USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1118 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 135 ASN : amide:sc= -1.47 K(o=-3.1,f=-4) USER MOD Set 1.2: A 136 THR OG1 : rot 91:sc= -1.58 USER MOD Set 2.1: A 92 THR OG1 : rot -170:sc= 0 USER MOD Set 2.2: A 116 MET CE :methyl 175:sc= 0 (180deg=0) USER MOD Set 3.1: A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 115 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 86 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 90 SER OG : rot 86:sc=0.000376 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 174:sc= -0.112 (180deg=-0.14) USER MOD Single : A 3 HIS : no HD1:sc= -0.104 X(o=-0.1,f=-0.0014) USER MOD Single : A 4 HIS : no HD1:sc= -0.0662 X(o=-0.066,f=0) USER MOD Single : A 5 HIS : no HD1:sc= -0.436 X(o=-0.44,f=-0.27) USER MOD Single : A 6 HIS : no HE2:sc= 0.0132 K(o=0.013,f=-0.56) USER MOD Single : A 7 HIS : no HD1:sc= -0.0755 X(o=-0.076,f=-0.039) USER MOD Single : A 8 HIS : no HD1:sc= -0.0584 X(o=-0.058,f=-0.058) USER MOD Single : A 10 MET CE :methyl 154:sc= 0 (180deg=-0.0736) USER MOD Single : A 14 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 CYS SG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 CYS SG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 62:sc= 1.24 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -2.48! C(o=-2.5!,f=-5.5!) USER MOD Single : A 51 TYR OH : rot 80:sc= -0.292 USER MOD Single : A 55 ASN : amide:sc= -1.83 K(o=-1.8,f=-0.29) USER MOD Single : A 60 CYS SG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot -101:sc= 0.0209 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= -0.188 USER MOD Single : A 77 SER OG : rot 180:sc= 0.00164 USER MOD Single : A 80 LYS NZ :NH3+ -141:sc= 0.155 (180deg=-0.479) USER MOD Single : A 81 MET CE :methyl 161:sc= -0.228 (180deg=-0.616) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 94:sc= 1.33 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0.0149 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= -0.0279 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 THR OG1 : rot 180:sc= -0.573 USER MOD Single : A 137 HIS : no HD1:sc= -0.0436 X(o=-0.044,f=0) USER MOD Single : A 138 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.319 -9.062 5.987 1.00 12.44 N ATOM 2 CA MET A 1 -2.672 -9.702 7.249 1.00 75.20 C ATOM 3 C MET A 1 -2.295 -8.817 8.433 1.00 64.44 C ATOM 4 O MET A 1 -2.325 -9.256 9.582 1.00 52.10 O ATOM 5 CB MET A 1 -1.976 -11.059 7.369 1.00 34.30 C ATOM 6 CG MET A 1 -2.903 -12.241 7.132 1.00 11.31 C ATOM 7 SD MET A 1 -2.166 -13.811 7.624 1.00 71.11 S ATOM 8 CE MET A 1 -3.374 -14.395 8.811 1.00 4.42 C ATOM 0 H1 MET A 1 -2.491 -9.723 5.203 1.00 12.44 H new ATOM 0 H2 MET A 1 -2.900 -8.210 5.855 1.00 12.44 H new ATOM 0 H3 MET A 1 -1.314 -8.796 6.002 1.00 12.44 H new ATOM 0 HA MET A 1 -3.751 -9.853 7.261 1.00 75.20 H new ATOM 0 HB2 MET A 1 -1.156 -11.102 6.653 1.00 34.30 H new ATOM 0 HB3 MET A 1 -1.536 -11.146 8.363 1.00 34.30 H new ATOM 0 HG2 MET A 1 -3.829 -12.089 7.687 1.00 11.31 H new ATOM 0 HG3 MET A 1 -3.168 -12.284 6.076 1.00 11.31 H new ATOM 0 HE1 MET A 1 -3.058 -15.360 9.207 1.00 4.42 H new ATOM 0 HE2 MET A 1 -3.458 -13.678 9.628 1.00 4.42 H new ATOM 0 HE3 MET A 1 -4.342 -14.502 8.322 1.00 4.42 H new ATOM 18 N ALA A 2 -1.938 -7.570 8.143 1.00 31.23 N ATOM 19 CA ALA A 2 -1.556 -6.624 9.184 1.00 11.11 C ATOM 20 C ALA A 2 -2.782 -6.089 9.917 1.00 61.04 C ATOM 21 O ALA A 2 -2.930 -6.284 11.124 1.00 53.54 O ATOM 22 CB ALA A 2 -0.754 -5.477 8.586 1.00 20.44 C ATOM 0 H ALA A 2 -1.905 -7.192 7.196 1.00 31.23 H new ATOM 0 HA ALA A 2 -0.933 -7.150 9.908 1.00 11.11 H new ATOM 0 HB1 ALA A 2 -0.475 -4.778 9.375 1.00 20.44 H new ATOM 0 HB2 ALA A 2 0.147 -5.870 8.114 1.00 20.44 H new ATOM 0 HB3 ALA A 2 -1.358 -4.960 7.840 1.00 20.44 H new ATOM 28 N HIS A 3 -3.658 -5.414 9.180 1.00 50.53 N ATOM 29 CA HIS A 3 -4.872 -4.850 9.760 1.00 3.11 C ATOM 30 C HIS A 3 -4.541 -3.972 10.964 1.00 74.33 C ATOM 31 O HIS A 3 -4.637 -4.412 12.110 1.00 3.42 O ATOM 32 CB HIS A 3 -5.830 -5.967 10.176 1.00 5.31 C ATOM 33 CG HIS A 3 -6.565 -6.584 9.027 1.00 70.02 C ATOM 34 ND1 HIS A 3 -7.227 -7.790 9.118 1.00 74.03 N ATOM 35 CD2 HIS A 3 -6.742 -6.154 7.755 1.00 21.35 C ATOM 36 CE1 HIS A 3 -7.778 -8.076 7.952 1.00 73.34 C ATOM 37 NE2 HIS A 3 -7.499 -7.099 7.108 1.00 61.33 N ATOM 0 H HIS A 3 -3.550 -5.244 8.180 1.00 50.53 H new ATOM 0 HA HIS A 3 -5.354 -4.232 9.003 1.00 3.11 H new ATOM 0 HB2 HIS A 3 -5.267 -6.743 10.695 1.00 5.31 H new ATOM 0 HB3 HIS A 3 -6.553 -5.568 10.887 1.00 5.31 H new ATOM 0 HD2 HIS A 3 -6.359 -5.238 7.329 1.00 21.35 H new ATOM 0 HE1 HIS A 3 -8.358 -8.959 7.727 1.00 73.34 H new ATOM 0 HE2 HIS A 3 -7.798 -7.054 6.134 1.00 61.33 H new ATOM 45 N HIS A 4 -4.152 -2.730 10.695 1.00 11.01 N ATOM 46 CA HIS A 4 -3.807 -1.791 11.756 1.00 14.53 C ATOM 47 C HIS A 4 -3.593 -0.389 11.193 1.00 71.02 C ATOM 48 O HIS A 4 -2.516 -0.070 10.687 1.00 35.01 O ATOM 49 CB HIS A 4 -2.549 -2.256 12.490 1.00 51.05 C ATOM 50 CG HIS A 4 -2.326 -1.560 13.797 1.00 63.21 C ATOM 51 ND1 HIS A 4 -1.270 -1.852 14.634 1.00 23.31 N ATOM 52 CD2 HIS A 4 -3.029 -0.579 14.409 1.00 31.12 C ATOM 53 CE1 HIS A 4 -1.334 -1.082 15.706 1.00 71.25 C ATOM 54 NE2 HIS A 4 -2.393 -0.300 15.593 1.00 25.05 N ATOM 0 H HIS A 4 -4.068 -2.351 9.752 1.00 11.01 H new ATOM 0 HA HIS A 4 -4.638 -1.758 12.461 1.00 14.53 H new ATOM 0 HB2 HIS A 4 -2.617 -3.329 12.667 1.00 51.05 H new ATOM 0 HB3 HIS A 4 -1.683 -2.093 11.849 1.00 51.05 H new ATOM 0 HD2 HIS A 4 -3.924 -0.104 14.035 1.00 31.12 H new ATOM 0 HE1 HIS A 4 -0.639 -1.090 16.533 1.00 71.25 H new ATOM 0 HE2 HIS A 4 -2.690 0.398 16.275 1.00 25.05 H new ATOM 62 N HIS A 5 -4.625 0.444 11.283 1.00 71.04 N ATOM 63 CA HIS A 5 -4.550 1.812 10.781 1.00 25.33 C ATOM 64 C HIS A 5 -5.288 2.772 11.709 1.00 70.21 C ATOM 65 O HIS A 5 -5.887 2.355 12.701 1.00 2.42 O ATOM 66 CB HIS A 5 -5.136 1.894 9.372 1.00 62.24 C ATOM 67 CG HIS A 5 -4.590 0.861 8.435 1.00 64.13 C ATOM 68 ND1 HIS A 5 -3.522 1.096 7.595 1.00 45.22 N ATOM 69 CD2 HIS A 5 -4.969 -0.419 8.209 1.00 2.21 C ATOM 70 CE1 HIS A 5 -3.269 0.007 6.892 1.00 64.41 C ATOM 71 NE2 HIS A 5 -4.132 -0.928 7.246 1.00 15.41 N ATOM 0 H HIS A 5 -5.523 0.196 11.699 1.00 71.04 H new ATOM 0 HA HIS A 5 -3.500 2.103 10.746 1.00 25.33 H new ATOM 0 HB2 HIS A 5 -6.219 1.783 9.431 1.00 62.24 H new ATOM 0 HB3 HIS A 5 -4.939 2.885 8.962 1.00 62.24 H new ATOM 0 HD2 HIS A 5 -5.779 -0.943 8.695 1.00 2.21 H new ATOM 0 HE1 HIS A 5 -2.489 -0.101 6.153 1.00 64.41 H new ATOM 0 HE2 HIS A 5 -4.171 -1.874 6.866 1.00 15.41 H new ATOM 79 N HIS A 6 -5.241 4.059 11.380 1.00 62.11 N ATOM 80 CA HIS A 6 -5.905 5.078 12.184 1.00 55.42 C ATOM 81 C HIS A 6 -5.740 6.459 11.555 1.00 32.15 C ATOM 82 O HIS A 6 -5.641 7.465 12.259 1.00 34.31 O ATOM 83 CB HIS A 6 -5.345 5.082 13.606 1.00 4.22 C ATOM 84 CG HIS A 6 -3.849 5.148 13.660 1.00 33.12 C ATOM 85 ND1 HIS A 6 -3.138 6.308 13.437 1.00 54.14 N ATOM 86 CD2 HIS A 6 -2.930 4.188 13.916 1.00 44.30 C ATOM 87 CE1 HIS A 6 -1.846 6.059 13.551 1.00 71.02 C ATOM 88 NE2 HIS A 6 -1.692 4.780 13.842 1.00 75.22 N ATOM 0 H HIS A 6 -4.750 4.421 10.562 1.00 62.11 H new ATOM 0 HA HIS A 6 -6.968 4.840 12.222 1.00 55.42 H new ATOM 0 HB2 HIS A 6 -5.758 5.933 14.148 1.00 4.22 H new ATOM 0 HB3 HIS A 6 -5.680 4.182 14.122 1.00 4.22 H new ATOM 0 HD1 HIS A 6 -3.546 7.217 13.218 1.00 54.14 H new ATOM 0 HD2 HIS A 6 -3.132 3.150 14.137 1.00 44.30 H new ATOM 0 HE1 HIS A 6 -1.051 6.779 13.427 1.00 71.02 H new ATOM 96 N HIS A 7 -5.710 6.500 10.227 1.00 33.51 N ATOM 97 CA HIS A 7 -5.557 7.757 9.504 1.00 24.10 C ATOM 98 C HIS A 7 -5.573 7.522 7.997 1.00 52.25 C ATOM 99 O HIS A 7 -5.889 6.426 7.532 1.00 42.20 O ATOM 100 CB HIS A 7 -4.254 8.447 9.910 1.00 13.31 C ATOM 101 CG HIS A 7 -4.404 9.920 10.141 1.00 64.40 C ATOM 102 ND1 HIS A 7 -3.653 10.866 9.475 1.00 20.35 N ATOM 103 CD2 HIS A 7 -5.225 10.607 10.969 1.00 43.13 C ATOM 104 CE1 HIS A 7 -4.005 12.071 9.885 1.00 3.31 C ATOM 105 NE2 HIS A 7 -4.957 11.942 10.791 1.00 12.20 N ATOM 0 H HIS A 7 -5.790 5.677 9.630 1.00 33.51 H new ATOM 0 HA HIS A 7 -6.397 8.401 9.763 1.00 24.10 H new ATOM 0 HB2 HIS A 7 -3.874 7.982 10.819 1.00 13.31 H new ATOM 0 HB3 HIS A 7 -3.508 8.283 9.132 1.00 13.31 H new ATOM 0 HD2 HIS A 7 -5.955 10.184 11.644 1.00 43.13 H new ATOM 0 HE1 HIS A 7 -3.585 13.004 9.538 1.00 3.31 H new ATOM 0 HE2 HIS A 7 -5.418 12.709 11.279 1.00 12.20 H new ATOM 113 N HIS A 8 -5.232 8.559 7.237 1.00 30.43 N ATOM 114 CA HIS A 8 -5.208 8.465 5.782 1.00 51.01 C ATOM 115 C HIS A 8 -6.604 8.189 5.232 1.00 13.21 C ATOM 116 O HIS A 8 -7.576 8.123 5.984 1.00 30.14 O ATOM 117 CB HIS A 8 -4.245 7.364 5.336 1.00 12.03 C ATOM 118 CG HIS A 8 -2.932 7.389 6.056 1.00 11.31 C ATOM 119 ND1 HIS A 8 -2.438 6.311 6.759 1.00 35.24 N ATOM 120 CD2 HIS A 8 -2.008 8.371 6.178 1.00 62.45 C ATOM 121 CE1 HIS A 8 -1.268 6.628 7.284 1.00 52.13 C ATOM 122 NE2 HIS A 8 -0.984 7.873 6.945 1.00 23.31 N ATOM 0 H HIS A 8 -4.969 9.473 7.605 1.00 30.43 H new ATOM 0 HA HIS A 8 -4.863 9.421 5.387 1.00 51.01 H new ATOM 0 HB2 HIS A 8 -4.717 6.394 5.492 1.00 12.03 H new ATOM 0 HB3 HIS A 8 -4.065 7.462 4.265 1.00 12.03 H new ATOM 0 HD2 HIS A 8 -2.066 9.362 5.751 1.00 62.45 H new ATOM 0 HE1 HIS A 8 -0.649 5.980 7.887 1.00 52.13 H new ATOM 0 HE2 HIS A 8 -0.141 8.382 7.210 1.00 23.31 H new ATOM 130 N ALA A 9 -6.696 8.030 3.916 1.00 51.31 N ATOM 131 CA ALA A 9 -7.973 7.761 3.266 1.00 23.41 C ATOM 132 C ALA A 9 -7.772 7.344 1.813 1.00 21.41 C ATOM 133 O ALA A 9 -8.370 6.374 1.348 1.00 54.44 O ATOM 134 CB ALA A 9 -8.874 8.983 3.346 1.00 15.45 C ATOM 0 H ALA A 9 -5.901 8.083 3.279 1.00 51.31 H new ATOM 0 HA ALA A 9 -8.453 6.935 3.791 1.00 23.41 H new ATOM 0 HB1 ALA A 9 -9.824 8.767 2.857 1.00 15.45 H new ATOM 0 HB2 ALA A 9 -9.053 9.235 4.391 1.00 15.45 H new ATOM 0 HB3 ALA A 9 -8.392 9.824 2.848 1.00 15.45 H new ATOM 140 N MET A 10 -6.927 8.082 1.102 1.00 44.32 N ATOM 141 CA MET A 10 -6.647 7.788 -0.299 1.00 31.21 C ATOM 142 C MET A 10 -6.220 6.334 -0.474 1.00 74.11 C ATOM 143 O MET A 10 -6.495 5.716 -1.503 1.00 30.54 O ATOM 144 CB MET A 10 -5.556 8.719 -0.830 1.00 40.32 C ATOM 145 CG MET A 10 -6.068 10.098 -1.215 1.00 30.13 C ATOM 146 SD MET A 10 -5.339 11.412 -0.219 1.00 1.32 S ATOM 147 CE MET A 10 -6.699 11.799 0.880 1.00 35.11 C ATOM 0 H MET A 10 -6.424 8.888 1.472 1.00 44.32 H new ATOM 0 HA MET A 10 -7.562 7.951 -0.868 1.00 31.21 H new ATOM 0 HB2 MET A 10 -4.781 8.827 -0.071 1.00 40.32 H new ATOM 0 HB3 MET A 10 -5.088 8.258 -1.700 1.00 40.32 H new ATOM 0 HG2 MET A 10 -5.850 10.281 -2.267 1.00 30.13 H new ATOM 0 HG3 MET A 10 -7.152 10.123 -1.105 1.00 30.13 H new ATOM 0 HE1 MET A 10 -6.309 12.218 1.808 1.00 35.11 H new ATOM 0 HE2 MET A 10 -7.358 12.524 0.402 1.00 35.11 H new ATOM 0 HE3 MET A 10 -7.259 10.890 1.100 1.00 35.11 H new ATOM 157 N VAL A 11 -5.547 5.793 0.537 1.00 51.34 N ATOM 158 CA VAL A 11 -5.083 4.412 0.494 1.00 34.32 C ATOM 159 C VAL A 11 -6.135 3.462 1.056 1.00 71.43 C ATOM 160 O VAL A 11 -6.105 2.260 0.790 1.00 75.43 O ATOM 161 CB VAL A 11 -3.773 4.235 1.285 1.00 73.12 C ATOM 162 CG1 VAL A 11 -3.005 3.023 0.781 1.00 63.13 C ATOM 163 CG2 VAL A 11 -2.922 5.492 1.193 1.00 52.42 C ATOM 0 H VAL A 11 -5.311 6.291 1.396 1.00 51.34 H new ATOM 0 HA VAL A 11 -4.902 4.171 -0.553 1.00 34.32 H new ATOM 0 HB VAL A 11 -4.021 4.068 2.333 1.00 73.12 H new ATOM 0 HG11 VAL A 11 -2.083 2.914 1.351 1.00 63.13 H new ATOM 0 HG12 VAL A 11 -3.616 2.128 0.904 1.00 63.13 H new ATOM 0 HG13 VAL A 11 -2.766 3.157 -0.274 1.00 63.13 H new ATOM 0 HG21 VAL A 11 -2.000 5.350 1.757 1.00 52.42 H new ATOM 0 HG22 VAL A 11 -2.681 5.693 0.149 1.00 52.42 H new ATOM 0 HG23 VAL A 11 -3.474 6.336 1.607 1.00 52.42 H new ATOM 173 N ILE A 12 -7.064 4.008 1.833 1.00 3.40 N ATOM 174 CA ILE A 12 -8.126 3.209 2.431 1.00 52.42 C ATOM 175 C ILE A 12 -9.143 2.773 1.381 1.00 0.53 C ATOM 176 O ILE A 12 -9.781 1.729 1.516 1.00 24.00 O ATOM 177 CB ILE A 12 -8.855 3.985 3.544 1.00 21.44 C ATOM 178 CG1 ILE A 12 -9.073 3.085 4.763 1.00 41.30 C ATOM 179 CG2 ILE A 12 -10.182 4.524 3.033 1.00 74.21 C ATOM 180 CD1 ILE A 12 -8.067 3.313 5.870 1.00 70.25 C ATOM 0 H ILE A 12 -7.103 5.001 2.063 1.00 3.40 H new ATOM 0 HA ILE A 12 -7.653 2.327 2.864 1.00 52.42 H new ATOM 0 HB ILE A 12 -8.235 4.829 3.844 1.00 21.44 H new ATOM 0 HG12 ILE A 12 -10.076 3.254 5.154 1.00 41.30 H new ATOM 0 HG13 ILE A 12 -9.025 2.043 4.448 1.00 41.30 H new ATOM 0 HG21 ILE A 12 -10.685 5.070 3.831 1.00 74.21 H new ATOM 0 HG22 ILE A 12 -10.003 5.194 2.192 1.00 74.21 H new ATOM 0 HG23 ILE A 12 -10.811 3.695 2.709 1.00 74.21 H new ATOM 0 HD11 ILE A 12 -8.282 2.642 6.701 1.00 70.25 H new ATOM 0 HD12 ILE A 12 -7.063 3.116 5.495 1.00 70.25 H new ATOM 0 HD13 ILE A 12 -8.130 4.346 6.212 1.00 70.25 H new ATOM 192 N ASP A 13 -9.288 3.580 0.335 1.00 21.44 N ATOM 193 CA ASP A 13 -10.225 3.276 -0.740 1.00 11.12 C ATOM 194 C ASP A 13 -9.825 1.995 -1.464 1.00 63.32 C ATOM 195 O ASP A 13 -10.676 1.264 -1.973 1.00 11.45 O ATOM 196 CB ASP A 13 -10.290 4.438 -1.732 1.00 12.42 C ATOM 197 CG ASP A 13 -11.563 4.426 -2.556 1.00 23.13 C ATOM 198 OD1 ASP A 13 -12.609 4.002 -2.023 1.00 75.14 O ATOM 199 OD2 ASP A 13 -11.512 4.839 -3.733 1.00 43.42 O ATOM 0 H ASP A 13 -8.769 4.449 0.209 1.00 21.44 H new ATOM 0 HA ASP A 13 -11.211 3.129 -0.299 1.00 11.12 H new ATOM 0 HB2 ASP A 13 -10.222 5.380 -1.188 1.00 12.42 H new ATOM 0 HB3 ASP A 13 -9.429 4.391 -2.399 1.00 12.42 H new ATOM 204 N HIS A 14 -8.523 1.728 -1.509 1.00 32.14 N ATOM 205 CA HIS A 14 -8.010 0.534 -2.171 1.00 45.54 C ATOM 206 C HIS A 14 -8.171 -0.694 -1.281 1.00 3.44 C ATOM 207 O HIS A 14 -8.316 -1.813 -1.772 1.00 31.53 O ATOM 208 CB HIS A 14 -6.537 0.723 -2.539 1.00 33.05 C ATOM 209 CG HIS A 14 -6.255 0.534 -3.997 1.00 41.42 C ATOM 210 ND1 HIS A 14 -6.261 -0.700 -4.612 1.00 21.15 N ATOM 211 CD2 HIS A 14 -5.958 1.433 -4.965 1.00 55.10 C ATOM 212 CE1 HIS A 14 -5.979 -0.553 -5.894 1.00 2.23 C ATOM 213 NE2 HIS A 14 -5.791 0.732 -6.134 1.00 54.31 N ATOM 0 H HIS A 14 -7.805 2.322 -1.095 1.00 32.14 H new ATOM 0 HA HIS A 14 -8.588 0.377 -3.082 1.00 45.54 H new ATOM 0 HB2 HIS A 14 -6.223 1.724 -2.243 1.00 33.05 H new ATOM 0 HB3 HIS A 14 -5.935 0.018 -1.966 1.00 33.05 H new ATOM 0 HD2 HIS A 14 -5.869 2.502 -4.841 1.00 55.10 H new ATOM 0 HE1 HIS A 14 -5.913 -1.348 -6.622 1.00 2.23 H new ATOM 0 HE2 HIS A 14 -5.559 1.138 -7.041 1.00 54.31 H new ATOM 221 N ILE A 15 -8.143 -0.476 0.030 1.00 51.32 N ATOM 222 CA ILE A 15 -8.286 -1.565 0.988 1.00 54.30 C ATOM 223 C ILE A 15 -9.578 -2.339 0.751 1.00 73.33 C ATOM 224 O ILE A 15 -9.685 -3.514 1.105 1.00 21.21 O ATOM 225 CB ILE A 15 -8.272 -1.045 2.438 1.00 44.34 C ATOM 226 CG1 ILE A 15 -6.966 -0.300 2.722 1.00 23.11 C ATOM 227 CG2 ILE A 15 -8.455 -2.196 3.415 1.00 11.01 C ATOM 228 CD1 ILE A 15 -5.786 -1.217 2.955 1.00 24.22 C ATOM 0 H ILE A 15 -8.023 0.445 0.452 1.00 51.32 H new ATOM 0 HA ILE A 15 -7.434 -2.229 0.840 1.00 54.30 H new ATOM 0 HB ILE A 15 -9.101 -0.349 2.568 1.00 44.34 H new ATOM 0 HG12 ILE A 15 -6.743 0.359 1.883 1.00 23.11 H new ATOM 0 HG13 ILE A 15 -7.102 0.334 3.598 1.00 23.11 H new ATOM 0 HG21 ILE A 15 -8.443 -1.813 4.435 1.00 11.01 H new ATOM 0 HG22 ILE A 15 -9.409 -2.688 3.223 1.00 11.01 H new ATOM 0 HG23 ILE A 15 -7.645 -2.914 3.288 1.00 11.01 H new ATOM 0 HD11 ILE A 15 -4.895 -0.621 3.150 1.00 24.22 H new ATOM 0 HD12 ILE A 15 -5.988 -1.859 3.812 1.00 24.22 H new ATOM 0 HD13 ILE A 15 -5.624 -1.833 2.071 1.00 24.22 H new ATOM 240 N LEU A 16 -10.558 -1.675 0.148 1.00 43.44 N ATOM 241 CA LEU A 16 -11.843 -2.301 -0.140 1.00 15.12 C ATOM 242 C LEU A 16 -11.658 -3.575 -0.958 1.00 1.21 C ATOM 243 O LEU A 16 -12.411 -4.538 -0.808 1.00 5.44 O ATOM 244 CB LEU A 16 -12.751 -1.326 -0.892 1.00 11.01 C ATOM 245 CG LEU A 16 -14.090 -1.889 -1.371 1.00 45.25 C ATOM 246 CD1 LEU A 16 -14.881 -2.453 -0.202 1.00 12.10 C ATOM 247 CD2 LEU A 16 -14.892 -0.816 -2.093 1.00 3.52 C ATOM 0 H LEU A 16 -10.487 -0.702 -0.151 1.00 43.44 H new ATOM 0 HA LEU A 16 -12.310 -2.565 0.809 1.00 15.12 H new ATOM 0 HB2 LEU A 16 -12.950 -0.472 -0.244 1.00 11.01 H new ATOM 0 HB3 LEU A 16 -12.207 -0.949 -1.758 1.00 11.01 H new ATOM 0 HG LEU A 16 -13.892 -2.699 -2.072 1.00 45.25 H new ATOM 0 HD11 LEU A 16 -15.830 -2.849 -0.562 1.00 12.10 H new ATOM 0 HD12 LEU A 16 -14.311 -3.252 