USER MOD reduce.3.24.130724 H: found=0, std=0, add=909, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 907 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 38 SER OG : rot 131:sc= 1.28 USER MOD Set 1.2: A 40 TYR OH : rot 180:sc= 0.706 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0151 USER MOD Single : A 3 SER OG : rot 180:sc= -0.069 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 138:sc= -1.58 (180deg=-4.47!) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot -130:sc= -0.508 USER MOD Single : A 20 GLN : amide:sc= -1.01! C(o=-1!,f=-2.9!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= -0.666 X(o=-0.67,f=-1) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot -174:sc= -0.852 USER MOD Single : A 39 TYR OH : rot 15:sc= -0.876 USER MOD Single : A 41 ASN : amide:sc= -0.846 K(o=-0.85,f=-8.6!) USER MOD Single : A 42 ASN : amide:sc= -0.87 K(o=-0.87,f=-1.7) USER MOD Single : A 44 LYS NZ :NH3+ -146:sc= -0.544 (180deg=-2.07!) USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -165:sc= 0.211 (180deg=-0.00826) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 66 ASN : amide:sc= -0.172 X(o=-0.17,f=-0.34) USER MOD Single : A 67 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0101) USER MOD Single : A 72 THR OG1 : rot -60:sc= -0.124 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -0.116 X(o=-0.12,f=-0.12) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= -0.0105 K(o=-0.011,f=-0.82) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -0.0365 X(o=-0.037,f=-0.037) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot -58:sc= 1.25 USER MOD Single : A 105 SER OG : rot 14:sc= 0.0125 USER MOD Single : A 106 GLN : amide:sc= -0.799 K(o=-0.8,f=-2.8!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 GLN : amide:sc=-0.00138 X(o=-0.0014,f=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0.0117 USER MOD Single : A 114 SER OG : rot 180:sc= -0.0335 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -6.308 -11.836 18.118 1.00 0.00 N ATOM 2 CA GLY A 1 -5.909 -10.632 18.823 1.00 0.00 C ATOM 3 C GLY A 1 -4.700 -9.967 18.196 1.00 0.00 C ATOM 4 O GLY A 1 -3.698 -10.624 17.914 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.138 -12.253 18.585 1.00 0.00 H new ATOM 0 H2 GLY A 1 -6.547 -11.599 17.134 1.00 0.00 H new ATOM 0 H3 GLY A 1 -5.525 -12.520 18.129 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -6.742 -9.929 18.834 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -5.686 -10.879 19.861 1.00 0.00 H new ATOM 8 N SER A 2 -4.793 -8.659 17.976 1.00 0.00 N ATOM 9 CA SER A 2 -3.700 -7.906 17.372 1.00 0.00 C ATOM 10 C SER A 2 -3.745 -6.444 17.805 1.00 0.00 C ATOM 11 O SER A 2 -4.806 -5.915 18.136 1.00 0.00 O ATOM 12 CB SER A 2 -3.769 -8.000 15.847 1.00 0.00 C ATOM 13 OG SER A 2 -3.605 -9.338 15.410 1.00 0.00 O ATOM 0 H SER A 2 -5.614 -8.099 18.207 1.00 0.00 H new ATOM 0 HA SER A 2 -2.760 -8.340 17.713 1.00 0.00 H new ATOM 0 HB2 SER A 2 -4.728 -7.616 15.499 1.00 0.00 H new ATOM 0 HB3 SER A 2 -2.995 -7.373 15.406 1.00 0.00 H new ATOM 0 HG SER A 2 -3.655 -9.371 14.432 1.00 0.00 H new ATOM 19 N SER A 3 -2.584 -5.796 17.800 1.00 0.00 N ATOM 20 CA SER A 3 -2.488 -4.396 18.196 1.00 0.00 C ATOM 21 C SER A 3 -1.339 -3.703 17.469 1.00 0.00 C ATOM 22 O SER A 3 -0.488 -4.355 16.866 1.00 0.00 O ATOM 23 CB SER A 3 -2.290 -4.284 19.709 1.00 0.00 C ATOM 24 OG SER A 3 -3.298 -4.993 20.409 1.00 0.00 O ATOM 0 H SER A 3 -1.697 -6.218 17.526 1.00 0.00 H new ATOM 0 HA SER A 3 -3.420 -3.902 17.921 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.310 -4.676 19.981 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.307 -3.235 20.005 1.00 0.00 H new ATOM 0 HG SER A 3 -3.148 -4.907 21.374 1.00 0.00 H new ATOM 30 N GLY A 4 -1.323 -2.375 17.531 1.00 0.00 N ATOM 31 CA GLY A 4 -0.276 -1.615 16.874 1.00 0.00 C ATOM 32 C GLY A 4 -0.627 -0.147 16.734 1.00 0.00 C ATOM 33 O GLY A 4 -1.076 0.292 15.675 1.00 0.00 O ATOM 0 H GLY A 4 -2.016 -1.812 18.024 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.650 -1.712 17.441 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -0.090 -2.037 15.886 1.00 0.00 H new ATOM 37 N SER A 5 -0.423 0.614 17.804 1.00 0.00 N ATOM 38 CA SER A 5 -0.726 2.041 17.797 1.00 0.00 C ATOM 39 C SER A 5 0.233 2.795 16.882 1.00 0.00 C ATOM 40 O SER A 5 -0.188 3.457 15.933 1.00 0.00 O ATOM 41 CB SER A 5 -0.648 2.607 19.216 1.00 0.00 C ATOM 42 OG SER A 5 -1.554 1.945 20.081 1.00 0.00 O ATOM 0 H SER A 5 -0.049 0.267 18.687 1.00 0.00 H new ATOM 0 HA SER A 5 -1.739 2.171 17.417 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.367 2.501 19.598 1.00 0.00 H new ATOM 0 HB3 SER A 5 -0.872 3.674 19.198 1.00 0.00 H new ATOM 0 HG SER A 5 -1.483 2.324 20.982 1.00 0.00 H new ATOM 48 N SER A 6 1.526 2.691 17.175 1.00 0.00 N ATOM 49 CA SER A 6 2.546 3.366 16.382 1.00 0.00 C ATOM 50 C SER A 6 3.041 2.466 15.254 1.00 0.00 C ATOM 51 O SER A 6 3.889 1.599 15.463 1.00 0.00 O ATOM 52 CB SER A 6 3.720 3.783 17.270 1.00 0.00 C ATOM 53 OG SER A 6 3.335 4.798 18.181 1.00 0.00 O ATOM 0 H SER A 6 1.891 2.146 17.956 1.00 0.00 H new ATOM 0 HA SER A 6 2.098 4.257 15.942 1.00 0.00 H new ATOM 0 HB2 SER A 6 4.089 2.917 17.820 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.541 4.140 16.649 1.00 0.00 H new ATOM 0 HG SER A 6 4.102 5.046 18.738 1.00 0.00 H new ATOM 59 N GLY A 7 2.504 2.678 14.056 1.00 0.00 N ATOM 60 CA GLY A 7 2.903 1.879 12.912 1.00 0.00 C ATOM 61 C GLY A 7 2.224 2.321 11.631 1.00 0.00 C ATOM 62 O GLY A 7 1.132 1.855 11.305 1.00 0.00 O ATOM 0 H GLY A 7 1.800 3.389 13.858 1.00 0.00 H new ATOM 0 HA2 GLY A 7 3.984 1.943 12.787 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.666 0.832 13.103 1.00 0.00 H new ATOM 66 N LYS A 8 2.871 3.225 10.902 1.00 0.00 N ATOM 67 CA LYS A 8 2.323 3.731 9.649 1.00 0.00 C ATOM 68 C LYS A 8 3.317 3.547 8.507 1.00 0.00 C ATOM 69 O LYS A 8 3.013 3.843 7.352 1.00 0.00 O ATOM 70 CB LYS A 8 1.960 5.211 9.789 1.00 0.00 C ATOM 71 CG LYS A 8 3.085 6.154 9.399 1.00 0.00 C ATOM 72 CD LYS A 8 2.953 7.498 10.096 1.00 0.00 C ATOM 73 CE LYS A 8 4.250 8.290 10.028 1.00 0.00 C ATOM 74 NZ LYS A 8 5.239 7.823 11.039 1.00 0.00 N ATOM 0 H LYS A 8 3.775 3.622 11.158 1.00 0.00 H new ATOM 0 HA LYS A 8 1.422 3.162 9.419 1.00 0.00 H new ATOM 0 HB2 LYS A 8 1.089 5.423 9.169 1.00 0.00 H new ATOM 0 HB3 LYS A 8 1.673 5.410 10.821 1.00 0.00 H new ATOM 0 HG2 LYS A 8 4.044 5.703 9.655 1.00 0.00 H new ATOM 0 HG3 LYS A 8 3.080 6.301 8.319 1.00 0.00 H new ATOM 0 HD2 LYS A 8 2.150 8.072 9.633 1.00 0.00 H new ATOM 0 HD3 LYS A 8 2.674 7.343 11.138 1.00 0.00 H new ATOM 0 HE2 LYS A 8 4.680 8.198 9.030 1.00 0.00 H new ATOM 0 HE3 LYS A 8 4.039 9.347 10.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 6.109 8.388 10.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 4.839 7.934 11.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 5.460 6.821 10.871 1.00 0.00 H new ATOM 88 N VAL A 9 4.507 3.055 8.838 1.00 0.00 N ATOM 89 CA VAL A 9 5.545 2.829 7.840 1.00 0.00 C ATOM 90 C VAL A 9 6.168 1.446 7.998 1.00 0.00 C ATOM 91 O VAL A 9 5.974 0.778 9.014 1.00 0.00 O ATOM 92 CB VAL A 9 6.655 3.893 7.932 1.00 0.00 C ATOM 93 CG1 VAL A 9 6.111 5.265 7.562 1.00 0.00 C ATOM 94 CG2 VAL A 9 7.262 3.910 9.327 1.00 0.00 C ATOM 0 H VAL A 9 4.776 2.805 9.790 1.00 0.00 H new ATOM 0 HA VAL A 9 5.065 2.899 6.864 1.00 0.00 H new ATOM 0 HB VAL A 9 7.441 3.636 7.222 1.00 0.00 H new ATOM 0 HG11 VAL A 9 6.909 6.004 7.633 1.00 0.00 H new ATOM 0 HG12 VAL A 9 5.728 5.241 6.542 1.00 0.00 H new ATOM 0 HG13 VAL A 9 5.306 5.534 8.246 1.00 0.00 H new ATOM 0 HG21 VAL A 9 8.044 4.667 9.374 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.488 4.142 10.058 1.00 0.00 H new ATOM 0 HG23 VAL A 9 7.690 2.932 9.550 1.00 0.00 H new ATOM 104 N LYS A 10 6.918 1.022 6.987 1.00 0.00 N ATOM 105 CA LYS A 10 7.573 -0.281 7.013 1.00 0.00 C ATOM 106 C LYS A 10 8.498 -0.449 5.812 1.00 0.00 C ATOM 107 O LYS A 10 8.189 0.004 4.710 1.00 0.00 O ATOM 108 CB LYS A 10 6.528 -1.399 7.025 1.00 0.00 C ATOM 109 CG LYS A 10 7.004 -2.669 7.709 1.00 0.00 C ATOM 110 CD LYS A 10 5.918 -3.731 7.731 1.00 0.00 C ATOM 111 CE LYS A 10 6.461 -5.074 8.197 1.00 0.00 C ATOM 112 NZ LYS A 10 6.780 -5.068 9.652 1.00 0.00 N ATOM 0 H LYS A 10 7.088 1.562 6.138 1.00 0.00 H new ATOM 0 HA LYS A 10 8.172 -0.341 7.922 1.00 0.00 H new ATOM 0 HB2 LYS A 10 5.630 -1.040 7.528 1.00 0.00 H new ATOM 0 HB3 LYS A 10 6.246 -1.633 5.998 1.00 0.00 H new ATOM 0 HG2 LYS A 10 7.882 -3.055 7.191 1.00 0.00 H new ATOM 0 HG3 LYS A 10 7.311 -2.440 8.729 1.00 0.00 H new ATOM 0 HD2 LYS A 10 5.111 -3.414 8.392 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.490 -3.836 6.734 1.00 0.00 H new ATOM 0 HE2 LYS A 10 5.729 -5.854 7.989 1.00 0.00 H new ATOM 0 HE3 LYS A 10 7.358 -5.320 7.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 6.462 -5.960 10.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 7.807 -4.968 9.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 6.294 -4.271 10.111 1.00 0.00 H new ATOM 126 N SER A 11 9.634 -1.104 6.033 1.00 0.00 N ATOM 127 CA SER A 11 10.605 -1.330 4.969 1.00 0.00 C ATOM 128 C SER A 11 11.361 -2.636 5.192 1.00 0.00 C ATOM 129 O SER A 11 11.858 -2.900 6.285 1.00 0.00 O ATOM 130 CB SER A 11 11.592 -0.163 4.895 1.00 0.00 C ATOM 131 OG SER A 11 12.340 -0.051 6.093 1.00 0.00 O ATOM 0 H SER A 11 9.904 -1.487 6.939 1.00 0.00 H new ATOM 0 HA SER A 11 10.064 -1.400 4.025 1.00 0.00 H new ATOM 0 HB2 SER A 11 12.268 -0.308 4.053 1.00 0.00 H new ATOM 0 HB3 SER A 11 11.050 0.765 4.713 1.00 0.00 H new ATOM 0 HG SER A 11 12.964 0.701 6.020 1.00 0.00 H new ATOM 137 N GLY A 12 11.442 -3.452 4.145 1.00 0.00 N ATOM 138 CA GLY A 12 12.137 -4.721 4.245 1.00 0.00 C ATOM 139 C GLY A 12 12.333 -5.384 2.896 1.00 0.00 C ATOM 140 O GLY A 12 11.961 -4.826 1.864 1.00 0.00 O ATOM 0 H GLY A 12 11.038 -3.256 3.229 1.00 0.00 H new ATOM 0 HA2 GLY A 12 13.109 -4.563 4.713 1.00 0.00 H new ATOM 0 HA3 GLY A 12 11.574 -5.390 4.896 1.00 0.00 H new ATOM 144 N TRP A 13 12.920 -6.575 2.903 1.00 0.00 N ATOM 145 CA TRP A 13 13.166 -7.313 1.670 1.00 0.00 C ATOM 146 C TRP A 13 11.890 -7.982 1.172 1.00 0.00 C ATOM 147 O TRP A 13 11.530 -9.070 1.623 1.00 0.00 O ATOM 148 CB TRP A 13 14.255 -8.364 1.889 1.00 0.00 C ATOM 149 CG TRP A 13 15.644 -7.824 1.727 1.00 0.00 C ATOM 150 CD1 TRP A 13 16.662 -7.894 2.634 1.00 0.00 C ATOM 151 CD2 TRP A 13 16.165 -7.128 0.589 1.00 0.00 C ATOM 152 NE1 TRP A 13 17.785 -7.285 2.129 1.00 0.00 N ATOM 153 CE2 TRP A 13 17.506 -6.807 0.875 1.00 0.00 C ATOM 154 CE3 TRP A 13 15.630 -6.747 -0.645 1.00 0.00 C ATOM 155 CZ2 TRP A 13 18.316 -6.123 -0.027 1.00 0.00 C ATOM 156 CZ3 TRP A 13 16.435 -6.068 -1.539 1.00 0.00 C ATOM 157 CH2 TRP A 13 17.767 -5.762 -1.227 1.00 0.00 C ATOM 0 H TRP A 13 13.234 -7.050 3.749 1.00 0.00 H new ATOM 0 HA TRP A 13 13.502 -6.604 0.913 1.00 0.00 H new ATOM 0 HB2 TRP A 13 14.150 -8.782 2.890 1.00 0.00 H new ATOM 0 HB3 TRP A 13 14.107 -9.182 1.185 1.00 0.00 H new ATOM 0 HD1 TRP A 13 16.594 -8.360 3.606 1.00 0.00 H new ATOM 0 HE1 TRP A 13 18.681 -7.202 2.609 1.00 0.00 H new ATOM 0 HE3 TRP A 13 14.605 -6.979 -0.895 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 19.342 -5.886 0.212 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 16.031 -5.768 -2.495 1.00 0.00 H new ATOM 0 HH2 TRP A 13 18.371 -5.231 -1.948 1.00 0.00 H new ATOM 168 N LEU A 14 11.208 -7.326 0.239 1.00 0.00 N ATOM 169 CA LEU A 14 9.971 -7.858 -0.321 1.00 0.00 C ATOM 170 C LEU A 14 10.208 -8.443 -1.709 1.00 0.00 C ATOM 171 O LEU A 14 10.697 -7.757 -2.607 1.00 0.00 O ATOM 172 CB LEU A 14 8.907 -6.761 -0.393 1.00 0.00 C ATOM 173 CG LEU A 14 8.155 -6.470 0.906 1.00 0.00 C ATOM 174 CD1 LEU A 14 7.201 -5.300 0.720 1.00 0.00 C ATOM 175 CD2 LEU A 14 7.401 -7.705 1.375 1.00 0.00 C ATOM 0 H LEU A 14 11.491 -6.425 -0.145 1.00 0.00 H new ATOM 0 HA LEU A 14 9.619 -8.655 0.334 1.00 0.00 H new ATOM 0 HB2 LEU A 14 9.385 -5.840 -0.727 1.00 0.00 H new ATOM 0 HB3 LEU A 14 8.180 -7.037 -1.156 1.00 0.00 H new ATOM 0 HG LEU A 14 8.883 -6.201 1.671 1.00 0.00 H new ATOM 0 HD11 LEU A 14 6.675 -5.108 1.655 1.00 0.00 H new ATOM 0 HD12 LEU A 14 7.765 -4.413 0.432 1.00 0.00 H new ATOM 0 HD13 LEU A 14 6.479 -5.540 -0.060 1.00 0.00 H new ATOM 0 HD21 LEU A 14 6.872 -7.479 2.301 1.00 0.00 H new ATOM 0 HD22 LEU A 14 6.684 -8.005 0.611 1.00 0.00 H new ATOM 0 HD23 LEU A 14 8.106 -8.517 1.550 1.00 0.00 H new ATOM 187 N ASP A 15 9.858 -9.714 -1.878 1.00 0.00 N ATOM 188 CA ASP A 15 10.030 -10.390 -3.158 1.00 0.00 C ATOM 189 C ASP A 15 8.796 -10.214 -4.037 1.00 0.00 C ATOM 190 O ASP A 15 7.674 -10.499 -3.615 1.00 0.00 O ATOM 191 CB ASP A 15 10.308 -11.879 -2.940 1.00 0.00 C ATOM 192 CG ASP A 15 11.750 -12.149 -2.556 1.00 0.00 C ATOM 193 OD1 ASP A 15 12.200 -11.609 -1.524 1.00 0.00 O ATOM 194 OD2 ASP A 15 12.427 -12.900 -3.288 1.00 0.00 O ATOM 0 H ASP A 15 9.454 -10.296 -1.144 1.00 0.00 H new ATOM 0 HA ASP A 15 10.883 -9.939 -3.666 1.00 0.00 H new ATOM 0 HB2 ASP A 15 9.650 -12.258 -2.158 1.00 0.00 H new ATOM 0 HB3 ASP A 15 10.069 -12.427 -3.851 1.00 0.00 H new ATOM 199 N LYS A 16 9.009 -9.742 -5.260 1.00 0.00 N ATOM 200 CA LYS A 16 7.914 -9.528 -6.200 1.00 0.00 C ATOM 201 C LYS A 16 7.891 -10.618 -7.266 1.00 0.00 C ATOM 202 O LYS A 16 8.924 -11.204 -7.592 1.00 0.00 O ATOM 203 CB LYS A 16 8.045 -8.154 -6.862 1.00 0.00 C ATOM 204 CG LYS A 16 6.742 -7.632 -7.442 1.00 0.00 C ATOM 205 CD LYS A 16 6.960 -6.361 -8.246 1.00 0.00 C ATOM 206 CE LYS A 16 5.721 -5.478 -8.239 1.00 0.00 C ATOM 207 NZ LYS A 16 5.983 -4.151 -8.862 1.00 0.00 N ATOM 0 H LYS A 16 9.930 -9.500 -5.624 1.00 0.00 H new ATOM 0 HA LYS A 16 6.977 -9.569 -5.644 1.00 0.00 H new ATOM 0 HB2 LYS A 16 8.418 -7.440 -6.128 1.00 0.00 H new ATOM 0 HB3 LYS A 16 8.789 -8.212 -7.656 1.00 0.00 H new ATOM 0 HG2 LYS A 16 6.295 -8.395 -8.079 1.00 0.00 H new ATOM 0 HG3 LYS A 16 6.036 -7.437 -6.635 1.00 0.00 H new ATOM 0 HD2 LYS A 16 7.804 -5.809 -7.834 1.00 0.00 H new ATOM 0 HD3 LYS A 16 7.219 -6.619 -9.273 1.00 0.00 H new ATOM 0 HE2 LYS A 16 4.915 -5.979 -8.776 1.00 0.00 H new ATOM 0 HE3 LYS A 16 5.381 -5.337 -7.