 O PHE A 12 18.565 -1.215 21.228 1.00 29.58 O
+ATOM 74 CB PHE A 12 18.640 1.623 22.559 1.00 21.02 C
+ATOM 75 CG PHE A 12 19.315 2.902 22.171 1.00 11.50 C
+ATOM 76 CD1 PHE A 12 19.728 3.118 20.868 1.00 9.04 C
+ATOM 77 CD2 PHE A 12 19.541 3.891 23.120 1.00 9.31 C
+ATOM 78 CE1 PHE A 12 20.360 4.306 20.507 1.00 8.10 C
+ATOM 79 CE2 PHE A 12 20.170 5.079 22.776 1.00 13.87 C
+ATOM 80 CZ PHE A 12 20.581 5.289 21.460 1.00 5.50 C
+ATOM 81 N LYS A 13 16.644 -0.951 22.363 1.00 24.95 N
+ATOM 82 CA LYS A 13 16.471 -2.377 22.610 1.00 22.15 C
+ATOM 83 C LYS A 13 15.857 -2.992 21.369 1.00 26.91 C
+ATOM 84 O LYS A 13 16.064 -4.172 21.069 1.00 27.19 O
+ATOM 85 CB LYS A 13 15.547 -2.605 23.802 1.00 22.23 C
+ATOM 86 CG LYS A 13 15.500 -4.046 24.297 1.00 25.86 C
+ATOM 87 CD LYS A 13 16.895 -4.645 24.415 1.00 35.90 C
+ATOM 88 CE LYS A 13 16.871 -5.966 25.165 1.00 34.40 C
+ATOM 89 NZ LYS A 13 15.703 -6.803 24.761 1.00 41.58 N
+ATOM 90 N GLU A 14 15.095 -2.180 20.648 1.00 24.65 N
+ATOM 91 CA GLU A 14 14.462 -2.638 19.428 1.00 19.41 C
+ATOM 92 C GLU A 14 15.545 -2.834 18.374 1.00 12.87 C
+ATOM 93 O GLU A 14 15.706 -3.931 17.850 1.00 13.27 O
+ATOM 94 CB GLU A 14 13.435 -1.617 18.959 1.00 23.89 C
+ATOM 95 CG GLU A 14 12.022 -2.134 18.985 1.00 33.16 C
+ATOM 96 CD GLU A 14 11.065 -1.215 18.261 1.00 48.91 C
+ATOM 97 OE1 GLU A 14 11.419 -0.753 17.155 1.00 50.20 O
+ATOM 98 OE2 GLU A 14 9.962 -0.955 18.797 1.00 55.73 O
+ATOM 99 N ALA A 15 16.292 -1.773 18.075 1.00 11.07 N
+ATOM 100 CA ALA A 15 17.376 -1.847 17.093 1.00 12.54 C
+ATOM 101 C ALA A 15 18.306 -3.011 17.421 1.00 15.86 C
+ATOM 102 O ALA A 15 18.766 -3.725 16.523 1.00 17.20 O
+ATOM 103 CB ALA A 15 18.159 -0.556 17.084 1.00 11.16 C
+ATOM 104 N PHE A 16 18.590 -3.191 18.710 1.00 11.77 N
+ATOM 105 CA PHE A 16 19.443 -4.289 19.155 1.00 13.59 C
+ATOM 106 C PHE A 16 18.876 -5.574 18.565 1.00 13.46 C
+ATOM 107 O PHE A 16 19.610 -6.415 18.070 1.00 16.65 O
+ATOM 108 CB PHE A 16 19.455 -4.380 20.692 1.00 13.03 C
+ATOM 109 CG PHE A 16 20.419 -5.405 21.240 1.00 16.79 C
+ATOM 110 CD1 PHE A 16 21.770 -5.109 21.376 1.00 8.17 C
+ATOM 111 CD2 PHE A 16 19.977 -6.681 21.592 1.00 19.38 C
+ATOM 112 CE1 PHE A 16 22.667 -6.066 21.849 1.00 6.84 C
+ATOM 113 CE2 PHE A 16 20.873 -7.640 22.064 1.00 16.44 C
+ATOM 114 CZ PHE A 16 22.219 -7.329 22.191 1.00 9.62 C
+ATOM 115 N SER A 17 17.555 -5.708 18.606 1.00 19.81 N
+ATOM 116 CA SER A 17 16.889 -6.892 18.075 1.00 20.39 C
+ATOM 117 C SER A 17 17.066 -7.042 16.565 1.00 22.87 C
+ATOM 118 O SER A 17 16.940 -8.144 16.029 1.00 22.65 O
+ATOM 119 CB SER A 17 15.400 -6.853 18.419 1.00 24.59 C
+ATOM 120 OG SER A 17 15.179 -7.272 19.759 1.00 33.65 O
+ATOM 121 N LEU A 18 17.341 -5.944 15.868 1.00 22.27 N
+ATOM 122 CA LEU A 18 17.543 -6.036 14.428 1.00 25.03 C
+ATOM 123 C LEU A 18 18.811 -6.854 14.191 1.00 25.88 C
+ATOM 124 O LEU A 18 18.858 -7.718 13.308 1.00 23.76 O
+ATOM 125 CB LEU A 18 17.721 -4.648 13.801 1.00 20.88 C
+ATOM 126 CG LEU A 18 16.471 -3.824 13.495 1.00 18.98 C
+ATOM 127 CD1 LEU A 18 16.845 -2.686 12.583 1.00 21.11 C
+ATOM 128 CD2 LEU A 18 15.407 -4.689 12.857 1.00 18.93 C
+ATOM 129 N PHE A 19 19.833 -6.580 14.998 1.00 17.20 N
+ATOM 130 CA PHE A 19 21.114 -7.257 14.873 1.00 17.40 C
+ATOM 131 C PHE A 19 21.098 -8.682 15.409 1.00 16.41 C
+ATOM 132 O PHE A 19 21.499 -9.626 14.721 1.00 22.40 O
+ATOM 133 CB PHE A 19 22.196 -6.443 15.588 1.00 14.04 C
+ATOM 134 CG PHE A 19 22.525 -5.146 14.907 1.00 14.35 C
+ATOM 135 CD1 PHE A 19 23.466 -5.099 13.888 1.00 17.11 C
+ATOM 136 CD2 PHE A 19 21.898 -3.973 15.284 1.00 16.31 C
+ATOM 137 CE1 PHE A 19 23.777 -3.906 13.259 1.00 12.02 C
+ATOM 138 CE2 PHE A 19 22.206 -2.772 14.657 1.00 17.10 C
+ATOM 139 CZ PHE A 19 23.147 -2.741 13.644 1.00 7.99 C
+ATOM 140 N ASP A 20 20.637 -8.827 16.641 1.00 14.92 N
+ATOM 141 CA ASP A 20 20.569 -10.118 17.306 1.00 17.36 C
+ATOM 142 C ASP A 20 19.401 -10.948 16.793 1.00 16.32 C
+ATOM 143 O ASP A 20 18.411 -11.121 17.498 1.00 18.07 O
+ATOM 144 CB ASP A 20 20.421 -9.903 18.811 1.00 16.81 C
+ATOM 145 CG ASP A 20 20.140 -11.178 19.550 1.00 15.24 C
+ATOM 146 OD1 ASP A 20 20.787 -12.194 19.235 1.00 16.80 O
+ATOM 147 OD2 ASP A 20 19.274 -11.161 20.447 1.00 22.98 O
+ATOM 148 N LYS A 21 19.536 -11.477 15.577 1.00 17.48 N
+ATOM 149 CA LYS A 21 18.484 -12.276 14.946 1.00 22.94 C
+ATOM 150 C LYS A 21 18.113 -13.601 15.618 1.00 21.39 C
+ATOM 151 O LYS A 21 16.957 -13.996 15.578 1.00 28.46 O
+ATOM 152 CB LYS A 21 18.833 -12.553 13.479 1.00 22.67 C
+ATOM 153 CG LYS A 21 19.571 -11.424 12.789 1.00 29.23 C
+ATOM 154 CD LYS A 21 18.625 -10.558 11.968 1.00 30.08 C
+ATOM 155 CE LYS A 21 19.393 -9.544 11.134 1.00 26.02 C
+ATOM 156 NZ LYS A 21 18.491 -8.510 10.549 1.00 31.51 N
+ATOM 157 N ASP A 22 19.066 -14.306 16.213 1.00 19.90 N
+ATOM 158 CA ASP A 22 18.709 -15.565 16.852 1.00 12.86 C
+ATOM 159 C ASP A 22 18.165 -15.307 18.239 1.00 17.00 C
+ATOM 160 O ASP A 22 17.943 -16.242 19.009 1.00 21.41 O
+ATOM 161 CB ASP A 22 19.906 -16.513 16.929 1.00 15.02 C
+ATOM 162 CG ASP A 22 21.082 -15.915 17.650 1.00 16.02 C
+ATOM 163 OD1 ASP A 22 20.932 -14.837 18.255 1.00 25.35 O
+ATOM 164 OD2 ASP A 22 22.168 -16.532 17.609 1.00 23.42 O
+ATOM 165 N GLY A 23 17.955 -14.026 18.543 1.00 11.74 N
+ATOM 166 CA GLY A 23 17.427 -13.620 19.833 1.00 7.87 C
+ATOM 167 C GLY A 23 18.082 -14.197 21.076 1.00 14.45 C
+ATOM 168 O GLY A 23 17.392 -14.492 22.055 1.00 20.76 O
+ATOM 169 N ASP A 24 19.404 -14.349 21.066 1.00 20.50 N
+ATOM 170 CA ASP A 24 20.099 -14.899 22.226 1.00 15.44 C
+ATOM 171 C ASP A 24 20.739 -13.832 23.115 1.00 23.84 C
+ATOM 172 O ASP A 24 21.461 -14.154 24.061 1.00 24.42 O
+ATOM 173 CB ASP A 24 21.143 -15.926 21.774 1.00 9.52 C
+ATOM 174 CG ASP A 24 22.408 -15.292 21.238 1.00 20.96 C
+ATOM 175 OD1 ASP A 24 22.323 -14.246 20.541 1.00 23.06 O
+ATOM 176 OD2 ASP A 24 23.494 -15.861 21.512 1.00 18.07 O
+ATOM 177 N GLY A 25 20.474 -12.561 22.809 1.00 26.33 N
+ATOM 178 CA GLY A 25 20.999 -11.477 23.624 1.00 24.52 C
+ATOM 179 C GLY A 25 22.417 -11.026 23.346 1.00 28.86 C
+ATOM 180 O GLY A 25 22.968 -10.198 24.081 1.00 31.78 O
+ATOM 181 N THR A 26 23.011 -11.562 22.286 1.00 27.29 N
+ATOM 182 CA THR A 26 24.374 -11.200 21.903 1.00 17.08 C
+ATOM 183 C THR A 26 24.458 -11.021 20.397 1.00 15.48 C
+ATOM 184 O THR A 26 23.835 -11.761 19.635 1.00 14.37 O
+ATOM 185 CB THR A 26 25.373 -12.297 22.272 1.00 10.24 C
+ATOM 186 OG1 THR A 26 25.093 -13.464 21.490 1.00 13.37 O
+ATOM 187 CG2 THR A 26 25.268 -12.649 23.726 1.00 4.60 C
+ATOM 188 N ILE A 27 25.223 -10.031 19.965 1.00 11.63 N
+ATOM 189 CA ILE A 27 25.404 -9.810 18.545 1.00 9.23 C
+ATOM 190 C ILE A 27 26.757 -10.418 18.170 1.00 18.05 C
+ATOM 191 O ILE A 27 27.759 -10.252 18.878 1.00 11.32 O
+ATOM 192 CB ILE A 27 25.403 -8.316 18.209 1.00 10.35 C
+ATOM 193 CG1 ILE A 27 24.098 -7.686 18.703 1.00 11.71 C
+ATOM 194 CG2 ILE A 27 25.593 -8.116 16.691 1.00 8.40 C
+ATOM 195 CD1 ILE A 27 24.091 -6.174 18.684 1.00 4.12 C
+ATOM 196 N THR A 28 26.770 -11.147 17.063 1.00 18.11 N
+ATOM 197 CA THR A 28 27.981 -11.788 16.575 1.00 16.73 C
+ATOM 198 C THR A 28 28.476 -11.083 15.313 1.00 20.17 C
+ATOM 199 O THR A 28 27.844 -10.146 14.822 1.00 30.00 O
+ATOM 200 CB THR A 28 27.702 -13.264 16.255 1.00 19.14 C
+ATOM 201 OG1 THR A 28 26.713 -13.357 15.217 1.00 14.18 O
+ATOM 202 CG2 THR A 28 27.189 -13.981 17.498 1.00 13.41 C
+ATOM 203 N THR A 29 29.616 -11.520 14.795 1.00 20.68 N
+ATOM 204 CA THR A 29 30.158 -10.929 13.577 1.00 15.58 C
+ATOM 205 C THR A 29 29.275 -11.399 12.429 1.00 15.42 C
+ATOM 206 O THR A 29 29.042 -10.673 11.473 1.00 18.09 O
+ATOM 207 CB THR A 29 31.601 -11.406 13.321 1.00 18.54 C
+ATOM 208 OG1 THR A 29 31.663 -12.827 13.499 1.00 19.74 O
+ATOM 209 CG2 THR A 29 32.581 -10.735 14.298 1.00 18.58 C
+ATOM 210 N LYS A 30 28.793 -12.635 12.529 1.00 19.18 N
+ATOM 211 CA LYS A 30 27.925 -13.193 11.505 1.00 16.03 C
+ATOM 212 C LYS A 30 26.660 -12.348 11.439 1.00 14.13 C
+ATOM 213 O LYS A 30 26.240 -11.958 10.354 1.00 14.18 O
+ATOM 214 CB LYS A 30 27.552 -14.640 11.830 1.00 16.01 C
+ATOM 215 CG LYS A 30 28.710 -15.572 12.061 1.00 16.83 C
+ATOM 216 CD LYS A 30 28.207 -16.933 12.553 1.00 11.84 C
+ATOM 217 CE LYS A 30 28.866 -17.331 13.864 1.00 15.65 C
+ATOM 218 NZ LYS A 30 29.896 -16.321 14.287 1.00 14.41 N
+ATOM 219 N GLU A 31 26.055 -12.071 12.597 1.00 10.58 N
+ATOM 220 CA GLU A 31 24.834 -11.256 12.650 1.00 11.64 C
+ATOM 221 C GLU A 31 25.091 -9.812 12.186 1.00 12.82 C
+ATOM 222 O GLU A 31 24.255 -9.216 11.508 1.00 17.89 O
+ATOM 223 CB GLU A 31 24.243 -11.268 14.065 1.00 13.58 C
+ATOM 224 CG GLU A 31 23.997 -12.677 14.604 1.00 8.60 C
+ATOM 225 CD GLU A 31 23.364 -12.708 15.985 1.00 5.09 C
+ATOM 226 OE1 GLU A 31 23.875 -12.038 16.908 1.00 11.72 O
+ATOM 227 OE2 GLU A 31 22.345 -13.417 16.159 1.00 18.71 O
+ATOM 228 N LEU A 32 26.248 -9.257 12.537 1.00 6.90 N
+ATOM 229 CA LEU A 32 26.606 -7.904 12.109 1.00 8.29 C
+ATOM 230 C LEU A 32 26.774 -7.870 10.592 1.00 9.24 C
+ATOM 231 O LEU A 32 26.325 -6.930 9.921 1.00 6.38 O
+ATOM 232 CB LEU A 32 27.921 -7.461 12.758 1.00 11.42 C
+ATOM 233 CG LEU A 32 28.407 -6.020 12.521 1.00 14.40 C
+ATOM 234 CD1 LEU A 32 27.317 -5.001 12.894 1.00 7.96 C
+ATOM 235 CD2 LEU A 32 29.659 -5.786 13.362 1.00 4.15 C
+ATOM 236 N GLY A 33 27.430 -8.900 10.063 1.00 13.00 N
+ATOM 237 CA GLY A 33 27.659 -8.992 8.630 1.00 12.15 C
+ATOM 238 C GLY A 33 26.371 -9.022 7.826 1.00 16.05 C
+ATOM 239 O GLY A 33 26.225 -8.294 6.843 1.00 19.45 O
+ATOM 240 N THR A 34 25.417 -9.847 8.240 1.00 10.74 N
+ATOM 241 CA THR A 34 24.177 -9.928 7.497 1.00 14.18 C
+ATOM 242 C THR A 34 23.449 -8.595 7.468 1.00 13.22 C
+ATOM 243 O THR A 34 22.828 -8.249 6.461 1.00 16.11 O
+ATOM 244 CB THR A 34 23.257 -11.041 8.045 1.00 9.11 C
+ATOM 245 OG1 THR A 34 22.622 -10.606 9.247 1.00 24.69 O
+ATOM 246 CG2 THR A 34 24.065 -12.283 8.320 1.00 3.29 C
+ATOM 247 N VAL A 35 23.532 -7.835 8.555 1.00 19.46 N
+ATOM 248 CA VAL A 35 22.866 -6.533 8.590 1.00 18.15 C
+ATOM 249 C VAL A 35 23.627 -5.596 7.663 1.00 21.39 C
+ATOM 250 O VAL A 35 23.031 -4.874 6.863 1.00 19.98 O
+ATOM 251 CB VAL A 35 22.844 -5.925 10.016 1.00 12.06 C
+ATOM 252 CG1 VAL A 35 22.593 -4.427 9.939 1.00 6.42 C
+ATOM 253 CG2 VAL A 35 21.758 -6.592 10.854 1.00 6.78 C
+ATOM 254 N MET A 36 24.952 -5.617 7.769 1.00 23.05 N
+ATOM 255 CA MET A 36 25.777 -4.768 6.926 1.00 20.42 C
+ATOM 256 C MET A 36 25.388 -4.993 5.469 1.00 19.66 C
+ATOM 257 O MET A 36 25.148 -4.046 4.726 1.00 22.64 O
+ATOM 258 CB MET A 36 27.257 -5.099 7.121 1.00 22.63 C
+ATOM 259 CG MET A 36 27.827 -4.649 8.447 1.00 30.03 C
+ATOM 260 SD MET A 36 27.614 -2.887 8.775 1.00 35.64 S
+ATOM 261 CE MET A 36 28.835 -2.176 7.673 1.00 32.77 C
+ATOM 262 N ARG A 37 25.317 -6.255 5.064 1.00 20.60 N
+ATOM 263 CA ARG A 37 24.962 -6.579 3.691 1.00 17.99 C
+ATOM 264 C ARG A 37 23.552 -6.110 3.342 1.00 17.23 C
+ATOM 265 O ARG A 37 23.338 -5.565 2.269 1.00 20.22 O
+ATOM 266 CB ARG A 37 25.112 -8.090 3.444 1.00 17.16 C
+ATOM 267 CG ARG A 37 26.576 -8.561 3.347 1.00 13.11 C
+ATOM 268 CD ARG A 37 26.706 -9.954 2.745 1.00 5.30 C
+ATOM 269 NE ARG A 37 26.481 -11.003 3.741 1.00 7.73 N
+ATOM 270 CZ ARG A 37 27.084 -11.053 4.925 1.00 5.79 C
+ATOM 271 NH1 ARG A 37 27.955 -10.112 5.262 1.00 10.49 N
+ATOM 272 NH2 ARG A 37 26.806 -12.032 5.780 1.00 6.16 N
+ATOM 273 N SER A 38 22.585 -6.301 4.238 1.00 20.76 N
+ATOM 274 CA SER A 38 21.225 -5.852 3.932 1.00 22.05 C
+ATOM 275 C SER A 38 21.251 -4.366 3.608 1.00 21.37 C
+ATOM 276 O SER A 38 20.430 -3.876 2.833 1.00 25.64 O
+ATOM 277 CB SER A 38 20.252 -6.123 5.095 1.00 13.42 C
+ATOM 278 OG SER A 38 20.713 -5.603 6.328 1.00 23.23 O
+ATOM 279 N LEU A 39 22.220 -3.665 4.192 1.00 24.50 N
+ATOM 280 CA LEU A 39 22.389 -2.228 3.985 1.00 20.22 C
+ATOM 281 C LEU A 39 23.429 -1.916 2.915 1.00 16.35 C
+ATOM 282 O LEU A 39 24.122 -0.903 2.985 1.00 17.23 O
+ATOM 283 CB LEU A 39 22.795 -1.552 5.291 1.00 16.47 C
+ATOM 284 CG LEU A 39 21.826 -1.755 6.451 1.00 15.97 C
+ATOM 285 CD1 LEU A 39 22.382 -1.109 7.709 1.00 9.31 C
+ATOM 286 CD2 LEU A 39 20.481 -1.148 6.083 1.00 11.82 C
+ATOM 287 N GLY A 40 23.546 -2.804 1.937 1.00 13.42 N
+ATOM 288 CA GLY A 40 24.481 -2.594 0.845 1.00 15.10 C
+ATOM 289 C GLY A 40 25.955 -2.444 1.170 1.00 14.20 C
+ATOM 290 O GLY A 40 26.733 -2.016 0.321 1.00 20.51 O
+ATOM 291 N GLN A 41 26.347 -2.786 2.389 1.00 20.21 N
+ATOM 292 CA GLN A 41 27.747 -2.703 2.791 1.00 20.64 C
+ATOM 293 C GLN A 41 28.365 -4.093 2.655 1.00 25.89 C
+ATOM 294 O GLN A 41 27.668 -5.100 2.795 1.00 23.52 O
+ATOM 295 CB GLN A 41 27.847 -2.239 4.241 1.00 23.18 C
+ATOM 296 CG GLN A 41 27.127 -0.944 4.511 1.00 29.42 C
+ATOM 297 CD GLN A 41 27.738 0.213 3.760 1.00 33.25 C
+ATOM 298 OE1 GLN A 41 28.745 0.774 4.184 1.00 40.04 O
+ATOM 299 NE2 GLN A 41 27.133 0.578 2.635 1.00 31.14 N
+ATOM 300 N ASN A 42 29.667 -4.156 2.395 1.00 28.30 N
+ATOM 301 CA ASN A 42 30.316 -5.448 2.242 1.00 29.55 C
+ATOM 302 C ASN A 42 31.642 -5.582 2.969 1.00 27.06 C
+ATOM 303 O ASN A 42 32.692 -5.763 2.351 1.00 30.53 O
+ATOM 304 CB ASN A 42 30.506 -5.762 0.758 1.00 39.60 C
+ATOM 305 CG ASN A 42 29.188 -5.912 0.025 1.00 49.00 C
+ATOM 306 OD1 ASN A 42 28.718 -4.977 -0.625 1.00 56.63 O
+ATOM 307 ND2 ASN A 42 28.581 -7.090 0.130 1.00 56.24 N
+ATOM 308 N PRO A 43 31.609 -5.503 4.303 1.00 23.19 N
+ATOM 309 CA PRO A 43 32.832 -5.628 5.099 1.00 21.21 C
+ATOM 310 C PRO A 43 33.352 -7.062 5.053 1.00 24.40 C
+ATOM 311 O PRO A 43 32.608 -7.991 4.732 1.00 26.97 O
+ATOM 312 CB PRO A 43 32.386 -5.243 6.501 1.00 20.56 C
+ATOM 313 CG PRO A 43 30.920 -5.586 6.528 1.00 21.54 C
+ATOM 314 CD PRO A 43 30.417 -5.291 5.146 1.00 22.91 C
+ATOM 315 N THR A 44 34.629 -7.239 5.367 1.00 21.00 N
+ATOM 316 CA THR A 44 35.222 -8.566 5.379 1.00 17.39 C
+ATOM 317 C THR A 44 35.116 -9.078 6.795 1.00 9.79 C
+ATOM 318 O THR A 44 34.731 -8.338 7.686 1.00 16.80 O
+ATOM 319 CB THR A 44 36.705 -8.529 4.992 1.00 19.96 C
+ATOM 320 OG1 THR A 44 37.412 -7.677 5.900 1.00 17.04 O
+ATOM 321 CG2 THR A 44 36.865 -8.021 3.577 1.00 2.00 C
+ATOM 322 N GLU A 45 35.451 -10.341 7.009 1.00 10.89 N
+ATOM 323 CA GLU A 45 35.381 -10.901 8.348 1.00 11.45 C
+ATOM 324 C GLU A 45 36.231 -10.012 9.250 1.00 12.52 C
+ATOM 325 O GLU A 45 35.783 -9.567 10.312 1.00 7.24 O
+ATOM 326 CB GLU A 45 35.890 -12.355 8.345 1.00 8.96 C
+ATOM 327 CG GLU A 45 37.401 -12.516 8.313 1.00 18.50 C
+ATOM 328 CD GLU A 45 37.977 -12.528 6.904 1.00 19.92 C
+ATOM 329 OE1 GLU A 45 37.356 -13.121 6.000 1.00 28.82 O
+ATOM 330 OE2 GLU A 45 39.062 -11.946 6.702 1.00 28.61 O
+ATOM 331 N ALA A 46 37.447 -9.722 8.794 1.00 15.44 N
+ATOM 332 CA ALA A 46 38.376 -8.877 9.539 1.00 13.69 C
+ATOM 333 C ALA A 46 37.719 -7.571 9.977 1.00 11.25 C
+ATOM 334 O ALA A 46 37.751 -7.208 11.147 1.00 15.61 O
+ATOM 335 CB ALA A 46 39.577 -8.578 8.687 1.00 17.17 C
+ATOM 336 N GLU A 47 37.133 -6.854 9.029 1.00 16.96 N
+ATOM 337 CA GLU A 47 36.462 -5.596 9.341 1.00 15.52 C
+ATOM 338 C GLU A 47 35.293 -5.837 10.286 1.00 15.45 C
+ATOM 339 O GLU A 47 35.103 -5.093 11.245 1.00 17.26 O
+ATOM 340 CB GLU A 47 35.977 -4.929 8.056 1.00 16.69 C
+ATOM 341 CG GLU A 47 37.100 -4.291 7.245 1.00 19.04 C