0.271 1.00 12.10 H new ATOM 0 HD13 LEU A 16 -15.070 -1.663 0.525 1.00 12.10 H new ATOM 0 HD21 LEU A 16 -15.842 -1.234 -2.427 1.00 3.52 H new ATOM 0 HD22 LEU A 16 -15.081 0.016 -1.414 1.00 3.52 H new ATOM 0 HD23 LEU A 16 -14.329 -0.460 -2.956 1.00 3.52 H new ATOM 259 N LYS A 17 -10.649 -3.575 -1.823 1.00 14.40 N ATOM 260 CA LYS A 17 -10.361 -4.731 -2.663 1.00 51.22 C ATOM 261 C LYS A 17 -10.009 -5.947 -1.813 1.00 21.11 C ATOM 262 O LYS A 17 -10.073 -7.084 -2.282 1.00 43.04 O ATOM 263 CB LYS A 17 -9.211 -4.416 -3.623 1.00 13.22 C ATOM 264 CG LYS A 17 -9.534 -3.315 -4.619 1.00 33.44 C ATOM 265 CD LYS A 17 -9.778 -3.876 -6.010 1.00 33.14 C ATOM 266 CE LYS A 17 -11.226 -4.307 -6.191 1.00 24.53 C ATOM 267 NZ LYS A 17 -11.791 -3.824 -7.481 1.00 32.14 N ATOM 0 H LYS A 17 -10.017 -2.786 -1.960 1.00 14.40 H new ATOM 0 HA LYS A 17 -11.256 -4.961 -3.241 1.00 51.22 H new ATOM 0 HB2 LYS A 17 -8.335 -4.125 -3.044 1.00 13.22 H new ATOM 0 HB3 LYS A 17 -8.946 -5.322 -4.169 1.00 13.22 H new ATOM 0 HG2 LYS A 17 -10.417 -2.769 -4.286 1.00 33.44 H new ATOM 0 HG3 LYS A 17 -8.711 -2.601 -4.653 1.00 33.44 H new ATOM 0 HD2 LYS A 17 -9.525 -3.123 -6.757 1.00 33.14 H new ATOM 0 HD3 LYS A 17 -9.120 -4.728 -6.181 1.00 33.14 H new ATOM 0 HE2 LYS A 17 -11.289 -5.394 -6.151 1.00 24.53 H new ATOM 0 HE3 LYS A 17 -11.825 -3.923 -5.366 1.00 24.53 H new ATOM 0 HZ1 LYS A 17 -12.779 -4.138 -7.567 1.00 32.14 H new ATOM 0 HZ2 LYS A 17 -11.755 -2.785 -7.509 1.00 32.14 H new ATOM 0 HZ3 LYS A 17 -11.235 -4.211 -8.270 1.00 32.14 H new ATOM 281 N CYS A 18 -9.639 -5.701 -0.561 1.00 40.11 N ATOM 282 CA CYS A 18 -9.278 -6.777 0.355 1.00 4.21 C ATOM 283 C CYS A 18 -10.523 -7.473 0.894 1.00 21.21 C ATOM 284 O CYS A 18 -10.540 -8.692 1.066 1.00 74.14 O ATOM 285 CB CYS A 18 -8.443 -6.229 1.514 1.00 62.33 C ATOM 286 SG CYS A 18 -7.439 -7.476 2.354 1.00 31.43 S ATOM 0 H CYS A 18 -9.581 -4.766 -0.157 1.00 40.11 H new ATOM 0 HA CYS A 18 -8.686 -7.507 -0.197 1.00 4.21 H new ATOM 0 HB2 CYS A 18 -7.788 -5.444 1.136 1.00 62.33 H new ATOM 0 HB3 CYS A 18 -9.110 -5.765 2.241 1.00 62.33 H new ATOM 0 HG CYS A 18 -6.768 -6.916 3.317 1.00 31.43 H new ATOM 292 N VAL A 19 -11.563 -6.690 1.161 1.00 35.34 N ATOM 293 CA VAL A 19 -12.813 -7.231 1.682 1.00 74.21 C ATOM 294 C VAL A 19 -13.741 -7.659 0.550 1.00 41.40 C ATOM 295 O VAL A 19 -14.560 -8.564 0.712 1.00 43.30 O ATOM 296 CB VAL A 19 -13.543 -6.205 2.569 1.00 41.22 C ATOM 297 CG1 VAL A 19 -14.818 -5.725 1.892 1.00 2.31 C ATOM 298 CG2 VAL A 19 -13.847 -6.802 3.934 1.00 22.05 C ATOM 0 H VAL A 19 -11.565 -5.679 1.025 1.00 35.34 H new ATOM 0 HA VAL A 19 -12.554 -8.102 2.285 1.00 74.21 H new ATOM 0 HB VAL A 19 -12.890 -5.344 2.712 1.00 41.22 H new ATOM 0 HG11 VAL A 19 -15.320 -5.001 2.534 1.00 2.31 H new ATOM 0 HG12 VAL A 19 -14.570 -5.256 0.940 1.00 2.31 H new ATOM 0 HG13 VAL A 19 -15.479 -6.574 1.717 1.00 2.31 H new ATOM 0 HG21 VAL A 19 -14.363 -6.063 4.547 1.00 22.05 H new ATOM 0 HG22 VAL A 19 -14.481 -7.680 3.814 1.00 22.05 H new ATOM 0 HG23 VAL A 19 -12.915 -7.091 4.420 1.00 22.05 H new ATOM 308 N PHE A 20 -13.607 -7.002 -0.597 1.00 43.24 N ATOM 309 CA PHE A 20 -14.433 -7.313 -1.758 1.00 32.22 C ATOM 310 C PHE A 20 -13.891 -8.531 -2.501 1.00 11.14 C ATOM 311 O PHE A 20 -14.604 -9.164 -3.280 1.00 45.10 O ATOM 312 CB PHE A 20 -14.496 -6.112 -2.703 1.00 13.41 C ATOM 313 CG PHE A 20 -15.888 -5.784 -3.163 1.00 42.54 C ATOM 314 CD1 PHE A 20 -16.778 -6.792 -3.496 1.00 25.30 C ATOM 315 CD2 PHE A 20 -16.306 -4.466 -3.263 1.00 73.52 C ATOM 316 CE1 PHE A 20 -18.058 -6.493 -3.921 1.00 32.02 C ATOM 317 CE2 PHE A 20 -17.586 -4.161 -3.687 1.00 30.10 C ATOM 318 CZ PHE A 20 -18.463 -5.176 -4.015 1.00 54.12 C ATOM 0 H PHE A 20 -12.934 -6.250 -0.748 1.00 43.24 H new ATOM 0 HA PHE A 20 -15.439 -7.542 -1.405 1.00 32.22 H new ATOM 0 HB2 PHE A 20 -14.073 -5.242 -2.201 1.00 13.41 H new ATOM 0 HB3 PHE A 20 -13.872 -6.312 -3.574 1.00 13.41 H new ATOM 0 HD1 PHE A 20 -16.468 -7.824 -3.422 1.00 25.30 H new ATOM 0 HD2 PHE A 20 -15.624 -3.669 -3.007 1.00 73.52 H new ATOM 0 HE1 PHE A 20 -18.741 -7.288 -4.180 1.00 32.02 H new ATOM 0 HE2 PHE A 20 -17.900 -3.130 -3.762 1.00 30.10 H new ATOM 0 HZ PHE A 20 -19.464 -4.940 -4.345 1.00 54.12 H new ATOM 328 N ASP A 21 -12.626 -8.852 -2.253 1.00 71.15 N ATOM 329 CA ASP A 21 -11.987 -9.994 -2.898 1.00 12.31 C ATOM 330 C ASP A 21 -12.514 -11.306 -2.325 1.00 41.22 C ATOM 331 O ASP A 21 -12.870 -12.221 -3.067 1.00 61.44 O ATOM 332 CB ASP A 21 -10.469 -9.920 -2.725 1.00 72.31 C ATOM 333 CG ASP A 21 -9.779 -11.211 -3.119 1.00 23.45 C ATOM 334 OD1 ASP A 21 -10.281 -11.898 -4.032 1.00 75.02 O ATOM 335 OD2 ASP A 21 -8.736 -11.536 -2.512 1.00 40.42 O ATOM 0 H ASP A 21 -12.023 -8.338 -1.611 1.00 71.15 H new ATOM 0 HA ASP A 21 -12.226 -9.961 -3.961 1.00 12.31 H new ATOM 0 HB2 ASP A 21 -10.077 -9.102 -3.330 1.00 72.31 H new ATOM 0 HB3 ASP A 21 -10.235 -9.689 -1.686 1.00 72.31 H new ATOM 340 N LYS A 22 -12.560 -11.391 -1.000 1.00 41.10 N ATOM 341 CA LYS A 22 -13.043 -12.590 -0.326 1.00 61.32 C ATOM 342 C LYS A 22 -14.553 -12.732 -0.485 1.00 33.45 C ATOM 343 O LYS A 22 -15.069 -13.840 -0.638 1.00 30.14 O ATOM 344 CB LYS A 22 -12.677 -12.548 1.159 1.00 22.12 C ATOM 345 CG LYS A 22 -11.947 -13.790 1.641 1.00 1.12 C ATOM 346 CD LYS A 22 -10.485 -13.498 1.937 1.00 73.01 C ATOM 347 CE LYS A 22 -9.776 -12.918 0.723 1.00 52.50 C ATOM 348 NZ LYS A 22 -8.296 -13.019 0.844 1.00 5.04 N ATOM 0 H LYS A 22 -12.268 -10.643 -0.371 1.00 41.10 H new ATOM 0 HA LYS A 22 -12.564 -13.454 -0.787 1.00 61.32 H new ATOM 0 HB2 LYS A 22 -12.053 -11.674 1.346 1.00 22.12 H new ATOM 0 HB3 LYS A 22 -13.587 -12.421 1.745 1.00 22.12 H new ATOM 0 HG2 LYS A 22 -12.432 -14.172 2.539 1.00 1.12 H new ATOM 0 HG3 LYS A 22 -12.017 -14.571 0.884 1.00 1.12 H new ATOM 0 HD2 LYS A 22 -10.414 -12.798 2.770 1.00 73.01 H new ATOM 0 HD3 LYS A 22 -9.985 -14.415 2.248 1.00 73.01 H new ATOM 0 HE2 LYS A 22 -10.104 -13.443 -0.174 1.00 52.50 H new ATOM 0 HE3 LYS A 22 -10.060 -11.873 0.602 1.00 52.50 H new ATOM 0 HZ1 LYS A 22 -7.850 -12.613 -0.003 1.00 5.04 H new ATOM 0 HZ2 LYS A 22 -7.980 -12.496 1.686 1.00 5.04 H new ATOM 0 HZ3 LYS A 22 -8.022 -14.018 0.934 1.00 5.04 H new ATOM 362 N ILE A 23 -15.256 -11.605 -0.448 1.00 71.40 N ATOM 363 CA ILE A 23 -16.707 -11.605 -0.590 1.00 63.31 C ATOM 364 C ILE A 23 -17.138 -12.378 -1.832 1.00 25.30 C ATOM 365 O ILE A 23 -18.121 -13.119 -1.804 1.00 52.04 O ATOM 366 CB ILE A 23 -17.264 -10.172 -0.672 1.00 73.02 C ATOM 367 CG1 ILE A 23 -17.338 -9.549 0.724 1.00 62.35 C ATOM 368 CG2 ILE A 23 -18.636 -10.174 -1.330 1.00 70.21 C ATOM 369 CD1 ILE A 23 -17.486 -8.044 0.707 1.00 60.15 C ATOM 0 H ILE A 23 -14.844 -10.680 -0.321 1.00 71.40 H new ATOM 0 HA ILE A 23 -17.111 -12.093 0.297 1.00 63.31 H new ATOM 0 HB ILE A 23 -16.590 -9.571 -1.282 1.00 73.02 H new ATOM 0 HG12 ILE A 23 -18.181 -9.983 1.262 1.00 62.35 H new ATOM 0 HG13 ILE A 23 -16.437 -9.811 1.278 1.00 62.35 H new ATOM 0 HG21 ILE A 23 -19.017 -9.154 -1.381 1.00 70.21 H new ATOM 0 HG22 ILE A 23 -18.556 -10.582 -2.338 1.00 70.21 H new ATOM 0 HG23 ILE A 23 -19.320 -10.788 -0.744 1.00 70.21 H new ATOM 0 HD11 ILE A 23 -17.532 -7.671 1.730 1.00 60.15 H new ATOM 0 HD12 ILE A 23 -16.631 -7.600 0.197 1.00 60.15 H new ATOM 0 HD13 ILE A 23 -18.402 -7.774 0.181 1.00 60.15 H new ATOM 381 N CYS A 24 -16.394 -12.202 -2.919 1.00 34.33 N ATOM 382 CA CYS A 24 -16.699 -12.884 -4.172 1.00 25.43 C ATOM 383 C CYS A 24 -16.166 -14.313 -4.156 1.00 21.50 C ATOM 384 O CYS A 24 -16.624 -15.167 -4.916 1.00 22.00 O ATOM 385 CB CYS A 24 -16.101 -12.117 -5.352 1.00 61.41 C ATOM 386 SG CYS A 24 -17.208 -10.877 -6.063 1.00 61.11 S ATOM 0 H CYS A 24 -15.576 -11.594 -2.958 1.00 34.33 H new ATOM 0 HA CYS A 24 -17.783 -12.921 -4.284 1.00 25.43 H new ATOM 0 HB2 CYS A 24 -15.185 -11.626 -5.025 1.00 61.41 H new ATOM 0 HB3 CYS A 24 -15.822 -12.828 -6.130 1.00 61.41 H new ATOM 0 HG CYS A 24 -16.613 -10.280 -7.053 1.00 61.11 H new ATOM 392 N LYS A 25 -15.194 -14.568 -3.286 1.00 51.51 N ATOM 393 CA LYS A 25 -14.597 -15.893 -3.170 1.00 53.24 C ATOM 394 C LYS A 25 -15.584 -16.882 -2.558 1.00 63.11 C ATOM 395 O LYS A 25 -15.923 -17.894 -3.172 1.00 31.55 O ATOM 396 CB LYS A 25 -13.327 -15.830 -2.319 1.00 61.15 C ATOM 397 CG LYS A 25 -12.291 -16.876 -2.694 1.00 74.24 C ATOM 398 CD LYS A 25 -10.918 -16.523 -2.148 1.00 14.41 C ATOM 399 CE LYS A 25 -10.080 -17.767 -1.900 1.00 63.14 C ATOM 400 NZ LYS A 25 -8.628 -17.448 -1.809 1.00 62.44 N ATOM 0 H LYS A 25 -14.803 -13.873 -2.650 1.00 51.51 H new ATOM 0 HA LYS A 25 -14.339 -16.237 -4.171 1.00 53.24 H new ATOM 0 HB2 LYS A 25 -12.883 -14.839 -2.417 1.00 61.15 H new ATOM 0 HB3 LYS A 25 -13.596 -15.957 -1.270 1.00 61.15 H new ATOM 0 HG2 LYS A 25 -12.598 -17.848 -2.308 1.00 74.24 H new ATOM 0 HG3 LYS A 25 -12.240 -16.966 -3.779 1.00 74.24 H new ATOM 0 HD2 LYS A 25 -10.402 -15.870 -2.852 1.00 14.41 H new ATOM 0 HD3 LYS A 25 -11.028 -15.965 -1.218 1.00 14.41 H new ATOM 0 HE2 LYS A 25 -10.405 -18.246 -0.976 1.00 63.14 H new ATOM 0 HE3 LYS A 25 -10.245 -18.483 -2.705 1.00 63.14 H new ATOM 0 HZ1 LYS A 25 -8.090 -18.322 -1.640 1.00 62.44 H new ATOM 0 HZ2 LYS A 25 -8.311 -17.014 -2.700 1.00 62.44 H new ATOM 0 HZ3 LYS A 25 -8.467 -16.785 -1.024 1.00 62.44 H new ATOM 414 N ILE A 26 -16.041 -16.582 -1.347 1.00 41.01 N ATOM 415 CA ILE A 26 -16.990 -17.444 -0.654 1.00 54.03 C ATOM 416 C ILE A 26 -18.364 -17.390 -1.314 1.00 32.32 C ATOM 417 O ILE A 26 -19.187 -18.286 -1.132 1.00 33.34 O ATOM 418 CB ILE A 26 -17.129 -17.051 0.828 1.00 34.03 C ATOM 419 CG1 ILE A 26 -17.426 -18.287 1.680 1.00 12.23 C ATOM 420 CG2 ILE A 26 -18.224 -16.008 0.999 1.00 5.24 C ATOM 421 CD1 ILE A 26 -16.183 -18.993 2.175 1.00 40.41 C ATOM 0 H ILE A 26 -15.769 -15.749 -0.826 1.00 41.01 H new ATOM 0 HA ILE A 26 -16.599 -18.459 -0.717 1.00 54.03 H new ATOM 0 HB ILE A 26 -16.187 -16.619 1.164 1.00 34.03 H new ATOM 0 HG12 ILE A 26 -18.031 -17.991 2.537 1.00 12.23 H new ATOM 0 HG13 ILE A 26 -18.023 -18.987 1.095 1.00 12.23 H new ATOM 0 HG21 ILE A 26 -18.310 -15.740 2.052 1.00 5.24 H new ATOM 0 HG22 ILE A 26 -17.975 -15.120 0.418 1.00 5.24 H new ATOM 0 HG23 ILE A 26 -19.173 -16.416 0.649 1.00 5.24 H new ATOM 0 HD11 ILE A 26 -16.470 -19.859 2.772 1.00 40.41 H new ATOM 0 HD12 ILE A 26 -15.587 -19.320 1.323 1.00 40.41 H new ATOM 0 HD13 ILE A 26 -15.596 -18.309 2.787 1.00 40.41 H new ATOM 433 N GLY A 27 -18.605 -16.333 -2.083 1.00 45.14 N ATOM 434 CA GLY A 27 -19.879 -16.183 -2.761 1.00 13.45 C ATOM 435 C GLY A 27 -19.974 -17.030 -4.014 1.00 24.13 C ATOM 436 O GLY A 27 -21.063 -17.251 -4.543 1.00 73.11 O ATOM 0 H GLY A 27 -17.940 -15.577 -2.249 1.00 45.14 H new ATOM 0 HA2 GLY A 27 -20.684 -16.457 -2.079 1.00 13.45 H new ATOM 0 HA3 GLY A 27 -20.026 -15.135 -3.023 1.00 13.45 H new ATOM 440 N THR A 28 -18.828 -17.506 -4.492 1.00 50.23 N ATOM 441 CA THR A 28 -18.785 -18.331 -5.693 1.00 33.02 C ATOM 442 C THR A 28 -18.904 -19.811 -5.347 1.00 41.01 C ATOM 443 O THR A 28 -19.270 -20.627 -6.192 1.00 64.13 O ATOM 444 CB THR A 28 -17.484 -18.103 -6.485 1.00 30.30 C ATOM 445 OG1 THR A 28 -17.372 -16.725 -6.858 1.00 32.24 O ATOM 446 CG2 THR A 28 -17.449 -18.975 -7.731 1.00 74.20 C ATOM 0 H THR A 28 -17.918 -17.334 -4.066 1.00 50.23 H new ATOM 0 HA THR A 28 -19.633 -18.036 -6.310 1.00 33.02 H new ATOM 0 HB THR A 28 -16.644 -18.375 -5.846 1.00 30.30 H new ATOM 0 HG1 THR A 28 -17.327 -16.170 -6.051 1.00 32.24 H new ATOM 0 HG21 THR A 28 -16.521 -18.797 -8.274 1.00 74.20 H new ATOM 0 HG22 THR A 28 -17.504 -20.025 -7.442 1.00 74.20 H new ATOM 0 HG23 THR A 28 -18.297 -18.730 -8.371 1.00 74.20 H new ATOM 454 N GLU A 29 -18.593 -20.149 -4.100 1.00 31.53 N ATOM 455 CA GLU A 29 -18.666 -21.533 -3.644 1.00 3.44 C ATOM 456 C GLU A 29 -20.086 -21.891 -3.217 1.00 54.11 C ATOM 457 O GLU A 29 -20.517 -23.036 -3.356 1.00 14.44 O ATOM 458 CB GLU A 29 -17.699 -21.760 -2.479 1.00 72.44 C ATOM 459 CG GLU A 29 -18.375 -21.761 -1.119 1.00 20.25 C ATOM 460 CD GLU A 29 -17.383 -21.850 0.025 1.00 33.32 C ATOM 461 OE1 GLU A 29 -16.173 -21.671 -0.223 1.00 42.10 O ATOM 462 OE2 GLU A 29 -17.819 -22.099 1.169 1.00 63.20 O ATOM 0 H GLU A 29 -18.288 -19.485 -3.388 1.00 31.53 H new ATOM 0 HA GLU A 29 -18.382 -22.178 -4.475 1.00 3.44 H new ATOM 0 HB2 GLU A 29 -17.188 -22.712 -2.622 1.00 72.44 H new ATOM 0 HB3 GLU A 29 -16.935 -20.983 -2.495 1.00 72.44 H new ATOM 0 HG2 GLU A 29 -18.968 -20.853 -1.011 1.00 20.25 H new ATOM 0 HG3 GLU A 29 -19.067 -22.602 -1.062 1.00 20.25 H new ATOM 469 N SER A 30 -20.809 -20.904 -2.697 1.00 43.31 N ATOM 470 CA SER A 30 -22.179 -21.115 -2.246 1.00 12.21 C ATOM 471 C SER A 30 -23.093 -21.448 -3.421 1.00 42.04 C ATOM 472 O SER A 30 -24.190 -21.976 -3.240 1.00 12.33 O ATOM 473 CB SER A 30 -22.697 -19.872 -1.520 1.00 4.34 C ATOM 474 OG SER A 30 -23.528 -19.096 -2.365 1.00 50.02 O ATOM 0 H SER A 30 -20.468 -19.950 -2.578 1.00 43.31 H new ATOM 0 HA SER A 30 -22.181 -21.958 -1.555 1.00 12.21 H new ATOM 0 HB2 SER A 30 -23.254 -20.172 -0.632 1.00 4.34 H new ATOM 0 HB3 SER A 30 -21.855 -19.269 -1.179 1.00 4.34 H new ATOM 0 HG SER A 30 -23.847 -18.309 -1.877 1.00 50.02 H new ATOM 480 N VAL A 31 -22.632 -21.136 -4.628 1.00 44.34 N ATOM 481 CA VAL A 31 -23.405 -21.402 -5.835 1.00 74.31 C ATOM 482 C VAL A 31 -23.568 -22.901 -6.064 1.00 12.34 C ATOM 483 O VAL A 31 -24.470 -23.334 -6.780 1.00 21.52 O ATOM 484 CB VAL A 31 -22.744 -20.774 -7.076 1.00 52.31 C ATOM 485 CG1 VAL A 31 -23.690 -20.820 -8.267 1.00 21.45 C ATOM 486 CG2 VAL A 31 -22.313 -19.345 -6.783 1.00 41.41 C ATOM 0 H VAL A 31 -21.726 -20.698 -4.796 1.00 44.34 H new ATOM 0 HA VAL A 31 -24.386 -20.950 -5.688 1.00 74.31 H new ATOM 0 HB VAL A 31 -21.856 -21.354 -7.326 1.00 52.31 H new ATOM 0 HG11 VAL A 31 -23.205 -20.372 -9.134 1.00 21.45 H new ATOM 0 HG12 VAL A 31 -23.945 -21.856 -8.489 1.00 21.45 H new ATOM 0 HG13 VAL A 31 -24.598 -20.265 -8.032 1.00 21.45 H new ATOM 0 HG21 VAL A 31 -21.848 -18.916 -7.671 1.00 41.41 H new ATOM 0 HG22 VAL A 31 -23.185 -18.751 -6.507 1.00 41.41 H new ATOM 0 HG23 VAL A 31 -21.597 -19.342 -5.961 1.00 41.41 H new ATOM 496 N GLU A 32 -22.689 -23.687 -5.449 1.00 52.54 N ATOM 497 CA GLU A 32 -22.736 -25.137 -5.587 1.00 30.53 C ATOM 498 C GLU A 32 -23.679 -25.751 -4.556 1.00 73.42 C ATOM 499 O GLU A 32 -24.610 -26.477 -4.906 1.00 1.04 O ATOM 500 CB GLU A 32 -21.335 -25.732 -5.430 1.00 70.30 C ATOM 501 CG GLU A 32 -20.554 -25.801 -6.731 1.00 41.05 C ATOM 502 CD GLU A 32 -19.689 -24.576 -6.958 1.00 71.22 C ATOM 503 OE1 GLU A 32 -18.736 -24.371 -6.177 1.00 54.42 O ATOM 504 OE2 GLU A 32 -19.965 -23.823 -7.916 1.00 23.55 O ATOM 0 H GLU A 32 -21.937 -23.344 -4.851 1.00 52.54 H new ATOM 0 HA GLU A 32 -23.113 -25.370 -6.583 1.00 30.53 H new ATOM 0 HB2 GLU A 32 -20.774 -25.135 -4.711 1.00 70.30 H new ATOM 0 HB3 GLU A 32 -21.420 -26.736 -5.014 1.00 70.30 H new ATOM 0 HG2 GLU A 32 -19.924 -26.690 -6.725 1.00 41.05 H new ATOM 0 HG3 GLU A 32 -21.250 -25.909 -7.563 1.00 41.05 H new ATOM 511 N ALA A 33 -23.431 -25.455 -3.285 1.00 1.02 N ATOM 512 CA ALA A 33 -24.258 -25.976 -2.203 1.00 41.23 C ATOM 513 C ALA A 33 -25.724 -25.608 -2.407 1.00 63.12 C ATOM 514 O ALA A 33 -26.618 -26.262 -1.872 1.00 40.20 O ATOM 515 CB ALA A 33 -23.763 -25.455 -0.862 1.00 44.23 C ATOM 0 H ALA A 33 -22.664 -24.857 -2.979 1.00 1.02 H new ATOM 0 HA ALA A 33 -24.179 -27.063 -2.209 1.00 41.23 H new ATOM 0 HB1 ALA A 33 -24.390 -25.852 -0.064 1.00 44.23 H new ATOM 0 HB2 ALA A 33 -22.732 -25.773 -0.706 1.00 44.23 H new ATOM 0 HB3 ALA A 33 -23.812 -24.366 -0.854 1.00 44.23 H new ATOM 521 N GLY A 34 -25.963 -24.556 -3.185 1.00 22.24 N ATOM 522 CA GLY A 34 -27.322 -24.119 -3.444 1.00 71.54 C ATOM 523 C GLY A 34 -28.040 -25.015 -4.434 1.00 62.43 C ATOM 524 O GLY A 34 -29.221 -25.318 -4.265 1.00 11.22 O ATOM 0 H GLY A 34 -25.240 -23.999 -3.640 1.00 22.24 H new ATOM 0 HA2 GLY A 34 -27.879 -24.098 -2.507 1.00 71.54 H new ATOM 0 HA3 GLY A 34 -27.306 -23.099 -3.827 1.00 71.54 H new ATOM 528 N ARG A 35 -27.326 -25.440 -5.472 1.00 4.24 N ATOM 529 CA ARG A 35 -27.903 -26.304 -6.494 1.00 43.13 C ATOM 530 C ARG A 35 -27.748 -27.774 -6.115 1.00 3.31 C ATOM 531 O ARG A 35 -28.463 -28.637 -6.626 1.00 0.33 O ATOM 532 CB ARG A 35 -27.238 -26.043 -7.847 1.00 54.43 C ATOM 533 CG ARG A 35 -27.220 -24.575 -8.243 1.00 63.33 C ATOM 534 CD ARG A 35 -28.517 -23.879 -7.864 