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 5.115 -3.579 -8.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 6.735 -3.662 -8.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 6.283 -4.284 -9.849 1.00 0.00 H new ATOM 221 N LEU A 17 6.707 -10.885 -7.807 1.00 0.00 N ATOM 222 CA LEU A 17 6.549 -11.904 -8.838 1.00 0.00 C ATOM 223 C LEU A 17 6.985 -11.373 -10.200 1.00 0.00 C ATOM 224 O LEU A 17 6.270 -10.594 -10.831 1.00 0.00 O ATOM 225 CB LEU A 17 5.094 -12.372 -8.902 1.00 0.00 C ATOM 226 CG LEU A 17 4.761 -13.380 -10.003 1.00 0.00 C ATOM 227 CD1 LEU A 17 3.604 -14.270 -9.578 1.00 0.00 C ATOM 228 CD2 LEU A 17 4.434 -12.661 -11.304 1.00 0.00 C ATOM 0 H LEU A 17 5.842 -10.410 -7.548 1.00 0.00 H new ATOM 0 HA LEU A 17 7.185 -12.750 -8.578 1.00 0.00 H new ATOM 0 HB2 LEU A 17 4.833 -12.815 -7.941 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.457 -11.497 -9.033 1.00 0.00 H new ATOM 0 HG LEU A 17 5.635 -14.010 -10.170 1.00 0.00 H new ATOM 0 HD11 LEU A 17 3.381 -14.981 -10.373 1.00 0.00 H new ATOM 0 HD12 LEU A 17 3.876 -14.812 -8.672 1.00 0.00 H new ATOM 0 HD13 LEU A 17 2.725 -13.656 -9.383 1.00 0.00 H new ATOM 0 HD21 LEU A 17 4.200 -13.394 -12.076 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.576 -12.007 -11.152 1.00 0.00 H new ATOM 0 HD23 LEU A 17 5.292 -12.067 -11.617 1.00 0.00 H new ATOM 240 N SER A 18 8.161 -11.800 -10.648 1.00 0.00 N ATOM 241 CA SER A 18 8.693 -11.366 -11.934 1.00 0.00 C ATOM 242 C SER A 18 8.051 -12.145 -13.078 1.00 0.00 C ATOM 243 O SER A 18 7.321 -11.597 -13.904 1.00 0.00 O ATOM 244 CB SER A 18 10.212 -11.546 -11.968 1.00 0.00 C ATOM 245 OG SER A 18 10.876 -10.342 -11.627 1.00 0.00 O ATOM 0 H SER A 18 8.764 -12.446 -10.139 1.00 0.00 H new ATOM 0 HA SER A 18 8.457 -10.309 -12.060 1.00 0.00 H new ATOM 0 HB2 SER A 18 10.503 -12.335 -11.274 1.00 0.00 H new ATOM 0 HB3 SER A 18 10.521 -11.866 -12.963 1.00 0.00 H new ATOM 0 HG SER A 18 11.562 -10.145 -12.298 1.00 0.00 H new ATOM 251 N PRO A 19 8.329 -13.457 -13.129 1.00 0.00 N ATOM 252 CA PRO A 19 7.789 -14.340 -14.166 1.00 0.00 C ATOM 253 C PRO A 19 6.288 -14.564 -14.013 1.00 0.00 C ATOM 254 O PRO A 19 5.791 -14.759 -12.904 1.00 0.00 O ATOM 255 CB PRO A 19 8.550 -15.650 -13.947 1.00 0.00 C ATOM 256 CG PRO A 19 8.947 -15.623 -12.512 1.00 0.00 C ATOM 257 CD PRO A 19 9.191 -14.177 -12.177 1.00 0.00 C ATOM 0 HA PRO A 19 7.913 -13.920 -15.164 1.00 0.00 H new ATOM 0 HB2 PRO A 19 7.923 -16.514 -14.168 1.00 0.00 H new ATOM 0 HB3 PRO A 19 9.422 -15.715 -14.598 1.00 0.00 H new ATOM 0 HG2 PRO A 19 8.163 -16.043 -11.882 1.00 0.00 H new ATOM 0 HG3 PRO A 19 9.844 -16.219 -12.344 1.00 0.00 H new ATOM 0 HD2 PRO A 19 8.924 -13.953 -11.144 1.00 0.00 H new ATOM 0 HD3 PRO A 19 10.240 -13.907 -12.301 1.00 0.00 H new ATOM 265 N GLN A 20 5.573 -14.536 -15.133 1.00 0.00 N ATOM 266 CA GLN A 20 4.129 -14.736 -15.122 1.00 0.00 C ATOM 267 C GLN A 20 3.731 -15.774 -14.077 1.00 0.00 C ATOM 268 O GLN A 20 3.066 -15.454 -13.093 1.00 0.00 O ATOM 269 CB GLN A 20 3.643 -15.175 -16.505 1.00 0.00 C ATOM 270 CG GLN A 20 3.628 -14.052 -17.529 1.00 0.00 C ATOM 271 CD GLN A 20 5.019 -13.665 -17.992 1.00 0.00 C ATOM 272 OE1 GLN A 20 5.698 -12.862 -17.352 1.00 0.00 O ATOM 273 NE2 GLN A 20 5.451 -14.237 -19.110 1.00 0.00 N ATOM 0 H GLN A 20 5.970 -14.377 -16.059 1.00 0.00 H new ATOM 0 HA GLN A 20 3.658 -13.788 -14.863 1.00 0.00 H new ATOM 0 HB2 GLN A 20 4.284 -15.978 -16.868 1.00 0.00 H new ATOM 0 HB3 GLN A 20 2.638 -15.586 -16.414 1.00 0.00 H new ATOM 0 HG2 GLN A 20 3.035 -14.359 -18.390 1.00 0.00 H new ATOM 0 HG3 GLN A 20 3.137 -13.179 -17.098 1.00 0.00 H new ATOM 0 HE21 GLN A 20 4.854 -14.897 -19.609 1.00 0.00 H new ATOM 0 HE22 GLN A 20 6.379 -14.016 -19.470 1.00 0.00 H new ATOM 282 N GLY A 21 4.143 -17.018 -14.300 1.00 0.00 N ATOM 283 CA GLY A 21 3.819 -18.084 -13.369 1.00 0.00 C ATOM 284 C GLY A 21 4.712 -18.075 -12.144 1.00 0.00 C ATOM 285 O GLY A 21 5.775 -17.454 -12.146 1.00 0.00 O ATOM 0 H GLY A 21 4.695 -17.307 -15.108 1.00 0.00 H new ATOM 0 HA2 GLY A 21 2.779 -17.987 -13.057 1.00 0.00 H new ATOM 0 HA3 GLY A 21 3.911 -19.045 -13.875 1.00 0.00 H new ATOM 289 N LYS A 22 4.280 -18.765 -11.094 1.00 0.00 N ATOM 290 CA LYS A 22 5.047 -18.835 -9.856 1.00 0.00 C ATOM 291 C LYS A 22 6.211 -19.811 -9.991 1.00 0.00 C ATOM 292 O LYS A 22 6.059 -21.010 -9.756 1.00 0.00 O ATOM 293 CB LYS A 22 4.144 -19.259 -8.696 1.00 0.00 C ATOM 294 CG LYS A 22 2.990 -18.304 -8.442 1.00 0.00 C ATOM 295 CD LYS A 22 1.915 -18.945 -7.581 1.00 0.00 C ATOM 296 CE LYS A 22 2.214 -18.778 -6.099 1.00 0.00 C ATOM 297 NZ LYS A 22 1.113 -19.307 -5.248 1.00 0.00 N ATOM 0 H LYS A 22 3.402 -19.284 -11.076 1.00 0.00 H new ATOM 0 HA LYS A 22 5.450 -17.843 -9.651 1.00 0.00 H new ATOM 0 HB2 LYS A 22 3.744 -20.252 -8.902 1.00 0.00 H new ATOM 0 HB3 LYS A 22 4.744 -19.339 -7.790 1.00 0.00 H new ATOM 0 HG2 LYS A 22 3.362 -17.405 -7.951 1.00 0.00 H new ATOM 0 HG3 LYS A 22 2.558 -17.993 -9.393 1.00 0.00 H new ATOM 0 HD2 LYS A 22 0.948 -18.497 -7.811 1.00 0.00 H new ATOM 0 HD3 LYS A 22 1.840 -20.006 -7.821 1.00 0.00 H new ATOM 0 HE2 LYS A 22 3.142 -19.295 -5.855 1.00 0.00 H new ATOM 0 HE3 LYS A 22 2.370 -17.722 -5.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 1.355 -19.175 -4.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 0.233 -18.796 -5.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 0.981 -20.320 -5.441 1.00 0.00 H new ATOM 311 N ARG A 23 7.374 -19.290 -10.370 1.00 0.00 N ATOM 312 CA ARG A 23 8.563 -20.117 -10.536 1.00 0.00 C ATOM 313 C ARG A 23 9.754 -19.509 -9.800 1.00 0.00 C ATOM 314 O ARG A 23 10.379 -20.163 -8.966 1.00 0.00 O ATOM 315 CB ARG A 23 8.896 -20.277 -12.021 1.00 0.00 C ATOM 316 CG ARG A 23 9.687 -21.536 -12.335 1.00 0.00 C ATOM 317 CD ARG A 23 8.784 -22.758 -12.403 1.00 0.00 C ATOM 318 NE ARG A 23 7.989 -22.784 -13.628 1.00 0.00 N ATOM 319 CZ ARG A 23 7.354 -23.864 -14.069 1.00 0.00 C ATOM 320 NH1 ARG A 23 7.420 -25.001 -13.389 1.00 0.00 N ATOM 321 NH2 ARG A 23 6.650 -23.809 -15.192 1.00 0.00 N ATOM 0 H ARG A 23 7.518 -18.300 -10.568 1.00 0.00 H new ATOM 0 HA ARG A 23 8.355 -21.098 -10.109 1.00 0.00 H new ATOM 0 HB2 ARG A 23 7.969 -20.288 -12.594 1.00 0.00 H new ATOM 0 HB3 ARG A 23 9.465 -19.408 -12.353 1.00 0.00 H new ATOM 0 HG2 ARG A 23 10.207 -21.413 -13.285 1.00 0.00 H new ATOM 0 HG3 ARG A 23 10.450 -21.688 -11.571 1.00 0.00 H new ATOM 0 HD2 ARG A 23 9.392 -23.661 -12.346 1.00 0.00 H new ATOM 0 HD3 ARG A 23 8.119 -22.766 -11.539 1.00 0.00 H new ATOM 0 HE ARG A 23 7.918 -21.926 -14.175 1.00 0.00 H new ATOM 0 HH11 ARG A 23 7.960 -25.048 -12.525 1.00 0.00 H new ATOM 0 HH12 ARG A 23 6.931 -25.829 -13.730 1.00 0.00 H new ATOM 0 HH21 ARG A 23 6.596 -22.937 -15.718 1.00 0.00 H new ATOM 0 HH22 ARG A 23 6.163 -24.639 -15.530 1.00 0.00 H new ATOM 335 N MET A 24 10.061 -18.256 -10.116 1.00 0.00 N ATOM 336 CA MET A 24 11.177 -17.560 -9.484 1.00 0.00 C ATOM 337 C MET A 24 10.732 -16.211 -8.928 1.00 0.00 C ATOM 338 O MET A 24 9.799 -15.594 -9.443 1.00 0.00 O ATOM 339 CB MET A 24 12.316 -17.362 -10.486 1.00 0.00 C ATOM 340 CG MET A 24 12.996 -18.657 -10.897 1.00 0.00 C ATOM 341 SD MET A 24 14.524 -18.379 -11.813 1.00 0.00 S ATOM 342 CE MET A 24 15.742 -18.892 -10.604 1.00 0.00 C ATOM 0 H MET A 24 9.554 -17.701 -10.805 1.00 0.00 H new ATOM 0 HA MET A 24 11.534 -18.174 -8.657 1.00 0.00 H new ATOM 0 HB2 MET A 24 11.925 -16.869 -11.376 1.00 0.00 H new ATOM 0 HB3 MET A 24 13.059 -16.693 -10.051 1.00 0.00 H new ATOM 0 HG2 MET A 24 13.213 -19.247 -10.007 1.00 0.00 H new ATOM 0 HG3 MET A 24 12.311 -19.244 -11.509 1.00 0.00 H new ATOM 0 HE1 MET A 24 16.742 -18.778 -11.024 1.00 0.00 H new ATOM 0 HE2 MET A 24 15.651 -18.274 -9.711 1.00 0.00 H new ATOM 0 HE3 MET A 24 15.576 -19.937 -10.341 1.00 0.00 H new ATOM 352 N PHE A 25 11.404 -15.759 -7.875 1.00 0.00 N ATOM 353 CA PHE A 25 11.076 -14.484 -7.249 1.00 0.00 C ATOM 354 C PHE A 25 12.230 -13.495 -7.393 1.00 0.00 C ATOM 355 O PHE A 25 13.398 -13.882 -7.378 1.00 0.00 O ATOM 356 CB PHE A 25 10.746 -14.688 -5.769 1.00 0.00 C ATOM 357 CG PHE A 25 9.292 -14.962 -5.511 1.00 0.00 C ATOM 358 CD1 PHE A 25 8.320 -14.067 -5.928 1.00 0.00 C ATOM 359 CD2 PHE A 25 8.898 -16.115 -4.852 1.00 0.00 C ATOM 360 CE1 PHE A 25 6.982 -14.317 -5.691 1.00 0.00 C ATOM 361 CE2 PHE A 25 7.560 -16.370 -4.612 1.00 0.00 C ATOM 362 CZ PHE A 25 6.601 -15.471 -5.034 1.00 0.00 C ATOM 0 H PHE A 25 12.179 -16.257 -7.437 1.00 0.00 H new ATOM 0 HA PHE A 25 10.203 -14.073 -7.755 1.00 0.00 H new ATOM 0 HB2 PHE A 25 11.338 -15.519 -5.384 1.00 0.00 H new ATOM 0 HB3 PHE A 25 11.044 -13.799 -5.213 1.00 0.00 H new ATOM 0 HD1 PHE A 25 8.611 -13.164 -6.444 1.00 0.00 H new ATOM 0 HD2 PHE A 25 9.644 -16.823 -4.522 1.00 0.00 H new ATOM 0 HE1 PHE A 25 6.234 -13.610 -6.019 1.00 0.00 H new ATOM 0 HE2 PHE A 25 7.266 -17.271 -4.095 1.00 0.00 H new ATOM 0 HZ PHE A 25 5.555 -15.669 -4.851 1.00 0.00 H new ATOM 372 N GLN A 26 11.892 -12.217 -7.533 1.00 0.00 N ATOM 373 CA GLN A 26 12.899 -11.173 -7.681 1.00 0.00 C ATOM 374 C GLN A 26 12.913 -10.254 -6.465 1.00 0.00 C ATOM 375 O GLN A 26 11.882 -9.704 -6.076 1.00 0.00 O ATOM 376 CB GLN A 26 12.636 -10.358 -8.948 1.00 0.00 C ATOM 377 CG GLN A 26 13.312 -10.923 -10.187 1.00 0.00 C ATOM 378 CD GLN A 26 14.739 -11.360 -9.925 1.00 0.00 C ATOM 379 OE1 GLN A 26 15.004 -12.534 -9.666 1.00 0.00 O ATOM 380 NE2 GLN A 26 15.669 -10.414 -9.991 1.00 0.00 N ATOM 0 H GLN A 26 10.929 -11.880 -7.547 1.00 0.00 H new ATOM 0 HA GLN A 26 13.874 -11.653 -7.762 1.00 0.00 H new ATOM 0 HB2 GLN A 26 11.561 -10.309 -9.122 1.00 0.00 H new ATOM 0 HB3 GLN A 26 12.981 -9.336 -8.791 1.00 0.00 H new ATOM 0 HG2 GLN A 26 12.737 -11.773 -10.554 1.00 0.00 H new ATOM 0 HG3 GLN A 26 13.306 -10.170 -10.975 1.00 0.00 H new ATOM 0 HE21 GLN A 26 15.405 -9.453 -10.209 1.00 0.00 H new ATOM 0 HE22 GLN A 26 16.648 -10.648 -9.824 1.00 0.00 H new ATOM 389 N LYS A 27 14.088 -10.091 -5.866 1.00 0.00 N ATOM 390 CA LYS A 27 14.238 -9.238 -4.693 1.00 0.00 C ATOM 391 C LYS A 27 14.180 -7.764 -5.082 1.00 0.00 C ATOM 392 O LYS A 27 14.644 -7.377 -6.154 1.00 0.00 O ATOM 393 CB LYS A 27 15.561 -9.538 -3.984 1.00 0.00 C ATOM 394 CG LYS A 27 15.694 -8.859 -2.632 1.00 0.00 C ATOM 395 CD LYS A 27 15.070 -9.693 -1.526 1.00 0.00 C ATOM 396 CE LYS A 27 15.930 -10.900 -1.184 1.00 0.00 C ATOM 397 NZ LYS A 27 15.297 -11.756 -0.144 1.00 0.00 N ATOM 0 H LYS A 27 14.951 -10.539 -6.174 1.00 0.00 H new ATOM 0 HA LYS A 27 13.413 -9.449 -4.013 1.00 0.00 H new ATOM 0 HB2 LYS A 27 15.656 -10.616 -3.851 1.00 0.00 H new ATOM 0 HB3 LYS A 27 16.386 -9.222 -4.623 1.00 0.00 H new ATOM 0 HG2 LYS A 27 16.748 -8.690 -2.411 1.00 0.00 H new ATOM 0 HG3 LYS A 27 15.214 -7.881 -2.666 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.935 -9.077 -0.637 1.00 0.00 H new ATOM 0 HD3 LYS A 27 14.080 -10.027 -1.835 1.00 0.00 H new ATOM 0 HE2 LYS A 27 16.102 -11.490 -2.084 1.00 0.00 H new ATOM 0 HE3 LYS A 27 16.905 -10.563 -0.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 15.914 -12.567 0.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 15.156 -11.201 0.