+ATOM 342 CD GLU A 47 36.756 -4.143 5.782 1.00 26.21 C
+ATOM 343 OE1 GLU A 47 35.575 -4.328 5.416 1.00 28.67 O
+ATOM 344 OE2 GLU A 47 37.672 -3.838 4.993 1.00 38.29 O
+ATOM 345 N LEU A 48 34.507 -6.877 10.022 1.00 14.98 N
+ATOM 346 CA LEU A 48 33.383 -7.193 10.894 1.00 14.48 C
+ATOM 347 C LEU A 48 33.970 -7.347 12.292 1.00 14.14 C
+ATOM 348 O LEU A 48 33.490 -6.749 13.254 1.00 10.38 O
+ATOM 349 CB LEU A 48 32.713 -8.497 10.456 1.00 13.96 C
+ATOM 350 CG LEU A 48 31.774 -8.456 9.246 1.00 10.08 C
+ATOM 351 CD1 LEU A 48 31.151 -9.816 9.087 1.00 4.69 C
+ATOM 352 CD2 LEU A 48 30.695 -7.393 9.419 1.00 8.22 C
+ATOM 353 N GLN A 49 35.031 -8.145 12.383 1.00 17.77 N
+ATOM 354 CA GLN A 49 35.743 -8.386 13.640 1.00 17.33 C
+ATOM 355 C GLN A 49 36.246 -7.086 14.292 1.00 18.09 C
+ATOM 356 O GLN A 49 36.260 -6.960 15.517 1.00 14.26 O
+ATOM 357 CB GLN A 49 36.929 -9.310 13.380 1.00 10.25 C
+ATOM 358 CG GLN A 49 37.062 -10.412 14.394 1.00 20.08 C
+ATOM 359 CD GLN A 49 37.532 -11.707 13.782 1.00 17.41 C
+ATOM 360 OE1 GLN A 49 37.006 -12.776 14.091 1.00 19.18 O
+ATOM 361 NE2 GLN A 49 38.531 -11.623 12.909 1.00 15.97 N
+ATOM 362 N ASP A 50 36.667 -6.127 13.472 1.00 19.06 N
+ATOM 363 CA ASP A 50 37.147 -4.851 13.986 1.00 21.29 C
+ATOM 364 C ASP A 50 35.989 -4.016 14.509 1.00 15.35 C
+ATOM 365 O ASP A 50 36.116 -3.368 15.539 1.00 22.85 O
+ATOM 366 CB ASP A 50 37.879 -4.060 12.901 1.00 27.87 C
+ATOM 367 CG ASP A 50 39.216 -4.674 12.529 1.00 37.71 C
+ATOM 368 OD1 ASP A 50 39.658 -5.610 13.226 1.00 40.06 O
+ATOM 369 OD2 ASP A 50 39.823 -4.218 11.534 1.00 42.89 O
+ATOM 370 N MET A 51 34.859 -4.030 13.809 1.00 16.30 N
+ATOM 371 CA MET A 51 33.695 -3.256 14.243 1.00 16.67 C
+ATOM 372 C MET A 51 33.189 -3.707 15.618 1.00 21.45 C
+ATOM 373 O MET A 51 32.812 -2.873 16.463 1.00 15.00 O
+ATOM 374 CB MET A 51 32.570 -3.370 13.211 1.00 16.12 C
+ATOM 375 CG MET A 51 32.804 -2.520 11.974 1.00 27.61 C
+ATOM 376 SD MET A 51 31.950 -3.077 10.485 1.00 25.85 S
+ATOM 377 CE MET A 51 30.271 -2.639 10.905 1.00 26.92 C
+ATOM 378 N ILE A 52 33.206 -5.022 15.840 1.00 15.88 N
+ATOM 379 CA ILE A 52 32.742 -5.610 17.092 1.00 19.57 C
+ATOM 380 C ILE A 52 33.738 -5.492 18.244 1.00 25.85 C
+ATOM 381 O ILE A 52 33.348 -5.340 19.404 1.00 23.06 O
+ATOM 382 CB ILE A 52 32.382 -7.102 16.893 1.00 19.64 C
+ATOM 383 CG1 ILE A 52 31.107 -7.212 16.053 1.00 8.07 C
+ATOM 384 CG2 ILE A 52 32.199 -7.793 18.248 1.00 16.66 C
+ATOM 385 CD1 ILE A 52 30.081 -8.118 16.624 1.00 5.31 C
+ATOM 386 N ASN A 53 35.023 -5.574 17.931 1.00 32.45 N
+ATOM 387 CA ASN A 53 36.041 -5.465 18.964 1.00 32.89 C
+ATOM 388 C ASN A 53 35.993 -4.071 19.573 1.00 33.10 C
+ATOM 389 O ASN A 53 36.015 -3.922 20.794 1.00 35.50 O
+ATOM 390 CB ASN A 53 37.427 -5.732 18.374 1.00 38.29 C
+ATOM 391 CG ASN A 53 37.767 -7.213 18.328 1.00 40.69 C
+ATOM 392 OD1 ASN A 53 38.404 -7.689 17.385 1.00 40.62 O
+ATOM 393 ND2 ASN A 53 37.342 -7.950 19.352 1.00 45.63 N
+ATOM 394 N GLU A 54 35.915 -3.057 18.714 1.00 31.89 N
+ATOM 395 CA GLU A 54 35.864 -1.658 19.148 1.00 34.90 C
+ATOM 396 C GLU A 54 34.773 -1.364 20.178 1.00 34.92 C
+ATOM 397 O GLU A 54 34.922 -0.484 21.025 1.00 40.24 O
+ATOM 398 CB GLU A 54 35.652 -0.747 17.941 1.00 37.03 C
+ATOM 399 CG GLU A 54 36.902 -0.520 17.120 1.00 54.36 C
+ATOM 400 CD GLU A 54 37.352 0.927 17.131 1.00 63.20 C
+ATOM 401 OE1 GLU A 54 36.687 1.763 16.481 1.00 72.63 O
+ATOM 402 OE2 GLU A 54 38.372 1.225 17.789 1.00 65.83 O
+ATOM 403 N VAL A 55 33.674 -2.100 20.100 1.00 30.22 N
+ATOM 404 CA VAL A 55 32.567 -1.897 21.008 1.00 22.65 C
+ATOM 405 C VAL A 55 32.535 -2.967 22.094 1.00 25.55 C
+ATOM 406 O VAL A 55 31.866 -2.805 23.111 1.00 23.58 O
+ATOM 407 CB VAL A 55 31.222 -1.874 20.222 1.00 25.73 C
+ATOM 408 CG1 VAL A 55 31.489 -2.044 18.743 1.00 23.24 C
+ATOM 409 CG2 VAL A 55 30.294 -2.972 20.709 1.00 30.77 C
+ATOM 410 N ASP A 56 33.266 -4.057 21.882 1.00 29.97 N
+ATOM 411 CA ASP A 56 33.315 -5.148 22.859 1.00 28.02 C
+ATOM 412 C ASP A 56 34.028 -4.709 24.138 1.00 30.12 C
+ATOM 413 O ASP A 56 35.193 -5.033 24.362 1.00 33.04 O
+ATOM 414 CB ASP A 56 34.032 -6.361 22.265 1.00 26.45 C
+ATOM 415 CG ASP A 56 33.877 -7.601 23.117 1.00 25.95 C
+ATOM 416 OD1 ASP A 56 32.849 -7.706 23.818 1.00 27.01 O
+ATOM 417 OD2 ASP A 56 34.775 -8.470 23.085 1.00 26.60 O
+ATOM 418 N ALA A 57 33.313 -3.974 24.976 1.00 30.55 N
+ATOM 419 CA ALA A 57 33.860 -3.477 26.232 1.00 33.80 C
+ATOM 420 C ALA A 57 34.388 -4.568 27.165 1.00 35.90 C
+ATOM 421 O ALA A 57 35.363 -4.348 27.885 1.00 37.57 O
+ATOM 422 CB ALA A 57 32.806 -2.654 26.952 1.00 29.69 C
+ATOM 423 N ASP A 58 33.751 -5.736 27.158 1.00 33.97 N
+ATOM 424 CA ASP A 58 34.172 -6.830 28.029 1.00 30.82 C
+ATOM 425 C ASP A 58 34.944 -7.942 27.317 1.00 33.07 C
+ATOM 426 O ASP A 58 34.994 -9.075 27.793 1.00 42.27 O
+ATOM 427 CB ASP A 58 32.951 -7.421 28.743 1.00 27.77 C
+ATOM 428 CG ASP A 58 32.275 -8.524 27.941 1.00 36.26 C
+ATOM 429 OD1 ASP A 58 32.166 -8.403 26.700 1.00 34.17 O
+ATOM 430 OD2 ASP A 58 31.843 -9.518 28.561 1.00 43.72 O
+ATOM 431 N GLY A 59 35.548 -7.616 26.179 1.00 30.05 N
+ATOM 432 CA GLY A 59 36.309 -8.600 25.429 1.00 25.39 C
+ATOM 433 C GLY A 59 35.718 -9.996 25.270 1.00 25.87 C
+ATOM 434 O GLY A 59 36.423 -10.897 24.828 1.00 24.04 O
+ATOM 435 N ASN A 60 34.443 -10.189 25.607 1.00 32.01 N
+ATOM 436 CA ASN A 60 33.806 -11.509 25.482 1.00 31.08 C
+ATOM 437 C ASN A 60 33.723 -12.020 24.041 1.00 29.44 C
+ATOM 438 O ASN A 60 33.475 -13.202 23.809 1.00 29.77 O
+ATOM 439 CB ASN A 60 32.393 -11.507 26.110 1.00 30.96 C
+ATOM 440 CG ASN A 60 31.428 -10.543 25.415 1.00 37.90 C
+ATOM 441 OD1 ASN A 60 31.663 -10.120 24.281 1.00 40.87 O
+ATOM 442 ND2 ASN A 60 30.335 -10.192 26.101 1.00 27.24 N
+ATOM 443 N GLY A 61 33.930 -11.134 23.073 1.00 28.47 N
+ATOM 444 CA GLY A 61 33.871 -11.556 21.682 1.00 30.91 C
+ATOM 445 C GLY A 61 32.625 -11.097 20.947 1.00 29.93 C
+ATOM 446 O GLY A 61 32.657 -10.868 19.737 1.00 26.59 O
+ATOM 447 N THR A 62 31.521 -10.974 21.678 1.00 31.09 N
+ATOM 448 CA THR A 62 30.260 -10.529 21.100 1.00 27.43 C
+ATOM 449 C THR A 62 29.813 -9.239 21.761 1.00 26.81 C
+ATOM 450 O THR A 62 30.481 -8.717 22.662 1.00 26.45 O
+ATOM 451 CB THR A 62 29.141 -11.565 21.280 1.00 23.96 C
+ATOM 452 OG1 THR A 62 29.010 -11.888 22.672 1.00 21.61 O
+ATOM 453 CG2 THR A 62 29.448 -12.816 20.482 1.00 13.03 C
+ATOM 454 N ILE A 63 28.666 -8.741 21.317 1.00 23.57 N
+ATOM 455 CA ILE A 63 28.118 -7.497 21.834 1.00 22.51 C
+ATOM 456 C ILE A 63 26.786 -7.703 22.542 1.00 20.83 C
+ATOM 457 O ILE A 63 25.802 -8.096 21.923 1.00 25.82 O
+ATOM 458 CB ILE A 63 27.924 -6.483 20.683 1.00 16.70 C
+ATOM 459 CG1 ILE A 63 29.249 -6.283 19.948 1.00 5.37 C
+ATOM 460 CG2 ILE A 63 27.387 -5.168 21.216 1.00 4.68 C
+ATOM 461 CD1 ILE A 63 30.407 -5.972 20.851 1.00 3.58 C
+ATOM 462 N ASP A 64 26.756 -7.458 23.844 1.00 17.71 N
+ATOM 463 CA ASP A 64 25.514 -7.596 24.581 1.00 21.67 C
+ATOM 464 C ASP A 64 24.857 -6.222 24.527 1.00 23.40 C
+ATOM 465 O ASP A 64 25.463 -5.263 24.044 1.00 22.64 O
+ATOM 466 CB ASP A 64 25.778 -8.018 26.032 1.00 22.99 C
+ATOM 467 CG ASP A 64 26.667 -7.038 26.779 1.00 28.28 C
+ATOM 468 OD1 ASP A 64 26.841 -5.894 26.302 1.00 30.69 O
+ATOM 469 OD2 ASP A 64 27.191 -7.414 27.850 1.00 21.10 O
+ATOM 470 N PHE A 65 23.627 -6.126 25.022 1.00 24.66 N
+ATOM 471 CA PHE A 65 22.902 -4.866 25.001 1.00 19.73 C
+ATOM 472 C PHE A 65 23.651 -3.721 25.665 1.00 21.50 C
+ATOM 473 O PHE A 65 23.811 -2.646 25.079 1.00 17.94 O
+ATOM 474 CB PHE A 65 21.537 -5.019 25.670 1.00 13.42 C
+ATOM 475 CG PHE A 65 20.703 -3.758 25.627 1.00 18.29 C
+ATOM 476 CD1 PHE A 65 20.401 -3.149 24.409 1.00 6.88 C
+ATOM 477 CD2 PHE A 65 20.199 -3.194 26.800 1.00 11.77 C
+ATOM 478 CE1 PHE A 65 19.610 -2.007 24.362 1.00 13.42 C
+ATOM 479 CE2 PHE A 65 19.404 -2.052 26.762 1.00 6.30 C
+ATOM 480 CZ PHE A 65 19.108 -1.457 25.541 1.00 7.73 C
+ATOM 481 N PRO A 66 24.104 -3.929 26.911 1.00 21.91 N
+ATOM 482 CA PRO A 66 24.832 -2.878 27.627 1.00 19.44 C
+ATOM 483 C PRO A 66 25.953 -2.276 26.789 1.00 13.91 C
+ATOM 484 O PRO A 66 26.186 -1.075 26.842 1.00 14.93 O
+ATOM 485 CB PRO A 66 25.351 -3.586 28.882 1.00 17.03 C
+ATOM 486 CG PRO A 66 24.379 -4.694 29.117 1.00 19.32 C
+ATOM 487 CD PRO A 66 23.950 -5.148 27.727 1.00 24.13 C
+ATOM 488 N GLU A 67 26.640 -3.109 26.013 1.00 13.27 N
+ATOM 489 CA GLU A 67 27.735 -2.632 25.169 1.00 12.89 C
+ATOM 490 C GLU A 67 27.200 -1.870 23.967 1.00 15.42 C
+ATOM 491 O GLU A 67 27.842 -0.950 23.465 1.00 22.43 O
+ATOM 492 CB GLU A 67 28.592 -3.807 24.705 1.00 8.22 C
+ATOM 493 CG GLU A 67 29.094 -4.652 25.848 1.00 15.25 C
+ATOM 494 CD GLU A 67 30.117 -5.673 25.424 1.00 20.73 C
+ATOM 495 OE1 GLU A 67 30.270 -5.898 24.205 1.00 25.73 O
+ATOM 496 OE2 GLU A 67 30.770 -6.255 26.316 1.00 24.59 O
+ATOM 497 N PHE A 68 26.008 -2.261 23.533 1.00 18.08 N
+ATOM 498 CA PHE A 68 25.319 -1.659 22.401 1.00 11.19 C
+ATOM 499 C PHE A 68 24.760 -0.286 22.786 1.00 16.50 C
+ATOM 500 O PHE A 68 24.964 0.703 22.074 1.00 15.30 O
+ATOM 501 CB PHE A 68 24.179 -2.582 21.968 1.00 12.72 C
+ATOM 502 CG PHE A 68 23.598 -2.239 20.640 1.00 18.19 C
+ATOM 503 CD1 PHE A 68 24.335 -2.419 19.480 1.00 24.85 C
+ATOM 504 CD2 PHE A 68 22.317 -1.722 20.545 1.00 22.66 C
+ATOM 505 CE1 PHE A 68 23.805 -2.089 18.250 1.00 26.62 C
+ATOM 506 CE2 PHE A 68 21.778 -1.385 19.313 1.00 21.17 C
+ATOM 507 CZ PHE A 68 22.524 -1.569 18.165 1.00 20.03 C
+ATOM 508 N LEU A 69 24.035 -0.234 23.902 1.00 14.61 N
+ATOM 509 CA LEU A 69 23.480 1.023 24.389 1.00 13.17 C
+ATOM 510 C LEU A 69 24.631 2.020 24.498 1.00 16.28 C
+ATOM 511 O LEU A 69 24.607 3.094 23.901 1.00 15.17 O
+ATOM 512 CB LEU A 69 22.868 0.831 25.775 1.00 10.89 C
+ATOM 513 CG LEU A 69 21.554 1.547 26.127 1.00 9.12 C
+ATOM 514 CD1 LEU A 69 21.589 1.929 27.592 1.00 4.08 C
+ATOM 515 CD2 LEU A 69 21.340 2.773 25.258 1.00 5.09 C
+ATOM 516 N THR A 70 25.641 1.641 25.272 1.00 12.97 N
+ATOM 517 CA THR A 70 26.809 2.477 25.470 1.00 18.99 C
+ATOM 518 C THR A 70 27.229 3.128 24.158 1.00 23.61 C
+ATOM 519 O THR A 70 27.213 4.349 24.024 1.00 28.56 O
+ATOM 520 CB THR A 70 27.999 1.647 26.010 1.00 24.76 C
+ATOM 521 OG1 THR A 70 27.834 1.420 27.416 1.00 21.07 O
+ATOM 522 CG2 THR A 70 29.311 2.380 25.772 1.00 23.66 C
+ATOM 523 N MET A 71 27.601 2.301 23.190 1.00 25.17 N
+ATOM 524 CA MET A 71 28.053 2.791 21.896 1.00 26.96 C
+ATOM 525 C MET A 71 26.989 3.537 21.099 1.00 27.38 C
+ATOM 526 O MET A 71 27.282 4.536 20.440 1.00 29.72 O
+ATOM 527 CB MET A 71 28.580 1.628 21.056 1.00 24.51 C
+ATOM 528 CG MET A 71 28.834 2.000 19.603 1.00 33.36 C
+ATOM 529 SD MET A 71 28.000 0.915 18.443 1.00 30.99 S
+ATOM 530 CE MET A 71 26.458 0.657 19.262 1.00 32.95 C
+ATOM 531 N MET A 72 25.759 3.041 21.145 1.00 26.28 N
+ATOM 532 CA MET A 72 24.673 3.661 20.407 1.00 27.29 C
+ATOM 533 C MET A 72 24.353 5.047 20.942 1.00 28.52 C
+ATOM 534 O MET A 72 24.072 5.968 20.177 1.00 30.44 O
+ATOM 535 CB MET A 72 23.429 2.777 20.470 1.00 32.02 C
+ATOM 536 CG MET A 72 22.935 2.285 19.113 1.00 37.41 C
+ATOM 537 SD MET A 72 24.232 2.135 17.859 1.00 42.13 S
+ATOM 538 CE MET A 72 23.503 3.091 16.505 1.00 44.81 C
+ATOM 539 N ALA A 73 24.407 5.192 22.260 1.00 35.06 N
+ATOM 540 CA ALA A 73 24.121 6.464 22.908 1.00 38.41 C
+ATOM 541 C ALA A 73 25.344 7.375 22.948 1.00 47.95 C
+ATOM 542 O ALA A 73 25.234 8.539 23.331 1.00 55.21 O
+ATOM 543 CB ALA A 73 23.610 6.220 24.322 1.00 28.91 C
+ATOM 544 N ARG A 74 26.507 6.852 22.562 1.00 55.11 N
+ATOM 545 CA ARG A 74 27.733 7.647 22.568 1.00 59.46 C
+ATOM 546 C ARG A 74 27.547 8.890 21.708 1.00 64.25 C
+ATOM 547 O ARG A 74 26.951 8.832 20.632 1.00 61.72 O
+ATOM 548 CB ARG A 74 28.915 6.824 22.048 1.00 59.63 C
+ATOM 549 N LYS A 75 28.060 10.016 22.193 1.00 73.51 N
+ATOM 550 CA LYS A 75 27.943 11.289 21.491 1.00 81.45 C
+ATOM 551 C LYS A 75 28.712 11.333 20.172 1.00 87.60 C
+ATOM 552 O LYS A 75 29.945 11.322 20.153 1.00 89.44 O
+ATOM 553 CB LYS A 75 28.403 12.420 22.398 1.00 75.91 C
+ATOM 554 N MET A 76 27.969 11.396 19.070 1.00 92.48 N
+ATOM 555 CA MET A 76 28.562 11.446 17.741 1.00 94.28 C
+ATOM 556 C MET A 76 28.921 12.881 17.372 1.00 95.70 C
+ATOM 557 O MET A 76 28.082 13.631 16.876 1.00 95.53 O
+ATOM 558 CB MET A 76 27.593 10.865 16.717 1.00 94.10 C
+ATOM 559 N LYS A 77 30.172 13.255 17.624 1.00 97.68 N
+ATOM 560 CA LYS A 77 30.666 14.606 17.319 1.00100.00 C
+ATOM 561 C LYS A 77 30.389 14.958 15.855 1.00100.00 C
+ATOM 562 O LYS A 77 30.155 14.073 15.019 1.00 99.56 O
+ATOM 563 CB LYS A 77 32.174 14.680 17.564 1.00100.00 C
+ATOM 564 N ASP A 78 30.416 16.259 15.570 1.00100.00 N
+ATOM 565 CA ASP A 78 30.187 16.780 14.228 1.00100.00 C
+ATOM 566 C ASP A 78 31.495 16.767 13.442 1.00100.00 C
+ATOM 567 O ASP A 78 31.504 16.966 12.224 1.00100.00 O
+ATOM 568 CB ASP A 78 29.639 18.202 14.305 1.00100.00 C
+ATOM 569 N THR A 79 32.599 16.546 14.150 1.00 99.99 N
+ATOM 570 CA THR A 79 33.896 16.493 13.501 1.00100.00 C
+ATOM 571 C THR A 79 34.153 15.081 13.008 1.00 99.94 C
+ATOM 572 O THR A 79 35.011 14.845 12.154 1.00 98.26 O
+ATOM 573 N ASP A 80 33.390 14.141 13.562 1.00 98.52 N
+ATOM 574 CA ASP A 80 33.485 12.727 13.214 1.00 94.98 C
+ATOM 575 C ASP A 80 33.580 12.541 11.702 1.00 91.92 C
+ATOM 576 O ASP A 80 33.415 13.494 10.937 1.00 93.33 O
+ATOM 577 CB ASP A 80 32.255 11.983 13.753 1.00 93.79 C
+ATOM 578 CG ASP A 80 32.288 10.495 13.451 1.00 94.02 C
+ATOM 579 OD1 ASP A 80 31.862 10.096 12.344 1.00 88.36 O
+ATOM 580 OD2 ASP A 80 32.735 9.723 14.326 1.00 94.97 O
+ATOM 581 N SER A 81 33.856 11.312 11.276 1.00 86.30 N
+ATOM 582 CA SER A 81 33.951 11.013 9.855 1.00 77.66 C
+ATOM 583 C SER A 81 32.561 11.188 9.258 1.00 71.00 C
+ATOM 584 O SER A 81 31.690 10.334 9.425 1.00 69.98 O
+ATOM 585 CB SER A 81 34.438 9.576 9.638 1.00 76.51 C
+ATOM 586 N GLU A 82 32.352 12.308 8.578 1.00 60.67 N
+ATOM 587 CA GLU A 82 31.064 12.588 7.962 1.00 58.56 C
+ATOM 588 C GLU A 82 30.770 11.602 6.828 1.00 52.92 C
+ATOM 589 O GLU A 82 29.611 11.289 6.556 1.00 52.22 O
+ATOM 590 CB GLU A 82 31.035 14.032 7.437 1.00 60.33 C
+ATOM 591 CG GLU A 82 31.849 14.267 6.173 1.00 60.56 C
+ATOM 592 CD GLU A 82 31.097 13.867 4.916 1.00 63.64 C
+ATOM 593 OE1 GLU A 82 30.193 14.623 4.497 1.00 67.27 O
+ATOM 594 OE2 GLU A 82 31.407 12.798 4.347 1.00 57.86 O
+ATOM 595 N GLU A 83 31.826 11.113 6.181 1.00 47.90 N
+ATOM 596 CA GLU A 83 31.699 10.168 5.076 1.00 40.66 C
+ATOM 597 C GLU A 83 30.896 8.952 5.516 1.00 41.72 C
+ATOM 598 O GLU A 83 30.329 8.232 4.690 1.00 37.47 O
+ATOM 599 CB GLU A 83 33.083 9.729 4.597 1.00 36.20 C
+ATOM 600 CG GLU A 83 33.062 8.574 3.608 1.00 31.97 C
+ATOM 601 N GLU A 84 30.853 8.728 6.825 1.00 41.78 N
+ATOM 602 CA GLU A 84 30.112 7.604 7.379 1.00 40.82 C
+ATOM 603 C GLU A 84 28.620 7.920 7.385 1.00 31.93 C
+ATOM 604 O GLU A 84 27.816 7.110 6.931 1.00 31.42 O
+ATOM 605 CB GLU A 84 30.599 7.299 8.801 1.00 55.05 C
+ATOM 606 CG GLU A 84 31.280 5.936 8.949 1.00 67.68 C
+ATOM 607 CD GLU A 84 32.584 6.006 9.727 1.00 73.34 C
+ATOM 608 OE1 GLU A 84 33.096 7.128 9.932 1.00 76.72 O
+ATOM 609 OE2 GLU A 84 33.097 4.938 10.132 1.00 75.46 O
+ATOM 610 N ILE A 85 28.263 9.097 7.899 1.00 28.20 N
