USER MOD reduce.3.24.130724 H: found=0, std=0, add=1050, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1045 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 113 THR OG1 : rot 180:sc= -0.0013 USER MOD Set 1.2: A 114 HIS : no HD1:sc= 0 X(o=-0.0013,f=0.047) USER MOD Set 2.1: A 93 THR OG1 : rot -60:sc= 0.281 USER MOD Set 2.2: A 95 MET CE :methyl -175:sc= -1.21 (180deg=-1.02) USER MOD Set 3.1: A 64 HIS : no HD1:sc= -0.161 X(o=-0.16,f=-0.48) USER MOD Set 3.2: A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 1 ILE N :NH3+ 152:sc= 0 (180deg=-0.0157) USER MOD Single : A 3 LYS NZ :NH3+ 168:sc= -0.0284 (180deg=-0.176) USER MOD Single : A 4 HIS : no HD1:sc= -0.252 X(o=-0.25,f=-0.41) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -1.5 X(o=-1.5,f=-1.8) USER MOD Single : A 20 THR OG1 : rot 99:sc= 1.25 USER MOD Single : A 21 GLN : amide:sc= -0.76 K(o=-0.76,f=-0.15) USER MOD Single : A 26 THR OG1 : rot -57:sc= 1.21 USER MOD Single : A 27 SER OG : rot 180:sc= -0.578 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= -0.785 X(o=-0.79,f=-1) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0.0154 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.698 X(o=-0.7,f=-0.7) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 50:sc= 1.21 USER MOD Single : A 72 ASN : amide:sc= -1.28 K(o=-1.3,f=-4!) USER MOD Single : A 74 TYR OH : rot 30:sc= 0 USER MOD Single : A 75 MET CE :methyl 156:sc= -1.38 (180deg=-1.47) USER MOD Single : A 78 TYR OH : rot 100:sc= -0.125 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 159:sc= 0.474 (180deg=0.078) USER MOD Single : A 86 SER OG : rot 31:sc= 0 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 TYR OH : rot 180:sc= -0.0309 USER MOD Single : A 110 ASN : amide:sc= -0.0026 X(o=-0.0026,f=0) USER MOD Single : A 118 THR OG1 : rot -170:sc= 0 USER MOD Single : A 121 GLN : amide:sc= -1.21! K(o=-1.2!,f=-0.035) USER MOD Single : A 122 MET CE :methyl 169:sc= -0.464 (180deg=-1.05) USER MOD Single : A 126 GLN : amide:sc= -0.366 X(o=-0.37,f=-0.59) USER MOD Single : A 127 GLN : amide:sc= 0.409 X(o=0.41,f=0) USER MOD Single : A 128 MET CE :methyl 179:sc= -1.2 (180deg=-1.22) USER MOD Single : A 129 GLN : amide:sc= -0.0992 X(o=-0.099,f=-0.38) USER MOD Single : A 134 ASN : amide:sc= -0.42 X(o=-0.42,f=-0.024) USER MOD Single : A 137 THR OG1 : rot 180:sc= -0.157 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 144 THR OG1 : rot 180:sc= 0.0127 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 1 18.432 -26.414 14.239 1.00 0.00 N ATOM 2 CA ILE A 1 19.509 -25.686 13.553 1.00 0.00 C ATOM 3 C ILE A 1 19.096 -24.235 13.285 1.00 0.00 C ATOM 4 O ILE A 1 18.673 -23.902 12.175 1.00 0.00 O ATOM 5 CB ILE A 1 20.025 -26.431 12.298 1.00 0.00 C ATOM 6 CG1 ILE A 1 18.909 -26.962 11.367 1.00 0.00 C ATOM 7 CG2 ILE A 1 20.936 -27.595 12.729 1.00 0.00 C ATOM 8 CD1 ILE A 1 19.408 -27.260 9.949 1.00 0.00 C ATOM 0 H1 ILE A 1 18.492 -27.425 14.003 1.00 0.00 H new ATOM 0 H2 ILE A 1 18.530 -26.292 15.267 1.00 0.00 H new ATOM 0 H3 ILE A 1 17.511 -26.041 13.933 1.00 0.00 H new ATOM 0 HA ILE A 1 20.370 -25.648 14.221 1.00 0.00 H new ATOM 0 HB ILE A 1 20.577 -25.694 11.715 1.00 0.00 H new ATOM 0 HG12 ILE A 1 18.486 -27.870 11.796 1.00 0.00 H new ATOM 0 HG13 ILE A 1 18.104 -26.228 11.317 1.00 0.00 H new ATOM 0 HG21 ILE A 1 21.299 -28.119 11.845 1.00 0.00 H new ATOM 0 HG22 ILE A 1 21.783 -27.204 13.293 1.00 0.00 H new ATOM 0 HG23 ILE A 1 20.372 -28.286 13.355 1.00 0.00 H new ATOM 0 HD11 ILE A 1 18.581 -27.629 9.342 1.00 0.00 H new ATOM 0 HD12 ILE A 1 19.806 -26.348 9.504 1.00 0.00 H new ATOM 0 HD13 ILE A 1 20.193 -28.015 9.991 1.00 0.00 H new ATOM 20 N PRO A 2 19.195 -23.343 14.285 1.00 0.00 N ATOM 21 CA PRO A 2 18.971 -21.914 14.092 1.00 0.00 C ATOM 22 C PRO A 2 20.127 -21.294 13.294 1.00 0.00 C ATOM 23 O PRO A 2 21.261 -21.774 13.381 1.00 0.00 O ATOM 24 CB PRO A 2 18.915 -21.338 15.507 1.00 0.00 C ATOM 25 CG PRO A 2 19.828 -22.258 16.313 1.00 0.00 C ATOM 26 CD PRO A 2 19.612 -23.619 15.654 1.00 0.00 C ATOM 0 HA PRO A 2 18.061 -21.706 13.529 1.00 0.00 H new ATOM 0 HB2 PRO A 2 19.264 -20.306 15.533 1.00 0.00 H new ATOM 0 HB3 PRO A 2 17.898 -21.340 15.899 1.00 0.00 H new ATOM 0 HG2 PRO A 2 20.870 -21.943 16.257 1.00 0.00 H new ATOM 0 HG3 PRO A 2 19.556 -22.273 17.368 1.00 0.00 H new ATOM 0 HD2 PRO A 2 20.528 -24.210 15.671 1.00 0.00 H new ATOM 0 HD3 PRO A 2 18.852 -24.193 16.185 1.00 0.00 H new ATOM 34 N LYS A 3 19.865 -20.219 12.545 1.00 0.00 N ATOM 35 CA LYS A 3 20.885 -19.380 11.908 1.00 0.00 C ATOM 36 C LYS A 3 20.397 -17.937 11.987 1.00 0.00 C ATOM 37 O LYS A 3 19.206 -17.692 11.788 1.00 0.00 O ATOM 38 CB LYS A 3 21.136 -19.769 10.440 1.00 0.00 C ATOM 39 CG LYS A 3 21.839 -21.123 10.234 1.00 0.00 C ATOM 40 CD LYS A 3 20.894 -22.324 10.037 1.00 0.00 C ATOM 41 CE LYS A 3 20.168 -22.363 8.683 1.00 0.00 C ATOM 42 NZ LYS A 3 21.107 -22.383 7.544 1.00 0.00 N ATOM 0 H LYS A 3 18.914 -19.900 12.360 1.00 0.00 H new ATOM 0 HA LYS A 3 21.833 -19.515 12.428 1.00 0.00 H new ATOM 0 HB2 LYS A 3 20.180 -19.791 9.918 1.00 0.00 H new ATOM 0 HB3 LYS A 3 21.738 -18.990 9.972 1.00 0.00 H new ATOM 0 HG2 LYS A 3 22.492 -21.048 9.365 1.00 0.00 H new ATOM 0 HG3 LYS A 3 22.477 -21.319 11.096 1.00 0.00 H new ATOM 0 HD2 LYS A 3 21.470 -23.243 10.150 1.00 0.00 H new ATOM 0 HD3 LYS A 3 20.148 -22.315 10.832 1.00 0.00 H new ATOM 0 HE2 LYS A 3 19.530 -23.246 8.641 1.00 0.00 H new ATOM 0 HE3 LYS A 3 19.516 -21.494 8.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 20.590 -22.612 6.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 21.554 -21.449 7.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 21.840 -23.102 7.711 1.00 0.00 H new ATOM 56 N HIS A 4 21.268 -16.998 12.331 1.00 0.00 N ATOM 57 CA HIS A 4 20.985 -15.577 12.506 1.00 0.00 C ATOM 58 C HIS A 4 21.127 -14.827 11.168 1.00 0.00 C ATOM 59 O HIS A 4 21.475 -15.448 10.158 1.00 0.00 O ATOM 60 CB HIS A 4 21.840 -15.031 13.666 1.00 0.00 C ATOM 61 CG HIS A 4 21.097 -14.997 14.989 1.00 0.00 C ATOM 62 ND1 HIS A 4 19.769 -14.656 15.189 1.00 0.00 N ATOM 63 CD2 HIS A 4 21.631 -15.284 16.218 1.00 0.00 C ATOM 64 CE1 HIS A 4 19.512 -14.730 16.505 1.00 0.00 C ATOM 65 NE2 HIS A 4 20.612 -15.128 17.167 1.00 0.00 N ATOM 0 H HIS A 4 22.248 -17.219 12.506 1.00 0.00 H new ATOM 0 HA HIS A 4 19.947 -15.414 12.797 1.00 0.00 H new ATOM 0 HB2 HIS A 4 22.732 -15.648 13.773 1.00 0.00 H new ATOM 0 HB3 HIS A 4 22.176 -14.024 13.419 1.00 0.00 H new ATOM 0 HD2 HIS A 4 22.651 -15.577 16.418 1.00 0.00 H new ATOM 0 HE1 HIS A 4 18.561 -14.503 16.964 1.00 0.00 H new ATOM 0 HE2 HIS A 4 20.690 -15.287 18.172 1.00 0.00 H new ATOM 73 N PRO A 5 20.666 -13.564 11.069 1.00 0.00 N ATOM 74 CA PRO A 5 20.636 -12.830 9.811 1.00 0.00 C ATOM 75 C PRO A 5 22.004 -12.299 9.368 1.00 0.00 C ATOM 76 O PRO A 5 22.091 -11.750 8.273 1.00 0.00 O ATOM 77 CB PRO A 5 19.654 -11.680 10.048 1.00 0.00 C ATOM 78 CG PRO A 5 19.854 -11.359 11.521 1.00 0.00 C ATOM 79 CD PRO A 5 20.068 -12.747 12.119 1.00 0.00 C ATOM 0 HA PRO A 5 20.334 -13.491 8.999 1.00 0.00 H new ATOM 0 HB2 PRO A 5 19.877 -10.822 9.414 1.00 0.00 H new ATOM 0 HB3 PRO A 5 18.627 -11.976 9.835 1.00 0.00 H new ATOM 0 HG2 PRO A 5 20.712 -10.707 11.684 1.00 0.00 H new ATOM 0 HG3 PRO A 5 18.987 -10.858 11.951 1.00 0.00 H new ATOM 0 HD2 PRO A 5 20.721 -12.697 12.991 1.00 0.00 H new ATOM 0 HD3 PRO A 5 19.123 -13.175 12.453 1.00 0.00 H new ATOM 87 N ASP A 6 23.055 -12.444 10.183 1.00 0.00 N ATOM 88 CA ASP A 6 24.445 -12.075 9.877 1.00 0.00 C ATOM 89 C ASP A 6 24.603 -10.576 9.546 1.00 0.00 C ATOM 90 O ASP A 6 25.538 -10.190 8.847 1.00 0.00 O ATOM 91 CB ASP A 6 25.037 -12.972 8.764 1.00 0.00 C ATOM 92 CG ASP A 6 24.865 -14.482 8.953 1.00 0.00 C ATOM 93 OD1 ASP A 6 24.833 -14.964 10.110 1.00 0.00 O ATOM 94 OD2 ASP A 6 24.789 -15.177 7.910 1.00 0.00 O ATOM 0 H ASP A 6 22.957 -12.840 11.118 1.00 0.00 H new ATOM 0 HA ASP A 6 25.021 -12.251 10.785 1.00 0.00 H new ATOM 0 HB2 ASP A 6 24.578 -12.690 7.816 1.00 0.00 H new ATOM 0 HB3 ASP A 6 26.102 -12.756 8.679 1.00 0.00 H new ATOM 99 N SER A 7 23.660 -9.724 9.965 1.00 0.00 N ATOM 100 CA SER A 7 23.629 -8.301 9.645 1.00 0.00 C ATOM 101 C SER A 7 24.702 -7.551 10.440 1.00 0.00 C ATOM 102 O SER A 7 24.543 -7.322 11.643 1.00 0.00 O ATOM 103 CB SER A 7 22.228 -7.743 9.923 1.00 0.00 C ATOM 104 OG SER A 7 21.271 -8.517 9.224 1.00 0.00 O ATOM 0 H SER A 7 22.879 -10.018 10.551 1.00 0.00 H new ATOM 0 HA SER A 7 23.850 -8.161 8.587 1.00 0.00 H new ATOM 0 HB2 SER A 7 22.020 -7.766 10.993 1.00 0.00 H new ATOM 0 HB3 SER A 7 22.170 -6.701 9.609 1.00 0.00 H new ATOM 0 HG SER A 7 20.374 -8.165 9.400 1.00 0.00 H new ATOM 110 N GLU A 8 25.782 -7.163 9.767 1.00 0.00 N ATOM 111 CA GLU A 8 26.944 -6.474 10.257 1.00 0.00 C ATOM 112 C GLU A 8 27.668 -5.889 9.059 1.00 0.00 C ATOM 113 O GLU A 8 28.157 -6.587 8.171 1.00 0.00 O ATOM 114 CB GLU A 8 27.866 -7.258 11.176 1.00 0.00 C ATOM 115 CG GLU A 8 28.450 -8.588 10.684 1.00 0.00 C ATOM 116 CD GLU A 8 29.110 -9.315 11.862 1.00 0.00 C ATOM 117 OE1 GLU A 8 28.349 -9.806 12.734 1.00 0.00 O ATOM 118 OE2 GLU A 8 30.360 -9.326 11.912 1.00 0.00 O ATOM 0 H GLU A 8 25.860 -7.348 8.767 1.00 0.00 H new ATOM 0 HA GLU A 8 26.591 -5.693 10.931 1.00 0.00 H new ATOM 0 HB2 GLU A 8 28.701 -6.608 11.437 1.00 0.00 H new ATOM 0 HB3 GLU A 8 27.319 -7.459 12.097 1.00 0.00 H new ATOM 0 HG2 GLU A 8 27.663 -9.207 10.254 1.00 0.00 H new ATOM 0 HG3 GLU A 8 29.181 -8.409 9.896 1.00 0.00 H new ATOM 125 N ALA A 9 27.551 -4.575 8.996 1.00 0.00 N ATOM 126 CA ALA A 9 28.238 -3.646 8.126 1.00 0.00 C ATOM 127 C ALA A 9 27.645 -3.699 6.719 1.00 0.00 C ATOM 128 O ALA A 9 28.323 -4.016 5.737 1.00 0.00 O ATOM 129 CB ALA A 9 29.763 -3.832 8.169 1.00 0.00 C ATOM 0 H ALA A 9 26.906 -4.086 9.617 1.00 0.00 H new ATOM 0 HA ALA A 9 28.074 -2.634 8.496 1.00 0.00 H new ATOM 0 HB1 ALA A 9 30.236 -3.113 7.500 1.00 0.00 H new ATOM 0 HB2 ALA A 9 30.121 -3.671 9.186 1.00 0.00 H new ATOM 0 HB3 ALA A 9 30.015 -4.844 7.851 1.00 0.00 H new ATOM 135 N VAL A 10 26.365 -3.337 6.621 1.00 0.00 N ATOM 136 CA VAL A 10 25.572 -3.380 5.411 1.00 0.00 C ATOM 137 C VAL A 10 25.163 -1.962 5.017 1.00 0.00 C ATOM 138 O VAL A 10 25.133 -1.035 5.839 1.00 0.00 O ATOM 139 CB VAL A 10 24.378 -4.347 5.575 1.00 0.00 C ATOM 140 CG1 VAL A 10 24.877 -5.786 5.783 1.00 0.00 C ATOM 141 CG2 VAL A 10 23.434 -3.964 6.729 1.00 0.00 C ATOM 0 H VAL A 10 25.838 -2.992 7.423 1.00 0.00 H new ATOM 0 HA VAL A 10 26.165 -3.780 4.588 1.00 0.00 H new ATOM 0 HB VAL A 10 23.804 -4.274 4.651 1.00 0.00 H new ATOM 0 HG11 VAL A 10 24.023 -6.454 5.897 1.00 0.00 H new ATOM 0 HG12 VAL A 10 25.467 -6.095 4.920 1.00 0.00 H new ATOM 0 HG13 VAL A 10 25.495 -5.831 6.680 1.00 0.00 H new ATOM 0 HG21 VAL A 10 22.619 -4.685 6.787 1.00 0.00 H new ATOM 0 HG22 VAL A 10 23.988 -3.966 7.668 1.00 0.00 H new ATOM 0 HG23 VAL A 10 23.026 -2.969 6.551 1.00 0.00 H new ATOM 151 N ALA A 11 24.904 -1.793 3.729 1.00 0.00 N ATOM 152 CA ALA A 11 24.488 -0.555 3.087 1.00 0.00 C ATOM 153 C ALA A 11 23.125 -0.088 3.623 1.00 0.00 C ATOM 154 O ALA A 11 22.339 -0.911 4.090 1.00 0.00 O ATOM 155 CB ALA A 11 24.421 -0.800 1.574 1.00 0.00 C ATOM 0 H ALA A 11 24.983 -2.563 3.064 1.00 0.00 H new ATOM 0 HA ALA A 11 25.208 0.234 3.306 1.00 0.00 H new ATOM 0 HB1 ALA A 11 24.111 0.116 1.071 1.00 0.00 H new ATOM 0 HB2 ALA A 11 25.404 -1.099 1.210 1.00 0.00 H new ATOM 0 HB3 ALA A 11 23.701 -1.591 1.365 1.00 0.00 H new ATOM 161 N PRO A 12 22.807 1.214 3.520 1.00 0.00 N ATOM 162 CA PRO A 12 21.510 1.732 3.926 1.00 0.00 C ATOM 163 C PRO A 12 20.427 1.298 2.936 1.00 0.00 C ATOM 164 O PRO A 12 20.689 1.120 1.741 1.00 0.00 O ATOM 165 CB PRO A 12 21.672 3.253 3.953 1.00 0.00 C ATOM 166 CG PRO A 12 22.736 3.505 2.885 1.00 0.00 C ATOM 167 CD PRO A 12 23.646 2.285 3.002 1.00 0.00 C ATOM 0 HA PRO A 12 21.199 1.352 4.899 1.00 0.00 H new ATOM 0 HB2 PRO A 12 20.737 3.763 3.719 1.00 0.00 H new ATOM 0 HB3 PRO A 12 21.992 3.607 4.933 