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 14.378 -12.099 -0.489 1.00 0.00 H new ATOM 411 N ARG A 28 13.610 -6.947 -4.202 1.00 0.00 N ATOM 412 CA ARG A 28 13.493 -5.516 -4.454 1.00 0.00 C ATOM 413 C ARG A 28 13.376 -4.741 -3.144 1.00 0.00 C ATOM 414 O ARG A 28 12.663 -5.153 -2.230 1.00 0.00 O ATOM 415 CB ARG A 28 12.277 -5.230 -5.338 1.00 0.00 C ATOM 416 CG ARG A 28 12.443 -4.005 -6.223 1.00 0.00 C ATOM 417 CD ARG A 28 13.098 -4.360 -7.549 1.00 0.00 C ATOM 418 NE ARG A 28 14.527 -4.624 -7.400 1.00 0.00 N ATOM 419 CZ ARG A 28 15.239 -5.330 -8.271 1.00 0.00 C ATOM 420 NH1 ARG A 28 14.658 -5.840 -9.348 1.00 0.00 N ATOM 421 NH2 ARG A 28 16.535 -5.526 -8.066 1.00 0.00 N ATOM 0 H ARG A 28 13.222 -7.252 -3.309 1.00 0.00 H new ATOM 0 HA ARG A 28 14.395 -5.189 -4.971 1.00 0.00 H new ATOM 0 HB2 ARG A 28 12.083 -6.099 -5.967 1.00 0.00 H new ATOM 0 HB3 ARG A 28 11.401 -5.094 -4.704 1.00 0.00 H new ATOM 0 HG2 ARG A 28 11.468 -3.553 -6.407 1.00 0.00 H new ATOM 0 HG3 ARG A 28 13.047 -3.260 -5.705 1.00 0.00 H new ATOM 0 HD2 ARG A 28 12.609 -5.238 -7.971 1.00 0.00 H new ATOM 0 HD3 ARG A 28 12.952 -3.543 -8.256 1.00 0.00 H new ATOM 0 HE ARG A 28 15.004 -4.245 -6.582 1.00 0.00 H new ATOM 0 HH11 ARG A 28 13.662 -5.691 -9.509 1.00 0.00 H new ATOM 0 HH12 ARG A 28 15.207 -6.382 -10.015 1.00 0.00 H new ATOM 0 HH21 ARG A 28 16.985 -5.134 -7.239 1.00 0.00 H new ATOM 0 HH22 ARG A 28 17.081 -6.068 -8.735 1.00 0.00 H new ATOM 435 N TRP A 29 14.082 -3.619 -3.063 1.00 0.00 N ATOM 436 CA TRP A 29 14.058 -2.787 -1.865 1.00 0.00 C ATOM 437 C TRP A 29 12.800 -1.927 -1.824 1.00 0.00 C ATOM 438 O TRP A 29 12.679 -0.951 -2.565 1.00 0.00 O ATOM 439 CB TRP A 29 15.301 -1.897 -1.812 1.00 0.00 C ATOM 440 CG TRP A 29 15.200 -0.796 -0.800 1.00 0.00 C ATOM 441 CD1 TRP A 29 15.171 0.546 -1.050 1.00 0.00 C ATOM 442 CD2 TRP A 29 15.118 -0.943 0.621 1.00 0.00 C ATOM 443 NE1 TRP A 29 15.075 1.242 0.131 1.00 0.00 N ATOM 444 CE2 TRP A 29 15.040 0.352 1.171 1.00 0.00 C ATOM 445 CE3 TRP A 29 15.100 -2.043 1.484 1.00 0.00 C ATOM 446 CZ2 TRP A 29 14.948 0.574 2.542 1.00 0.00 C ATOM 447 CZ3 TRP A 29 15.009 -1.820 2.845 1.00 0.00 C ATOM 448 CH2 TRP A 29 14.933 -0.521 3.363 1.00 0.00 C ATOM 0 H TRP A 29 14.677 -3.265 -3.811 1.00 0.00 H new ATOM 0 HA TRP A 29 14.054 -3.445 -0.996 1.00 0.00 H new ATOM 0 HB2 TRP A 29 16.171 -2.513 -1.583 1.00 0.00 H new ATOM 0 HB3 TRP A 29 15.470 -1.461 -2.797 1.00 0.00 H new ATOM 0 HD1 TRP A 29 15.217 0.994 -2.031 1.00 0.00 H new ATOM 0 HE1 TRP A 29 15.036 2.257 0.219 1.00 0.00 H new ATOM 0 HE3 TRP A 29 15.156 -3.049 1.094 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 14.890 1.575 2.944 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 14.996 -2.662 3.521 1.00 0.00 H new ATOM 0 HH2 TRP A 29 14.861 -0.381 4.431 1.00 0.00 H new ATOM 459 N VAL A 30 11.864 -2.295 -0.955 1.00 0.00 N ATOM 460 CA VAL A 30 10.615 -1.556 -0.817 1.00 0.00 C ATOM 461 C VAL A 30 10.560 -0.812 0.512 1.00 0.00 C ATOM 462 O VAL A 30 10.989 -1.329 1.544 1.00 0.00 O ATOM 463 CB VAL A 30 9.395 -2.490 -0.921 1.00 0.00 C ATOM 464 CG1 VAL A 30 8.113 -1.683 -1.051 1.00 0.00 C ATOM 465 CG2 VAL A 30 9.554 -3.445 -2.095 1.00 0.00 C ATOM 0 H VAL A 30 11.947 -3.101 -0.336 1.00 0.00 H new ATOM 0 HA VAL A 30 10.582 -0.836 -1.635 1.00 0.00 H new ATOM 0 HB VAL A 30 9.333 -3.080 -0.007 1.00 0.00 H new ATOM 0 HG11 VAL A 30 7.262 -2.361 -1.123 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.995 -1.044 -0.176 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.162 -1.065 -1.947 1.00 0.00 H new ATOM 0 HG21 VAL A 30 8.683 -4.098 -2.154 1.00 0.00 H new ATOM 0 HG22 VAL A 30 9.642 -2.874 -3.019 1.00 0.00 H new ATOM 0 HG23 VAL A 30 10.451 -4.048 -1.954 1.00 0.00 H new ATOM 475 N LYS A 31 10.027 0.405 0.482 1.00 0.00 N ATOM 476 CA LYS A 31 9.913 1.221 1.685 1.00 0.00 C ATOM 477 C LYS A 31 8.615 2.022 1.678 1.00 0.00 C ATOM 478 O LYS A 31 8.273 2.660 0.682 1.00 0.00 O ATOM 479 CB LYS A 31 11.109 2.168 1.799 1.00 0.00 C ATOM 480 CG LYS A 31 11.102 3.008 3.064 1.00 0.00 C ATOM 481 CD LYS A 31 11.812 4.335 2.857 1.00 0.00 C ATOM 482 CE LYS A 31 11.331 5.385 3.847 1.00 0.00 C ATOM 483 NZ LYS A 31 11.821 6.746 3.493 1.00 0.00 N ATOM 0 H LYS A 31 9.667 0.848 -0.363 1.00 0.00 H new ATOM 0 HA LYS A 31 9.903 0.554 2.547 1.00 0.00 H new ATOM 0 HB2 LYS A 31 12.029 1.584 1.766 1.00 0.00 H new ATOM 0 HB3 LYS A 31 11.121 2.830 0.933 1.00 0.00 H new ATOM 0 HG2 LYS A 31 10.073 3.190 3.375 1.00 0.00 H new ATOM 0 HG3 LYS A 31 11.587 2.457 3.870 1.00 0.00 H new ATOM 0 HD2 LYS A 31 12.887 4.195 2.968 1.00 0.00 H new ATOM 0 HD3 LYS A 31 11.639 4.686 1.840 1.00 0.00 H new ATOM 0 HE2 LYS A 31 10.241 5.387 3.874 1.00 0.00 H new ATOM 0 HE3 LYS A 31 11.674 5.124 4.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 11.472 7.433 4.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 12.861 6.751 3.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 11.473 7.005 2.548 1.00 0.00 H new ATOM 497 N PHE A 32 7.897 1.987 2.795 1.00 0.00 N ATOM 498 CA PHE A 32 6.637 2.710 2.917 1.00 0.00 C ATOM 499 C PHE A 32 6.811 3.965 3.768 1.00 0.00 C ATOM 500 O PHE A 32 7.212 3.891 4.929 1.00 0.00 O ATOM 501 CB PHE A 32 5.564 1.809 3.532 1.00 0.00 C ATOM 502 CG PHE A 32 4.201 2.439 3.571 1.00 0.00 C ATOM 503 CD1 PHE A 32 3.679 3.060 2.448 1.00 0.00 C ATOM 504 CD2 PHE A 32 3.443 2.411 4.730 1.00 0.00 C ATOM 505 CE1 PHE A 32 2.425 3.642 2.481 1.00 0.00 C ATOM 506 CE2 PHE A 32 2.189 2.990 4.770 1.00 0.00 C ATOM 507 CZ PHE A 32 1.679 3.606 3.643 1.00 0.00 C ATOM 0 H PHE A 32 8.166 1.465 3.629 1.00 0.00 H new ATOM 0 HA PHE A 32 6.321 3.010 1.918 1.00 0.00 H new ATOM 0 HB2 PHE A 32 5.510 0.881 2.963 1.00 0.00 H new ATOM 0 HB3 PHE A 32 5.862 1.544 4.546 1.00 0.00 H new ATOM 0 HD1 PHE A 32 4.258 3.090 1.537 1.00 0.00 H new ATOM 0 HD2 PHE A 32 3.837 1.931 5.613 1.00 0.00 H new ATOM 0 HE1 PHE A 32 2.029 4.124 1.599 1.00 0.00 H new ATOM 0 HE2 PHE A 32 1.609 2.961 5.680 1.00 0.00 H new ATOM 0 HZ PHE A 32 0.699 4.059 3.671 1.00 0.00 H new ATOM 517 N ASP A 33 6.506 5.117 3.180 1.00 0.00 N ATOM 518 CA ASP A 33 6.628 6.389 3.883 1.00 0.00 C ATOM 519 C ASP A 33 5.273 6.850 4.411 1.00 0.00 C ATOM 520 O ASP A 33 5.186 7.820 5.163 1.00 0.00 O ATOM 521 CB ASP A 33 7.216 7.454 2.956 1.00 0.00 C ATOM 522 CG ASP A 33 7.293 8.817 3.615 1.00 0.00 C ATOM 523 OD1 ASP A 33 7.608 8.875 4.821 1.00 0.00 O ATOM 524 OD2 ASP A 33 7.036 9.826 2.924 1.00 0.00 O ATOM 0 H ASP A 33 6.173 5.196 2.219 1.00 0.00 H new ATOM 0 HA ASP A 33 7.299 6.245 4.730 1.00 0.00 H new ATOM 0 HB2 ASP A 33 8.214 7.148 2.643 1.00 0.00 H new ATOM 0 HB3 ASP A 33 6.607 7.523 2.055 1.00 0.00 H new ATOM 529 N GLY A 34 4.217 6.147 4.011 1.00 0.00 N ATOM 530 CA GLY A 34 2.881 6.500 4.453 1.00 0.00 C ATOM 531 C GLY A 34 1.996 6.962 3.313 1.00 0.00 C ATOM 532 O GLY A 34 0.799 6.674 3.290 1.00 0.00 O ATOM 0 H GLY A 34 4.264 5.340 3.389 1.00 0.00 H new ATOM 0 HA2 GLY A 34 2.423 5.638 4.938 1.00 0.00 H new ATOM 0 HA3 GLY A 34 2.946 7.290 5.201 1.00 0.00 H new ATOM 536 N LEU A 35 2.584 7.683 2.365 1.00 0.00 N ATOM 537 CA LEU A 35 1.841 8.188 1.215 1.00 0.00 C ATOM 538 C LEU A 35 1.741 7.128 0.123 1.00 0.00 C ATOM 539 O LEU A 35 0.651 6.825 -0.363 1.00 0.00 O ATOM 540 CB LEU A 35 2.513 9.446 0.662 1.00 0.00 C ATOM 541 CG LEU A 35 2.628 10.626 1.627 1.00 0.00 C ATOM 542 CD1 LEU A 35 3.853 11.466 1.299 1.00 0.00 C ATOM 543 CD2 LEU A 35 1.367 11.477 1.582 1.00 0.00 C ATOM 0 H LEU A 35 3.573 7.931 2.370 1.00 0.00 H new ATOM 0 HA LEU A 35 0.833 8.438 1.546 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.515 9.180 0.324 1.00 0.00 H new ATOM 0 HB3 LEU A 35 1.957 9.774 -0.216 1.00 0.00 H new ATOM 0 HG LEU A 35 2.742 10.234 2.638 1.00 0.00 H new ATOM 0 HD11 LEU A 35 3.919 12.301 1.996 1.00 0.00 H new ATOM 0 HD12 LEU A 35 4.749 10.851 1.384 1.00 0.00 H new ATOM 0 HD13 LEU A 35 3.770 11.848 0.282 1.00 0.00 H new ATOM 0 HD21 LEU A 35 1.467 12.312 2.275 1.00 0.00 H new ATOM 0 HD22 LEU A 35 1.222 11.859 0.572 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.508 10.870 1.867 1.00 0.00 H new ATOM 555 N SER A 36 2.884 6.567 -0.256 1.00 0.00 N ATOM 556 CA SER A 36 2.925 5.541 -1.292 1.00 0.00 C ATOM 557 C SER A 36 4.104 4.598 -1.077 1.00 0.00 C ATOM 558 O SER A 36 4.970 4.851 -0.238 1.00 0.00 O ATOM 559 CB SER A 36 3.020 6.188 -2.676 1.00 0.00 C ATOM 560 OG SER A 36 1.961 7.106 -2.884 1.00 0.00 O ATOM 0 H SER A 36 3.794 6.805 0.138 1.00 0.00 H new ATOM 0 HA SER A 36 2.004 4.962 -1.232 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.976 6.702 -2.776 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.992 5.416 -3.445 1.00 0.00 H new ATOM 0 HG SER A 36 1.989 7.435 -3.807 1.00 0.00 H new ATOM 566 N ILE A 37 4.131 3.510 -1.839 1.00 0.00 N ATOM 567 CA ILE A 37 5.204 2.529 -1.733 1.00 0.00 C ATOM 568 C ILE A 37 6.204 2.682 -2.874 1.00 0.00 C ATOM 569 O ILE A 37 5.875 2.444 -4.037 1.00 0.00 O ATOM 570 CB ILE A 37 4.654 1.091 -1.737 1.00 0.00 C ATOM 571 CG1 ILE A 37 3.675 0.893 -0.577 1.00 0.00 C ATOM 572 CG2 ILE A 37 5.794 0.088 -1.651 1.00 0.00 C ATOM 573 CD1 ILE A 37 2.622 -0.159 -0.848 1.00 0.00 C ATOM 0 H ILE A 37 3.422 3.285 -2.537 1.00 0.00 H new ATOM 0 HA ILE A 37 5.708 2.714 -0.784 1.00 0.00 H new ATOM 0 HB ILE A 37 4.119 0.925 -2.672 1.00 0.00 H new ATOM 0 HG12 ILE A 37 4.234 0.614 0.316 1.00 0.00 H new ATOM 0 HG13 ILE A 37 3.183 1.841 -0.362 1.00 0.00 H new ATOM 0 HG21 ILE A 37 5.389 -0.924 -1.655 1.00 0.00 H new ATOM 0 HG22 ILE A 37 6.457 0.217 -2.506 1.00 0.00 H new ATOM 0 HG23 ILE A 37 6.354 0.251 -0.730 1.00 0.00 H new ATOM 0 HD11 ILE A 37 1.964 -0.246 0.016 1.00 0.00 H new ATOM 0 HD12 ILE A 37 2.038 0.128 -1.722 1.00 0.00 H new ATOM 0 HD13 ILE A 37 3.105 -1.118 -1.034 1.00 0.00 H new ATOM 585 N SER A 38 7.426 3.079 -2.534 1.00 0.00 N ATOM 586 CA SER A 38 8.474 3.266 -3.531 1.00 0.00 C ATOM 587 C SER A 38 9.516 2.156 -3.437 1.00 0.00 C ATOM 588 O SER A 38 10.011 1.843 -2.353 1.00 0.00 O ATOM 589 CB SER A 38 9.145 4.628 -3.347 1.00 0.00 C ATOM 590 OG SER A 38 9.807 4.706 -2.097 1.00 0.00 O ATOM 0 H SER A 38 7.715 3.277 -1.576 1.00 0.00 H new ATOM 0 HA SER A 38 8.014 3.227 -4.518 1.00 0.00 H new ATOM 0 HB2 SER A 38 9.860 4.796 -4.152 1.00 0.00 H new ATOM 0 HB3 SER A 38 8.397 5.418 -3.416 1.00 0.00 H new ATOM 0 HG SER A 38 10.719 5.040 -2.230 1.00 0.00 H new ATOM 596 N TYR A 39 9.846 1.564 -4.580 1.00 0.00 N ATOM 597 CA TYR A 39 10.828 0.488 -4.627 1.00 0.00 C ATOM 598 C TYR A 39 12.071 0.917 -5.401 1.00 0.00 C ATOM 599 O TYR A 39 12.068 1.942 -6.083 1.00 0.00 O ATOM 600 CB TYR A 39 10.218 -0.758 -5.272 1.00 0.00 C ATOM 601 CG TYR A 39 9.281 -0.451 -6.418 1.00 0.00 C ATOM 602 CD1 TYR A 39 7.995 0.020 -6.183 1.00 0.00 C ATOM 603 CD2 TYR A 39 9.682 -0.632 -7.736 1.00 0.00 C ATOM 604 CE1 TYR A 39 7.136 0.302 -7.227 1.00 0.00 C ATOM 605 CE2 TYR A 39 8.829 -0.351 -8.786 1.00 0.00 C ATOM 606 CZ TYR A 39 7.558 0.116 -8.527 1.00 0.00 C ATOM 607 OH TYR A 39 6.705 0.395 -9.570 1.00 0.00 O ATOM 0 H TYR A 39 9.448 1.811 -5.486 1.00 0.00 H new ATOM 0 HA TYR A 39 11.122 0.254 -3.604 1.00 0.00 H new ATOM 0 HB2 TYR A 39 11.021 -1.400 -5.633 1.00 0.00 H new ATOM 0 HB3 TYR A 39 9.677 -1.322 -4.512 1.00 0.00 H new ATOM 0 HD1 TYR A 39 7.662 0.168 -5.167 1.00 0.00 H new ATOM 0 HD2 TYR A 39 10.677 -0.998 -7.943 1.00 0.00 H new ATOM 0 HE1 TYR A 39 6.139 0.666 -7.027 1.00 0.00 H new ATOM 0 HE2 TYR A 39 9.156 -0.497 -9.805 1.00 0.00 H new ATOM 0 HH TYR A 39 5.951 0.928 -9.242 1.00 0.00 H new ATOM 617 N TYR A 40 13.132 0.126 -5.290 1.00 0.00 N ATOM 618 CA TYR A 40 14.383 0.424 -5.976 1.00 0.00 C ATOM 619 C TYR A 40 15.234 -0.833 -6.127 1.00 0.00 C ATOM 620 O TYR A 40 15.262 -1.687 -5.243 1.00 0.00 O ATOM 621 CB TYR A 40 15.165 1.495 -5.214 1.00 0.00 C ATOM 622 CG TYR A 40 14.303 2.630 -4.708 1.00 0.00 C ATOM 623 CD1 TYR A 40 13.435 2.446 -3.639 1.00 0.00 C ATOM 624 CD2 TYR A 40 14.358 3.886 -5.299 1.00 0.00 C ATOM 625 CE1 TYR A 40 12.645 3.480 -3.174 1.00 0.00 C ATOM 626 CE2 TYR A 40 13.573 4.926 -4.840 1.00 0.00 C ATOM 627 CZ TYR A 40 12.718 4.718 -3.778 1.00 0.00 C ATOM 628 OH TYR A 40 11.934 5.751 -3.317 1.00 0.00 O ATOM 0 H TYR A 40 13.151 -0.727 -4.731 1.00 0.00 H new ATOM 0 HA TYR A 40 14.142 0.799 -6.971 1.00 0.00 H new ATOM 0 HB2 TYR A 40 15.672 1.030 -4.368 1.00 0.00 H new ATOM 0 HB3 TYR A 40 15.939 1.900 -5.866 1.00 0.00 H new ATOM 0 HD1 TYR A 40 13.377 1.478 -3.163 1.00 0.00 H new ATOM 0 HD2 TYR A 40 15.026 4.052 -6.131 1.00 0.00 H new ATOM 0 HE1 TYR A 40 11.974 3.320 -2.343 1.00 0.00 H new ATOM 0 HE2 TYR A 40 13.629 5.897 -5.310 1.00 0.00 H new ATOM 0 HH TYR A 40 12.106 6.555 -3.850 1.00 0.00 H new ATOM 638 N ASN A 41 15.929 -0.937 -7.256 1.00 0.00 N ATOM 639 CA ASN A 41 16.782 -2.089 -7.524 1.00 0.00 C ATOM 640 C ASN A 41 18.114 -1.963 -6.791 1.00 0.00 C ATOM 641 O ASN A 41 19.179 -2.103 -7.389 1.00 0.00 O ATOM 642 CB ASN A 41 17.027 -2.229 -9.028 1.00 0.00 C ATOM 643 CG ASN A 41 15.751 -2.096 -9.837 1.00 0.00 C ATOM 644 OD1 ASN A 41 14.847 -2.925 -9.731 1.00 0.00 O ATOM 645 ND2 ASN A 41 15.672 -1.049 -10.650 1.00 0.00 N ATOM 0 H ASN A 41 15.918 -0.238 -7.999 1.00 0.00 H new ATOM 0 HA ASN A 41 16.271 -2.980 -7.160 1.00 0.00 H new ATOM 0 HB2 ASN A 41 17.739 -1.469 -9.350 1.00 0.00 H new ATOM 0 HB3 ASN A 41 17.483 -3.198 -9.230 1.00 0.00 H new ATOM 0 HD21 ASN A 41 14.837 -0.907 -11.219 1.00 0.00 H new ATOM 0 HD22 ASN A 41 16.446 -0.387 -10.706 1.00 0.00 H new ATOM 652 N ASN A 42 18.043 -1.697 -5.490 1.00 0.00 N ATOM 653 CA ASN A 42 19.243 -1.552 -4.674 1.00 0.00 C ATOM 654 C ASN A 42 20.292 -0.709 -5.394 1.00 0.00 C ATOM 655 O ASN A 42 21.488 -0.986 -5.310 1.00 0.00 O ATOM 656 CB ASN A 42 19.823 -2.926 -4.333 1.00 0.00 C ATOM 657 CG ASN A 42 21.047 -2.833 -3.443 1.00 0.00 C ATOM 658 OD1 ASN A 42 21.208 -1.873 -2.689 1.00 0.00 O ATOM 659 ND2 ASN A 42 21.918 -3.832 -3.529 1.00 0.00 N ATOM 0 H ASN A 42 17.168 -1.578 -4.979 1.00 0.00 H new ATOM 0 HA ASN A 42 18.965 -1.044 -3.751 1.00 0.00 H new ATOM 0 HB2 ASN A 42 19.061 -3.526 -3.836 1.00 0.00 H new ATOM 0 HB3 ASN A 42 20.086 -3.445 -5.255 1.00 0.00 H new ATOM 0 HD21 ASN A 42 22.762 -3.824 -2.956 1.00 0.00 H new ATOM 0 HD22 ASN A 42 21.743 -4.607 -4.168 1.00 0.00 H new ATOM 666 N GLU A 43 19.834 0.320 -6.100 1.00 0.00 N ATOM 667 CA GLU A 43 20.733 1.202 -6.834 1.00 0.00 C ATOM 668 C GLU A 43 20.093 2.569 -7.056 1.00 0.00 C ATOM 669 O GLU A 43 18.901 2.669 -7.348 1.00 0.00 O ATOM 670 CB GLU A 43 21.109 0.578 -8.180 1.00 0.00 C ATOM 671 CG GLU A 43 22.487 0.985 -8.676 1.00 0.00 C ATOM 672 CD GLU A 43 23.604 0.443 -7.805 1.00 0.00 C ATOM 673 OE1 GLU A 43 23.905 -0.764 -7.910 1.00 0.00 O ATOM 674 OE2 GLU A 43 24.176 1.226 -7.018 1.00 0.00 O ATOM 0 H GLU A 43 18.847 0.563 -6.179 1.00 0.00 H new ATOM 0 HA GLU A 43 21.636 1.335 -6.238 1.00 0.00 H new ATOM 0 HB2 GLU A 43 21.070 -0.508 -8.091 1.00 0.00 H new ATOM 0 HB3 GLU A 43 20.365 0.864 -8.924 1.00 0.00 H new ATOM 0 HG2 GLU A 43 22.622 0.628 -9.697 1.00 0.00 H new ATOM 0 HG3 GLU A 43 22.551 2.073 -8.708 1.00 0.00 H new ATOM 681 N LYS A 44 20.893 3.620 -6.915 1.00 0.00 N ATOM 682 CA LYS A 44 20.407 4.983 -7.100 1.00 0.00 C ATOM 683 C LYS A 44 20.317 5.331 -8.582 1.00 0.00 C ATOM 684 O LYS A 44 21.249 5.897 -9.153 1.00 0.00 O ATOM 685 CB LYS A 44 21.327 5.976 -6.386 1.00 0.00 C ATOM 686 CG LYS A 44 20.886 7.422 -6.527 1.00 0.00 C ATOM 687 CD LYS A 44 21.830 8.366 -5.800 1.00 0.00 C ATOM 688 CE LYS A 44 22.998 8.777 -6.683 1.00 0.00 C ATOM 689 NZ LYS A 44 24.016 7.696 -6.795 1.00 0.00 N ATOM 0 H LYS A 44 21.882 3.555 -6.673 1.00 0.00 H new ATOM 0 HA LYS A 44 19.408 5.048 -6.668 1.00 0.00 H new ATOM 0 HB2 LYS A 44 21.372 5.720 -5.327 1.00 0.00 H new ATOM 0 HB3 LYS A 44 22.337 5.873 -6.782 1.00 0.00 H new ATOM 0 HG2 LYS A 44 20.844 7.689 -7.583 1.00 0.00 H new ATOM 0 HG3 LYS A 44 19.878 7.536 -6.129 1.00 0.00 H new ATOM 0 HD2 LYS A 44 21.284 9.254 -5.481 1.00 0.00 H new ATOM 0 HD3 LYS A 44 22.207 7.882 -4.899 1.00 0.00 H new ATOM 0 HE2 LYS A 44 22.630 9.033 -7.676 1.00 0.00 H new ATOM 0 HE3 LYS A 44 23.464 9.674 -6.