+ATOM 611 CA ILE A 85 26.871 9.550 7.951 1.00 24.73 C
+ATOM 612 C ILE A 85 26.355 9.569 6.529 1.00 21.60 C
+ATOM 613 O ILE A 85 25.244 9.134 6.245 1.00 26.48 O
+ATOM 614 CB ILE A 85 26.743 11.001 8.484 1.00 30.20 C
+ATOM 615 CG1 ILE A 85 27.152 11.075 9.957 1.00 30.21 C
+ATOM 616 CG2 ILE A 85 25.307 11.492 8.305 1.00 28.57 C
+ATOM 617 CD1 ILE A 85 27.732 9.785 10.504 1.00 37.49 C
+ATOM 618 N ARG A 86 27.184 10.100 5.642 1.00 21.49 N
+ATOM 619 CA ARG A 86 26.855 10.195 4.233 1.00 22.65 C
+ATOM 620 C ARG A 86 26.549 8.812 3.676 1.00 23.38 C
+ATOM 621 O ARG A 86 25.558 8.614 2.971 1.00 27.85 O
+ATOM 622 CB ARG A 86 28.024 10.818 3.475 1.00 19.77 C
+ATOM 623 CG ARG A 86 27.719 11.132 2.019 1.00 32.03 C
+ATOM 624 CD ARG A 86 27.298 12.587 1.834 1.00 39.23 C
+ATOM 625 NE ARG A 86 25.928 12.700 1.335 1.00 48.22 N
+ATOM 626 CZ ARG A 86 25.345 13.851 1.011 1.00 51.72 C
+ATOM 627 NH1 ARG A 86 26.016 14.989 1.132 1.00 50.57 N
+ATOM 628 NH2 ARG A 86 24.091 13.866 0.575 1.00 52.93 N
+ATOM 629 N GLU A 87 27.411 7.854 3.990 1.00 25.60 N
+ATOM 630 CA GLU A 87 27.216 6.491 3.528 1.00 25.36 C
+ATOM 631 C GLU A 87 25.871 6.003 4.045 1.00 22.28 C
+ATOM 632 O GLU A 87 25.117 5.354 3.328 1.00 25.79 O
+ATOM 633 CB GLU A 87 28.332 5.598 4.059 1.00 29.73 C
+ATOM 634 CG GLU A 87 29.246 5.059 2.986 1.00 47.94 C
+ATOM 635 CD GLU A 87 30.402 4.280 3.566 1.00 58.66 C
+ATOM 636 OE1 GLU A 87 30.246 3.743 4.684 1.00 62.49 O
+ATOM 637 OE2 GLU A 87 31.466 4.207 2.911 1.00 66.78 O
+ATOM 638 N ALA A 88 25.583 6.331 5.298 1.00 16.14 N
+ATOM 639 CA ALA A 88 24.341 5.947 5.942 1.00 13.63 C
+ATOM 640 C ALA A 88 23.119 6.581 5.271 1.00 19.28 C
+ATOM 641 O ALA A 88 22.082 5.940 5.136 1.00 26.21 O
+ATOM 642 CB ALA A 88 24.393 6.335 7.415 1.00 20.40 C
+ATOM 643 N PHE A 89 23.233 7.838 4.856 1.00 16.85 N
+ATOM 644 CA PHE A 89 22.120 8.520 4.200 1.00 15.54 C
+ATOM 645 C PHE A 89 21.775 7.899 2.847 1.00 16.40 C
+ATOM 646 O PHE A 89 20.608 7.839 2.458 1.00 16.45 O
+ATOM 647 CB PHE A 89 22.455 9.998 3.988 1.00 13.26 C
+ATOM 648 CG PHE A 89 21.331 10.798 3.374 1.00 6.43 C
+ATOM 649 CD1 PHE A 89 20.216 11.151 4.130 1.00 11.59 C
+ATOM 650 CD2 PHE A 89 21.408 11.230 2.061 1.00 5.43 C
+ATOM 651 CE1 PHE A 89 19.201 11.926 3.587 1.00 2.00 C
+ATOM 652 CE2 PHE A 89 20.406 12.000 1.511 1.00 5.23 C
+ATOM 653 CZ PHE A 89 19.296 12.351 2.281 1.00 7.95 C
+ATOM 654 N ARG A 90 22.802 7.446 2.139 1.00 13.50 N
+ATOM 655 CA ARG A 90 22.641 6.862 0.822 1.00 12.36 C
+ATOM 656 C ARG A 90 21.893 5.538 0.832 1.00 18.76 C
+ATOM 657 O ARG A 90 21.292 5.153 -0.178 1.00 24.43 O
+ATOM 658 CB ARG A 90 24.014 6.677 0.163 1.00 14.60 C
+ATOM 659 CG ARG A 90 24.145 7.328 -1.216 1.00 14.43 C
+ATOM 660 CD ARG A 90 25.542 7.857 -1.447 1.00 6.86 C
+ATOM 661 NE ARG A 90 26.518 7.104 -0.664 1.00 14.69 N
+ATOM 662 CZ ARG A 90 27.729 7.543 -0.327 1.00 10.26 C
+ATOM 663 NH1 ARG A 90 28.142 8.749 -0.700 1.00 9.91 N
+ATOM 664 NH2 ARG A 90 28.537 6.761 0.376 1.00 16.84 N
+ATOM 665 N VAL A 91 21.926 4.827 1.954 1.00 18.59 N
+ATOM 666 CA VAL A 91 21.222 3.552 2.014 1.00 17.75 C
+ATOM 667 C VAL A 91 19.719 3.800 2.003 1.00 19.23 C
+ATOM 668 O VAL A 91 18.958 3.026 1.425 1.00 25.07 O
+ATOM 669 CB VAL A 91 21.596 2.749 3.271 1.00 20.27 C
+ATOM 670 CG1 VAL A 91 22.930 2.056 3.060 1.00 28.79 C
+ATOM 671 CG2 VAL A 91 21.660 3.658 4.466 1.00 16.19 C
+ATOM 672 N PHE A 92 19.295 4.883 2.650 1.00 16.67 N
+ATOM 673 CA PHE A 92 17.885 5.236 2.689 1.00 11.36 C
+ATOM 674 C PHE A 92 17.499 5.850 1.359 1.00 9.10 C
+ATOM 675 O PHE A 92 16.731 5.261 0.610 1.00 14.33 O
+ATOM 676 CB PHE A 92 17.612 6.236 3.804 1.00 13.80 C
+ATOM 677 CG PHE A 92 17.667 5.637 5.165 1.00 7.59 C
+ATOM 678 CD1 PHE A 92 16.554 5.020 5.701 1.00 9.27 C
+ATOM 679 CD2 PHE A 92 18.847 5.657 5.895 1.00 12.55 C
+ATOM 680 CE1 PHE A 92 16.606 4.417 6.952 1.00 16.00 C
+ATOM 681 CE2 PHE A 92 18.918 5.061 7.143 1.00 20.03 C
+ATOM 682 CZ PHE A 92 17.792 4.436 7.676 1.00 20.73 C
+ATOM 683 N ASP A 93 18.046 7.025 1.059 1.00 9.98 N
+ATOM 684 CA ASP A 93 17.738 7.712 -0.193 1.00 8.22 C
+ATOM 685 C ASP A 93 18.180 6.883 -1.384 1.00 9.16 C
+ATOM 686 O ASP A 93 19.160 7.204 -2.044 1.00 13.59 O
+ATOM 687 CB ASP A 93 18.420 9.078 -0.222 1.00 4.61 C
+ATOM 688 CG ASP A 93 17.980 9.926 -1.404 1.00 16.83 C
+ATOM 689 OD1 ASP A 93 17.056 9.501 -2.126 1.00 20.56 O
+ATOM 690 OD2 ASP A 93 18.560 11.021 -1.611 1.00 10.97 O
+ATOM 691 N LYS A 94 17.431 5.821 -1.666 1.00 15.45 N
+ATOM 692 CA LYS A 94 17.744 4.908 -2.762 1.00 24.09 C
+ATOM 693 C LYS A 94 17.572 5.489 -4.160 1.00 27.12 C
+ATOM 694 O LYS A 94 18.132 4.961 -5.122 1.00 31.78 O
+ATOM 695 CB LYS A 94 16.900 3.635 -2.637 1.00 27.12 C
+ATOM 696 CG LYS A 94 17.517 2.573 -1.739 1.00 28.30 C
+ATOM 697 CD LYS A 94 16.537 2.081 -0.688 1.00 33.14 C
+ATOM 698 CE LYS A 94 15.243 2.880 -0.696 1.00 35.87 C
+ATOM 699 NZ LYS A 94 14.412 2.572 -1.900 1.00 33.66 N
+ATOM 700 N ASP A 95 16.787 6.553 -4.282 1.00 26.91 N
+ATOM 701 CA ASP A 95 16.583 7.187 -5.580 1.00 22.54 C
+ATOM 702 C ASP A 95 17.629 8.283 -5.759 1.00 19.20 C
+ATOM 703 O ASP A 95 17.736 8.882 -6.820 1.00 26.27 O
+ATOM 704 CB ASP A 95 15.170 7.787 -5.682 1.00 27.09 C
+ATOM 705 CG ASP A 95 14.840 8.736 -4.531 1.00 34.34 C
+ATOM 706 OD1 ASP A 95 15.729 9.499 -4.088 1.00 31.66 O
+ATOM 707 OD2 ASP A 95 13.680 8.719 -4.067 1.00 41.61 O
+ATOM 708 N GLY A 96 18.394 8.539 -4.705 1.00 14.09 N
+ATOM 709 CA GLY A 96 19.423 9.559 -4.758 1.00 17.48 C
+ATOM 710 C GLY A 96 18.946 10.985 -4.989 1.00 19.05 C
+ATOM 711 O GLY A 96 19.736 11.841 -5.396 1.00 20.91 O
+ATOM 712 N ASN A 97 17.673 11.264 -4.721 1.00 15.65 N
+ATOM 713 CA ASN A 97 17.148 12.611 -4.933 1.00 12.51 C
+ATOM 714 C ASN A 97 17.417 13.615 -3.804 1.00 14.09 C
+ATOM 715 O ASN A 97 17.132 14.798 -3.939 1.00 14.33 O
+ATOM 716 CB ASN A 97 15.651 12.539 -5.240 1.00 9.87 C
+ATOM 717 CG ASN A 97 14.791 12.464 -3.996 1.00 14.29 C
+ATOM 718 OD1 ASN A 97 15.123 11.792 -3.005 1.00 18.48 O
+ATOM 719 ND2 ASN A 97 13.659 13.147 -4.047 1.00 12.45 N
+ATOM 720 N GLY A 98 17.971 13.141 -2.692 1.00 18.36 N
+ATOM 721 CA GLY A 98 18.281 14.029 -1.586 1.00 11.48 C
+ATOM 722 C GLY A 98 17.250 14.055 -0.479 1.00 14.28 C
+ATOM 723 O GLY A 98 17.379 14.822 0.469 1.00 18.35 O
+ATOM 724 N TYR A 99 16.229 13.216 -0.589 1.00 17.70 N
+ATOM 725 CA TYR A 99 15.175 13.180 0.411 1.00 12.77 C
+ATOM 726 C TYR A 99 14.728 11.773 0.737 1.00 11.35 C
+ATOM 727 O TYR A 99 14.327 11.028 -0.155 1.00 7.49 O
+ATOM 728 CB TYR A 99 13.957 13.971 -0.077 1.00 8.38 C
+ATOM 729 CG TYR A 99 14.225 15.442 -0.267 1.00 7.31 C
+ATOM 730 CD1 TYR A 99 14.178 16.324 0.807 1.00 2.00 C
+ATOM 731 CD2 TYR A 99 14.576 15.941 -1.515 1.00 4.38 C
+ATOM 732 CE1 TYR A 99 14.480 17.661 0.638 1.00 9.41 C
+ATOM 733 CE2 TYR A 99 14.880 17.268 -1.696 1.00 2.00 C
+ATOM 734 CZ TYR A 99 14.833 18.126 -0.620 1.00 11.04 C
+ATOM 735 OH TYR A 99 15.151 19.451 -0.812 1.00 21.92 O
+ATOM 736 N ILE A 100 14.793 11.418 2.018 1.00 11.34 N
+ATOM 737 CA ILE A 100 14.342 10.104 2.459 1.00 14.37 C
+ATOM 738 C ILE A 100 12.825 10.172 2.683 1.00 19.87 C
+ATOM 739 O ILE A 100 12.338 10.971 3.494 1.00 11.74 O
+ATOM 740 CB ILE A 100 15.000 9.663 3.793 1.00 13.14 C
+ATOM 741 CG1 ILE A 100 16.524 9.623 3.658 1.00 11.68 C
+ATOM 742 CG2 ILE A 100 14.472 8.298 4.192 1.00 2.00 C
+ATOM 743 CD1 ILE A 100 17.238 9.594 4.992 1.00 4.82 C
+ATOM 744 N SER A 101 12.096 9.343 1.938 1.00 16.25 N
+ATOM 745 CA SER A 101 10.646 9.251 2.029 1.00 17.57 C
+ATOM 746 C SER A 101 10.308 8.044 2.905 1.00 25.51 C
+ATOM 747 O SER A 101 11.161 7.187 3.139 1.00 29.69 O
+ATOM 748 CB SER A 101 10.049 9.041 0.641 1.00 20.07 C
+ATOM 749 OG SER A 101 10.280 7.713 0.183 1.00 15.89 O
+ATOM 750 N ALA A 102 9.069 7.967 3.383 1.00 24.60 N
+ATOM 751 CA ALA A 102 8.675 6.846 4.224 1.00 21.49 C
+ATOM 752 C ALA A 102 8.909 5.565 3.438 1.00 18.85 C
+ATOM 753 O ALA A 102 9.360 4.561 3.986 1.00 15.96 O
+ATOM 754 CB ALA A 102 7.210 6.966 4.619 1.00 25.86 C
+ATOM 755 N ALA A 103 8.607 5.611 2.145 1.00 10.38 N
+ATOM 756 CA ALA A 103 8.796 4.450 1.284 1.00 14.26 C
+ATOM 757 C ALA A 103 10.230 3.961 1.444 1.00 15.15 C
+ATOM 758 O ALA A 103 10.463 2.820 1.842 1.00 17.19 O
+ATOM 759 CB ALA A 103 8.527 4.821 -0.168 1.00 13.06 C
+ATOM 760 N GLU A 104 11.180 4.842 1.138 1.00 17.53 N
+ATOM 761 CA GLU A 104 12.603 4.540 1.246 1.00 14.55 C
+ATOM 762 C GLU A 104 12.952 4.002 2.633 1.00 14.07 C
+ATOM 763 O GLU A 104 13.794 3.111 2.764 1.00 17.48 O
+ATOM 764 CB GLU A 104 13.426 5.795 0.929 1.00 11.66 C
+ATOM 765 CG GLU A 104 13.418 6.159 -0.562 1.00 15.51 C
+ATOM 766 CD GLU A 104 14.222 7.408 -0.890 1.00 27.08 C
+ATOM 767 OE1 GLU A 104 14.115 8.419 -0.164 1.00 30.83 O
+ATOM 768 OE2 GLU A 104 14.965 7.391 -1.892 1.00 33.52 O
+ATOM 769 N LEU A 105 12.295 4.532 3.662 1.00 11.91 N
+ATOM 770 CA LEU A 105 12.531 4.086 5.037 1.00 14.82 C
+ATOM 771 C LEU A 105 11.946 2.682 5.190 1.00 19.88 C
+ATOM 772 O LEU A 105 12.581 1.772 5.734 1.00 15.98 O
+ATOM 773 CB LEU A 105 11.848 5.036 6.032 1.00 14.70 C
+ATOM 774 CG LEU A 105 11.598 4.542 7.467 1.00 8.04 C
+ATOM 775 CD1 LEU A 105 12.590 3.465 7.828 1.00 9.18 C
+ATOM 776 CD2 LEU A 105 11.744 5.699 8.443 1.00 10.07 C
+ATOM 777 N ARG A 106 10.720 2.528 4.704 1.00 24.94 N
+ATOM 778 CA ARG A 106 10.014 1.258 4.741 1.00 25.56 C
+ATOM 779 C ARG A 106 10.860 0.194 4.033 1.00 25.02 C
+ATOM 780 O ARG A 106 11.194 -0.838 4.615 1.00 25.13 O
+ATOM 781 CB ARG A 106 8.659 1.417 4.043 1.00 28.88 C
+ATOM 782 CG ARG A 106 7.944 0.118 3.716 1.00 42.26 C
+ATOM 783 CD ARG A 106 6.519 0.388 3.257 1.00 53.36 C
+ATOM 784 NE ARG A 106 5.561 0.260 4.353 1.00 70.41 N
+ATOM 785 CZ ARG A 106 4.961 1.287 4.953 1.00 76.60 C
+ATOM 786 NH1 ARG A 106 5.216 2.532 4.567 1.00 76.78 N
+ATOM 787 NH2 ARG A 106 4.107 1.066 5.944 1.00 78.98 N
+ATOM 788 N HIS A 107 11.212 0.461 2.780 1.00 19.92 N
+ATOM 789 CA HIS A 107 12.014 -0.464 1.994 1.00 20.09 C
+ATOM 790 C HIS A 107 13.215 -0.993 2.773 1.00 20.62 C
+ATOM 791 O HIS A 107 13.520 -2.184 2.724 1.00 18.22 O
+ATOM 792 CB HIS A 107 12.489 0.226 0.718 1.00 22.37 C
+ATOM 793 CG HIS A 107 11.371 0.717 -0.146 1.00 28.15 C
+ATOM 794 ND1 HIS A 107 10.071 0.285 0.003 1.00 37.77 N
+ATOM 795 CD2 HIS A 107 11.360 1.592 -1.179 1.00 32.05 C
+ATOM 796 CE1 HIS A 107 9.306 0.870 -0.901 1.00 36.27 C
+ATOM 797 NE2 HIS A 107 10.064 1.668 -1.631 1.00 38.28 N
+ATOM 798 N VAL A 108 13.898 -0.103 3.486 1.00 23.52 N
+ATOM 799 CA VAL A 108 15.062 -0.497 4.276 1.00 19.65 C
+ATOM 800 C VAL A 108 14.635 -1.427 5.391 1.00 17.60 C
+ATOM 801 O VAL A 108 15.253 -2.464 5.615 1.00 20.11 O
+ATOM 802 CB VAL A 108 15.760 0.712 4.930 1.00 18.42 C
+ATOM 803 CG1 VAL A 108 16.712 0.224 6.011 1.00 19.68 C
+ATOM 804 CG2 VAL A 108 16.517 1.508 3.887 1.00 21.14 C
+ATOM 805 N MET A 109 13.578 -1.044 6.099 1.00 20.68 N
+ATOM 806 CA MET A 109 13.074 -1.855 7.196 1.00 22.68 C
+ATOM 807 C MET A 109 12.800 -3.271 6.688 1.00 24.61 C
+ATOM 808 O MET A 109 13.320 -4.250 7.240 1.00 26.59 O
+ATOM 809 CB MET A 109 11.795 -1.237 7.768 1.00 26.82 C
+ATOM 810 CG MET A 109 12.018 -0.119 8.791 1.00 31.58 C
+ATOM 811 SD MET A 109 13.546 -0.238 9.760 1.00 31.29 S
+ATOM 812 CE MET A 109 14.422 1.182 9.120 1.00 29.64 C
+ATOM 813 N THR A 110 11.990 -3.370 5.635 1.00 19.08 N
+ATOM 814 CA THR A 110 11.654 -4.657 5.029 1.00 21.65 C
+ATOM 815 C THR A 110 12.938 -5.465 4.821 1.00 25.01 C
+ATOM 816 O THR A 110 13.047 -6.623 5.236 1.00 24.48 O
+ATOM 817 CB THR A 110 10.986 -4.470 3.648 1.00 20.65 C
+ATOM 818 OG1 THR A 110 9.592 -4.200 3.813 1.00 25.16 O
+ATOM 819 CG2 THR A 110 11.140 -5.710 2.815 1.00 12.32 C
+ATOM 820 N ASN A 111 13.916 -4.844 4.176 1.00 24.14 N
+ATOM 821 CA ASN A 111 15.172 -5.522 3.914 1.00 25.56 C
+ATOM 822 C ASN A 111 15.911 -5.930 5.188 1.00 22.12 C
+ATOM 823 O ASN A 111 16.761 -6.819 5.158 1.00 16.22 O
+ATOM 824 CB ASN A 111 16.067 -4.648 3.038 1.00 24.24 C
+ATOM 825 CG ASN A 111 16.908 -5.470 2.081 1.00 37.85 C
+ATOM 826 OD1 ASN A 111 16.586 -6.625 1.787 1.00 33.91 O
+ATOM 827 ND2 ASN A 111 17.997 -4.882 1.592 1.00 47.45 N
+ATOM 828 N LEU A 112 15.585 -5.282 6.303 1.00 21.94 N
+ATOM 829 CA LEU A 112 16.219 -5.593 7.580 1.00 23.79 C
+ATOM 830 C LEU A 112 15.454 -6.705 8.292 1.00 24.47 C
+ATOM 831 O LEU A 112 15.765 -7.053 9.429 1.00 19.28 O
+ATOM 832 CB LEU A 112 16.246 -4.351 8.472 1.00 21.01 C
+ATOM 833 CG LEU A 112 17.419 -3.392 8.264 1.00 20.90 C
+ATOM 834 CD1 LEU A 112 17.107 -2.026 8.909 1.00 23.22 C
+ATOM 835 CD2 LEU A 112 18.670 -4.005 8.867 1.00 14.99 C
+ATOM 836 N GLY A 113 14.451 -7.252 7.609 1.00 31.66 N
+ATOM 837 CA GLY A 113 13.633 -8.304 8.182 1.00 33.71 C
+ATOM 838 C GLY A 113 12.582 -7.695 9.085 1.00 41.39 C
+ATOM 839 O GLY A 113 11.882 -8.397 9.813 1.00 43.94 O
+ATOM 840 N GLU A 114 12.469 -6.373 9.028 1.00 48.14 N
+ATOM 841 CA GLU A 114 11.519 -5.646 9.856 1.00 52.25 C
+ATOM 842 C GLU A 114 10.212 -5.326 9.149 1.00 53.90 C
+ATOM 843 O GLU A 114 10.191 -5.033 7.956 1.00 57.67 O
+ATOM 844 CB GLU A 114 12.157 -4.349 10.359 1.00 56.23 C
+ATOM 845 CG GLU A 114 12.365 -4.324 11.859 1.00 61.55 C
+ATOM 846 CD GLU A 114 11.699 -5.500 12.541 1.00 63.37 C
+ATOM 847 OE1 GLU A 114 10.457 -5.470 12.691 1.00 69.50 O
+ATOM 848 OE2 GLU A 114 12.413 -6.452 12.920 1.00 58.45 O
+ATOM 849 N LYS A 115 9.119 -5.385 9.900 1.00 58.17 N
+ATOM 850 CA LYS A 115 7.798 -5.089 9.365 1.00 60.45 C
+ATOM 851 C LYS A 115 7.166 -4.024 10.255 1.00 56.63 C
+ATOM 852 O LYS A 115 7.042 -4.217 11.465 1.00 58.38 O
+ATOM 853 CB LYS A 115 6.931 -6.353 9.355 1.00 63.06 C
+ATOM 854 N LEU A 116 6.782 -2.897 9.661 1.00 48.46 N
+ATOM 855 CA LEU A 116 6.171 -1.813 10.423 1.00 48.80 C
+ATOM 856 C LEU A 116 4.870 -1.315 9.822 1.00 48.64 C
+ATOM 857 O LEU A 116 4.654 -1.397 8.613 1.00 51.38 O
+ATOM 858 CB LEU A 116 7.138 -0.635 10.547 1.00 43.88 C
+ATOM 859 CG LEU A 116 8.594 -1.033 10.733 1.00 40.15 C
+ATOM 860 CD1 LEU A 116 9.159 -1.452 9.391 1.00 47.92 C
+ATOM 861 CD2 LEU A 116 9.377 0.116 11.314 1.00 34.16 C
+ATOM 862 N THR A 117 4.003 -0.794 10.681 1.00 49.11 N
+ATOM 863 CA THR A 117 2.727 -0.268 10.235 1.00 46.71 C
+ATOM 864 C THR A 117 3.009 1.040 9.523 1.00 44.88 C
+ATOM 865 O THR A 117 4.053 1.652 9.730 1.00 41.27 O
+ATOM 866 CB THR A 117 1.790 0.007 11.416 1.00 49.26 C
+ATOM 867 OG1 THR A 117 1.830 -1.097 12.328 1.00 47.60 O
+ATOM 868 CG2 THR A 117 0.362 0.196 10.922 1.00 56.20 C
+ATOM 869 N ASP A 118 2.084 1.466 8.676 1.00 43.53 N
+ATOM 870 CA ASP A 118 2.266 2.711 7.957 1.00 41.14 C
+ATOM 871 C ASP A 118 2.516 3.848 8.939 1.00 42.01 C
+ATOM 872 O ASP A 118 3.279 4.763 8.647 1.00 41.73 O
+ATOM 873 CB ASP A 118 1.028 3.015 7.118 1.00 42.34 C
+ATOM 874 CG ASP A 118 1.051 2.313 5.782 1.00 44.15 C
+ATOM 875 OD1 ASP A 118 1.660 1.227 5.693 1.00 47.97 O
+ATOM 876 OD2 ASP A 118 0.462 2.846 4.820 1.00 47.32 O
+ATOM 877 N GLU A 119 1.881 3.775 10.106 1.00 41.40 N
+ATOM 878 CA GLU A 119 2.017 4.810 11.129 1.00 45.57 C
+ATOM 879 C GLU A 119 3.360 4.772 11.834 1.00 39.37 C
+ATOM 880 O GLU A 119 3.934 5.814 12.143 1.00 36.92 O
+ATOM 881 CB GLU A 119 0.901 4.677 12.169 1.00 57.58 C
+ATOM 882 CG GLU A 119 0.499 3.237 12.461 1.00 70.54 C
+ATOM 883 CD GLU A 119 0.168 3.008 13.925 1.00 73.34 C