1.00 0.00 H new ATOM 0 HG2 PRO A 12 22.297 3.585 1.891 1.00 0.00 H new ATOM 0 HG3 PRO A 12 23.280 4.432 3.069 1.00 0.00 H new ATOM 0 HD2 PRO A 12 24.068 2.018 2.033 1.00 0.00 H new ATOM 0 HD3 PRO A 12 24.483 2.484 3.671 1.00 0.00 H new ATOM 175 N ASP A 13 19.196 1.181 3.429 1.00 0.00 N ATOM 176 CA ASP A 13 17.996 0.901 2.639 1.00 0.00 C ATOM 177 C ASP A 13 17.647 2.098 1.745 1.00 0.00 C ATOM 178 O ASP A 13 18.061 3.225 2.039 1.00 0.00 O ATOM 179 CB ASP A 13 16.813 0.562 3.573 1.00 0.00 C ATOM 180 CG ASP A 13 16.340 -0.880 3.366 1.00 0.00 C ATOM 181 OD1 ASP A 13 17.187 -1.792 3.492 1.00 0.00 O ATOM 182 OD2 ASP A 13 15.149 -1.103 3.054 1.00 0.00 O ATOM 0 H ASP A 13 18.998 1.282 4.425 1.00 0.00 H new ATOM 0 HA ASP A 13 18.194 0.042 1.998 1.00 0.00 H new ATOM 0 HB2 ASP A 13 17.114 0.703 4.611 1.00 0.00 H new ATOM 0 HB3 ASP A 13 15.988 1.249 3.384 1.00 0.00 H new ATOM 187 N PRO A 14 16.860 1.884 0.678 1.00 0.00 N ATOM 188 CA PRO A 14 16.296 2.945 -0.146 1.00 0.00 C ATOM 189 C PRO A 14 15.166 3.687 0.593 1.00 0.00 C ATOM 190 O PRO A 14 14.955 3.512 1.799 1.00 0.00 O ATOM 191 CB PRO A 14 15.822 2.228 -1.422 1.00 0.00 C ATOM 192 CG PRO A 14 15.466 0.826 -0.938 1.00 0.00 C ATOM 193 CD PRO A 14 16.458 0.578 0.183 1.00 0.00 C ATOM 0 HA PRO A 14 17.016 3.729 -0.383 1.00 0.00 H new ATOM 0 HB2 PRO A 14 14.962 2.729 -1.867 1.00 0.00 H new ATOM 0 HB3 PRO A 14 16.604 2.203 -2.181 1.00 0.00 H new ATOM 0 HG2 PRO A 14 14.437 0.773 -0.583 1.00 0.00 H new ATOM 0 HG3 PRO A 14 15.567 0.088 -1.734 1.00 0.00 H new ATOM 0 HD2 PRO A 14 16.005 -0.015 0.977 1.00 0.00 H new ATOM 0 HD3 PRO A 14 17.320 0.019 -0.179 1.00 0.00 H new ATOM 201 N PHE A 15 14.423 4.502 -0.168 1.00 0.00 N ATOM 202 CA PHE A 15 13.252 5.273 0.220 1.00 0.00 C ATOM 203 C PHE A 15 13.658 6.492 1.052 1.00 0.00 C ATOM 204 O PHE A 15 14.843 6.680 1.344 1.00 0.00 O ATOM 205 CB PHE A 15 12.214 4.378 0.905 1.00 0.00 C ATOM 206 CG PHE A 15 11.946 3.037 0.228 1.00 0.00 C ATOM 207 CD1 PHE A 15 11.301 2.992 -1.020 1.00 0.00 C ATOM 208 CD2 PHE A 15 12.289 1.828 0.864 1.00 0.00 C ATOM 209 CE1 PHE A 15 10.929 1.763 -1.595 1.00 0.00 C ATOM 210 CE2 PHE A 15 11.943 0.596 0.279 1.00 0.00 C ATOM 211 CZ PHE A 15 11.264 0.563 -0.951 1.00 0.00 C ATOM 0 H PHE A 15 14.652 4.645 -1.152 1.00 0.00 H new ATOM 0 HA PHE A 15 12.767 5.665 -0.674 1.00 0.00 H new ATOM 0 HB2 PHE A 15 12.542 4.189 1.927 1.00 0.00 H new ATOM 0 HB3 PHE A 15 11.274 4.926 0.969 1.00 0.00 H new ATOM 0 HD1 PHE A 15 11.088 3.912 -1.544 1.00 0.00 H new ATOM 0 HD2 PHE A 15 12.820 1.847 1.804 1.00 0.00 H new ATOM 0 HE1 PHE A 15 10.387 1.744 -2.529 1.00 0.00 H new ATOM 0 HE2 PHE A 15 12.200 -0.327 0.777 1.00 0.00 H new ATOM 0 HZ PHE A 15 11.001 -0.384 -1.399 1.00 0.00 H new ATOM 221 N ASN A 16 12.719 7.399 1.341 1.00 0.00 N ATOM 222 CA ASN A 16 13.004 8.514 2.253 1.00 0.00 C ATOM 223 C ASN A 16 11.722 9.107 2.833 1.00 0.00 C ATOM 224 O ASN A 16 10.759 9.307 2.089 1.00 0.00 O ATOM 225 CB ASN A 16 13.738 9.633 1.487 1.00 0.00 C ATOM 226 CG ASN A 16 14.803 10.334 2.320 1.00 0.00 C ATOM 227 OD1 ASN A 16 15.500 9.720 3.117 1.00 0.00 O ATOM 228 ND2 ASN A 16 14.967 11.632 2.163 1.00 0.00 N ATOM 0 H ASN A 16 11.771 7.386 0.965 1.00 0.00 H new ATOM 0 HA ASN A 16 13.618 8.124 3.065 1.00 0.00 H new ATOM 0 HB2 ASN A 16 14.203 9.210 0.597 1.00 0.00 H new ATOM 0 HB3 ASN A 16 13.010 10.369 1.147 1.00 0.00 H new ATOM 0 HD21 ASN A 16 15.675 12.126 2.706 1.00 0.00 H new ATOM 0 HD22 ASN A 16 14.386 12.143 1.499 1.00 0.00 H new ATOM 235 N PRO A 17 11.716 9.553 4.100 1.00 0.00 N ATOM 236 CA PRO A 17 10.549 10.183 4.697 1.00 0.00 C ATOM 237 C PRO A 17 10.344 11.613 4.183 1.00 0.00 C ATOM 238 O PRO A 17 9.221 12.111 4.242 1.00 0.00 O ATOM 239 CB PRO A 17 10.805 10.148 6.203 1.00 0.00 C ATOM 240 CG PRO A 17 12.324 10.228 6.289 1.00 0.00 C ATOM 241 CD PRO A 17 12.766 9.401 5.091 1.00 0.00 C ATOM 0 HA PRO A 17 9.630 9.659 4.433 1.00 0.00 H new ATOM 0 HB2 PRO A 17 10.326 10.983 6.714 1.00 0.00 H new ATOM 0 HB3 PRO A 17 10.422 9.234 6.657 1.00 0.00 H new ATOM 0 HG2 PRO A 17 12.680 11.256 6.226 1.00 0.00 H new ATOM 0 HG3 PRO A 17 12.700 9.817 7.226 1.00 0.00 H new ATOM 0 HD2 PRO A 17 13.723 9.752 4.705 1.00 0.00 H new ATOM 0 HD3 PRO A 17 12.897 8.354 5.365 1.00 0.00 H new ATOM 249 N ALA A 18 11.370 12.255 3.608 1.00 0.00 N ATOM 250 CA ALA A 18 11.242 13.564 2.969 1.00 0.00 C ATOM 251 C ALA A 18 10.280 13.540 1.778 1.00 0.00 C ATOM 252 O ALA A 18 9.872 14.595 1.320 1.00 0.00 O ATOM 253 CB ALA A 18 12.617 14.069 2.520 1.00 0.00 C ATOM 0 H ALA A 18 12.316 11.875 3.575 1.00 0.00 H new ATOM 0 HA ALA A 18 10.824 14.244 3.711 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.509 15.044 2.046 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.273 14.157 3.386 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.049 13.365 1.808 1.00 0.00 H new ATOM 259 N ALA A 19 9.883 12.373 1.273 1.00 0.00 N ATOM 260 CA ALA A 19 8.861 12.274 0.247 1.00 0.00 C ATOM 261 C ALA A 19 7.443 12.442 0.806 1.00 0.00 C ATOM 262 O ALA A 19 6.533 12.822 0.070 1.00 0.00 O ATOM 263 CB ALA A 19 9.018 10.891 -0.365 1.00 0.00 C ATOM 0 H ALA A 19 10.264 11.474 1.567 1.00 0.00 H new ATOM 0 HA ALA A 19 8.989 13.073 -0.483 1.00 0.00 H new ATOM 0 HB1 ALA A 19 8.273 10.753 -1.149 1.00 0.00 H new ATOM 0 HB2 ALA A 19 10.016 10.793 -0.792 1.00 0.00 H new ATOM 0 HB3 ALA A 19 8.877 10.134 0.406 1.00 0.00 H new ATOM 269 N THR A 20 7.233 12.135 2.088 1.00 0.00 N ATOM 270 CA THR A 20 5.914 11.849 2.651 1.00 0.00 C ATOM 271 C THR A 20 4.975 13.052 2.574 1.00 0.00 C ATOM 272 O THR A 20 3.768 12.861 2.442 1.00 0.00 O ATOM 273 CB THR A 20 6.050 11.403 4.110 1.00 0.00 C ATOM 274 OG1 THR A 20 7.138 10.523 4.244 1.00 0.00 O ATOM 275 CG2 THR A 20 4.814 10.697 4.670 1.00 0.00 C ATOM 0 H THR A 20 7.986 12.078 2.773 1.00 0.00 H new ATOM 0 HA THR A 20 5.479 11.049 2.053 1.00 0.00 H new ATOM 0 HB THR A 20 6.192 12.323 4.677 1.00 0.00 H new ATOM 0 HG1 THR A 20 7.916 11.014 4.582 1.00 0.00 H new ATOM 0 HG21 THR A 20 4.995 10.415 5.707 1.00 0.00 H new ATOM 0 HG22 THR A 20 3.957 11.369 4.621 1.00 0.00 H new ATOM 0 HG23 THR A 20 4.608 9.803 4.081 1.00 0.00 H new ATOM 283 N GLN A 21 5.497 14.281 2.645 1.00 0.00 N ATOM 284 CA GLN A 21 4.653 15.471 2.682 1.00 0.00 C ATOM 285 C GLN A 21 3.821 15.633 1.402 1.00 0.00 C ATOM 286 O GLN A 21 2.798 16.312 1.416 1.00 0.00 O ATOM 287 CB GLN A 21 5.509 16.705 2.999 1.00 0.00 C ATOM 288 CG GLN A 21 6.200 17.394 1.812 1.00 0.00 C ATOM 289 CD GLN A 21 7.661 17.681 2.118 1.00 0.00 C ATOM 290 OE1 GLN A 21 7.991 18.533 2.942 1.00 0.00 O ATOM 291 NE2 GLN A 21 8.525 16.903 1.496 1.00 0.00 N ATOM 0 H GLN A 21 6.498 14.473 2.678 1.00 0.00 H new ATOM 0 HA GLN A 21 3.923 15.355 3.484 1.00 0.00 H new ATOM 0 HB2 GLN A 21 4.875 17.439 3.496 1.00 0.00 H new ATOM 0 HB3 GLN A 21 6.277 16.411 3.715 1.00 0.00 H new ATOM 0 HG2 GLN A 21 6.128 16.760 0.928 1.00 0.00 H new ATOM 0 HG3 GLN A 21 5.685 18.326 1.579 1.00 0.00 H new ATOM 0 HE21 GLN A 21 8.196 16.212 0.821 1.00 0.00 H new ATOM 0 HE22 GLN A 21 9.523 16.992 1.690 1.00 0.00 H new ATOM 300 N LEU A 22 4.261 15.009 0.305 1.00 0.00 N ATOM 301 CA LEU A 22 3.668 15.151 -1.017 1.00 0.00 C ATOM 302 C LEU A 22 2.472 14.216 -1.197 1.00 0.00 C ATOM 303 O LEU A 22 1.756 14.318 -2.189 1.00 0.00 O ATOM 304 CB LEU A 22 4.741 14.868 -2.086 1.00 0.00 C ATOM 305 CG LEU A 22 6.035 15.694 -1.915 1.00 0.00 C ATOM 306 CD1 LEU A 22 7.032 15.342 -3.014 1.00 0.00 C ATOM 307 CD2 LEU A 22 5.790 17.204 -1.933 1.00 0.00 C ATOM 0 H LEU A 22 5.061 14.376 0.318 1.00 0.00 H new ATOM 0 HA LEU A 22 3.301 16.171 -1.127 1.00 0.00 H new ATOM 0 HB2 LEU A 22 4.993 13.808 -2.060 1.00 0.00 H new ATOM 0 HB3 LEU A 22 4.320 15.072 -3.071 1.00 0.00 H new ATOM 0 HG LEU A 22 6.435 15.436 -0.934 1.00 0.00 H new ATOM 0 HD11 LEU A 22 7.940 15.930 -2.883 1.00 0.00 H new ATOM 0 HD12 LEU A 22 7.276 14.281 -2.958 1.00 0.00 H new ATOM 0 HD13 LEU A 22 6.594 15.563 -3.987 1.00 0.00 H new ATOM 0 HD21 LEU A 22 6.738 17.728 -1.808 1.00 0.00 H new ATOM 0 HD22 LEU A 22 5.340 17.488 -2.884 1.00 0.00 H new ATOM 0 HD23 LEU A 22 5.117 17.473 -1.119 1.00 0.00 H new ATOM 319 N LEU A 23 2.250 13.292 -0.256 1.00 0.00 N ATOM 320 CA LEU A 23 1.251 12.231 -0.377 1.00 0.00 C ATOM 321 C LEU A 23 -0.181 12.778 -0.324 1.00 0.00 C ATOM 322 O LEU A 23 -1.096 12.059 -0.717 1.00 0.00 O ATOM 323 CB LEU A 23 1.478 11.163 0.714 1.00 0.00 C ATOM 324 CG LEU A 23 2.574 10.106 0.436 1.00 0.00 C ATOM 325 CD1 LEU A 23 2.034 8.983 -0.446 1.00 0.00 C ATOM 326 CD2 LEU A 23 3.872 10.647 -0.177 1.00 0.00 C ATOM 0 H LEU A 23 2.768 13.262 0.622 1.00 0.00 H new ATOM 0 HA LEU A 23 1.374 11.767 -1.356 1.00 0.00 H new ATOM 0 HB2 LEU A 23 1.727 11.674 1.644 1.00 0.00 H new ATOM 0 HB3 LEU A 23 0.536 10.641 0.880 1.00 0.00 H new ATOM 0 HG LEU A 23 2.841 9.734 1.425 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.822 8.252 -0.628 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.197 8.497 0.055 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.697 9.397 -1.396 1.00 0.00 H new ATOM 0 HD21 LEU A 23 4.572 9.825 -0.331 1.00 0.00 H new ATOM 0 HD22 LEU A 23 3.653 11.121 -1.134 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.315 11.379 0.498 1.00 0.00 H new ATOM 338 N ASP A 24 -0.365 14.037 0.090 1.00 0.00 N ATOM 339 CA ASP A 24 -1.640 14.764 0.157 1.00 0.00 C ATOM 340 C ASP A 24 -2.322 14.901 -1.213 1.00 0.00 C ATOM 341 O ASP A 24 -3.470 15.339 -1.280 1.00 0.00 O ATOM 342 CB ASP A 24 -1.406 16.175 0.744 1.00 0.00 C ATOM 343 CG ASP A 24 -1.462 16.264 2.273 1.00 0.00 C ATOM 344 OD1 ASP A 24 -2.057 15.394 2.942 1.00 0.00 O ATOM 345 OD2 ASP A 24 -0.920 17.242 2.850 1.00 0.00 O ATOM 0 H ASP A 24 0.417 14.610 0.406 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.301 14.181 0.798 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.432 16.532 0.411 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -2.153 16.852 0.329 1.00 0.00 H new ATOM 350 N ASP A 25 -1.632 14.552 -2.298 1.00 0.00 N ATOM 351 CA ASP A 25 -1.972 14.866 -3.687 1.00 0.00 C ATOM 352 C ASP A 25 -1.963 13.608 -4.566 1.00 0.00 C ATOM 353 O ASP A 25 -1.979 13.694 -5.790 1.00 0.00 O ATOM 354 CB ASP A 25 -0.895 15.863 -4.146 1.00 0.00 C ATOM 355 CG ASP A 25 -1.063 16.442 -5.548 1.00 0.00 C ATOM 356 OD1 ASP A 25 -1.863 17.393 -5.700 1.00 0.00 O ATOM 357 OD2 ASP A 25 -0.298 16.052 -6.463 1.00 0.00 O ATOM 0 H ASP A 25 -0.770 14.011 -2.228 1.00 0.00 H new ATOM 0 HA ASP A 25 -2.977 15.279 -3.770 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -0.869 16.689 -3.436 1.00 0.00 H new ATOM 0 HB3 ASP A 25 0.074 15.367 -4.094 1.00 0.00 H new ATOM 362 N THR A 26 -1.865 12.420 -3.962 1.00 0.00 N ATOM 363 CA THR A 26 -1.472 11.202 -4.670 1.00 0.00 C ATOM 364 C THR A 26 -2.623 10.193 -4.731 1.00 0.00 C ATOM 365 O THR A 26 -3.752 10.513 -4.360 1.00 0.00 O ATOM 366 CB THR A 26 -0.163 10.664 -4.076 1.00 0.00 C ATOM 367 OG1 THR A 26 -0.290 10.296 -2.719 1.00 0.00 O ATOM 368 CG2 THR A 26 1.001 11.647 -4.202 1.00 0.00 C ATOM 0 H THR A 26 -2.056 12.278 -2.970 1.00 0.00 H new ATOM 0 HA THR A 26 -1.262 11.424 -5.716 1.00 0.00 H new ATOM 0 HB THR A 26 0.056 9.777 -4.671 1.00 0.00 H new ATOM 0 HG1 THR A 26 -0.599 11.067 -2.199 1.00 0.00 H new ATOM 0 HG21 THR A 26 1.897 11.208 -3.764 1.00 0.00 H new ATOM 0 HG22 THR A 26 1.181 11.865 -5.255 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.756 12.571 -3.678 1.00 0.00 H new ATOM 376 N SER A 27 -2.380 8.985 -5.256 1.00 0.00 N ATOM 377 CA SER A 27 -3.471 8.054 -5.518 1.00 0.00 C ATOM 378 C SER A 27 -3.017 6.618 -5.472 1.00 0.00 C ATOM 379 O SER A 27 -3.343 5.941 -4.512 1.00 0.00 O ATOM 380 CB SER A 27 -4.121 8.424 -6.853 1.00 0.00 C ATOM 381 OG SER A 27 -5.515 8.503 -6.820 1.00 0.00 O ATOM 0 H SER A 27 -1.453 8.639 -5.502 1.00 0.00 H new ATOM 0 HA SER A 27 -4.217 8.141 -4.728 1.00 0.00 H new ATOM 0 HB2 SER A 27 -3.724 9.384 -7.181 1.00 0.00 H new ATOM 0 HB3 SER A 27 -3.830 7.686 -7.601 1.00 0.00 H new ATOM 