1.00 34.21 C ATOM 535 NE ARG A 35 -29.688 -24.592 -8.368 1.00 13.21 N ATOM 536 CZ ARG A 35 -30.097 -24.533 -9.630 1.00 72.24 C ATOM 537 NH1 ARG A 35 -29.433 -23.799 -10.512 1.00 60.14 N ATOM 538 NH2 ARG A 35 -31.172 -25.210 -10.013 1.00 73.21 N ATOM 0 H ARG A 35 -26.347 -25.200 -5.627 1.00 4.24 H new ATOM 0 HA ARG A 35 -28.966 -26.076 -6.569 1.00 43.13 H new ATOM 0 HB2 ARG A 35 -26.214 -26.415 -7.817 1.00 54.43 H new ATOM 0 HB3 ARG A 35 -27.761 -26.612 -8.616 1.00 54.43 H new ATOM 0 HG2 ARG A 35 -26.382 -24.076 -7.756 1.00 63.33 H new ATOM 0 HG3 ARG A 35 -27.061 -24.489 -9.318 1.00 63.33 H new ATOM 0 HD2 ARG A 35 -28.581 -23.798 -6.779 1.00 34.21 H new ATOM 0 HD3 ARG A 35 -28.513 -22.863 -8.260 1.00 34.21 H new ATOM 0 HE ARG A 35 -30.221 -25.167 -7.715 1.00 13.21 H new ATOM 0 HH11 ARG A 35 -28.606 -23.278 -10.222 1.00 60.14 H new ATOM 0 HH12 ARG A 35 -29.749 -23.756 -11.481 1.00 60.14 H new ATOM 0 HH21 ARG A 35 -31.685 -25.777 -9.338 1.00 73.21 H new ATOM 0 HH22 ARG A 35 -31.485 -25.164 -10.983 1.00 73.21 H new ATOM 552 N LEU A 36 -26.809 -28.052 -5.217 1.00 13.44 N ATOM 553 CA LEU A 36 -26.559 -29.417 -4.769 1.00 34.24 C ATOM 554 C LEU A 36 -27.577 -29.839 -3.713 1.00 5.41 C ATOM 555 O LEU A 36 -28.028 -30.984 -3.694 1.00 64.30 O ATOM 556 CB LEU A 36 -25.142 -29.539 -4.205 1.00 55.13 C ATOM 557 CG LEU A 36 -24.097 -30.144 -5.143 1.00 31.21 C ATOM 558 CD1 LEU A 36 -23.672 -29.130 -6.194 1.00 24.35 C ATOM 559 CD2 LEU A 36 -22.892 -30.634 -4.353 1.00 72.10 C ATOM 0 H LEU A 36 -26.208 -27.350 -4.785 1.00 13.44 H new ATOM 0 HA LEU A 36 -26.659 -30.079 -5.629 1.00 34.24 H new ATOM 0 HB2 LEU A 36 -24.804 -28.546 -3.908 1.00 55.13 H new ATOM 0 HB3 LEU A 36 -25.183 -30.145 -3.300 1.00 55.13 H new ATOM 0 HG LEU A 36 -24.544 -30.998 -5.652 1.00 31.21 H new ATOM 0 HD11 LEU A 36 -22.928 -29.578 -6.852 1.00 24.35 H new ATOM 0 HD12 LEU A 36 -24.540 -28.828 -6.780 1.00 24.35 H new ATOM 0 HD13 LEU A 36 -23.243 -28.256 -5.704 1.00 24.35 H new ATOM 0 HD21 LEU A 36 -22.158 -31.062 -5.036 1.00 72.10 H new ATOM 0 HD22 LEU A 36 -22.444 -29.798 -3.817 1.00 72.10 H new ATOM 0 HD23 LEU A 36 -23.209 -31.394 -3.639 1.00 72.10 H new ATOM 571 N ILE A 37 -27.935 -28.905 -2.838 1.00 25.12 N ATOM 572 CA ILE A 37 -28.901 -29.179 -1.782 1.00 20.23 C ATOM 573 C ILE A 37 -30.316 -29.272 -2.342 1.00 71.11 C ATOM 574 O ILE A 37 -31.048 -30.217 -2.050 1.00 55.21 O ATOM 575 CB ILE A 37 -28.864 -28.094 -0.689 1.00 62.31 C ATOM 576 CG1 ILE A 37 -27.843 -28.461 0.390 1.00 31.20 C ATOM 577 CG2 ILE A 37 -30.245 -27.910 -0.079 1.00 10.23 C ATOM 578 CD1 ILE A 37 -26.515 -28.925 -0.167 1.00 33.12 C ATOM 0 H ILE A 37 -27.571 -27.952 -2.840 1.00 25.12 H new ATOM 0 HA ILE A 37 -28.623 -30.137 -1.341 1.00 20.23 H new ATOM 0 HB ILE A 37 -28.561 -27.151 -1.144 1.00 62.31 H new ATOM 0 HG12 ILE A 37 -27.676 -27.595 1.031 1.00 31.20 H new ATOM 0 HG13 ILE A 37 -28.259 -29.248 1.019 1.00 31.20 H new ATOM 0 HG21 ILE A 37 -30.203 -27.140 0.692 1.00 10.23 H new ATOM 0 HG22 ILE A 37 -30.948 -27.608 -0.855 1.00 10.23 H new ATOM 0 HG23 ILE A 37 -30.575 -28.849 0.364 1.00 10.23 H new ATOM 0 HD11 ILE A 37 -25.841 -29.168 0.654 1.00 33.12 H new ATOM 0 HD12 ILE A 37 -26.669 -29.810 -0.784 1.00 33.12 H new ATOM 0 HD13 ILE A 37 -26.077 -28.132 -0.773 1.00 33.12 H new ATOM 590 N GLU A 38 -30.693 -28.286 -3.150 1.00 0.22 N ATOM 591 CA GLU A 38 -32.021 -28.258 -3.752 1.00 44.41 C ATOM 592 C GLU A 38 -32.288 -29.537 -4.540 1.00 42.32 C ATOM 593 O GLU A 38 -33.237 -30.269 -4.255 1.00 5.31 O ATOM 594 CB GLU A 38 -32.163 -27.041 -4.669 1.00 71.24 C ATOM 595 CG GLU A 38 -32.065 -25.713 -3.938 1.00 53.23 C ATOM 596 CD GLU A 38 -33.424 -25.100 -3.657 1.00 64.22 C ATOM 597 OE1 GLU A 38 -34.305 -25.183 -4.539 1.00 3.44 O ATOM 598 OE2 GLU A 38 -33.606 -24.539 -2.557 1.00 4.40 O ATOM 0 H GLU A 38 -30.098 -27.497 -3.403 1.00 0.22 H new ATOM 0 HA GLU A 38 -32.755 -28.187 -2.949 1.00 44.41 H new ATOM 0 HB2 GLU A 38 -31.389 -27.082 -5.436 1.00 71.24 H new ATOM 0 HB3 GLU A 38 -33.123 -27.094 -5.182 1.00 71.24 H new ATOM 0 HG2 GLU A 38 -31.535 -25.859 -2.997 1.00 53.23 H new ATOM 0 HG3 GLU A 38 -31.473 -25.018 -4.533 1.00 53.23 H new ATOM 605 N LEU A 39 -31.445 -29.799 -5.533 1.00 73.42 N ATOM 606 CA LEU A 39 -31.589 -30.990 -6.364 1.00 54.10 C ATOM 607 C LEU A 39 -31.703 -32.244 -5.503 1.00 64.14 C ATOM 608 O LEU A 39 -32.403 -33.192 -5.859 1.00 12.21 O ATOM 609 CB LEU A 39 -30.400 -31.117 -7.317 1.00 70.45 C ATOM 610 CG LEU A 39 -30.581 -30.496 -8.703 1.00 3.12 C ATOM 611 CD1 LEU A 39 -31.748 -31.144 -9.431 1.00 31.24 C ATOM 612 CD2 LEU A 39 -30.789 -28.993 -8.590 1.00 3.30 C ATOM 0 H LEU A 39 -30.655 -29.204 -5.782 1.00 73.42 H new ATOM 0 HA LEU A 39 -32.504 -30.888 -6.947 1.00 54.10 H new ATOM 0 HB2 LEU A 39 -29.531 -30.657 -6.846 1.00 70.45 H new ATOM 0 HB3 LEU A 39 -30.172 -32.175 -7.442 1.00 70.45 H new ATOM 0 HG LEU A 39 -29.675 -30.675 -9.281 1.00 3.12 H new ATOM 0 HD11 LEU A 39 -31.861 -30.689 -10.415 1.00 31.24 H new ATOM 0 HD12 LEU A 39 -31.559 -32.211 -9.544 1.00 31.24 H new ATOM 0 HD13 LEU A 39 -32.662 -30.997 -8.856 1.00 31.24 H new ATOM 0 HD21 LEU A 39 -30.916 -28.567 -9.585 1.00 3.30 H new ATOM 0 HD22 LEU A 39 -31.679 -28.793 -7.993 1.00 3.30 H new ATOM 0 HD23 LEU A 39 -29.921 -28.541 -8.110 1.00 3.30 H new ATOM 624 N SER A 40 -31.010 -32.242 -4.369 1.00 11.41 N ATOM 625 CA SER A 40 -31.032 -33.380 -3.458 1.00 4.13 C ATOM 626 C SER A 40 -32.452 -33.665 -2.978 1.00 64.22 C ATOM 627 O SER A 40 -32.870 -34.820 -2.897 1.00 42.34 O ATOM 628 CB SER A 40 -30.119 -33.117 -2.258 1.00 72.10 C ATOM 629 OG SER A 40 -29.739 -34.330 -1.631 1.00 52.21 O ATOM 0 H SER A 40 -30.426 -31.465 -4.059 1.00 11.41 H new ATOM 0 HA SER A 40 -30.668 -34.254 -3.999 1.00 4.13 H new ATOM 0 HB2 SER A 40 -29.229 -32.579 -2.585 1.00 72.10 H new ATOM 0 HB3 SER A 40 -30.632 -32.478 -1.540 1.00 72.10 H new ATOM 0 HG SER A 40 -29.155 -34.135 -0.869 1.00 52.21 H new ATOM 635 N GLN A 41 -33.187 -32.604 -2.662 1.00 21.24 N ATOM 636 CA GLN A 41 -34.560 -32.740 -2.189 1.00 63.24 C ATOM 637 C GLN A 41 -35.525 -32.899 -3.360 1.00 3.24 C ATOM 638 O GLN A 41 -36.419 -33.743 -3.328 1.00 14.03 O ATOM 639 CB GLN A 41 -34.955 -31.525 -1.348 1.00 63.12 C ATOM 640 CG GLN A 41 -33.806 -30.946 -0.538 1.00 62.34 C ATOM 641 CD GLN A 41 -34.281 -30.125 0.644 1.00 42.22 C ATOM 642 OE1 GLN A 41 -35.231 -29.350 0.534 1.00 14.22 O ATOM 643 NE2 GLN A 41 -33.620 -30.290 1.784 1.00 72.42 N ATOM 0 H GLN A 41 -32.855 -31.641 -2.725 1.00 21.24 H new ATOM 0 HA GLN A 41 -34.618 -33.635 -1.570 1.00 63.24 H new ATOM 0 HB2 GLN A 41 -35.351 -30.751 -2.006 1.00 63.12 H new ATOM 0 HB3 GLN A 41 -35.760 -31.809 -0.670 1.00 63.12 H new ATOM 0 HG2 GLN A 41 -33.173 -31.758 -0.180 1.00 62.34 H new ATOM 0 HG3 GLN A 41 -33.189 -30.322 -1.184 1.00 62.34 H new ATOM 0 HE21 GLN A 41 -32.838 -30.943 1.830 1.00 72.42 H new ATOM 0 HE22 GLN A 41 -33.894 -29.763 2.613 1.00 72.42 H new ATOM 652 N GLU A 42 -35.336 -32.081 -4.391 1.00 34.13 N ATOM 653 CA GLU A 42 -36.192 -32.131 -5.570 1.00 40.15 C ATOM 654 C GLU A 42 -35.728 -31.127 -6.622 1.00 63.30 C ATOM 655 O GLU A 42 -35.813 -31.385 -7.822 1.00 51.30 O ATOM 656 CB GLU A 42 -37.646 -31.848 -5.186 1.00 3.51 C ATOM 657 CG GLU A 42 -38.655 -32.649 -5.990 1.00 73.21 C ATOM 658 CD GLU A 42 -39.718 -33.290 -5.119 1.00 13.11 C ATOM 659 OE1 GLU A 42 -39.461 -34.387 -4.580 1.00 71.14 O ATOM 660 OE2 GLU A 42 -40.807 -32.695 -4.976 1.00 22.01 O ATOM 0 H GLU A 42 -34.599 -31.377 -4.433 1.00 34.13 H new ATOM 0 HA GLU A 42 -36.125 -33.133 -5.993 1.00 40.15 H new ATOM 0 HB2 GLU A 42 -37.782 -32.067 -4.127 1.00 3.51 H new ATOM 0 HB3 GLU A 42 -37.848 -30.785 -5.321 1.00 3.51 H new ATOM 0 HG2 GLU A 42 -39.134 -31.996 -6.719 1.00 73.21 H new ATOM 0 HG3 GLU A 42 -38.134 -33.425 -6.551 1.00 73.21 H new ATOM 667 N GLY A 43 -35.236 -29.981 -6.161 1.00 50.14 N ATOM 668 CA GLY A 43 -34.766 -28.955 -7.074 1.00 71.32 C ATOM 669 C GLY A 43 -35.890 -28.343 -7.886 1.00 41.14 C ATOM 670 O GLY A 43 -35.645 -27.621 -8.852 1.00 74.22 O ATOM 0 H GLY A 43 -35.154 -29.745 -5.172 1.00 50.14 H new ATOM 0 HA2 GLY A 43 -34.263 -28.171 -6.507 1.00 71.32 H new ATOM 0 HA3 GLY A 43 -34.026 -29.385 -7.749 1.00 71.32 H new ATOM 674 N GLY A 44 -37.127 -28.633 -7.495 1.00 52.21 N ATOM 675 CA GLY A 44 -38.274 -28.099 -8.206 1.00 13.23 C ATOM 676 C GLY A 44 -39.299 -27.484 -7.273 1.00 51.23 C ATOM 677 O GLY A 44 -38.974 -27.095 -6.152 1.00 73.02 O ATOM 0 H GLY A 44 -37.355 -29.228 -6.699 1.00 52.21 H new ATOM 0 HA2 GLY A 44 -37.938 -27.346 -8.919 1.00 13.23 H new ATOM 0 HA3 GLY A 44 -38.744 -28.896 -8.782 1.00 13.23 H new ATOM 681 N GLY A 45 -40.542 -27.394 -7.738 1.00 45.34 N ATOM 682 CA GLY A 45 -41.598 -26.818 -6.926 1.00 63.42 C ATOM 683 C GLY A 45 -41.803 -25.342 -7.202 1.00 63.25 C ATOM 684 O GLY A 45 -40.956 -24.516 -6.863 1.00 35.54 O ATOM 0 H GLY A 45 -40.836 -27.710 -8.662 1.00 45.34 H new ATOM 0 HA2 GLY A 45 -42.529 -27.352 -7.114 1.00 63.42 H new ATOM 0 HA3 GLY A 45 -41.358 -26.957 -5.872 1.00 63.42 H new ATOM 688 N GLY A 46 -42.930 -25.009 -7.823 1.00 54.41 N ATOM 689 CA GLY A 46 -43.223 -23.622 -8.136 1.00 64.14 C ATOM 690 C GLY A 46 -42.090 -22.945 -8.883 1.00 72.30 C ATOM 691 O GLY A 46 -41.559 -23.493 -9.848 1.00 22.01 O ATOM 0 H GLY A 46 -43.646 -25.675 -8.115 1.00 54.41 H new ATOM 0 HA2 GLY A 46 -44.131 -23.572 -8.737 1.00 64.14 H new ATOM 0 HA3 GLY A 46 -43.421 -23.078 -7.212 1.00 64.14 H new ATOM 695 N GLY A 47 -41.721 -21.749 -8.436 1.00 45.35 N ATOM 696 CA GLY A 47 -40.647 -21.015 -9.082 1.00 35.12 C ATOM 697 C GLY A 47 -39.385 -21.842 -9.226 1.00 52.33 C ATOM 698 O GLY A 47 -39.193 -22.825 -8.512 1.00 13.31 O ATOM 0 H GLY A 47 -42.146 -21.275 -7.639 1.00 45.35 H new ATOM 0 HA2 GLY A 47 -40.977 -20.687 -10.068 1.00 35.12 H new ATOM 0 HA3 GLY A 47 -40.426 -20.117 -8.504 1.00 35.12 H new ATOM 702 N GLY A 48 -38.522 -21.443 -10.156 1.00 24.34 N ATOM 703 CA GLY A 48 -37.283 -22.166 -10.376 1.00 61.50 C ATOM 704 C GLY A 48 -36.100 -21.513 -9.689 1.00 70.23 C ATOM 705 O GLY A 48 -36.256 -20.654 -8.821 1.00 23.30 O ATOM 0 H GLY A 48 -38.659 -20.633 -10.760 1.00 24.34 H new ATOM 0 HA2 GLY A 48 -37.392 -23.187 -10.011 1.00 61.50 H new ATOM 0 HA3 GLY A 48 -37.088 -22.229 -11.447 1.00 61.50 H new ATOM 709 N PRO A 49 -34.884 -21.924 -10.079 1.00 1.33 N ATOM 710 CA PRO A 49 -33.646 -21.386 -9.506 1.00 71.13 C ATOM 711 C PRO A 49 -33.397 -19.939 -9.918 1.00 73.24 C ATOM 712 O PRO A 49 -32.504 -19.277 -9.388 1.00 53.33 O ATOM 713 CB PRO A 49 -32.562 -22.300 -10.083 1.00 73.31 C ATOM 714 CG PRO A 49 -33.144 -22.825 -11.350 1.00 73.11 C ATOM 715 CD PRO A 49 -34.624 -22.944 -11.108 1.00 44.23 C ATOM 0 HA PRO A 49 -33.675 -21.370 -8.416 1.00 71.13 H new ATOM 0 HB2 PRO A 49 -31.639 -21.751 -10.269 1.00 73.31 H new ATOM 0 HB3 PRO A 49 -32.318 -23.109 -9.394 1.00 73.31 H new ATOM 0 HG2 PRO A 49 -32.938 -22.152 -12.182 1.00 73.11 H new ATOM 0 HG3 PRO A 49 -32.712 -23.792 -11.607 1.00 73.11 H new ATOM 0 HD2 PRO A 49 -35.196 -22.754 -12.016 1.00 44.23 H new ATOM 0 HD3 PRO A 49 -34.896 -23.942 -10.763 1.00 44.23 H new ATOM 723 N LEU A 50 -34.192 -19.454 -10.866 1.00 22.01 N ATOM 724 CA LEU A 50 -34.058 -18.084 -11.349 1.00 52.01 C ATOM 725 C LEU A 50 -34.594 -17.090 -10.323 1.00 71.24 C ATOM 726 O LEU A 50 -34.113 -15.961 -10.228 1.00 40.11 O ATOM 727 CB LEU A 50 -34.801 -17.915 -12.676 1.00 22.43 C ATOM 728 CG LEU A 50 -34.371 -18.848 -13.809 1.00 33.45 C ATOM 729 CD1 LEU A 50 -35.560 -19.200 -14.690 1.00 22.53 C ATOM 730 CD2 LEU A 50 -33.264 -18.210 -14.634 1.00 25.40 C ATOM 0 H LEU A 50 -34.936 -19.989 -11.315 1.00 22.01 H new ATOM 0 HA LEU A 50 -32.998 -17.882 -11.505 1.00 52.01 H new ATOM 0 HB2 LEU A 50 -35.866 -18.063 -12.495 1.00 22.43 H new ATOM 0 HB3 LEU A 50 -34.675 -16.886 -13.012 1.00 22.43 H new ATOM 0 HG LEU A 50 -33.985 -19.768 -13.370 1.00 33.45 H new ATOM 0 HD11 LEU A 50 -35.235 -19.864 -15.491 1.00 22.53 H new ATOM 0 HD12 LEU A 50 -36.322 -19.699 -14.091 1.00 22.53 H new ATOM 0 HD13 LEU A 50 -35.976 -18.289 -15.121 1.00 22.53 H new ATOM 0 HD21 LEU A 50 -32.971 -18.888 -15.435 1.00 25.40 H new ATOM 0 HD22 LEU A 50 -33.623 -17.275 -15.063 1.00 25.40 H new ATOM 0 HD23 LEU A 50 -32.404 -18.009 -13.995 1.00 25.40 H new ATOM 742 N TYR A 51 -35.591 -17.519 -9.557 1.00 42.31 N ATOM 743 CA TYR A 51 -36.192 -16.667 -8.538 1.00 53.43 C ATOM 744 C TYR A 51 -35.256 -16.499 -7.346 1.00 5.02 C ATOM 745 O TYR A 51 -35.215 -15.441 -6.717 1.00 31.30 O ATOM 746 CB TYR A 51 -37.526 -17.254 -8.074 1.00 72.35 C ATOM 747 CG TYR A 51 -37.755 -17.136 -6.585 1.00 2.44 C ATOM 748 CD1 TYR A 51 -37.980 -15.899 -5.993 1.00 51.40 C ATOM 749 CD2 TYR A 51 -37.745 -18.260 -5.768 1.00 44.23 C ATOM 750 CE1 TYR A 51 -38.189 -15.785 -4.632 1.00 62.11 C ATOM 751 CE2 TYR A 51 -37.954 -18.156 -4.407 1.00 2.12 C ATOM 752 CZ TYR A 51 -38.175 -16.917 -3.843 1.00 52.54 C ATOM 753 OH TYR A 51 -38.383 -16.809 -2.487 1.00 44.33 O ATOM 0 H TYR A 51 -36.000 -18.451 -9.622 1.00 42.31 H new ATOM 0 HA TYR A 51 -36.368 -15.686 -8.979 1.00 53.43 H new ATOM 0 HB2 TYR A 51 -38.337 -16.749 -8.599 1.00 72.35 H new ATOM 0 HB3 TYR A 51 -37.569 -18.306 -8.357 1.00 72.35 H new ATOM 0 HD1 TYR A 51 -37.992 -15.011 -6.608 1.00 51.40 H new ATOM 0 HD2 TYR A 51 -37.571 -19.232 -6.205 1.00 44.23 H new ATOM 0 HE1 TYR A 51 -38.362 -14.816 -4.188 1.00 62.11 H new ATOM 0 HE2 TYR A 51 -37.944 -19.040 -3.787 1.00 2.12 H new ATOM 0 HH TYR A 51 -39.343 -16.724 -2.309 1.00 44.33 H new ATOM 763 N PHE A 52 -34.503 -17.551 -7.041 1.00 2.22 N ATOM 764 CA PHE A 52 -33.566 -17.522 -5.924 1.00 23.02 C ATOM 765 C PHE A 52 -32.490 -16.463 -6.144 1.00 5.11 C ATOM 766 O PHE A 52 -32.088 -15.767 -5.211 1.00 44.13 O ATOM 767 CB PHE A 52 -32.916 -18.895 -5.740 1.00 61.13 C ATOM 768 CG PHE A 52 -31.472 -18.825 -5.334 1.00 23.34 C ATOM 769 CD1 PHE A 52 -31.114 -18.377 -4.072 1.00 53.12 C ATOM 770 CD2 PHE A 52 -30.471 -19.207 -6.213 1.00 34.41 C ATOM 771 CE1 PHE A 52 -29.786 -18.312 -3.695 1.00 13.24 C ATOM 772 CE2 PHE A 52 -29.142 -19.145 -5.841 1.00 1.12 C ATOM 773 CZ PHE A 52 -28.799 -18.695 -4.581 1.00 22.44 C ATOM 0 H PHE A 52 -34.523 -18.434 -7.552 1.00 2.22 H new ATOM 0 HA PHE A 52 -34.123 -17.267 -5.022 1.00 23.02 H new ATOM 0 HB2 PHE A 52 -33.471 -19.452 -4.985 1.00 61.13 H new ATOM 0 HB3 PHE A 52 -32.996 -19.454 -6.672 1.00 61.13 H new ATOM 0 HD1 PHE A 52 -31.882 -18.075 -3.375 1.00 53.12 H new ATOM 0 HD2 PHE A 52 -30.733 -19.557 -7.200 1.00 34.41 H new ATOM 0 HE1 PHE A 52 -29.521 -17.962 -2.708 1.00 13.24 H new ATOM 0 HE2 PHE A 52 -28.372 -19.448 -6.535 1.00 1.12 H new ATOM 0 HZ PHE A 52 -27.760 -18.643 -4.289 1.00 22.44 H new ATOM 783 N VAL A 53 -32.026 -16.347 -7.384 1.00 73.25 N ATOM 784 CA VAL A 53 -30.997 -15.373 -7.729 1.00 32.54 C ATOM 785 C VAL A 53 -31.611 -14.017 -8.056 1.00 34.11 C ATOM 786 O VAL A 53 -30.968 -12.979 -7.903 1.00 41.20 O ATOM 787 CB VAL A 53 -30.156 -15.847 -8.929 1.00 4.43 C ATOM 788 CG1 VAL A 53 -30.650 -15.202 -10.215 1.00 21.31 C ATOM 789 CG2 VAL A 53 -28.683 -15.540 -8.700 1.00 53.35 C ATOM 0 H VAL A 53 -32.347 -16.916 -8.167 1.00 73.25 H new ATOM 0 HA VAL A 53 -30.350 -15.274 -6.858 1.00 32.54 H new ATOM 0 HB VAL A 53 -30.268 -16.927 -9.026 1.00 4.43 H new ATOM 0 HG11 VAL A 53 -30.044 -15.549 -11.052 1.00 21.31 H new ATOM 0 HG12 VAL A 53 -31.691 -15.476 -10.383 1.00 21.31 H new ATOM 0 HG13 VAL A 53 -30.569 -14.118 -10.133 1.00 21.31 H new ATOM 0 HG21 VAL A 53 -28.103 -15.881 -9.557 1.00 53.35 H new ATOM 0 HG22 VAL A 53 -28.550 -14.465 -8.577 1.00 53.35 H new ATOM 0 HG23 VAL A 53 -28.340 -16.053 -7.802 1.00 53.35 H new ATOM 799 N VAL A 54 -32.862 -14.033 -8.507 1.00 22.10 N ATOM 800 CA VAL A 54 -33.565 -12.804 -8.855 1.00 21.13 C ATOM 801 C VAL A 54 -34.043 -12.073 -7.606 1.00 14.44 C ATOM 802 O VAL A 54 -34.122 -10.845 -7.585 1.00 75.10 O ATOM 803 CB VAL A 54 -34.774 -13.088 -9.765 1.00 53.32 C ATOM 804 CG1 VAL A 54 -35.811 -11.983 -9.635 1.00 55.34 C ATOM 805 CG2 VAL A 54 -34.327 -13.244 -11.211 1.00 14.51 C ATOM 0 H VAL A 54 -33.409 -14.884 -8.640 1.00 22.10 H new ATOM 0 HA VAL A 54 -32.856 -12.174 -9.392 1.00 21.13 H new ATOM 0 HB VAL A 54 -35.234 -14.024 -9.448 1.00 53.32 H new ATOM 0 HG11 VAL A 54 -36.658 -12.201 -10.285 1.00 55.34 H new ATOM 0 HG12 VAL A 54 -36.153 -11.924 -8.602 1.00 55.34 H new