+ATOM 884 OE1 GLU A 119 0.593 3.831 14.762 1.00 74.00 O
+ATOM 885 OE2 GLU A 119 -0.517 2.008 14.236 1.00 74.45 O
+ATOM 886 N GLU A 120 3.847 3.567 12.107 1.00 37.53 N
+ATOM 887 CA GLU A 120 5.138 3.411 12.766 1.00 30.41 C
+ATOM 888 C GLU A 120 6.156 4.225 11.974 1.00 28.86 C
+ATOM 889 O GLU A 120 6.883 5.053 12.533 1.00 24.43 O
+ATOM 890 CB GLU A 120 5.565 1.937 12.777 1.00 26.48 C
+ATOM 891 CG GLU A 120 4.529 0.972 13.339 1.00 31.47 C
+ATOM 892 CD GLU A 120 5.148 -0.345 13.803 1.00 31.69 C
+ATOM 893 OE1 GLU A 120 5.600 -0.433 14.969 1.00 25.40 O
+ATOM 894 OE2 GLU A 120 5.181 -1.298 12.998 1.00 32.59 O
+ATOM 895 N VAL A 121 6.181 3.981 10.665 1.00 21.16 N
+ATOM 896 CA VAL A 121 7.091 4.650 9.751 1.00 25.47 C
+ATOM 897 C VAL A 121 6.887 6.159 9.691 1.00 32.08 C
+ATOM 898 O VAL A 121 7.857 6.922 9.695 1.00 32.41 O
+ATOM 899 CB VAL A 121 6.944 4.084 8.339 1.00 27.51 C
+ATOM 900 CG1 VAL A 121 7.769 4.896 7.361 1.00 30.21 C
+ATOM 901 CG2 VAL A 121 7.380 2.631 8.326 1.00 34.76 C
+ATOM 902 N ASP A 122 5.626 6.585 9.630 1.00 36.46 N
+ATOM 903 CA ASP A 122 5.291 8.006 9.569 1.00 38.30 C
+ATOM 904 C ASP A 122 5.805 8.740 10.804 1.00 37.64 C
+ATOM 905 O ASP A 122 6.436 9.793 10.699 1.00 39.27 O
+ATOM 906 CB ASP A 122 3.776 8.183 9.448 1.00 45.37 C
+ATOM 907 CG ASP A 122 3.235 7.697 8.108 1.00 57.26 C
+ATOM 908 OD1 ASP A 122 4.016 7.640 7.128 1.00 58.73 O
+ATOM 909 OD2 ASP A 122 2.027 7.370 8.035 1.00 61.89 O
+ATOM 910 N GLU A 123 5.530 8.183 11.977 1.00 31.16 N
+ATOM 911 CA GLU A 123 5.992 8.790 13.214 1.00 27.93 C
+ATOM 912 C GLU A 123 7.518 8.888 13.171 1.00 25.15 C
+ATOM 913 O GLU A 123 8.102 9.827 13.711 1.00 23.79 O
+ATOM 914 CB GLU A 123 5.544 7.948 14.412 1.00 24.56 C
+ATOM 915 N MET A 124 8.154 7.914 12.519 1.00 24.18 N
+ATOM 916 CA MET A 124 9.610 7.879 12.396 1.00 21.38 C
+ATOM 917 C MET A 124 10.116 9.062 11.570 1.00 21.80 C
+ATOM 918 O MET A 124 11.049 9.762 11.959 1.00 19.46 O
+ATOM 919 CB MET A 124 10.054 6.566 11.741 1.00 26.73 C
+ATOM 920 CG MET A 124 9.917 5.332 12.643 1.00 32.38 C
+ATOM 921 SD MET A 124 11.205 4.068 12.375 1.00 29.55 S
+ATOM 922 CE MET A 124 10.250 2.761 11.769 1.00 23.57 C
+ATOM 923 N ILE A 125 9.492 9.278 10.423 1.00 23.39 N
+ATOM 924 CA ILE A 125 9.868 10.378 9.548 1.00 22.94 C
+ATOM 925 C ILE A 125 9.669 11.728 10.248 1.00 23.69 C
+ATOM 926 O ILE A 125 10.554 12.587 10.244 1.00 29.13 O
+ATOM 927 CB ILE A 125 9.023 10.359 8.262 1.00 19.67 C
+ATOM 928 CG1 ILE A 125 9.463 9.196 7.374 1.00 10.99 C
+ATOM 929 CG2 ILE A 125 9.146 11.690 7.542 1.00 11.69 C
+ATOM 930 CD1 ILE A 125 10.905 9.287 6.933 1.00 16.18 C
+ATOM 931 N ARG A 126 8.506 11.897 10.862 1.00 22.34 N
+ATOM 932 CA ARG A 126 8.161 13.129 11.552 1.00 17.96 C
+ATOM 933 C ARG A 126 9.135 13.529 12.665 1.00 17.24 C
+ATOM 934 O ARG A 126 9.456 14.704 12.818 1.00 20.61 O
+ATOM 935 CB ARG A 126 6.730 13.000 12.071 1.00 16.25 C
+ATOM 936 CG ARG A 126 6.445 13.592 13.438 1.00 28.66 C
+ATOM 937 CD ARG A 126 4.981 13.365 13.742 1.00 24.05 C
+ATOM 938 NE ARG A 126 4.318 12.881 12.530 1.00 32.60 N
+ATOM 939 CZ ARG A 126 3.555 11.792 12.460 1.00 33.71 C
+ATOM 940 NH1 ARG A 126 3.339 11.042 13.543 1.00 22.47 N
+ATOM 941 NH2 ARG A 126 3.022 11.444 11.294 1.00 29.13 N
+ATOM 942 N GLU A 127 9.618 12.566 13.440 1.00 17.36 N
+ATOM 943 CA GLU A 127 10.563 12.895 14.502 1.00 15.54 C
+ATOM 944 C GLU A 127 11.906 13.321 13.908 1.00 18.46 C
+ATOM 945 O GLU A 127 12.722 13.964 14.577 1.00 16.96 O
+ATOM 946 CB GLU A 127 10.763 11.701 15.438 1.00 12.31 C
+ATOM 947 CG GLU A 127 10.293 11.965 16.873 1.00 12.76 C
+ATOM 948 N ALA A 128 12.125 12.971 12.644 1.00 22.24 N
+ATOM 949 CA ALA A 128 13.363 13.309 11.949 1.00 15.57 C
+ATOM 950 C ALA A 128 13.196 14.624 11.188 1.00 15.43 C
+ATOM 951 O ALA A 128 14.142 15.408 11.060 1.00 9.45 O
+ATOM 952 CB ALA A 128 13.726 12.203 10.997 1.00 12.93 C
+ATOM 953 N ASP A 129 11.984 14.847 10.689 1.00 8.51 N
+ATOM 954 CA ASP A 129 11.637 16.049 9.940 1.00 10.67 C
+ATOM 955 C ASP A 129 11.853 17.291 10.791 1.00 16.62 C
+ATOM 956 O ASP A 129 11.443 17.332 11.952 1.00 19.75 O
+ATOM 957 CB ASP A 129 10.168 15.988 9.521 1.00 9.73 C
+ATOM 958 CG ASP A 129 9.887 16.732 8.226 1.00 16.36 C
+ATOM 959 OD1 ASP A 129 10.809 17.361 7.665 1.00 9.60 O
+ATOM 960 OD2 ASP A 129 8.725 16.685 7.768 1.00 23.08 O
+ATOM 961 N ILE A 130 12.491 18.306 10.217 1.00 15.58 N
+ATOM 962 CA ILE A 130 12.718 19.549 10.940 1.00 18.91 C
+ATOM 963 C ILE A 130 11.982 20.701 10.260 1.00 20.80 C
+ATOM 964 O ILE A 130 11.499 21.608 10.927 1.00 21.73 O
+ATOM 965 CB ILE A 130 14.218 19.904 11.020 1.00 19.34 C
+ATOM 966 CG1 ILE A 130 14.926 18.936 11.961 1.00 18.11 C
+ATOM 967 CG2 ILE A 130 14.395 21.334 11.546 1.00 16.77 C
+ATOM 968 CD1 ILE A 130 16.365 19.310 12.238 1.00 21.86 C
+ATOM 969 N ASP A 131 11.898 20.655 8.933 1.00 20.95 N
+ATOM 970 CA ASP A 131 11.227 21.705 8.171 1.00 21.84 C
+ATOM 971 C ASP A 131 9.754 21.416 7.867 1.00 21.91 C
+ATOM 972 O ASP A 131 9.046 22.288 7.356 1.00 20.91 O
+ATOM 973 CB ASP A 131 11.985 21.980 6.860 1.00 19.79 C
+ATOM 974 CG ASP A 131 12.259 20.718 6.052 1.00 21.91 C
+ATOM 975 OD1 ASP A 131 11.582 19.681 6.260 1.00 17.74 O
+ATOM 976 OD2 ASP A 131 13.164 20.768 5.192 1.00 23.51 O
+ATOM 977 N GLY A 132 9.303 20.196 8.162 1.00 19.05 N
+ATOM 978 CA GLY A 132 7.908 19.836 7.941 1.00 13.86 C
+ATOM 979 C GLY A 132 7.457 19.435 6.544 1.00 8.99 C
+ATOM 980 O GLY A 132 6.263 19.259 6.301 1.00 14.08 O
+ATOM 981 N ASP A 133 8.397 19.277 5.624 1.00 10.69 N
+ATOM 982 CA ASP A 133 8.068 18.896 4.262 1.00 7.02 C
+ATOM 983 C ASP A 133 7.719 17.399 4.131 1.00 11.52 C
+ATOM 984 O ASP A 133 7.509 16.879 3.022 1.00 5.67 O
+ATOM 985 CB ASP A 133 9.230 19.268 3.347 1.00 4.69 C
+ATOM 986 CG ASP A 133 10.425 18.358 3.521 1.00 16.94 C
+ATOM 987 OD1 ASP A 133 10.514 17.692 4.580 1.00 18.87 O
+ATOM 988 OD2 ASP A 133 11.271 18.314 2.596 1.00 15.21 O
+ATOM 989 N GLY A 134 7.650 16.714 5.271 1.00 11.47 N
+ATOM 990 CA GLY A 134 7.301 15.302 5.282 1.00 6.41 C
+ATOM 991 C GLY A 134 8.370 14.337 4.806 1.00 8.58 C
+ATOM 992 O GLY A 134 8.104 13.147 4.646 1.00 12.20 O
+ATOM 993 N GLN A 135 9.576 14.841 4.563 1.00 11.55 N
+ATOM 994 CA GLN A 135 10.682 14.002 4.118 1.00 4.48 C
+ATOM 995 C GLN A 135 11.898 14.333 4.970 1.00 11.89 C
+ATOM 996 O GLN A 135 11.864 15.266 5.780 1.00 13.63 O
+ATOM 997 CB GLN A 135 10.976 14.261 2.638 1.00 4.33 C
+ATOM 998 CG GLN A 135 9.791 13.986 1.726 1.00 2.00 C
+ATOM 999 CD GLN A 135 10.193 13.633 0.301 1.00 4.79 C
+ATOM 1000 OE1 GLN A 135 10.558 14.501 -0.493 1.00 7.99 O
+ATOM 1001 NE2 GLN A 135 10.115 12.355 -0.032 1.00 8.98 N
+ATOM 1002 N VAL A 136 12.966 13.558 4.817 1.00 13.19 N
+ATOM 1003 CA VAL A 136 14.185 13.809 5.587 1.00 7.41 C
+ATOM 1004 C VAL A 136 15.302 14.087 4.596 1.00 4.78 C
+ATOM 1005 O VAL A 136 15.550 13.299 3.688 1.00 4.95 O
+ATOM 1006 CB VAL A 136 14.575 12.587 6.487 1.00 11.03 C
+ATOM 1007 CG1 VAL A 136 15.720 12.967 7.449 1.00 5.27 C
+ATOM 1008 CG2 VAL A 136 13.365 12.107 7.285 1.00 2.68 C
+ATOM 1009 N ASN A 137 15.961 15.226 4.754 1.00 8.92 N
+ATOM 1010 CA ASN A 137 17.044 15.589 3.850 1.00 12.84 C
+ATOM 1011 C ASN A 137 18.381 15.303 4.528 1.00 19.36 C
+ATOM 1012 O ASN A 137 18.420 14.745 5.630 1.00 21.07 O
+ATOM 1013 CB ASN A 137 16.935 17.069 3.458 1.00 10.01 C
+ATOM 1014 CG ASN A 137 17.076 17.999 4.645 1.00 11.12 C
+ATOM 1015 OD1 ASN A 137 17.436 17.569 5.744 1.00 13.66 O
+ATOM 1016 ND2 ASN A 137 16.784 19.281 4.434 1.00 2.00 N
+ATOM 1017 N TYR A 138 19.481 15.680 3.886 1.00 14.54 N
+ATOM 1018 CA TYR A 138 20.770 15.403 4.486 1.00 14.19 C
+ATOM 1019 C TYR A 138 20.982 16.162 5.788 1.00 12.68 C
+ATOM 1020 O TYR A 138 21.261 15.566 6.827 1.00 15.24 O
+ATOM 1021 CB TYR A 138 21.894 15.707 3.506 1.00 11.49 C
+ATOM 1022 CG TYR A 138 23.238 15.292 4.041 1.00 15.71 C
+ATOM 1023 CD1 TYR A 138 23.577 13.949 4.173 1.00 10.76 C
+ATOM 1024 CD2 TYR A 138 24.156 16.247 4.458 1.00 18.68 C
+ATOM 1025 CE1 TYR A 138 24.801 13.575 4.712 1.00 18.05 C
+ATOM 1026 CE2 TYR A 138 25.372 15.887 4.994 1.00 19.99 C
+ATOM 1027 CZ TYR A 138 25.692 14.558 5.121 1.00 20.90 C
+ATOM 1028 OH TYR A 138 26.912 14.236 5.659 1.00 28.02 O
+ATOM 1029 N GLU A 139 20.842 17.477 5.736 1.00 11.90 N
+ATOM 1030 CA GLU A 139 21.012 18.287 6.926 1.00 19.56 C
+ATOM 1031 C GLU A 139 20.174 17.731 8.080 1.00 21.51 C
+ATOM 1032 O GLU A 139 20.653 17.629 9.210 1.00 28.56 O
+ATOM 1033 CB GLU A 139 20.621 19.736 6.632 1.00 22.94 C
+ATOM 1034 CG GLU A 139 21.781 20.722 6.747 1.00 30.72 C
+ATOM 1035 CD GLU A 139 22.906 20.209 7.639 1.00 38.70 C
+ATOM 1036 OE1 GLU A 139 22.684 20.076 8.866 1.00 34.04 O
+ATOM 1037 OE2 GLU A 139 24.007 19.936 7.108 1.00 36.21 O
+ATOM 1038 N GLU A 140 18.926 17.368 7.798 1.00 17.47 N
+ATOM 1039 CA GLU A 140 18.053 16.814 8.825 1.00 10.99 C
+ATOM 1040 C GLU A 140 18.604 15.473 9.299 1.00 13.79 C
+ATOM 1041 O GLU A 140 18.640 15.204 10.500 1.00 20.62 O
+ATOM 1042 CB GLU A 140 16.640 16.612 8.276 1.00 13.91 C
+ATOM 1043 CG GLU A 140 15.860 17.892 8.095 1.00 9.67 C
+ATOM 1044 CD GLU A 140 14.552 17.692 7.349 1.00 11.37 C
+ATOM 1045 OE1 GLU A 140 14.441 16.751 6.524 1.00 13.29 O
+ATOM 1046 OE2 GLU A 140 13.628 18.490 7.594 1.00 9.90 O
+ATOM 1047 N PHE A 141 19.021 14.630 8.355 1.00 12.84 N
+ATOM 1048 CA PHE A 141 19.579 13.317 8.680 1.00 13.80 C
+ATOM 1049 C PHE A 141 20.809 13.487 9.569 1.00 16.77 C
+ATOM 1050 O PHE A 141 20.965 12.805 10.583 1.00 15.47 O
+ATOM 1051 CB PHE A 141 19.972 12.583 7.394 1.00 23.65 C
+ATOM 1052 CG PHE A 141 20.355 11.137 7.601 1.00 18.07 C
+ATOM 1053 CD1 PHE A 141 19.384 10.169 7.807 1.00 16.84 C
+ATOM 1054 CD2 PHE A 141 21.688 10.747 7.568 1.00 18.95 C
+ATOM 1055 CE1 PHE A 141 19.732 8.840 7.976 1.00 16.07 C
+ATOM 1056 CE2 PHE A 141 22.045 9.419 7.735 1.00 19.51 C
+ATOM 1057 CZ PHE A 141 21.066 8.464 7.940 1.00 17.43 C
+ATOM 1058 N VAL A 142 21.678 14.415 9.187 1.00 12.32 N
+ATOM 1059 CA VAL A 142 22.884 14.671 9.948 1.00 12.26 C
+ATOM 1060 C VAL A 142 22.564 14.926 11.417 1.00 13.44 C
+ATOM 1061 O VAL A 142 23.094 14.253 12.297 1.00 18.13 O
+ATOM 1062 CB VAL A 142 23.658 15.902 9.388 1.00 7.59 C
+ATOM 1063 CG1 VAL A 142 24.870 16.200 10.246 1.00 2.00 C
+ATOM 1064 CG2 VAL A 142 24.105 15.632 7.969 1.00 11.28 C
+ATOM 1065 N GLN A 143 21.683 15.885 11.685 1.00 15.76 N
+ATOM 1066 CA GLN A 143 21.346 16.243 13.065 1.00 19.56 C
+ATOM 1067 C GLN A 143 20.875 15.120 13.972 1.00 21.63 C
+ATOM 1068 O GLN A 143 21.278 15.056 15.124 1.00 26.63 O
+ATOM 1069 CB GLN A 143 20.320 17.377 13.085 1.00 11.98 C
+ATOM 1070 CG GLN A 143 20.895 18.697 12.609 1.00 15.36 C
+ATOM 1071 CD GLN A 143 20.004 19.886 12.914 1.00 16.99 C
+ATOM 1072 OE1 GLN A 143 19.978 20.860 12.159 1.00 21.23 O
+ATOM 1073 NE2 GLN A 143 19.274 19.816 14.024 1.00 14.40 N
+ATOM 1074 N MET A 144 20.021 14.238 13.472 1.00 30.03 N
+ATOM 1075 CA MET A 144 19.534 13.146 14.306 1.00 35.40 C
+ATOM 1076 C MET A 144 20.571 12.032 14.455 1.00 39.44 C
+ATOM 1077 O MET A 144 20.556 11.283 15.430 1.00 39.54 O
+ATOM 1078 CB MET A 144 18.219 12.588 13.735 1.00 34.86 C
+ATOM 1079 CG MET A 144 18.360 11.749 12.478 1.00 38.43 C
+ATOM 1080 SD MET A 144 17.220 10.342 12.467 1.00 39.91 S
+ATOM 1081 CE MET A 144 18.186 9.139 11.577 1.00 34.33 C
+ATOM 1082 N MET A 145 21.476 11.937 13.487 1.00 45.86 N
+ATOM 1083 CA MET A 145 22.520 10.923 13.501 1.00 51.17 C
+ATOM 1084 C MET A 145 23.657 11.313 14.435 1.00 54.36 C
+ATOM 1085 O MET A 145 24.379 10.454 14.945 1.00 59.42 O
+ATOM 1086 CB MET A 145 23.075 10.716 12.089 1.00 54.05 C
+ATOM 1087 CG MET A 145 23.070 9.270 11.633 1.00 61.51 C
+ATOM 1088 SD MET A 145 21.426 8.523 11.758 1.00 72.30 S
+ATOM 1089 CE MET A 145 21.277 8.312 13.529 1.00 72.38 C
+ATOM 1090 N THR A 146 23.817 12.612 14.657 1.00 54.38 N
+ATOM 1091 CA THR A 146 24.874 13.106 15.523 1.00 55.70 C
+ATOM 1092 C THR A 146 24.338 13.500 16.906 1.00 64.96 C
+ATOM 1093 O THR A 146 24.194 14.679 17.235 1.00 65.57 O
+ATOM 1094 CB THR A 146 25.608 14.302 14.853 1.00 47.05 C
+ATOM 1095 OG1 THR A 146 24.777 15.466 14.870 1.00 33.03 O
+ATOM 1096 CG2 THR A 146 25.939 13.968 13.411 1.00 47.30 C
+END
diff --git a/modules/seq/alg/tests/testfiles/calmodulin_02.pdb b/modules/seq/alg/tests/testfiles/calmodulin_02.pdb
new file mode 100644
index 0000000000000000000000000000000000000000..f7c5c28911eaca78350a7444fb63fad809f092fe
--- /dev/null
+++ b/modules/seq/alg/tests/testfiles/calmodulin_02.pdb
@@ -0,0 +1,1126 @@
+ATOM 1 N LEU A 4 -6.873 21.082 25.312 1.00 49.53 N
+ATOM 2 CA LEU A 4 -6.696 22.003 26.447 1.00 48.82 C
+ATOM 3 C LEU A 4 -6.318 23.391 25.929 1.00 46.50 C
+ATOM 4 O LEU A 4 -5.313 23.981 26.352 1.00 45.72 O
+ATOM 5 N THR A 5 -7.147 23.871 25.013 1.00 46.77 N
+ATOM 6 CA THR A 5 -6.891 25.193 24.428 1.00 46.84 C
+ATOM 7 C THR A 5 -6.801 26.228 25.543 1.00 45.36 C
+ATOM 8 O THR A 5 -5.829 26.999 25.561 1.00 47.41 O
+ATOM 9 CB THR A 5 -7.923 25.626 23.323 1.00 46.33 C
+ATOM 10 OG1 THR A 5 -9.238 25.386 23.908 1.00 48.28 O
+ATOM 11 CG2 THR A 5 -7.704 24.943 21.974 1.00 44.31 C
+ATOM 12 N GLU A 6 -7.781 26.217 26.419 1.00 46.42 N
+ATOM 13 CA GLU A 6 -7.858 27.154 27.557 1.00 45.65 C
+ATOM 14 C GLU A 6 -6.502 27.343 28.224 1.00 44.22 C
+ATOM 15 O GLU A 6 -6.040 28.483 28.423 1.00 42.97 O
+ATOM 16 CB GLU A 6 -8.881 26.726 28.592 1.00 50.13 C
+ATOM 17 CG GLU A 6 -9.358 27.699 29.657 1.00 55.79 C
+ATOM 18 CD GLU A 6 -10.322 27.149 30.668 1.00 58.96 C
+ATOM 19 OE1 GLU A 6 -10.775 26.034 30.334 1.00 62.89 O
+ATOM 20 OE2 GLU A 6 -10.648 27.701 31.706 1.00 60.58 O
+ATOM 21 N GLU A 7 -5.878 26.224 28.555 1.00 41.38 N
+ATOM 22 CA GLU A 7 -4.554 26.201 29.194 1.00 39.78 C
+ATOM 23 C GLU A 7 -3.488 26.654 28.194 1.00 36.82 C
+ATOM 24 O GLU A 7 -2.492 27.284 28.575 1.00 35.19 O
+ATOM 25 CB GLU A 7 -4.220 24.818 29.707 1.00 41.74 C
+ATOM 26 CG GLU A 7 -2.859 24.477 30.277 1.00 45.41 C
+ATOM 27 CD GLU A 7 -2.755 23.096 30.867 1.00 47.19 C
+ATOM 28 OE1 GLU A 7 -3.096 22.069 30.304 1.00 45.58 O
+ATOM 29 OE2 GLU A 7 -2.284 23.115 32.029 1.00 49.85 O
+ATOM 30 N GLN A 8 -3.742 26.335 26.934 1.00 34.23 N
+ATOM 31 CA GLN A 8 -2.874 26.663 25.797 1.00 32.23 C
+ATOM 32 C GLN A 8 -2.838 28.187 25.588 1.00 33.49 C
+ATOM 33 O GLN A 8 -1.732 28.749 25.518 1.00 32.07 O
+ATOM 34 CB GLN A 8 -3.273 25.955 24.510 1.00 30.73 C
+ATOM 35 CG GLN A 8 -2.731 24.544 24.361 1.00 29.84 C
+ATOM 36 CD GLN A 8 -2.980 23.970 22.985 1.00 28.64 C
+ATOM 37 OE1 GLN A 8 -4.082 23.858 22.452 1.00 29.29 O
+ATOM 38 NE2 GLN A 8 -1.893 23.581 22.335 1.00 26.48 N
+ATOM 39 N ILE A 9 -4.017 28.772 25.488 1.00 32.05 N
+ATOM 40 CA ILE A 9 -4.118 30.226 25.284 1.00 35.87 C
+ATOM 41 C ILE A 9 -3.405 30.916 26.444 1.00 33.10 C
+ATOM 42 O ILE A 9 -2.686 31.909 26.240 1.00 32.76 O
+ATOM 43 CB ILE A 9 -5.569 30.720 25.011 1.00 38.25 C
+ATOM 44 CG1 ILE A 9 -6.249 31.153 26.340 1.00 42.51 C
+ATOM 45 CG2 ILE A 9 -6.441 29.697 24.231 1.00 38.25 C
+ATOM 46 CD1 ILE A 9 -7.719 31.624 26.165 1.00 46.23 C
+ATOM 47 N ALA A 10 -3.568 30.386 27.641 1.00 32.29 N
+ATOM 48 CA ALA A 10 -2.933 30.933 28.846 1.00 29.35 C
+ATOM 49 C ALA A 10 -1.427 31.094 28.677 1.00 29.52 C