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 24.964 8.118 -6.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 23.970 7.088 -5.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 23.826 7.126 -7.644 1.00 0.00 H new ATOM 703 N GLU A 45 19.189 4.991 -9.198 1.00 0.00 N ATOM 704 CA GLU A 45 18.979 5.270 -10.614 1.00 0.00 C ATOM 705 C GLU A 45 17.719 6.105 -10.823 1.00 0.00 C ATOM 706 O GLU A 45 16.724 5.933 -10.120 1.00 0.00 O ATOM 707 CB GLU A 45 18.874 3.963 -11.404 1.00 0.00 C ATOM 708 CG GLU A 45 20.220 3.398 -11.826 1.00 0.00 C ATOM 709 CD GLU A 45 20.114 1.991 -12.382 1.00 0.00 C ATOM 710 OE1 GLU A 45 19.505 1.132 -11.711 1.00 0.00 O ATOM 711 OE2 GLU A 45 20.639 1.750 -13.489 1.00 0.00 O ATOM 0 H GLU A 45 18.408 4.523 -8.739 1.00 0.00 H new ATOM 0 HA GLU A 45 19.835 5.838 -10.977 1.00 0.00 H new ATOM 0 HB2 GLU A 45 18.352 3.222 -10.798 1.00 0.00 H new ATOM 0 HB3 GLU A 45 18.266 4.133 -12.292 1.00 0.00 H new ATOM 0 HG2 GLU A 45 20.663 4.050 -12.579 1.00 0.00 H new ATOM 0 HG3 GLU A 45 20.894 3.396 -10.969 1.00 0.00 H new ATOM 718 N MET A 46 17.771 7.011 -11.794 1.00 0.00 N ATOM 719 CA MET A 46 16.635 7.873 -12.096 1.00 0.00 C ATOM 720 C MET A 46 15.588 7.125 -12.915 1.00 0.00 C ATOM 721 O MET A 46 14.450 6.954 -12.477 1.00 0.00 O ATOM 722 CB MET A 46 17.099 9.118 -12.855 1.00 0.00 C ATOM 723 CG MET A 46 17.852 10.113 -11.987 1.00 0.00 C ATOM 724 SD MET A 46 18.895 11.225 -12.950 1.00 0.00 S ATOM 725 CE MET A 46 19.330 12.441 -11.709 1.00 0.00 C ATOM 0 H MET A 46 18.588 7.167 -12.385 1.00 0.00 H new ATOM 0 HA MET A 46 16.183 8.179 -11.153 1.00 0.00 H new ATOM 0 HB2 MET A 46 17.740 8.812 -13.682 1.00 0.00 H new ATOM 0 HB3 MET A 46 16.231 9.612 -13.291 1.00 0.00 H new ATOM 0 HG2 MET A 46 17.137 10.700 -11.410 1.00 0.00 H new ATOM 0 HG3 MET A 46 18.470 9.570 -11.271 1.00 0.00 H new ATOM 0 HE1 MET A 46 19.976 13.199 -12.153 1.00 0.00 H new ATOM 0 HE2 MET A 46 18.424 12.913 -11.329 1.00 0.00 H new ATOM 0 HE3 MET A 46 19.856 11.952 -10.889 1.00 0.00 H new ATOM 735 N TYR A 47 15.979 6.683 -14.104 1.00 0.00 N ATOM 736 CA TYR A 47 15.073 5.955 -14.985 1.00 0.00 C ATOM 737 C TYR A 47 14.451 4.764 -14.264 1.00 0.00 C ATOM 738 O TYR A 47 14.680 4.557 -13.072 1.00 0.00 O ATOM 739 CB TYR A 47 15.816 5.478 -16.234 1.00 0.00 C ATOM 740 CG TYR A 47 16.292 6.605 -17.123 1.00 0.00 C ATOM 741 CD1 TYR A 47 15.391 7.503 -17.683 1.00 0.00 C ATOM 742 CD2 TYR A 47 17.643 6.772 -17.404 1.00 0.00 C ATOM 743 CE1 TYR A 47 15.821 8.533 -18.496 1.00 0.00 C ATOM 744 CE2 TYR A 47 18.082 7.800 -18.215 1.00 0.00 C ATOM 745 CZ TYR A 47 17.168 8.678 -18.759 1.00 0.00 C ATOM 746 OH TYR A 47 17.601 9.703 -19.568 1.00 0.00 O ATOM 0 H TYR A 47 16.918 6.816 -14.481 1.00 0.00 H new ATOM 0 HA TYR A 47 14.274 6.634 -15.283 1.00 0.00 H new ATOM 0 HB2 TYR A 47 16.674 4.879 -15.929 1.00 0.00 H new ATOM 0 HB3 TYR A 47 15.160 4.825 -16.809 1.00 0.00 H new ATOM 0 HD1 TYR A 47 14.336 7.393 -17.479 1.00 0.00 H new ATOM 0 HD2 TYR A 47 18.362 6.086 -16.981 1.00 0.00 H new ATOM 0 HE1 TYR A 47 15.107 9.221 -18.924 1.00 0.00 H new ATOM 0 HE2 TYR A 47 19.136 7.916 -18.422 1.00 0.00 H new ATOM 0 HH TYR A 47 18.577 9.664 -19.651 1.00 0.00 H new ATOM 756 N SER A 48 13.663 3.982 -14.996 1.00 0.00 N ATOM 757 CA SER A 48 13.005 2.812 -14.426 1.00 0.00 C ATOM 758 C SER A 48 12.179 3.196 -13.202 1.00 0.00 C ATOM 759 O SER A 48 12.092 2.439 -12.235 1.00 0.00 O ATOM 760 CB SER A 48 14.041 1.753 -14.046 1.00 0.00 C ATOM 761 OG SER A 48 14.292 0.873 -15.128 1.00 0.00 O ATOM 0 H SER A 48 13.465 4.138 -15.984 1.00 0.00 H new ATOM 0 HA SER A 48 12.334 2.399 -15.180 1.00 0.00 H new ATOM 0 HB2 SER A 48 14.969 2.239 -13.746 1.00 0.00 H new ATOM 0 HB3 SER A 48 13.686 1.185 -13.186 1.00 0.00 H new ATOM 0 HG SER A 48 14.959 0.207 -14.860 1.00 0.00 H new ATOM 767 N LYS A 49 11.575 4.378 -13.251 1.00 0.00 N ATOM 768 CA LYS A 49 10.754 4.864 -12.148 1.00 0.00 C ATOM 769 C LYS A 49 9.586 3.921 -11.881 1.00 0.00 C ATOM 770 O LYS A 49 8.874 3.524 -12.802 1.00 0.00 O ATOM 771 CB LYS A 49 10.229 6.268 -12.456 1.00 0.00 C ATOM 772 CG LYS A 49 11.156 7.379 -11.994 1.00 0.00 C ATOM 773 CD LYS A 49 10.843 7.811 -10.571 1.00 0.00 C ATOM 774 CE LYS A 49 11.968 8.648 -9.982 1.00 0.00 C ATOM 775 NZ LYS A 49 13.184 7.833 -9.711 1.00 0.00 N ATOM 0 H LYS A 49 11.638 5.018 -14.043 1.00 0.00 H new ATOM 0 HA LYS A 49 11.377 4.903 -11.255 1.00 0.00 H new ATOM 0 HB2 LYS A 49 10.072 6.360 -13.531 1.00 0.00 H new ATOM 0 HB3 LYS A 49 9.257 6.396 -11.980 1.00 0.00 H new ATOM 0 HG2 LYS A 49 12.190 7.039 -12.053 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.063 8.234 -12.664 1.00 0.00 H new ATOM 0 HD2 LYS A 49 9.917 8.385 -10.559 1.00 0.00 H new ATOM 0 HD3 LYS A 49 10.680 6.930 -9.950 1.00 0.00 H new ATOM 0 HE2 LYS A 49 12.218 9.455 -10.670 1.00 0.00 H new ATOM 0 HE3 LYS A 49 11.628 9.112 -9.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 13.826 8.364 -9.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 12.909 6.943 -9.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 13.667 7.622 -10.607 1.00 0.00 H new ATOM 789 N GLY A 50 9.395 3.566 -10.614 1.00 0.00 N ATOM 790 CA GLY A 50 8.310 2.673 -10.250 1.00 0.00 C ATOM 791 C GLY A 50 7.838 2.886 -8.825 1.00 0.00 C ATOM 792 O GLY A 50 8.578 2.632 -7.874 1.00 0.00 O ATOM 0 H GLY A 50 9.972 3.880 -9.834 1.00 0.00 H new ATOM 0 HA2 GLY A 50 7.474 2.824 -10.933 1.00 0.00 H new ATOM 0 HA3 GLY A 50 8.637 1.640 -10.371 1.00 0.00 H new ATOM 796 N ILE A 51 6.603 3.354 -8.677 1.00 0.00 N ATOM 797 CA ILE A 51 6.034 3.601 -7.358 1.00 0.00 C ATOM 798 C ILE A 51 4.544 3.276 -7.332 1.00 0.00 C ATOM 799 O ILE A 51 3.828 3.527 -8.301 1.00 0.00 O ATOM 800 CB ILE A 51 6.236 5.064 -6.923 1.00 0.00 C ATOM 801 CG1 ILE A 51 5.937 5.221 -5.430 1.00 0.00 C ATOM 802 CG2 ILE A 51 5.352 5.989 -7.746 1.00 0.00 C ATOM 803 CD1 ILE A 51 6.389 6.547 -4.860 1.00 0.00 C ATOM 0 H ILE A 51 5.978 3.570 -9.454 1.00 0.00 H new ATOM 0 HA ILE A 51 6.558 2.947 -6.661 1.00 0.00 H new ATOM 0 HB ILE A 51 7.276 5.339 -7.097 1.00 0.00 H new ATOM 0 HG12 ILE A 51 4.864 5.112 -5.269 1.00 0.00 H new ATOM 0 HG13 ILE A 51 6.425 4.414 -4.883 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.507 7.020 -7.426 1.00 0.00 H new ATOM 0 HG22 ILE A 51 5.609 5.894 -8.801 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.306 5.717 -7.601 1.00 0.00 H new ATOM 0 HD11 ILE A 51 6.145 6.589 -3.798 1.00 0.00 H new ATOM 0 HD12 ILE A 51 7.466 6.650 -4.989 1.00 0.00 H new ATOM 0 HD13 ILE A 51 5.882 7.359 -5.381 1.00 0.00 H new ATOM 815 N ILE A 52 4.085 2.718 -6.217 1.00 0.00 N ATOM 816 CA ILE A 52 2.680 2.362 -6.064 1.00 0.00 C ATOM 817 C ILE A 52 1.963 3.337 -5.137 1.00 0.00 C ATOM 818 O ILE A 52 2.234 3.405 -3.937 1.00 0.00 O ATOM 819 CB ILE A 52 2.518 0.933 -5.513 1.00 0.00 C ATOM 820 CG1 ILE A 52 3.166 -0.079 -6.460 1.00 0.00 C ATOM 821 CG2 ILE A 52 1.046 0.608 -5.308 1.00 0.00 C ATOM 822 CD1 ILE A 52 3.679 -1.319 -5.761 1.00 0.00 C ATOM 0 H ILE A 52 4.666 2.503 -5.406 1.00 0.00 H new ATOM 0 HA ILE A 52 2.232 2.413 -7.056 1.00 0.00 H new ATOM 0 HB ILE A 52 3.021 0.872 -4.548 1.00 0.00 H new ATOM 0 HG12 ILE A 52 2.439 -0.373 -7.217 1.00 0.00 H new ATOM 0 HG13 ILE A 52 3.993 0.402 -6.982 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.948 -0.405 -4.918 1.00 0.00 H new ATOM 0 HG22 ILE A 52 0.613 1.313 -4.598 1.00 0.00 H new ATOM 0 HG23 ILE A 52 0.521 0.683 -6.260 1.00 0.00 H new ATOM 0 HD11 ILE A 52 4.125 -1.991 -6.494 1.00 0.00 H new ATOM 0 HD12 ILE A 52 4.430 -1.036 -5.023 1.00 0.00 H new ATOM 0 HD13 ILE A 52 2.852 -1.824 -5.262 1.00 0.00 H new ATOM 834 N PRO A 53 1.025 4.111 -5.702 1.00 0.00 N ATOM 835 CA PRO A 53 0.247 5.095 -4.943 1.00 0.00 C ATOM 836 C PRO A 53 -0.735 4.439 -3.979 1.00 0.00 C ATOM 837 O PRO A 53 -1.351 3.422 -4.300 1.00 0.00 O ATOM 838 CB PRO A 53 -0.505 5.867 -6.030 1.00 0.00 C ATOM 839 CG PRO A 53 -0.602 4.915 -7.172 1.00 0.00 C ATOM 840 CD PRO A 53 0.650 4.083 -7.126 1.00 0.00 C ATOM 0 HA PRO A 53 0.882 5.722 -4.318 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -1.492 6.175 -5.686 1.00 0.00 H new ATOM 0 HB3 PRO A 53 0.030 6.773 -6.314 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -1.490 4.289 -7.084 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -0.681 5.449 -8.119 1.00 0.00 H new ATOM 0 HD2 PRO A 53 0.470 3.066 -7.474 1.00 0.00 H new ATOM 0 HD3 PRO A 53 1.434 4.502 -7.757 1.00 0.00 H new ATOM 848 N LEU A 54 -0.876 5.026 -2.796 1.00 0.00 N ATOM 849 CA LEU A 54 -1.785 4.499 -1.784 1.00 0.00 C ATOM 850 C LEU A 54 -3.213 4.430 -2.316 1.00 0.00 C ATOM 851 O LEU A 54 -3.953 3.494 -2.015 1.00 0.00 O ATOM 852 CB LEU A 54 -1.739 5.369 -0.526 1.00 0.00 C ATOM 853 CG LEU A 54 -2.898 5.190 0.456 1.00 0.00 C ATOM 854 CD1 LEU A 54 -2.608 4.051 1.421 1.00 0.00 C ATOM 855 CD2 LEU A 54 -3.156 6.483 1.216 1.00 0.00 C ATOM 0 H LEU A 54 -0.373 5.867 -2.514 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.462 3.489 -1.532 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.807 5.162 0.001 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.707 6.415 -0.832 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.795 4.939 -0.110 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.443 3.938 2.112 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -2.473 3.126 0.861 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -1.700 4.272 1.982 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.984 6.338 1.910 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.261 6.763 1.772 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.408 7.275 0.511 1.00 0.00 H new ATOM 867 N SER A 55 -3.591 5.426 -3.111 1.00 0.00 N ATOM 868 CA SER A 55 -4.931 5.479 -3.685 1.00 0.00 C ATOM 869 C SER A 55 -5.245 4.198 -4.451 1.00 0.00 C ATOM 870 O SER A 55 -6.316 3.614 -4.293 1.00 0.00 O ATOM 871 CB SER A 55 -5.063 6.687 -4.614 1.00 0.00 C ATOM 872 OG SER A 55 -3.999 6.730 -5.549 1.00 0.00 O ATOM 0 H SER A 55 -2.989 6.207 -3.372 1.00 0.00 H new ATOM 0 HA SER A 55 -5.646 5.578 -2.868 1.00 0.00 H new ATOM 0 HB2 SER A 55 -6.015 6.640 -5.143 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.071 7.604 -4.025 1.00 0.00 H new ATOM 0 HG SER A 55 -4.107 7.510 -6.132 1.00 0.00 H new ATOM 878 N ALA A 56 -4.301 3.766 -5.282 1.00 0.00 N ATOM 879 CA ALA A 56 -4.475 2.553 -6.071 1.00 0.00 C ATOM 880 C ALA A 56 -4.891 1.380 -5.191 1.00 0.00 C ATOM 881 O ALA A 56 -5.779 0.606 -5.551 1.00 0.00 O ATOM 882 CB ALA A 56 -3.194 2.224 -6.823 1.00 0.00 C ATOM 0 H ALA A 56 -3.408 4.238 -5.426 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.272 2.731 -6.793 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -3.339 1.316 -7.408 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -2.941 3.049 -7.490 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -2.383 2.072 -6.111 1.00 0.00 H new ATOM 888 N ILE A 57 -4.244 1.254 -4.037 1.00 0.00 N ATOM 889 CA ILE A 57 -4.547 0.174 -3.106 1.00 0.00 C ATOM 890 C ILE A 57 -6.009 0.216 -2.673 1.00 0.00 C ATOM 891 O ILE A 57 -6.410 1.074 -1.887 1.00 0.00 O ATOM 892 CB ILE A 57 -3.651 0.241 -1.856 1.00 0.00 C ATOM 893 CG1 ILE A 57 -2.175 0.221 -2.258 1.00 0.00 C ATOM 894 CG2 ILE A 57 -3.965 -0.914 -0.916 1.00 0.00 C ATOM 895 CD1 ILE A 57 -1.234 0.554 -1.121 1.00 0.00 C ATOM 0 H ILE A 57 -3.507 1.886 -3.725 1.00 0.00 H new ATOM 0 HA ILE A 57 -4.353 -0.761 -3.632 1.00 0.00 H new ATOM 0 HB ILE A 57 -3.853 1.175 -1.332 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -1.926 -0.766 -2.647 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -2.018 0.932 -3.069 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -3.323 -0.853 -0.037 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -5.009 -0.859 -0.608 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -3.788 -1.859 -1.429 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.205 0.521 -1.479 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -1.456 1.553 -0.746 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.362 -0.172 -0.318 1.00 0.00 H new ATOM 907 N SER A 58 -6.801 -0.717 -3.191 