ATOM 0 HG13 VAL A 54 -35.366 -11.031 -9.925 1.00 55.34 H new ATOM 0 HG21 VAL A 54 -35.194 -13.444 -11.840 1.00 14.51 H new ATOM 0 HG22 VAL A 54 -33.842 -12.326 -11.543 1.00 14.51 H new ATOM 0 HG23 VAL A 54 -33.624 -14.074 -11.287 1.00 14.51 H new ATOM 815 N ASN A 55 -34.361 -12.836 -6.565 1.00 13.31 N ATOM 816 CA ASN A 55 -34.833 -12.260 -5.311 1.00 4.14 C ATOM 817 C ASN A 55 -33.663 -11.948 -4.382 1.00 11.11 C ATOM 818 O ASN A 55 -33.761 -11.083 -3.511 1.00 33.41 O ATOM 819 CB ASN A 55 -35.806 -13.217 -4.620 1.00 22.33 C ATOM 820 CG ASN A 55 -35.134 -14.045 -3.541 1.00 14.02 C ATOM 821 OD1 ASN A 55 -35.240 -13.740 -2.353 1.00 11.22 O ATOM 822 ND2 ASN A 55 -34.439 -15.099 -3.951 1.00 63.10 N ATOM 0 H ASN A 55 -34.300 -13.854 -6.565 1.00 13.31 H new ATOM 0 HA ASN A 55 -35.351 -11.329 -5.540 1.00 4.14 H new ATOM 0 HB2 ASN A 55 -36.623 -12.645 -4.180 1.00 22.33 H new ATOM 0 HB3 ASN A 55 -36.247 -13.882 -5.363 1.00 22.33 H new ATOM 0 HD21 ASN A 55 -33.966 -15.694 -3.271 1.00 63.10 H new ATOM 0 HD22 ASN A 55 -34.378 -15.314 -4.946 1.00 63.10 H new ATOM 829 N VAL A 56 -32.556 -12.658 -4.575 1.00 2.25 N ATOM 830 CA VAL A 56 -31.366 -12.456 -3.756 1.00 33.21 C ATOM 831 C VAL A 56 -30.498 -11.335 -4.315 1.00 63.24 C ATOM 832 O VAL A 56 -30.026 -10.473 -3.574 1.00 1.13 O ATOM 833 CB VAL A 56 -30.526 -13.743 -3.661 1.00 23.33 C ATOM 834 CG1 VAL A 56 -29.095 -13.418 -3.260 1.00 21.33 C ATOM 835 CG2 VAL A 56 -31.155 -14.719 -2.678 1.00 12.34 C ATOM 0 H VAL A 56 -32.458 -13.378 -5.291 1.00 2.25 H new ATOM 0 HA VAL A 56 -31.710 -12.181 -2.759 1.00 33.21 H new ATOM 0 HB VAL A 56 -30.505 -14.215 -4.643 1.00 23.33 H new ATOM 0 HG11 VAL A 56 -28.516 -14.340 -3.198 1.00 21.33 H new ATOM 0 HG12 VAL A 56 -28.649 -12.759 -4.005 1.00 21.33 H new ATOM 0 HG13 VAL A 56 -29.093 -12.922 -2.289 1.00 21.33 H new ATOM 0 HG21 VAL A 56 -30.548 -15.623 -2.624 1.00 12.34 H new ATOM 0 HG22 VAL A 56 -31.209 -14.258 -1.692 1.00 12.34 H new ATOM 0 HG23 VAL A 56 -32.160 -14.976 -3.013 1.00 12.34 H new ATOM 845 N ILE A 57 -30.291 -11.353 -5.628 1.00 30.32 N ATOM 846 CA ILE A 57 -29.480 -10.337 -6.287 1.00 73.01 C ATOM 847 C ILE A 57 -30.233 -9.014 -6.389 1.00 24.52 C ATOM 848 O ILE A 57 -29.625 -7.952 -6.516 1.00 62.22 O ATOM 849 CB ILE A 57 -29.056 -10.784 -7.699 1.00 14.52 C ATOM 850 CG1 ILE A 57 -28.234 -12.072 -7.625 1.00 13.25 C ATOM 851 CG2 ILE A 57 -28.264 -9.682 -8.387 1.00 71.11 C ATOM 852 CD1 ILE A 57 -26.868 -11.882 -7.004 1.00 10.21 C ATOM 0 H ILE A 57 -30.674 -12.060 -6.256 1.00 30.32 H new ATOM 0 HA ILE A 57 -28.588 -10.199 -5.676 1.00 73.01 H new ATOM 0 HB ILE A 57 -29.953 -10.982 -8.286 1.00 14.52 H new ATOM 0 HG12 ILE A 57 -28.787 -12.813 -7.048 1.00 13.25 H new ATOM 0 HG13 ILE A 57 -28.114 -12.475 -8.631 1.00 13.25 H new ATOM 0 HG21 ILE A 57 -27.971 -10.012 -9.384 1.00 71.11 H new ATOM 0 HG22 ILE A 57 -28.881 -8.787 -8.468 1.00 71.11 H new ATOM 0 HG23 ILE A 57 -27.372 -9.456 -7.803 1.00 71.11 H new ATOM 0 HD11 ILE A 57 -26.341 -12.836 -6.984 1.00 10.21 H new ATOM 0 HD12 ILE A 57 -26.297 -11.165 -7.593 1.00 10.21 H new ATOM 0 HD13 ILE A 57 -26.980 -11.508 -5.986 1.00 10.21 H new ATOM 864 N GLU A 58 -31.559 -9.088 -6.330 1.00 24.11 N ATOM 865 CA GLU A 58 -32.394 -7.896 -6.415 1.00 3.45 C ATOM 866 C GLU A 58 -31.943 -6.843 -5.406 1.00 30.24 C ATOM 867 O GLU A 58 -31.556 -5.730 -5.762 1.00 72.25 O ATOM 868 CB GLU A 58 -33.861 -8.255 -6.172 1.00 20.31 C ATOM 869 CG GLU A 58 -34.752 -8.024 -7.380 1.00 53.35 C ATOM 870 CD GLU A 58 -36.158 -8.555 -7.179 1.00 71.30 C ATOM 871 OE1 GLU A 58 -36.589 -8.668 -6.013 1.00 22.35 O ATOM 872 OE2 GLU A 58 -36.828 -8.858 -8.189 1.00 44.10 O ATOM 0 H GLU A 58 -32.077 -9.960 -6.224 1.00 24.11 H new ATOM 0 HA GLU A 58 -32.290 -7.482 -7.418 1.00 3.45 H new ATOM 0 HB2 GLU A 58 -33.926 -9.303 -5.878 1.00 20.31 H new ATOM 0 HB3 GLU A 58 -34.237 -7.665 -5.336 1.00 20.31 H new ATOM 0 HG2 GLU A 58 -34.798 -6.956 -7.594 1.00 53.35 H new ATOM 0 HG3 GLU A 58 -34.308 -8.504 -8.252 1.00 53.35 H new ATOM 879 N PRO A 59 -31.994 -7.202 -4.114 1.00 53.02 N ATOM 880 CA PRO A 59 -31.596 -6.304 -3.027 1.00 4.44 C ATOM 881 C PRO A 59 -30.091 -6.058 -3.000 1.00 1.31 C ATOM 882 O PRO A 59 -29.629 -5.033 -2.496 1.00 24.40 O ATOM 883 CB PRO A 59 -32.037 -7.053 -1.767 1.00 73.33 C ATOM 884 CG PRO A 59 -32.050 -8.489 -2.166 1.00 5.23 C ATOM 885 CD PRO A 59 -32.445 -8.512 -3.616 1.00 61.53 C ATOM 0 HA PRO A 59 -32.044 -5.316 -3.131 1.00 4.44 H new ATOM 0 HB2 PRO A 59 -31.348 -6.878 -0.941 1.00 73.33 H new ATOM 0 HB3 PRO A 59 -33.022 -6.725 -1.436 1.00 73.33 H new ATOM 0 HG2 PRO A 59 -31.070 -8.943 -2.021 1.00 5.23 H new ATOM 0 HG3 PRO A 59 -32.757 -9.056 -1.560 1.00 5.23 H new ATOM 0 HD2 PRO A 59 -31.965 -9.332 -4.150 1.00 61.53 H new ATOM 0 HD3 PRO A 59 -33.521 -8.639 -3.737 1.00 61.53 H new ATOM 893 N CYS A 60 -29.332 -7.002 -3.545 1.00 53.12 N ATOM 894 CA CYS A 60 -27.879 -6.887 -3.584 1.00 24.44 C ATOM 895 C CYS A 60 -27.447 -5.746 -4.498 1.00 51.32 C ATOM 896 O CYS A 60 -26.417 -5.110 -4.272 1.00 52.15 O ATOM 897 CB CYS A 60 -27.255 -8.201 -4.058 1.00 52.34 C ATOM 898 SG CYS A 60 -26.146 -8.969 -2.855 1.00 33.25 S ATOM 0 H CYS A 60 -29.699 -7.856 -3.966 1.00 53.12 H new ATOM 0 HA CYS A 60 -27.530 -6.671 -2.574 1.00 24.44 H new ATOM 0 HB2 CYS A 60 -28.053 -8.903 -4.300 1.00 52.34 H new ATOM 0 HB3 CYS A 60 -26.702 -8.017 -4.979 1.00 52.34 H new ATOM 0 HG CYS A 60 -25.671 -10.075 -3.347 1.00 33.25 H new ATOM 904 N LYS A 61 -28.241 -5.491 -5.533 1.00 21.30 N ATOM 905 CA LYS A 61 -27.942 -4.427 -6.483 1.00 53.43 C ATOM 906 C LYS A 61 -27.797 -3.086 -5.770 1.00 44.04 C ATOM 907 O LYS A 61 -26.738 -2.459 -5.815 1.00 52.34 O ATOM 908 CB LYS A 61 -29.044 -4.336 -7.542 1.00 23.20 C ATOM 909 CG LYS A 61 -29.022 -5.480 -8.541 1.00 52.01 C ATOM 910 CD LYS A 61 -28.445 -5.043 -9.877 1.00 3.21 C ATOM 911 CE LYS A 61 -29.504 -4.398 -10.758 1.00 3.44 C ATOM 912 NZ LYS A 61 -29.315 -4.742 -12.194 1.00 53.42 N ATOM 0 H LYS A 61 -29.097 -6.008 -5.735 1.00 21.30 H new ATOM 0 HA LYS A 61 -26.996 -4.664 -6.970 1.00 53.43 H new ATOM 0 HB2 LYS A 61 -30.014 -4.317 -7.045 1.00 23.20 H new ATOM 0 HB3 LYS A 61 -28.943 -3.393 -8.079 1.00 23.20 H new ATOM 0 HG2 LYS A 61 -28.430 -6.303 -8.140 1.00 52.01 H new ATOM 0 HG3 LYS A 61 -30.034 -5.857 -8.687 1.00 52.01 H new ATOM 0 HD2 LYS A 61 -27.631 -4.338 -9.710 1.00 3.21 H new ATOM 0 HD3 LYS A 61 -28.019 -5.905 -10.390 1.00 3.21 H new ATOM 0 HE2 LYS A 61 -30.493 -4.722 -10.434 1.00 3.44 H new ATOM 0 HE3 LYS A 61 -29.468 -3.315 -10.636 1.00 3.44 H new ATOM 0 HZ1 LYS A 61 -30.056 -4.283 -12.761 1.00 53.42 H new ATOM 0 HZ2 LYS A 61 -28.382 -4.410 -12.511 1.00 53.42 H new ATOM 0 HZ3 LYS A 61 -29.375 -5.773 -12.315 1.00 53.42 H new ATOM 926 N LYS A 62 -28.866 -2.652 -5.111 1.00 63.42 N ATOM 927 CA LYS A 62 -28.857 -1.388 -4.386 1.00 10.42 C ATOM 928 C LYS A 62 -27.724 -1.354 -3.365 1.00 14.23 C ATOM 929 O LYS A 62 -27.243 -0.284 -2.992 1.00 12.42 O ATOM 930 CB LYS A 62 -30.199 -1.170 -3.683 1.00 23.15 C ATOM 931 CG LYS A 62 -31.088 -0.150 -4.371 1.00 53.25 C ATOM 932 CD LYS A 62 -32.533 -0.271 -3.916 1.00 23.32 C ATOM 933 CE LYS A 62 -33.305 1.016 -4.162 1.00 71.42 C ATOM 934 NZ LYS A 62 -33.986 1.499 -2.929 1.00 72.51 N ATOM 0 H LYS A 62 -29.750 -3.158 -5.064 1.00 63.42 H new ATOM 0 HA LYS A 62 -28.697 -0.586 -5.106 1.00 10.42 H new ATOM 0 HB2 LYS A 62 -30.728 -2.121 -3.626 1.00 23.15 H new ATOM 0 HB3 LYS A 62 -30.014 -0.846 -2.659 1.00 23.15 H new ATOM 0 HG2 LYS A 62 -30.722 0.855 -4.159 1.00 53.25 H new ATOM 0 HG3 LYS A 62 -31.033 -0.288 -5.451 1.00 53.25 H new ATOM 0 HD2 LYS A 62 -33.015 -1.092 -4.446 1.00 23.32 H new ATOM 0 HD3 LYS A 62 -32.562 -0.516 -2.854 1.00 23.32 H new ATOM 0 HE2 LYS A 62 -32.623 1.785 -4.525 1.00 71.42 H new ATOM 0 HE3 LYS A 62 -34.045 0.851 -4.945 1.00 71.42 H new ATOM 0 HZ1 LYS A 62 -34.501 2.378 -3.138 1.00 72.51 H new ATOM 0 HZ2 LYS A 62 -34.656 0.776 -2.596 1.00 72.51 H new ATOM 0 HZ3 LYS A 62 -33.278 1.681 -2.190 1.00 72.51 H new ATOM 948 N PHE A 63 -27.302 -2.532 -2.917 1.00 51.40 N ATOM 949 CA PHE A 63 -26.225 -2.636 -1.939 1.00 72.44 C ATOM 950 C PHE A 63 -24.862 -2.550 -2.620 1.00 53.11 C ATOM 951 O PHE A 63 -23.870 -2.169 -2.000 1.00 24.44 O ATOM 952 CB PHE A 63 -26.338 -3.951 -1.164 1.00 0.41 C ATOM 953 CG PHE A 63 -25.009 -4.561 -0.822 1.00 62.13 C ATOM 954 CD1 PHE A 63 -24.362 -4.230 0.357 1.00 11.35 C ATOM 955 CD2 PHE A 63 -24.406 -5.467 -1.681 1.00 13.53 C ATOM 956 CE1 PHE A 63 -23.139 -4.789 0.674 1.00 63.54 C ATOM 957 CE2 PHE A 63 -23.183 -6.030 -1.370 1.00 10.14 C ATOM 958 CZ PHE A 63 -22.549 -5.692 -0.190 1.00 40.53 C ATOM 0 H PHE A 63 -27.689 -3.427 -3.215 1.00 51.40 H new ATOM 0 HA PHE A 63 -26.317 -1.802 -1.243 1.00 72.44 H new ATOM 0 HB2 PHE A 63 -26.895 -3.775 -0.244 1.00 0.41 H new ATOM 0 HB3 PHE A 63 -26.915 -4.663 -1.754 1.00 0.41 H new ATOM 0 HD1 PHE A 63 -24.819 -3.526 1.037 1.00 11.35 H new ATOM 0 HD2 PHE A 63 -24.898 -5.736 -2.604 1.00 13.53 H new ATOM 0 HE1 PHE A 63 -22.645 -4.521 1.596 1.00 63.54 H new ATOM 0 HE2 PHE A 63 -22.723 -6.733 -2.049 1.00 10.14 H new ATOM 0 HZ PHE A 63 -21.594 -6.133 0.057 1.00 40.53 H new ATOM 968 N SER A 64 -24.823 -2.906 -3.900 1.00 71.40 N ATOM 969 CA SER A 64 -23.582 -2.874 -4.665 1.00 10.31 C ATOM 970 C SER A 64 -22.920 -1.503 -4.568 1.00 1.33 C ATOM 971 O SER A 64 -21.696 -1.397 -4.504 1.00 3.45 O ATOM 972 CB SER A 64 -23.852 -3.219 -6.131 1.00 33.45 C ATOM 973 OG SER A 64 -22.877 -4.117 -6.631 1.00 45.11 O ATOM 0 H SER A 64 -25.637 -3.220 -4.429 1.00 71.40 H new ATOM 0 HA SER A 64 -22.905 -3.617 -4.243 1.00 10.31 H new ATOM 0 HB2 SER A 64 -24.843 -3.663 -6.227 1.00 33.45 H new ATOM 0 HB3 SER A 64 -23.852 -2.307 -6.728 1.00 33.45 H new ATOM 0 HG SER A 64 -23.073 -4.323 -7.569 1.00 45.11 H new ATOM 979 N GLU A 65 -23.739 -0.456 -4.558 1.00 14.04 N ATOM 980 CA GLU A 65 -23.233 0.909 -4.469 1.00 74.33 C ATOM 981 C GLU A 65 -22.904 1.274 -3.025 1.00 5.30 C ATOM 982 O GLU A 65 -22.120 2.189 -2.767 1.00 41.15 O ATOM 983 CB GLU A 65 -24.258 1.894 -5.035 1.00 34.01 C ATOM 984 CG GLU A 65 -24.484 1.746 -6.530 1.00 41.23 C ATOM 985 CD GLU A 65 -23.768 2.813 -7.336 1.00 74.24 C ATOM 986 OE1 GLU A 65 -22.568 2.631 -7.629 1.00 32.01 O ATOM 987 OE2 GLU A 65 -24.410 3.830 -7.675 1.00 23.32 O ATOM 0 H GLU A 65 -24.755 -0.527 -4.610 1.00 14.04 H new ATOM 0 HA GLU A 65 -22.318 0.969 -5.058 1.00 74.33 H new ATOM 0 HB2 GLU A 65 -25.207 1.755 -4.517 1.00 34.01 H new ATOM 0 HB3 GLU A 65 -23.926 2.911 -4.825 1.00 34.01 H new ATOM 0 HG2 GLU A 65 -24.141 0.762 -6.850 1.00 41.23 H new ATOM 0 HG3 GLU A 65 -25.553 1.794 -6.739 1.00 41.23 H new ATOM 994 N LEU A 66 -23.507 0.554 -2.086 1.00 71.11 N ATOM 995 CA LEU A 66 -23.279 0.802 -0.667 1.00 22.43 C ATOM 996 C LEU A 66 -21.868 0.387 -0.262 1.00 1.23 C ATOM 997 O LEU A 66 -21.235 1.032 0.575 1.00 12.22 O ATOM 998 CB LEU A 66 -24.307 0.044 0.175 1.00 22.32 C ATOM 999 CG LEU A 66 -25.770 0.426 -0.048 1.00 74.12 C ATOM 1000 CD1 LEU A 66 -26.675 -0.353 0.894 1.00 12.31 C ATOM 1001 CD2 LEU A 66 -25.965 1.924 0.139 1.00 60.53 C ATOM 0 H LEU A 66 -24.158 -0.207 -2.282 1.00 71.11 H new ATOM 0 HA LEU A 66 -23.389 1.872 -0.488 1.00 22.43 H new ATOM 0 HB2 LEU A 66 -24.196 -1.022 -0.025 1.00 22.32 H new ATOM 0 HB3 LEU A 66 -24.069 0.197 1.228 1.00 22.32 H new ATOM 0 HG LEU A 66 -26.040 0.170 -1.073 1.00 74.12 H new ATOM 0 HD11 LEU A 66 -27.713 -0.068 0.721 1.00 12.31 H new ATOM 0 HD12 LEU A 66 -26.557 -1.421 0.712 1.00 12.31 H new ATOM 0 HD13 LEU A 66 -26.405 -0.129 1.926 1.00 12.31 H new ATOM 0 HD21 LEU A 66 -27.013 2.178 -0.024 1.00 60.53 H new ATOM 0 HD22 LEU A 66 -25.677 2.205 1.152 1.00 60.53 H new ATOM 0 HD23 LEU A 66 -25.346 2.464 -0.577 1.00 60.53 H new ATOM 1013 N THR A 67 -21.378 -0.693 -0.863 1.00 13.05 N ATOM 1014 CA THR A 67 -20.042 -1.193 -0.565 1.00 71.35 C ATOM 1015 C THR A 67 -18.976 -0.170 -0.940 1.00 11.01 C ATOM 1016 O THR A 67 -17.842 -0.239 -0.467 1.00 53.13 O ATOM 1017 CB THR A 67 -19.757 -2.511 -1.311 1.00 0.22 C ATOM 1018 OG1 THR A 67 -20.865 -3.406 -1.164 1.00 25.44 O ATOM 1019 CG2 THR A 67 -18.492 -3.169 -0.781 1.00 60.33 C ATOM 0 H THR A 67 -21.887 -1.238 -1.559 1.00 13.05 H new ATOM 0 HA THR A 67 -20.005 -1.376 0.509 1.00 71.35 H new ATOM 0 HB THR A 67 -19.613 -2.282 -2.367 1.00 0.22 H new ATOM 0 HG1 THR A 67 -20.659 -4.071 -0.474 1.00 25.44 H new ATOM 0 HG21 THR A 67 -18.311 -4.098 -1.322 1.00 60.33 H new ATOM 0 HG22 THR A 67 -17.646 -2.496 -0.921 1.00 60.33 H new ATOM 0 HG23 THR A 67 -18.612 -3.385 0.281 1.00 60.33 H new ATOM 1027 N GLY A 68 -19.348 0.781 -1.792 1.00 62.42 N ATOM 1028 CA GLY A 68 -18.411 1.805 -2.215 1.00 14.40 C ATOM 1029 C GLY A 68 -18.601 3.109 -1.465 1.00 21.11 C ATOM 1030 O GLY A 68 -17.743 3.992 -1.513 1.00 32.24 O ATOM 0 H GLY A 68 -20.281 0.860 -2.196 1.00 62.42 H new ATOM 0 HA2 GLY A 68 -17.393 1.447 -2.063 1.00 14.40 H new ATOM 0 HA3 GLY A 68 -18.530 1.983 -3.284 1.00 14.40 H new ATOM 1034 N LEU A 69 -19.727 3.232 -0.771 1.00 51.14 N ATOM 1035 CA LEU A 69 -20.028 4.439 -0.008 1.00 62.35 C ATOM 1036 C LEU A 69 -19.521 4.317 1.425 1.00 33.21 C ATOM 1037 O LEU A 69 -19.532 5.287 2.183 1.00 23.10 O ATOM 1038 CB LEU A 69 -21.534 4.704 -0.008 1.00 74.53 C ATOM 1039 CG LEU A 69 -21.958 6.169 0.094 1.00 53.13 C ATOM 1040 CD1 LEU A 69 -21.387 6.972 -1.065 1.00 22.13 C ATOM 1041 CD2 LEU A 69 -23.475 6.284 0.128 1.00 52.51 C ATOM 0 H LEU A 69 -20.447 2.511 -0.721 1.00 51.14 H new ATOM 0 HA LEU A 69 -19.519 5.277 -0.484 1.00 62.35 H new ATOM 0 HB2 LEU A 69 -21.956 4.287 -0.923 1.00 74.53 H new ATOM 0 HB3 LEU A 69 -21.978 4.159 0.825 1.00 74.53 H new ATOM 0 HG LEU A 69 -21.561 6.578 1.023 1.00 53.13 H new ATOM 0 HD11 LEU A 69 -21.699 8.012 -0.976 1.00 22.13 H new ATOM 0 HD12 LEU A 69 -20.299 6.917 -1.045 1.00 22.13 H new ATOM 0 HD13 LEU A 69 -21.753 6.563 -2.007 1.00 22.13 H new ATOM 0 HD21 LEU A 69 -23.759 7.334 0.201 1.00 52.51 H new ATOM 0 HD22 LEU A 69 -23.893 5.858 -0.784 1.00 52.51 H new ATOM 0 HD23 LEU A 69 -23.862 5.743 0.992 1.00 52.51 H new ATOM 1053 N VAL A 70 -19.076 3.119 1.790 1.00 30.32 N ATOM 1054 CA VAL A 70 -18.562 2.870 3.132 1.00 41.42 C ATOM 1055 C VAL A 70 -17.044 3.008 3.173 1.00 51.12 C ATOM 1056 O VAL A 70 -16.474 3.412 4.186 1.00 22.15 O ATOM 1057 CB VAL A 70 -18.953 1.467 3.632 1.00 42.02 C ATOM 1058 CG1 VAL A 70 -17.956 0.973 4.669 1.00 31.22 C ATOM 1059 CG2 VAL A 70 -20.364 1.478 4.199 1.00 12.13 C ATOM 0 H VAL A 70 -19.061 2.305 1.175 1.00 30.32 H new ATOM 0 HA VAL A 70 -19.010 3.618 3.786 1.00 41.42 H new ATOM 0 HB VAL A 70 -18.932 0.779 2.786 1.00 42.02 H new ATOM 0 HG11 VAL A 70 -18.248 -0.020 5.011 1.00 31.22 H new ATOM 0 HG12 VAL A 70 -16.962 0.925 4.224 1.00 31.22 H new ATOM 0 HG13 VAL A 70 -17.942 1.659 5.516 1.00 31.22 H new ATOM 0 HG21 VAL A 70 -20.624 0.478 4.548 1.00 12.13 H new ATOM 0 HG22 VAL A 70 -20.416 2.178 5.033 1.00 12.13 H new ATOM 0 HG23 VAL A 70 -21.065 1.785 3.423 1.00 12.13 H new ATOM 1069 N PHE A 71 -16.395 2.670 2.064 1.00 43.12 N ATOM 1070 CA PHE A 71 -14.942 2.755 1.973 1.00 42.34 C ATOM 1071 C PHE A 71 -14.515 4.051 1.289 1.00 1.11 C ATOM 1072 O PHE A 71 -13.325 4.301 1.097 1.00 42.50 O ATOM 1073 CB PHE A 71 -14.386 1.554 1.205 1.00 34.21 C ATOM 1074 CG PHE A 71 -14.279 0.308 2.038 1.00 54.24 C ATOM 1075 CD1 PHE A 71 -15.417 -0.381 2.426 1.00 10.13 C ATOM 1076 CD2 PHE A 71 -13.042 -0.174 2.431 1.00 65.01 C ATOM 1077 CE1 PHE A 71 -15.321 -1.527 3.193 1.00 13.20 C ATOM 1078 CE2 PHE A 71 -12.940 -1.320 3.197 1.00 4.23 C ATOM 1079 CZ PHE A 71 -14.081 -1.998 3.578 1.00 51.41 C ATOM 0 H PHE A 71 -16.852 2.335 1.216 1.00 43.12 H new ATOM 0 HA PHE A 71 -14.539 2.748 2.986 1.00 42.34 H new ATOM 0 HB2 PHE A 71 -15.027 1.354 0.346 1.00 34.21 H new ATOM 0 HB3 PHE A 71 -13.400 1.807 0.815 1.00 34.21 H new ATOM 0 HD1 PHE A 71 -16.389 -0.019 2.126 1.00 10.13 H new ATOM 0 HD2 PHE A 71 -12.146 0.352 2.136 1.00 65.01 H new ATOM 0 HE1 PHE A 71 -16.215 -2.054 3.491 1.00 13.20 H new ATOM 0 HE2 PHE A 71 -11.969 -1.685 3.497 1.00 4.23 H new ATOM 0 HZ PHE A 71 -14.004 -2.894 4.176 1.00 51.41 H new ATOM 1089 N TYR A 72 -15.494 4.871 0.924 1.00 34.40 N ATOM 1090 CA TYR A 72 -15.222 6.139 0.259 1.00 4.31 C ATOM 1091 C TYR A 72 -15.732 7.311 1.092 1.00 42.53 C ATOM 1092 O TYR A 72 -14.961 8.181 1.499 1.00 2.34 O ATOM 1093 CB TYR A 72 -15.870 6.163 -1.126 1.00 63.22 C ATOM 1094 CG TYR A 72 -15.260 7.181 -2.063 1.00 24.30 C ATOM 1095 CD1 TYR A 72 -13.882 7.270 -2.222 1.00 20.43 C ATOM 1096 CD2 TYR A 72 -16.060 8.054 -2.788 1.00 51.25 C ATOM 1097 CE1 TYR A 72 -13.320 8.198 -3.076 1.00 2.51 C ATOM 1098 CE2 TYR A 72 -15.507 8.985 -3.646 1.00 42.20 C ATOM 1099 CZ TYR A 72 -14.136 9.054 -3.786 1.00 74.42 C ATOM 1100 OH TYR A 72 -13.581 9.981 -4.638 1.00 73.44 O ATOM 0 H TYR A 72 -16.484 4.680 1.078 1.00 34.40 H new ATOM 0 HA TYR A 72 -14.142 6.237 0.149 1.00 4.31 H new ATOM 0 HB2 TYR A 72 -15.786 5.173 -1.574 1.00 63.22 H new ATOM 0 HB3 TYR A 72 -16.934 6.374 -1.016 1.00 63.22 H new ATOM 0 HD1 TYR A 72 -13.240 6.602 -1.668 1.00 20.43 H new ATOM 0 HD2 TYR A 72 -17.133 8.004 -2.679 1.00 51.25 H new ATOM 0 HE1 TYR A 72 -12.247 8.253 -3.188 1.00 2.51 H new ATOM 0 HE2 TYR A 72 -16.144 9.655 -4.204 1.00 42.20 H new ATOM 0 HH TYR A 72 -14.293 10.504 -5.061 1.00 73.44 H new ATOM 1110 N LEU A 73 -17.037 7.328 1.341 1.00 65.40 N ATOM 1111 CA LEU A 73 -17.652 8.392 2.126 1.00 74.01 C ATOM 1112 C LEU A 73 -18.755 7.839 3.022 1.00 35.15 C ATOM 1113 O LEU A 73 -19.946 8.008 2.759 1.00 33.52 O ATOM 1114 CB LEU A 73 -18.223 9.469 1.202 1.00 43.42 C ATOM 1115 CG LEU A 73 -17.301 10.651 0.899 1.00 4.03 C ATOM 1116 CD1 LEU A 73 -17.606 11.228 -0.474 1.00 50.51 C ATOM 1117 CD2 LEU A 73 -17.436 11.722 1.972 1.00 32.42 C ATOM 0 H LEU A 73 -17.689 6.617 1.011 1.00 65.40 H new ATOM 0 HA LEU A 73 -16.883 8.835 2.759 1.00 74.01 H new ATOM 0 HB2 LEU A 73 -18.501 9.000 0.258 1.00 43.42 H new ATOM 0 HB3 LEU A 73 -19.140 9.854 1.649 1.00 43.42 H new ATOM 0 HG LEU A 73 -16.272 10.293 0.899 1.00 4.03 H new ATOM 0 HD11 LEU A 73 -16.940 12.068 -0.672 1.00 50.51 H new ATOM 0 HD12 LEU A 73 -17.457 10.460 -1.233 1.00 50.51 H new ATOM 0 HD13 LEU A 73 -18.640 11.570 -0.503 1.00 50.51 H new ATOM 0 HD21 LEU A 73 -16.773 12.555 1.740 1.00 32.42 H new ATOM 0 HD22 LEU A 73 -18.466 12.077 2.005 1.00 32.42 H new ATOM 0 HD23 LEU A 73 -17.166 11.302 2.941 1.00 32.42 H new ATOM 1129 N PRO A 74 -18.352 7.164 4.109 1.00 33.12 N ATOM 1130 CA PRO A 74 -19.291 6.575 5.069 1.00 71.24 C ATOM 1131 C PRO A 74 -20.031 7.633 5.880 1.00 72.11 C ATOM 1132 O PRO A 74 -19.417 8.533 6.453 1.00 10.50 O ATOM 1133 CB PRO A 74 -18.389 5.737 5.979 1.00 54.23 C ATOM 1134 CG PRO A 74 -17.051 6.384 5.885 1.00 3.30 C ATOM 1135 CD PRO A 74 -16.949 6.924 4.485 1.00 1.33 C ATOM 0 HA PRO A 74 -20.073 5.999 4.574 1.00 71.24 H new ATOM 0 HB2 PRO A 74 -18.756 5.733 7.005 1.00 54.23 H new ATOM 0 HB3 PRO A 74 -18.351 4.698 5.651 1.00 54.23 H new ATOM 0 HG2 PRO A 74 -16.952 7.183 6.620 1.00 3.30 H new ATOM 0 HG3 PRO A 74 -16.256 5.666 6.085 1.00 3.30 H new ATOM 0 HD2 PRO A 74 -16.361 7.841 4.450 1.00 1.33 H new ATOM 0 HD3 PRO A 74 -16.469 6.212 3.814 1.00 1.33 H new ATOM 1143 N THR A 75 -21.355 7.519 5.925 1.00 20.32 N ATOM 1144 CA THR A 75 -22.179 8.466 6.666 1.00 61.33 C ATOM 1145 C THR A 75 -21.773 8.517 8.134 1.00 31.42 C ATOM 1146 O THR A 75 -22.032 9.501 8.826 1.00 54.40 O ATOM 1147 CB THR A 75 -23.673 8.105 6.570 1.00 33.10 C ATOM 1148 OG1 THR A 75 -24.101 8.147 5.204 1.00 21.41 O ATOM 1149 CG2 THR A 75 -24.515 9.062 7.400 1.00 54.43 C ATOM 0 H THR A 75 -21.879 6.780 5.457 1.00 20.32 H new ATOM 0 HA THR A 75 -22.020 9.445 6.214 1.00 61.33 H new ATOM 0 HB THR A 75 -23.806 7.096 6.961 1.00 33.10 H new ATOM 0 HG1 THR A 75 -25.052 7.915 5.152 1.00 21.41 H new ATOM 0 HG21 THR A 75 -25.567 8.787 7.317 1.00 54.43 H new ATOM 0 HG22 THR A 75 -24.207 9.006 8.444 1.00 54.43 H new ATOM 0 HG23 THR A 75 -24.376 10.080 7.035 1.00 54.43 H new ATOM 1157 N ASP A 76 -21.135 7.450 8.604 1.00 10.40 N ATOM 1158 CA ASP A 76 -20.691 7.374 9.991 1.00 14.42 C ATOM 1159 C ASP A 76 -19.907 6.090 10.241 1.00 3.42 C ATOM 1160 O ASP A 76 -19.598 5.348 9.309 1.00 51.21 O ATOM 1161 CB ASP A 76 -21.891 7.446 10.937 1.00 11.12 C ATOM 1162 CG ASP A 76 -21.580 8.208 12.210 1.00 24.25 C ATOM 1163 OD1 ASP A 76 -20.402 8.213 12.625 1.00 2.10 O ATOM 1164 OD2 ASP A 76 -22.514 8.798 12.793 1.00 62.21 O ATOM 0 H ASP A 76 -20.914 6.626 8.045 1.00 10.40 H new ATOM 0 HA ASP A 76 -20.034 8.222 10.184 1.00 14.42 H new ATOM 0 HB2 ASP A 76 -22.725 7.925 10.425 1.00 11.12 H new ATOM 0 HB3 ASP A 76 -22.211 6.435 11.191 1.00 11.12 H new ATOM 1169 N SER A 77 -19.586 5.835 11.506 1.00 51.53 N ATOM 1170 CA SER A 77 -18.833 4.644 11.878 1.00 62.30 C ATOM 1171 C SER A 77 -19.611 3.378 11.529 1.00 3.43 C ATOM 1172 O SER A 77 -19.047 2.287 11.466 1.00 64.04 O ATOM 1173 CB SER A 77 -18.513 4.663 13.374 1.00 41.31 C ATOM 1174 OG SER A 77 -19.666 4.972 14.138 1.00 62.30 O ATOM 0 H SER A 77 -19.836 6.438 12.290 1.00 51.53 H new ATOM 0 HA SER A 77 -17.900 4.644 11.314 1.00 62.30 H new ATOM 0 HB2 SER A 77 -18.121 3.692 13.678 1.00 41.31 H new ATOM 0 HB3 SER A 77 -17.733 5.398 13.573 1.00 41.31 H new ATOM 0 HG SER A 77 -19.436 4.976 15.091 1.00 62.30 H new ATOM 1180 N GLY A 78 -20.912 3.534 11.304 1.00 1.22 N ATOM 1181 CA GLY A 78 -21.747 2.397 10.965 1.00 15.20 C ATOM 1182 C GLY A 78 -23.116 2.813 10.462 1.00 63.30 C ATOM 1183 O GLY A 78 -24.096 2.091 10.643 1.00 65.32 O ATOM 0 H GLY A 78 -21.402 4.427 11.350 1.00 1.22 H new ATOM 0 HA2 GLY A 78 -21.249 1.799 10.202 1.00 15.20 H new ATOM 0 HA3 GLY A 78 -21.863 1.761 11.843 1.00 15.20 H new ATOM 1187 N GLU A 79 -23.183 3.980 9.830 1.00 2.53 N ATOM 1188 CA GLU A 79 -24.442 4.491 9.302 1.00 14.22 C ATOM 1189 C GLU A 79 -24.723 3.919 7.916 1.00 73.41 C ATOM 1190 O GLU A 79 -25.844 3.505 7.617 1.00 0.34 O ATOM 1191 CB GLU A 79 -24.412 6.020 9.238 1.00 22.30 C ATOM 1192 CG GLU A 79 -24.986 6.692 10.474 1.00 41.45 C ATOM 1193 CD GLU A 79 -26.492 6.542 10.573 1.00 5.21 C ATOM 1194 OE1 GLU A 79 -27.060 5.742 9.800 1.00 4.23 O ATOM 1195 OE2 GLU A 79 -27.101 7.224 11.423 1.00 75.01 O ATOM 0 H GLU A 79 -22.380 4.589 9.671 1.00 2.53 H new ATOM 0 HA GLU A 79 -25.241 4.178 9.974 1.00 14.22 H new ATOM 0 HB2 GLU A 79 -23.382 6.349 9.101 1.00 22.30 H new ATOM 0 HB3 GLU A 79 -24.971 6.350 8.363 1.00 22.30 H new ATOM 0 HG2 GLU A 79 -24.523 6.265 11.363 1.00 41.45 H new ATOM 0 HG3 GLU A 79 -24.730 7.751 10.459 1.00 41.45 H new ATOM 1202 N LYS A 80 -23.697 3.898 7.072 1.00 73.01 N ATOM 1203 CA LYS A 80 -23.831 3.376 5.717 1.00 40.00 C ATOM 1204 C LYS A 80 -23.743 1.853 5.709 1.00 2.24 C ATOM 1205 O LYS A 80 -24.391 1.189 4.901 1.00 23.00 O ATOM 1206 CB LYS A 80 -22.746 3.965 4.812 1.00 31.23 C ATOM 1207 CG LYS A 80 -23.252 5.061 3.890 1.00 21.50 C ATOM 1208 CD LYS A 80 -24.298 4.535 2.921 1.00 11.33 C ATOM 1209 CE LYS A 80 -25.505 5.458 2.851 1.00 74.24 C ATOM 1210 NZ LYS A 80 -26.336 5.193 1.643 1.00 22.03 N ATOM 0 H LYS A 80 -22.763 4.237 7.303 1.00 73.01 H new ATOM 0 HA LYS A 80 -24.810 3.668 5.337 1.00 40.00 H new ATOM 0 HB2 LYS A 80 -21.945 4.365 5.433 1.00 31.23 H new ATOM 0 HB3 LYS A 80 -22.314 3.166 4.210 1.00 31.23 H new ATOM 0 HG2 LYS A 80 -23.679 5.869 4.484 1.00 21.50 H new ATOM 0 HG3 LYS A 80 -22.416 5.483 3.331 1.00 21.50 H new ATOM 0 HD2 LYS A 80 -23.858 4.433 1.929 1.00 11.33 H new ATOM 0 HD3 LYS A 80 -24.617 3.540 3.232 1.00 11.33 H new ATOM 0 HE2 LYS A 80 -26.114 5.329 3.746 1.00 74.24 H new ATOM 0 HE3 LYS A 80 -25.169 6.495 2.841 1.00 74.24 H new ATOM 0 HZ1 LYS A 80 -26.678 6.094 1.252 1.00 22.03 H new ATOM 0 HZ2 LYS A 80 -25.763 4.701 0.928 1.00 22.03 H new ATOM 0 HZ3 LYS A 80 -27.148 4.598 1.904 1.00 22.03 H new ATOM 1224 N MET A 81 -22.938 1.307 6.615 1.00 14.14 N ATOM 1225 CA MET A 81 -22.769 -0.138 6.714 1.00 44.01 C ATOM 1226 C MET A 81 -24.039 -0.800 7.237 1.00 31.24 C ATOM 1227 O MET A 81 -24.555 -1.742 6.635 1.00 64.43 O ATOM 1228 CB MET A 81 -21.590 -0.473 7.630 1.00 71.20 C ATOM 1229 CG MET A 81 -20.332 0.320 7.316 1.00 22.13 C ATOM 1230 SD MET A 81 -19.007 0.018 8.502 1.00 60.04 S ATOM 1231 CE MET A 81 -18.233 1.632 8.562 1.00 24.11 C ATOM 0 H MET A 81 -22.393 1.843 7.290 1.00 14.14 H new ATOM 0 HA MET A 81 -22.565 -0.524 5.715 1.00 44.01 H new ATOM 0 HB2 MET A 81 -21.879 -0.285 8.664 1.00 71.20 H new ATOM 0 HB3 MET A 81 -21.368 -1.537 7.549 1.00 71.20 H new ATOM 0 HG2 MET A 81 -19.985 0.062 6.316 1.00 22.13 H new ATOM 0 HG3 MET A 81 -20.570 1.384 7.306 1.00 22.13 H new ATOM 0 HE1 MET A 81 -17.633 1.715 9.469 1.00 24.11 H new ATOM 0 HE2 MET A 81 -17.592 1.761 7.690 1.00 24.11 H new ATOM 0 HE3 MET A 81 -19.002 2.404 8.564 1.00 24.11 H new ATOM 1241 N THR A 82 -24.540 -0.302 8.364 1.00 71.04 N ATOM 1242 CA THR A 82 -25.749 -0.846 8.969 1.00 70.32 C ATOM 1243 C THR A 82 -26.896 -0.887 7.965 1.00 1.25 C ATOM 1244 O THR A 82 -27.783 -1.734 8.058 1.00 70.53 O ATOM 1245 CB THR A 82 -26.184 -0.022 10.195 1.00 4.31 C ATOM 1246 OG1 THR A 82 -27.165 -0.743 10.948 1.00 71.22 O ATOM 1247 CG2 THR A 82 -26.752 1.323 9.769 1.00 50.41 C ATOM 0 H THR A 82 -24.126 0.477 8.876 1.00 71.04 H new ATOM 0 HA THR A 82 -25.513 -1.861 9.288 1.00 70.32 H new ATOM 0 HB THR A 82 -25.306 0.153 10.817 1.00 4.31 H new ATOM 0 HG1 THR A 82 -27.435 -0.212 11.726 1.00 71.22 H new ATOM 0 HG21 THR A 82 -27.052 1.887 10.652 1.00 50.41 H new ATOM 0 HG22 THR A 82 -25.993 1.882 9.222 1.00 50.41 H new ATOM 0 HG23 THR A 82 -27.619 1.165 9.127 1.00 50.41 H new ATOM 1255 N GLU A 83 -26.871 0.035 7.007 1.00 21.44 N ATOM 1256 CA GLU A 83 -27.910 0.103 5.987 1.00 71.22 C ATOM 1257 C GLU A 83 -27.677 -0.945 4.902 1.00 35.45 C ATOM 1258 O GLU A 83 -28.624 -1.447 4.296 1.00 42.24 O ATOM 1259 CB GLU A 83 -27.951 1.499 5.362 1.00 72.23 C ATOM 1260 CG GLU A 83 -29.308 1.869 4.787 1.00 32.21 C ATOM 1261 CD GLU A 83 -29.235 3.038 3.825 1.00 51.33 C ATOM 1262 OE1 GLU A 83 -28.145 3.277 3.263 1.00 31.45 O ATOM 1263 OE2 GLU A 83 -30.267 3.715 3.633 1.00 62.01 O ATOM 0 H GLU A 83 -26.143 0.744 6.917 1.00 21.44 H new ATOM 0 HA GLU A 83 -28.868 -0.102 6.466 1.00 71.22 H new ATOM 0 HB2 GLU A 83 -27.673 2.234 6.117 1.00 72.23 H new ATOM 0 HB3 GLU A 83 -27.203 1.556 4.571 1.00 72.23 H new ATOM 0 HG2 GLU A 83 -29.728 1.005 4.272 1.00 32.21 H new ATOM 0 HG3 GLU A 83 -29.989 2.116 5.602 1.00 32.21 H new ATOM 1270 N SER A 84 -26.411 -1.271 4.664 1.00 1.14 N ATOM 1271 CA SER A 84 -26.052 -2.256 3.650 1.00 15.35 C ATOM 1272 C SER A 84 -26.121 -3.670 4.219 1.00 51.03 C ATOM 1273 O SER A 84 -26.236 -4.645 3.476 1.00 32.53 O ATOM 1274 CB SER A 84 -24.647 -1.977 3.113 1.00 33.52 C ATOM 1275 OG SER A 84 -23.821 -3.123 3.228 1.00 74.33 O ATOM 0 H SER A 84 -25.616 -0.867 5.160 1.00 1.14 H new ATOM 0 HA SER A 84 -26.768 -2.177 2.832 1.00 15.35 H new ATOM 0 HB2 SER A 84 -24.707 -1.672 2.068 1.00 33.52 H new ATOM 0 HB3 SER A 84 -24.202 -1.147 3.663 1.00 33.52 H new ATOM 0 HG SER A 84 -23.853 -3.634 2.393 1.00 74.33 H new ATOM 1281 N LYS A 85 -26.050 -3.773 5.541 1.00 24.44 N ATOM 1282 CA LYS A 85 -26.105 -5.067 6.212 1.00 4.23 C ATOM 1283 C LYS A 85 -27.547 -5.533 6.378 1.00 75.02 C ATOM 1284 O LYS A 85 -27.855 -6.710 6.189 1.00 50.24 O ATOM 1285 CB LYS A 85 -25.424 -4.984 7.581 1.00 51.04 C ATOM 1286 CG LYS A 85 -23.920 -4.787 7.501 1.00 71.40 C ATOM 1287 CD LYS A 85 -23.173 -6.079 7.787 1.00 21.21 C ATOM 1288 CE LYS A 85 -23.049 -6.332 9.282 1.00 73.22 C ATOM 1289 NZ LYS A 85 -23.791 -7.554 9.701 1.00 52.51 N ATOM 0 H LYS A 85 -25.954 -2.976 6.170 1.00 24.44 H new ATOM 0 HA LYS A 85 -25.576 -5.792 5.593 1.00 4.23 H new ATOM 0 HB2 LYS A 85 -25.860 -4.160 8.145 1.00 51.04 H new ATOM 0 HB3 LYS A 85 -25.633 -5.897 8.138 1.00 51.04 H new ATOM 0 HG2 LYS A 85 -23.652 -4.422 6.509 1.00 71.40 H new ATOM 0 HG3 LYS A 85 -23.614 -4.023 8.215 1.00 71.40 H new ATOM 0 HD2 LYS A 85 -23.694 -6.913 7.318 1.00 21.21 H new ATOM 0 HD3 LYS A 85 -22.179 -6.032 7.341 1.00 21.21 H new ATOM 0 HE2 LYS A 85 -21.997 -6.437 9.547 1.00 73.22 H new ATOM 0 HE3 LYS A 85 -23.430 -5.470 9.829 1.00 73.22 H new ATOM 0 HZ1 LYS A 85 -23.682 -7.692 10.726 1.00 52.51 H new ATOM 0 HZ2 LYS A 85 -24.799 -7.444 9.472 1.00 52.51 H new ATOM 0 HZ3 LYS A 85 -23.410 -8.381 9.198 1.00 52.51 H new ATOM 1303 N SER A 86 -28.429 -4.602 6.731 1.00 64.55 N ATOM 1304 CA SER A 86 -29.839 -4.919 6.923 1.00 21.14 C ATOM 1305 C SER A 86 -30.464 -5.424 5.627 1.00 75.32 C ATOM 1306 O SER A 86 -31.527 -6.046 5.638 1.00 51.25 O ATOM 1307 CB SER A 86 -30.596 -3.687 7.422 1.00 34.02 C ATOM 1308 OG SER A 86 -31.715 -4.060 8.208 1.00 2.25 O ATOM 0 H SER A 86 -28.191 -3.623 6.890 1.00 64.55 H new ATOM 0 HA SER A 86 -29.910 -5.709 7.671 1.00 21.14 H new ATOM 0 HB2 SER A 86 -29.927 -3.059 8.011 1.00 34.02 H new ATOM 0 HB3 SER A 86 -30.927 -3.091 6.572 1.00 34.02 H new ATOM 0 HG SER A 86 -32.181 -3.255 8.516 1.00 2.25 H new ATOM 1314 N VAL A 87 -29.797 -5.152 4.510 1.00 60.42 N ATOM 1315 CA VAL A 87 -30.285 -5.579 3.204 1.00 35.42 C ATOM 1316 C VAL A 87 -30.288 -7.100 3.089 1.00 53.53 C ATOM 1317 O VAL A 87 -31.067 -7.674 2.326 1.00 1.14 O ATOM 1318 CB VAL A 87 -29.432 -4.991 2.065 1.00 4.34 C ATOM 1319 CG1 VAL A 87 -29.967 -5.434 0.712 1.00 1.14 C ATOM 1320 CG2 VAL A 87 -29.391 -3.473 2.161 1.00 43.03 C ATOM 0 H VAL A 87 -28.917 -4.638 4.483 1.00 60.42 H new ATOM 0 HA VAL A 87 -31.306 -5.208 3.111 1.00 35.42 H new ATOM 0 HB VAL A 87 -28.414 -5.367 2.166 1.00 4.34 H new ATOM 0 HG11 VAL A 87 -29.351 -5.008 -0.080 1.00 1.14 H new ATOM 0 HG12 VAL A 87 -29.939 -6.522 0.648 1.00 1.14 H new ATOM 0 HG13 VAL A 87 -30.995 -5.090 0.597 1.00 1.14 H new ATOM 0 HG21 VAL A 87 -28.784 -3.073 1.349 1.00 43.03 H new ATOM 0 HG22 VAL A 87 -30.403 -3.076 2.087 1.00 43.03 H new ATOM 0 HG23 VAL A 87 -28.956 -3.180 3.117 1.00 43.03 H new ATOM 1330 N LEU A 88 -29.413 -7.747 3.850 1.00 13.34 N ATOM 1331 CA LEU A 88 -29.314 -9.202 3.835 1.00 74.13 C ATOM 1332 C LEU A 88 -30.313 -9.826 4.804 1.00 74.23 C ATOM 1333 O LEU A 88 -30.857 -10.900 4.546 1.00 20.41 O ATOM 1334 CB LEU A 88 -27.894 -9.640 4.196 1.00 71.41 C ATOM 1335 CG LEU A 88 -26.814 -9.342 3.155 1.00 14.01 C ATOM 1336 CD1 LEU A 88 -25.465 -9.867 3.620 1.00 1.54 C ATOM 1337 CD2 LEU A 88 -27.189 -9.947 1.810 1.00 42.22 C ATOM 0 H LEU A 88 -28.761 -7.287 4.486 1.00 13.34 H new ATOM 0 HA LEU A 88 -29.549 -9.547 2.828 1.00 74.13 H new ATOM 0 HB2 LEU A 88 -27.613 -9.156 5.131 1.00 71.41 H new ATOM 0 HB3 LEU A 88 -27.903 -10.714 4.384 1.00 71.41 H new ATOM 0 HG LEU A 88 -26.739 -8.261 3.037 1.00 14.01 H new ATOM 0 HD11 LEU A 88 -24.709 -9.646 2.866 1.00 1.54 H new ATOM 0 HD12 LEU A 88 -25.192 -9.387 4.560 1.00 1.54 H new ATOM 0 HD13 LEU A 88 -25.525 -10.945 3.768 1.00 1.54 H new ATOM 0 HD21 LEU A 88 -26.409 -9.725 1.081 1.00 42.22 H new ATOM 0 HD22 LEU A 88 -27.293 -11.027 1.913 1.00 42.22 H new ATOM 0 HD23 LEU A 88 -28.134 -9.523 1.471 1.00 42.22 H new ATOM 1349 N LYS A 89 -30.553 -9.145 5.919 1.00 3.30 N ATOM 1350 CA LYS A 89 -31.489 -9.629 6.926 1.00 31.22 C ATOM 1351 C LYS A 89 -32.930 -9.383 6.492 1.00 35.12 C ATOM 1352 O LYS A 89 -33.817 -10.194 6.761 1.00 3.01 O ATOM 1353 CB LYS A 89 -31.226 -8.944 8.269 1.00 45.21 C ATOM 1354 CG LYS A 89 -31.950 -9.592 9.435 1.00 35.25 C ATOM 1355 CD LYS A 89 -31.097 -9.591 10.693 1.00 51.43 C ATOM 1356 CE LYS A 89 -30.225 -10.834 10.776 1.00 43.22 C ATOM 1357 NZ LYS A 89 -30.169 -11.381 12.160 1.00 51.13 N ATOM 0 H LYS A 89 -30.111 -8.255 6.148 1.00 3.30 H new ATOM 0 HA LYS A 89 -31.340 -10.703 7.038 1.00 31.22 H new ATOM 0 HB2 LYS A 89 -30.154 -8.953 8.468 1.00 45.21 H new ATOM 0 HB3 LYS A 89 -31.529 -7.899 8.200 1.00 45.21 H new ATOM 0 HG2 LYS A 89 -32.882 -9.060 9.626 1.00 35.25 H new ATOM 0 HG3 LYS A 89 -32.215 -10.617 9.175 1.00 35.25 H new ATOM 0 HD2 LYS A 89 -30.467 -8.702 10.706 1.00 51.43 H new ATOM 0 HD3 LYS A 89 -31.741 -9.538 11.571 1.00 51.43 H new ATOM 0 HE2 LYS A 89 -30.613 -11.596 10.100 1.00 43.22 H new ATOM 0 HE3 LYS A 89 -29.217 -10.593 10.440 1.00 43.22 H new ATOM 0 HZ1 LYS A 89 -29.565 -12.227 12.175 1.00 51.13 H new ATOM 0 HZ2 LYS A 89 -29.775 -10.663 12.801 1.00 51.13 H new ATOM 0 HZ3 LYS A 89 -31.128 -11.635 12.472 1.00 51.13 H new ATOM 1371 N SER A 90 -33.157 -8.260 5.818 1.00 34.13 N ATOM 1372 CA SER A 90 -34.492 -7.907 5.349 1.00 0.50 C ATOM 1373 C SER A 90 -34.832 -8.655 4.064 1.00 43.35 C ATOM 1374 O SER A 90 -36.001 -8.791 3.701 1.00 20.00 O ATOM 1375 CB SER A 90 -34.590 -6.398 5.116 1.00 55.24 C ATOM 1376 OG SER A 90 -34.570 -5.689 6.343 1.00 63.42 O ATOM 0 H SER A 90 -32.434 -7.579 5.585 1.00 34.13 H new ATOM 0 HA SER A 90 -35.209 -8.197 6.117 1.00 0.50 H new ATOM 0 HB2 SER A 90 -33.761 -6.069 4.489 1.00 55.24 H new ATOM 0 HB3 SER A 90 -35.509 -6.169 4.575 1.00 55.24 H new ATOM 0 HG SER A 90 -33.642 -5.536 6.617 1.00 63.42 H new ATOM 1382 N LEU A 91 -33.801 -9.138 3.378 1.00 14.10 N ATOM 1383 CA LEU A 91 -33.989 -9.873 2.132 1.00 62.00 C ATOM 1384 C LEU A 91 -34.548 -11.267 2.401 1.00 42.53 C ATOM 1385 O LEU A 91 -35.513 -11.694 1.766 1.00 12.43 O ATOM 1386 CB LEU A 91 -32.663 -9.980 1.376 1.00 54.23 C ATOM 1387 CG LEU A 91 -32.463 -11.251 0.550 1.00 44.24 C ATOM 1388 CD1 LEU A 91 -33.539 -11.369 -0.518 1.00 42.24 C ATOM 1389 CD2 LEU A 91 -31.078 -11.263 -0.082 1.00 72.10 C ATOM 0 H LEU A 91 -32.827 -9.034 3.664 1.00 14.10 H new ATOM 0 HA LEU A 91 -34.706 -9.326 1.520 1.00 62.00 H new ATOM 0 HB2 LEU A 91 -32.576 -9.121 0.711 1.00 54.23 H new ATOM 0 HB3 LEU A 91 -31.849 -9.908 2.098 1.00 54.23 H new ATOM 0 HG LEU A 91 -32.545 -12.111 1.215 1.00 44.24 H new ATOM 0 HD11 LEU A 91 -33.380 -12.280 -1.096 1.00 42.24 H new ATOM 0 HD12 LEU A 91 -34.520 -11.407 -0.044 1.00 42.24 H new ATOM 0 HD13 LEU A 91 -33.490 -10.505 -1.181 1.00 42.24 H new ATOM 0 HD21 LEU A 91 -30.953 -12.175 -0.666 1.00 72.10 H new ATOM 0 HD22 LEU A 91 -30.968 -10.396 -0.734 1.00 72.10 H new ATOM 0 HD23 LEU A 91 -30.320 -11.227 0.701 1.00 72.10 H new ATOM 1401 N THR A 92 -33.936 -11.972 3.347 1.00 11.32 N ATOM 1402 CA THR A 92 -34.373 -13.316 3.701 1.00 23.41 C ATOM 1403 C THR A 92 -35.860 -13.341 4.036 1.00 24.33 C ATOM 1404 O THR A 92 -36.525 -14.363 3.871 1.00 62.22 O ATOM 1405 CB THR A 92 -33.578 -13.868 4.900 1.00 14.43 C ATOM 1406 OG1 THR A 92 -33.684 -15.295 4.944 1.00 52.04 O ATOM 1407 CG2 THR A 92 -34.089 -13.276 6.206 1.00 73.45 C ATOM 0 H THR A 92 -33.136 -11.634 3.882 1.00 11.32 H new ATOM 0 HA THR A 92 -34.189 -13.947 2.831 1.00 23.41 H new ATOM 0 HB THR A 92 -32.533 -13.586 4.775 1.00 14.43 H new ATOM 0 HG1 THR A 92 -33.313 -15.625 5.789 1.00 52.04 H new ATOM 0 HG21 THR A 92 -33.513 -13.680 7.039 1.00 73.45 H new ATOM 0 HG22 THR A 92 -33.980 -12.192 6.181 1.00 73.45 H new ATOM 0 HG23 THR A 92 -35.141 -13.532 6.334 1.00 73.45 H new ATOM 1415 N GLU A 93 -36.374 -12.210 4.507 1.00 14.23 N ATOM 1416 CA GLU A 93 -37.784 -12.104 4.866 1.00 41.45 C ATOM 1417 C GLU A 93 -38.675 -12.488 3.688 1.00 50.43 C ATOM 1418 O GLU A 93 -39.781 -12.997 3.871 1.00 41.11 O ATOM 1419 CB GLU A 93 -38.111 -10.681 5.324 1.00 42.22 C ATOM 1420 CG GLU A 93 -38.695 -10.612 6.725 1.00 41.32 C ATOM 1421 CD GLU A 93 -40.202 -10.776 6.737 1.00 13.31 C ATOM 1422 OE1 GLU A 93 -40.698 -11.759 6.148 1.00 4.11 O ATOM 1423 OE2 GLU A 93 -40.887 -9.920 7.337 1.00 44.14 O ATOM 0 H GLU A 93 -35.837 -11.355 4.649 1.00 14.23 H new ATOM 0 HA GLU A 93 -37.977 -12.795 5.686 1.00 41.45 H new ATOM 0 HB2 GLU A 93 -37.203 -10.079 5.288 1.00 42.22 H new ATOM 0 HB3 GLU A 93 -38.817 -10.236 4.623 1.00 42.22 H new ATOM 0 HG2 GLU A 93 -38.244 -11.389 7.341 1.00 41.32 H new ATOM 0 HG3 GLU A 93 -38.434 -9.655 7.177 1.00 41.32 H new ATOM 1430 N LYS A 94 -38.186 -12.239 2.478 1.00 63.23 N ATOM 1431 CA LYS A 94 -38.935 -12.559 1.268 1.00 11.54 C ATOM 1432 C LYS A 94 -38.743 -14.021 0.880 1.00 75.02 C ATOM 1433 O LYS A 94 -39.576 -14.603 0.183 1.00 61.01 O ATOM 1434 CB LYS A 94 -38.495 -11.652 0.117 1.00 50.14 C ATOM 1435 CG LYS A 94 -39.653 -11.033 -0.647 1.00 31.21 C ATOM 1436 CD LYS A 94 -39.791 -9.550 -0.345 1.00 71.32 C ATOM 1437 CE LYS A 94 -40.236 -9.313 1.090 1.00 55.44 C ATOM 1438 NZ LYS A 94 -41.002 -8.043 1.230 1.00 45.33 N ATOM 0 H LYS A 94 -37.273 -11.816 2.309 1.00 63.23 H new ATOM 0 HA LYS A 94 -39.993 -12.392 1.470 1.00 11.54 H new ATOM 0 HB2 LYS A 94 -37.865 -10.856 0.514 1.00 50.14 H new ATOM 0 HB3 LYS A 94 -37.881 -12.229 -0.575 1.00 50.14 H new ATOM 0 HG2 LYS A 94 -39.501 -11.175 -1.717 1.00 31.21 H new ATOM 0 HG3 LYS A 94 -40.578 -11.546 -0.385 1.00 31.21 H new ATOM 0 HD2 LYS A 94 -38.837 -9.052 -0.518 1.00 71.32 H new ATOM 0 HD3 LYS A 94 -40.513 -9.104 -1.029 1.00 71.32 H new ATOM 0 HE2 LYS A 94 -40.853 -10.148 1.422 1.00 55.44 H new ATOM 0 HE3 LYS A 94 -39.362 -9.284 1.741 1.00 55.44 H new ATOM 0 HZ1 LYS A 94 -41.288 -7.917 2.222 1.00 45.33 H new ATOM 0 HZ2 LYS A 94 -40.405 -7.243 0.938 1.00 45.33 H new ATOM 0 HZ3 LYS A 94 -41.849 -8.080 0.628 1.00 45.33 H new ATOM 1452 N LEU A 95 -37.644 -14.610 1.335 1.00 25.25 N ATOM 1453 CA LEU A 95 -37.344 -16.006 1.037 1.00 65.21 C ATOM 1454 C LEU A 95 -38.072 -16.938 2.000 1.00 11.22 C ATOM 1455 O LEU A 95 -38.762 -17.867 1.580 1.00 22.32 O ATOM 1456 CB LEU A 95 -35.836 -16.252 1.114 1.00 63.11 C ATOM 1457 CG LEU A 95 -35.384 -17.704 0.958 1.00 63.55 C ATOM 1458 CD1 LEU A 95 -35.697 -18.213 -0.441 1.00 22.41 C ATOM 1459 CD2 LEU A 95 -33.897 -17.835 1.254 1.00 22.11 C ATOM 0 H LEU A 95 -36.945 -14.143 1.912 1.00 25.25 H new ATOM 0 HA LEU A 95 -37.690 -16.217 0.025 1.00 65.21 H new ATOM 0 HB2 LEU A 95 -35.351 -15.656 0.341 1.00 63.11 H new ATOM 0 HB3 LEU A 95 -35.476 -15.882 2.074 1.00 63.11 H new ATOM 0 HG LEU A 95 -35.932 -18.314 1.676 1.00 63.55 H new ATOM 0 HD11 LEU A 95 -35.368 -19.248 -0.534 1.00 22.41 H new ATOM 0 HD12 LEU A 95 -36.771 -18.156 -0.617 1.00 22.41 H new ATOM 0 HD13 LEU A 95 -35.176 -17.600 -1.176 1.00 22.41 H new ATOM 0 HD21 LEU A 95 -33.593 -18.875 1.138 1.00 22.11 H new ATOM 0 HD22 LEU A 95 -33.332 -17.212 0.561 1.00 22.11 H new ATOM 0 HD23 LEU A 95 -33.700 -17.511 2.276 1.00 22.11 H new ATOM 1471 N LYS A 96 -37.916 -16.682 3.295 1.00 52.55 N ATOM 1472 CA LYS A 96 -38.561 -17.494 4.319 1.00 32.10 C ATOM 1473 C LYS A 96 -40.075 -17.504 4.133 1.00 51.43 C ATOM 1474 O LYS A 96 -40.754 -18.451 4.529 1.00 60.45 O ATOM 1475 CB LYS A 96 -38.212 -16.967 5.712 1.00 5.25 C ATOM 1476 CG LYS A 96 -36.774 -17.237 6.122 1.00 32.42 C ATOM 1477 CD LYS A 96 -36.694 -18.296 7.209 1.00 70.41 C ATOM 1478 CE LYS A 96 -35.549 -18.021 8.172 1.00 74.31 C ATOM 1479 NZ LYS A 96 -34.836 -19.271 8.557 1.00 13.43 N ATOM 0 H LYS A 96 -37.348 -15.918 3.660 1.00 52.55 H new ATOM 0 HA LYS A 96 -38.194 -18.516 4.221 1.00 32.10 H new ATOM 0 HB2 LYS A 96 -38.394 -15.893 5.741 1.00 5.25 H new ATOM 0 HB3 LYS A 96 -38.881 -17.423 6.442 1.00 5.25 H new ATOM 0 HG2 LYS A 96 -36.202 -17.562 5.253 1.00 32.42 H new ATOM 0 HG3 LYS A 96 -36.317 -16.314 6.478 1.00 32.42 H new ATOM 0 HD2 LYS A 96 -37.634 -18.326 7.759 1.00 70.41 H new ATOM 0 HD3 LYS A 96 -36.560 -19.277 6.753 1.00 70.41 H new ATOM 0 HE2 LYS A 96 -34.845 -17.329 7.711 1.00 74.31 H new ATOM 0 HE3 LYS A 96 -35.936 -17.533 9.067 1.00 74.31 H new ATOM 0 HZ1 LYS A 96 -34.063 -19.041 9.214 1.00 13.43 H new ATOM 0 HZ2 LYS A 96 -35.502 -19.922 9.020 1.00 13.43 H new ATOM 0 HZ3 LYS A 96 -34.445 -19.723 7.706 1.00 13.43 H new ATOM 1493 N LYS A 97 -40.599 -16.444 3.526 1.00 4.44 N ATOM 1494 CA LYS A 97 -42.032 -16.330 3.284 1.00 30.33 C ATOM 1495 C LYS A 97 -42.476 -17.294 2.188 1.00 15.53 C ATOM 1496 O LYS A 97 -43.671 -17.524 1.999 1.00 52.23 O ATOM 1497 CB LYS A 97 -42.392 -14.895 2.894 1.00 73.23 C ATOM 1498 CG LYS A 97 -43.318 -14.210 3.884 1.00 52.45 C ATOM 1499 CD LYS A 97 -44.768 -14.602 3.655 1.00 71.40 C ATOM 1500 CE LYS A 97 -45.128 -15.870 4.414 1.00 73.40 C ATOM 1501 NZ LYS A 97 -46.337 -15.684 5.264 1.00 4.41 N ATOM 0 H LYS A 97 -40.051 -15.651 3.192 1.00 4.44 H new ATOM 0 HA LYS A 97 -42.553 -16.590 4.205 1.00 30.33 H new ATOM 0 HB2 LYS A 97 -41.476 -14.312 2.803 1.00 73.23 H new ATOM 0 HB3 LYS A 97 -42.865 -14.902 1.912 1.00 73.23 H new ATOM 0 HG2 LYS A 97 -43.025 -14.474 4.900 1.00 52.45 H new ATOM 0 HG3 LYS A 97 -43.214 -13.129 3.793 1.00 52.45 H new ATOM 0 HD2 LYS A 97 -45.421 -13.789 3.973 1.00 71.40 H new ATOM 0 HD3 LYS A 97 -44.942 -14.753 2.589 1.00 71.40 H new ATOM 0 HE2 LYS A 97 -45.303 -16.680 3.706 1.00 73.40 H new ATOM 0 HE3 LYS A 97 -44.287 -16.170 5.039 1.00 73.40 H new ATOM 0 HZ1 LYS A 97 -46.549 -16.571 5.765 1.00 4.41 H new ATOM 0 HZ2 LYS A 97 -46.161 -14.929 5.957 1.00 4.41 H new ATOM 0 HZ3 LYS A 97 -47.146 -15.423 4.665 1.00 4.41 H new ATOM 1515 N ILE A 98 -41.508 -17.854 1.471 1.00 14.21 N ATOM 1516 CA ILE A 98 -41.801 -18.794 0.396 1.00 10.13 C ATOM 1517 C ILE A 98 -42.721 -19.911 0.878 1.00 50.40 C ATOM 1518 O ILE A 98 -43.433 -20.528 0.086 1.00 30.20 O ATOM 1519 CB ILE A 98 -40.513 -19.416 -0.174 1.00 44.31 C ATOM 1520 CG1 ILE A 98 -40.797 -20.087 -1.519 1.00 64.04 C ATOM 1521 CG2 ILE A 98 -39.927 -20.417 0.810 1.00 2.24 C ATOM 1522 CD1 ILE A 98 -40.531 -19.192 -2.709 1.00 54.34 C ATOM 0 H ILE A 98 -40.514 -17.673 1.615 1.00 14.21 H new ATOM 0 HA ILE A 98 -42.301 -18.228 -0.390 1.00 10.13 H new ATOM 0 HB ILE A 98 -39.783 -18.622 -0.332 1.00 44.31 H new ATOM 0 HG12 ILE A 98 -40.184 -20.984 -1.605 1.00 64.04 H new ATOM 0 HG13 ILE A 98 -41.838 -20.409 -1.542 1.00 64.04 H new ATOM 0 HG21 ILE A 98 -39.017 -20.848 0.392 1.00 2.24 H new ATOM 0 HG22 ILE A 98 -39.692 -19.912 1.747 1.00 2.24 H new ATOM 0 HG23 ILE A 98 -40.651 -21.210 0.997 1.00 2.24 H new ATOM 0 HD11 ILE A 98 -40.754 -19.733 -3.628 1.00 54.34 H new ATOM 0 HD12 ILE A 98 -41.164 -18.306 -2.647 1.00 54.34 H new ATOM 0 HD13 ILE A 98 -39.484 -18.890 -2.710 1.00 54.34 H new ATOM 1534 N VAL A 99 -42.702 -20.164 2.183 1.00 54.22 N ATOM 1535 CA VAL A 99 -43.537 -21.204 2.772 1.00 71.23 C ATOM 1536 C VAL A 99 -45.012 -20.958 2.476 1.00 13.15 C ATOM 1537 O VAL A 99 -45.833 -21.871 2.561 1.00 23.12 O ATOM 1538 CB VAL A 99 -43.337 -21.288 4.297 1.00 60.25 C ATOM 1539 CG1 VAL A 99 -44.124 -22.454 4.875 1.00 23.40 C ATOM 1540 CG2 VAL A 99 -41.859 -21.412 4.633 1.00 22.25 C ATOM 0 H VAL A 99 -42.118 -19.663 2.852 1.00 54.22 H new ATOM 0 HA VAL A 99 -43.232 -22.148 2.321 1.00 71.23 H new ATOM 0 HB VAL A 99 -43.713 -20.369 4.747 1.00 60.25 H new ATOM 0 HG11 VAL A 99 -43.971 -22.498 5.953 1.00 23.40 H new ATOM 0 HG12 VAL A 99 -45.185 -22.317 4.665 1.00 23.40 H new ATOM 0 HG13 VAL A 99 -43.782 -23.384 4.422 1.00 23.40 H new ATOM 0 HG21 VAL A 99 -41.735 -21.470 5.714 1.00 22.25 H new ATOM 0 HG22 VAL A 99 -41.456 -22.314 4.173 1.00 22.25 H new ATOM 0 HG23 VAL A 99 -41.325 -20.541 4.253 1.00 22.25 H new ATOM 1550 N GLU A 100 -45.342 -19.718 2.129 1.00 2.32 N ATOM 1551 CA GLU A 100 -46.719 -19.352 1.822 1.00 54.34 C ATOM 1552 C GLU A 100 -47.052 -19.659 0.364 1.00 24.33 C ATOM 1553 O GLU A 100 -48.221 -19.770 -0.008 1.00 24.22 O ATOM 1554 CB GLU A 100 -46.952 -17.866 2.107 1.00 64.44 C ATOM 1555 CG GLU A 100 -48.273 -17.343 1.569 1.00 43.24 C ATOM 1556 CD GLU A 100 -49.460 -18.161 2.039 1.00 4.34 C ATOM 1557 OE1 GLU A 100 -49.352 -18.805 3.103 1.00 31.33 O ATOM 1558 OE2 GLU A 100 -50.496 -18.155 1.343 1.00 34.41 O ATOM 0 H GLU A 100 -44.675 -18.950 2.054 1.00 2.32 H new ATOM 0 HA GLU A 100 -47.375 -19.944 2.460 1.00 54.34 H new ATOM 0 HB2 GLU A 100 -46.917 -17.701 3.184 1.00 64.44 H new ATOM 0 HB3 GLU A 100 -46.137 -17.289 1.670 1.00 64.44 H new ATOM 0 HG2 GLU A 100 -48.404 -16.307 1.882 1.00 43.24 H new ATOM 0 HG3 GLU A 100 -48.244 -17.345 0.479 1.00 43.24 H new ATOM 1565 N LEU A 101 -46.016 -19.795 -0.456 1.00 61.23 N ATOM 1566 CA LEU A 101 -46.196 -20.090 -1.874 1.00 12.43 C ATOM 1567 C LEU A 101 -45.884 -21.553 -2.170 1.00 45.21 C ATOM 1568 O LEU A 101 -46.714 -22.276 -2.722 1.00 2.50 O ATOM 1569 CB LEU A 101 -45.301 -19.183 -2.721 1.00 33.31 C ATOM 1570 CG LEU A 101 -46.021 -18.256 -3.701 1.00 61.54 C ATOM 1571 CD1 LEU A 101 -47.056 -17.411 -2.975 1.00 71.54 C ATOM 1572 CD2 LEU A 101 -45.021 -17.370 -4.429 1.00 2.43 C ATOM 0 H LEU A 101 -45.043 -19.706 -0.164 1.00 61.23 H new ATOM 0 HA LEU A 101 -47.239 -19.902 -2.130 1.00 12.43 H new ATOM 0 HB2 LEU A 101 -44.698 -18.572 -2.050 1.00 33.31 H new ATOM 0 HB3 LEU A 101 -44.612 -19.811 -3.285 1.00 33.31 H new ATOM 0 HG LEU A 101 -46.537 -18.870 -4.439 1.00 61.54 H new ATOM 0 HD11 LEU A 101 -47.558 -16.758 -3.689 1.00 71.54 H new ATOM 0 HD12 LEU A 101 -47.790 -18.063 -2.501 1.00 71.54 H new ATOM 0 HD13 LEU A 101 -46.563 -16.806 -2.214 1.00 71.54 H new ATOM 0 HD21 LEU A 101 -45.551 -16.717 -5.122 1.00 2.43 H new ATOM 0 HD22 LEU A 101 -44.476 -16.765 -3.704 1.00 2.43 H new ATOM 0 HD23 LEU A 101 -44.318 -17.993 -4.982 1.00 2.43 H new ATOM 1584 N ILE A 102 -44.683 -21.983 -1.798 1.00 44.21 N ATOM 1585 CA ILE A 102 -44.262 -23.361 -2.021 1.00 53.40 C ATOM 1586 C ILE A 102 -43.520 -23.912 -0.809 1.00 4.24 C ATOM 1587 O ILE A 102 -42.290 -23.946 -0.766 1.00 23.13 O ATOM 1588 CB ILE A 102 -43.357 -23.479 -3.261 1.00 61.32 C ATOM 1589 CG1 ILE A 102 -43.999 -22.774 -4.458 1.00 3.03 C ATOM 1590 CG2 ILE A 102 -43.089 -24.942 -3.583 1.00 44.11 C ATOM 1591 CD1 ILE A 102 -43.344 -21.455 -4.804 1.00 12.01 C ATOM 0 H ILE A 102 -43.984 -21.397 -1.341 1.00 44.21 H new ATOM 0 HA ILE A 102 -45.167 -23.945 -2.185 1.00 53.40 H new ATOM 0 HB ILE A 102 -42.405 -22.993 -3.045 1.00 61.32 H new ATOM 0 HG12 ILE A 102 -43.952 -23.432 -5.325 1.00 3.03 H new ATOM 0 HG13 ILE A 102 -45.054 -22.602 -4.245 1.00 3.03 H new ATOM 0 HG21 ILE A 102 -42.448 -25.010 -4.462 1.00 44.11 H new ATOM 0 HG22 ILE A 102 -42.594 -25.416 -2.736 1.00 44.11 H new ATOM 0 HG23 ILE A 102 -44.033 -25.449 -3.782 1.00 44.11 H new ATOM 0 HD11 ILE A 102 -43.850 -21.011 -5.661 1.00 12.01 H new ATOM 0 HD12 ILE A 102 -43.414 -20.779 -3.952 1.00 12.01 H new ATOM 0 HD13 ILE A 102 -42.295 -21.623 -5.049 1.00 12.01 H new ATOM 1603 N PRO A 103 -44.283 -24.356 0.201 1.00 3.21 N ATOM 1604 CA PRO A 103 -43.719 -24.916 1.433 1.00 65.34 C ATOM 1605 C PRO A 103 -43.061 -26.273 1.204 1.00 45.23 C ATOM 1606 O PRO A 103 -42.479 -26.854 2.120 1.00 0.30 O ATOM 1607 CB PRO A 103 -44.937 -25.061 2.347 1.00 12.24 C ATOM 1608 CG PRO A 103 -46.096 -25.184 1.419 1.00 65.42 C ATOM 1609 CD PRO A 103 -45.755 -24.345 0.218 1.00 31.42 C ATOM 0 HA PRO A 103 -42.933 -24.284 1.845 1.00 65.34 H new ATOM 0 HB2 PRO A 103 -44.849 -25.938 2.988 1.00 12.24 H new ATOM 0 HB3 PRO A 103 -45.045 -24.197 3.002 1.00 12.24 H new ATOM 0 HG2 PRO A 103 -46.260 -26.224 1.135 1.00 65.42 H new ATOM 0 HG3 PRO A 103 -47.014 -24.834 1.892 1.00 65.42 H new ATOM 0 HD2 PRO A 103 -46.171 -24.766 -0.697 1.00 31.42 H new ATOM 0 HD3 PRO A 103 -46.148 -23.333 0.310 1.00 31.42 H new ATOM 1617 N SER A 104 -43.156 -26.772 -0.024 1.00 41.04 N ATOM 1618 CA SER A 104 -42.572 -28.062 -0.373 1.00 34.24 C ATOM 1619 C SER A 104 -41.049 -27.987 -0.373 1.00 44.11 C ATOM 1620 O SER A 104 -40.367 -28.943 0.000 1.00 51.42 O ATOM 1621 CB SER A 104 -43.072 -28.518 -1.745 1.00 33.33 C ATOM 1622 OG SER A 104 -43.685 -29.793 -1.666 1.00 74.41 O ATOM 0 H SER A 104 -43.632 -26.303 -0.794 1.00 41.04 H new ATOM 0 HA SER A 104 -42.882 -28.788 0.378 1.00 34.24 H new ATOM 0 HB2 SER A 104 -43.785 -27.792 -2.136 1.00 33.33 H new ATOM 0 HB3 SER A 104 -42.238 -28.555 -2.446 1.00 33.33 H new ATOM 0 HG SER A 104 -43.998 -30.061 -2.555 1.00 74.41 H new ATOM 1628 N THR A 105 -40.519 -26.843 -0.795 1.00 41.21 N ATOM 1629 CA THR A 105 -39.076 -26.641 -0.846 1.00 35.11 C ATOM 1630 C THR A 105 -38.558 -26.047 0.459 1.00 51.34 C ATOM 1631 O THR A 105 -37.356 -26.063 0.725 1.00 54.01 O ATOM 1632 CB THR A 105 -38.679 -25.716 -2.012 1.00 33.31 C ATOM 1633 OG1 THR A 105 -39.547 -24.578 -2.052 1.00 33.10 O ATOM 1634 CG2 THR A 105 -38.746 -26.458 -3.338 1.00 71.42 C ATOM 0 H THR A 105 -41.068 -26.042 -1.107 1.00 41.21 H new ATOM 0 HA THR A 105 -38.625 -27.621 -1.000 1.00 35.11 H new ATOM 0 HB THR A 105 -37.653 -25.384 -1.851 1.00 33.31 H new ATOM 0 HG1 THR A 105 -39.287 -23.994 -2.795 1.00 33.10 H new ATOM 0 HG21 THR A 105 -38.462 -25.785 -4.147 1.00 71.42 H new ATOM 0 HG22 THR A 105 -38.062 -27.307 -3.315 1.00 71.42 H new ATOM 0 HG23 THR A 105 -39.762 -26.815 -3.504 1.00 71.42 H new ATOM 1642 N SER A 106 -39.472 -25.523 1.269 1.00 0.22 N ATOM 1643 CA SER A 106 -39.106 -24.920 2.546 1.00 71.04 C ATOM 1644 C SER A 106 -38.265 -25.882 3.379 1.00 2.22 C ATOM 1645 O SER A 106 -37.502 -25.462 4.249 1.00 21.34 O ATOM 1646 CB SER A 106 -40.361 -24.518 3.322 1.00 13.12 C ATOM 1647 OG SER A 106 -40.359 -25.082 4.622 1.00 12.02 O ATOM 0 H SER A 106 -40.471 -25.504 1.064 1.00 0.22 H new ATOM 0 HA SER A 106 -38.512 -24.029 2.343 1.00 71.04 H new ATOM 0 HB2 SER A 106 -40.416 -23.432 3.394 1.00 13.12 H new ATOM 0 HB3 SER A 106 -41.248 -24.847 2.781 1.00 13.12 H new ATOM 0 HG SER A 106 -41.171 -24.809 5.098 1.00 12.02 H new ATOM 1653 N SER A 107 -38.410 -27.174 3.106 1.00 32.51 N ATOM 1654 CA SER A 107 -37.667 -28.198 3.833 1.00 53.54 C ATOM 1655 