+ATOM 50 O ALA A 10 -0.849 32.120 29.060 1.00 29.04 O
+ATOM 51 CB ALA A 10 -3.281 30.070 30.058 1.00 32.99 C
+ATOM 52 N GLU A 11 -0.787 30.084 28.107 1.00 30.70 N
+ATOM 53 CA GLU A 11 0.670 30.102 27.900 1.00 31.69 C
+ATOM 54 C GLU A 11 1.098 31.116 26.852 1.00 29.24 C
+ATOM 55 O GLU A 11 2.183 31.704 26.957 1.00 32.68 O
+ATOM 56 CB GLU A 11 1.191 28.718 27.487 1.00 37.43 C
+ATOM 57 CG GLU A 11 0.859 27.630 28.520 1.00 40.07 C
+ATOM 58 CD GLU A 11 1.277 26.245 28.139 1.00 42.15 C
+ATOM 59 OE1 GLU A 11 2.451 26.028 28.517 1.00 48.12 O
+ATOM 60 OE2 GLU A 11 0.584 25.440 27.547 1.00 44.80 O
+ATOM 61 N PHE A 12 0.223 31.283 25.879 1.00 28.97 N
+ATOM 62 CA PHE A 12 0.462 32.236 24.777 1.00 26.93 C
+ATOM 63 C PHE A 12 0.271 33.672 25.299 1.00 24.14 C
+ATOM 64 O PHE A 12 1.002 34.532 24.826 1.00 26.06 O
+ATOM 65 CB PHE A 12 -0.393 31.969 23.550 1.00 28.76 C
+ATOM 66 CG PHE A 12 0.066 30.867 22.641 1.00 30.67 C
+ATOM 67 CD1 PHE A 12 1.328 30.920 22.046 1.00 32.84 C
+ATOM 68 CD2 PHE A 12 -0.767 29.774 22.377 1.00 28.68 C
+ATOM 69 CE1 PHE A 12 1.752 29.891 21.185 1.00 33.43 C
+ATOM 70 CE2 PHE A 12 -0.369 28.755 21.524 1.00 32.88 C
+ATOM 71 CZ PHE A 12 0.893 28.813 20.931 1.00 29.64 C
+ATOM 72 N LYS A 13 -0.659 33.857 26.203 1.00 20.89 N
+ATOM 73 CA LYS A 13 -0.987 35.159 26.817 1.00 22.33 C
+ATOM 74 C LYS A 13 0.192 35.621 27.656 1.00 20.70 C
+ATOM 75 O LYS A 13 0.613 36.788 27.776 1.00 16.13 O
+ATOM 76 CB LYS A 13 -2.217 34.930 27.661 1.00 28.79 C
+ATOM 77 CG LYS A 13 -3.041 36.094 28.154 1.00 32.48 C
+ATOM 78 CD LYS A 13 -4.442 35.589 28.530 1.00 36.44 C
+ATOM 79 CE LYS A 13 -5.276 35.366 27.283 1.00 40.40 C
+ATOM 80 NZ LYS A 13 -6.424 34.469 27.572 1.00 41.12 N
+ATOM 81 N GLU A 14 0.774 34.606 28.303 1.00 21.57 N
+ATOM 82 CA GLU A 14 1.948 34.832 29.154 1.00 21.36 C
+ATOM 83 C GLU A 14 3.092 35.346 28.288 1.00 22.09 C
+ATOM 84 O GLU A 14 3.746 36.313 28.684 1.00 20.70 O
+ATOM 85 CB GLU A 14 2.402 33.605 29.926 1.00 27.25 C
+ATOM 86 CG GLU A 14 1.881 33.442 31.347 1.00 35.30 C
+ATOM 87 CD GLU A 14 2.032 32.070 31.947 1.00 39.45 C
+ATOM 88 OE1 GLU A 14 3.185 31.613 31.795 1.00 41.02 O
+ATOM 89 OE2 GLU A 14 1.111 31.490 32.497 1.00 42.94 O
+ATOM 90 N ALA A 15 3.312 34.709 27.151 1.00 20.13 N
+ATOM 91 CA ALA A 15 4.375 35.089 26.210 1.00 20.94 C
+ATOM 92 C ALA A 15 4.146 36.506 25.665 1.00 17.60 C
+ATOM 93 O ALA A 15 5.108 37.285 25.635 1.00 18.43 O
+ATOM 94 CB ALA A 15 4.499 34.020 25.123 1.00 17.73 C
+ATOM 95 N PHE A 16 2.934 36.813 25.287 1.00 20.02 N
+ATOM 96 CA PHE A 16 2.482 38.106 24.744 1.00 15.27 C
+ATOM 97 C PHE A 16 2.771 39.212 25.755 1.00 15.45 C
+ATOM 98 O PHE A 16 3.341 40.248 25.376 1.00 16.92 O
+ATOM 99 CB PHE A 16 1.002 38.123 24.378 1.00 13.77 C
+ATOM 100 CG PHE A 16 0.463 39.353 23.734 1.00 16.36 C
+ATOM 101 CD1 PHE A 16 0.534 39.540 22.365 1.00 14.23 C
+ATOM 102 CD2 PHE A 16 -0.115 40.359 24.545 1.00 14.21 C
+ATOM 103 CE1 PHE A 16 0.050 40.703 21.750 1.00 16.13 C
+ATOM 104 CE2 PHE A 16 -0.589 41.541 23.975 1.00 16.04 C
+ATOM 105 CZ PHE A 16 -0.506 41.686 22.584 1.00 18.35 C
+ATOM 106 N SER A 17 2.398 38.968 27.017 1.00 14.55 N
+ATOM 107 CA SER A 17 2.620 40.003 28.044 1.00 18.34 C
+ATOM 108 C SER A 17 4.065 40.424 28.164 1.00 15.87 C
+ATOM 109 O SER A 17 4.281 41.596 28.542 1.00 20.17 O
+ATOM 110 CB SER A 17 2.054 39.565 29.403 1.00 18.71 C
+ATOM 111 OG SER A 17 0.694 39.178 29.164 1.00 29.11 O
+ATOM 112 N LEU A 18 5.017 39.537 27.863 1.00 16.90 N
+ATOM 113 CA LEU A 18 6.429 39.916 27.972 1.00 13.77 C
+ATOM 114 C LEU A 18 6.760 41.054 26.994 1.00 11.96 C
+ATOM 115 O LEU A 18 7.580 41.947 27.290 1.00 12.75 O
+ATOM 116 CB LEU A 18 7.292 38.669 27.689 1.00 26.24 C
+ATOM 117 CG LEU A 18 8.757 38.900 27.325 1.00 29.37 C
+ATOM 118 CD1 LEU A 18 9.628 39.178 28.545 1.00 23.47 C
+ATOM 119 CD2 LEU A 18 9.288 37.653 26.611 1.00 29.36 C
+ATOM 120 N PHE A 19 6.091 41.007 25.852 1.00 16.90 N
+ATOM 121 CA PHE A 19 6.326 42.020 24.806 1.00 13.01 C
+ATOM 122 C PHE A 19 5.501 43.313 24.966 1.00 15.56 C
+ATOM 123 O PHE A 19 6.055 44.390 24.697 1.00 10.27 O
+ATOM 124 CB PHE A 19 6.018 41.441 23.420 1.00 16.88 C
+ATOM 125 CG PHE A 19 6.985 40.410 22.937 1.00 15.97 C
+ATOM 126 CD1 PHE A 19 8.160 40.772 22.278 1.00 16.90 C
+ATOM 127 CD2 PHE A 19 6.650 39.067 23.164 1.00 14.82 C
+ATOM 128 CE1 PHE A 19 9.036 39.782 21.827 1.00 22.16 C
+ATOM 129 CE2 PHE A 19 7.537 38.059 22.738 1.00 19.54 C
+ATOM 130 CZ PHE A 19 8.705 38.449 22.071 1.00 15.11 C
+ATOM 131 N ASP A 20 4.266 43.121 25.376 1.00 14.41 N
+ATOM 132 CA ASP A 20 3.304 44.245 25.573 1.00 11.59 C
+ATOM 133 C ASP A 20 3.670 44.929 26.900 1.00 14.74 C
+ATOM 134 O ASP A 20 2.889 44.743 27.823 1.00 18.73 O
+ATOM 135 CB ASP A 20 1.892 43.688 25.483 1.00 9.57 C
+ATOM 136 CG ASP A 20 0.838 44.766 25.732 1.00 12.80 C
+ATOM 137 OD1 ASP A 20 1.362 45.900 25.680 1.00 15.48 O
+ATOM 138 OD2 ASP A 20 -0.327 44.468 26.038 1.00 14.91 O
+ATOM 139 N LYS A 21 4.728 45.693 26.942 1.00 17.60 N
+ATOM 140 CA LYS A 21 5.293 46.400 28.082 1.00 17.11 C
+ATOM 141 C LYS A 21 4.294 47.280 28.828 1.00 18.92 C
+ATOM 142 O LYS A 21 4.315 47.311 30.060 1.00 17.29 O
+ATOM 143 CB LYS A 21 6.503 47.292 27.783 1.00 13.27 C
+ATOM 144 CG LYS A 21 7.799 46.588 27.382 1.00 17.02 C
+ATOM 145 CD LYS A 21 7.997 45.345 28.241 1.00 12.36 C
+ATOM 146 CE LYS A 21 9.432 44.873 28.246 1.00 14.04 C
+ATOM 147 NZ LYS A 21 9.466 43.420 28.594 1.00 12.84 N
+ATOM 148 N ASP A 22 3.444 47.960 28.072 1.00 16.55 N
+ATOM 149 CA ASP A 22 2.467 48.811 28.776 1.00 15.05 C
+ATOM 150 C ASP A 22 1.114 48.178 28.881 1.00 12.96 C
+ATOM 151 O ASP A 22 0.189 48.826 29.396 1.00 14.58 O
+ATOM 152 CB ASP A 22 2.549 50.211 28.151 1.00 12.16 C
+ATOM 153 CG ASP A 22 1.791 50.191 26.830 1.00 19.80 C
+ATOM 154 OD1 ASP A 22 1.480 49.126 26.287 1.00 12.67 O
+ATOM 155 OD2 ASP A 22 1.487 51.294 26.337 1.00 14.63 O
+ATOM 156 N GLY A 23 0.901 46.928 28.470 1.00 11.59 N
+ATOM 157 CA GLY A 23 -0.417 46.341 28.589 1.00 12.59 C
+ATOM 158 C GLY A 23 -1.603 46.932 27.878 1.00 15.04 C
+ATOM 159 O GLY A 23 -2.725 46.782 28.403 1.00 19.45 O
+ATOM 160 N ASP A 24 -1.454 47.546 26.710 1.00 15.63 N
+ATOM 161 CA ASP A 24 -2.616 48.079 25.966 1.00 13.63 C
+ATOM 162 C ASP A 24 -3.219 47.054 25.040 1.00 15.51 C
+ATOM 163 O ASP A 24 -4.213 47.333 24.351 1.00 11.21 O
+ATOM 164 CB ASP A 24 -2.213 49.407 25.299 1.00 16.34 C
+ATOM 165 CG ASP A 24 -1.522 49.054 23.983 1.00 17.21 C
+ATOM 166 OD1 ASP A 24 -0.647 48.198 24.144 1.00 6.33 O
+ATOM 167 OD2 ASP A 24 -1.796 49.554 22.920 1.00 11.82 O
+ATOM 168 N GLY A 25 -2.631 45.860 24.931 1.00 6.69 N
+ATOM 169 CA GLY A 25 -3.185 44.822 24.047 1.00 11.58 C
+ATOM 170 C GLY A 25 -2.510 44.785 22.651 1.00 2.00 C
+ATOM 171 O GLY A 25 -3.040 44.051 21.780 1.00 10.63 O
+ATOM 172 N THR A 26 -1.468 45.522 22.517 1.00 5.29 N
+ATOM 173 CA THR A 26 -0.742 45.570 21.225 1.00 7.60 C
+ATOM 174 C THR A 26 0.732 45.703 21.494 1.00 9.51 C
+ATOM 175 O THR A 26 1.230 46.259 22.472 1.00 11.31 O
+ATOM 176 CB THR A 26 -1.250 46.702 20.252 1.00 13.05 C
+ATOM 177 OG1 THR A 26 -0.824 47.960 20.889 1.00 11.71 O
+ATOM 178 CG2 THR A 26 -2.752 46.752 19.973 1.00 15.35 C
+ATOM 179 N ILE A 27 1.487 45.176 20.498 1.00 10.83 N
+ATOM 180 CA ILE A 27 2.948 45.226 20.545 1.00 10.53 C
+ATOM 181 C ILE A 27 3.373 46.196 19.430 1.00 9.58 C
+ATOM 182 O ILE A 27 2.968 46.058 18.283 1.00 7.93 O
+ATOM 183 CB ILE A 27 3.631 43.828 20.356 1.00 12.73 C
+ATOM 184 CG1 ILE A 27 3.061 42.772 21.322 1.00 9.70 C
+ATOM 185 CG2 ILE A 27 5.170 44.038 20.518 1.00 20.43 C
+ATOM 186 CD1 ILE A 27 3.357 41.298 20.894 1.00 16.56 C
+ATOM 187 N THR A 28 4.130 47.187 19.784 1.00 8.69 N
+ATOM 188 CA THR A 28 4.614 48.231 18.848 1.00 13.66 C
+ATOM 189 C THR A 28 6.066 48.039 18.487 1.00 16.31 C
+ATOM 190 O THR A 28 6.709 47.194 19.149 1.00 14.73 O
+ATOM 191 CB THR A 28 4.397 49.407 19.926 1.00 8.84 C
+ATOM 192 OG1 THR A 28 3.328 50.261 19.465 1.00 23.63 O
+ATOM 193 CG2 THR A 28 5.697 49.759 20.563 1.00 4.75 C
+ATOM 194 N THR A 29 6.625 48.793 17.551 1.00 17.87 N
+ATOM 195 CA THR A 29 8.042 48.661 17.186 1.00 20.41 C
+ATOM 196 C THR A 29 8.972 48.898 18.370 1.00 20.52 C
+ATOM 197 O THR A 29 10.010 48.216 18.477 1.00 22.52 O
+ATOM 198 CB THR A 29 8.475 49.654 16.036 1.00 16.79 C
+ATOM 199 OG1 THR A 29 8.236 51.000 16.543 1.00 23.49 O
+ATOM 200 CG2 THR A 29 7.730 49.451 14.729 1.00 17.84 C
+ATOM 201 N LYS A 30 8.620 49.865 19.204 1.00 19.91 N
+ATOM 202 CA LYS A 30 9.395 50.247 20.386 1.00 17.77 C
+ATOM 203 C LYS A 30 9.359 49.163 21.449 1.00 16.00 C
+ATOM 204 O LYS A 30 10.371 48.918 22.116 1.00 21.31 O
+ATOM 205 CB LYS A 30 8.937 51.528 21.076 1.00 18.19 C
+ATOM 206 CG LYS A 30 8.271 52.555 20.162 1.00 24.44 C
+ATOM 207 CD LYS A 30 6.755 52.484 20.356 1.00 31.34 C
+ATOM 208 CE LYS A 30 6.009 52.925 19.112 1.00 33.74 C
+ATOM 209 NZ LYS A 30 6.597 52.282 17.907 1.00 34.76 N
+ATOM 210 N GLU A 31 8.220 48.516 21.601 1.00 15.72 N
+ATOM 211 CA GLU A 31 8.160 47.434 22.629 1.00 15.49 C
+ATOM 212 C GLU A 31 8.991 46.269 22.136 1.00 13.09 C
+ATOM 213 O GLU A 31 9.814 45.682 22.880 1.00 13.15 O
+ATOM 214 CB GLU A 31 6.723 47.039 22.947 1.00 8.61 C
+ATOM 215 CG GLU A 31 5.971 48.075 23.781 1.00 15.46 C
+ATOM 216 CD GLU A 31 4.517 47.919 23.975 1.00 10.77 C
+ATOM 217 OE1 GLU A 31 3.830 47.450 23.067 1.00 9.39 O
+ATOM 218 OE2 GLU A 31 3.900 48.247 24.996 1.00 17.00 O
+ATOM 219 N LEU A 32 8.798 45.896 20.886 1.00 11.34 N
+ATOM 220 CA LEU A 32 9.571 44.776 20.282 1.00 10.72 C
+ATOM 221 C LEU A 32 11.036 45.115 20.443 1.00 10.76 C
+ATOM 222 O LEU A 32 11.821 44.226 20.767 1.00 13.29 O
+ATOM 223 CB LEU A 32 9.120 44.561 18.821 1.00 11.99 C
+ATOM 224 CG LEU A 32 9.953 43.533 18.037 1.00 13.38 C
+ATOM 225 CD1 LEU A 32 9.856 42.168 18.694 1.00 21.91 C
+ATOM 226 CD2 LEU A 32 9.355 43.529 16.621 1.00 15.76 C
+ATOM 227 N GLY A 33 11.399 46.370 20.252 1.00 7.66 N
+ATOM 228 CA GLY A 33 12.770 46.883 20.366 1.00 16.31 C
+ATOM 229 C GLY A 33 13.356 46.657 21.755 1.00 16.66 C
+ATOM 230 O GLY A 33 14.485 46.150 21.904 1.00 16.41 O
+ATOM 231 N THR A 34 12.624 47.005 22.805 1.00 15.62 N
+ATOM 232 CA THR A 34 13.153 46.797 24.169 1.00 19.19 C
+ATOM 233 C THR A 34 13.268 45.312 24.446 1.00 15.87 C
+ATOM 234 O THR A 34 14.269 44.943 25.120 1.00 20.23 O
+ATOM 235 CB THR A 34 12.510 47.726 25.272 1.00 24.30 C
+ATOM 236 OG1 THR A 34 12.010 46.918 26.379 1.00 29.42 O
+ATOM 237 CG2 THR A 34 11.505 48.704 24.702 1.00 19.41 C
+ATOM 238 N VAL A 35 12.361 44.497 23.923 1.00 12.65 N
+ATOM 239 CA VAL A 35 12.557 43.050 24.184 1.00 19.28 C
+ATOM 240 C VAL A 35 13.859 42.548 23.547 1.00 21.94 C
+ATOM 241 O VAL A 35 14.644 41.851 24.241 1.00 21.37 O
+ATOM 242 CB VAL A 35 11.356 42.183 23.826 1.00 22.99 C
+ATOM 243 CG1 VAL A 35 11.666 40.694 23.973 1.00 23.97 C
+ATOM 244 CG2 VAL A 35 10.130 42.550 24.637 1.00 25.21 C
+ATOM 245 N MET A 36 14.089 42.856 22.295 1.00 22.58 N
+ATOM 246 CA MET A 36 15.291 42.403 21.571 1.00 24.04 C
+ATOM 247 C MET A 36 16.574 42.876 22.235 1.00 25.85 C
+ATOM 248 O MET A 36 17.509 42.058 22.382 1.00 30.54 O
+ATOM 249 CB MET A 36 15.271 42.783 20.095 1.00 24.39 C
+ATOM 250 CG MET A 36 14.010 42.360 19.406 1.00 27.42 C
+ATOM 251 SD MET A 36 13.933 40.545 19.279 1.00 37.60 S
+ATOM 252 CE MET A 36 14.898 40.274 17.785 1.00 37.79 C
+ATOM 253 N ARG A 37 16.621 44.134 22.599 1.00 22.30 N
+ATOM 254 CA ARG A 37 17.784 44.748 23.248 1.00 24.72 C
+ATOM 255 C ARG A 37 18.127 44.071 24.577 1.00 25.68 C
+ATOM 256 O ARG A 37 19.310 44.062 24.976 1.00 30.14 O
+ATOM 257 CB ARG A 37 17.570 46.244 23.418 1.00 21.50 C
+ATOM 258 CG ARG A 37 17.629 47.108 22.183 1.00 22.38 C
+ATOM 259 CD ARG A 37 17.810 48.548 22.459 1.00 29.01 C
+ATOM 260 NE ARG A 37 16.577 49.120 23.014 1.00 33.11 N
+ATOM 261 CZ ARG A 37 15.634 49.620 22.208 1.00 32.22 C
+ATOM 262 NH1 ARG A 37 15.800 49.648 20.889 1.00 30.61 N
+ATOM 263 NH2 ARG A 37 14.504 50.069 22.751 1.00 33.35 N
+ATOM 264 N SER A 38 17.130 43.532 25.237 1.00 24.69 N
+ATOM 265 CA SER A 38 17.351 42.851 26.531 1.00 30.18 C
+ATOM 266 C SER A 38 17.960 41.476 26.233 1.00 32.47 C
+ATOM 267 O SER A 38 18.483 40.814 27.143 1.00 36.66 O
+ATOM 268 CB SER A 38 16.109 42.734 27.380 1.00 28.75 C
+ATOM 269 OG SER A 38 15.277 41.685 26.924 1.00 30.47 O
+ATOM 270 N LEU A 39 17.885 41.105 24.961 1.00 32.02 N
+ATOM 271 CA LEU A 39 18.426 39.820 24.495 1.00 30.40 C
+ATOM 272 C LEU A 39 19.841 39.972 23.945 1.00 30.27 C
+ATOM 273 O LEU A 39 20.410 38.948 23.530 1.00 31.46 O
+ATOM 274 CB LEU A 39 17.456 39.202 23.487 1.00 29.34 C
+ATOM 275 CG LEU A 39 16.059 38.816 23.920 1.00 32.36 C
+ATOM 276 CD1 LEU A 39 15.269 38.185 22.783 1.00 34.54 C
+ATOM 277 CD2 LEU A 39 16.137 37.838 25.090 1.00 33.87 C
+ATOM 278 N GLY A 40 20.405 41.168 23.943 1.00 26.01 N
+ATOM 279 CA GLY A 40 21.774 41.366 23.425 1.00 28.44 C
+ATOM 280 C GLY A 40 21.797 41.652 21.924 1.00 25.97 C
+ATOM 281 O GLY A 40 22.816 41.594 21.213 1.00 26.68 O
+ATOM 282 N GLN A 41 20.638 42.015 21.427 1.00 26.26 N
+ATOM 283 CA GLN A 41 20.442 42.345 19.998 1.00 24.93 C
+ATOM 284 C GLN A 41 19.920 43.775 19.921 1.00 28.39 C
+ATOM 285 O GLN A 41 18.896 44.034 20.578 1.00 28.96 O
+ATOM 286 CB GLN A 41 19.403 41.374 19.495 1.00 28.97 C
+ATOM 287 CG GLN A 41 19.511 40.733 18.149 1.00 36.53 C
+ATOM 288 CD GLN A 41 19.014 39.301 18.263 1.00 38.83 C
+ATOM 289 OE1 GLN A 41 18.387 38.761 17.367 1.00 41.03 O
+ATOM 290 NE2 GLN A 41 19.300 38.714 19.428 1.00 42.41 N
+ATOM 291 N ASN A 42 20.600 44.625 19.179 1.00 27.74 N
+ATOM 292 CA ASN A 42 20.142 46.026 19.052 1.00 26.58 C
+ATOM 293 C ASN A 42 19.797 46.268 17.576 1.00 26.15 C
+ATOM 294 O ASN A 42 20.572 46.811 16.765 1.00 28.12 O
+ATOM 295 CB ASN A 42 21.138 46.955 19.722 1.00 20.72 C
+ATOM 296 CG ASN A 42 21.331 46.776 21.220 1.00 26.76 C
+ATOM 297 OD1 ASN A 42 21.697 45.729 21.775 1.00 22.91 O
+ATOM 298 ND2 ASN A 42 21.116 47.842 22.006 1.00 15.27 N
+ATOM 299 N PRO A 43 18.587 45.850 17.223 1.00 27.74 N
+ATOM 300 CA PRO A 43 18.069 46.009 15.859 1.00 27.47 C
+ATOM 301 C PRO A 43 17.816 47.480 15.568 1.00 28.41 C
+ATOM 302 O PRO A 43 17.657 48.313 16.486 1.00 27.47 O
+ATOM 303 CB PRO A 43 16.778 45.193 15.807 1.00 29.27 C
+ATOM 304 CG PRO A 43 16.311 45.200 17.250 1.00 29.04 C
+ATOM 305 CD PRO A 43 17.583 45.217 18.091 1.00 29.78 C
+ATOM 306 N THR A 44 17.786 47.780 14.276 1.00 27.75 N
+ATOM 307 CA THR A 44 17.541 49.173 13.853 1.00 25.78 C
+ATOM 308 C THR A 44 16.027 49.337 13.701 1.00 25.42 C
+ATOM 309 O THR A 44 15.334 48.317 13.644 1.00 24.39 O
+ATOM 310 CB THR A 44 18.321 49.490 12.526 1.00 23.72 C
+ATOM 311 OG1 THR A 44 17.668 48.675 11.496 1.00 24.67 O
+ATOM 312 CG2 THR A 44 19.820 49.177 12.561 1.00 24.35 C
+ATOM 313 N GLU A 45 15.558 50.570 13.614 1.00 27.78 N
+ATOM 314 CA GLU A 45 14.113 50.802 13.422 1.00 27.10 C
+ATOM 315 C GLU A 45 13.674 50.087 12.148 1.00 25.32 C
+ATOM 316 O GLU A 45 12.604 49.451 12.118 1.00 26.16 O
+ATOM 317 CB GLU A 45 13.777 52.287 13.415 1.00 31.88 C
+ATOM 318 CG GLU A 45 12.330 52.725 13.430 1.00 38.44 C
+ATOM 319 CD GLU A 45 11.457 52.597 14.634 1.00 42.72 C
+ATOM 320 OE1 GLU A 45 12.059 52.647 15.735 1.00 43.65 O
+ATOM 321 OE2 GLU A 45 10.234 52.468 14.557 1.00 43.30 O