0 HG SER A 27 -5.850 8.745 -7.709 1.00 0.00 H new ATOM 387 N TRP A 28 -2.172 6.209 -6.415 1.00 0.00 N ATOM 388 CA TRP A 28 -1.584 4.879 -6.487 1.00 0.00 C ATOM 389 C TRP A 28 -2.605 3.765 -6.754 1.00 0.00 C ATOM 390 O TRP A 28 -3.817 3.966 -6.766 1.00 0.00 O ATOM 391 CB TRP A 28 -0.684 4.578 -5.263 1.00 0.00 C ATOM 392 CG TRP A 28 0.052 5.715 -4.609 1.00 0.00 C ATOM 393 CD1 TRP A 28 -0.485 6.543 -3.686 1.00 0.00 C ATOM 394 CD2 TRP A 28 1.457 6.101 -4.707 1.00 0.00 C ATOM 395 NE1 TRP A 28 0.450 7.478 -3.294 1.00 0.00 N ATOM 396 CE2 TRP A 28 1.678 7.237 -3.873 1.00 0.00 C ATOM 397 CE3 TRP A 28 2.579 5.578 -5.379 1.00 0.00 C ATOM 398 CZ2 TRP A 28 2.939 7.844 -3.749 1.00 0.00 C ATOM 399 CZ3 TRP A 28 3.841 6.196 -5.291 1.00 0.00 C ATOM 400 CH2 TRP A 28 4.031 7.318 -4.460 1.00 0.00 C ATOM 0 H TRP A 28 -1.869 6.818 -7.175 1.00 0.00 H new ATOM 0 HA TRP A 28 -0.940 4.888 -7.366 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -1.307 4.107 -4.503 1.00 0.00 H new ATOM 0 HB3 TRP A 28 0.056 3.839 -5.571 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -1.496 6.482 -3.311 1.00 0.00 H new ATOM 0 HE1 TRP A 28 0.257 8.250 -2.656 1.00 0.00 H new ATOM 0 HE3 TRP A 28 2.469 4.684 -5.975 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 3.068 8.707 -3.113 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 4.669 5.807 -5.865 1.00 0.00 H new ATOM 0 HH2 TRP A 28 5.008 7.770 -4.370 1.00 0.00 H new ATOM 411 N VAL A 29 -2.090 2.568 -7.005 1.00 0.00 N ATOM 412 CA VAL A 29 -2.840 1.328 -7.136 1.00 0.00 C ATOM 413 C VAL A 29 -1.984 0.300 -6.408 1.00 0.00 C ATOM 414 O VAL A 29 -0.756 0.326 -6.542 1.00 0.00 O ATOM 415 CB VAL A 29 -3.046 0.964 -8.623 1.00 0.00 C ATOM 416 CG1 VAL A 29 -3.966 -0.249 -8.806 1.00 0.00 C ATOM 417 CG2 VAL A 29 -3.627 2.119 -9.446 1.00 0.00 C ATOM 0 H VAL A 29 -1.087 2.430 -7.129 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.844 1.390 -6.716 1.00 0.00 H new ATOM 0 HB VAL A 29 -2.045 0.729 -8.985 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -4.078 -0.463 -9.869 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -3.531 -1.114 -8.305 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -4.943 -0.033 -8.374 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.749 1.802 -10.482 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -4.596 2.405 -9.038 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.950 2.972 -9.405 1.00 0.00 H new ATOM 427 N LEU A 30 -2.607 -0.546 -5.596 1.00 0.00 N ATOM 428 CA LEU A 30 -1.945 -1.672 -4.958 1.00 0.00 C ATOM 429 C LEU A 30 -1.720 -2.747 -6.014 1.00 0.00 C ATOM 430 O LEU A 30 -2.597 -2.970 -6.854 1.00 0.00 O ATOM 431 CB LEU A 30 -2.864 -2.219 -3.862 1.00 0.00 C ATOM 432 CG LEU A 30 -2.267 -3.429 -3.126 1.00 0.00 C ATOM 433 CD1 LEU A 30 -1.092 -3.028 -2.235 1.00 0.00 C ATOM 434 CD2 LEU A 30 -3.338 -4.066 -2.268 1.00 0.00 C ATOM 0 H LEU A 30 -3.596 -0.467 -5.361 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.993 -1.370 -4.522 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -3.071 -1.428 -3.141 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.818 -2.505 -4.305 1.00 0.00 H new ATOM 0 HG LEU A 30 -1.901 -4.131 -3.876 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.698 -3.912 -1.732 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -0.309 -2.579 -2.846 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.430 -2.307 -1.490 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -2.920 -4.925 -1.743 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -3.703 -3.339 -1.542 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -4.164 -4.393 -2.900 1.00 0.00 H new ATOM 446 N SER A 31 -0.594 -3.461 -5.956 1.00 0.00 N ATOM 447 CA SER A 31 -0.391 -4.566 -6.880 1.00 0.00 C ATOM 448 C SER A 31 0.301 -5.787 -6.285 1.00 0.00 C ATOM 449 O SER A 31 0.039 -6.880 -6.792 1.00 0.00 O ATOM 450 CB SER A 31 0.286 -4.025 -8.146 1.00 0.00 C ATOM 451 OG SER A 31 -0.414 -4.395 -9.318 1.00 0.00 O ATOM 0 H SER A 31 0.168 -3.297 -5.298 1.00 0.00 H new ATOM 0 HA SER A 31 -1.370 -4.969 -7.140 1.00 0.00 H new ATOM 0 HB2 SER A 31 0.348 -2.938 -8.088 1.00 0.00 H new ATOM 0 HB3 SER A 31 1.308 -4.400 -8.200 1.00 0.00 H new ATOM 0 HG SER A 31 0.046 -4.031 -10.103 1.00 0.00 H new ATOM 457 N ALA A 32 1.046 -5.677 -5.178 1.00 0.00 N ATOM 458 CA ALA A 32 1.493 -6.860 -4.444 1.00 0.00 C ATOM 459 C ALA A 32 1.469 -6.622 -2.938 1.00 0.00 C ATOM 460 O ALA A 32 1.347 -5.492 -2.462 1.00 0.00 O ATOM 461 CB ALA A 32 2.883 -7.313 -4.900 1.00 0.00 C ATOM 0 H ALA A 32 1.348 -4.789 -4.777 1.00 0.00 H new ATOM 0 HA ALA A 32 0.790 -7.662 -4.669 1.00 0.00 H new ATOM 0 HB1 ALA A 32 3.183 -8.194 -4.333 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.856 -7.557 -5.962 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.601 -6.511 -4.730 1.00 0.00 H new ATOM 467 N TRP A 33 1.595 -7.716 -2.194 1.00 0.00 N ATOM 468 CA TRP A 33 1.527 -7.802 -0.750 1.00 0.00 C ATOM 469 C TRP A 33 2.406 -8.974 -0.318 1.00 0.00 C ATOM 470 O TRP A 33 2.009 -10.135 -0.458 1.00 0.00 O ATOM 471 CB TRP A 33 0.060 -7.991 -0.332 1.00 0.00 C ATOM 472 CG TRP A 33 -0.251 -7.949 1.126 1.00 0.00 C ATOM 473 CD1 TRP A 33 0.636 -7.863 2.139 1.00 0.00 C ATOM 474 CD2 TRP A 33 -1.566 -7.900 1.750 1.00 0.00 C ATOM 475 NE1 TRP A 33 -0.045 -7.724 3.323 1.00 0.00 N ATOM 476 CE2 TRP A 33 -1.407 -7.753 3.156 1.00 0.00 C ATOM 477 CE3 TRP A 33 -2.880 -7.907 1.256 1.00 0.00 C ATOM 478 CZ2 TRP A 33 -2.492 -7.621 4.039 1.00 0.00 C ATOM 479 CZ3 TRP A 33 -3.973 -7.776 2.133 1.00 0.00 C ATOM 480 CH2 TRP A 33 -3.788 -7.619 3.512 1.00 0.00 C ATOM 0 H TRP A 33 1.759 -8.628 -2.621 1.00 0.00 H new ATOM 0 HA TRP A 33 1.890 -6.895 -0.267 1.00 0.00 H new ATOM 0 HB2 TRP A 33 -0.532 -7.220 -0.825 1.00 0.00 H new ATOM 0 HB3 TRP A 33 -0.280 -8.951 -0.721 1.00 0.00 H new ATOM 0 HD1 TRP A 33 1.710 -7.898 2.035 1.00 0.00 H new ATOM 0 HE1 TRP A 33 0.412 -7.611 4.228 1.00 0.00 H new ATOM 0 HE3 TRP A 33 -3.053 -8.014 0.195 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 -2.329 -7.523 5.102 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 -4.976 -7.797 1.734 1.00 0.00 H new ATOM 0 HH2 TRP A 33 -4.640 -7.497 4.164 1.00 0.00 H new ATOM 491 N LYS A 34 3.615 -8.703 0.167 1.00 0.00 N ATOM 492 CA LYS A 34 4.470 -9.700 0.790 1.00 0.00 C ATOM 493 C LYS A 34 4.150 -9.758 2.280 1.00 0.00 C ATOM 494 O LYS A 34 3.866 -8.725 2.888 1.00 0.00 O ATOM 495 CB LYS A 34 5.946 -9.326 0.572 1.00 0.00 C ATOM 496 CG LYS A 34 6.794 -10.586 0.394 1.00 0.00 C ATOM 497 CD LYS A 34 6.969 -10.959 -1.087 1.00 0.00 C ATOM 498 CE LYS A 34 8.295 -10.383 -1.597 1.00 0.00 C ATOM 499 NZ LYS A 34 8.726 -10.973 -2.880 1.00 0.00 N ATOM 0 H LYS A 34 4.030 -7.772 0.136 1.00 0.00 H new ATOM 0 HA LYS A 34 4.293 -10.678 0.343 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.040 -8.689 -0.308 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.312 -8.751 1.423 1.00 0.00 H new ATOM 0 HG2 LYS A 34 7.773 -10.431 0.847 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.326 -11.416 0.924 1.00 0.00 H new ATOM 0 HD2 LYS A 34 6.960 -12.043 -1.205 1.00 0.00 H new ATOM 0 HD3 LYS A 34 6.138 -10.567 -1.674 1.00 0.00 H new ATOM 0 HE2 LYS A 34 8.194 -9.304 -1.715 1.00 0.00 H new ATOM 0 HE3 LYS A 34 9.069 -10.551 -0.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 9.627 -10.545 -3.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.851 -11.999 -2.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 8.004 -10.791 -3.606 1.00 0.00 H new ATOM 513 N GLN A 35 4.223 -10.938 2.884 1.00 0.00 N ATOM 514 CA GLN A 35 4.314 -11.094 4.326 1.00 0.00 C ATOM 515 C GLN A 35 5.779 -11.065 4.751 1.00 0.00 C ATOM 516 O GLN A 35 6.672 -11.132 3.905 1.00 0.00 O ATOM 517 CB GLN A 35 3.667 -12.391 4.789 1.00 0.00 C ATOM 518 CG GLN A 35 2.242 -12.616 4.268 1.00 0.00 C ATOM 519 CD GLN A 35 1.597 -13.881 4.838 1.00 0.00 C ATOM 520 OE1 GLN A 35 0.468 -14.206 4.497 1.00 0.00 O ATOM 521 NE2 GLN A 35 2.271 -14.622 5.702 1.00 0.00 N ATOM 0 H GLN A 35 4.220 -11.823 2.377 1.00 0.00 H new ATOM 0 HA GLN A 35 3.777 -10.268 4.792 1.00 0.00 H new ATOM 0 HB2 GLN A 35 4.292 -13.226 4.472 1.00 0.00 H new ATOM 0 HB3 GLN A 35 3.647 -12.403 5.879 1.00 0.00 H new ATOM 0 HG2 GLN A 35 1.626 -11.753 4.522 1.00 0.00 H new ATOM 0 HG3 GLN A 35 2.264 -12.683 3.180 1.00 0.00 H new ATOM 0 HE21 GLN A 35 3.212 -14.348 5.984 1.00 0.00 H new ATOM 0 HE22 GLN A 35 1.850 -15.468 6.086 1.00 0.00 H new ATOM 530 N ALA A 36 6.009 -11.038 6.064 1.00 0.00 N ATOM 531 CA ALA A 36 7.336 -10.953 6.664 1.00 0.00 C ATOM 532 C ALA A 36 8.235 -12.120 6.278 1.00 0.00 C ATOM 533 O ALA A 36 9.434 -11.932 6.084 1.00 0.00 O ATOM 534 CB ALA A 36 7.189 -10.890 8.182 1.00 0.00 C ATOM 0 H ALA A 36 5.259 -11.076 6.754 1.00 0.00 H new ATOM 0 HA ALA A 36 7.815 -10.051 6.284 1.00 0.00 H new ATOM 0 HB1 ALA A 36 8.176 -10.826 8.641 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.605 -10.011 8.455 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.682 -11.787 8.536 1.00 0.00 H new ATOM 540 N ASP A 37 7.651 -13.310 6.116 1.00 0.00 N ATOM 541 CA ASP A 37 8.426 -14.509 5.770 1.00 0.00 C ATOM 542 C ASP A 37 8.684 -14.574 4.262 1.00 0.00 C ATOM 543 O ASP A 37 9.216 -15.559 3.751 1.00 0.00 O ATOM 544 CB ASP A 37 7.781 -15.798 6.315 1.00 0.00 C ATOM 545 CG ASP A 37 8.775 -16.557 7.195 1.00 0.00 C ATOM 546 OD1 ASP A 37 9.037 -16.053 8.310 1.00 0.00 O ATOM 547 OD2 ASP A 37 9.225 -17.669 6.822 1.00 0.00 O ATOM 0 H ASP A 37 6.649 -13.471 6.218 1.00 0.00 H new ATOM 0 HA ASP A 37 9.395 -14.431 6.263 1.00 0.00 H new ATOM 0 HB2 ASP A 37 6.889 -15.551 6.891 1.00 0.00 H new ATOM 0 HB3 ASP A 37 7.461 -16.431 5.487 1.00 0.00 H new ATOM 552 N GLY A 38 8.294 -13.534 3.522 1.00 0.00 N ATOM 553 CA GLY A 38 8.475 -13.413 2.090 1.00 0.00 C ATOM 554 C GLY A 38 7.269 -13.953 1.328 1.00 0.00 C ATOM 555 O GLY A 38 7.344 -14.164 0.121 1.00 0.00 O ATOM 0 H GLY A 38 7.825 -12.725 3.929 1.00 0.00 H new ATOM 0 HA2 GLY A 38 8.633 -12.367 1.829 1.00 0.00 H new ATOM 0 HA3 GLY A 38 9.371 -13.956 1.788 1.00 0.00 H new ATOM 559 N THR A 39 6.154 -14.228 2.001 1.00 0.00 N ATOM 560 CA THR A 39 4.977 -14.854 1.425 1.00 0.00 C ATOM 561 C THR A 39 4.260 -13.824 0.556 1.00 0.00 C ATOM 562 O THR A 39 3.568 -12.960 1.090 1.00 0.00 O ATOM 563 CB THR A 39 4.105 -15.358 2.582 1.00 0.00 C ATOM 564 OG1 THR A 39 4.900 -15.981 3.575 1.00 0.00 O ATOM 565 CG2 THR A 39 3.012 -16.309 2.131 1.00 0.00 C ATOM 0 H THR A 39 6.046 -14.013 2.992 1.00 0.00 H new ATOM 0 HA THR A 39 5.226 -15.704 0.789 1.00 0.00 H new ATOM 0 HB THR A 39 3.617 -14.478 3.000 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.326 -16.294 4.305 1.00 0.00 H new ATOM 0 HG21 THR A 39 2.430 -16.630 2.995 1.00 0.00 H new ATOM 0 HG22 THR A 39 2.358 -15.802 1.421 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.461 -17.179 1.653 1.00 0.00 H new ATOM 573 N ALA A 40 4.443 -13.845 -0.764 1.00 0.00 N ATOM 574 CA ALA A 40 3.602 -13.047 -1.642 1.00 0.00 C ATOM 575 C ALA A 40 2.172 -13.589 -1.585 1.00 0.00 C ATOM 576 O ALA A 40 1.851 -14.659 -2.119 1.00 0.00 O ATOM 577 CB ALA A 40 4.169 -12.992 -3.051 1.00 0.00 C ATOM 0 H ALA A 40 5.156 -14.398 -1.239 1.00 0.00 H new ATOM 0 HA ALA A 40 3.582 -12.012 -1.300 1.00 0.00 H new ATOM 0 HB1 ALA A 40 3.517 -12.388 -3.682 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.164 -12.547 -3.026 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.233 -14.002 -3.457 1.00 0.00 H new ATOM 583 N ARG A 41 1.318 -12.857 -0.873 1.00 0.00 N ATOM 584 CA ARG A 41 -0.108 -13.120 -0.762 1.00 0.00 C ATOM 585 C ARG A 41 -0.756 -13.081 -2.138 1.00 0.00 C ATOM 586 O ARG A 41 -0.237 -12.446 -3.059 1.00 0.00 O ATOM 587 CB ARG A 41 -0.744 -12.086 0.185 1.00 0.00 C ATOM 588 CG ARG A 41 -0.507 -12.460 1.654 1.00 0.00 C ATOM 589 CD ARG A 41 -0.680 -11.250 2.588 1.00 0.00 C ATOM 590 NE ARG A 41 -1.205 -11.680 3.894 1.00 0.00 N ATOM 591 CZ ARG A 41 -1.183 -11.076 5.086 1.00 0.00 C ATOM 592 NH1 ARG A 