1.00 0.00 N ATOM 908 CA SER A 58 -8.219 -0.786 -2.859 1.00 0.00 C ATOM 909 C SER A 58 -8.453 -1.696 -1.657 1.00 0.00 C ATOM 910 O SER A 58 -9.335 -1.445 -0.835 1.00 0.00 O ATOM 911 CB SER A 58 -9.021 -1.292 -4.060 1.00 0.00 C ATOM 912 OG SER A 58 -10.336 -0.764 -4.055 1.00 0.00 O ATOM 0 H SER A 58 -6.485 -1.436 -3.842 1.00 0.00 H new ATOM 0 HA SER A 58 -8.556 0.218 -2.602 1.00 0.00 H new ATOM 0 HB2 SER A 58 -8.516 -1.009 -4.984 1.00 0.00 H new ATOM 0 HB3 SER A 58 -9.063 -2.381 -4.040 1.00 0.00 H new ATOM 0 HG SER A 58 -10.827 -1.101 -4.833 1.00 0.00 H new ATOM 918 N THR A 59 -7.655 -2.755 -1.561 1.00 0.00 N ATOM 919 CA THR A 59 -7.774 -3.704 -0.461 1.00 0.00 C ATOM 920 C THR A 59 -6.580 -4.651 -0.420 1.00 0.00 C ATOM 921 O THR A 59 -6.023 -5.009 -1.458 1.00 0.00 O ATOM 922 CB THR A 59 -9.068 -4.532 -0.571 1.00 0.00 C ATOM 923 OG1 THR A 59 -9.296 -5.250 0.646 1.00 0.00 O ATOM 924 CG2 THR A 59 -8.988 -5.509 -1.735 1.00 0.00 C ATOM 0 H THR A 59 -6.919 -2.977 -2.232 1.00 0.00 H new ATOM 0 HA THR A 59 -7.802 -3.120 0.459 1.00 0.00 H new ATOM 0 HB THR A 59 -9.897 -3.847 -0.748 1.00 0.00 H new ATOM 0 HG1 THR A 59 -10.122 -5.772 0.568 1.00 0.00 H new ATOM 0 HG21 THR A 59 -9.913 -6.083 -1.793 1.00 0.00 H new ATOM 0 HG22 THR A 59 -8.845 -4.957 -2.664 1.00 0.00 H new ATOM 0 HG23 THR A 59 -8.149 -6.188 -1.583 1.00 0.00 H new ATOM 932 N VAL A 60 -6.192 -5.054 0.786 1.00 0.00 N ATOM 933 CA VAL A 60 -5.065 -5.961 0.962 1.00 0.00 C ATOM 934 C VAL A 60 -5.500 -7.252 1.647 1.00 0.00 C ATOM 935 O VAL A 60 -6.309 -7.232 2.574 1.00 0.00 O ATOM 936 CB VAL A 60 -3.942 -5.307 1.789 1.00 0.00 C ATOM 937 CG1 VAL A 60 -2.643 -6.084 1.634 1.00 0.00 C ATOM 938 CG2 VAL A 60 -3.756 -3.854 1.379 1.00 0.00 C ATOM 0 H VAL A 60 -6.642 -4.766 1.655 1.00 0.00 H new ATOM 0 HA VAL A 60 -4.686 -6.191 -0.034 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.228 -5.330 2.841 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -1.861 -5.607 2.225 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -2.787 -7.107 1.981 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.349 -6.095 0.585 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.959 -3.407 1.973 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -3.492 -3.805 0.323 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -4.684 -3.307 1.547 1.00 0.00 H new ATOM 948 N ARG A 61 -4.956 -8.373 1.185 1.00 0.00 N ATOM 949 CA ARG A 61 -5.289 -9.674 1.753 1.00 0.00 C ATOM 950 C ARG A 61 -4.072 -10.595 1.752 1.00 0.00 C ATOM 951 O ARG A 61 -3.047 -10.286 1.143 1.00 0.00 O ATOM 952 CB ARG A 61 -6.431 -10.320 0.967 1.00 0.00 C ATOM 953 CG ARG A 61 -6.145 -10.462 -0.519 1.00 0.00 C ATOM 954 CD ARG A 61 -7.337 -11.042 -1.263 1.00 0.00 C ATOM 955 NE ARG A 61 -7.503 -12.470 -1.004 1.00 0.00 N ATOM 956 CZ ARG A 61 -8.221 -13.278 -1.776 1.00 0.00 C ATOM 957 NH1 ARG A 61 -8.837 -12.801 -2.849 1.00 0.00 N ATOM 958 NH2 ARG A 61 -8.324 -14.566 -1.475 1.00 0.00 N ATOM 0 H ARG A 61 -4.283 -8.407 0.419 1.00 0.00 H new ATOM 0 HA ARG A 61 -5.607 -9.522 2.784 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -6.636 -11.306 1.385 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -7.334 -9.724 1.099 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -5.893 -9.487 -0.937 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -5.277 -11.105 -0.664 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -8.242 -10.512 -0.966 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -7.210 -10.880 -2.333 1.00 0.00 H new ATOM 0 HE ARG A 61 -7.042 -12.868 -0.186 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -8.760 -11.811 -3.083 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -9.388 -13.424 -3.440 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -7.852 -14.936 -0.650 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -8.876 -15.186 -2.068 1.00 0.00 H new ATOM 972 N VAL A 62 -4.192 -11.727 2.438 1.00 0.00 N ATOM 973 CA VAL A 62 -3.103 -12.693 2.516 1.00 0.00 C ATOM 974 C VAL A 62 -3.100 -13.617 1.304 1.00 0.00 C ATOM 975 O VAL A 62 -4.147 -13.893 0.720 1.00 0.00 O ATOM 976 CB VAL A 62 -3.198 -13.544 3.796 1.00 0.00 C ATOM 977 CG1 VAL A 62 -3.101 -12.663 5.032 1.00 0.00 C ATOM 978 CG2 VAL A 62 -4.489 -14.349 3.805 1.00 0.00 C ATOM 0 H VAL A 62 -5.033 -11.998 2.948 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.175 -12.122 2.536 1.00 0.00 H new ATOM 0 HB VAL A 62 -2.361 -14.242 3.811 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -3.170 -13.282 5.926 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -2.147 -12.135 5.029 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -3.916 -11.939 5.028 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -4.540 -14.945 4.716 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -5.341 -13.670 3.767 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -4.512 -15.009 2.938 1.00 0.00 H new ATOM 988 N GLN A 63 -1.915 -14.091 0.931 1.00 0.00 N ATOM 989 CA GLN A 63 -1.776 -14.985 -0.213 1.00 0.00 C ATOM 990 C GLN A 63 -0.888 -16.176 0.131 1.00 0.00 C ATOM 991 O GLN A 63 0.077 -16.047 0.883 1.00 0.00 O ATOM 992 CB GLN A 63 -1.195 -14.229 -1.409 1.00 0.00 C ATOM 993 CG GLN A 63 -0.929 -15.113 -2.617 1.00 0.00 C ATOM 994 CD GLN A 63 -2.155 -15.291 -3.491 1.00 0.00 C ATOM 995 OE1 GLN A 63 -3.181 -15.804 -3.045 1.00 0.00 O ATOM 996 NE2 GLN A 63 -2.054 -14.866 -4.745 1.00 0.00 N ATOM 0 H GLN A 63 -1.038 -13.871 1.404 1.00 0.00 H new ATOM 0 HA GLN A 63 -2.767 -15.358 -0.474 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -1.884 -13.434 -1.695 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -0.263 -13.750 -1.108 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -0.124 -14.678 -3.210 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -0.584 -16.090 -2.279 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -1.184 -14.447 -5.073 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -2.846 -14.959 -5.380 1.00 0.00 H new ATOM 1005 N GLY A 64 -1.223 -17.337 -0.424 1.00 0.00 N ATOM 1006 CA GLY A 64 -0.446 -18.535 -0.163 1.00 0.00 C ATOM 1007 C GLY A 64 0.068 -18.593 1.261 1.00 0.00 C ATOM 1008 O GLY A 64 -0.672 -18.323 2.207 1.00 0.00 O ATOM 0 H GLY A 64 -2.018 -17.469 -1.049 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -1.061 -19.413 -0.360 1.00 0.00 H new ATOM 0 HA3 GLY A 64 0.397 -18.575 -0.852 1.00 0.00 H new ATOM 1012 N ASP A 65 1.339 -18.949 1.416 1.00 0.00 N ATOM 1013 CA ASP A 65 1.952 -19.044 2.736 1.00 0.00 C ATOM 1014 C ASP A 65 3.033 -17.982 2.910 1.00 0.00 C ATOM 1015 O ASP A 65 3.963 -17.892 2.110 1.00 0.00 O ATOM 1016 CB ASP A 65 2.548 -20.436 2.946 1.00 0.00 C ATOM 1017 CG ASP A 65 1.617 -21.540 2.486 1.00 0.00 C ATOM 1018 OD1 ASP A 65 1.456 -21.707 1.259 1.00 0.00 O ATOM 1019 OD2 ASP A 65 1.049 -22.238 3.352 1.00 0.00 O ATOM 0 H ASP A 65 1.965 -19.177 0.643 1.00 0.00 H new ATOM 0 HA ASP A 65 1.177 -18.873 3.483 1.00 0.00 H new ATOM 0 HB2 ASP A 65 3.490 -20.510 2.403 1.00 0.00 H new ATOM 0 HB3 ASP A 65 2.777 -20.574 4.003 1.00 0.00 H new ATOM 1024 N ASN A 66 2.902 -17.179 3.961 1.00 0.00 N ATOM 1025 CA ASN A 66 3.868 -16.121 4.240 1.00 0.00 C ATOM 1026 C ASN A 66 3.926 -15.121 3.089 1.00 0.00 C ATOM 1027 O ASN A 66 4.987 -14.583 2.772 1.00 0.00 O ATOM 1028 CB ASN A 66 5.255 -16.720 4.481 1.00 0.00 C ATOM 1029 CG ASN A 66 5.196 -18.025 5.250 1.00 0.00 C ATOM 1030 OD1 ASN A 66 4.517 -18.127 6.272 1.00 0.00 O ATOM 1031 ND2 ASN A 66 5.909 -19.033 4.760 1.00 0.00 N ATOM 0 H ASN A 66 2.137 -17.240 4.633 1.00 0.00 H new ATOM 0 HA ASN A 66 3.546 -15.595 5.139 1.00 0.00 H new ATOM 0 HB2 ASN A 66 5.746 -16.888 3.523 1.00 0.00 H new ATOM 0 HB3 ASN A 66 5.866 -16.005 5.031 1.00 0.00 H new ATOM 0 HD21 ASN A 66 5.908 -19.936 5.234 1.00 0.00 H new ATOM 0 HD22 ASN A 66 6.458 -18.904 3.910 1.00 0.00 H new ATOM 1038 N LYS A 67 2.778 -14.876 2.467 1.00 0.00 N ATOM 1039 CA LYS A 67 2.696 -13.939 1.352 1.00 0.00 C ATOM 1040 C LYS A 67 1.397 -13.141 1.407 1.00 0.00 C ATOM 1041 O LYS A 67 0.493 -13.460 2.179 1.00 0.00 O ATOM 1042 CB LYS A 67 2.791 -14.689 0.022 1.00 0.00 C ATOM 1043 CG LYS A 67 4.187 -15.201 -0.290 1.00 0.00 C ATOM 1044 CD LYS A 67 4.290 -15.708 -1.718 1.00 0.00 C ATOM 1045 CE LYS A 67 3.567 -17.035 -1.891 1.00 0.00 C ATOM 1046 NZ LYS A 67 4.350 -18.171 -1.329 1.00 0.00 N ATOM 0 H LYS A 67 1.891 -15.313 2.716 1.00 0.00 H new ATOM 0 HA LYS A 67 3.532 -13.244 1.431 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.100 -15.532 0.040 1.00 0.00 H new ATOM 0 HB3 LYS A 67 2.468 -14.028 -0.782 1.00 0.00 H new ATOM 0 HG2 LYS A 67 4.912 -14.402 -0.134 1.00 0.00 H new ATOM 0 HG3 LYS A 67 4.444 -16.004 0.401 1.00 0.00 H new ATOM 0 HD2 LYS A 67 3.866 -14.970 -2.399 1.00 0.00 H new ATOM 0 HD3 LYS A 67 5.339 -15.826 -1.989 1.00 0.00 H new ATOM 0 HE2 LYS A 67 2.595 -16.986 -1.400 1.00 0.00 H new ATOM 0 HE3 LYS A 67 3.380 -17.211 -2.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 3.865 -19.066 -1.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 5.299 -18.183 -1.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 4.434 -18.059 -0.298 1.00 0.00 H new ATOM 1060 N PHE A 68 1.311 -12.104 0.581 1.00 0.00 N ATOM 1061 CA PHE A 68 0.122 -11.261 0.535 1.00 0.00 C ATOM 1062 C PHE A 68 -0.067 -10.663 -0.856 1.00 0.00 C ATOM 1063 O PHE A 68 0.894 -10.494 -1.606 1.00 0.00 O ATOM 1064 CB PHE A 68 0.223 -10.142 1.574 1.00 0.00 C ATOM 1065 CG PHE A 68 1.358 -9.191 1.322 1.00 0.00 C ATOM 1066 CD1 PHE A 68 2.663 -9.556 1.613 1.00 0.00 C ATOM 1067 CD2 PHE A 68 1.120 -7.932 0.794 1.00 0.00 C ATOM 1068 CE1 PHE A 68 3.710 -8.683 1.382 1.00 0.00 C ATOM 1069 CE2 PHE A 68 2.163 -7.056 0.560 1.00 0.00 C ATOM 1070 CZ PHE A 68 3.459 -7.431 0.856 1.00 0.00 C ATOM 0 H PHE A 68 2.050 -11.827 -0.065 1.00 0.00 H new ATOM 0 HA PHE A 68 -0.743 -11.883 0.765 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.713 -9.583 1.587 1.00 0.00 H new ATOM 0 HB3 PHE A 68 0.343 -10.585 2.563 1.00 0.00 H new ATOM 0 HD1 PHE A 68 2.864 -10.534 2.025 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.109 -7.632 0.563 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.723 -8.980 1.613 1.00 0.00 H new ATOM 0 HE2 PHE A 68 1.965 -6.078 0.146 1.00 0.00 H new ATOM 0 HZ PHE A 68 4.275 -6.746 0.676 1.00 0.00 H new ATOM 1080 N GLU A 69 -1.314 -10.345 -1.193 1.00 0.00 N ATOM 1081 CA GLU A 69 -1.629 -9.767 -2.494 1.00 0.00 C ATOM 1082 C GLU A 69 -2.175 -8.350 -2.342 1.00 0.00 C ATOM 1083 O GLU A 69 -3.001 -8.081 -1.470 1.00 0.00 O ATOM 1084 CB GLU A 69 -2.645 -10.640 -3.232 1.00 0.00 C ATOM 1085 CG GLU A 69 -2.545 -10.545 -4.745 1.00 0.00 C ATOM 1086 CD GLU A 69 -3.562 -11.419 -5.453 1.00 0.00 C ATOM 1087 OE1 GLU A 69 -4.769 -11.274 -5.169 1.00 0.00 O ATOM 1088 OE2 GLU A 69 -3.150 -12.249 -6.291 1.00 0.00 O ATOM 0 H GLU A 69 -2.121 -10.478 -0.584 1.00 0.00 H new ATOM 0 HA GLU A 69 -0.708 -9.723 -3.076 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.505 -11.678 -2.932 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -3.650 -10.352 -2.924 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -2.687 -9.508 -5.050 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -1.542 -10.835 -5.058 1.00 0.00 H new ATOM 1095 N VAL A 70 -1.705 -7.447 -3.197 1.00 0.00 N ATOM 1096 CA VAL A 70 -2.146 -6.057 -3.160 1.00 0.00 C ATOM 1097 C VAL A 70 -3.066 -5.740 -4.333 1.00 0.00 C ATOM 1098 O VAL A 70 -2.639 -5.741 -5.488 1.00 0.00 O ATOM 1099 CB VAL A 70 -0.949 -5.088 -3.184 1.00 0.00 C ATOM 1100 CG1 VAL A 70 -1.429 -3.647 -3.266 1.00 0.00 C ATOM 1101 CG2 VAL A 70 -0.071 -5.296 -1.959 1.00 0.00 C ATOM 0 H VAL A 70 -1.019 -7.653 -3.923 1.00 0.00 H new ATOM 0 HA VAL A 70 -2.694 -5.924 -2.227 1.00 0.00 H new ATOM 0 HB VAL A 70 -0.352 -5.298 -4.072 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -0.569 -2.977 -3.282 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -2.013 -3.509 -4.176 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.049 -3.420 -2.399 1.00 0.00 H new ATOM 0 HG21 VAL A 70 0.770 -4.603 -1.992 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -0.656 -5.114 -1.057 1.00 0.00 H new ATOM 0 HG23 VAL A 70 0.303 -6.320 -1.949 1.00 0.00 H new ATOM 1111 N VAL A 71 -4.331 -5.469 -4.030 1.00 0.00 N ATOM 1112 CA VAL A 71 -5.312 -5.148 -5.060 1.00 0.00 C ATOM 1113 C VAL A 71 -5.225 -3.680 -5.464 1.00 0.00 C ATOM 1114 O VAL A 71 -5.600 -2.791 -4.699 1.00 0.00 O ATOM 1115 CB VAL A 71 -6.745 -5.454 -4.585 1.00 0.00 C ATOM 1116 CG1 VAL A 71 -7.746 -5.188 -5.699 1.00 0.00 C ATOM 1117 CG2 VAL A 71 -6.848 -6.892 -4.097 1.00 0.00 C ATOM 0 H VAL A 71 -4.701 -5.465 -3.079 1.00 0.00 H new ATOM 0 HA VAL A 71 -5.081 -5.773 -5.922 1.00 0.00 H new ATOM 0 HB VAL A 71 -6.982 -4.793 -3.751 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -8.753 -5.410 -5.344 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -7.689 -4.141 -5.997 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -7.515 -5.822 -6.555 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -7.867 -7.091 -3.765 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.592 -7.571 -4.910 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.159 -7.044 -3.266 1.00 0.00 H new ATOM 1127 N THR A 72 -4.729 -3.433 -6.672 1.00 0.00 N ATOM 1128 CA THR A 72 -4.592 -2.073 -7.178 1.00 0.00 C ATOM 1129 C THR A 72 -5.433 -1.866 -8.432 1.00 0.00 C