+ATOM 322 N ALA A 46 14.472 50.099 11.093 1.00 24.71 N
+ATOM 323 CA ALA A 46 14.141 49.427 9.828 1.00 20.95 C
+ATOM 324 C ALA A 46 13.881 47.943 9.998 1.00 21.64 C
+ATOM 325 O ALA A 46 12.939 47.338 9.458 1.00 19.18 O
+ATOM 326 CB ALA A 46 15.248 49.641 8.791 1.00 23.64 C
+ATOM 327 N GLU A 47 14.771 47.307 10.752 1.00 19.51 N
+ATOM 328 CA GLU A 47 14.658 45.869 11.023 1.00 20.53 C
+ATOM 329 C GLU A 47 13.432 45.643 11.912 1.00 15.29 C
+ATOM 330 O GLU A 47 12.753 44.655 11.678 1.00 14.12 O
+ATOM 331 CB GLU A 47 15.904 45.297 11.693 1.00 23.05 C
+ATOM 332 CG GLU A 47 17.102 45.115 10.752 1.00 24.45 C
+ATOM 333 CD GLU A 47 18.461 45.177 11.384 1.00 28.74 C
+ATOM 334 OE1 GLU A 47 18.727 45.739 12.437 1.00 28.22 O
+ATOM 335 OE2 GLU A 47 19.328 44.616 10.672 1.00 23.62 O
+ATOM 336 N LEU A 48 13.181 46.544 12.845 1.00 13.15 N
+ATOM 337 CA LEU A 48 12.024 46.429 13.766 1.00 10.72 C
+ATOM 338 C LEU A 48 10.755 46.492 12.915 1.00 11.70 C
+ATOM 339 O LEU A 48 9.849 45.688 13.089 1.00 13.32 O
+ATOM 340 CB LEU A 48 12.125 47.492 14.846 1.00 19.61 C
+ATOM 341 CG LEU A 48 12.428 47.183 16.295 1.00 20.36 C
+ATOM 342 CD1 LEU A 48 13.007 45.806 16.543 1.00 23.93 C
+ATOM 343 CD2 LEU A 48 13.373 48.247 16.860 1.00 21.03 C
+ATOM 344 N GLN A 49 10.717 47.363 11.909 1.00 14.61 N
+ATOM 345 CA GLN A 49 9.529 47.460 11.046 1.00 14.47 C
+ATOM 346 C GLN A 49 9.283 46.208 10.224 1.00 13.88 C
+ATOM 347 O GLN A 49 8.121 45.751 10.085 1.00 11.99 O
+ATOM 348 CB GLN A 49 9.607 48.764 10.244 1.00 19.70 C
+ATOM 349 CG GLN A 49 8.265 49.056 9.587 1.00 28.77 C
+ATOM 350 CD GLN A 49 7.204 49.395 10.612 1.00 30.35 C
+ATOM 351 OE1 GLN A 49 6.141 48.787 10.645 1.00 33.82 O
+ATOM 352 NE2 GLN A 49 7.530 50.394 11.434 1.00 31.96 N
+ATOM 353 N ASP A 50 10.320 45.584 9.662 1.00 18.83 N
+ATOM 354 CA ASP A 50 10.179 44.341 8.880 1.00 14.32 C
+ATOM 355 C ASP A 50 9.629 43.199 9.746 1.00 11.08 C
+ATOM 356 O ASP A 50 8.795 42.418 9.293 1.00 13.15 O
+ATOM 357 CB ASP A 50 11.518 43.946 8.248 1.00 16.77 C
+ATOM 358 CG ASP A 50 11.792 44.763 6.994 1.00 21.73 C
+ATOM 359 OD1 ASP A 50 10.900 45.179 6.250 1.00 24.00 O
+ATOM 360 OD2 ASP A 50 13.003 44.962 6.817 1.00 22.73 O
+ATOM 361 N MET A 51 10.105 43.139 10.978 1.00 15.31 N
+ATOM 362 CA MET A 51 9.613 42.106 11.907 1.00 12.18 C
+ATOM 363 C MET A 51 8.117 42.253 12.128 1.00 9.57 C
+ATOM 364 O MET A 51 7.376 41.226 12.098 1.00 14.22 O
+ATOM 365 CB MET A 51 10.404 42.111 13.206 1.00 16.25 C
+ATOM 366 CG MET A 51 11.882 41.960 12.974 1.00 25.99 C
+ATOM 367 SD MET A 51 12.662 41.534 14.575 1.00 31.06 S
+ATOM 368 CE MET A 51 14.268 42.304 14.343 1.00 33.58 C
+ATOM 369 N ILE A 52 7.636 43.455 12.372 1.00 15.00 N
+ATOM 370 CA ILE A 52 6.206 43.697 12.614 1.00 9.92 C
+ATOM 371 C ILE A 52 5.402 43.465 11.344 1.00 9.44 C
+ATOM 372 O ILE A 52 4.348 42.828 11.327 1.00 11.75 O
+ATOM 373 CB ILE A 52 6.011 45.145 13.198 1.00 13.02 C
+ATOM 374 CG1 ILE A 52 6.451 45.096 14.682 1.00 22.03 C
+ATOM 375 CG2 ILE A 52 4.573 45.640 12.915 1.00 14.79 C
+ATOM 376 CD1 ILE A 52 5.499 45.757 15.695 1.00 26.23 C
+ATOM 377 N ASN A 53 5.949 43.935 10.232 1.00 13.88 N
+ATOM 378 CA ASN A 53 5.295 43.775 8.930 1.00 7.92 C
+ATOM 379 C ASN A 53 4.944 42.313 8.654 1.00 6.09 C
+ATOM 380 O ASN A 53 3.850 41.993 8.201 1.00 12.29 O
+ATOM 381 CB ASN A 53 6.131 44.298 7.750 1.00 18.24 C
+ATOM 382 CG ASN A 53 6.012 45.816 7.653 1.00 20.79 C
+ATOM 383 OD1 ASN A 53 6.704 46.424 6.834 1.00 23.91 O
+ATOM 384 ND2 ASN A 53 5.155 46.325 8.517 1.00 16.53 N
+ATOM 385 N GLU A 54 5.899 41.451 8.898 1.00 12.39 N
+ATOM 386 CA GLU A 54 5.680 40.017 8.679 1.00 17.61 C
+ATOM 387 C GLU A 54 4.520 39.397 9.443 1.00 21.44 C
+ATOM 388 O GLU A 54 3.896 38.441 8.950 1.00 22.19 O
+ATOM 389 CB GLU A 54 6.980 39.306 9.092 1.00 26.47 C
+ATOM 390 CG GLU A 54 7.091 37.803 8.955 1.00 37.65 C
+ATOM 391 CD GLU A 54 8.324 37.167 9.530 1.00 43.96 C
+ATOM 392 OE1 GLU A 54 9.213 38.003 9.794 1.00 48.31 O
+ATOM 393 OE2 GLU A 54 8.439 35.960 9.721 1.00 50.11 O
+ATOM 394 N VAL A 55 4.220 39.902 10.627 1.00 19.68 N
+ATOM 395 CA VAL A 55 3.156 39.398 11.506 1.00 18.90 C
+ATOM 396 C VAL A 55 1.880 40.207 11.501 1.00 10.90 C
+ATOM 397 O VAL A 55 0.810 39.722 11.892 1.00 14.51 O
+ATOM 398 CB VAL A 55 3.707 39.303 12.952 1.00 17.13 C
+ATOM 399 CG1 VAL A 55 5.122 38.766 12.957 1.00 14.61 C
+ATOM 400 CG2 VAL A 55 3.649 40.601 13.714 1.00 26.02 C
+ATOM 401 N ASP A 56 1.965 41.461 11.075 1.00 18.02 N
+ATOM 402 CA ASP A 56 0.738 42.329 11.068 1.00 14.93 C
+ATOM 403 C ASP A 56 -0.171 42.108 9.888 1.00 17.89 C
+ATOM 404 O ASP A 56 -0.065 42.685 8.791 1.00 17.87 O
+ATOM 405 CB ASP A 56 1.338 43.730 11.207 1.00 14.83 C
+ATOM 406 CG ASP A 56 0.256 44.800 11.247 1.00 14.70 C
+ATOM 407 OD1 ASP A 56 -0.834 44.378 11.658 1.00 9.18 O
+ATOM 408 OD2 ASP A 56 0.621 45.908 10.829 1.00 14.53 O
+ATOM 409 N ALA A 57 -1.135 41.207 10.062 1.00 15.88 N
+ATOM 410 CA ALA A 57 -2.114 40.819 9.062 1.00 20.86 C
+ATOM 411 C ALA A 57 -3.085 41.892 8.609 1.00 20.68 C
+ATOM 412 O ALA A 57 -3.364 41.876 7.392 1.00 26.17 O
+ATOM 413 CB ALA A 57 -2.829 39.552 9.532 1.00 19.58 C
+ATOM 414 N ASP A 58 -3.542 42.783 9.458 1.00 25.48 N
+ATOM 415 CA ASP A 58 -4.498 43.838 9.122 1.00 22.06 C
+ATOM 416 C ASP A 58 -3.865 45.184 8.763 1.00 23.59 C
+ATOM 417 O ASP A 58 -4.609 46.155 8.577 1.00 23.87 O
+ATOM 418 CB ASP A 58 -5.501 44.035 10.269 1.00 23.40 C
+ATOM 419 CG ASP A 58 -4.887 44.551 11.543 1.00 20.37 C
+ATOM 420 OD1 ASP A 58 -3.669 44.751 11.695 1.00 21.72 O
+ATOM 421 OD2 ASP A 58 -5.642 44.742 12.521 1.00 22.23 O
+ATOM 422 N GLY A 59 -2.563 45.224 8.731 1.00 21.04 N
+ATOM 423 CA GLY A 59 -1.733 46.342 8.405 1.00 17.64 C
+ATOM 424 C GLY A 59 -1.950 47.607 9.181 1.00 21.41 C
+ATOM 425 O GLY A 59 -1.666 48.677 8.614 1.00 22.08 O
+ATOM 426 N ASN A 60 -2.382 47.482 10.428 1.00 17.37 N
+ATOM 427 CA ASN A 60 -2.608 48.645 11.292 1.00 16.01 C
+ATOM 428 C ASN A 60 -1.325 49.102 11.956 1.00 18.56 C
+ATOM 429 O ASN A 60 -1.383 50.118 12.688 1.00 16.11 O
+ATOM 430 CB ASN A 60 -3.772 48.467 12.260 1.00 20.56 C
+ATOM 431 CG ASN A 60 -3.377 47.606 13.445 1.00 16.93 C
+ATOM 432 OD1 ASN A 60 -2.429 46.793 13.325 1.00 14.20 O
+ATOM 433 ND2 ASN A 60 -4.074 47.746 14.552 1.00 19.49 N
+ATOM 434 N GLY A 61 -0.224 48.406 11.780 1.00 19.98 N
+ATOM 435 CA GLY A 61 1.053 48.800 12.337 1.00 19.24 C
+ATOM 436 C GLY A 61 1.474 48.240 13.681 1.00 19.03 C
+ATOM 437 O GLY A 61 2.604 48.563 14.089 1.00 13.84 O
+ATOM 438 N THR A 62 0.599 47.451 14.306 1.00 12.39 N
+ATOM 439 CA THR A 62 0.964 46.893 15.618 1.00 7.64 C
+ATOM 440 C THR A 62 0.452 45.439 15.558 1.00 2.00 C
+ATOM 441 O THR A 62 -0.391 45.099 14.724 1.00 14.16 O
+ATOM 442 CB THR A 62 0.256 47.655 16.807 1.00 9.89 C
+ATOM 443 OG1 THR A 62 -1.157 47.624 16.526 1.00 10.49 O
+ATOM 444 CG2 THR A 62 0.663 49.129 16.976 1.00 11.10 C
+ATOM 445 N ILE A 63 0.994 44.734 16.558 1.00 13.11 N
+ATOM 446 CA ILE A 63 0.513 43.331 16.621 1.00 11.54 C
+ATOM 447 C ILE A 63 -0.367 43.200 17.872 1.00 12.43 C
+ATOM 448 O ILE A 63 0.015 43.642 18.955 1.00 12.62 O
+ATOM 449 CB ILE A 63 1.652 42.318 16.352 1.00 19.31 C
+ATOM 450 CG1 ILE A 63 1.563 41.066 17.280 1.00 9.32 C
+ATOM 451 CG2 ILE A 63 3.094 42.803 16.148 1.00 11.65 C
+ATOM 452 CD1 ILE A 63 0.556 40.040 16.713 1.00 22.67 C
+ATOM 453 N ASP A 64 -1.499 42.592 17.643 1.00 14.08 N
+ATOM 454 CA ASP A 64 -2.517 42.309 18.661 1.00 11.41 C
+ATOM 455 C ASP A 64 -2.365 40.817 19.055 1.00 14.01 C
+ATOM 456 O ASP A 64 -1.551 40.126 18.437 1.00 13.61 O
+ATOM 457 CB ASP A 64 -3.929 42.651 18.256 1.00 13.48 C
+ATOM 458 CG ASP A 64 -4.516 41.964 17.054 1.00 11.48 C
+ATOM 459 OD1 ASP A 64 -4.024 40.917 16.573 1.00 19.19 O
+ATOM 460 OD2 ASP A 64 -5.554 42.440 16.561 1.00 19.69 O
+ATOM 461 N PHE A 65 -3.115 40.401 20.058 1.00 10.75 N
+ATOM 462 CA PHE A 65 -3.021 38.984 20.513 1.00 16.47 C
+ATOM 463 C PHE A 65 -3.307 37.947 19.445 1.00 17.70 C
+ATOM 464 O PHE A 65 -2.552 36.961 19.256 1.00 16.73 O
+ATOM 465 CB PHE A 65 -3.862 38.793 21.787 1.00 20.98 C
+ATOM 466 CG PHE A 65 -3.661 37.402 22.350 1.00 13.65 C
+ATOM 467 CD1 PHE A 65 -2.395 36.996 22.758 1.00 15.54 C
+ATOM 468 CD2 PHE A 65 -4.758 36.545 22.427 1.00 19.27 C
+ATOM 469 CE1 PHE A 65 -2.232 35.691 23.248 1.00 19.09 C
+ATOM 470 CE2 PHE A 65 -4.623 35.246 22.905 1.00 20.56 C
+ATOM 471 CZ PHE A 65 -3.348 34.850 23.318 1.00 20.75 C
+ATOM 472 N PRO A 66 -4.426 38.042 18.763 1.00 15.37 N
+ATOM 473 CA PRO A 66 -4.815 37.106 17.708 1.00 20.60 C
+ATOM 474 C PRO A 66 -3.713 36.956 16.665 1.00 20.83 C
+ATOM 475 O PRO A 66 -3.427 35.825 16.235 1.00 17.65 O
+ATOM 476 CB PRO A 66 -6.121 37.648 17.173 1.00 21.18 C
+ATOM 477 CG PRO A 66 -6.618 38.590 18.221 1.00 17.65 C
+ATOM 478 CD PRO A 66 -5.408 39.130 18.945 1.00 16.35 C
+ATOM 479 N GLU A 67 -3.071 38.041 16.275 1.00 15.50 N
+ATOM 480 CA GLU A 67 -1.981 38.065 15.277 1.00 14.38 C
+ATOM 481 C GLU A 67 -0.747 37.351 15.814 1.00 17.23 C
+ATOM 482 O GLU A 67 -0.126 36.532 15.110 1.00 19.20 O
+ATOM 483 CB GLU A 67 -1.612 39.481 14.839 1.00 17.56 C
+ATOM 484 CG GLU A 67 -2.504 40.208 13.828 1.00 13.54 C
+ATOM 485 CD GLU A 67 -2.253 41.700 13.706 1.00 14.36 C
+ATOM 486 OE1 GLU A 67 -1.470 42.217 14.438 1.00 15.62 O
+ATOM 487 OE2 GLU A 67 -2.920 42.249 12.800 1.00 12.60 O
+ATOM 488 N PHE A 68 -0.387 37.612 17.061 1.00 11.17 N
+ATOM 489 CA PHE A 68 0.744 36.990 17.758 1.00 15.85 C
+ATOM 490 C PHE A 68 0.546 35.467 17.855 1.00 17.28 C
+ATOM 491 O PHE A 68 1.520 34.720 17.636 1.00 18.26 O
+ATOM 492 CB PHE A 68 0.930 37.563 19.154 1.00 18.11 C
+ATOM 493 CG PHE A 68 1.923 36.927 20.073 1.00 17.51 C
+ATOM 494 CD1 PHE A 68 1.536 35.888 20.929 1.00 17.02 C
+ATOM 495 CD2 PHE A 68 3.232 37.381 20.100 1.00 17.36 C
+ATOM 496 CE1 PHE A 68 2.478 35.310 21.785 1.00 18.58 C
+ATOM 497 CE2 PHE A 68 4.176 36.829 20.966 1.00 20.93 C
+ATOM 498 CZ PHE A 68 3.790 35.790 21.817 1.00 16.11 C
+ATOM 499 N LEU A 69 -0.650 35.101 18.231 1.00 21.02 N
+ATOM 500 CA LEU A 69 -1.099 33.706 18.420 1.00 23.90 C
+ATOM 501 C LEU A 69 -0.883 32.918 17.133 1.00 27.92 C
+ATOM 502 O LEU A 69 -0.170 31.897 17.173 1.00 28.73 O
+ATOM 503 CB LEU A 69 -2.533 33.804 18.915 1.00 27.45 C
+ATOM 504 CG LEU A 69 -3.406 32.705 19.438 1.00 31.75 C
+ATOM 505 CD1 LEU A 69 -3.700 31.657 18.375 1.00 32.19 C
+ATOM 506 CD2 LEU A 69 -2.745 32.062 20.657 1.00 31.64 C
+ATOM 507 N THR A 70 -1.458 33.393 16.043 1.00 28.87 N
+ATOM 508 CA THR A 70 -1.335 32.723 14.741 1.00 32.11 C
+ATOM 509 C THR A 70 0.117 32.585 14.291 1.00 33.13 C
+ATOM 510 O THR A 70 0.464 31.527 13.721 1.00 35.80 O
+ATOM 511 CB THR A 70 -2.165 33.364 13.562 1.00 31.35 C
+ATOM 512 OG1 THR A 70 -1.271 34.330 12.930 1.00 40.44 O
+ATOM 513 CG2 THR A 70 -3.504 33.972 13.953 1.00 32.27 C
+ATOM 514 N MET A 71 0.929 33.594 14.517 1.00 31.95 N
+ATOM 515 CA MET A 71 2.339 33.524 14.102 1.00 35.39 C
+ATOM 516 C MET A 71 3.116 32.557 14.998 1.00 35.93 C
+ATOM 517 O MET A 71 3.965 31.788 14.517 1.00 34.06 O
+ATOM 518 CB MET A 71 2.995 34.897 14.084 1.00 36.46 C
+ATOM 519 CG MET A 71 4.505 34.765 14.052 1.00 43.44 C
+ATOM 520 SD MET A 71 5.119 35.236 15.705 1.00 51.18 S
+ATOM 521 CE MET A 71 6.517 34.125 15.904 1.00 49.00 C
+ATOM 522 N MET A 72 2.813 32.644 16.275 1.00 34.29 N
+ATOM 523 CA MET A 72 3.445 31.850 17.332 1.00 35.38 C
+ATOM 524 C MET A 72 3.260 30.361 17.049 1.00 33.66 C
+ATOM 525 O MET A 72 4.182 29.553 17.200 1.00 31.68 O
+ATOM 526 CB MET A 72 2.866 32.226 18.694 1.00 40.65 C
+ATOM 527 CG MET A 72 3.797 31.783 19.791 1.00 46.00 C
+ATOM 528 SD MET A 72 5.374 32.645 19.468 1.00 55.43 S
+ATOM 529 CE MET A 72 6.306 32.163 20.936 1.00 52.35 C
+ATOM 530 N ALA A 73 2.041 30.069 16.660 1.00 33.28 N
+ATOM 531 CA ALA A 73 1.613 28.701 16.334 1.00 34.31 C
+ATOM 532 C ALA A 73 2.460 28.184 15.170 1.00 37.90 C
+ATOM 533 O ALA A 73 3.214 27.215 15.321 1.00 37.29 O
+ATOM 534 CB ALA A 73 0.122 28.661 16.028 1.00 32.80 C
+ATOM 535 N ARG A 74 2.315 28.864 14.047 1.00 38.05 N
+ATOM 536 CA ARG A 74 3.037 28.517 12.815 1.00 40.00 C
+ATOM 537 C ARG A 74 4.523 28.377 13.094 1.00 39.52 C
+ATOM 538 O ARG A 74 5.177 27.479 12.526 1.00 40.32 O
+ATOM 539 CB ARG A 74 2.755 29.504 11.680 1.00 41.12 C
+ATOM 540 CG ARG A 74 1.393 29.271 11.026 1.00 47.61 C
+ATOM 541 CD ARG A 74 1.353 29.771 9.624 1.00 55.76 C
+ATOM 542 NE ARG A 74 1.195 31.214 9.510 1.00 58.03 N
+ATOM 543 CZ ARG A 74 0.025 31.856 9.530 1.00 60.60 C
+ATOM 544 NH1 ARG A 74 -1.124 31.195 9.644 1.00 61.96 N
+ATOM 545 NH2 ARG A 74 -0.011 33.190 9.445 1.00 60.54 N
+ATOM 546 N LYS A 75 5.038 29.234 13.955 1.00 39.34 N
+ATOM 547 CA LYS A 75 6.459 29.181 14.306 1.00 41.79 C
+ATOM 548 C LYS A 75 6.750 27.884 15.073 1.00 43.90 C
+ATOM 549 O LYS A 75 7.796 27.257 14.814 1.00 42.38 O
+ATOM 550 CB LYS A 75 6.953 30.345 15.152 1.00 44.08 C
+ATOM 551 CG LYS A 75 8.476 30.366 15.329 1.00 43.84 C
+ATOM 552 CD LYS A 75 9.134 31.306 14.341 1.00 45.26 C
+ATOM 553 CE LYS A 75 8.430 31.404 13.012 1.00 45.01 C
+ATOM 554 NZ LYS A 75 8.563 30.151 12.230 1.00 45.66 N
+ATOM 555 N MET A 76 5.863 27.528 15.978 1.00 41.59 N
+ATOM 556 CA MET A 76 6.025 26.315 16.792 1.00 43.47 C
+ATOM 557 C MET A 76 6.191 25.107 15.871 1.00 41.68 C
+ATOM 558 O MET A 76 7.226 24.429 15.914 1.00 39.26 O
+ATOM 559 CB MET A 76 4.879 26.099 17.758 1.00 47.60 C
+ATOM 560 CG MET A 76 4.724 27.205 18.766 1.00 53.04 C
+ATOM 561 SD MET A 76 6.184 27.197 19.856 1.00 61.27 S
+ATOM 562 CE MET A 76 7.402 27.992 18.793 1.00 56.84 C
+ATOM 563 N LYS A 77 5.159 24.876 15.092 1.00 41.72 N
+ATOM 564 CA LYS A 77 5.102 23.767 14.134 1.00 44.13 C
+ATOM 565 C LYS A 77 6.445 23.576 13.420 1.00 44.14 C
+ATOM 566 O LYS A 77 6.942 22.450 13.256 1.00 45.25 O
+ATOM 567 CB LYS A 77 4.065 24.007 13.039 1.00 44.78 C
+ATOM 568 CG LYS A 77 2.658 24.359 13.492 1.00 49.08 C
+ATOM 569 CD LYS A 77 1.753 23.142 13.589 1.00 51.18 C
+ATOM 570 CE LYS A 77 0.916 22.930 12.345 1.00 54.27 C
+ATOM 571 NZ LYS A 77 -0.376 23.664 12.432 1.00 51.55 N
+ATOM 572 N ASP A 78 6.979 24.702 12.979 1.00 43.17 N
+ATOM 573 CA ASP A 78 8.249 24.759 12.235 1.00 42.10 C
+ATOM 574 C ASP A 78 9.459 24.411 13.091 1.00 41.13 C
+ATOM 575 O ASP A 78 10.384 23.757 12.574 1.00 43.13 O
+ATOM 576 CB ASP A 78 8.381 26.100 11.513 1.00 43.55 C
+ATOM 577 CG ASP A 78 7.501 26.198 10.284 1.00 42.36 C
+ATOM 578 OD1 ASP A 78 6.559 25.388 10.202 1.00 45.72 O
+ATOM 579 OD2 ASP A 78 7.744 27.050 9.425 1.00 45.57 O
+ATOM 580 N THR A 79 9.451 24.827 14.333 1.00 40.84 N
+ATOM 581 CA THR A 79 10.551 24.555 15.264 1.00 42.20 C
+ATOM 582 C THR A 79 10.605 23.052 15.565 1.00 43.34 C
+ATOM 583 O THR A 79 11.682 22.523 15.889 1.00 43.23 O
+ATOM 584 CB THR A 79 10.488 25.406 16.588 1.00 41.54 C
+ATOM 585 OG1 THR A 79 11.129 26.689 16.292 1.00 40.60 O
+ATOM 586 CG2 THR A 79 11.140 24.746 17.813 1.00 42.06 C
+ATOM 587 N ASP A 80 9.449 22.426 15.456 1.00 44.63 N
+ATOM 588 CA ASP A 80 9.281 20.990 15.705 1.00 46.06 C
+ATOM 589 C ASP A 80 9.852 20.206 14.522 1.00 45.97 C
+ATOM 590 O ASP A 80 10.441 19.123 14.702 1.00 45.31 O
+ATOM 591 CB ASP A 80 7.836 20.648 16.046 1.00 51.03 C
+ATOM 592 CG ASP A 80 7.400 21.131 17.415 1.00 53.74 C