41 -0.549 -9.925 5.275 1.00 0.00 N ATOM 593 NH2 ARG A 41 -1.807 -11.650 6.101 1.00 0.00 N ATOM 0 H ARG A 41 1.613 -12.038 -0.341 1.00 0.00 H new ATOM 0 HA ARG A 41 -0.268 -14.115 -0.348 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -0.324 -11.100 -0.014 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -1.815 -12.022 -0.009 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -1.203 -13.246 1.945 1.00 0.00 H new ATOM 0 HG3 ARG A 41 0.498 -12.866 1.768 1.00 0.00 H new ATOM 0 HD2 ARG A 41 0.277 -10.746 2.722 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -1.360 -10.528 2.136 1.00 0.00 H new ATOM 0 HE ARG A 41 -1.662 -12.592 3.888 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -0.061 -9.478 4.499 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -0.550 -9.488 6.196 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -2.293 -12.537 5.966 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -1.803 -11.206 7.019 1.00 0.00 H new ATOM 607 N ALA A 42 -1.901 -13.729 -2.274 1.00 0.00 N ATOM 608 CA ALA A 42 -2.738 -13.571 -3.453 1.00 0.00 C ATOM 609 C ALA A 42 -3.449 -12.224 -3.348 1.00 0.00 C ATOM 610 O ALA A 42 -4.131 -11.984 -2.350 1.00 0.00 O ATOM 611 CB ALA A 42 -3.745 -14.719 -3.534 1.00 0.00 C ATOM 0 H ALA A 42 -2.275 -14.374 -1.578 1.00 0.00 H new ATOM 0 HA ALA A 42 -2.135 -13.596 -4.361 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -4.369 -14.594 -4.419 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -3.211 -15.667 -3.597 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -4.374 -14.715 -2.644 1.00 0.00 H new ATOM 617 N VAL A 43 -3.310 -11.352 -4.349 1.00 0.00 N ATOM 618 CA VAL A 43 -4.044 -10.094 -4.416 1.00 0.00 C ATOM 619 C VAL A 43 -4.674 -9.943 -5.812 1.00 0.00 C ATOM 620 O VAL A 43 -4.144 -10.494 -6.783 1.00 0.00 O ATOM 621 CB VAL A 43 -3.139 -8.908 -4.031 1.00 0.00 C ATOM 622 CG1 VAL A 43 -2.631 -9.042 -2.586 1.00 0.00 C ATOM 623 CG2 VAL A 43 -1.913 -8.727 -4.935 1.00 0.00 C ATOM 0 H VAL A 43 -2.681 -11.503 -5.138 1.00 0.00 H new ATOM 0 HA VAL A 43 -4.855 -10.100 -3.688 1.00 0.00 H new ATOM 0 HB VAL A 43 -3.780 -8.034 -4.150 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.995 -8.191 -2.343 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.480 -9.067 -1.903 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.057 -9.963 -2.486 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.332 -7.871 -4.593 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -1.295 -9.624 -4.894 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.239 -8.557 -5.961 1.00 0.00 H new ATOM 633 N PRO A 44 -5.819 -9.255 -5.948 1.00 0.00 N ATOM 634 CA PRO A 44 -6.526 -9.136 -7.216 1.00 0.00 C ATOM 635 C PRO A 44 -5.818 -8.115 -8.125 1.00 0.00 C ATOM 636 O PRO A 44 -5.888 -6.908 -7.901 1.00 0.00 O ATOM 637 CB PRO A 44 -7.957 -8.738 -6.841 1.00 0.00 C ATOM 638 CG PRO A 44 -7.729 -7.893 -5.592 1.00 0.00 C ATOM 639 CD PRO A 44 -6.572 -8.608 -4.888 1.00 0.00 C ATOM 0 HA PRO A 44 -6.538 -10.061 -7.793 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -8.445 -8.172 -7.634 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -8.583 -9.607 -6.638 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -7.472 -6.864 -5.844 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -8.619 -7.855 -4.964 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -5.950 -7.902 -4.338 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -6.941 -9.337 -4.166 1.00 0.00 H new ATOM 647 N SER A 45 -5.095 -8.606 -9.133 1.00 0.00 N ATOM 648 CA SER A 45 -4.468 -7.808 -10.178 1.00 0.00 C ATOM 649 C SER A 45 -5.571 -7.201 -11.058 1.00 0.00 C ATOM 650 O SER A 45 -6.722 -7.642 -11.011 1.00 0.00 O ATOM 651 CB SER A 45 -3.632 -8.787 -11.002 1.00 0.00 C ATOM 652 OG SER A 45 -2.297 -8.888 -10.541 1.00 0.00 O ATOM 0 H SER A 45 -4.926 -9.606 -9.244 1.00 0.00 H new ATOM 0 HA SER A 45 -3.856 -7.001 -9.776 1.00 0.00 H new ATOM 0 HB2 SER A 45 -4.098 -9.772 -10.971 1.00 0.00 H new ATOM 0 HB3 SER A 45 -3.629 -8.468 -12.044 1.00 0.00 H new ATOM 0 HG SER A 45 -1.806 -9.526 -11.099 1.00 0.00 H new ATOM 658 N ALA A 46 -5.213 -6.262 -11.937 1.00 0.00 N ATOM 659 CA ALA A 46 -6.166 -5.649 -12.854 1.00 0.00 C ATOM 660 C ALA A 46 -6.919 -6.698 -13.666 1.00 0.00 C ATOM 661 O ALA A 46 -8.145 -6.651 -13.757 1.00 0.00 O ATOM 662 CB ALA A 46 -5.462 -4.645 -13.769 1.00 0.00 C ATOM 0 H ALA A 46 -4.260 -5.910 -12.030 1.00 0.00 H new ATOM 0 HA ALA A 46 -6.904 -5.112 -12.258 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -6.189 -4.198 -14.446 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -5.000 -3.864 -13.165 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -4.694 -5.157 -14.348 1.00 0.00 H new ATOM 668 N ASP A 47 -6.192 -7.673 -14.215 1.00 0.00 N ATOM 669 CA ASP A 47 -6.778 -8.680 -15.098 1.00 0.00 C ATOM 670 C ASP A 47 -7.694 -9.667 -14.358 1.00 0.00 C ATOM 671 O ASP A 47 -8.432 -10.413 -14.996 1.00 0.00 O ATOM 672 CB ASP A 47 -5.674 -9.407 -15.884 1.00 0.00 C ATOM 673 CG ASP A 47 -6.054 -9.503 -17.357 1.00 0.00 C ATOM 674 OD1 ASP A 47 -6.995 -10.245 -17.712 1.00 0.00 O ATOM 675 OD2 ASP A 47 -5.467 -8.772 -18.182 1.00 0.00 O ATOM 0 H ASP A 47 -5.190 -7.786 -14.061 1.00 0.00 H new ATOM 0 HA ASP A 47 -7.421 -8.156 -15.805 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -4.730 -8.873 -15.778 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -5.523 -10.406 -15.474 1.00 0.00 H new ATOM 680 N GLN A 48 -7.699 -9.656 -13.018 1.00 0.00 N ATOM 681 CA GLN A 48 -8.631 -10.435 -12.199 1.00 0.00 C ATOM 682 C GLN A 48 -10.029 -9.813 -12.166 1.00 0.00 C ATOM 683 O GLN A 48 -10.965 -10.422 -11.641 1.00 0.00 O ATOM 684 CB GLN A 48 -8.146 -10.506 -10.751 1.00 0.00 C ATOM 685 CG GLN A 48 -6.793 -11.209 -10.597 1.00 0.00 C ATOM 686 CD GLN A 48 -6.902 -12.722 -10.551 1.00 0.00 C ATOM 687 OE1 GLN A 48 -7.331 -13.293 -9.556 1.00 0.00 O ATOM 688 NE2 GLN A 48 -6.450 -13.408 -11.583 1.00 0.00 N ATOM 0 H GLN A 48 -7.046 -9.098 -12.468 1.00 0.00 H new ATOM 0 HA GLN A 48 -8.675 -11.425 -12.654 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.070 -9.495 -10.351 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -8.890 -11.030 -10.152 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -6.147 -10.924 -11.427 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.312 -10.859 -9.684 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -6.096 -12.919 -12.405 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -6.455 -14.428 -11.559 1.00 0.00 H new ATOM 697 N GLY A 49 -10.160 -8.578 -12.642 1.00 0.00 N ATOM 698 CA GLY A 49 -11.422 -7.893 -12.793 1.00 0.00 C ATOM 699 C GLY A 49 -11.483 -6.595 -12.006 1.00 0.00 C ATOM 700 O GLY A 49 -12.124 -5.644 -12.446 1.00 0.00 O ATOM 0 H GLY A 49 -9.362 -8.017 -12.940 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -11.592 -7.681 -13.849 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -12.228 -8.549 -12.466 1.00 0.00 H new ATOM 704 N ALA A 50 -10.816 -6.553 -10.855 1.00 0.00 N ATOM 705 CA ALA A 50 -10.883 -5.492 -9.870 1.00 0.00 C ATOM 706 C ALA A 50 -9.476 -5.232 -9.308 1.00 0.00 C ATOM 707 O ALA A 50 -9.117 -5.839 -8.301 1.00 0.00 O ATOM 708 CB ALA A 50 -11.882 -5.895 -8.782 1.00 0.00 C ATOM 0 H ALA A 50 -10.182 -7.302 -10.576 1.00 0.00 H new ATOM 0 HA ALA A 50 -11.231 -4.561 -10.317 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -11.943 -5.105 -8.033 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -12.864 -6.048 -9.229 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -11.551 -6.819 -8.308 1.00 0.00 H new ATOM 714 N PRO A 51 -8.646 -4.391 -9.951 1.00 0.00 N ATOM 715 CA PRO A 51 -7.411 -3.917 -9.341 1.00 0.00 C ATOM 716 C PRO A 51 -7.762 -3.057 -8.134 1.00 0.00 C ATOM 717 O PRO A 51 -8.650 -2.197 -8.226 1.00 0.00 O ATOM 718 CB PRO A 51 -6.703 -3.072 -10.397 1.00 0.00 C ATOM 719 CG PRO A 51 -7.821 -2.638 -11.354 1.00 0.00 C ATOM 720 CD PRO A 51 -8.920 -3.692 -11.196 1.00 0.00 C ATOM 0 HA PRO A 51 -6.774 -4.738 -9.012 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -6.207 -2.211 -9.949 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -5.936 -3.647 -10.917 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -8.190 -1.644 -11.102 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -7.463 -2.594 -12.383 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -9.905 -3.225 -11.170 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -8.918 -4.384 -12.038 1.00 0.00 H new ATOM 728 N ILE A 52 -7.113 -3.278 -6.995 1.00 0.00 N ATOM 729 CA ILE A 52 -7.295 -2.416 -5.828 1.00 0.00 C ATOM 730 C ILE A 52 -6.666 -1.045 -6.092 1.00 0.00 C ATOM 731 O ILE A 52 -5.452 -0.873 -5.993 1.00 0.00 O ATOM 732 CB ILE A 52 -6.851 -3.126 -4.533 1.00 0.00 C ATOM 733 CG1 ILE A 52 -7.794 -4.329 -4.352 1.00 0.00 C ATOM 734 CG2 ILE A 52 -6.947 -2.210 -3.300 1.00 0.00 C ATOM 735 CD1 ILE A 52 -7.510 -5.205 -3.143 1.00 0.00 C ATOM 0 H ILE A 52 -6.456 -4.046 -6.853 1.00 0.00 H new ATOM 0 HA ILE A 52 -8.353 -2.217 -5.660 1.00 0.00 H new ATOM 0 HB ILE A 52 -5.806 -3.423 -4.619 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -8.817 -3.959 -4.279 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -7.742 -4.948 -5.248 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.623 -2.757 -2.414 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.307 -1.339 -3.443 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -7.979 -1.884 -3.168 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -8.230 -6.022 -3.109 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -6.502 -5.613 -3.218 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -7.594 -4.609 -2.234 1.00 0.00 H new ATOM 747 N THR A 53 -7.496 -0.070 -6.469 1.00 0.00 N ATOM 748 CA THR A 53 -7.083 1.318 -6.580 1.00 0.00 C ATOM 749 C THR A 53 -6.977 1.907 -5.172 1.00 0.00 C ATOM 750 O THR A 53 -7.695 1.482 -4.259 1.00 0.00 O ATOM 751 CB THR A 53 -8.110 2.099 -7.422 1.00 0.00 C ATOM 752 OG1 THR A 53 -9.429 2.008 -6.916 1.00 0.00 O ATOM 753 CG2 THR A 53 -8.190 1.575 -8.854 1.00 0.00 C ATOM 0 H THR A 53 -8.476 -0.228 -6.705 1.00 0.00 H new ATOM 0 HA THR A 53 -6.114 1.388 -7.075 1.00 0.00 H new ATOM 0 HB THR A 53 -7.753 3.128 -7.384 1.00 0.00 H new ATOM 0 HG1 THR A 53 -10.035 2.523 -7.488 1.00 0.00 H new ATOM 0 HG21 THR A 53 -8.926 2.154 -9.413 1.00 0.00 H new ATOM 0 HG22 THR A 53 -7.215 1.671 -9.331 1.00 0.00 H new ATOM 0 HG23 THR A 53 -8.487 0.526 -8.842 1.00 0.00 H new ATOM 761 N LEU A 54 -6.137 2.931 -5.021 1.00 0.00 N ATOM 762 CA LEU A 54 -5.993 3.739 -3.818 1.00 0.00 C ATOM 763 C LEU A 54 -6.220 5.185 -4.297 1.00 0.00 C ATOM 764 O LEU A 54 -6.055 5.476 -5.485 1.00 0.00 O ATOM 765 CB LEU A 54 -4.574 3.416 -3.296 1.00 0.00 C ATOM 766 CG LEU A 54 -4.058 3.843 -1.907 1.00 0.00 C ATOM 767 CD1 LEU A 54 -3.742 5.244 -1.489 1.00 0.00 C ATOM 768 CD2 LEU A 54 -4.959 3.306 -0.793 1.00 0.00 C ATOM 0 H LEU A 54 -5.512 3.230 -5.770 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.684 3.559 -2.995 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.470 2.332 -3.341 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.878 3.834 -4.023 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.067 3.413 -2.056 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.398 5.246 -0.455 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -2.961 5.648 -2.132 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.637 5.860 -1.575 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -4.570 3.623 0.174 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -5.969 3.695 -0.923 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.981 2.217 -0.836 1.00 0.00 H new ATOM 780 N THR A 55 -6.647 6.098 -3.433 1.00 0.00 N ATOM 781 CA THR A 55 -6.680 7.533 -3.694 1.00 0.00 C ATOM 782 C THR A 55 -6.286 8.231 -2.395 1.00 0.00 C ATOM 783 O THR A 55 -6.783 7.841 -1.337 1.00 0.00 O ATOM 784 CB THR A 55 -8.044 8.036 -4.198 1.00 0.00 C ATOM 785 OG1 THR A 55 -8.574 7.265 -5.259 1.00 0.00 O ATOM 786 CG2 THR A 55 -7.914 9.476 -4.728 1.00 0.00 C ATOM 0 H THR A 55 -6.990 5.854 -2.504 1.00 0.00 H new ATOM 0 HA THR A 55 -5.984 7.762 -4.501 1.00 0.00 H new ATOM 0 HB THR A 55 -8.712 7.965 -3.339 1.00 0.00 H new ATOM 0 HG1 THR A 55 -9.440 7.635 -5.531 1.00 0.00 H new ATOM 0 HG21 THR A 55 -8.885 9.822 -5.082 1.00 0.00 H new ATOM 0 HG22 THR A 55 -7.566 10.128 -3.927 1.00 0.00 H new ATOM 0 HG23 THR A 55 -7.199 9.498 -5.550 1.00 0.00 H new ATOM 794 N LEU A 56 -5.446 9.268 -2.464 1.00 0.00 N ATOM 795 CA LEU A 56 -5.056 10.116 -1.337 1.00 0.00 C ATOM 796 C LEU A 56 -5.267 11.571 -1.748 1.00 0.00 C ATOM 797 O LEU A 56 -4.319 12.354 -1.750 1.00 0.00 O ATOM 798 CB LEU A 56 -3.587 9.868 -0.930 1.00 0.00 C ATOM 799 CG LEU A 56 -3.278 8.441 -0.481 1.00 0.00 C ATOM 800 CD1 LEU A 56 -1.775 8.270 -0.256 1.00 0.00 C ATOM 801 CD2 LEU A 56 -4.038 8.044 0.792 1.00 0.00 C ATOM 0 H LEU A 56 -5.004 9.549 -3.339 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.668 9.877 -0.467 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -2.944 10.115 -1.775 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.328 10.552 -0.122 1.00 0.00 H new ATOM 0 HG LEU A 56 -3.612 7.780 -1.281 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.569 7.249 0.064 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -1.243 8.474 -1.185 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -1.441 8.966 0.514 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -3.781 7.021 1.065 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.763 8.717 1.605 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.111 8.112 0.612 1.00 0.00 H new ATOM 813 N SER A 57 -6.506 11.934 -2.074 1.00 0.00 N ATOM 814 CA SER A 57 -6.866 13.221 -2.658 1.00 0.00 C ATOM 815 C SER A 57 -8.110 13.754 -1.921 1.00 0.00 C ATOM 816 O SER A 57 -8.727 13.055 -1.116 1.00 0.00 O ATOM 817 CB SER A 57 -7.105 12.989 -4.158 1.00 0.00 C ATOM 818 OG SER A 57 -7.201 14.191 -4.888 1.00 0.00 O ATOM 0 H SER A 57 -7.310 11.321 -1.934 1.00 0.00 H new ATOM 0 HA SER A 57 -6.084 13.972 -2.551 1.00 0.00 H new ATOM 0 HB2 SER A 57 -6.291 12.388 -4.562 1.00 0.00 H new ATOM 0 HB3 SER A 57 -8.022 12.414 -4.291 1.00 0.00 H new ATOM 0 HG SER A 57 -7.351 13.988 -5.835 1.00 0.00 H new ATOM 824 N THR A 58 -8.519 14.987 -2.187 1.00 0.00 N ATOM 825 CA THR A 58 -9.397 15.768 -1.325 1.00 0.00 C ATOM 826 C THR A 58 -10.860 15.650 -1.763 1.00 0.00 C ATOM 827 O THR A 58 -11.561 16.651 -1.825 1.00 0.00 O ATOM 828 CB THR A 58 -8.907 17.222 -1.336 1.00 0.00 C ATOM 829 OG1 THR A 58 -8.830 17.669 -2.675 1.00 0.00 O ATOM 830 CG2 THR A 58 -7.550 17.374 -0.649 1.00 0.00 C ATOM 0 H THR A 58 -8.242 15.486 -3.032 1.00 0.00 H new ATOM 0 HA THR A 58 -9.359 15.383 -0.306 1.00 0.00 H new ATOM 0 HB THR A 58 -9.618 17.829 -0.776 1.00 0.00 H new ATOM 0 HG1 THR A 58 -8.519 18.598 -2.692 1.00 0.00 H new ATOM 0 HG21 THR A 58 -7.242 18.419 -0.680 1.00 0.00 H new ATOM 0 HG22 THR A 58 -7.629 17.050 0.389 1.00 0.00 H new ATOM 0 HG23 THR A 58 -6.810 16.762 -1.165 1.00 0.00 H new ATOM 838 N SER A 59 -11.352 14.454 -2.087 1.00 0.00 N ATOM 839 CA SER A 59 -12.715 14.263 -2.589 1.00 0.00 C ATOM 840 C SER A 59 -13.833 14.751 -1.637 1.00 0.00 C ATOM 841 O SER A 59 -14.972 14.903 -2.095 1.00 0.00 O ATOM 842 CB SER A 59 -12.895 12.790 -2.968 1.00 0.00 C ATOM 843 OG SER A 59 -13.091 12.653 -4.365 1.00 0.00 O ATOM 0 H SER A 59 -10.817 13.589 -2.009 1.00 0.00 H new ATOM 0 HA SER A 59 -12.827 14.900 -3.466 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.018 12.220 -2.661 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.749 12.373 -2.433 1.00 0.00 H new ATOM 0 HG SER A 59 -13.202 11.705 -4.588 1.00 0.00 H new ATOM 849 N THR A 60 -13.525 15.041 -0.368 1.00 0.00 N ATOM 850 CA THR A 60 -14.386 15.683 0.626 1.00 0.00 C ATOM 851 C THR A 60 -13.777 16.992 1.175 1.00 0.00 C ATOM 852 O THR A 60 -14.389 17.646 2.023 1.00 0.00 O ATOM 853 CB THR A 60 -14.726 14.679 1.752 1.00 0.00 C ATOM 854 OG1 THR A 60 -13.603 14.002 2.296 1.00 0.00 O ATOM 855 CG2 THR A 60 -15.697 13.597 1.286 1.00 0.00 C ATOM 0 H THR A 60 -12.606 14.818 0.015 1.00 0.00 H new ATOM 0 HA THR A 60 -15.314 15.975 0.134 1.00 0.00 H new ATOM 0 HB THR A 60 -15.169 15.313 2.520 1.00 0.00 H new ATOM 0 HG1 THR A 60 -13.900 13.389 3.000 1.00 0.00 H new ATOM 0 HG21 THR A 60 -15.906 12.916 2.111 1.00 0.00 H new ATOM 0 HG22 THR A 60 -16.626 14.060 0.954 1.00 0.00 H new ATOM 0 HG23 THR A 60 -15.253 13.041 0.460 1.00 0.00 H new ATOM 863 N GLY A 61 -12.587 17.383 0.708 1.00 0.00 N ATOM 864 CA GLY A 61 -11.824 18.571 1.076 1.00 0.00 C ATOM 865 C GLY A 61 -10.665 18.236 2.015 1.00 0.00 C ATOM 866 O GLY A 61 -9.565 18.765 1.871 1.00 0.00 O ATOM 0 H GLY A 61 -12.096 16.829 0.006 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -11.436 19.046 0.175 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -12.485 19.292 1.558 1.00 0.00 H new ATOM 870 N GLN A 62 -10.891 17.329 2.966 1.00 0.00 N ATOM 871 CA GLN A 62 -9.892 16.895 3.933 1.00 0.00 C ATOM 872 C GLN A 62 -9.021 15.813 3.287 1.00 0.00 C ATOM 873 O GLN A 62 -9.339 15.306 2.207 1.00 0.00 O ATOM 874 CB GLN A 62 -10.585 16.371 5.207 1.00 0.00 C ATOM 875 CG GLN A 62 -11.237 17.488 6.042 1.00 0.00 C ATOM 876 CD GLN A 62 -12.473 18.091 5.376 1.00 0.00 C ATOM 877 OE1 GLN A 62 -13.485 17.418 5.205 1.00 0.00 O ATOM 878 NE2 GLN A 62 -12.428 19.348 4.968 1.00 0.00 N ATOM 0 H GLN A 62 -11.793 16.868 3.085 1.00 0.00 H new ATOM 0 HA GLN A 62 -9.258 17.732 4.223 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -11.347 15.644 4.926 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -9.854 15.846 5.821 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -11.516 17.089 7.017 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -10.505 18.276 6.217 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -11.584 19.901 5.113 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -13.238 19.764 4.508 1.00 0.00 H new ATOM 887 N ARG A 63 -7.956 15.395 3.971 1.00 0.00 N ATOM 888 CA ARG A 63 -7.158 14.246 3.557 1.00 0.00 C ATOM 889 C ARG A 63 -7.891 12.936 3.885 1.00 0.00 C ATOM 890 O ARG A 63 -7.588 12.245 4.861 1.00 0.00 O ATOM 891 CB ARG A 63 -5.726 14.340 4.097 1.00 0.00 C ATOM 892 CG ARG A 63 -5.543 14.506 5.609 1.00 0.00 C ATOM 893 CD ARG A 63 -4.087 14.165 5.943 1.00 0.00 C ATOM 894 NE ARG A 63 -3.144 15.186 5.465 1.00 0.00 N ATOM 895 CZ ARG A 63 -2.728 16.259 6.142 1.00 0.00 C ATOM 896 NH1 ARG A 63 -3.100 16.439 7.404 1.00 0.00 N ATOM 897 NH2 ARG A 63 -1.929 17.138 5.557 1.00 0.00 N ATOM 0 H ARG A 63 -7.625 15.843 4.825 1.00 0.00 H new ATOM 0 HA ARG A 63 -7.043 14.251 2.473 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.193 13.439 3.792 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.237 15.181 3.606 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.776 15.527 5.913 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.223 13.849 6.151 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -3.982 14.055 7.022 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -3.832 13.203 5.498 1.00 0.00 H new ATOM 0 HE ARG A 63 -2.771 15.063 4.524 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.706 15.756 7.860 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.780 17.260 7.918 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -1.633 16.995 4.592 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -1.610 17.959 6.072 1.00 0.00 H new ATOM 911 N HIS A 64 -8.890 12.609 3.072 1.00 0.00 N ATOM 912 CA HIS A 64 -9.667 11.385 3.127 1.00 0.00 C ATOM 913 C HIS A 64 -9.161 10.486 2.007 1.00 0.00 C ATOM 914 O HIS A 64 -9.093 10.877 0.846 1.00 0.00 O ATOM 915 CB HIS A 64 -11.152 11.717 2.988 1.00 0.00 C ATOM 916 CG HIS A 64 -12.098 10.861 3.777 1.00 0.00 C ATOM 917 ND1 HIS A 64 -12.975 9.953 3.251 1.00 0.00 N ATOM 918 CD2 HIS A 64 -12.366 10.966 5.110 1.00 0.00 C ATOM 919 CE1 HIS A 64 -13.741 9.481 4.237 1.00 0.00 C ATOM 920 NE2 HIS A 64 -13.400 10.062 5.401 1.00 0.00 N ATOM 0 H HIS A 64 -9.192 13.227 2.318 1.00 0.00 H new ATOM 0 HA HIS A 64 -9.552 10.867 4.079 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -11.300 12.755 3.285 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -11.422 11.645 1.934 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -11.874 11.623 5.812 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -14.519 8.742 4.118 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -13.812 9.881 6.316 1.00 0.00 H new ATOM 928 N ALA A 65 -8.747 9.293 2.386 1.00 0.00 N ATOM 929 CA ALA A 65 -8.333 8.220 1.507 1.00 0.00 C ATOM 930 C ALA A 65 -9.593 7.539 1.009 1.00 0.00 C ATOM 931 O ALA A 65 -10.530 7.328 1.787 1.00 0.00 O ATOM 932 CB ALA A 65 -7.477 7.221 2.285 1.00 0.00 C ATOM 0 H ALA A 65 -8.688 9.033 3.371 1.00 0.00 H new ATOM 0 HA ALA A 65 -7.744 8.602 0.673 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -7.166 6.414 1.622 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -6.595 7.727 2.679 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -8.058 6.809 3.110 1.00 0.00 H new ATOM 938 N SER A 66 -9.599 7.080 -0.232 1.00 0.00 N ATOM 939 CA SER A 66 -10.598 6.137 -0.722 1.00 0.00 C ATOM 940 C SER A 66 -9.878 5.089 -1.562 1.00 0.00 C ATOM 941 O SER A 66 -8.680 5.212 -1.815 1.00 0.00 O ATOM 942 CB SER A 66 -11.758 6.827 -1.475 1.00 0.00 C ATOM 943 OG SER A 66 -11.656 8.247 -1.531 1.00 0.00 O ATOM 0 H SER A 66 -8.909 7.351 -0.933 1.00 0.00 H new ATOM 0 HA SER A 66 -11.087 5.650 0.122 1.00 0.00 H new ATOM 0 HB2 SER A 66 -11.799 6.437 -2.492 1.00 0.00 H new ATOM 0 HB3 SER A 66 -12.699 6.560 -0.993 1.00 0.00 H new ATOM 0 HG SER A 66 -12.422 8.611 -2.023 1.00 0.00 H new ATOM 949 N GLY A 67 -10.593 4.063 -1.993 1.00 0.00 N ATOM 950 CA GLY A 67 -10.076 3.053 -2.890 1.00 0.00 C ATOM 951 C GLY A 67 -11.183 2.058 -3.179 1.00 0.00 C ATOM 952 O GLY A 67 -12.352 2.302 -2.840 1.00 0.00 O ATOM 0 H GLY A 67 -11.564 3.910 -1.723 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -9.726 3.511 -3.815 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -9.220 2.549 -2.441 1.00 0.00 H new ATOM 956 N PHE A 68 -10.821 0.939 -3.798 1.00 0.00 N ATOM 957 CA PHE A 68 -11.727 -0.165 -4.051 1.00 0.00 C ATOM 958 C PHE A 68 -11.022 -1.469 -3.691 1.00 0.00 C ATOM 959 O PHE A 68 -10.277 -1.978 -4.518 1.00 0.00 O ATOM 960 CB PHE A 68 -12.209 -0.130 -5.513 1.00 0.00 C ATOM 961 CG PHE A 68 -13.224 -1.210 -5.821 1.00 0.00 C ATOM 962 CD1 PHE A 68 -14.357 -1.316 -5.005 1.00 0.00 C ATOM 963 CD2 PHE A 68 -13.041 -2.124 -6.875 1.00 0.00 C ATOM 964 CE1 PHE A 68 -15.259 -2.366 -5.183 1.00 0.00 C ATOM 965 CE2 PHE A 68 -13.948 -3.182 -7.061 1.00 0.00 C ATOM 966 CZ PHE A 68 -15.054 -3.308 -6.201 1.00 0.00 C ATOM 0 H PHE A 68 -9.875 0.776 -4.141 1.00 0.00 H new ATOM 0 HA PHE A 68 -12.619 -0.083 -3.430 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -12.648 0.845 -5.723 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -11.352 -0.243 -6.176 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -14.534 -0.581 -4.234 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -12.200 -2.012 -7.544 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.118 -2.453 -4.534 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -13.797 -3.894 -7.859 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.744 -4.129 -6.325 1.00 0.00 H new ATOM 976 N SER A 69 -11.207 -2.001 -2.482 1.00 0.00 N ATOM 977 CA SER A 69 -10.699 -3.299 -2.051 1.00 0.00 C ATOM 978 C SER A 69 -11.500 -4.441 -2.694 1.00 0.00 C ATOM 979 O SER A 69 -12.313 -5.081 -2.023 1.00 0.00 O ATOM 980 CB SER A 69 -10.810 -3.451 -0.528 1.00 0.00 C ATOM 981 OG SER A 69 -10.194 -2.451 0.246 1.00 0.00 O ATOM 0 H SER A 69 -11.734 -1.521 -1.752 1.00 0.00 H new ATOM 0 HA SER A 69 -9.655 -3.351 -2.360 1.00 0.00 H new ATOM 0 HB2 SER A 69 -11.867 -3.485 -0.264 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.380 -4.413 -0.248 1.00 0.00 H new ATOM 0 HG SER A 69 -10.478 -1.569 -0.073 1.00 0.00 H new ATOM 987 N GLY A 70 -11.256 -4.755 -3.966 1.00 0.00 N ATOM 988 CA GLY A 70 -11.577 -6.031 -4.587 1.00 0.00 C ATOM 989 C GLY A 70 -13.057 -6.233 -4.843 1.00 0.00 C ATOM 990 O GLY A 70 -13.440 -6.355 -6.009 1.00 0.00 O ATOM 0 H GLY A 70 -10.813 -4.101 -4.612 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -11.041 -6.109 -5.533 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -11.215 -6.836 -3.948 1.00 0.00 H new ATOM 994 N CYS A 71 -13.902 -6.287 -3.810 1.00 0.00 N ATOM 995 CA CYS A 71 -15.329 -6.283 -4.001 1.00 0.00 C ATOM 996 C CYS A 71 -15.954 -5.024 -3.437 1.00 0.00 C ATOM 997 O CYS A 71 -17.079 -4.707 -3.820 1.00 0.00 O ATOM 998 CB CYS A 71 -15.904 -7.532 -3.359 1.00 0.00 C ATOM 999 SG CYS A 71 -15.773 -8.959 -4.470 1.00 0.00 S ATOM 0 H CYS A 71 -13.607 -6.334 -2.835 1.00 0.00 H new ATOM 0 HA CYS A 71 -15.558 -6.289 -5.067 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -15.376 -7.742 -2.429 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -16.949 -7.363 -3.101 1.00 0.00 H new ATOM 1004 N ASN A 72 -15.246 -4.293 -2.578 1.00 0.00 N ATOM 1005 CA ASN A 72 -15.817 -3.374 -1.619 1.00 0.00 C ATOM 1006 C ASN A 72 -14.919 -2.158 -1.606 1.00 0.00 C ATOM 1007 O ASN A 72 -13.718 -2.248 -1.384 1.00 0.00 O ATOM 1008 CB ASN A 72 -15.854 -3.939 -0.184 1.00 0.00 C ATOM 1009 CG ASN A 72 -15.753 -5.457 0.001 1.00 0.00 C ATOM 1010 OD1 ASN A 72 -15.004 -6.181 -0.642 1.00 0.00 O ATOM 1011 ND2 ASN A 72 -16.545 -5.991 0.900 1.00 0.00 N ATOM 0 H ASN A 72 -14.228 -4.332 -2.536 1.00 0.00 H new ATOM 0 HA ASN A 72 -16.845 -3.164 -1.913 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -15.038 -3.481 0.375 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -16.783 -3.608 0.280 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -16.532 -6.999 1.057 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -17.174 -5.398 1.442 1.00 0.00 H new ATOM 1018 N ARG A 73 -15.488 -0.993 -1.843 1.00 0.00 N ATOM 1019 CA ARG A 73 -14.801 0.245 -1.509 1.00 0.00 C ATOM 1020 C ARG A 73 -14.795 0.489 -0.008 1.00 0.00 C ATOM 1021 O ARG A 73 -15.628 -0.011 0.755 1.00 0.00 O ATOM 1022 CB ARG A 73 -15.351 1.446 -2.273 1.00 0.00 C ATOM 1023 CG ARG A 73 -16.875 1.484 -2.263 1.00 0.00 C ATOM 1024 CD ARG A 73 -17.322 2.942 -2.187 1.00 0.00 C ATOM 1025 NE ARG A 73 -18.776 3.080 -2.086 1.00 0.00 N ATOM 1026 CZ ARG A 73 -19.419 4.222 -1.830 1.00 0.00 C ATOM 1027 NH1 ARG A 73 -18.743 5.352 -1.631 1.00 0.00 N ATOM 1028 NH2 ARG A 73 -20.743 4.216 -1.809 1.00 0.00 N ATOM 0 H ARG A 73 -16.411 -0.874 -2.260 1.00 0.00 H new ATOM 0 HA ARG A 73 -13.766 0.125 -1.830 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -14.963 2.364 -1.832 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -14.997 1.413 -3.303 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -17.272 1.012 -3.162 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -17.262 0.924 -1.412 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -16.855 3.417 -1.324 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -16.971 3.473 -3.072 1.00 0.00 H new ATOM 0 HE ARG A 73 -19.340 2.241 -2.221 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -17.724 5.351 -1.673 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -19.244 6.219 -1.436 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -21.252 3.350 -1.986 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -21.254 5.077 -1.615 1.00 0.00 H new ATOM 1042 N TYR A 74 -13.883 1.382 0.328 1.00 0.00 N ATOM 1043 CA TYR A 74 -13.458 1.855 1.625 1.00 0.00 C ATOM 1044 C TYR A 74 -13.103 3.325 1.469 1.00 0.00 C ATOM 1045 O TYR A 74 -12.653 3.763 0.405 1.00 0.00 O ATOM 1046 CB TYR A 74 -12.272 1.062 2.207 1.00 0.00 C ATOM 1047 CG TYR A 74 -10.967 1.153 1.432 1.00 0.00 C ATOM 1048 CD1 TYR A 74 -10.859 0.578 0.151 1.00 0.00 C ATOM 1049 CD2 TYR A 74 -9.840 1.772 2.013 1.00 0.00 C ATOM 1050 CE1 TYR A 74 -9.640 0.623 -0.544 1.00 0.00 C ATOM 1051 CE2 TYR A 74 -8.620 1.820 1.320 1.00 0.00 C ATOM 1052 CZ TYR A 74 -8.514 1.221 0.049 1.00 0.00 C ATOM 1053 OH TYR A 74 -7.325 1.181 -0.598 1.00 0.00 O ATOM 0 H TYR A 74 -13.354 1.853 -0.406 1.00 0.00 H new ATOM 0 HA TYR A 74 -14.270 1.712 2.338 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -12.093 1.409 3.225 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -12.560 0.013 2.274 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -11.717 0.101 -0.298 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -9.916 2.211 2.997 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -9.567 0.198 -1.534 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -7.766 2.314 1.759 1.00 0.00 H new ATOM 0 HH TYR A 74 -7.479 1.166 -1.566 1.00 0.00 H new ATOM 1063 N MET A 75 -13.353 4.083 2.527 1.00 0.00 N ATOM 1064 CA MET A 75 -13.134 5.507 2.662 1.00 0.00 C ATOM 1065 C MET A 75 -12.776 5.750 4.119 1.00 0.00 C ATOM 1066 O MET A 75 -13.256 5.038 5.004 1.00 0.00 O ATOM 1067 CB MET A 75 -14.413 6.296 2.359 1.00 0.00 C ATOM 1068 CG MET A 75 -14.937 6.078 0.954 1.00 0.00 C ATOM 1069 SD MET A 75 -16.674 6.470 0.658 1.00 0.00 S ATOM 1070 CE MET A 75 -17.465 5.111 1.541 1.00 0.00 C ATOM 0 H MET A 75 -13.745 3.681 3.378 1.00 0.00 H new ATOM 0 HA MET A 75 -12.356 5.828 1.969 1.00 0.00 H new ATOM 0 HB2 MET A 75 -15.184 6.011 3.075 1.00 0.00 H new ATOM 0 HB3 MET A 75 -14.219 7.359 2.505 1.00 0.00 H new ATOM 0 HG2 MET A 75 -14.334 6.676 0.271 1.00 0.00 H new ATOM 0 HG3 MET A 75 -14.776 5.033 0.691 1.00 0.00 H new ATOM 0 HE1 MET A 75 -18.475 5.403 1.828 1.00 0.00 H new ATOM 0 HE2 MET A 75 -17.510 4.234 0.895 1.00 0.00 H new ATOM 0 HE3 MET A 75 -16.888 4.873 2.435 1.00 0.00 H new ATOM 1080 N GLY A 76 -12.013 6.793 4.386 1.00 0.00 N ATOM 1081 CA GLY A 76 -11.680 7.207 5.741 1.00 0.00 C ATOM 1082 C GLY A 76 -10.506 8.169 5.741 1.00 0.00 C ATOM 1083 O GLY A 76 -9.927 8.437 4.690 1.00 0.00 O ATOM 0 H GLY A 76 -11.602 7.384 3.663 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.545 7.683 6.203 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.438 6.332 6.344 1.00 0.00 H new ATOM 1087 N SER A 77 -10.148 8.710 6.900 1.00 0.00 N ATOM 1088 CA SER A 77 -9.102 9.724 6.983 1.00 0.00 C ATOM 1089 C SER A 77 -7.707 9.088 6.915 1.00 0.00 C ATOM 1090 O SER A 77 -7.520 7.932 7.309 1.00 0.00 O ATOM 1091 CB SER A 77 -9.295 10.559 8.252 1.00 0.00 C ATOM 1092 OG SER A 77 -10.359 11.474 8.065 1.00 0.00 O ATOM 0 H SER A 77 -10.567 8.463 7.797 1.00 0.00 H new ATOM 0 HA SER A 77 -9.180 10.390 6.124 1.00 0.00 H new ATOM 0 HB2 SER A 77 -9.508 9.907 9.099 1.00 0.00 H new ATOM 0 HB3 SER A 77 -8.377 11.097 8.488 1.00 0.00 H new ATOM 0 HG SER A 77 -10.481 12.005 8.880 1.00 0.00 H new ATOM 1098 N TYR A 78 -6.718 9.870 6.470 1.00 0.00 N ATOM 1099 CA TYR A 78 -5.294 9.554 6.577 1.00 0.00 C ATOM 1100 C TYR A 78 -4.540 10.695 7.269 1.00 0.00 C ATOM 1101 O TYR A 78 -5.147 11.693 7.668 1.00 0.00 O ATOM 1102 CB TYR A 78 -4.688 9.128 5.222 1.00 0.00 C ATOM 1103 CG TYR A 78 -4.594 10.161 4.108 1.00 0.00 C ATOM 1104 CD1 TYR A 78 -5.696 10.357 3.262 1.00 0.00 C ATOM 1105 CD2 TYR A 78 -3.396 10.856 3.847 1.00 0.00 C ATOM 1106 CE1 TYR A 78 -5.625 11.227 2.160 1.00 0.00 C ATOM 1107 CE2 TYR A 78 -3.321 11.757 2.765 1.00 0.00 C ATOM 1108 CZ TYR A 78 -4.432 11.939 1.910 1.00 0.00 C ATOM 1109 OH TYR A 78 -4.402 12.901 0.950 1.00 0.00 O ATOM 0 H TYR A 78 -6.893 10.765 6.013 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.180 8.678 7.216 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.682 8.754 5.412 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -5.274 8.289 4.847 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -6.617 9.829 3.461 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.533 10.698 4.477 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -6.478 11.350 1.509 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -2.411 12.311 2.589 1.00 0.00 H new ATOM 0 HH TYR A 78 -4.484 13.783 1.368 1.00 0.00 H new ATOM 1119 N ALA A 79 -3.235 10.530 7.494 1.00 0.00 N ATOM 1120 CA ALA A 79 -2.324 11.530 8.036 1.00 0.00 C ATOM 1121 C ALA A 79 -0.914 11.274 7.508 1.00 0.00 C ATOM 1122 O ALA A 79 -0.556 10.135 7.199 1.00 0.00 O ATOM 1123 CB ALA A 79 -2.313 11.463 9.565 1.00 0.00 C ATOM 0 H ALA A 79 -2.765 9.648 7.291 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.660 12.519 7.726 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -1.628 12.215 9.957 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.317 11.653 9.945 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.986 10.473 9.883 1.00 0.00 H new ATOM 1129 N LEU A 80 -0.118 12.343 7.444 1.00 0.00 N ATOM 1130 CA LEU A 80 1.272 12.372 7.017 1.00 0.00 C ATOM 1131 C LEU A 80 2.076 12.688 8.262 1.00 0.00 C ATOM 1132 O LEU A 80 2.069 13.818 8.760 1.00 0.00 O ATOM 1133 CB LEU A 80 1.470 13.443 5.934 1.00 0.00 C ATOM 1134 CG LEU A 80 1.154 12.949 4.514 1.00 0.00 C ATOM 1135 CD1 LEU A 80 -0.107 12.099 4.378 1.00 0.00 C ATOM 1136 CD2 LEU A 80 1.043 14.127 3.554 1.00 0.00 C ATOM 0 H LEU A 80 -0.454 13.269 7.707 1.00 0.00 H new ATOM 0 HA LEU A 80 1.589 11.425 6.579 1.00 0.00 H new ATOM 0 HB2 LEU A 80 0.835 14.299 6.161 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.501 13.794 5.966 1.00 0.00 H new ATOM 0 HG LEU A 80 1.992 12.298 4.266 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.236 11.804 3.337 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -0.014 11.208 4.999 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.972 12.678 4.701 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.819 13.760 2.552 1.00 0.00 H new ATOM 0 HD22 LEU A 80 0.245 14.791 3.884 1.00 0.00 H new ATOM 0 HD23 LEU A 80 1.986 14.673 3.538 1.00 0.00 H new ATOM 1148 N LYS A 81 2.669 11.651 8.832 1.00 0.00 N ATOM 1149 CA LYS A 81 3.385 11.735 10.103 1.00 0.00 C ATOM 1150 C LYS A 81 4.424 10.633 10.172 1.00 0.00 C ATOM 1151 O LYS A 81 4.278 9.632 9.490 1.00 0.00 O ATOM 1152 CB LYS A 81 2.383 11.618 11.264 1.00 0.00 C ATOM 1153 CG LYS A 81 1.733 10.223 11.364 1.00 0.00 C ATOM 1154 CD LYS A 81 0.455 10.220 12.210 1.00 0.00 C ATOM 1155 CE LYS A 81 0.752 10.652 13.643 1.00 0.00 C ATOM 1156 NZ LYS A 81 -0.463 10.733 14.465 1.00 0.00 N ATOM 0 H LYS A 81 2.669 10.716 8.424 1.00 0.00 H new ATOM 0 HA LYS A 81 3.894 12.696 10.181 1.00 0.00 H new ATOM 0 HB2 LYS A 81 2.893 11.842 12.201 1.00 0.00 H new ATOM 0 HB3 LYS A 81 1.602 12.368 11.139 1.00 0.00 H new ATOM 0 HG2 LYS A 81 1.500 9.864 10.362 1.00 0.00 H new ATOM 0 HG3 LYS A 81 2.450 9.524 11.795 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -0.281 10.892 11.768 1.00 0.00 H new ATOM 0 HD3 LYS A 81 0.016 9.222 12.210 1.00 0.00 H new ATOM 0 HE2 LYS A 81 1.448 9.946 14.096 1.00 0.00 H new ATOM 0 HE3 LYS A 81 1.246 11.624 13.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -0.211 11.030 15.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -1.118 11.426 14.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -0.922 9.800 14.499 1.00 0.00 H new ATOM 1170 N ASP A 82 5.442 10.779 11.013 1.00 0.00 N ATOM 1171 CA ASP A 82 6.520 9.803 11.212 1.00 0.00 C ATOM 1172 C ASP A 82 7.096 9.210 9.917 1.00 0.00 C ATOM 1173 O ASP A 82 7.479 8.039 9.853 1.00 0.00 O ATOM 1174 CB ASP A 82 6.120 8.737 12.241 1.00 0.00 C ATOM 1175 CG ASP A 82 7.343 8.091 12.893 1.00 0.00 C ATOM 1176 OD1 ASP A 82 8.490 8.480 12.592 1.00 0.00 O ATOM 1177 OD2 ASP A 82 7.138 7.261 13.809 1.00 0.00 O ATOM 0 H ASP A 82 5.548 11.608 11.598 1.00 0.00 H new ATOM 0 HA ASP A 82 7.357 10.364 11.628 1.00 0.00 H new ATOM 0 HB2 ASP A 82 5.495 9.191 13.010 1.00 0.00 H new ATOM 0 HB3 ASP A 82 5.519 7.969 11.754 1.00 0.00 H new ATOM 1182 N GLY A 83 7.128 10.020 8.856 1.00 0.00 N ATOM 1183 CA GLY A 83 7.560 9.603 7.533 1.00 0.00 C ATOM 1184 C GLY A 83 6.663 8.559 6.864 1.00 0.00 C ATOM 1185 O GLY A 83 7.024 8.088 5.786 1.00 0.00 O ATOM 0 H GLY A 83 6.848 11.000 8.900 1.00 0.00 H new ATOM 0 HA2 GLY A 83 7.613 10.481 6.890 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.570 9.200 7.606 1.00 0.00 H new ATOM 1189 N LYS A 84 5.523 8.178 7.452 1.00 0.00 N ATOM 1190 CA LYS A 84 4.673 7.088 6.994 1.00 0.00 C ATOM 1191 C LYS A 84 3.255 7.575 6.734 1.00 0.00 C ATOM 1192 O LYS A 84 2.718 8.446 7.424 1.00 0.00 O ATOM 1193 CB LYS A 84 4.749 5.903 7.969 1.00 0.00 C ATOM 1194 CG LYS A 84 4.016 6.118 9.299 1.00 0.00 C ATOM 1195 CD LYS A 84 4.660 5.308 10.427 1.00 0.00 C ATOM 1196 CE LYS A 84 3.791 5.407 11.686 1.00 0.00 C ATOM 1197 NZ LYS A 84 4.019 4.280 12.606 1.00 0.00 N ATOM 0 H LYS A 84 5.160 8.639 8.287 1.00 0.00 H new ATOM 0 HA LYS A 84 5.041 6.722 6.036 1.00 0.00 H new ATOM 0 HB2 LYS A 84 4.335 5.021 7.480 1.00 0.00 H new ATOM 0 HB3 LYS A 84 5.797 5.689 8.178 1.00 0.00 H new ATOM 0 HG2 LYS A 84 4.028 7.177 9.556 1.00 0.00 H new ATOM 0 HG3 LYS A 84 2.971 5.828 9.191 1.00 0.00 H new ATOM 0 HD2 LYS A 84 4.766 4.266 10.126 1.00 0.00 H new ATOM 0 HD3 LYS A 84 5.662 5.684 10.633 1.00 0.00 H new ATOM 0 HE2 LYS A 84 4.005 6.344 12.201 1.00 0.00 H new ATOM 0 HE3 LYS A 84 2.740 5.434 11.