C SER A 107 -36.164 -27.987 3.682 1.00 2.12 C ATOM 1656 O SER A 107 -35.371 -28.511 4.464 1.00 33.22 O ATOM 1657 CB SER A 107 -38.051 -29.590 3.330 1.00 74.52 C ATOM 1658 OG SER A 107 -39.136 -30.120 4.073 1.00 40.44 O ATOM 0 H SER A 107 -39.035 -27.538 2.387 1.00 32.51 H new ATOM 0 HA SER A 107 -37.924 -28.118 4.889 1.00 53.54 H new ATOM 0 HB2 SER A 107 -38.320 -29.537 2.275 1.00 74.52 H new ATOM 0 HB3 SER A 107 -37.193 -30.258 3.407 1.00 74.52 H new ATOM 0 HG SER A 107 -39.363 -31.010 3.731 1.00 40.44 H new ATOM 1664 N ALA A 108 -35.779 -27.215 2.671 1.00 70.31 N ATOM 1665 CA ALA A 108 -34.372 -26.933 2.418 1.00 44.11 C ATOM 1666 C ALA A 108 -33.868 -25.805 3.313 1.00 75.33 C ATOM 1667 O ALA A 108 -32.663 -25.591 3.440 1.00 22.22 O ATOM 1668 CB ALA A 108 -34.159 -26.582 0.953 1.00 42.41 C ATOM 0 H ALA A 108 -36.422 -26.774 2.014 1.00 70.31 H new ATOM 0 HA ALA A 108 -33.800 -27.831 2.652 1.00 44.11 H new ATOM 0 HB1 ALA A 108 -33.103 -26.374 0.779 1.00 42.41 H new ATOM 0 HB2 ALA A 108 -34.472 -27.419 0.329 1.00 42.41 H new ATOM 0 HB3 ALA A 108 -34.749 -25.701 0.700 1.00 42.41 H new ATOM 1674 N VAL A 109 -34.800 -25.086 3.931 1.00 41.14 N ATOM 1675 CA VAL A 109 -34.451 -23.980 4.814 1.00 3.12 C ATOM 1676 C VAL A 109 -33.339 -24.377 5.779 1.00 35.43 C ATOM 1677 O VAL A 109 -32.278 -23.756 5.833 1.00 12.31 O ATOM 1678 CB VAL A 109 -35.671 -23.501 5.623 1.00 41.32 C ATOM 1679 CG1 VAL A 109 -35.236 -22.966 6.979 1.00 53.53 C ATOM 1680 CG2 VAL A 109 -36.443 -22.445 4.846 1.00 1.12 C ATOM 0 H VAL A 109 -35.802 -25.250 3.836 1.00 41.14 H new ATOM 0 HA VAL A 109 -34.103 -23.165 4.179 1.00 3.12 H new ATOM 0 HB VAL A 109 -36.332 -24.352 5.790 1.00 41.32 H new ATOM 0 HG11 VAL A 109 -36.111 -22.632 7.536 1.00 53.53 H new ATOM 0 HG12 VAL A 109 -34.730 -23.755 7.536 1.00 53.53 H new ATOM 0 HG13 VAL A 109 -34.554 -22.127 6.838 1.00 53.53 H new ATOM 0 HG21 VAL A 109 -37.302 -22.117 5.432 1.00 1.12 H new ATOM 0 HG22 VAL A 109 -35.793 -21.593 4.647 1.00 1.12 H new ATOM 0 HG23 VAL A 109 -36.788 -22.867 3.902 1.00 1.12 H new ATOM 1690 N PRO A 110 -33.586 -25.439 6.561 1.00 73.21 N ATOM 1691 CA PRO A 110 -32.618 -25.945 7.538 1.00 1.23 C ATOM 1692 C PRO A 110 -31.408 -26.592 6.874 1.00 63.11 C ATOM 1693 O PRO A 110 -30.387 -26.835 7.520 1.00 14.51 O ATOM 1694 CB PRO A 110 -33.418 -26.987 8.324 1.00 61.14 C ATOM 1695 CG PRO A 110 -34.486 -27.431 7.385 1.00 52.21 C ATOM 1696 CD PRO A 110 -34.830 -26.228 6.550 1.00 24.11 C ATOM 0 HA PRO A 110 -32.209 -25.146 8.157 1.00 1.23 H new ATOM 0 HB2 PRO A 110 -32.788 -27.822 8.630 1.00 61.14 H new ATOM 0 HB3 PRO A 110 -33.842 -26.558 9.232 1.00 61.14 H new ATOM 0 HG2 PRO A 110 -34.139 -28.254 6.760 1.00 52.21 H new ATOM 0 HG3 PRO A 110 -35.359 -27.791 7.929 1.00 52.21 H new ATOM 0 HD2 PRO A 110 -35.118 -26.511 5.537 1.00 24.11 H new ATOM 0 HD3 PRO A 110 -35.664 -25.669 6.974 1.00 24.11 H new ATOM 1704 N LEU A 111 -31.527 -26.869 5.580 1.00 22.42 N ATOM 1705 CA LEU A 111 -30.441 -27.488 4.827 1.00 34.53 C ATOM 1706 C LEU A 111 -29.449 -26.438 4.340 1.00 65.11 C ATOM 1707 O LEU A 111 -28.273 -26.465 4.705 1.00 1.42 O ATOM 1708 CB LEU A 111 -31.001 -28.269 3.637 1.00 62.32 C ATOM 1709 CG LEU A 111 -30.280 -29.572 3.290 1.00 25.31 C ATOM 1710 CD1 LEU A 111 -28.784 -29.434 3.528 1.00 42.13 C ATOM 1711 CD2 LEU A 111 -30.846 -30.728 4.102 1.00 2.23 C ATOM 0 H LEU A 111 -32.364 -26.675 5.030 1.00 22.42 H new ATOM 0 HA LEU A 111 -29.917 -28.175 5.491 1.00 34.53 H new ATOM 0 HB2 LEU A 111 -32.047 -28.499 3.839 1.00 62.32 H new ATOM 0 HB3 LEU A 111 -30.980 -27.621 2.761 1.00 62.32 H new ATOM 0 HG LEU A 111 -30.441 -29.783 2.233 1.00 25.31 H new ATOM 0 HD11 LEU A 111 -28.287 -30.371 3.276 1.00 42.13 H new ATOM 0 HD12 LEU A 111 -28.388 -28.634 2.903 1.00 42.13 H new ATOM 0 HD13 LEU A 111 -28.603 -29.198 4.577 1.00 42.13 H new ATOM 0 HD21 LEU A 111 -30.321 -31.647 3.842 1.00 2.23 H new ATOM 0 HD22 LEU A 111 -30.716 -30.524 5.165 1.00 2.23 H new ATOM 0 HD23 LEU A 111 -31.907 -30.842 3.882 1.00 2.23 H new ATOM 1723 N ILE A 112 -29.930 -25.514 3.515 1.00 21.05 N ATOM 1724 CA ILE A 112 -29.085 -24.453 2.981 1.00 33.02 C ATOM 1725 C ILE A 112 -28.836 -23.370 4.026 1.00 71.23 C ATOM 1726 O ILE A 112 -27.864 -22.621 3.939 1.00 21.41 O ATOM 1727 CB ILE A 112 -29.713 -23.810 1.731 1.00 50.53 C ATOM 1728 CG1 ILE A 112 -28.816 -22.688 1.203 1.00 52.31 C ATOM 1729 CG2 ILE A 112 -31.103 -23.279 2.049 1.00 3.42 C ATOM 1730 CD1 ILE A 112 -29.036 -22.377 -0.261 1.00 41.20 C ATOM 0 H ILE A 112 -30.900 -25.479 3.202 1.00 21.05 H new ATOM 0 HA ILE A 112 -28.136 -24.913 2.705 1.00 33.02 H new ATOM 0 HB ILE A 112 -29.805 -24.571 0.956 1.00 50.53 H new ATOM 0 HG12 ILE A 112 -28.994 -21.786 1.788 1.00 52.31 H new ATOM 0 HG13 ILE A 112 -27.773 -22.966 1.354 1.00 52.31 H new ATOM 0 HG21 ILE A 112 -31.533 -22.828 1.155 1.00 3.42 H new ATOM 0 HG22 ILE A 112 -31.738 -24.099 2.383 1.00 3.42 H new ATOM 0 HG23 ILE A 112 -31.035 -22.529 2.837 1.00 3.42 H new ATOM 0 HD11 ILE A 112 -28.367 -21.573 -0.567 1.00 41.20 H new ATOM 0 HD12 ILE A 112 -28.830 -23.266 -0.857 1.00 41.20 H new ATOM 0 HD13 ILE A 112 -30.070 -22.068 -0.416 1.00 41.20 H new ATOM 1742 N GLY A 113 -29.722 -23.295 5.015 1.00 45.42 N ATOM 1743 CA GLY A 113 -29.579 -22.301 6.063 1.00 33.54 C ATOM 1744 C GLY A 113 -28.195 -22.305 6.681 1.00 11.03 C ATOM 1745 O GLY A 113 -27.732 -21.285 7.193 1.00 35.20 O ATOM 0 H GLY A 113 -30.535 -23.904 5.109 1.00 45.42 H new ATOM 0 HA2 GLY A 113 -29.788 -21.313 5.653 1.00 33.54 H new ATOM 0 HA3 GLY A 113 -30.321 -22.487 6.840 1.00 33.54 H new ATOM 1749 N LYS A 114 -27.532 -23.455 6.636 1.00 24.31 N ATOM 1750 CA LYS A 114 -26.192 -23.589 7.196 1.00 50.00 C ATOM 1751 C LYS A 114 -25.217 -22.641 6.506 1.00 43.24 C ATOM 1752 O LYS A 114 -24.279 -22.140 7.126 1.00 2.43 O ATOM 1753 CB LYS A 114 -25.701 -25.032 7.058 1.00 10.22 C ATOM 1754 CG LYS A 114 -24.253 -25.224 7.475 1.00 71.02 C ATOM 1755 CD LYS A 114 -23.774 -26.638 7.191 1.00 12.12 C ATOM 1756 CE LYS A 114 -23.780 -26.940 5.701 1.00 74.05 C ATOM 1757 NZ LYS A 114 -22.845 -28.045 5.355 1.00 65.53 N ATOM 0 H LYS A 114 -27.901 -24.309 6.217 1.00 24.31 H new ATOM 0 HA LYS A 114 -26.239 -23.327 8.253 1.00 50.00 H new ATOM 0 HB2 LYS A 114 -26.334 -25.682 7.663 1.00 10.22 H new ATOM 0 HB3 LYS A 114 -25.817 -25.349 6.022 1.00 10.22 H new ATOM 0 HG2 LYS A 114 -23.623 -24.512 6.943 1.00 71.02 H new ATOM 0 HG3 LYS A 114 -24.148 -25.010 8.539 1.00 71.02 H new ATOM 0 HD2 LYS A 114 -22.766 -26.768 7.585 1.00 12.12 H new ATOM 0 HD3 LYS A 114 -24.414 -27.351 7.710 1.00 12.12 H new ATOM 0 HE2 LYS A 114 -24.790 -27.208 5.389 1.00 74.05 H new ATOM 0 HE3 LYS A 114 -23.502 -26.043 5.148 1.00 74.05 H new ATOM 0 HZ1 LYS A 114 -22.879 -28.220 4.330 1.00 65.53 H new ATOM 0 HZ2 LYS A 114 -21.878 -27.780 5.629 1.00 65.53 H new ATOM 0 HZ3 LYS A 114 -23.125 -28.908 5.863 1.00 65.53 H new ATOM 1771 N TYR A 115 -25.445 -22.398 5.220 1.00 62.22 N ATOM 1772 CA TYR A 115 -24.585 -21.511 4.445 1.00 14.33 C ATOM 1773 C TYR A 115 -25.021 -20.057 4.603 1.00 45.12 C ATOM 1774 O TYR A 115 -24.196 -19.144 4.574 1.00 63.13 O ATOM 1775 CB TYR A 115 -24.610 -21.905 2.967 1.00 3.35 C ATOM 1776 CG TYR A 115 -24.323 -23.370 2.727 1.00 55.34 C ATOM 1777 CD1 TYR A 115 -23.022 -23.823 2.545 1.00 14.35 C ATOM 1778 CD2 TYR A 115 -25.354 -24.301 2.679 1.00 3.50 C ATOM 1779 CE1 TYR A 115 -22.756 -25.160 2.324 1.00 30.14 C ATOM 1780 CE2 TYR A 115 -25.097 -25.640 2.460 1.00 4.00 C ATOM 1781 CZ TYR A 115 -23.796 -26.065 2.283 1.00 13.11 C ATOM 1782 OH TYR A 115 -23.536 -27.398 2.063 1.00 32.12 O ATOM 0 H TYR A 115 -26.218 -22.803 4.692 1.00 62.22 H new ATOM 0 HA TYR A 115 -23.567 -21.610 4.823 1.00 14.33 H new ATOM 0 HB2 TYR A 115 -25.588 -21.662 2.551 1.00 3.35 H new ATOM 0 HB3 TYR A 115 -23.876 -21.306 2.427 1.00 3.35 H new ATOM 0 HD1 TYR A 115 -22.205 -23.117 2.577 1.00 14.35 H new ATOM 0 HD2 TYR A 115 -26.373 -23.972 2.815 1.00 3.50 H new ATOM 0 HE1 TYR A 115 -21.739 -25.495 2.184 1.00 30.14 H new ATOM 0 HE2 TYR A 115 -25.910 -26.351 2.427 1.00 4.00 H new ATOM 0 HH TYR A 115 -24.378 -27.900 2.065 1.00 32.12 H new ATOM 1792 N MET A 116 -26.323 -19.851 4.770 1.00 3.34 N ATOM 1793 CA MET A 116 -26.869 -18.508 4.935 1.00 64.53 C ATOM 1794 C MET A 116 -26.132 -17.753 6.037 1.00 73.33 C ATOM 1795 O MET A 116 -25.462 -16.753 5.777 1.00 71.02 O ATOM 1796 CB MET A 116 -28.362 -18.578 5.258 1.00 32.34 C ATOM 1797 CG MET A 116 -29.257 -18.263 4.071 1.00 42.44 C ATOM 1798 SD MET A 116 -30.908 -18.967 4.238 1.00 21.50 S ATOM 1799 CE MET A 116 -31.678 -17.770 5.325 1.00 75.41 C ATOM 0 H MET A 116 -27.020 -20.596 4.795 1.00 3.34 H new ATOM 0 HA MET A 116 -26.733 -17.969 3.997 1.00 64.53 H new ATOM 0 HB2 MET A 116 -28.599 -19.576 5.626 1.00 32.34 H new ATOM 0 HB3 MET A 116 -28.584 -17.880 6.065 1.00 32.34 H new ATOM 0 HG2 MET A 116 -29.337 -17.182 3.959 1.00 42.44 H new ATOM 0 HG3 MET A 116 -28.794 -18.645 3.161 1.00 42.44 H new ATOM 0 HE1 MET A 116 -32.732 -18.019 5.452 1.00 75.41 H new ATOM 0 HE2 MET A 116 -31.182 -17.788 6.295 1.00 75.41 H new ATOM 0 HE3 MET A 116 -31.590 -16.774 4.890 1.00 75.41 H new ATOM 1809 N LEU A 117 -26.261 -18.237 7.267 1.00 32.31 N ATOM 1810 CA LEU A 117 -25.608 -17.607 8.409 1.00 30.54 C ATOM 1811 C LEU A 117 -24.091 -17.635 8.253 1.00 70.14 C ATOM 1812 O LEU A 117 -23.383 -16.802 8.818 1.00 3.12 O ATOM 1813 CB LEU A 117 -26.011 -18.313 9.705 1.00 31.13 C ATOM 1814 CG LEU A 117 -27.205 -17.716 10.452 1.00 45.33 C ATOM 1815 CD1 LEU A 117 -27.823 -18.747 11.383 1.00 64.24 C ATOM 1816 CD2 LEU A 117 -26.782 -16.478 11.229 1.00 2.15 C ATOM 0 H LEU A 117 -26.812 -19.064 7.499 1.00 32.31 H new ATOM 0 HA LEU A 117 -25.931 -16.567 8.452 1.00 30.54 H new ATOM 0 HB2 LEU A 117 -26.237 -19.354 9.473 1.00 31.13 H new ATOM 0 HB3 LEU A 117 -25.152 -18.315 10.376 1.00 31.13 H new ATOM 0 HG LEU A 117 -27.957 -17.422 9.720 1.00 45.33 H new ATOM 0 HD11 LEU A 117 -28.671 -18.304 11.905 1.00 64.24 H new ATOM 0 HD12 LEU A 117 -28.163 -19.604 10.802 1.00 64.24 H new ATOM 0 HD13 LEU A 117 -27.079 -19.073 12.110 1.00 64.24 H new ATOM 0 HD21 LEU A 117 -27.644 -16.066 11.754 1.00 2.15 H new ATOM 0 HD22 LEU A 117 -26.011 -16.747 11.951 1.00 2.15 H new ATOM 0 HD23 LEU A 117 -26.388 -15.732 10.539 1.00 2.15 H new ATOM 1828 N PHE A 118 -23.599 -18.597 7.479 1.00 23.23 N ATOM 1829 CA PHE A 118 -22.166 -18.733 7.246 1.00 4.35 C ATOM 1830 C PHE A 118 -21.563 -17.410 6.781 1.00 22.42 C ATOM 1831 O PHE A 118 -20.699 -16.839 7.448 1.00 61.23 O ATOM 1832 CB PHE A 118 -21.897 -19.822 6.207 1.00 71.55 C ATOM 1833 CG PHE A 118 -20.581 -20.521 6.396 1.00 1.30 C ATOM 1834 CD1 PHE A 118 -19.392 -19.810 6.358 1.00 54.52 C ATOM 1835 CD2 PHE A 118 -20.532 -21.889 6.612 1.00 51.41 C ATOM 1836 CE1 PHE A 118 -18.179 -20.449 6.532 1.00 15.02 C ATOM 1837 CE2 PHE A 118 -19.322 -22.533 6.787 1.00 33.34 C ATOM 1838 CZ PHE A 118 -18.144 -21.813 6.746 1.00 15.13 C ATOM 0 H PHE A 118 -24.172 -19.294 7.003 1.00 23.23 H new ATOM 0 HA PHE A 118 -21.696 -19.016 8.188 1.00 4.35 H new ATOM 0 HB2 PHE A 118 -22.699 -20.559 6.249 1.00 71.55 H new ATOM 0 HB3 PHE A 118 -21.923 -19.378 5.212 1.00 71.55 H new ATOM 0 HD1 PHE A 118 -19.414 -18.743 6.190 1.00 54.52 H new ATOM 0 HD2 PHE A 118 -21.449 -22.458 6.644 1.00 51.41 H new ATOM 0 HE1 PHE A 118 -17.260 -19.883 6.501 1.00 15.02 H new ATOM 0 HE2 PHE A 118 -19.297 -23.599 6.956 1.00 33.34 H new ATOM 0 HZ PHE A 118 -17.198 -22.316 6.881 1.00 15.13 H new ATOM 1848 N THR A 119 -22.024 -16.928 5.631 1.00 33.53 N ATOM 1849 CA THR A 119 -21.531 -15.675 5.075 1.00 63.22 C ATOM 1850 C THR A 119 -21.940 -14.490 5.941 1.00 0.24 C ATOM 1851 O THR A 119 -21.171 -13.545 6.123 1.00 75.21 O ATOM 1852 CB THR A 119 -22.051 -15.453 3.642 1.00 31.11 C ATOM 1853 OG1 THR A 119 -23.430 -15.068 3.676 1.00 42.41 O ATOM 1854 CG2 THR A 119 -21.892 -16.715 2.807 1.00 14.21 C ATOM 0 H THR A 119 -22.739 -17.387 5.067 1.00 33.53 H new ATOM 0 HA THR A 119 -20.444 -15.746 5.052 1.00 63.22 H new ATOM 0 HB THR A 119 -21.463 -14.657 3.185 1.00 31.11 H new ATOM 0 HG1 THR A 119 -23.753 -14.927 2.762 1.00 42.41 H new ATOM 0 HG21 THR A 119 -22.266 -16.534 1.799 1.00 14.21 H new ATOM 0 HG22 THR A 119 -20.838 -16.989 2.759 1.00 14.21 H new ATOM 0 HG23 THR A 119 -22.458 -17.527 3.264 1.00 14.21 H new ATOM 1862 N LYS A 120 -23.155 -14.545 6.476 1.00 72.23 N ATOM 1863 CA LYS A 120 -23.667 -13.477 7.326 1.00 72.01 C ATOM 1864 C LYS A 120 -22.714 -13.199 8.483 1.00 4.35 C ATOM 1865 O LYS A 120 -22.656 -12.082 8.996 1.00 10.34 O ATOM 1866 CB LYS A 120 -25.050 -13.847 7.868 1.00 42.22 C ATOM 1867 CG LYS A 120 -26.036 -12.691 7.859 1.00 64.43 C ATOM 1868 CD LYS A 120 -27.356 -13.080 8.502 1.00 11.03 C ATOM 1869 CE LYS A 120 -28.364 -13.551 7.465 1.00 14.24 C ATOM 1870 NZ LYS A 120 -29.675 -12.859 7.612 1.00 21.01 N ATOM 0 H LYS A 120 -23.804 -15.319 6.336 1.00 72.23 H new ATOM 0 HA LYS A 120 -23.750 -12.574 6.722 1.00 72.01 H new ATOM 0 HB2 LYS A 120 -25.457 -14.665 7.274 1.00 42.22 H new ATOM 0 HB3 LYS A 120 -24.944 -14.216 8.888 1.00 42.22 H new ATOM 0 HG2 LYS A 120 -25.607 -11.842 8.391 1.00 64.43 H new ATOM 0 HG3 LYS A 120 -26.211 -12.369 6.833 1.00 64.43 H new ATOM 0 HD2 LYS A 120 -27.187 -13.871 9.232 1.00 11.03 H new ATOM 0 HD3 LYS A 120 -27.763 -12.227 9.045 1.00 11.03 H new ATOM 0 HE2 LYS A 120 -27.968 -13.371 6.466 1.00 14.24 H new ATOM 0 HE3 LYS A 120 -28.508 -14.627 7.561 1.00 14.24 H new ATOM 0 HZ1 LYS A 120 -30.335 -13.207 6.887 1.00 21.01 H new ATOM 0 HZ2 LYS A 120 -30.065 -13.052 8.557 1.00 21.01 H new ATOM 0 HZ3 LYS A 120 -29.542 -11.834 7.495 1.00 21.01 H new ATOM 1884 N GLU A 121 -21.967 -14.221 8.888 1.00 21.33 N ATOM 1885 CA GLU A 121 -21.016 -14.085 9.985 1.00 45.31 C ATOM 1886 C GLU A 121 -19.688 -13.520 9.487 1.00 72.35 C ATOM 1887 O GLU A 121 -18.947 -12.889 10.240 1.00 21.33 O ATOM 1888 CB GLU A 121 -20.785 -15.438 10.661 1.00 12.32 C ATOM 1889 CG GLU A 121 -20.531 -15.336 12.156 1.00 52.32 C ATOM 1890 CD GLU A 121 -19.635 -16.445 12.672 1.00 11.43 C ATOM 1891 OE1 GLU A 121 -18.403 -16.339 12.500 1.00 5.14 O ATOM 1892 OE2 GLU A 121 -20.166 -17.417 13.248 1.00 64.43 O ATOM 0 H GLU A 121 -22.002 -15.152 8.473 1.00 21.33 H new ATOM 0 HA GLU A 121 -21.437 -13.391 10.712 1.00 45.31 H new ATOM 0 HB2 GLU A 121 -21.655 -16.073 10.491 1.00 12.32 H new ATOM 0 HB3 GLU A 121 -19.934 -15.930 10.189 1.00 12.32 H new ATOM 0 HG2 GLU A 121 -20.074 -14.372 12.378 1.00 52.32 H new ATOM 0 HG3 GLU A 121 -21.483 -15.367 12.686 1.00 52.32 H new ATOM 1899 N PHE A 122 -19.395 -13.753 8.211 1.00 3.24 N ATOM 1900 CA PHE A 122 -18.156 -13.270 7.612 1.00 54.34 C ATOM 1901 C PHE A 122 -18.308 -11.827 7.138 1.00 73.35 C ATOM 1902 O PHE A 122 -17.331 -11.083 7.056 1.00 54.44 O ATOM 1903 CB PHE A 122 -17.750 -14.164 6.438 1.00 13.14 C ATOM 1904 CG PHE A 122 -16.395 -13.839 5.878 1.00 21.44 C ATOM 1905 CD1 PHE A 122 -16.254 -12.899 4.871 1.00 71.14 C ATOM 1906 CD2 PHE A 122 -15.262 -14.475 6.359 1.00 23.24 C ATOM 1907 CE1 PHE A 122 -15.008 -12.598 4.353 1.00 12.23 C ATOM 1908 CE2 PHE A 122 -14.013 -14.178 5.846 1.00 13.24 C ATOM 1909 CZ PHE A 122 -13.887 -13.239 4.841 1.00 5.13 C ATOM 0 H PHE A 122 -19.998 -14.273 7.573 1.00 3.24 H new ATOM 0 HA PHE A 122 -17.376 -13.304 8.373 1.00 54.34 H new ATOM 0 HB2 PHE A 122 -17.760 -15.204 6.763 1.00 13.14 H new ATOM 0 HB3 PHE A 122 -18.493 -14.071 5.646 1.00 13.14 H new ATOM 0 HD1 PHE A 122 -17.128 -12.395 4.486 1.00 71.14 H new ATOM 0 HD2 PHE A 122 -15.356 -15.211 7.144 1.00 23.24 H new ATOM 0 HE1 PHE A 122 -14.912 -11.863 3.568 1.00 12.23 H new ATOM 0 HE2 PHE A 122 -13.137 -14.679 6.231 1.00 13.24 H new ATOM 0 HZ PHE A 122 -12.913 -13.007 4.437 1.00 5.13 H new ATOM 1919 N VAL A 123 -19.541 -11.440 6.826 1.00 51.14 N ATOM 1920 CA VAL A 123 -19.823 -10.087 6.360 1.00 25.20 C ATOM 1921 C VAL A 123 -19.332 -9.048 7.362 1.00 43.13 C ATOM 1922 O VAL A 123 -19.041 -7.909 6.997 1.00 64.53 O ATOM 1923 CB VAL A 123 -21.329 -9.879 6.118 1.00 73.11 C ATOM 1924 CG1 VAL A 123 -21.611 -8.442 5.708 1.00 0.53 C ATOM 1925 CG2 VAL A 123 -21.839 -10.852 5.065 1.00 45.32 C ATOM 0 H VAL A 123 -20.361 -12.044 6.887 1.00 51.14 H new ATOM 0 HA VAL A 123 -19.291 -9.959 5.417 1.00 25.20 H new ATOM 0 HB VAL A 123 -21.859 -10.076 7.050 1.00 73.11 H new ATOM 0 HG11 VAL A 123 -22.681 -8.314 5.541 1.00 0.53 H new ATOM 0 HG12 VAL A 123 -21.284 -7.767 6.499 1.00 0.53 H new ATOM 0 HG13 VAL A 123 -21.071 -8.213 4.789 1.00 0.53 H new ATOM 0 HG21 VAL A 123 -22.905 -10.691 4.907 1.00 45.32 H new ATOM 0 HG22 VAL A 123 -21.304 -10.689 4.129 1.00 45.32 H new ATOM 0 HG23 VAL A 123 -21.673 -11.875 5.404 1.00 45.32 H new ATOM 1935 N GLU A 124 -19.242 -9.449 8.626 1.00 0.30 N ATOM 1936 CA GLU A 124 -18.786 -8.551 9.681 1.00 53.22 C ATOM 1937 C GLU A 124 -17.362 -8.073 9.411 1.00 32.42 C ATOM 1938 O GLU A 124 -16.952 -7.013 9.884 1.00 65.53 O ATOM 1939 CB GLU A 124 -18.853 -9.250 11.040 1.00 2.23 C ATOM 1940 CG GLU A 124 -20.263 -9.372 11.594 1.00 43.15 C ATOM 1941 CD GLU A 124 -20.322 -10.203 12.860 1.00 34.32 C ATOM 1942 OE1 GLU A 124 -19.545 -11.175 12.969 1.00 43.44 O ATOM 1943 OE2 GLU A 124 -21.146 -9.883 13.742 1.00 31.44 O ATOM 0 H GLU A 124 -19.478 -10.389 8.944 1.00 0.30 H new ATOM 0 HA GLU A 124 -19.445 -7.683 9.695 1.00 53.22 H new ATOM 0 HB2 GLU A 124 -18.420 -10.246 10.948 1.00 2.23 H new ATOM 0 HB3 GLU A 124 -18.238 -8.700 11.753 1.00 2.23 H new ATOM 0 HG2 GLU A 124 -20.656 -8.376 11.799 1.00 43.15 H new ATOM 0 HG3 GLU A 124 -20.909 -9.821 10.839 1.00 43.15 H new ATOM 1950 N SER A 125 -16.614 -8.864 8.649 1.00 65.11 N ATOM 1951 CA SER A 125 -15.234 -8.525 8.320 1.00 60.45 C ATOM 1952 C SER A 125 -15.147 -7.126 7.719 1.00 42.24 C ATOM 1953 O SER A 125 -14.178 -6.401 7.943 1.00 23.04 O ATOM 1954 CB SER A 125 -14.655 -9.550 7.342 1.00 43.42 C ATOM 1955 OG SER A 125 -13.252 -9.672 7.503 1.00 51.22 O ATOM 0 H SER A 125 -16.940 -9.743 8.248 1.00 65.11 H new ATOM 0 HA SER A 125 -14.651 -8.542 9.241 1.00 60.45 H new ATOM 0 HB2 SER A 125 -15.128 -10.519 7.503 1.00 43.42 H new ATOM 0 HB3 SER A 125 -14.882 -9.250 6.319 1.00 43.42 H new ATOM 0 HG SER A 125 -12.906 -10.334 6.868 1.00 51.22 H new ATOM 1961 N SER A 126 -16.167 -6.753 6.953 1.00 53.21 N ATOM 1962 CA SER A 126 -16.206 -5.442 6.316 1.00 44.24 C ATOM 1963 C SER A 126 -15.966 -4.334 7.337 1.00 73.10 C ATOM 1964 O SER A 126 -15.116 -3.466 7.139 1.00 51.41 O ATOM 1965 CB SER A 126 -17.552 -5.228 5.621 1.00 62.33 C ATOM 1966 OG SER A 126 -17.397 -4.478 4.429 1.00 51.42 O ATOM 0 H SER A 126 -16.978 -7.340 6.758 1.00 53.21 H new ATOM 0 HA SER A 126 -15.411 -5.404 5.571 1.00 44.24 H new ATOM 0 HB2 SER A 126 -18.004 -6.193 5.391 1.00 62.33 H new ATOM 0 HB3 SER A 126 -18.234 -4.709 6.295 1.00 62.33 H new ATOM 0 HG SER A 126 -18.271 -4.357 4.003 1.00 51.42 H new ATOM 1972 N ILE A 127 -16.722 -4.372 8.429 1.00 10.22 N ATOM 1973 CA ILE A 127 -16.592 -3.373 9.482 1.00 1.54 C ATOM 1974 C ILE A 127 -15.466 -3.732 10.445 1.00 23.34 C ATOM 1975 O ILE A 127 -14.903 -2.864 11.113 1.00 40.03 O ATOM 1976 CB ILE A 127 -17.902 -3.218 10.277 1.00 31.41 C ATOM 1977 CG1 ILE A 127 -19.106 -3.273 9.334 1.00 63.21 C ATOM 1978 CG2 ILE A 127 -17.896 -1.915 11.061 1.00 3.42 C ATOM 1979 CD1 ILE A 127 -19.777 -4.628 9.289 1.00 64.24 C ATOM 0 H ILE A 127 -17.431 -5.084 8.607 1.00 10.22 H new ATOM 0 HA ILE A 127 -16.360 -2.427 8.992 1.00 1.54 H new ATOM 0 HB ILE A 127 -17.980 -4.044 10.984 1.00 31.41 H new ATOM 0 HG12 ILE A 127 -19.836 -2.525 9.645 1.00 63.21 H new ATOM 0 HG13 ILE A 127 -18.782 -3.003 8.329 1.00 63.21 H new ATOM 0 HG21 ILE A 127 -18.829 -1.821 11.617 1.00 3.42 H new ATOM 0 HG22 ILE A 127 -17.057 -1.913 11.757 1.00 3.42 H new ATOM 0 HG23 ILE A 127 -17.798 -1.076 10.372 1.00 3.42 H new ATOM 0 HD11 ILE A 127 -20.622 -4.593 8.601 1.00 64.24 H new ATOM 0 HD12 ILE A 127 -19.062 -5.377 8.948 1.00 64.24 H new ATOM 0 HD13 ILE A 127 -20.132 -4.892 10.285 1.00 64.24 H new ATOM 1991 N LYS A 128 -15.140 -5.019 10.512 1.00 42.32 N ATOM 1992 CA LYS A 128 -14.078 -5.495 11.390 1.00 32.14 C ATOM 1993 C LYS A 128 -12.751 -4.824 11.054 1.00 43.54 C ATOM 1994 O LYS A 128 -11.926 -4.581 11.935 1.00 11.03 O ATOM 1995 CB LYS A 128 -13.937 -7.015 11.276 1.00 43.42 C ATOM 1996 CG LYS A 128 -13.516 -7.686 12.572 1.00 41.23 C ATOM 1997 CD LYS A 128 -14.702 -8.314 13.285 1.00 65.44 C ATOM 1998 CE LYS A 128 -14.446 -8.450 14.778 1.00 52.21 C ATOM 1999 NZ LYS A 128 -13.693 -9.693 15.101 1.00 1.14 N ATOM 0 H LYS A 128 -15.597 -5.751 9.968 1.00 42.32 H new ATOM 0 HA LYS A 128 -14.345 -5.237 12.415 1.00 32.14 H new ATOM 0 HB2 LYS A 128 -14.888 -7.436 10.951 1.00 43.42 H new ATOM 0 HB3 LYS A 128 -13.205 -7.247 10.502 1.00 43.42 H new ATOM 0 HG2 LYS A 128 -12.770 -8.452 12.361 1.00 41.23 H new ATOM 0 HG3 LYS A 128 -13.044 -6.953 13.226 1.00 41.23 H new ATOM 0 HD2 LYS A 128 -15.591 -7.705 13.121 1.00 65.44 H new ATOM 0 HD3 LYS A 128 -14.906 -9.296 12.859 1.00 65.44 H new ATOM 0 HE2 LYS A 128 -13.886 -7.584 15.131 1.00 52.21 H new ATOM 0 HE3 LYS A 128 -15.397 -8.453 15.311 1.00 52.21 H new ATOM 0 HZ1 LYS A 128 -13.539 -9.748 16.128 1.00 1.14 H new ATOM 0 HZ2 LYS A 128 -14.239 -10.521 14.788 1.00 1.14 H new ATOM 0 HZ3 LYS A 128 -12.775 -9.679 14.613 1.00 1.14 H new ATOM 2013 N ILE A 129 -12.552 -4.525 9.774 1.00 1.33 N ATOM 2014 CA ILE A 129 -11.326 -3.879 9.323 1.00 43.41 C ATOM 2015 C ILE A 129 -11.378 -2.373 9.561 1.00 60.24 C ATOM 2016 O ILE A 129 -10.522 -1.811 10.244 1.00 3.40 O ATOM 2017 CB ILE A 129 -11.068 -4.142 7.828 1.00 70.24 C ATOM 2018 CG1 ILE A 129 -11.042 -5.647 7.550 1.00 52.44 C ATOM 2019 CG2 ILE A 129 -9.761 -3.495 7.393 1.00 34.22 C ATOM 2020 CD1 ILE A 129 -11.082 -5.990 6.077 1.00 51.31 C ATOM 0 H ILE A 129 -13.224 -4.720 9.032 1.00 1.33 H new ATOM 0 HA ILE A 129 -10.511 -4.309 9.905 1.00 43.41 H new ATOM 0 HB ILE A 129 -11.879 -3.698 7.251 1.00 70.24 H new ATOM 0 HG12 ILE A 129 -10.141 -6.074 7.990 1.00 52.44 H new ATOM 0 HG13 ILE A 129 -11.892 -6.115 8.047 1.00 52.44 H new ATOM 0 HG21 ILE A 129 -9.593 -3.690 6.334 1.00 34.22 H new ATOM 0 HG22 ILE A 129 -9.814 -2.419 7.560 1.00 34.22 H new ATOM 0 HG23 ILE A 129 -8.938 -3.912 7.974 1.00 34.22 H new ATOM 0 HD11 ILE A 129 -11.061 -7.073 5.955 1.00 51.31 H new ATOM 0 HD12 ILE A 129 -11.996 -5.593 5.636 1.00 51.31 H new ATOM 0 HD13 ILE A 129 -10.218 -5.552 5.578 1.00 51.31 H new ATOM 2032 N THR A 130 -12.390 -1.725 8.993 1.00 14.31 N ATOM 2033 CA THR A 130 -12.556 -0.285 9.143 1.00 2.54 C ATOM 2034 C THR A 130 -12.667 0.106 10.613 1.00 64.23 C ATOM 2035 O THR A 130 -12.401 1.249 10.982 1.00 43.12 O ATOM 2036 CB THR A 130 -13.804 0.219 8.395 1.00 73.24 C ATOM 2037 OG1 THR A 130 -14.848 -0.758 8.471 1.00 33.31 O ATOM 2038 CG2 THR A 130 -13.481 0.509 6.937 1.00 44.50 C ATOM 0 H THR A 130 -13.107 -2.175 8.425 1.00 14.31 H new ATOM 0 HA THR A 130 -11.670 0.181 8.711 1.00 2.54 H new ATOM 0 HB THR A 130 -14.135 1.143 8.868 1.00 73.24 H new ATOM 0 HG1 THR A 130 -15.639 -0.430 7.994 1.00 33.31 H new ATOM 0 HG21 THR A 130 -14.378 0.864 6.429 1.00 44.50 H new ATOM 0 HG22 THR A 130 -12.706 1.274 6.881 1.00 44.50 H new ATOM 0 HG23 THR A 130 -13.127 -0.402 6.455 1.00 44.50 H new ATOM 2046 N GLU A 131 -13.060 -0.852 11.447 1.00 52.33 N ATOM 2047 CA GLU A 131 -13.206 -0.606 12.877 1.00 61.14 C ATOM 2048 C GLU A 131 -11.880 -0.168 13.491 1.00 24.03 C ATOM 2049 O GLU A 131 -11.848 0.403 14.581 1.00 41.13 O ATOM 2050 CB GLU A 131 -13.717 -1.863 13.583 1.00 35.21 C ATOM 2051 CG GLU A 131 -13.714 -1.754 15.099 1.00 53.44 C ATOM 2052 CD GLU A 131 -12.497 -2.402 15.728 1.00 62.41 C ATOM 2053 OE1 GLU A 131 -12.428 -3.649 15.740 1.00 65.13 O ATOM 2054 OE2 GLU A 131 -11.613 -1.662 16.208 1.00 22.44 O ATOM 0 H GLU A 131 -13.283 -1.804 11.157 1.00 52.33 H new ATOM 0 HA GLU A 131 -13.931 0.197 13.010 1.00 61.14 H new ATOM 0 HB2 GLU A 131 -14.732 -2.073 13.244 1.00 35.21 H new ATOM 0 HB3 GLU A 131 -13.100 -2.712 13.287 1.00 35.21 H new ATOM 0 HG2 GLU A 131 -13.749 -0.702 15.384 1.00 53.44 H new ATOM 0 HG3 GLU A 131 -14.615 -2.222 15.495 1.00 53.44 H new ATOM 2061 N GLU A 132 -10.787 -0.441 12.784 1.00 35.02 N ATOM 2062 CA GLU A 132 -9.459 -0.076 13.261 1.00 24.51 C ATOM 2063 C GLU A 132 -9.127 1.368 12.896 1.00 23.40 C ATOM 2064 O GLU A 132 -8.319 2.017 13.559 1.00 4.55 O ATOM 2065 CB GLU A 132 -8.405 -1.018 12.673 1.00 54.32 C ATOM 2066 CG GLU A 132 -7.630 -1.796 13.723 1.00 72.04 C ATOM 2067 CD GLU A 132 -8.332 -3.075 14.137 1.00 42.11 C ATOM 2068 OE1 GLU A 132 -8.143 -4.103 13.453 1.00 3.21 O ATOM 2069 OE2 GLU A 132 -9.070 -3.048 15.144 1.00 63.12 O ATOM 0 H GLU A 132 -10.796 -0.913 11.880 1.00 35.02 H new ATOM 0 HA GLU A 132 -9.453 -0.168 14.347 1.00 24.51 H new ATOM 0 HB2 GLU A 132 -8.894 -1.722 11.999 1.00 54.32 H new ATOM 0 HB3 GLU A 132 -7.705 -0.437 12.073 1.00 54.32 H new ATOM 0 HG2 GLU A 132 -6.641 -2.038 13.334 1.00 72.04 H new ATOM 0 HG3 GLU A 132 -7.482 -1.167 14.601 1.00 72.04 H new ATOM 2076 N VAL A 133 -9.756 1.863 11.835 1.00 13.34 N ATOM 2077 CA VAL A 133 -9.529 3.230 11.381 1.00 11.13 C ATOM 2078 C VAL A 133 -10.469 4.205 12.082 1.00 45.21 C ATOM 2079 O VAL A 133 -10.165 5.392 12.209 1.00 32.23 O ATOM 2080 CB VAL A 133 -9.721 3.355 9.858 1.00 24.51 C ATOM 2081 CG1 VAL A 133 -11.124 3.844 9.534 1.00 20.14 C ATOM 2082 CG2 VAL A 133 -8.673 4.284 9.264 1.00 62.40 C ATOM 0 H VAL A 133 -10.427 1.338 11.274 1.00 13.34 H new ATOM 0 HA VAL A 133 -8.498 3.479 11.631 1.00 11.13 H new ATOM 0 HB VAL A 133 -9.595 2.369 9.411 1.00 24.51 H new ATOM 0 HG11 VAL A 133 -11.240 3.926 8.453 1.00 20.14 H new ATOM 0 HG12 VAL A 133 -11.855 3.137 9.925 1.00 20.14 H new ATOM 0 HG13 VAL A 133 -11.284 4.821 9.991 1.00 20.14 H new ATOM 0 HG21 VAL A 133 -8.823 4.361 8.187 1.00 62.40 H new ATOM 0 HG22 VAL A 133 -8.765 5.272 9.715 1.00 62.40 H new ATOM 0 HG23 VAL A 133 -7.678 3.886 9.464 1.00 62.40 H new ATOM 2092 N ILE A 134 -11.610 3.697 12.535 1.00 64.12 N ATOM 2093 CA ILE A 134 -12.593 4.523 13.224 1.00 23.15 C ATOM 2094 C ILE A 134 -12.073 4.977 14.584 1.00 24.22 C ATOM 2095 O ILE A 134 -12.531 5.978 15.133 1.00 74.40 O ATOM 2096 CB ILE A 134 -13.922 3.770 13.421 1.00 1.21 C ATOM 2097 CG1 ILE A 134 -13.796 2.758 14.561 1.00 30.24 C ATOM 2098 CG2 ILE A 134 -14.333 3.075 12.131 1.00 2.45 C ATOM 2099 CD1 ILE A 134 -14.309 3.274 15.887 1.00 14.12 C ATOM 0 H ILE A 134 -11.876 2.717 12.437 1.00 64.12 H new ATOM 0 HA ILE A 134 -12.769 5.395 12.595 1.00 23.15 H new ATOM 0 HB ILE A 134 -14.696 4.491 13.685 1.00 1.21 H new ATOM 0 HG12 ILE A 134 -14.344 1.854 14.296 1.00 30.24 H new ATOM 0 HG13 ILE A 134 -12.749 2.475 14.671 1.00 30.24 H new ATOM 0 HG21 ILE A 134 -15.274 2.547 12.286 1.00 2.45 H new ATOM 0 HG22 ILE A 134 -14.459 3.817 11.342 1.00 2.45 H new ATOM 0 HG23 ILE A 134 -13.561 2.363 11.840 1.00 2.45 H new ATOM 0 HD11 ILE A 134 -14.188 2.504 16.649 1.00 14.12 H new ATOM 0 HD12 ILE A 134 -13.745 4.161 16.175 1.00 14.12 H new ATOM 0 HD13 ILE A 134 -15.364 3.530 15.794 1.00 14.12 H new ATOM 2111 N ASN A 135 -11.110 4.234 15.121 1.00 12.05 N ATOM 2112 CA ASN A 135 -10.526 4.561 16.417 1.00 21.32 C ATOM 2113 C ASN A 135 -10.053 6.011 16.450 1.00 22.25 C ATOM 2114 O ASN A 135 -10.066 6.656 17.499 1.00 1.51 O ATOM 2115 CB ASN A 135 -9.356 3.624 16.723 1.00 23.41 C ATOM 2116 CG ASN A 135 -8.060 4.375 16.960 1.00 10.03 C ATOM 2117 OD1 ASN A 135 -7.727 4.718 18.095 1.00 71.01 O ATOM 2118 ND2 ASN A 135 -7.322 4.635 15.887 1.00 21.34 N ATOM 0 H ASN A 135 -10.718 3.402 14.679 1.00 12.05 H new ATOM 0 HA ASN A 135 -11.296 4.431 17.178 1.00 21.32 H new ATOM 0 HB2 ASN A 135 -9.593 3.027 17.604 1.00 23.41 H new ATOM 0 HB3 ASN A 135 -9.224 2.930 15.893 1.00 23.41 H new ATOM 0 HD21 ASN A 135 -6.440 5.138 15.984 1.00 21.34 H new ATOM 0 HD22 ASN A 135 -7.637 4.332 14.966 1.00 21.34 H new ATOM 2125 N THR A 136 -9.635 6.518 15.295 1.00 52.13 N ATOM 2126 CA THR A 136 -9.157 7.891 15.191 1.00 54.11 C ATOM 2127 C THR A 136 -10.267 8.825 14.723 1.00 51.52 C ATOM 2128 O THR A 136 -10.354 9.972 15.163 1.00 1.23 O ATOM 2129 CB THR A 136 -7.967 8.000 14.220 1.00 62.44 C ATOM 2130 OG1 THR A 136 -7.871 6.811 13.427 1.00 74.02 O ATOM 2131 CG2 THR A 136 -6.666 8.214 14.979 1.00 14.24 C ATOM 0 H THR A 136 -9.618 5.998 14.418 1.00 52.13 H new ATOM 0 HA THR A 136 -8.831 8.188 16.188 1.00 54.11 H new ATOM 0 HB THR A 136 -8.136 8.858 13.570 1.00 62.44 H new ATOM 0 HG1 THR A 136 -8.390 6.924 12.604 1.00 74.02 H new ATOM 0 HG21 THR A 136 -5.840 8.288 14.272 1.00 14.24 H new ATOM 0 HG22 THR A 136 -6.730 9.135 15.559 1.00 14.24 H new ATOM 0 HG23 THR A 136 -6.494 7.373 15.651 1.00 14.24 H new ATOM 2139 N HIS A 137 -11.115 8.328 13.828 1.00 50.30 N ATOM 2140 CA HIS A 137 -12.221 9.119 13.301 1.00 52.52 C ATOM 2141 C HIS A 137 -13.181 9.522 14.416 1.00 33.22 C ATOM 2142 O HIS A 137 -13.739 10.620 14.403 1.00 20.34 O ATOM 2143 CB HIS A 137 -12.971 8.333 12.225 1.00 13.23 C ATOM 2144 CG HIS A 137 -13.417 9.175 11.069 1.00 25.21 C ATOM 2145 ND1 HIS A 137 -13.513 8.693 9.781 1.00 43.14 N ATOM 2146 CD2 HIS A 137 -13.795 10.473 11.013 1.00 45.30 C ATOM 2147 CE1 HIS A 137 -13.929 9.659 8.982 1.00 43.43 C ATOM 2148 NE2 HIS A 137 -14.108 10.750 9.705 1.00 44.11 N ATOM 0 H HIS A 137 -11.057 7.381 13.453 1.00 50.30 H new ATOM 0 HA HIS A 137 -11.808 10.025 12.857 1.00 52.52 H new ATOM 0 HB2 HIS A 137 -12.328 7.535 11.855 1.00 13.23 H new ATOM 0 HB3 HIS A 137 -13.842 7.858 12.675 1.00 13.23 H new ATOM 0 HD2 HIS A 137 -13.842 11.163 11.843 1.00 45.30 H new ATOM 0 HE1 HIS A 137 -14.095 9.572 7.918 1.00 43.43 H new ATOM 0 HE2 HIS A 137 -14.427 11.651 9.350 1.00 44.11 H new ATOM 2156 N HIS A 138 -13.370 8.626 15.380 1.00 73.32 N ATOM 2157 CA HIS A 138 -14.263 8.888 16.503 1.00 74.42 C ATOM 2158 C HIS A 138 -13.710 9.999 17.389 1.00 0.23 C ATOM 2159 O HIS A 138 -14.414 10.955 17.716 1.00 73.24 O ATOM 2160 CB HIS A 138 -14.467 7.616 17.327 1.00 73.01 C ATOM 2161 CG HIS A 138 -15.776 7.577 18.054 1.00 20.02 C ATOM 2162 ND1 HIS A 138 -15.903 7.887 19.392 1.00 53.33 N ATOM 2163 CD2 HIS A 138 -17.020 7.263 17.622 1.00 2.23 C ATOM 2164 CE1 HIS A 138 -17.168 7.764 19.751 1.00 14.45 C ATOM 2165 NE2 HIS A 138 -17.867 7.387 18.696 1.00 50.11 N ATOM 0 H HIS A 138 -12.917 7.713 15.406 1.00 73.32 H new ATOM 0 HA HIS A 138 -15.224 9.211 16.103 1.00 74.42 H new ATOM 0 HB2 HIS A 138 -14.401 6.751 16.667 1.00 73.01 H new ATOM 0 HB3 HIS A 138 -13.656 7.527 18.050 1.00 73.01 H new ATOM 0 HD2 HIS A 138 -17.295 6.970 16.620 1.00 2.23 H new ATOM 0 HE1 HIS A 138 -17.564 7.942 20.740 1.00 14.45 H new ATOM 0 HE2 HIS A 138 -18.872 7.216 18.681 1.00 50.11 H new ATOM 2173 N ARG A 139 -12.445 9.867 17.776 1.00 34.20 N ATOM 2174 CA ARG A 139 -11.799 10.859 18.626 1.00 24.13 C ATOM 2175 C ARG A 139 -11.902 12.252 18.012 1.00 64.33 C ATOM 2176 O ARG A 139 -12.675 13.090 18.475 1.00 72.22 O ATOM 2177 CB ARG A 139 -10.329 10.494 18.845 1.00 32.23 C ATOM 2178 CG ARG A 139 -10.122 9.396 19.875 1.00 25.44 C ATOM 2179 CD ARG A 139 -8.869 8.585 19.580 1.00 35.52 C ATOM 2180 NE ARG A 139 -8.890 7.285 20.246 1.00 63.21 N ATOM 2181 CZ ARG A 139 -7.820 6.508 20.374 1.00 62.11 C ATOM 2182 NH1 ARG A 139 -6.651 6.898 19.885 1.00 61.14 N ATOM 2183 NH2 ARG A 139 -7.918 5.338 20.993 1.00 41.41 N ATOM 0 H ARG A 139 -11.848 9.083 17.514 1.00 34.20 H new ATOM 0 HA ARG A 139 -12.312 10.866 19.588 1.00 24.13 H new ATOM 0 HB2 ARG A 139 -9.897 10.177 17.896 1.00 32.23 H new ATOM 0 HB3 ARG A 139 -9.785 11.384 19.161 1.00 32.23 H new ATOM 0 HG2 ARG A 139 -10.046 9.837 20.869 1.00 25.44 H new ATOM 0 HG3 ARG A 139 -10.990 8.736 19.885 1.00 25.44 H new ATOM 0 HD2 ARG A 139 -8.776 8.440 18.504 1.00 35.52 H new ATOM 0 HD3 ARG A 139 -7.991 9.144 19.903 1.00 35.52 H new ATOM 0 HE ARG A 139 -9.774 6.956 20.634 1.00 63.21 H new ATOM 0 HH11 ARG A 139 -6.571 7.797 19.409 1.00 61.14 H new ATOM 0 HH12 ARG A 139 -5.831 6.299 19.985 1.00 61.14 H new ATOM 0 HH21 ARG A 139 -8.815 5.035 21.371 1.00 41.41 H new ATOM 0 HH22 ARG A 139 -7.096 4.742 21.091 1.00 41.41 H new ATOM 2197 N SER A 140 -11.116 12.491 16.967 1.00 50.44 N ATOM 2198 CA SER A 140 -11.116 13.784 16.291 1.00 24.31 C ATOM 2199 C SER A 140 -11.131 13.605 14.776 1.00 33.30 C ATOM 2200 O SER A 140 -11.750 14.386 14.055 1.00 31.14 O ATOM 2201 CB SER A 140 -9.890 14.600 16.707 1.00 72.21 C ATOM 2202 OG SER A 140 -9.613 14.437 18.087 1.00 31.40 O ATOM 0 H SER A 140 -10.472 11.807 16.570 1.00 50.44 H new ATOM 0 HA SER A 140 -12.018 14.320 16.585 1.00 24.31 H new ATOM 0 HB2 SER A 140 -9.026 14.289 16.120 1.00 72.21 H new ATOM 0 HB3 SER A 140 -10.060 15.654 16.489 1.00 72.21 H new ATOM 0 HG SER A 140 -8.825 14.967 18.327 1.00 31.40 H new TER 2208 SER A 140