ATOM 1130 O THR A 72 -5.763 -2.821 -9.137 1.00 0.00 O ATOM 1131 CB THR A 72 -3.123 -1.739 -7.499 1.00 0.00 C ATOM 1132 OG1 THR A 72 -2.670 -2.529 -8.603 1.00 0.00 O ATOM 1133 CG2 THR A 72 -2.234 -1.991 -6.290 1.00 0.00 C ATOM 0 H THR A 72 -4.415 -4.157 -7.318 1.00 0.00 H new ATOM 0 HA THR A 72 -4.946 -1.406 -6.392 1.00 0.00 H new ATOM 0 HB THR A 72 -3.063 -0.683 -7.761 1.00 0.00 H new ATOM 0 HG1 THR A 72 -2.746 -3.480 -8.378 1.00 0.00 H new ATOM 0 HG21 THR A 72 -1.201 -1.748 -6.541 1.00 0.00 H new ATOM 0 HG22 THR A 72 -2.563 -1.366 -5.460 1.00 0.00 H new ATOM 0 HG23 THR A 72 -2.300 -3.040 -6.002 1.00 0.00 H new ATOM 1141 N THR A 73 -5.779 -0.612 -8.707 1.00 0.00 N ATOM 1142 CA THR A 73 -6.582 -0.280 -9.876 1.00 0.00 C ATOM 1143 C THR A 73 -5.952 -0.828 -11.151 1.00 0.00 C ATOM 1144 O THR A 73 -6.549 -1.651 -11.845 1.00 0.00 O ATOM 1145 CB THR A 73 -6.762 1.243 -10.020 1.00 0.00 C ATOM 1146 OG1 THR A 73 -7.231 1.800 -8.787 1.00 0.00 O ATOM 1147 CG2 THR A 73 -7.744 1.570 -11.135 1.00 0.00 C ATOM 0 H THR A 73 -5.515 0.190 -8.135 1.00 0.00 H new ATOM 0 HA THR A 73 -7.558 -0.742 -9.729 1.00 0.00 H new ATOM 0 HB THR A 73 -5.794 1.678 -10.270 1.00 0.00 H new ATOM 0 HG1 THR A 73 -7.341 2.769 -8.887 1.00 0.00 H new ATOM 0 HG21 THR A 73 -7.854 2.651 -11.217 1.00 0.00 H new ATOM 0 HG22 THR A 73 -7.370 1.171 -12.078 1.00 0.00 H new ATOM 0 HG23 THR A 73 -8.712 1.123 -10.910 1.00 0.00 H new ATOM 1155 N GLN A 74 -4.742 -0.367 -11.453 1.00 0.00 N ATOM 1156 CA GLN A 74 -4.031 -0.812 -12.646 1.00 0.00 C ATOM 1157 C GLN A 74 -4.099 -2.330 -12.785 1.00 0.00 C ATOM 1158 O GLN A 74 -4.619 -2.850 -13.772 1.00 0.00 O ATOM 1159 CB GLN A 74 -2.572 -0.357 -12.595 1.00 0.00 C ATOM 1160 CG GLN A 74 -2.386 1.124 -12.879 1.00 0.00 C ATOM 1161 CD GLN A 74 -0.993 1.614 -12.536 1.00 0.00 C ATOM 1162 OE1 GLN A 74 -0.490 1.371 -11.439 1.00 0.00 O ATOM 1163 NE2 GLN A 74 -0.362 2.309 -13.475 1.00 0.00 N ATOM 0 H GLN A 74 -4.234 0.314 -10.888 1.00 0.00 H new ATOM 0 HA GLN A 74 -4.513 -0.364 -13.515 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -2.164 -0.584 -11.610 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -1.995 -0.932 -13.319 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -2.585 1.316 -13.933 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -3.118 1.694 -12.308 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -0.817 2.487 -14.370 1.00 0.00 H new ATOM 0 HE22 GLN A 74 0.578 2.665 -13.301 1.00 0.00 H new ATOM 1172 N ARG A 75 -3.569 -3.034 -11.790 1.00 0.00 N ATOM 1173 CA ARG A 75 -3.568 -4.492 -11.802 1.00 0.00 C ATOM 1174 C ARG A 75 -3.054 -5.047 -10.477 1.00 0.00 C ATOM 1175 O ARG A 75 -2.058 -4.566 -9.934 1.00 0.00 O ATOM 1176 CB ARG A 75 -2.706 -5.013 -12.954 1.00 0.00 C ATOM 1177 CG ARG A 75 -1.314 -4.403 -12.998 1.00 0.00 C ATOM 1178 CD ARG A 75 -0.421 -5.125 -13.994 1.00 0.00 C ATOM 1179 NE ARG A 75 -0.563 -4.590 -15.345 1.00 0.00 N ATOM 1180 CZ ARG A 75 0.001 -5.138 -16.416 1.00 0.00 C ATOM 1181 NH1 ARG A 75 0.742 -6.231 -16.293 1.00 0.00 N ATOM 1182 NH2 ARG A 75 -0.176 -4.593 -17.612 1.00 0.00 N ATOM 0 H ARG A 75 -3.135 -2.619 -10.966 1.00 0.00 H new ATOM 0 HA ARG A 75 -4.595 -4.830 -11.943 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -2.616 -6.096 -12.868 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -3.213 -4.809 -13.897 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -1.386 -3.350 -13.269 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -0.865 -4.447 -12.006 1.00 0.00 H new ATOM 0 HD2 ARG A 75 0.618 -5.039 -13.678 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -0.666 -6.187 -13.997 1.00 0.00 H new ATOM 0 HE ARG A 75 -1.126 -3.749 -15.474 1.00 0.00 H new ATOM 0 HH11 ARG A 75 0.880 -6.653 -15.375 1.00 0.00 H new ATOM 0 HH12 ARG A 75 1.174 -6.650 -17.117 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -0.745 -3.752 -17.710 1.00 0.00 H new ATOM 0 HH22 ARG A 75 0.257 -5.014 -18.434 1.00 0.00 H new ATOM 1196 N THR A 76 -3.739 -6.061 -9.960 1.00 0.00 N ATOM 1197 CA THR A 76 -3.354 -6.680 -8.698 1.00 0.00 C ATOM 1198 C THR A 76 -1.911 -7.172 -8.745 1.00 0.00 C ATOM 1199 O THR A 76 -1.491 -7.802 -9.716 1.00 0.00 O ATOM 1200 CB THR A 76 -4.276 -7.863 -8.348 1.00 0.00 C ATOM 1201 OG1 THR A 76 -5.641 -7.430 -8.323 1.00 0.00 O ATOM 1202 CG2 THR A 76 -3.903 -8.459 -6.998 1.00 0.00 C ATOM 0 H THR A 76 -4.564 -6.472 -10.396 1.00 0.00 H new ATOM 0 HA THR A 76 -3.450 -5.914 -7.928 1.00 0.00 H new ATOM 0 HB THR A 76 -4.152 -8.630 -9.113 1.00 0.00 H new ATOM 0 HG1 THR A 76 -6.221 -8.188 -8.101 1.00 0.00 H new ATOM 0 HG21 THR A 76 -4.568 -9.293 -6.772 1.00 0.00 H new ATOM 0 HG22 THR A 76 -2.873 -8.814 -7.029 1.00 0.00 H new ATOM 0 HG23 THR A 76 -4.001 -7.697 -6.224 1.00 0.00 H new ATOM 1210 N PHE A 77 -1.158 -6.881 -7.690 1.00 0.00 N ATOM 1211 CA PHE A 77 0.239 -7.294 -7.611 1.00 0.00 C ATOM 1212 C PHE A 77 0.429 -8.371 -6.547 1.00 0.00 C ATOM 1213 O PHE A 77 -0.522 -8.768 -5.873 1.00 0.00 O ATOM 1214 CB PHE A 77 1.131 -6.090 -7.300 1.00 0.00 C ATOM 1215 CG PHE A 77 1.150 -5.059 -8.392 1.00 0.00 C ATOM 1216 CD1 PHE A 77 1.767 -5.326 -9.604 1.00 0.00 C ATOM 1217 CD2 PHE A 77 0.550 -3.824 -8.207 1.00 0.00 C ATOM 1218 CE1 PHE A 77 1.786 -4.378 -10.610 1.00 0.00 C ATOM 1219 CE2 PHE A 77 0.565 -2.873 -9.210 1.00 0.00 C ATOM 1220 CZ PHE A 77 1.184 -3.151 -10.413 1.00 0.00 C ATOM 0 H PHE A 77 -1.491 -6.361 -6.878 1.00 0.00 H new ATOM 0 HA PHE A 77 0.525 -7.710 -8.577 1.00 0.00 H new ATOM 0 HB2 PHE A 77 0.788 -5.623 -6.377 1.00 0.00 H new ATOM 0 HB3 PHE A 77 2.149 -6.438 -7.122 1.00 0.00 H new ATOM 0 HD1 PHE A 77 2.238 -6.285 -9.764 1.00 0.00 H new ATOM 0 HD2 PHE A 77 0.065 -3.602 -7.268 1.00 0.00 H new ATOM 0 HE1 PHE A 77 2.271 -4.597 -11.550 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.093 -1.914 -9.053 1.00 0.00 H new ATOM 0 HZ PHE A 77 1.197 -2.410 -11.198 1.00 0.00 H new ATOM 1230 N VAL A 78 1.664 -8.840 -6.402 1.00 0.00 N ATOM 1231 CA VAL A 78 1.980 -9.870 -5.420 1.00 0.00 C ATOM 1232 C VAL A 78 3.286 -9.559 -4.697 1.00 0.00 C ATOM 1233 O VAL A 78 4.253 -9.105 -5.309 1.00 0.00 O ATOM 1234 CB VAL A 78 2.089 -11.258 -6.078 1.00 0.00 C ATOM 1235 CG1 VAL A 78 2.352 -12.328 -5.029 1.00 0.00 C ATOM 1236 CG2 VAL A 78 0.827 -11.573 -6.867 1.00 0.00 C ATOM 0 H VAL A 78 2.462 -8.523 -6.952 1.00 0.00 H new ATOM 0 HA VAL A 78 1.163 -9.881 -4.699 1.00 0.00 H new ATOM 0 HB VAL A 78 2.931 -11.248 -6.770 1.00 0.00 H new ATOM 0 HG11 VAL A 78 2.426 -13.302 -5.513 1.00 0.00 H new ATOM 0 HG12 VAL A 78 3.286 -12.108 -4.511 1.00 0.00 H new ATOM 0 HG13 VAL A 78 1.533 -12.342 -4.310 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.921 -12.557 -7.326 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -0.033 -11.565 -6.197 1.00 0.00 H new ATOM 0 HG23 VAL A 78 0.687 -10.822 -7.645 1.00 0.00 H new ATOM 1246 N PHE A 79 3.306 -9.805 -3.392 1.00 0.00 N ATOM 1247 CA PHE A 79 4.494 -9.551 -2.584 1.00 0.00 C ATOM 1248 C PHE A 79 4.699 -10.659 -1.555 1.00 0.00 C ATOM 1249 O PHE A 79 3.740 -11.169 -0.977 1.00 0.00 O ATOM 1250 CB PHE A 79 4.376 -8.199 -1.878 1.00 0.00 C ATOM 1251 CG PHE A 79 4.724 -7.031 -2.757 1.00 0.00 C ATOM 1252 CD1 PHE A 79 5.983 -6.925 -3.325 1.00 0.00 C ATOM 1253 CD2 PHE A 79 3.791 -6.040 -3.015 1.00 0.00 C ATOM 1254 CE1 PHE A 79 6.306 -5.852 -4.134 1.00 0.00 C ATOM 1255 CE2 PHE A 79 4.108 -4.965 -3.824 1.00 0.00 C ATOM 1256 CZ PHE A 79 5.367 -4.870 -4.383 1.00 0.00 C ATOM 0 H PHE A 79 2.514 -10.180 -2.871 1.00 0.00 H new ATOM 0 HA PHE A 79 5.358 -9.532 -3.248 1.00 0.00 H new ATOM 0 HB2 PHE A 79 3.357 -8.077 -1.512 1.00 0.00 H new ATOM 0 HB3 PHE A 79 5.030 -8.195 -1.006 1.00 0.00 H new ATOM 0 HD1 PHE A 79 6.721 -7.690 -3.133 1.00 0.00 H new ATOM 0 HD2 PHE A 79 2.805 -6.108 -2.579 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.291 -5.781 -4.571 1.00 0.00 H new ATOM 0 HE2 PHE A 79 3.371 -4.200 -4.019 1.00 0.00 H new ATOM 0 HZ PHE A 79 5.617 -4.030 -5.014 1.00 0.00 H new ATOM 1266 N ARG A 80 5.957 -11.025 -1.333 1.00 0.00 N ATOM 1267 CA ARG A 80 6.289 -12.073 -0.375 1.00 0.00 C ATOM 1268 C ARG A 80 7.171 -11.528 0.744 1.00 0.00 C ATOM 1269 O ARG A 80 7.980 -10.625 0.528 1.00 0.00 O ATOM 1270 CB ARG A 80 6.999 -13.231 -1.080 1.00 0.00 C ATOM 1271 CG ARG A 80 7.536 -14.287 -0.127 1.00 0.00 C ATOM 1272 CD ARG A 80 8.953 -13.963 0.321 1.00 0.00 C ATOM 1273 NE ARG A 80 9.584 -15.093 0.998 1.00 0.00 N ATOM 1274 CZ ARG A 80 10.743 -15.009 1.643 1.00 0.00 C ATOM 1275 NH1 ARG A 80 11.392 -13.854 1.699 1.00 0.00 N ATOM 1276 NH2 ARG A 80 11.253 -16.081 2.235 1.00 0.00 N ATOM 0 H ARG A 80 6.763 -10.612 -1.803 1.00 0.00 H new ATOM 0 HA ARG A 80 5.360 -12.437 0.063 1.00 0.00 H new ATOM 0 HB2 ARG A 80 6.305 -13.701 -1.777 1.00 0.00 H new ATOM 0 HB3 ARG A 80 7.824 -12.834 -1.671 1.00 0.00 H new ATOM 0 HG2 ARG A 80 6.885 -14.358 0.744 1.00 0.00 H new ATOM 0 HG3 ARG A 80 7.521 -15.261 -0.616 1.00 0.00 H new ATOM 0 HD2 ARG A 80 9.551 -13.679 -0.545 1.00 0.00 H new ATOM 0 HD3 ARG A 80 8.934 -13.103 0.991 1.00 0.00 H new ATOM 0 HE ARG A 80 9.109 -15.996 0.974 1.00 0.00 H new ATOM 0 HH11 ARG A 80 11.002 -13.027 1.246 1.00 0.00 H new ATOM 0 HH12 ARG A 80 12.281 -13.792 2.195 1.00 0.00 H new ATOM 0 HH21 ARG A 80 10.756 -16.971 2.195 1.00 0.00 H new ATOM 0 HH22 ARG A 80 12.143 -16.016 2.730 1.00 0.00 H new ATOM 1290 N VAL A 81 7.010 -12.082 1.941 1.00 0.00 N ATOM 1291 CA VAL A 81 7.792 -11.652 3.095 1.00 0.00 C ATOM 1292 C VAL A 81 8.702 -12.770 3.590 1.00 0.00 C ATOM 1293 O VAL A 81 8.661 -13.888 3.079 1.00 0.00 O ATOM 1294 CB VAL A 81 6.882 -11.195 4.251 1.00 0.00 C ATOM 1295 CG1 VAL A 81 6.414 -9.765 4.029 1.00 0.00 C ATOM 1296 CG2 VAL A 81 5.696 -12.136 4.398 1.00 0.00 C ATOM 0 H VAL A 81 6.345 -12.830 2.138 1.00 0.00 H new ATOM 0 HA VAL A 81 8.402 -10.810 2.768 1.00 0.00 H new ATOM 0 HB VAL A 81 7.457 -11.224 5.177 1.00 0.00 H new ATOM 0 HG11 VAL A 81 5.772 -9.460 4.856 1.00 0.00 H new ATOM 0 HG12 VAL A 81 7.279 -9.103 3.977 1.00 0.00 H new ATOM 0 HG13 VAL A 81 5.855 -9.706 3.095 1.00 0.00 H new ATOM 0 HG21 VAL A 81 5.063 -11.799 5.219 1.00 0.00 H new ATOM 0 HG22 VAL A 81 5.119 -12.141 3.473 1.00 0.00 H new ATOM 0 HG23 VAL A 81 6.055 -13.144 4.607 1.00 0.00 H new ATOM 1306 N GLU A 82 9.522 -12.459 4.589 1.00 0.00 N ATOM 1307 CA GLU A 82 10.443 -13.439 5.153 1.00 0.00 C ATOM 1308 C GLU A 82 9.924 -13.968 6.488 1.00 0.00 C ATOM 1309 O GLU A 82 10.058 -15.153 6.794 1.00 0.00 O ATOM 1310 CB GLU A 82 11.829 -12.820 5.341 1.00 0.00 C ATOM 1311 CG GLU A 82 11.797 -11.324 5.606 1.00 0.00 C ATOM 1312 CD GLU A 82 13.149 -10.774 6.016 1.00 0.00 C ATOM 1313 OE1 GLU A 82 14.081 -10.812 5.186 1.00 0.00 O ATOM 1314 OE2 GLU A 82 13.276 -10.308 7.167 1.00 0.00 O ATOM 0 H GLU A 82 9.567 -11.537 5.024 1.00 0.00 H new ATOM 0 HA GLU A 82 10.518 -14.273 4.456 1.00 0.00 H new ATOM 0 HB2 GLU A 82 12.330 -13.317 6.172 1.00 0.00 H new ATOM 0 HB3 GLU A 82 12.426 -13.010 4.449 1.00 0.00 H new ATOM 0 HG2 GLU A 82 11.456 -10.807 4.709 1.00 0.00 H new ATOM 0 HG3 GLU A 82 11.070 -11.114 6.391 1.00 0.00 H new ATOM 1321 N LYS A 83 9.332 -13.080 7.279 1.00 0.00 N ATOM 1322 CA LYS A 83 8.792 -13.454 8.581 1.00 0.00 C ATOM 1323 C LYS A 83 7.280 -13.256 8.620 1.00 0.00 C ATOM 1324 O LYS A 83 6.756 -12.302 8.046 1.00 0.00 O ATOM 1325 CB LYS A 83 9.455 -12.630 9.687 1.00 0.00 C ATOM 1326 CG LYS A 83 10.968 -12.760 9.719 1.00 0.00 C ATOM 1327 CD LYS A 83 11.399 -14.192 9.987 1.00 0.00 C ATOM 1328 CE LYS A 83 12.875 -14.271 10.346 1.00 0.00 C ATOM 1329 NZ LYS A 83 13.741 -14.281 9.135 1.00 0.00 N ATOM 0 H LYS A 83 9.214 -12.095 7.041 1.00 0.00 H new ATOM 0 HA LYS A 83 9.006 -14.510 8.746 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.192 -11.581 9.554 1.00 0.00 H new ATOM 0 HB3 LYS A 83 9.052 -12.940 10.651 1.00 0.00 H new ATOM 0 HG2 LYS A 83 11.383 -12.426 8.768 1.00 0.00 H new ATOM 0 HG3 LYS A 83 11.374 -12.106 10.491 1.00 0.00 H new ATOM 0 HD2 LYS A 83 10.803 -14.607 10.800 1.00 0.00 H new ATOM 0 HD3 LYS A 83 11.204 -14.803 9.105 1.00 0.00 H new ATOM 0 HE2 LYS A 83 13.141 -13.422 10.976 1.00 0.00 H new ATOM 0 HE3 LYS A 83 13.059 -15.172 10.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 14.739 -14.336 9.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 13.505 -15.105 8.