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 3.709 4.545 13.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 3.477 3.453 12.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 5.032 4.045 12.623 1.00 0.00 H new ATOM 1211 N LEU A 85 2.639 6.975 5.727 1.00 0.00 N ATOM 1212 CA LEU A 85 1.225 7.133 5.443 1.00 0.00 C ATOM 1213 C LEU A 85 0.491 6.373 6.543 1.00 0.00 C ATOM 1214 O LEU A 85 0.718 5.177 6.689 1.00 0.00 O ATOM 1215 CB LEU A 85 0.942 6.548 4.048 1.00 0.00 C ATOM 1216 CG LEU A 85 -0.337 7.040 3.345 1.00 0.00 C ATOM 1217 CD1 LEU A 85 -0.703 6.005 2.277 1.00 0.00 C ATOM 1218 CD2 LEU A 85 -1.539 7.302 4.257 1.00 0.00 C ATOM 0 H LEU A 85 3.118 6.354 5.074 1.00 0.00 H new ATOM 0 HA LEU A 85 0.899 8.173 5.432 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.793 6.772 3.405 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.887 5.463 4.137 1.00 0.00 H new ATOM 0 HG LEU A 85 -0.107 8.019 2.924 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -1.607 6.322 1.758 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.114 5.916 1.561 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.877 5.039 2.751 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.383 7.644 3.658 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.811 6.382 4.774 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.280 8.067 4.989 1.00 0.00 H new ATOM 1230 N SER A 86 -0.347 7.034 7.335 1.00 0.00 N ATOM 1231 CA SER A 86 -1.125 6.374 8.382 1.00 0.00 C ATOM 1232 C SER A 86 -2.604 6.658 8.172 1.00 0.00 C ATOM 1233 O SER A 86 -2.958 7.705 7.624 1.00 0.00 O ATOM 1234 CB SER A 86 -0.645 6.829 9.763 1.00 0.00 C ATOM 1235 OG SER A 86 -0.414 8.226 9.780 1.00 0.00 O ATOM 0 H SER A 86 -0.507 8.039 7.271 1.00 0.00 H new ATOM 0 HA SER A 86 -0.979 5.295 8.327 1.00 0.00 H new ATOM 0 HB2 SER A 86 -1.390 6.570 10.515 1.00 0.00 H new ATOM 0 HB3 SER A 86 0.271 6.301 10.027 1.00 0.00 H new ATOM 0 HG SER A 86 -1.030 8.667 9.159 1.00 0.00 H new ATOM 1241 N PHE A 87 -3.468 5.750 8.625 1.00 0.00 N ATOM 1242 CA PHE A 87 -4.904 5.813 8.361 1.00 0.00 C ATOM 1243 C PHE A 87 -5.744 5.913 9.634 1.00 0.00 C ATOM 1244 O PHE A 87 -5.228 5.884 10.755 1.00 0.00 O ATOM 1245 CB PHE A 87 -5.321 4.623 7.495 1.00 0.00 C ATOM 1246 CG PHE A 87 -4.720 4.641 6.109 1.00 0.00 C ATOM 1247 CD1 PHE A 87 -5.319 5.394 5.083 1.00 0.00 C ATOM 1248 CD2 PHE A 87 -3.577 3.874 5.838 1.00 0.00 C ATOM 1249 CE1 PHE A 87 -4.777 5.362 3.787 1.00 0.00 C ATOM 1250 CE2 PHE A 87 -2.998 3.896 4.559 1.00 0.00 C ATOM 1251 CZ PHE A 87 -3.614 4.622 3.526 1.00 0.00 C ATOM 0 H PHE A 87 -3.189 4.946 9.188 1.00 0.00 H new ATOM 0 HA PHE A 87 -5.100 6.736 7.815 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -5.029 3.700 7.996 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -6.408 4.610 7.410 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -6.192 5.995 5.291 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -3.141 3.265 6.616 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -5.257 5.909 2.989 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -2.082 3.356 4.370 1.00 0.00 H new ATOM 0 HZ PHE A 87 -3.193 4.610 2.532 1.00 0.00 H new ATOM 1261 N GLY A 88 -7.056 6.075 9.463 1.00 0.00 N ATOM 1262 CA GLY A 88 -8.048 6.071 10.524 1.00 0.00 C ATOM 1263 C GLY A 88 -8.815 4.752 10.532 1.00 0.00 C ATOM 1264 O GLY A 88 -8.249 3.690 10.795 1.00 0.00 O ATOM 0 H GLY A 88 -7.468 6.218 8.541 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -7.560 6.221 11.487 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -8.741 6.901 10.385 1.00 0.00 H new ATOM 1268 N THR A 89 -10.099 4.819 10.197 1.00 0.00 N ATOM 1269 CA THR A 89 -11.130 3.835 10.427 1.00 0.00 C ATOM 1270 C THR A 89 -11.849 3.684 9.097 1.00 0.00 C ATOM 1271 O THR A 89 -12.918 4.252 8.840 1.00 0.00 O ATOM 1272 CB THR A 89 -11.953 4.317 11.630 1.00 0.00 C ATOM 1273 OG1 THR A 89 -12.961 3.401 11.992 1.00 0.00 O ATOM 1274 CG2 THR A 89 -12.583 5.715 11.571 1.00 0.00 C ATOM 0 H THR A 89 -10.469 5.639 9.716 1.00 0.00 H new ATOM 0 HA THR A 89 -10.801 2.834 10.707 1.00 0.00 H new ATOM 0 HB THR A 89 -11.168 4.387 12.383 1.00 0.00 H new ATOM 0 HG1 THR A 89 -13.458 3.748 12.762 1.00 0.00 H new ATOM 0 HG21 THR A 89 -13.130 5.907 12.494 1.00 0.00 H new ATOM 0 HG22 THR A 89 -11.799 6.463 11.452 1.00 0.00 H new ATOM 0 HG23 THR A 89 -13.268 5.770 10.725 1.00 0.00 H new ATOM 1282 N LEU A 90 -11.139 3.067 8.157 1.00 0.00 N ATOM 1283 CA LEU A 90 -11.565 2.968 6.807 1.00 0.00 C ATOM 1284 C LEU A 90 -12.725 2.003 6.693 1.00 0.00 C ATOM 1285 O LEU A 90 -12.827 1.008 7.415 1.00 0.00 O ATOM 1286 CB LEU A 90 -10.379 2.443 6.023 1.00 0.00 C ATOM 1287 CG LEU A 90 -9.078 3.201 6.276 1.00 0.00 C ATOM 1288 CD1 LEU A 90 -9.183 4.726 6.298 1.00 0.00 C ATOM 1289 CD2 LEU A 90 -8.259 2.534 7.358 1.00 0.00 C ATOM 0 H LEU A 90 -10.239 2.622 8.338 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.899 3.934 6.428 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -10.229 1.393 6.272 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -10.612 2.488 4.959 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.472 3.105 5.375 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.199 5.156 6.486 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -9.556 5.079 5.336 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -9.869 5.032 7.088 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.339 3.096 7.516 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -8.832 2.508 8.285 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -8.015 1.516 7.054 1.00 0.00 H new ATOM 1301 N GLY A 91 -13.551 2.245 5.696 1.00 0.00 N ATOM 1302 CA GLY A 91 -14.614 1.349 5.334 1.00 0.00 C ATOM 1303 C GLY A 91 -15.509 2.082 4.367 1.00 0.00 C ATOM 1304 O GLY A 91 -15.414 3.302 4.230 1.00 0.00 O ATOM 0 H GLY A 91 -13.497 3.080 5.112 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -14.214 0.444 4.877 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -15.174 1.040 6.217 1.00 0.00 H new ATOM 1308 N GLY A 92 -16.346 1.364 3.640 1.00 0.00 N ATOM 1309 CA GLY A 92 -17.251 2.030 2.722 1.00 0.00 C ATOM 1310 C GLY A 92 -18.558 1.305 2.527 1.00 0.00 C ATOM 1311 O GLY A 92 -19.602 1.926 2.305 1.00 0.00 O ATOM 0 H GLY A 92 -16.418 0.347 3.665 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -17.455 3.035 3.092 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -16.759 2.139 1.756 1.00 0.00 H new ATOM 1315 N THR A 93 -18.480 0.002 2.718 1.00 0.00 N ATOM 1316 CA THR A 93 -19.457 -1.019 2.379 1.00 0.00 C ATOM 1317 C THR A 93 -19.122 -2.316 3.140 1.00 0.00 C ATOM 1318 O THR A 93 -18.063 -2.418 3.760 1.00 0.00 O ATOM 1319 CB THR A 93 -19.453 -1.200 0.842 1.00 0.00 C ATOM 1320 OG1 THR A 93 -18.155 -1.456 0.330 1.00 0.00 O ATOM 1321 CG2 THR A 93 -19.991 0.031 0.098 1.00 0.00 C ATOM 0 H THR A 93 -17.655 -0.408 3.155 1.00 0.00 H new ATOM 0 HA THR A 93 -20.464 -0.730 2.679 1.00 0.00 H new ATOM 0 HB THR A 93 -20.105 -2.056 0.671 1.00 0.00 H new ATOM 0 HG1 THR A 93 -17.564 -0.705 0.547 1.00 0.00 H new ATOM 0 HG21 THR A 93 -19.965 -0.153 -0.976 1.00 0.00 H new ATOM 0 HG22 THR A 93 -21.018 0.224 0.408 1.00 0.00 H new ATOM 0 HG23 THR A 93 -19.373 0.897 0.333 1.00 0.00 H new ATOM 1329 N ARG A 94 -20.016 -3.307 3.120 1.00 0.00 N ATOM 1330 CA ARG A 94 -19.912 -4.573 3.858 1.00 0.00 C ATOM 1331 C ARG A 94 -20.132 -5.759 2.914 1.00 0.00 C ATOM 1332 O ARG A 94 -20.692 -6.785 3.313 1.00 0.00 O ATOM 1333 CB ARG A 94 -20.892 -4.538 5.054 1.00 0.00 C ATOM 1334 CG ARG A 94 -20.278 -3.827 6.268 1.00 0.00 C ATOM 1335 CD ARG A 94 -19.411 -4.781 7.102 1.00 0.00 C ATOM 1336 NE ARG A 94 -20.203 -5.597 8.042 1.00 0.00 N ATOM 1337 CZ ARG A 94 -19.834 -5.899 9.294 1.00 0.00 C ATOM 1338 NH1 ARG A 94 -18.604 -5.645 9.732 1.00 0.00 N ATOM 1339 NH2 ARG A 94 -20.723 -6.455 10.104 1.00 0.00 N ATOM 0 H ARG A 94 -20.870 -3.249 2.566 1.00 0.00 H new ATOM 0 HA ARG A 94 -18.910 -4.703 4.266 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -21.809 -4.028 4.759 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -21.168 -5.556 5.329 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -19.673 -2.986 5.930 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -21.073 -3.418 6.891 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -18.857 -5.440 6.433 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -18.676 -4.202 7.661 1.00 0.00 H new ATOM 0 HE ARG A 94 -21.099 -5.958 7.714 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -17.921 -5.212 9.111 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -18.344 -5.883 10.689 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -21.668 -6.645 9.770 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -20.462 -6.693 11.061 1.00 0.00 H new ATOM 1353 N MET A 95 -19.780 -5.588 1.640 1.00 0.00 N ATOM 1354 CA MET A 95 -20.133 -6.504 0.565 1.00 0.00 C ATOM 1355 C MET A 95 -19.563 -7.904 0.822 1.00 0.00 C ATOM 1356 O MET A 95 -18.434 -8.068 1.295 1.00 0.00 O ATOM 1357 CB MET A 95 -19.667 -5.956 -0.794 1.00 0.00 C ATOM 1358 CG MET A 95 -19.959 -4.457 -0.998 1.00 0.00 C ATOM 1359 SD MET A 95 -19.740 -3.917 -2.710 1.00 0.00 S ATOM 1360 CE MET A 95 -19.682 -2.103 -2.626 1.00 0.00 C ATOM 0 H MET A 95 -19.229 -4.790 1.324 1.00 0.00 H new ATOM 0 HA MET A 95 -21.219 -6.590 0.539 1.00 0.00 H new ATOM 0 HB2 MET A 95 -18.595 -6.124 -0.894 1.00 0.00 H new ATOM 0 HB3 MET A 95 -20.153 -6.522 -1.589 1.00 0.00 H new ATOM 0 HG2 MET A 95 -20.982 -4.247 -0.685 1.00 0.00 H new ATOM 0 HG3 MET A 95 -19.302 -3.874 -0.353 1.00 0.00 H new ATOM 0 HE1 MET A 95 -19.640 -1.693 -3.635 1.00 0.00 H new ATOM 0 HE2 MET A 95 -20.575 -1.733 -2.121 1.00 0.00 H new ATOM 0 HE3 MET A 95 -18.797 -1.793 -2.071 1.00 0.00 H new ATOM 1370 N ALA A 96 -20.350 -8.918 0.485 1.00 0.00 N ATOM 1371 CA ALA A 96 -19.987 -10.322 0.563 1.00 0.00 C ATOM 1372 C ALA A 96 -19.728 -10.833 -0.848 1.00 0.00 C ATOM 1373 O ALA A 96 -20.611 -10.741 -1.710 1.00 0.00 O ATOM 1374 CB ALA A 96 -21.118 -11.117 1.222 1.00 0.00 C ATOM 0 H ALA A 96 -21.298 -8.775 0.136 1.00 0.00 H new ATOM 0 HA ALA A 96 -19.088 -10.445 1.167 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -20.839 -12.169 1.277 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -21.293 -10.735 2.228 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -22.028 -11.014 0.631 1.00 0.00 H new ATOM 1380 N CYS A 97 -18.547 -11.398 -1.071 1.00 0.00 N ATOM 1381 CA CYS A 97 -18.218 -12.145 -2.272 1.00 0.00 C ATOM 1382 C CYS A 97 -17.675 -13.514 -1.897 1.00 0.00 C ATOM 1383 O CYS A 97 -17.323 -13.785 -0.746 1.00 0.00 O ATOM 1384 CB CYS A 97 -17.182 -11.392 -3.100 1.00 0.00 C ATOM 1385 SG CYS A 97 -17.811 -9.952 -3.989 1.00 0.00 S ATOM 0 H CYS A 97 -17.776 -11.346 -0.405 1.00 0.00 H new ATOM 0 HA CYS A 97 -19.124 -12.265 -2.866 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -16.377 -11.069 -2.440 