+ATOM 593 OD1 ASP A 80 8.299 21.330 18.263 1.00 55.69 O
+ATOM 594 OD2 ASP A 80 6.204 21.324 17.681 1.00 56.11 O
+ATOM 595 N SER A 81 9.672 20.772 13.345 1.00 46.51 N
+ATOM 596 CA SER A 81 10.167 20.164 12.093 1.00 44.61 C
+ATOM 597 C SER A 81 11.690 20.064 12.138 1.00 44.58 C
+ATOM 598 O SER A 81 12.315 18.996 12.081 1.00 45.14 O
+ATOM 599 CB SER A 81 9.682 20.961 10.904 1.00 44.23 C
+ATOM 600 OG SER A 81 8.306 20.685 10.685 1.00 48.47 O
+ATOM 601 N GLU A 82 12.293 21.219 12.268 1.00 42.93 N
+ATOM 602 CA GLU A 82 13.731 21.407 12.350 1.00 42.96 C
+ATOM 603 C GLU A 82 14.450 20.484 13.323 1.00 43.40 C
+ATOM 604 O GLU A 82 15.501 19.921 12.987 1.00 40.45 O
+ATOM 605 CB GLU A 82 14.044 22.841 12.820 1.00 45.45 C
+ATOM 606 CG GLU A 82 15.500 23.272 12.696 1.00 48.19 C
+ATOM 607 CD GLU A 82 16.077 23.101 11.314 1.00 51.96 C
+ATOM 608 OE1 GLU A 82 15.188 22.973 10.441 1.00 53.84 O
+ATOM 609 OE2 GLU A 82 17.277 23.077 11.083 1.00 50.68 O
+ATOM 610 N GLU A 83 13.923 20.361 14.530 1.00 43.29 N
+ATOM 611 CA GLU A 83 14.526 19.525 15.575 1.00 43.44 C
+ATOM 612 C GLU A 83 14.374 18.042 15.279 1.00 41.00 C
+ATOM 613 O GLU A 83 15.187 17.245 15.787 1.00 38.42 O
+ATOM 614 CB GLU A 83 14.068 19.888 16.984 1.00 49.03 C
+ATOM 615 CG GLU A 83 14.818 21.059 17.624 1.00 56.26 C
+ATOM 616 CD GLU A 83 14.374 21.638 18.930 1.00 58.86 C
+ATOM 617 OE1 GLU A 83 13.217 21.836 19.266 1.00 60.26 O
+ATOM 618 OE2 GLU A 83 15.334 21.923 19.692 1.00 61.29 O
+ATOM 619 N GLU A 84 13.392 17.685 14.468 1.00 39.10 N
+ATOM 620 CA GLU A 84 13.190 16.277 14.094 1.00 41.57 C
+ATOM 621 C GLU A 84 14.283 15.889 13.091 1.00 41.27 C
+ATOM 622 O GLU A 84 14.923 14.825 13.233 1.00 42.46 O
+ATOM 623 CB GLU A 84 11.840 15.978 13.475 1.00 47.51 C
+ATOM 624 CG GLU A 84 10.590 16.031 14.346 1.00 52.07 C
+ATOM 625 CD GLU A 84 9.307 15.645 13.661 1.00 54.53 C
+ATOM 626 OE1 GLU A 84 9.369 14.471 13.233 1.00 57.32 O
+ATOM 627 OE2 GLU A 84 8.327 16.361 13.527 1.00 56.57 O
+ATOM 628 N ILE A 85 14.491 16.744 12.106 1.00 38.06 N
+ATOM 629 CA ILE A 85 15.497 16.557 11.055 1.00 32.72 C
+ATOM 630 C ILE A 85 16.899 16.637 11.663 1.00 29.37 C
+ATOM 631 O ILE A 85 17.793 15.879 11.262 1.00 31.84 O
+ATOM 632 CB ILE A 85 15.314 17.542 9.858 1.00 32.26 C
+ATOM 633 CG1 ILE A 85 13.910 17.425 9.234 1.00 32.00 C
+ATOM 634 CG2 ILE A 85 16.408 17.315 8.771 1.00 35.02 C
+ATOM 635 CD1 ILE A 85 13.697 18.369 8.009 1.00 36.33 C
+ATOM 636 N ARG A 86 17.105 17.527 12.606 1.00 28.13 N
+ATOM 637 CA ARG A 86 18.384 17.699 13.290 1.00 30.21 C
+ATOM 638 C ARG A 86 18.680 16.426 14.114 1.00 30.09 C
+ATOM 639 O ARG A 86 19.840 16.031 14.274 1.00 26.39 O
+ATOM 640 CB ARG A 86 18.434 18.906 14.221 1.00 36.19 C
+ATOM 641 CG ARG A 86 18.927 20.195 13.579 1.00 39.33 C
+ATOM 642 CD ARG A 86 19.075 21.296 14.572 1.00 44.30 C
+ATOM 643 NE ARG A 86 19.944 22.365 14.102 1.00 46.88 N
+ATOM 644 CZ ARG A 86 19.585 23.389 13.320 1.00 48.12 C
+ATOM 645 NH1 ARG A 86 18.343 23.540 12.880 1.00 45.08 N
+ATOM 646 NH2 ARG A 86 20.503 24.290 12.964 1.00 48.53 N
+ATOM 647 N GLU A 87 17.623 15.830 14.649 1.00 29.65 N
+ATOM 648 CA GLU A 87 17.769 14.618 15.451 1.00 28.95 C
+ATOM 649 C GLU A 87 18.315 13.488 14.565 1.00 26.09 C
+ATOM 650 O GLU A 87 19.297 12.840 14.901 1.00 24.72 O
+ATOM 651 CB GLU A 87 16.463 14.048 15.996 1.00 29.47 C
+ATOM 652 CG GLU A 87 15.920 14.676 17.273 1.00 39.81 C
+ATOM 653 CD GLU A 87 14.802 13.948 17.960 1.00 41.83 C
+ATOM 654 OE1 GLU A 87 14.324 12.991 17.317 1.00 43.69 O
+ATOM 655 OE2 GLU A 87 14.425 14.297 19.067 1.00 47.72 O
+ATOM 656 N ALA A 88 17.598 13.309 13.472 1.00 27.38 N
+ATOM 657 CA ALA A 88 17.940 12.266 12.492 1.00 24.53 C
+ATOM 658 C ALA A 88 19.318 12.516 11.912 1.00 25.16 C
+ATOM 659 O ALA A 88 19.913 11.526 11.456 1.00 20.92 O
+ATOM 660 CB ALA A 88 16.859 12.106 11.439 1.00 20.76 C
+ATOM 661 N PHE A 89 19.794 13.749 11.912 1.00 21.15 N
+ATOM 662 CA PHE A 89 21.128 14.041 11.349 1.00 21.69 C
+ATOM 663 C PHE A 89 22.191 13.489 12.297 1.00 24.27 C
+ATOM 664 O PHE A 89 23.225 12.941 11.889 1.00 23.21 O
+ATOM 665 CB PHE A 89 21.349 15.533 11.063 1.00 21.68 C
+ATOM 666 CG PHE A 89 22.709 15.856 10.513 1.00 23.58 C
+ATOM 667 CD1 PHE A 89 22.911 15.781 9.129 1.00 24.43 C
+ATOM 668 CD2 PHE A 89 23.759 16.218 11.337 1.00 23.55 C
+ATOM 669 CE1 PHE A 89 24.151 16.046 8.569 1.00 26.05 C
+ATOM 670 CE2 PHE A 89 25.024 16.487 10.794 1.00 29.52 C
+ATOM 671 CZ PHE A 89 25.215 16.402 9.403 1.00 26.27 C
+ATOM 672 N ARG A 90 21.908 13.650 13.592 1.00 22.01 N
+ATOM 673 CA ARG A 90 22.797 13.183 14.654 1.00 19.74 C
+ATOM 674 C ARG A 90 22.953 11.657 14.629 1.00 15.48 C
+ATOM 675 O ARG A 90 24.067 11.230 14.936 1.00 20.49 O
+ATOM 676 CB ARG A 90 22.284 13.650 16.013 1.00 27.21 C
+ATOM 677 CG ARG A 90 23.343 14.214 16.952 1.00 35.75 C
+ATOM 678 CD ARG A 90 22.694 14.981 18.062 1.00 39.34 C
+ATOM 679 NE ARG A 90 22.299 16.316 17.708 1.00 39.30 N
+ATOM 680 CZ ARG A 90 21.139 16.924 17.937 1.00 38.98 C
+ATOM 681 NH1 ARG A 90 20.078 16.358 18.500 1.00 34.23 N
+ATOM 682 NH2 ARG A 90 21.088 18.220 17.606 1.00 36.60 N
+ATOM 683 N VAL A 91 21.888 10.986 14.293 1.00 20.93 N
+ATOM 684 CA VAL A 91 21.923 9.511 14.231 1.00 23.12 C
+ATOM 685 C VAL A 91 22.783 9.031 13.059 1.00 25.01 C
+ATOM 686 O VAL A 91 23.493 8.007 13.248 1.00 19.16 O
+ATOM 687 CB VAL A 91 20.540 8.876 14.356 1.00 30.73 C
+ATOM 688 CG1 VAL A 91 19.483 9.494 13.467 1.00 36.19 C
+ATOM 689 CG2 VAL A 91 20.592 7.356 14.154 1.00 30.41 C
+ATOM 690 N PHE A 92 22.715 9.754 11.951 1.00 20.82 N
+ATOM 691 CA PHE A 92 23.519 9.409 10.767 1.00 20.32 C
+ATOM 692 C PHE A 92 24.985 9.744 10.991 1.00 17.27 C
+ATOM 693 O PHE A 92 25.888 8.980 10.593 1.00 21.58 O
+ATOM 694 CB PHE A 92 23.053 10.089 9.480 1.00 20.89 C
+ATOM 695 CG PHE A 92 21.903 9.475 8.753 1.00 23.31 C
+ATOM 696 CD1 PHE A 92 20.597 9.757 9.137 1.00 26.02 C
+ATOM 697 CD2 PHE A 92 22.129 8.603 7.683 1.00 29.61 C
+ATOM 698 CE1 PHE A 92 19.514 9.176 8.477 1.00 25.75 C
+ATOM 699 CE2 PHE A 92 21.071 8.029 6.996 1.00 30.44 C
+ATOM 700 CZ PHE A 92 19.766 8.321 7.394 1.00 29.21 C
+ATOM 701 N ASP A 93 25.219 10.909 11.563 1.00 16.35 N
+ATOM 702 CA ASP A 93 26.597 11.381 11.810 1.00 17.94 C
+ATOM 703 C ASP A 93 27.157 10.683 13.044 1.00 24.33 C
+ATOM 704 O ASP A 93 27.335 11.275 14.124 1.00 28.63 O
+ATOM 705 CB ASP A 93 26.607 12.911 11.857 1.00 22.19 C
+ATOM 706 CG ASP A 93 27.981 13.442 12.195 1.00 22.47 C
+ATOM 707 OD1 ASP A 93 28.910 12.650 11.917 1.00 28.58 O
+ATOM 708 OD2 ASP A 93 28.169 14.562 12.713 1.00 23.68 O
+ATOM 709 N LYS A 94 27.449 9.408 12.857 1.00 29.19 N
+ATOM 710 CA LYS A 94 27.969 8.523 13.903 1.00 30.21 C
+ATOM 711 C LYS A 94 29.149 9.088 14.654 1.00 32.04 C
+ATOM 712 O LYS A 94 29.280 8.745 15.859 1.00 34.49 O
+ATOM 713 CB LYS A 94 28.211 7.127 13.338 1.00 30.56 C
+ATOM 714 CG LYS A 94 28.552 6.027 14.323 1.00 37.50 C
+ATOM 715 CD LYS A 94 27.740 4.760 14.094 1.00 41.28 C
+ATOM 716 CE LYS A 94 28.384 3.546 14.749 1.00 42.61 C
+ATOM 717 NZ LYS A 94 28.653 3.789 16.190 1.00 44.18 N
+ATOM 718 N ASP A 95 30.002 9.917 14.069 1.00 31.76 N
+ATOM 719 CA ASP A 95 31.145 10.443 14.844 1.00 34.26 C
+ATOM 720 C ASP A 95 31.018 11.935 15.155 1.00 35.78 C
+ATOM 721 O ASP A 95 32.057 12.530 15.501 1.00 37.81 O
+ATOM 722 CB ASP A 95 32.481 10.168 14.179 1.00 32.88 C
+ATOM 723 CG ASP A 95 32.746 10.923 12.895 1.00 29.93 C
+ATOM 724 OD1 ASP A 95 31.951 11.793 12.509 1.00 30.52 O
+ATOM 725 OD2 ASP A 95 33.764 10.619 12.255 1.00 29.45 O
+ATOM 726 N GLY A 96 29.829 12.459 15.008 1.00 36.02 N
+ATOM 727 CA GLY A 96 29.543 13.869 15.254 1.00 37.43 C
+ATOM 728 C GLY A 96 30.671 14.806 14.841 1.00 38.02 C
+ATOM 729 O GLY A 96 31.108 15.640 15.650 1.00 40.57 O
+ATOM 730 N ASN A 97 31.125 14.678 13.612 1.00 37.14 N
+ATOM 731 CA ASN A 97 32.201 15.542 13.076 1.00 33.04 C
+ATOM 732 C ASN A 97 31.504 16.652 12.280 1.00 31.56 C
+ATOM 733 O ASN A 97 32.141 17.637 11.872 1.00 32.41 O
+ATOM 734 CB ASN A 97 33.301 14.765 12.382 1.00 35.73 C
+ATOM 735 CG ASN A 97 32.981 14.234 10.998 1.00 31.86 C
+ATOM 736 OD1 ASN A 97 31.841 13.851 10.695 1.00 33.10 O
+ATOM 737 ND2 ASN A 97 34.006 14.212 10.147 1.00 36.61 N
+ATOM 738 N GLY A 98 30.207 16.503 12.098 1.00 27.52 N
+ATOM 739 CA GLY A 98 29.345 17.442 11.389 1.00 26.51 C
+ATOM 740 C GLY A 98 29.068 17.043 9.945 1.00 24.98 C
+ATOM 741 O GLY A 98 28.473 17.800 9.159 1.00 26.16 O
+ATOM 742 N TYR A 99 29.481 15.839 9.575 1.00 25.86 N
+ATOM 743 CA TYR A 99 29.231 15.410 8.193 1.00 22.31 C
+ATOM 744 C TYR A 99 29.024 13.899 8.111 1.00 20.01 C
+ATOM 745 O TYR A 99 29.733 13.165 8.786 1.00 21.77 O
+ATOM 746 CB TYR A 99 30.397 15.735 7.272 1.00 31.25 C
+ATOM 747 CG TYR A 99 31.081 17.063 7.292 1.00 34.85 C
+ATOM 748 CD1 TYR A 99 32.158 17.321 8.149 1.00 35.91 C
+ATOM 749 CD2 TYR A 99 30.686 18.072 6.406 1.00 35.64 C
+ATOM 750 CE1 TYR A 99 32.811 18.554 8.139 1.00 36.59 C
+ATOM 751 CE2 TYR A 99 31.332 19.306 6.381 1.00 36.86 C
+ATOM 752 CZ TYR A 99 32.392 19.531 7.248 1.00 35.05 C
+ATOM 753 OH TYR A 99 33.005 20.751 7.193 1.00 38.23 O
+ATOM 754 N ILE A 100 28.104 13.572 7.240 1.00 19.00 N
+ATOM 755 CA ILE A 100 27.815 12.157 6.981 1.00 17.02 C
+ATOM 756 C ILE A 100 28.666 11.617 5.831 1.00 17.92 C
+ATOM 757 O ILE A 100 28.561 12.059 4.672 1.00 23.03 O
+ATOM 758 CB ILE A 100 26.313 12.020 6.680 1.00 11.61 C
+ATOM 759 CG1 ILE A 100 25.399 12.544 7.822 1.00 11.00 C
+ATOM 760 CG2 ILE A 100 25.891 10.572 6.349 1.00 12.51 C
+ATOM 761 CD1 ILE A 100 23.937 12.601 7.258 1.00 13.19 C
+ATOM 762 N SER A 101 29.499 10.655 6.145 1.00 20.33 N
+ATOM 763 CA SER A 101 30.367 9.981 5.172 1.00 19.64 C
+ATOM 764 C SER A 101 29.583 8.817 4.570 1.00 22.87 C
+ATOM 765 O SER A 101 28.454 8.425 4.933 1.00 18.75 O
+ATOM 766 CB SER A 101 31.656 9.511 5.824 1.00 20.95 C
+ATOM 767 OG SER A 101 31.360 8.533 6.827 1.00 14.46 O
+ATOM 768 N ALA A 102 30.237 8.242 3.562 1.00 17.36 N
+ATOM 769 CA ALA A 102 29.718 7.093 2.817 1.00 18.70 C
+ATOM 770 C ALA A 102 29.575 5.902 3.781 1.00 14.55 C
+ATOM 771 O ALA A 102 28.533 5.264 3.788 1.00 21.52 O
+ATOM 772 CB ALA A 102 30.695 6.745 1.690 1.00 18.13 C
+ATOM 773 N ALA A 103 30.647 5.685 4.527 1.00 16.08 N
+ATOM 774 CA ALA A 103 30.728 4.600 5.518 1.00 14.58 C
+ATOM 775 C ALA A 103 29.633 4.717 6.571 1.00 16.97 C
+ATOM 776 O ALA A 103 28.985 3.727 6.974 1.00 15.34 O
+ATOM 777 CB ALA A 103 32.114 4.598 6.147 1.00 13.81 C
+ATOM 778 N GLU A 104 29.373 5.939 6.996 1.00 11.60 N
+ATOM 779 CA GLU A 104 28.321 6.203 8.014 1.00 13.51 C
+ATOM 780 C GLU A 104 26.956 5.928 7.429 1.00 18.49 C
+ATOM 781 O GLU A 104 26.146 5.190 8.019 1.00 17.83 O
+ATOM 782 CB GLU A 104 28.448 7.624 8.527 1.00 15.44 C
+ATOM 783 CG GLU A 104 29.394 7.862 9.704 1.00 22.41 C
+ATOM 784 CD GLU A 104 29.639 9.306 10.008 1.00 23.25 C
+ATOM 785 OE1 GLU A 104 29.205 10.211 9.326 1.00 26.70 O
+ATOM 786 OE2 GLU A 104 30.346 9.430 11.028 1.00 20.68 O
+ATOM 787 N LEU A 105 26.686 6.473 6.247 1.00 15.75 N
+ATOM 788 CA LEU A 105 25.426 6.264 5.550 1.00 17.47 C
+ATOM 789 C LEU A 105 25.229 4.780 5.296 1.00 12.94 C
+ATOM 790 O LEU A 105 24.109 4.246 5.523 1.00 12.78 O
+ATOM 791 CB LEU A 105 25.396 7.210 4.306 1.00 11.48 C
+ATOM 792 CG LEU A 105 24.202 6.912 3.395 1.00 13.27 C
+ATOM 793 CD1 LEU A 105 22.904 7.265 4.102 1.00 20.40 C
+ATOM 794 CD2 LEU A 105 24.402 7.751 2.135 1.00 20.78 C
+ATOM 795 N ARG A 106 26.258 4.039 4.881 1.00 14.55 N
+ATOM 796 CA ARG A 106 26.136 2.598 4.602 1.00 13.48 C
+ATOM 797 C ARG A 106 25.799 1.745 5.826 1.00 12.65 C
+ATOM 798 O ARG A 106 25.024 0.770 5.739 1.00 17.09 O
+ATOM 799 CB ARG A 106 27.407 2.074 3.903 1.00 10.46 C
+ATOM 800 CG ARG A 106 27.201 0.668 3.323 1.00 15.55 C
+ATOM 801 CD ARG A 106 28.271 0.377 2.300 1.00 12.53 C
+ATOM 802 NE ARG A 106 29.532 0.117 2.867 1.00 21.07 N
+ATOM 803 CZ ARG A 106 30.717 0.423 3.288 1.00 31.60 C
+ATOM 804 NH1 ARG A 106 31.279 1.635 3.203 1.00 36.63 N
+ATOM 805 NH2 ARG A 106 31.420 -0.527 3.930 1.00 35.05 N
+ATOM 806 N HIS A 107 26.370 2.105 6.949 1.00 17.49 N
+ATOM 807 CA HIS A 107 26.112 1.398 8.231 1.00 18.44 C
+ATOM 808 C HIS A 107 24.680 1.661 8.659 1.00 20.32 C
+ATOM 809 O HIS A 107 23.923 0.708 8.898 1.00 17.09 O
+ATOM 810 CB HIS A 107 27.122 1.781 9.326 1.00 24.42 C
+ATOM 811 CG HIS A 107 26.949 0.984 10.590 1.00 30.66 C
+ATOM 812 ND1 HIS A 107 27.278 -0.348 10.724 1.00 33.01 N
+ATOM 813 CD2 HIS A 107 26.458 1.382 11.787 1.00 32.96 C
+ATOM 814 CE1 HIS A 107 26.994 -0.725 11.961 1.00 36.56 C
+ATOM 815 NE2 HIS A 107 26.511 0.301 12.626 1.00 35.22 N
+ATOM 816 N VAL A 108 24.174 2.897 8.699 1.00 17.89 N
+ATOM 817 CA VAL A 108 22.765 3.086 9.097 1.00 18.38 C
+ATOM 818 C VAL A 108 21.804 2.422 8.136 1.00 15.49 C
+ATOM 819 O VAL A 108 20.718 1.898 8.475 1.00 16.73 O
+ATOM 820 CB VAL A 108 22.442 4.569 9.388 1.00 20.05 C
+ATOM 821 CG1 VAL A 108 23.531 5.328 10.110 1.00 20.07 C
+ATOM 822 CG2 VAL A 108 22.010 5.321 8.151 1.00 24.53 C
+ATOM 823 N MET A 109 22.129 2.379 6.854 1.00 17.22 N
+ATOM 824 CA MET A 109 21.273 1.761 5.834 1.00 17.85 C
+ATOM 825 C MET A 109 21.113 0.266 6.093 1.00 10.47 C
+ATOM 826 O MET A 109 20.050 -0.359 5.886 1.00 14.11 O
+ATOM 827 CB MET A 109 21.909 2.144 4.505 1.00 22.24 C
+ATOM 828 CG MET A 109 20.979 2.621 3.457 1.00 29.60 C
+ATOM 829 SD MET A 109 19.894 3.984 4.029 1.00 32.18 S
+ATOM 830 CE MET A 109 18.527 3.674 2.904 1.00 33.27 C
+ATOM 831 N THR A 110 22.191 -0.363 6.558 1.00 17.98 N
+ATOM 832 CA THR A 110 22.121 -1.826 6.819 1.00 22.31 C
+ATOM 833 C THR A 110 21.151 -2.012 7.994 1.00 22.14 C
+ATOM 834 O THR A 110 20.346 -2.952 7.952 1.00 26.54 O
+ATOM 835 CB THR A 110 23.510 -2.540 6.922 1.00 21.86 C
+ATOM 836 OG1 THR A 110 23.953 -2.589 8.315 1.00 33.28 O
+ATOM 837 CG2 THR A 110 24.612 -1.981 6.033 1.00 19.63 C
+ATOM 838 N ASN A 111 21.248 -1.106 8.950 1.00 25.65 N
+ATOM 839 CA ASN A 111 20.368 -1.121 10.142 1.00 21.59 C
+ATOM 840 C ASN A 111 18.913 -0.904 9.751 1.00 25.07 C
+ATOM 841 O ASN A 111 18.005 -1.294 10.505 1.00 27.22 O
+ATOM 842 CB ASN A 111 20.877 -0.158 11.210 1.00 28.26 C
+ATOM 843 CG ASN A 111 22.088 -0.707 11.942 1.00 28.57 C
+ATOM 844 OD1 ASN A 111 22.764 0.053 12.638 1.00 34.57 O
+ATOM 845 ND2 ASN A 111 22.392 -1.990 11.802 1.00 28.88 N
+ATOM 846 N LEU A 112 18.684 -0.286 8.606 1.00 22.38 N
+ATOM 847 CA LEU A 112 17.353 -0.012 8.074 1.00 21.94 C
+ATOM 848 C LEU A 112 16.818 -1.139 7.223 1.00 20.89 C
+ATOM 849 O LEU A 112 15.662 -1.110 6.757 1.00 24.83 O
+ATOM 850 CB LEU A 112 17.409 1.361 7.367 1.00 28.40 C
+ATOM 851 CG LEU A 112 16.985 2.575 8.181 1.00 32.53 C
+ATOM 852 CD1 LEU A 112 17.316 2.403 9.662 1.00 33.72 C
+ATOM 853 CD2 LEU A 112 17.701 3.814 7.648 1.00 32.97 C
+ATOM 854 N GLY A 113 17.645 -2.143 6.991 1.00 13.38 N
+ATOM 855 CA GLY A 113 17.382 -3.345 6.242 1.00 13.85 C
+ATOM 856 C GLY A 113 17.808 -3.292 4.774 1.00 16.81 C
+ATOM 857 O GLY A 113 17.410 -4.213 4.074 1.00 15.55 O
+ATOM 858 N GLU A 114 18.545 -2.293 4.403 1.00 12.74 N
+ATOM 859 CA GLU A 114 19.055 -2.096 3.031 1.00 20.68 C
+ATOM 860 C GLU A 114 20.568 -2.255 3.002 1.00 16.21 C
+ATOM 861 O GLU A 114 21.318 -1.394 3.467 1.00 16.36 O