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 13.585 -13.409 8.589 1.00 0.00 H new ATOM 1343 N GLU A 84 6.587 -14.162 9.302 1.00 0.00 N ATOM 1344 CA GLU A 84 5.135 -14.084 9.416 1.00 0.00 C ATOM 1345 C GLU A 84 4.706 -12.737 9.991 1.00 0.00 C ATOM 1346 O GLU A 84 3.743 -12.131 9.523 1.00 0.00 O ATOM 1347 CB GLU A 84 4.609 -15.218 10.298 1.00 0.00 C ATOM 1348 CG GLU A 84 3.111 -15.153 10.545 1.00 0.00 C ATOM 1349 CD GLU A 84 2.599 -16.336 11.344 1.00 0.00 C ATOM 1350 OE1 GLU A 84 3.066 -17.467 11.093 1.00 0.00 O ATOM 1351 OE2 GLU A 84 1.733 -16.131 12.220 1.00 0.00 O ATOM 0 H GLU A 84 7.006 -14.957 9.783 1.00 0.00 H new ATOM 0 HA GLU A 84 4.712 -14.184 8.417 1.00 0.00 H new ATOM 0 HB2 GLU A 84 4.850 -16.172 9.830 1.00 0.00 H new ATOM 0 HB3 GLU A 84 5.128 -15.192 11.256 1.00 0.00 H new ATOM 0 HG2 GLU A 84 2.874 -14.231 11.076 1.00 0.00 H new ATOM 0 HG3 GLU A 84 2.590 -15.113 9.588 1.00 0.00 H new ATOM 1358 N GLU A 85 5.427 -12.277 11.008 1.00 0.00 N ATOM 1359 CA GLU A 85 5.120 -11.003 11.647 1.00 0.00 C ATOM 1360 C GLU A 85 4.977 -9.894 10.609 1.00 0.00 C ATOM 1361 O GLU A 85 3.998 -9.149 10.613 1.00 0.00 O ATOM 1362 CB GLU A 85 6.212 -10.636 12.654 1.00 0.00 C ATOM 1363 CG GLU A 85 6.047 -11.314 14.005 1.00 0.00 C ATOM 1364 CD GLU A 85 4.761 -10.917 14.703 1.00 0.00 C ATOM 1365 OE1 GLU A 85 4.615 -9.725 15.047 1.00 0.00 O ATOM 1366 OE2 GLU A 85 3.900 -11.799 14.905 1.00 0.00 O ATOM 0 H GLU A 85 6.227 -12.767 11.407 1.00 0.00 H new ATOM 0 HA GLU A 85 4.171 -11.109 12.173 1.00 0.00 H new ATOM 0 HB2 GLU A 85 7.183 -10.905 12.238 1.00 0.00 H new ATOM 0 HB3 GLU A 85 6.214 -9.555 12.797 1.00 0.00 H new ATOM 0 HG2 GLU A 85 6.064 -12.395 13.869 1.00 0.00 H new ATOM 0 HG3 GLU A 85 6.895 -11.060 14.641 1.00 0.00 H new ATOM 1373 N GLU A 86 5.962 -9.791 9.722 1.00 0.00 N ATOM 1374 CA GLU A 86 5.946 -8.772 8.679 1.00 0.00 C ATOM 1375 C GLU A 86 4.613 -8.773 7.937 1.00 0.00 C ATOM 1376 O GLU A 86 3.951 -7.741 7.827 1.00 0.00 O ATOM 1377 CB GLU A 86 7.092 -9.004 7.691 1.00 0.00 C ATOM 1378 CG GLU A 86 8.446 -8.553 8.213 1.00 0.00 C ATOM 1379 CD GLU A 86 9.416 -8.211 7.099 1.00 0.00 C ATOM 1380 OE1 GLU A 86 9.332 -8.844 6.025 1.00 0.00 O ATOM 1381 OE2 GLU A 86 10.258 -7.312 7.300 1.00 0.00 O ATOM 0 H GLU A 86 6.780 -10.400 9.705 1.00 0.00 H new ATOM 0 HA GLU A 86 6.076 -7.800 9.155 1.00 0.00 H new ATOM 0 HB2 GLU A 86 7.141 -10.065 7.447 1.00 0.00 H new ATOM 0 HB3 GLU A 86 6.874 -8.474 6.764 1.00 0.00 H new ATOM 0 HG2 GLU A 86 8.312 -7.681 8.854 1.00 0.00 H new ATOM 0 HG3 GLU A 86 8.873 -9.341 8.833 1.00 0.00 H new ATOM 1388 N ARG A 87 4.226 -9.939 7.430 1.00 0.00 N ATOM 1389 CA ARG A 87 2.973 -10.075 6.697 1.00 0.00 C ATOM 1390 C ARG A 87 1.890 -9.187 7.302 1.00 0.00 C ATOM 1391 O ARG A 87 1.470 -8.203 6.695 1.00 0.00 O ATOM 1392 CB ARG A 87 2.511 -11.534 6.699 1.00 0.00 C ATOM 1393 CG ARG A 87 1.527 -11.863 5.589 1.00 0.00 C ATOM 1394 CD ARG A 87 0.576 -12.977 5.999 1.00 0.00 C ATOM 1395 NE ARG A 87 1.253 -14.268 6.092 1.00 0.00 N ATOM 1396 CZ ARG A 87 0.641 -15.396 6.433 1.00 0.00 C ATOM 1397 NH1 ARG A 87 -0.656 -15.392 6.711 1.00 0.00 N ATOM 1398 NH2 ARG A 87 1.325 -16.531 6.496 1.00 0.00 N ATOM 0 H ARG A 87 4.762 -10.803 7.513 1.00 0.00 H new ATOM 0 HA ARG A 87 3.147 -9.758 5.669 1.00 0.00 H new ATOM 0 HB2 ARG A 87 3.382 -12.182 6.604 1.00 0.00 H new ATOM 0 HB3 ARG A 87 2.049 -11.759 7.661 1.00 0.00 H new ATOM 0 HG2 ARG A 87 0.955 -10.971 5.332 1.00 0.00 H new ATOM 0 HG3 ARG A 87 2.073 -12.160 4.694 1.00 0.00 H new ATOM 0 HD2 ARG A 87 0.126 -12.734 6.961 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -0.236 -13.045 5.275 1.00 0.00 H new ATOM 0 HE ARG A 87 2.251 -14.305 5.884 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -1.185 -14.521 6.663 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -1.124 -16.260 6.973 1.00 0.00 H new ATOM 0 HH21 ARG A 87 2.322 -16.538 6.282 1.00 0.00 H new ATOM 0 HH22 ARG A 87 0.854 -17.397 6.758 1.00 0.00 H new ATOM 1412 N ASN A 88 1.442 -9.542 8.502 1.00 0.00 N ATOM 1413 CA ASN A 88 0.407 -8.778 9.189 1.00 0.00 C ATOM 1414 C ASN A 88 0.766 -7.296 9.236 1.00 0.00 C ATOM 1415 O ASN A 88 -0.033 -6.441 8.856 1.00 0.00 O ATOM 1416 CB ASN A 88 0.208 -9.312 10.609 1.00 0.00 C ATOM 1417 CG ASN A 88 -0.014 -10.812 10.637 1.00 0.00 C ATOM 1418 OD1 ASN A 88 -1.063 -11.303 10.219 1.00 0.00 O ATOM 1419 ND2 ASN A 88 0.975 -11.547 11.132 1.00 0.00 N ATOM 0 H ASN A 88 1.780 -10.354 9.019 1.00 0.00 H new ATOM 0 HA ASN A 88 -0.523 -8.891 8.632 1.00 0.00 H new ATOM 0 HB2 ASN A 88 1.081 -9.065 11.213 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -0.646 -8.812 11.066 1.00 0.00 H new ATOM 0 HD21 ASN A 88 0.883 -12.562 11.177 1.00 0.00 H new ATOM 0 HD22 ASN A 88 1.827 -11.097 11.467 1.00 0.00 H new ATOM 1426 N ASP A 89 1.974 -7.001 9.704 1.00 0.00 N ATOM 1427 CA ASP A 89 2.440 -5.622 9.800 1.00 0.00 C ATOM 1428 C ASP A 89 2.144 -4.858 8.513 1.00 0.00 C ATOM 1429 O ASP A 89 1.377 -3.895 8.514 1.00 0.00 O ATOM 1430 CB ASP A 89 3.941 -5.588 10.094 1.00 0.00 C ATOM 1431 CG ASP A 89 4.253 -5.891 11.546 1.00 0.00 C ATOM 1432 OD1 ASP A 89 3.574 -5.326 12.429 1.00 0.00 O ATOM 1433 OD2 ASP A 89 5.178 -6.691 11.801 1.00 0.00 O ATOM 0 H ASP A 89 2.648 -7.697 10.023 1.00 0.00 H new ATOM 0 HA ASP A 89 1.906 -5.140 10.619 1.00 0.00 H new ATOM 0 HB2 ASP A 89 4.450 -6.312 9.457 1.00 0.00 H new ATOM 0 HB3 ASP A 89 4.336 -4.605 9.838 1.00 0.00 H new ATOM 1438 N TRP A 90 2.758 -5.293 7.419 1.00 0.00 N ATOM 1439 CA TRP A 90 2.561 -4.648 6.125 1.00 0.00 C ATOM 1440 C TRP A 90 1.078 -4.430 5.846 1.00 0.00 C ATOM 1441 O TRP A 90 0.632 -3.297 5.661 1.00 0.00 O ATOM 1442 CB TRP A 90 3.183 -5.492 5.012 1.00 0.00 C ATOM 1443 CG TRP A 90 4.672 -5.353 4.922 1.00 0.00 C ATOM 1444 CD1 TRP A 90 5.607 -6.240 5.376 1.00 0.00 C ATOM 1445 CD2 TRP A 90 5.398 -4.262 4.346 1.00 0.00 C ATOM 1446 NE1 TRP A 90 6.870 -5.765 5.115 1.00 0.00 N ATOM 1447 CE2 TRP A 90 6.769 -4.554 4.483 1.00 0.00 C ATOM 1448 CE3 TRP A 90 5.023 -3.068 3.724 1.00 0.00 C ATOM 1449 CZ2 TRP A 90 7.763 -3.694 4.024 1.00 0.00 C ATOM 1450 CZ3 TRP A 90 6.011 -2.215 3.269 1.00 0.00 C ATOM 1451 CH2 TRP A 90 7.367 -2.532 3.420 1.00 0.00 C ATOM 0 H TRP A 90 3.396 -6.089 7.401 1.00 0.00 H new ATOM 0 HA TRP A 90 3.053 -3.676 6.153 1.00 0.00 H new ATOM 0 HB2 TRP A 90 2.933 -6.540 5.178 1.00 0.00 H new ATOM 0 HB3 TRP A 90 2.740 -5.205 4.058 1.00 0.00 H new ATOM 0 HD1 TRP A 90 5.386 -7.176 5.867 1.00 0.00 H new ATOM 0 HE1 TRP A 90 7.742 -6.238 5.353 1.00 0.00 H new ATOM 0 HE3 TRP A 90 3.980 -2.816 3.601 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 8.809 -3.935 4.141 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 5.733 -1.288 2.789 1.00 0.00 H new ATOM 0 HH2 TRP A 90 8.115 -1.845 3.052 1.00 0.00 H new ATOM 1462 N ILE A 91 0.318 -5.520 5.818 1.00 0.00 N ATOM 1463 CA ILE A 91 -1.115 -5.445 5.563 1.00 0.00 C ATOM 1464 C ILE A 91 -1.778 -4.400 6.453 1.00 0.00 C ATOM 1465 O ILE A 91 -2.268 -3.379 5.970 1.00 0.00 O ATOM 1466 CB ILE A 91 -1.799 -6.806 5.792 1.00 0.00 C ATOM 1467 CG1 ILE A 91 -1.170 -7.874 4.894 1.00 0.00 C ATOM 1468 CG2 ILE A 91 -3.293 -6.699 5.529 1.00 0.00 C ATOM 1469 CD1 ILE A 91 -1.817 -9.235 5.030 1.00 0.00 C ATOM 0 H ILE A 91 0.671 -6.465 5.969 1.00 0.00 H new ATOM 0 HA ILE A 91 -1.235 -5.158 4.518 1.00 0.00 H new ATOM 0 HB ILE A 91 -1.653 -7.099 6.832 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -1.238 -7.550 3.855 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -0.110 -7.959 5.132 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -3.762 -7.669 5.695 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -3.730 -5.964 6.205 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -3.460 -6.387 4.498 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -1.321 -9.942 4.365 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -1.725 -9.580 6.060 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -2.872 -9.165 4.763 1.00 0.00 H new ATOM 1481 N SER A 92 -1.788 -4.661 7.757 1.00 0.00 N ATOM 1482 CA SER A 92 -2.393 -3.744 8.715 1.00 0.00 C ATOM 1483 C SER A 92 -2.025 -2.299 8.391 1.00 0.00 C ATOM 1484 O SER A 92 -2.898 -1.441 8.255 1.00 0.00 O ATOM 1485 CB SER A 92 -1.945 -4.089 10.137 1.00 0.00 C ATOM 1486 OG SER A 92 -2.768 -3.455 11.100 1.00 0.00 O ATOM 0 H SER A 92 -1.384 -5.500 8.173 1.00 0.00 H new ATOM 0 HA SER A 92 -3.476 -3.849 8.647 1.00 0.00 H new ATOM 0 HB2 SER A 92 -1.979 -5.169 10.280 1.00 0.00 H new ATOM 0 HB3 SER A 92 -0.909 -3.781 10.280 1.00 0.00 H new ATOM 0 HG SER A 92 -2.462 -3.693 12.000 1.00 0.00 H new ATOM 1492 N ILE A 93 -0.728 -2.039 8.268 1.00 0.00 N ATOM 1493 CA ILE A 93 -0.244 -0.699 7.959 1.00 0.00 C ATOM 1494 C ILE A 93 -0.950 -0.129 6.733 1.00 0.00 C ATOM 1495 O ILE A 93 -1.567 0.935 6.796 1.00 0.00 O ATOM 1496 CB ILE A 93 1.276 -0.692 7.712 1.00 0.00 C ATOM 1497 CG1 ILE A 93 2.028 -0.951 9.020 1.00 0.00 C ATOM 1498 CG2 ILE A 93 1.707 0.632 7.100 1.00 0.00 C ATOM 1499 CD1 ILE A 93 3.528 -1.031 8.848 1.00 0.00 C ATOM 0 H ILE A 93 0.007 -2.738 8.378 1.00 0.00 H new ATOM 0 HA ILE A 93 -0.465 -0.076 8.826 1.00 0.00 H new ATOM 0 HB ILE A 93 1.519 -1.490 7.011 1.00 0.00 H new ATOM 0 HG12 ILE A 93 1.793 -0.156 9.728 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.670 -1.883 9.457 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.784 0.621 6.931 1.00 0.00 H new ATOM 0 HG22 ILE A 93 1.192 0.779 6.150 1.00 0.00 H new ATOM 0 HG23 ILE A 93 1.454 1.446 7.779 1.00 0.00 H new ATOM 0 HD11 ILE A 93 3.996 -1.216 9.815 1.00 0.00 H new ATOM 0 HD12 ILE A 93 3.773 -1.844 8.165 1.00 0.00 H new ATOM 0 HD13 ILE A 93 3.898 -0.090 8.440 1.00 0.00 H new ATOM 1511 N LEU A 94 -0.856 -0.845 5.618 1.00 0.00 N ATOM 1512 CA LEU A 94 -1.486 -0.412 4.375 1.00 0.00 C ATOM 1513 C LEU A 94 -2.952 -0.057 4.604 1.00 0.00 C ATOM 1514 O LEU A 94 -3.385 1.058 4.311 1.00 0.00 O ATOM 1515 CB LEU A 94 -1.375 -1.509 3.315 1.00 0.00 C ATOM 1516 CG LEU A 94 0.043 -1.968 2.971 1.00 0.00 C ATOM 1517 CD1 LEU A 94 0.020 -3.367 2.373 1.00 0.00 C ATOM 1518 CD2 LEU A 94 0.704 -0.988 2.014 1.00 0.00 C ATOM 0 H LEU A 94 -0.350 -1.728 5.549 1.00 0.00 H new ATOM 0 HA LEU A 94 -0.965 0.479 4.023 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -1.943 -2.375 3.656 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.852 -1.154 2.402 1.00 0.00 H new ATOM 0 HG LEU A 94 0.628 -1.997 3.890 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.037 -3.677 2.134 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.413 -4.063 3.092 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.581 -3.364 1.464 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.712 -1.331 1.781 1.00 0.00 H new ATOM 0 HD22 LEU A 94 0.120 -0.926 1.096 1.00 0.00 H new ATOM 0 HD23 LEU A 94 0.754 -0.003 2.479 1.00 0.00 H new ATOM 1530 N LEU A 95 -3.712 -1.012 5.130 1.00 0.00 N ATOM 1531 CA LEU A 95 -5.129 -0.800 5.400 1.00 0.00 C ATOM 1532 C LEU A 95 -5.345 0.475 6.209 1.00 0.00 C ATOM 1533 O LEU A 95 -6.168 1.317 5.852 1.00 0.00 O ATOM 1534 CB LEU A 95 -5.710 -1.999 6.153 1.00 0.00 C ATOM 1535 CG LEU A 95 -6.023 -3.234 5.308 1.00 0.00 C ATOM 1536 CD1 LEU A 95 -6.295 -4.436 6.199 1.00 0.00 C ATOM 1537 CD2 LEU A 95 -7.210 -2.967 4.393 1.00 0.00 C ATOM 0 H LEU A 95 -3.370 -1.940 5.378 1.00 0.00 H new ATOM 0 HA LEU A 95 -5.643 -0.694 4.445 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -5.007 -2.287 6.935 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -6.627 -1.681 6.650 1.00 0.00 H new ATOM 0 HG LEU A 95 -5.154 -3.456 4.688 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -6.516 -5.305 5.580 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -5.417 -4.641 6.812 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -7.147 -4.225 6.845 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -7.419 -3.857 3.799 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -8.084 -2.719 4.995 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -6.978 -2.134 3.730 1.00 0.00 H new ATOM 1549 N ASN A 96 -4.597 0.612 7.299 1.00 0.00 N ATOM 1550 CA ASN A 96 -4.705 1.786 8.158 1.00 0.00 C ATOM 1551 C ASN A 96 -4.523 3.068 7.351 1.00 0.00 C ATOM 1552 O ASN A 96 -5.257 4.039 7.536 1.00 0.00 O ATOM 1553 CB ASN A 96 -3.663 1.722 9.277 1.00 0.00 C ATOM 1554 CG ASN A 96 -4.002 2.641 10.435 1.00 0.00 C ATOM 1555 OD1 ASN A 96 -5.144 2.684 10.894 1.00 0.00 O ATOM 1556 ND2 ASN A 96 -3.009 3.381 10.913 1.00 0.00 N ATOM 0 H ASN A 96 -3.910 -0.075 7.608 1.00 0.00 H new ATOM 0 HA ASN A 96 -5.702 1.793 8.599 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -3.586 0.697 9.640 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -2.686 1.992 8.876 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -3.177 4.018 11.692 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -2.078 3.313 10.501 1.00 0.00 H new ATOM 1563 N ALA A 97 -3.541 3.064 6.456 1.00 0.00 N ATOM 1564 CA ALA A 97 -3.264 4.225 5.620 1.00 0.00 C ATOM 1565 C ALA A 97 -4.475 4.588 4.767 1.00 0.00 C ATOM 1566 O ALA A 97 -4.718 5.762 4.483 1.00 0.00 O ATOM 1567 CB ALA A 97 -2.054 3.963 4.736 1.00 0.00 C ATOM 0 H ALA A 97 -2.924 2.269 6.291 1.00 0.00 H new ATOM 0 HA ALA A 97 -3.046 5.069 6.274 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -1.859 4.839 4.117 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.184 3.759 5.361 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -2.250 3.103 4.096 1.00 0.00 H new ATOM 1573 N LEU A 98 -5.232 3.574 4.360 1.00 0.00 N ATOM 1574 CA LEU A 98 -6.418 3.787 3.538 1.00 0.00 C ATOM 1575 C LEU A 98 -7.535 4.433 4.351 1.00 0.00 C ATOM 1576 O LEU A 98 -8.080 5.468 3.965 1.00 0.00 O ATOM 1577 CB LEU A 98 -6.901 2.459 2.953 1.00 0.00 C ATOM 1578 CG LEU A 98 -5.983 1.808 1.918 1.00 0.00 C ATOM 1579 CD1 LEU A 98 -6.404 0.370 1.660 1.00 0.00 C ATOM 1580 CD2 LEU A 98 -5.987 2.607 0.623 1.00 0.00 C ATOM 0 H LEU A 98 -5.045 2.597 4.586 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.150 4.460 2.724 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.047 1.756 3.773 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -7.876 2.621 2.494 1.00 0.00 H new ATOM 0 HG LEU A 98 -4.968 1.802 2.315 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -5.739 -0.077 0.921 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -6.348 -0.198 2.589 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.427 0.352 1.285 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -5.328 2.129 -0.102 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.000 2.646 0.222 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -5.636 3.620 0.819 1.00 0.00 H new ATOM 1592 N LYS A 99 -7.870 3.819 5.480 1.00 0.00 N ATOM 1593 CA LYS A 99 -8.920 4.335 6.351 1.00 0.00 C ATOM 1594 C LYS A 99 -8.563 5.725 6.868 1.00 0.00 C ATOM 1595 O LYS A 99 -9.441 6.553 7.108 1.00 0.00 O ATOM 1596 CB LYS A 99 -9.147 3.385 7.529 1.00 0.00 C ATOM 1597 CG LYS A 99 -8.228 3.647 8.709 1.00 0.00 C ATOM 1598 CD LYS A 99 -8.638 2.836 9.927 1.00 0.00 C ATOM 1599 CE LYS A 99 -9.635 3.594 10.790 1.00 0.00 C ATOM 1600 NZ LYS A 99 -8.962 4.586 11.674 1.00 0.00 N ATOM 0 H LYS A 99 -7.429 2.962 5.814 1.00 0.00 H new ATOM 0 HA LYS A 99 -9.838 4.407 5.768 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -10.182 3.471 7.860 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -9.005 2.359 7.190 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -7.203 3.399 8.434 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -8.245 4.709 8.955 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -9.077 1.891 9.606 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -7.755 2.592 10.518 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -10.353 4.106 10.150 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -10.198 2.888 11.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -9.675 5.082 12.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -8.295 4.095 12.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -8.445 5.276 11.092 1.00 0.00 H new ATOM 1614 N SER A 100 -7.268 5.975 7.035 1.00 0.00 N ATOM 1615 CA SER A 100 -6.795 7.264 7.526 1.00 0.00 C ATOM 1616 C SER A 100 -7.213 8.390 6.584 1.00 0.00 C ATOM 1617 O SER A 100 -7.693 9.434 7.024 1.00 0.00 O ATOM 1618 CB SER A 100 -5.273 7.249 7.677 1.00 0.00 C ATOM 1619 OG SER A 100 -4.815 8.416 8.338 1.00 0.00 O ATOM 0 H SER A 100 -6.528 5.302 6.837 1.00 0.00 H new ATOM 0 HA SER A 100 -7.248 7.442 8.501 1.00 0.00 H new ATOM 0 HB2 SER A 100 -4.969 6.366 8.239 1.00 0.00 H new ATOM 0 HB3 SER A 100 -4.807 7.178 6.694 1.00 0.00 H new ATOM 0 HG SER A 100 -3.839 8.382 8.424 1.00 0.00 H new ATOM 1625 N GLN A 101 -7.026 8.168 5.287 1.00 0.00 N ATOM 1626 CA GLN A 101 -7.383 9.163 4.283 1.00 0.00 C ATOM 1627 C GLN A 101 -8.729 9.804 4.606 1.00 0.00 C ATOM 1628 O GLN A 101 -8.929 10.997 4.381 1.00 0.00 O ATOM 1629 CB GLN A 101 -7.428 8.524 2.894 1.00 0.00 C ATOM 1630 CG GLN A 101 -6.055 8.201 2.328 1.00 0.00 C ATOM 1631 CD GLN A 101 -6.017 8.272 0.814 1.00 0.00 C ATOM 1632 OE1 GLN A 101 -5.631 9.289 0.238 1.00 0.00 O ATOM 1633 NE2 GLN A 101 -6.419 7.188 0.160 1.00 0.00 N ATOM 0 H GLN A 101 -6.630 7.308 4.907 1.00 0.00 H new ATOM 0 HA GLN A 101 -6.620 9.941 4.292 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -8.016 7.608 2.944 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -7.945 9.197 2.210 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -5.324 8.897 2.739 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -5.760 7.202 2.649 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -6.731 6.366 0.678 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -6.415 7.177 -0.860 1.00 0.00 H new ATOM 1642 N SER A 102 -9.648 9.003 5.134 1.00 0.00 N ATOM 1643 CA SER A 102 -10.977 9.490 5.483 1.00 0.00 C ATOM 1644 C SER A 102 -11.107 9.681 6.992 1.00 0.00 C ATOM 1645 O SER A 102 -11.329 8.723 7.734 1.00 0.00 O ATOM 1646 CB SER A 102 -12.048 8.517 4.987 1.00 0.00 C ATOM 1647 OG SER A 102 -13.344 9.076 5.115 1.00 0.00 O ATOM 0 H SER A 102 -9.497 8.013 5.330 1.00 0.00 H new ATOM 0 HA SER A 102 -11.121 10.455 4.998 1.00 0.00 H new ATOM 0 HB2 SER A 102 -11.859 8.264 3.944 1.00 0.00 H new ATOM 0 HB3 SER A 102 -11.991 7.588 5.555 1.00 0.00 H new ATOM 0 HG SER A 102 -14.010 8.435 4.790 1.00 0.00 H new ATOM 1653 N LEU A 103 -10.965 10.924 7.439 1.00 0.00 N ATOM 1654 CA LEU A 103 -11.066 11.243 8.859 1.00 0.00 C ATOM 1655 C LEU A 103 -12.525 11.371 9.286 1.00 0.00 C ATOM 1656 O LEU A 103 -13.435 11.293 8.460 1.00 0.00 O ATOM 1657 CB LEU A 103 -10.317 12.541 9.164 1.00 0.00 C ATOM 1658 CG LEU A 103 -8.791 12.449 9.176 1.00 0.00 C ATOM 1659 CD1 LEU A 103 -8.234 12.644 7.774 1.00 0.00 C ATOM 1660 CD2 LEU A 103 -8.202 13.475 10.133 1.00 0.00 C ATOM 0 H LEU A 103 -10.780 11.727 6.839 1.00 0.00 H new ATOM 0 HA LEU A 103 -10.612 10.428 9.423 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -10.610 13.288 8.426 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -10.646 12.907 10.136 1.00 0.00 H new ATOM 0 HG LEU A 103 -8.509 11.455 9.522 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -7.147 12.575 7.802 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -8.630 11.872 7.115 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -8.526 13.625 7.400 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -7.115 13.395 10.128 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -8.493 14.477 9.817 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -8.575 13.289 11.140 1.00 0.00 H new ATOM 1672 N THR A 104 -12.741 11.569 10.583 1.00 0.00 N ATOM 1673 CA THR A 104 -14.088 11.709 11.120 1.00 0.00 C ATOM 1674 C THR A 104 -14.263 13.049 11.825 1.00 0.00 C ATOM 1675 O THR A 104 -15.086 13.183 12.730 1.00 0.00 O ATOM 1676 CB THR A 104 -14.420 10.575 12.108 1.00 0.00 C ATOM 1677 OG1 THR A 104 -15.725 10.774 12.662 1.00 0.00 O ATOM 1678 CG2 THR A 104 -13.392 10.516 13.228 1.00 0.00 C ATOM 0 H THR A 104 -12.000 11.636 11.280 1.00 0.00 H new ATOM 0 HA THR A 104 -14.772 11.655 10.273 1.00 0.00 H new ATOM 0 HB THR A 104 -14.397 9.631 11.564 1.00 0.00 H new ATOM 0 HG1 THR A 104 -15.762 11.647 13.106 1.00 0.00 H new ATOM 0 HG21 THR A 104 -13.647 9.708 13.914 1.00 0.00 H new ATOM 0 HG22 THR A 104 -12.404 10.335 12.806 1.00 0.00 H new ATOM 0 HG23 THR A 104 -13.388 11.463 13.768 1.00 0.00 H new ATOM 1686 N SER A 105 -13.483 14.040 11.404 1.00 0.00 N ATOM 1687 CA SER A 105 -13.549 15.370 11.998 1.00 0.00 C ATOM 1688 C SER A 105 -13.422 16.450 10.928 1.00 0.00 C ATOM 1689 O SER A 105 -13.166 16.154 9.761 1.00 0.00 O ATOM 1690 CB SER A 105 -12.446 15.540 13.044 1.00 0.00 C ATOM 1691 OG SER A 105 -12.790 14.893 14.257 1.00 0.00 O ATOM 0 H SER A 105 -12.798 13.947 10.654 1.00 0.00 H new ATOM 0 HA SER A 105 -14.519 15.476 12.483 1.00 0.00 H new ATOM 0 HB2 SER A 105 -11.511 15.130 12.662 1.00 0.00 H new ATOM 0 HB3 SER A 105 -12.276 16.601 13.229 1.00 0.00 H new ATOM 0 HG SER A 105 -13.553 14.298 14.105 1.00 0.00 H new ATOM 1697 N GLN A 106 -13.602 17.702 11.335 1.00 0.00 N ATOM 1698 CA GLN A 106 -13.508 18.827 10.411 1.00 0.00 C ATOM 1699 C GLN A 106 -12.076 19.347 10.331 1.00 0.00 C ATOM 1700 O GLN A 106 -11.503 19.773 11.334 1.00 0.00 O ATOM 1701 CB GLN A 106 -14.448 19.952 10.846 1.00 0.00 C ATOM 1702 CG GLN A 106 -14.950 20.806 9.693 1.00 0.00 C ATOM 1703 CD GLN A 106 -15.849 20.036 8.745 1.00 0.00 C ATOM 1704 OE1 GLN A 106 -15.387 19.178 7.993 1.00 0.00 O ATOM 1705 NE2 GLN A 106 -17.141 20.340 8.777 1.00 0.00 N ATOM 0 H GLN A 106 -13.814 17.963 12.298 1.00 0.00 H new ATOM 0 HA GLN A 106 -13.805 18.478 9.422 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -15.303 19.519 11.366 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -13.930 20.591 11.561 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -15.496 21.662 10.090 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -14.098 21.200 9.140 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -17.480 21.058 9.417 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -17.794 19.855 8.162 1.00 0.00 H new ATOM 1714 N SER A 107 -11.504 19.308 9.132 1.00 0.00 N ATOM 1715 CA SER A 107 -10.138 19.772 8.922 1.00 0.00 C ATOM 1716 C SER A 107 -10.070 21.296 8.953 1.00 0.00 C ATOM 1717 O SER A 107 -10.781 21.974 8.213 1.00 0.00 O ATOM 1718 CB SER A 107 -9.601 19.254 7.586 1.00 0.00 C ATOM 1719 OG SER A 107 -9.101 17.934 7.714 1.00 0.00 O ATOM 0 H SER A 107 -11.965 18.960 8.291 1.00 0.00 H new ATOM 0 HA SER A 107 -9.520 19.382 9.731 1.00 0.00 H new ATOM 0 HB2 SER A 107 -10.395 19.275 6.839 1.00 0.00 H new ATOM 0 HB3 SER A 107 -8.810 19.913 7.229 1.00 0.00 H new ATOM 0 HG SER A 107 -8.766 17.626 6.846 1.00 0.00 H new ATOM 1725 N GLN A 108 -9.210 21.825 9.817 1.00 0.00 N ATOM 1726 CA GLN A 108 -9.050 23.269 9.947 1.00 0.00 C ATOM 1727 C GLN A 108 -7.775 23.739 9.253 1.00 0.00 C ATOM 1728 O GLN A 108 -6.746 23.067 9.303 1.00 0.00 O ATOM 1729 CB GLN A 108 -9.019 23.670 11.422 1.00 0.00 C ATOM 1730 CG GLN A 108 -9.291 25.147 11.658 1.00 0.00 C ATOM 1731 CD GLN A 108 -9.408 25.492 13.129 1.00 0.00 C ATOM 1732 OE1 GLN A 108 -10.420 26.034 13.573 1.00 0.00 O ATOM 1733 NE2 GLN A 108 -8.369 25.178 13.895 1.00 0.00 N ATOM 0 H GLN A 108 -8.614 21.277 10.437 1.00 0.00 H new ATOM 0 HA GLN A 108 -9.903 23.748 9.466 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -9.759 23.082 11.965 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -8.043 23.418 11.838 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -8.488 25.736 11.214 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -10.213 25.429 11.148 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -7.550 24.729 13.485 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -8.390 25.386 14.893 1.00 0.00 H new ATOM 1742 N ALA A 109 -7.852 24.898 8.607 1.00 0.00 N ATOM 1743 CA ALA A 109 -6.704 25.459 7.905 1.00 0.00 C ATOM 1744 C ALA A 109 -5.403 25.127 8.628 1.00 0.00 C ATOM 1745 O ALA A 109 -5.320 25.221 9.852 1.00 0.00 O ATOM 1746 CB ALA A 109 -6.860 26.966 7.760 1.00 0.00 C ATOM 0 H ALA A 109 -8.697 25.467 8.555 1.00 0.00 H new ATOM 0 HA ALA A 109 -6.662 25.012 6.912 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -5.996 27.372 7.234 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -7.765 27.185 7.194 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -6.930 27.421 8.748 1.00 0.00 H new ATOM 1752 N SER A 110 -4.389 24.737 7.861 1.00 0.00 N ATOM 1753 CA SER A 110 -3.093 24.386 8.429 1.00 0.00 C ATOM 1754 C SER A 110 -1.965 24.723 7.458 1.00 0.00 C ATOM 1755 O SER A 110 -2.200 24.954 6.272 1.00 0.00 O ATOM 1756 CB SER A 110 -3.052 22.898 8.779 1.00 0.00 C ATOM 1757 OG SER A 110 -1.929 22.595 9.588 1.00 0.00 O ATOM 0 H SER A 110 -4.440 24.656 6.845 1.00 0.00 H new ATOM 0 HA SER A 110 -2.953 24.970 9.339 1.00 0.00 H new ATOM 0 HB2 SER A 110 -3.967 22.619 9.302 1.00 0.00 H new ATOM 0 HB3 SER A 110 -3.015 22.307 7.864 1.00 0.00 H new ATOM 0 HG SER A 110 -1.927 21.638 9.799 1.00 0.00 H new ATOM 1763 N GLY A 111 -0.739 24.749 7.970 1.00 0.00 N ATOM 1764 CA GLY A 111 0.408 25.058 7.136 1.00 0.00 C ATOM 1765 C GLY A 111 1.692 24.457 7.670 1.00 0.00 C ATOM 1766 O GLY A 111 2.474 25.117 8.355 1.00 0.00 O ATOM 0 H GLY A 111 -0.519 24.561 8.948 1.00 0.00 H new ATOM 0 HA2 GLY A 111 0.230 24.688 6.127 1.00 0.00 H new ATOM 0 HA3 GLY A 111 0.520 26.140 7.063 1.00 0.00 H new ATOM 1770 N PRO A 112 1.925 23.173 7.358 1.00 0.00 N ATOM 1771 CA PRO A 112 3.123 22.455 7.802 1.00 0.00 C ATOM 1772 C PRO A 112 4.388 22.954 7.112 1.00 0.00 C ATOM 1773 O PRO A 112 4.332 23.496 6.008 1.00 0.00 O ATOM 1774 CB PRO A 112 2.834 21.005 7.405 1.00 0.00 C ATOM 1775 CG PRO A 112 1.874 21.106 6.271 1.00 0.00 C ATOM 1776 CD PRO A 112 1.037 22.325 6.545 1.00 0.00 C ATOM 0 HA PRO A 112 3.308 22.591 8.867 1.00 0.00 H new ATOM 0 HB2 PRO A 112 3.746 20.487 7.107 1.00 0.00 H new ATOM 0 HB3 PRO A 112 2.407 20.445 8.237 1.00 0.00 H new ATOM 0 HG2 PRO A 112 2.400 21.199 5.321 1.00 0.00 H new ATOM 0 HG3 PRO A 112 1.253 20.213 6.205 1.00 0.00 H new ATOM 0 HD2 PRO A 112 0.739 22.824 5.623 1.00 0.00 H new ATOM 0 HD3 PRO A 112 0.122 22.072 7.080 1.00 0.00 H new ATOM 1784 N SER A 113 5.528 22.768 7.770 1.00 0.00 N ATOM 1785 CA SER A 113 6.807 23.203 7.221 1.00 0.00 C ATOM 1786 C SER A 113 7.928 22.258 7.641 1.00 0.00 C ATOM 1787 O SER A 113 7.701 21.292 8.369 1.00 0.00 O ATOM 1788 CB SER A 113 7.126 24.627 7.681 1.00 0.00 C ATOM 1789 OG SER A 113 8.024 25.262 6.788 1.00 0.00 O ATOM 0 H SER A 113 5.592 22.319 8.684 1.00 0.00 H new ATOM 0 HA SER A 113 6.731 23.188 6.134 1.00 0.00 H new ATOM 0 HB2 SER A 113 6.205 25.206 7.748 1.00 0.00 H new ATOM 0 HB3 SER A 113 7.560 24.601 8.681 1.00 0.00 H new ATOM 0 HG SER A 113 8.211 26.171 7.103 1.00 0.00 H new ATOM 1795 N SER A 114 9.140 22.544 7.176 1.00 0.00 N ATOM 1796 CA SER A 114 10.297 21.718 7.499 1.00 0.00 C ATOM 1797 C SER A 114 11.584 22.365 6.996 1.00 0.00 C ATOM 1798 O SER A 114 11.556 23.238 6.130 1.00 0.00 O ATOM 1799 CB SER A 114 10.142 20.324 6.889 1.00 0.00 C ATOM 1800 OG SER A 114 11.208 19.475 7.278 1.00 0.00 O ATOM 0 H SER A 114 9.346 23.342 6.574 1.00 0.00 H new ATOM 0 HA SER A 114 10.356 21.628 8.584 1.00 0.00 H new ATOM 0 HB2 SER A 114 9.193 19.889 7.204 1.00 0.00 H new ATOM 0 HB3 SER A 114 10.112 20.401 5.802 1.00 0.00 H new ATOM 0 HG SER A 114 11.084 18.590 6.876 1.00 0.00 H new ATOM 1806 N GLY A 115 12.713 21.929 7.548 1.00 0.00 N ATOM 1807 CA GLY A 115 13.995 22.476 7.144 1.00 0.00 C ATOM 1808 C GLY A 115 14.237 23.863 7.706 1.00 0.00 C ATOM 1809 O GLY A 115 13.308 24.519 8.178 1.00 0.00 O ATOM 0 H GLY A 115 12.762 21.207 8.267 1.00 0.00 H new ATOM 0 HA2 GLY A 115 14.791 21.809 7.475 1.00 0.00 H new ATOM 0 HA3 GLY A 115 14.043 22.515 6.056 1.00 0.00 H new TER 1813 GLY A 115