+ATOM 862 CB GLU A 114 18.749 -0.706 2.486 1.00 23.41 C
+ATOM 863 CG GLU A 114 17.321 -0.427 2.053 1.00 28.79 C
+ATOM 864 CD GLU A 114 16.762 -1.417 1.073 1.00 30.38 C
+ATOM 865 OE1 GLU A 114 17.447 -1.993 0.249 1.00 33.28 O
+ATOM 866 OE2 GLU A 114 15.536 -1.575 1.207 1.00 33.01 O
+ATOM 867 N LYS A 115 20.988 -3.354 2.402 1.00 17.64 N
+ATOM 868 CA LYS A 115 22.396 -3.713 2.225 1.00 16.35 C
+ATOM 869 C LYS A 115 22.814 -3.172 0.849 1.00 13.69 C
+ATOM 870 O LYS A 115 22.499 -3.789 -0.177 1.00 19.70 O
+ATOM 871 CB LYS A 115 22.588 -5.215 2.345 1.00 22.75 C
+ATOM 872 CG LYS A 115 22.512 -5.680 3.791 1.00 22.22 C
+ATOM 873 CD LYS A 115 22.410 -7.205 3.920 1.00 30.21 C
+ATOM 874 CE LYS A 115 23.004 -7.667 5.244 1.00 32.56 C
+ATOM 875 NZ LYS A 115 24.265 -6.921 5.490 1.00 34.87 N
+ATOM 876 N LEU A 116 23.479 -2.055 0.898 1.00 12.64 N
+ATOM 877 CA LEU A 116 23.950 -1.332 -0.301 1.00 11.47 C
+ATOM 878 C LEU A 116 25.439 -1.555 -0.505 1.00 8.92 C
+ATOM 879 O LEU A 116 26.210 -1.765 0.455 1.00 9.78 O
+ATOM 880 CB LEU A 116 23.631 0.143 0.022 1.00 18.42 C
+ATOM 881 CG LEU A 116 22.364 0.815 -0.443 1.00 22.89 C
+ATOM 882 CD1 LEU A 116 21.265 -0.159 -0.806 1.00 19.53 C
+ATOM 883 CD2 LEU A 116 21.929 1.798 0.645 1.00 24.21 C
+ATOM 884 N THR A 117 25.857 -1.493 -1.765 1.00 11.57 N
+ATOM 885 CA THR A 117 27.296 -1.646 -2.068 1.00 10.45 C
+ATOM 886 C THR A 117 27.863 -0.246 -1.906 1.00 12.44 C
+ATOM 887 O THR A 117 27.065 0.709 -1.760 1.00 15.68 O
+ATOM 888 CB THR A 117 27.507 -2.160 -3.544 1.00 6.20 C
+ATOM 889 OG1 THR A 117 27.009 -1.130 -4.423 1.00 14.05 O
+ATOM 890 CG2 THR A 117 26.816 -3.486 -3.858 1.00 9.07 C
+ATOM 891 N ASP A 118 29.174 -0.150 -1.906 1.00 10.98 N
+ATOM 892 CA ASP A 118 29.839 1.168 -1.812 1.00 10.40 C
+ATOM 893 C ASP A 118 29.437 2.041 -3.014 1.00 13.14 C
+ATOM 894 O ASP A 118 29.249 3.263 -2.842 1.00 16.62 O
+ATOM 895 CB ASP A 118 31.348 1.000 -1.697 1.00 16.46 C
+ATOM 896 CG ASP A 118 32.107 2.291 -1.516 0.50 13.30 C
+ATOM 897 OD1 ASP A 118 31.940 2.877 -0.421 0.50 16.97 O
+ATOM 898 OD2 ASP A 118 32.863 2.737 -2.402 0.50 16.23 O
+ATOM 899 N GLU A 119 29.352 1.460 -4.189 1.00 14.88 N
+ATOM 900 CA GLU A 119 28.982 2.220 -5.391 1.00 15.46 C
+ATOM 901 C GLU A 119 27.573 2.800 -5.229 1.00 15.37 C
+ATOM 902 O GLU A 119 27.378 3.966 -5.625 1.00 12.27 O
+ATOM 903 CB GLU A 119 29.080 1.382 -6.653 1.00 21.90 C
+ATOM 904 CG GLU A 119 28.234 1.799 -7.850 1.00 31.31 C
+ATOM 905 CD GLU A 119 28.533 1.058 -9.119 1.00 35.39 C
+ATOM 906 OE1 GLU A 119 29.696 1.312 -9.507 1.00 37.83 O
+ATOM 907 OE2 GLU A 119 27.759 0.316 -9.692 1.00 42.50 O
+ATOM 908 N GLU A 120 26.664 2.022 -4.691 1.00 12.34 N
+ATOM 909 CA GLU A 120 25.278 2.502 -4.482 1.00 13.81 C
+ATOM 910 C GLU A 120 25.279 3.634 -3.464 1.00 17.51 C
+ATOM 911 O GLU A 120 24.531 4.617 -3.684 1.00 20.47 O
+ATOM 912 CB GLU A 120 24.275 1.438 -4.102 1.00 11.80 C
+ATOM 913 CG GLU A 120 24.131 0.193 -4.933 1.00 19.49 C
+ATOM 914 CD GLU A 120 23.297 -0.974 -4.607 1.00 19.71 C
+ATOM 915 OE1 GLU A 120 23.591 -1.576 -3.547 1.00 23.54 O
+ATOM 916 OE2 GLU A 120 22.385 -1.363 -5.331 1.00 26.94 O
+ATOM 917 N VAL A 121 26.048 3.563 -2.404 1.00 14.00 N
+ATOM 918 CA VAL A 121 26.113 4.619 -1.379 1.00 20.56 C
+ATOM 919 C VAL A 121 26.760 5.882 -1.951 1.00 18.88 C
+ATOM 920 O VAL A 121 26.317 7.023 -1.682 1.00 15.07 O
+ATOM 921 CB VAL A 121 26.812 4.159 -0.092 1.00 20.95 C
+ATOM 922 CG1 VAL A 121 27.103 5.328 0.854 1.00 21.82 C
+ATOM 923 CG2 VAL A 121 26.052 3.073 0.657 1.00 27.91 C
+ATOM 924 N ASP A 122 27.794 5.712 -2.748 1.00 16.45 N
+ATOM 925 CA ASP A 122 28.518 6.833 -3.372 1.00 18.15 C
+ATOM 926 C ASP A 122 27.550 7.623 -4.263 1.00 17.09 C
+ATOM 927 O ASP A 122 27.649 8.855 -4.258 1.00 18.60 O
+ATOM 928 CB ASP A 122 29.775 6.375 -4.104 1.00 20.93 C
+ATOM 929 CG ASP A 122 30.974 6.132 -3.223 1.00 26.20 C
+ATOM 930 OD1 ASP A 122 31.122 6.680 -2.118 1.00 30.64 O
+ATOM 931 OD2 ASP A 122 31.830 5.341 -3.686 1.00 32.60 O
+ATOM 932 N GLU A 123 26.676 6.947 -4.958 1.00 17.41 N
+ATOM 933 CA GLU A 123 25.689 7.582 -5.856 1.00 17.64 C
+ATOM 934 C GLU A 123 24.688 8.388 -5.035 1.00 17.66 C
+ATOM 935 O GLU A 123 24.236 9.460 -5.458 1.00 15.21 O
+ATOM 936 CB GLU A 123 24.930 6.530 -6.620 1.00 24.75 C
+ATOM 937 CG GLU A 123 24.268 6.843 -7.949 1.00 31.70 C
+ATOM 938 CD GLU A 123 23.512 5.685 -8.539 1.00 36.02 C
+ATOM 939 OE1 GLU A 123 24.068 4.589 -8.248 1.00 41.52 O
+ATOM 940 OE2 GLU A 123 22.490 5.801 -9.201 1.00 37.82 O
+ATOM 941 N MET A 124 24.335 7.867 -3.883 1.00 18.88 N
+ATOM 942 CA MET A 124 23.383 8.529 -2.972 1.00 19.52 C
+ATOM 943 C MET A 124 24.019 9.826 -2.459 1.00 18.78 C
+ATOM 944 O MET A 124 23.299 10.839 -2.377 1.00 21.59 O
+ATOM 945 CB MET A 124 22.938 7.658 -1.804 1.00 22.22 C
+ATOM 946 CG MET A 124 22.070 6.484 -2.155 1.00 27.24 C
+ATOM 947 SD MET A 124 21.539 5.654 -0.595 1.00 33.21 S
+ATOM 948 CE MET A 124 21.621 7.041 0.533 1.00 28.08 C
+ATOM 949 N ILE A 125 25.282 9.782 -2.101 1.00 15.76 N
+ATOM 950 CA ILE A 125 26.016 10.923 -1.558 1.00 18.72 C
+ATOM 951 C ILE A 125 26.114 12.003 -2.648 1.00 22.84 C
+ATOM 952 O ILE A 125 25.806 13.161 -2.399 1.00 24.22 O
+ATOM 953 CB ILE A 125 27.428 10.567 -1.003 1.00 21.27 C
+ATOM 954 CG1 ILE A 125 27.331 9.576 0.187 1.00 19.99 C
+ATOM 955 CG2 ILE A 125 28.300 11.783 -0.560 1.00 14.28 C
+ATOM 956 CD1 ILE A 125 26.725 10.085 1.496 1.00 23.70 C
+ATOM 957 N ARG A 126 26.563 11.550 -3.808 1.00 24.18 N
+ATOM 958 CA ARG A 126 26.755 12.441 -4.958 1.00 24.45 C
+ATOM 959 C ARG A 126 25.526 13.269 -5.256 1.00 25.57 C
+ATOM 960 O ARG A 126 25.674 14.473 -5.500 1.00 25.35 O
+ATOM 961 CB ARG A 126 27.177 11.672 -6.225 1.00 21.84 C
+ATOM 962 CG ARG A 126 28.661 11.326 -6.167 1.00 24.22 C
+ATOM 963 CD ARG A 126 29.237 11.012 -7.504 1.00 28.33 C
+ATOM 964 NE ARG A 126 28.865 9.668 -7.957 1.00 32.06 N
+ATOM 965 CZ ARG A 126 27.901 9.520 -8.860 1.00 31.98 C
+ATOM 966 NH1 ARG A 126 27.295 10.614 -9.306 1.00 37.36 N
+ATOM 967 NH2 ARG A 126 27.577 8.328 -9.338 1.00 29.43 N
+ATOM 968 N GLU A 127 24.390 12.629 -5.224 1.00 24.18 N
+ATOM 969 CA GLU A 127 23.122 13.312 -5.518 1.00 26.34 C
+ATOM 970 C GLU A 127 22.833 14.487 -4.602 1.00 27.12 C
+ATOM 971 O GLU A 127 22.190 15.478 -5.013 1.00 26.79 O
+ATOM 972 CB GLU A 127 22.013 12.274 -5.386 1.00 29.28 C
+ATOM 973 CG GLU A 127 20.822 12.359 -6.327 1.00 39.60 C
+ATOM 974 CD GLU A 127 20.027 11.088 -6.386 1.00 42.87 C
+ATOM 975 OE1 GLU A 127 20.744 10.133 -6.727 1.00 46.47 O
+ATOM 976 OE2 GLU A 127 18.846 11.002 -6.125 1.00 49.38 O
+ATOM 977 N ALA A 128 23.292 14.421 -3.362 1.00 24.46 N
+ATOM 978 CA ALA A 128 23.050 15.486 -2.379 1.00 23.77 C
+ATOM 979 C ALA A 128 24.225 16.373 -2.083 1.00 23.91 C
+ATOM 980 O ALA A 128 24.025 17.409 -1.411 1.00 29.10 O
+ATOM 981 CB ALA A 128 22.580 14.790 -1.093 1.00 25.84 C
+ATOM 982 N ASP A 129 25.404 16.021 -2.541 1.00 25.22 N
+ATOM 983 CA ASP A 129 26.669 16.705 -2.327 1.00 26.68 C
+ATOM 984 C ASP A 129 26.828 17.969 -3.176 1.00 29.48 C
+ATOM 985 O ASP A 129 27.341 17.834 -4.298 1.00 28.32 O
+ATOM 986 CB ASP A 129 27.812 15.714 -2.601 1.00 25.33 C
+ATOM 987 CG ASP A 129 29.132 16.286 -2.148 1.00 26.32 C
+ATOM 988 OD1 ASP A 129 29.127 17.280 -1.406 1.00 28.49 O
+ATOM 989 OD2 ASP A 129 30.167 15.723 -2.566 1.00 28.27 O
+ATOM 990 N ILE A 130 26.440 19.103 -2.626 1.00 32.93 N
+ATOM 991 CA ILE A 130 26.497 20.404 -3.305 1.00 32.17 C
+ATOM 992 C ILE A 130 27.853 21.092 -3.333 1.00 34.02 C
+ATOM 993 O ILE A 130 28.127 21.801 -4.316 1.00 34.80 O
+ATOM 994 CB ILE A 130 25.450 21.406 -2.695 1.00 31.49 C
+ATOM 995 CG1 ILE A 130 24.014 20.836 -2.738 1.00 28.74 C
+ATOM 996 CG2 ILE A 130 25.497 22.795 -3.397 1.00 28.12 C
+ATOM 997 CD1 ILE A 130 23.101 21.543 -1.695 1.00 30.45 C
+ATOM 998 N ASP A 131 28.645 20.910 -2.302 1.00 35.99 N
+ATOM 999 CA ASP A 131 29.977 21.525 -2.190 1.00 36.40 C
+ATOM 1000 C ASP A 131 31.067 20.539 -2.618 1.00 37.81 C
+ATOM 1001 O ASP A 131 32.271 20.784 -2.429 1.00 39.78 O
+ATOM 1002 CB ASP A 131 30.180 22.103 -0.789 1.00 35.20 C
+ATOM 1003 CG ASP A 131 30.282 21.040 0.281 1.00 37.29 C
+ATOM 1004 OD1 ASP A 131 30.424 19.858 -0.114 1.00 35.06 O
+ATOM 1005 OD2 ASP A 131 30.250 21.330 1.488 1.00 39.90 O
+ATOM 1006 N GLY A 132 30.638 19.438 -3.191 1.00 37.47 N
+ATOM 1007 CA GLY A 132 31.471 18.349 -3.693 1.00 34.52 C
+ATOM 1008 C GLY A 132 32.682 18.039 -2.837 1.00 35.62 C
+ATOM 1009 O GLY A 132 33.821 18.092 -3.345 1.00 39.10 O
+ATOM 1010 N ASP A 133 32.462 17.709 -1.575 1.00 34.75 N
+ATOM 1011 CA ASP A 133 33.548 17.362 -0.645 1.00 28.46 C
+ATOM 1012 C ASP A 133 33.453 15.859 -0.353 1.00 28.01 C
+ATOM 1013 O ASP A 133 34.275 15.315 0.376 1.00 26.53 O
+ATOM 1014 CB ASP A 133 33.597 18.222 0.605 1.00 31.74 C
+ATOM 1015 CG ASP A 133 32.466 17.941 1.590 1.00 32.07 C
+ATOM 1016 OD1 ASP A 133 31.410 17.478 1.113 1.00 32.00 O
+ATOM 1017 OD2 ASP A 133 32.636 18.199 2.795 1.00 31.53 O
+ATOM 1018 N GLY A 134 32.473 15.226 -0.951 1.00 27.96 N
+ATOM 1019 CA GLY A 134 32.203 13.799 -0.846 1.00 29.38 C
+ATOM 1020 C GLY A 134 31.418 13.385 0.396 1.00 29.34 C
+ATOM 1021 O GLY A 134 31.260 12.176 0.617 1.00 31.75 O
+ATOM 1022 N GLN A 135 30.955 14.351 1.155 1.00 29.92 N
+ATOM 1023 CA GLN A 135 30.185 14.092 2.384 1.00 28.61 C
+ATOM 1024 C GLN A 135 28.912 14.918 2.382 1.00 26.53 C
+ATOM 1025 O GLN A 135 28.816 15.812 1.536 1.00 25.59 O
+ATOM 1026 CB GLN A 135 30.980 14.519 3.624 1.00 29.34 C
+ATOM 1027 CG GLN A 135 32.233 13.695 3.786 1.00 35.92 C
+ATOM 1028 CD GLN A 135 33.166 14.341 4.781 1.00 40.73 C
+ATOM 1029 OE1 GLN A 135 33.369 15.549 4.744 1.00 43.44 O
+ATOM 1030 NE2 GLN A 135 33.703 13.493 5.652 1.00 38.16 N
+ATOM 1031 N VAL A 136 27.995 14.620 3.290 1.00 27.00 N
+ATOM 1032 CA VAL A 136 26.768 15.445 3.308 1.00 26.02 C
+ATOM 1033 C VAL A 136 26.772 16.226 4.622 1.00 27.90 C
+ATOM 1034 O VAL A 136 26.897 15.634 5.704 1.00 25.44 O
+ATOM 1035 CB VAL A 136 25.479 14.693 2.989 1.00 27.97 C
+ATOM 1036 CG1 VAL A 136 25.705 13.495 2.076 1.00 30.03 C
+ATOM 1037 CG2 VAL A 136 24.669 14.349 4.216 1.00 32.46 C
+ATOM 1038 N ASN A 137 26.663 17.529 4.443 1.00 25.75 N
+ATOM 1039 CA ASN A 137 26.632 18.420 5.637 1.00 26.18 C
+ATOM 1040 C ASN A 137 25.155 18.560 5.973 1.00 22.55 C
+ATOM 1041 O ASN A 137 24.331 18.016 5.227 1.00 19.93 O
+ATOM 1042 CB ASN A 137 27.409 19.699 5.411 1.00 28.53 C
+ATOM 1043 CG ASN A 137 26.779 20.659 4.433 1.00 26.88 C
+ATOM 1044 OD1 ASN A 137 27.400 21.702 4.129 1.00 35.85 O
+ATOM 1045 ND2 ASN A 137 25.584 20.378 3.952 1.00 26.83 N
+ATOM 1046 N TYR A 138 24.850 19.270 7.048 1.00 24.78 N
+ATOM 1047 CA TYR A 138 23.454 19.448 7.469 1.00 23.50 C
+ATOM 1048 C TYR A 138 22.606 20.150 6.436 1.00 20.23 C
+ATOM 1049 O TYR A 138 21.456 19.754 6.155 1.00 20.32 O
+ATOM 1050 CB TYR A 138 23.390 20.117 8.873 1.00 28.35 C
+ATOM 1051 CG TYR A 138 21.944 20.343 9.283 1.00 27.38 C
+ATOM 1052 CD1 TYR A 138 21.108 19.250 9.542 1.00 26.39 C
+ATOM 1053 CD2 TYR A 138 21.414 21.628 9.398 1.00 27.44 C
+ATOM 1054 CE1 TYR A 138 19.776 19.426 9.906 1.00 31.51 C
+ATOM 1055 CE2 TYR A 138 20.077 21.809 9.751 1.00 28.63 C
+ATOM 1056 CZ TYR A 138 19.268 20.721 10.010 1.00 28.67 C
+ATOM 1057 OH TYR A 138 17.971 20.946 10.369 1.00 32.79 O
+ATOM 1058 N GLU A 139 23.178 21.224 5.879 1.00 22.97 N
+ATOM 1059 CA GLU A 139 22.463 21.984 4.853 1.00 24.26 C
+ATOM 1060 C GLU A 139 22.033 21.063 3.718 1.00 22.58 C
+ATOM 1061 O GLU A 139 20.863 21.061 3.315 1.00 22.14 O
+ATOM 1062 CB GLU A 139 23.281 23.145 4.276 1.00 27.79 C
+ATOM 1063 CG GLU A 139 22.625 23.737 3.029 1.00 35.74 C
+ATOM 1064 CD GLU A 139 23.085 25.080 2.549 1.00 38.18 C
+ATOM 1065 OE1 GLU A 139 24.243 25.347 2.914 1.00 38.14 O
+ATOM 1066 OE2 GLU A 139 22.347 25.771 1.862 1.00 38.80 O
+ATOM 1067 N GLU A 140 22.977 20.280 3.211 1.00 24.44 N
+ATOM 1068 CA GLU A 140 22.708 19.329 2.111 1.00 21.16 C
+ATOM 1069 C GLU A 140 21.702 18.264 2.524 1.00 22.90 C
+ATOM 1070 O GLU A 140 20.886 17.783 1.722 1.00 21.73 O
+ATOM 1071 CB GLU A 140 24.006 18.672 1.650 1.00 25.54 C
+ATOM 1072 CG GLU A 140 25.053 19.500 0.918 1.00 27.23 C
+ATOM 1073 CD GLU A 140 26.457 19.013 0.996 1.00 27.89 C
+ATOM 1074 OE1 GLU A 140 26.825 18.170 1.799 1.00 26.44 O
+ATOM 1075 OE2 GLU A 140 27.259 19.519 0.179 1.00 24.17 O
+ATOM 1076 N PHE A 141 21.754 17.901 3.800 1.00 24.94 N
+ATOM 1077 CA PHE A 141 20.845 16.890 4.380 1.00 23.65 C
+ATOM 1078 C PHE A 141 19.413 17.413 4.405 1.00 25.48 C
+ATOM 1079 O PHE A 141 18.481 16.674 4.057 1.00 26.26 O
+ATOM 1080 CB PHE A 141 21.309 16.408 5.752 1.00 25.31 C
+ATOM 1081 CG PHE A 141 20.487 15.368 6.444 1.00 24.55 C
+ATOM 1082 CD1 PHE A 141 20.674 14.013 6.172 1.00 26.37 C
+ATOM 1083 CD2 PHE A 141 19.532 15.738 7.399 1.00 27.96 C
+ATOM 1084 CE1 PHE A 141 19.910 13.040 6.824 1.00 25.57 C
+ATOM 1085 CE2 PHE A 141 18.776 14.786 8.061 1.00 27.08 C
+ATOM 1086 CZ PHE A 141 18.944 13.427 7.770 1.00 27.38 C
+ATOM 1087 N VAL A 142 19.253 18.663 4.828 1.00 27.54 N
+ATOM 1088 CA VAL A 142 17.874 19.223 4.871 1.00 32.91 C
+ATOM 1089 C VAL A 142 17.330 19.322 3.447 1.00 33.99 C
+ATOM 1090 O VAL A 142 16.149 19.034 3.166 1.00 32.31 O
+ATOM 1091 CB VAL A 142 17.844 20.506 5.707 1.00 35.90 C
+ATOM 1092 CG1 VAL A 142 18.725 20.418 6.951 1.00 37.48 C
+ATOM 1093 CG2 VAL A 142 18.157 21.770 4.928 1.00 37.47 C
+ATOM 1094 N GLN A 143 18.207 19.695 2.529 1.00 39.08 N
+ATOM 1095 CA GLN A 143 17.788 19.809 1.115 1.00 44.99 C
+ATOM 1096 C GLN A 143 17.223 18.466 0.642 1.00 46.83 C
+ATOM 1097 O GLN A 143 16.179 18.449 -0.027 1.00 47.28 O
+ATOM 1098 CB GLN A 143 18.886 20.301 0.179 1.00 48.44 C
+ATOM 1099 CG GLN A 143 19.513 21.602 0.640 1.00 53.90 C
+ATOM 1100 CD GLN A 143 19.498 22.650 -0.448 1.00 56.61 C
+ATOM 1101 OE1 GLN A 143 18.632 22.666 -1.319 1.00 58.44 O
+ATOM 1102 NE2 GLN A 143 20.479 23.551 -0.371 1.00 60.07 N
+ATOM 1103 N MET A 144 17.914 17.395 0.988 1.00 48.93 N
+ATOM 1104 CA MET A 144 17.507 16.036 0.595 1.00 51.20 C
+ATOM 1105 C MET A 144 16.268 15.586 1.366 1.00 52.52 C
+ATOM 1106 O MET A 144 15.403 14.875 0.826 1.00 51.30 O
+ATOM 1107 CB MET A 144 18.697 15.101 0.717 1.00 52.48 C
+ATOM 1108 CG MET A 144 18.692 13.996 -0.294 1.00 56.97 C
+ATOM 1109 SD MET A 144 18.478 14.621 -1.996 1.00 60.64 S
+ATOM 1110 CE MET A 144 19.621 16.005 -2.023 1.00 58.95 C
+ATOM 1111 N MET A 145 16.188 16.019 2.608 1.00 53.95 N
+ATOM 1112 CA MET A 145 15.081 15.705 3.519 1.00 56.65 C
+ATOM 1113 C MET A 145 13.765 16.338 3.076 1.00 59.15 C
+ATOM 1114 O MET A 145 12.816 15.644 2.680 1.00 60.32 O
+ATOM 1115 CB MET A 145 15.452 16.115 4.943 1.00 55.72 C
+ATOM 1116 CG MET A 145 15.940 14.930 5.739 1.00 57.44 C
+ATOM 1117 SD MET A 145 15.881 13.459 4.657 1.00 58.23 S
+ATOM 1118 CE MET A 145 17.490 12.736 4.995 1.00 58.02 C
+ATOM 1119 N THR A 146 13.727 17.651 3.166 1.00 62.18 N
+ATOM 1120 CA THR A 146 12.558 18.451 2.797 1.00 65.34 C
+ATOM 1121 C THR A 146 12.199 18.268 1.329 1.00 67.12 C
+ATOM 1122 O THR A 146 11.073 17.854 1.003 1.00 68.37 O
+ATOM 1123 CB THR A 146 12.781 19.972 3.163 1.00 66.92 C
+ATOM 1124 OG1 THR A 146 13.796 20.484 2.242 1.00 68.17 O
+ATOM 1125 CG2 THR A 146 13.179 20.186 4.629 1.00 67.78 C
+END