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -16.745 -12.082 -3.821 1.00 0.00 H new ATOM 1390 N MET A 98 -17.579 -14.372 -2.905 1.00 0.00 N ATOM 1391 CA MET A 98 -17.132 -15.749 -2.807 1.00 0.00 C ATOM 1392 C MET A 98 -15.907 -15.875 -3.715 1.00 0.00 C ATOM 1393 O MET A 98 -15.816 -16.769 -4.556 1.00 0.00 O ATOM 1394 CB MET A 98 -18.305 -16.713 -3.096 1.00 0.00 C ATOM 1395 CG MET A 98 -19.657 -16.179 -2.581 1.00 0.00 C ATOM 1396 SD MET A 98 -20.856 -17.410 -2.028 1.00 0.00 S ATOM 1397 CE MET A 98 -20.290 -17.517 -0.308 1.00 0.00 C ATOM 0 H MET A 98 -17.824 -14.109 -3.860 1.00 0.00 H new ATOM 0 HA MET A 98 -16.817 -16.036 -1.804 1.00 0.00 H new ATOM 0 HB2 MET A 98 -18.372 -16.884 -4.170 1.00 0.00 H new ATOM 0 HB3 MET A 98 -18.100 -17.678 -2.632 1.00 0.00 H new ATOM 0 HG2 MET A 98 -19.461 -15.498 -1.752 1.00 0.00 H new ATOM 0 HG3 MET A 98 -20.115 -15.590 -3.375 1.00 0.00 H new ATOM 0 HE1 MET A 98 -20.904 -18.237 0.233 1.00 0.00 H new ATOM 0 HE2 MET A 98 -19.249 -17.840 -0.287 1.00 0.00 H new ATOM 0 HE3 MET A 98 -20.376 -16.539 0.165 1.00 0.00 H new ATOM 1407 N THR A 99 -14.989 -14.914 -3.588 1.00 0.00 N ATOM 1408 CA THR A 99 -13.728 -14.838 -4.306 1.00 0.00 C ATOM 1409 C THR A 99 -12.616 -14.526 -3.289 1.00 0.00 C ATOM 1410 O THR A 99 -12.913 -13.945 -2.233 1.00 0.00 O ATOM 1411 CB THR A 99 -13.812 -13.758 -5.406 1.00 0.00 C ATOM 1412 OG1 THR A 99 -14.085 -12.487 -4.851 1.00 0.00 O ATOM 1413 CG2 THR A 99 -14.901 -14.049 -6.441 1.00 0.00 C ATOM 0 H THR A 99 -15.118 -14.131 -2.947 1.00 0.00 H new ATOM 0 HA THR A 99 -13.506 -15.785 -4.799 1.00 0.00 H new ATOM 0 HB THR A 99 -12.839 -13.769 -5.897 1.00 0.00 H new ATOM 0 HG1 THR A 99 -14.132 -11.820 -5.568 1.00 0.00 H new ATOM 0 HG21 THR A 99 -14.913 -13.256 -7.189 1.00 0.00 H new ATOM 0 HG22 THR A 99 -14.696 -15.003 -6.927 1.00 0.00 H new ATOM 0 HG23 THR A 99 -15.871 -14.095 -5.946 1.00 0.00 H new ATOM 1421 N PRO A 100 -11.346 -14.855 -3.585 1.00 0.00 N ATOM 1422 CA PRO A 100 -10.214 -14.492 -2.739 1.00 0.00 C ATOM 1423 C PRO A 100 -10.105 -12.972 -2.599 1.00 0.00 C ATOM 1424 O PRO A 100 -9.992 -12.448 -1.490 1.00 0.00 O ATOM 1425 CB PRO A 100 -8.963 -15.085 -3.404 1.00 0.00 C ATOM 1426 CG PRO A 100 -9.470 -15.982 -4.534 1.00 0.00 C ATOM 1427 CD PRO A 100 -10.908 -15.553 -4.783 1.00 0.00 C ATOM 0 HA PRO A 100 -10.334 -14.885 -1.729 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -8.317 -14.297 -3.791 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -8.374 -15.657 -2.687 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -8.864 -15.862 -5.432 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -9.418 -17.034 -4.253 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -10.973 -14.903 -5.656 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -11.542 -16.418 -4.981 1.00 0.00 H new ATOM 1435 N GLY A 101 -10.180 -12.258 -3.729 1.00 0.00 N ATOM 1436 CA GLY A 101 -10.069 -10.806 -3.767 1.00 0.00 C ATOM 1437 C GLY A 101 -11.258 -10.118 -3.085 1.00 0.00 C ATOM 1438 O GLY A 101 -11.175 -8.925 -2.809 1.00 0.00 O ATOM 0 H GLY A 101 -10.321 -12.681 -4.646 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.144 -10.501 -3.277 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -10.005 -10.475 -4.803 1.00 0.00 H new ATOM 1442 N GLY A 102 -12.330 -10.845 -2.757 1.00 0.00 N ATOM 1443 CA GLY A 102 -13.449 -10.334 -1.990 1.00 0.00 C ATOM 1444 C GLY A 102 -13.139 -10.309 -0.497 1.00 0.00 C ATOM 1445 O GLY A 102 -13.200 -9.248 0.120 1.00 0.00 O ATOM 0 H GLY A 102 -12.438 -11.823 -3.027 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -13.694 -9.327 -2.329 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -14.328 -10.953 -2.170 1.00 0.00 H new ATOM 1449 N GLN A 103 -12.847 -11.462 0.114 1.00 0.00 N ATOM 1450 CA GLN A 103 -12.782 -11.542 1.580 1.00 0.00 C ATOM 1451 C GLN A 103 -11.513 -10.934 2.179 1.00 0.00 C ATOM 1452 O GLN A 103 -11.485 -10.636 3.379 1.00 0.00 O ATOM 1453 CB GLN A 103 -12.920 -12.992 2.048 1.00 0.00 C ATOM 1454 CG GLN A 103 -14.365 -13.464 1.892 1.00 0.00 C ATOM 1455 CD GLN A 103 -14.618 -14.679 2.773 1.00 0.00 C ATOM 1456 OE1 GLN A 103 -14.301 -15.807 2.416 1.00 0.00 O ATOM 1457 NE2 GLN A 103 -15.199 -14.473 3.941 1.00 0.00 N ATOM 0 H GLN A 103 -12.655 -12.338 -0.371 1.00 0.00 H new ATOM 0 HA GLN A 103 -13.619 -10.945 1.941 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -12.256 -13.633 1.468 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -12.613 -13.076 3.091 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -15.049 -12.660 2.163 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -14.563 -13.714 0.850 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -15.456 -13.527 4.223 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -15.390 -15.260 4.561 1.00 0.00 H new ATOM 1466 N ILE A 104 -10.472 -10.747 1.368 1.00 0.00 N ATOM 1467 CA ILE A 104 -9.223 -10.111 1.772 1.00 0.00 C ATOM 1468 C ILE A 104 -9.427 -8.659 2.241 1.00 0.00 C ATOM 1469 O ILE A 104 -8.599 -8.173 3.003 1.00 0.00 O ATOM 1470 CB ILE A 104 -8.193 -10.238 0.634 1.00 0.00 C ATOM 1471 CG1 ILE A 104 -6.815 -9.726 1.090 1.00 0.00 C ATOM 1472 CG2 ILE A 104 -8.666 -9.489 -0.615 1.00 0.00 C ATOM 1473 CD1 ILE A 104 -5.711 -10.142 0.115 1.00 0.00 C ATOM 0 H ILE A 104 -10.476 -11.041 0.391 1.00 0.00 H new ATOM 0 HA ILE A 104 -8.830 -10.632 2.645 1.00 0.00 H new ATOM 0 HB ILE A 104 -8.097 -11.293 0.378 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -6.839 -8.639 1.172 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -6.591 -10.116 2.083 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -7.922 -9.593 -1.405 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -9.615 -9.907 -0.952 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -8.798 -8.433 -0.378 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.752 -9.763 0.468 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -5.671 -11.230 0.053 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -5.923 -9.730 -0.872 1.00 0.00 H new ATOM 1485 N GLU A 105 -10.521 -7.989 1.864 1.00 0.00 N ATOM 1486 CA GLU A 105 -10.909 -6.646 2.308 1.00 0.00 C ATOM 1487 C GLU A 105 -10.752 -6.516 3.829 1.00 0.00 C ATOM 1488 O GLU A 105 -10.123 -5.584 4.328 1.00 0.00 O ATOM 1489 CB GLU A 105 -12.343 -6.407 1.796 1.00 0.00 C ATOM 1490 CG GLU A 105 -13.208 -5.356 2.507 1.00 0.00 C ATOM 1491 CD GLU A 105 -12.765 -3.891 2.418 1.00 0.00 C ATOM 1492 OE1 GLU A 105 -11.562 -3.607 2.229 1.00 0.00 O ATOM 1493 OE2 GLU A 105 -13.665 -3.037 2.600 1.00 0.00 O ATOM 0 H GLU A 105 -11.193 -8.388 1.209 1.00 0.00 H new ATOM 0 HA GLU A 105 -10.262 -5.870 1.899 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -12.277 -6.127 0.745 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -12.874 -7.358 1.840 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -14.219 -5.426 2.105 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -13.265 -5.626 3.562 1.00 0.00 H new ATOM 1500 N GLY A 106 -11.227 -7.504 4.590 1.00 0.00 N ATOM 1501 CA GLY A 106 -11.086 -7.451 6.035 1.00 0.00 C ATOM 1502 C GLY A 106 -9.628 -7.538 6.499 1.00 0.00 C ATOM 1503 O GLY A 106 -9.275 -6.884 7.477 1.00 0.00 O ATOM 0 H GLY A 106 -11.703 -8.333 4.233 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -11.524 -6.523 6.403 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -11.652 -8.269 6.480 1.00 0.00 H new ATOM 1507 N ALA A 107 -8.759 -8.302 5.820 1.00 0.00 N ATOM 1508 CA ALA A 107 -7.336 -8.313 6.148 1.00 0.00 C ATOM 1509 C ALA A 107 -6.691 -6.982 5.762 1.00 0.00 C ATOM 1510 O ALA A 107 -5.777 -6.538 6.459 1.00 0.00 O ATOM 1511 CB ALA A 107 -6.609 -9.456 5.430 1.00 0.00 C ATOM 0 H ALA A 107 -9.020 -8.914 5.047 1.00 0.00 H new ATOM 0 HA ALA A 107 -7.247 -8.464 7.224 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.552 -9.438 5.694 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -7.042 -10.409 5.732 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -6.716 -9.335 4.352 1.00 0.00 H new ATOM 1517 N TYR A 108 -7.129 -6.378 4.651 1.00 0.00 N ATOM 1518 CA TYR A 108 -6.626 -5.116 4.132 1.00 0.00 C ATOM 1519 C TYR A 108 -6.842 -4.015 5.158 1.00 0.00 C ATOM 1520 O TYR A 108 -5.872 -3.431 5.638 1.00 0.00 O ATOM 1521 CB TYR A 108 -7.279 -4.754 2.781 1.00 0.00 C ATOM 1522 CG TYR A 108 -6.618 -5.316 1.562 1.00 0.00 C ATOM 1523 CD1 TYR A 108 -5.266 -5.035 1.337 1.00 0.00 C ATOM 1524 CD2 TYR A 108 -7.364 -6.031 0.615 1.00 0.00 C ATOM 1525 CE1 TYR A 108 -4.623 -5.549 0.208 1.00 0.00 C ATOM 1526 CE2 TYR A 108 -6.722 -6.560 -0.513 1.00 0.00 C ATOM 1527 CZ TYR A 108 -5.345 -6.335 -0.714 1.00 0.00 C ATOM 1528 OH TYR A 108 -4.724 -6.883 -1.789 1.00 0.00 O ATOM 0 H TYR A 108 -7.870 -6.775 4.073 1.00 0.00 H new ATOM 0 HA TYR A 108 -5.557 -5.223 3.948 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -8.315 -5.094 2.798 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -7.301 -3.668 2.690 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -4.719 -4.420 2.037 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -8.426 -6.173 0.753 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -3.576 -5.345 0.042 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -7.283 -7.141 -1.230 1.00 0.00 H new ATOM 0 HH TYR A 108 -5.373 -7.394 -2.317 1.00 0.00 H new ATOM 1538 N LEU A 109 -8.098 -3.729 5.506 1.00 0.00 N ATOM 1539 CA LEU A 109 -8.426 -2.601 6.378 1.00 0.00 C ATOM 1540 C LEU A 109 -7.960 -2.850 7.812 1.00 0.00 C ATOM 1541 O LEU A 109 -7.755 -1.892 8.556 1.00 0.00 O ATOM 1542 CB LEU A 109 -9.934 -2.329 6.374 1.00 0.00 C ATOM 1543 CG LEU A 109 -10.571 -2.175 4.981 1.00 0.00 C ATOM 1544 CD1 LEU A 109 -12.001 -1.694 5.194 1.00 0.00 C ATOM 1545 CD2 LEU A 109 -9.783 -1.286 4.006 1.00 0.00 C ATOM 0 H LEU A 109 -8.908 -4.266 5.195 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.902 -1.729 5.987 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.435 -3.144 6.896 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.124 -1.420 6.945 1.00 0.00 H new ATOM 0 HG LEU A 109 -10.556 -3.143 4.481 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -12.491 -1.571 4.228 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -12.547 -2.427 5.787 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -11.989 -0.739 5.719 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -10.308 -1.237 3.052 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -9.691 -0.283 4.422 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -8.789 -1.707 3.852 1.00 0.00 H new ATOM 1557 N ASN A 110 -7.788 -4.117 8.209 1.00 0.00 N ATOM 1558 CA ASN A 110 -7.120 -4.476 9.457 1.00 0.00 C ATOM 1559 C ASN A 110 -5.682 -3.991 9.440 1.00 0.00 C ATOM 1560 O ASN A 110 -5.273 -3.228 10.311 1.00 0.00 O ATOM 1561 CB ASN A 110 -7.114 -5.995 9.678 1.00 0.00 C ATOM 1562 CG ASN A 110 -6.513 -6.310 11.039 1.00 0.00 C ATOM 1563 OD1 ASN A 110 -7.199 -6.164 12.049 1.00 0.00 O ATOM 1564 ND2 ASN A 110 -5.249 -6.693 11.091 1.00 0.00 N ATOM 0 H ASN A 110 -8.110 -4.920 7.670 1.00 0.00 H new ATOM 0 HA ASN A 110 -7.674 -4.000 10.266 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -8.130 -6.385 9.619 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -6.538 -6.485 8.893 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -4.809 -6.879 11.992 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -4.713 -6.803 10.230 1.00 0.00 H new ATOM 1571 N ALA A 111 -4.928 -4.471 8.454 1.00 0.00 N ATOM 1572 CA ALA A 111 -3.517 -4.205 8.287 1.00 0.00 C ATOM 1573 C ALA A 111 -3.264 -2.712 8.085 1.00 0.00 C ATOM 1574 O ALA A 111 -2.226 -2.212 8.509 1.00 0.00 O ATOM 1575 CB ALA A 111 -3.043 -5.031 7.093 1.00 0.00 C ATOM 0 H ALA A 111 -5.305 -5.078 7.726 1.00 0.00 H new ATOM 0 HA ALA A 111 -2.958 -4.487 9.179 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -1.979 -4.859 6.931 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -3.214 -6.089 7.292 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -3.598 -4.735 6.203 1.00 0.00 H new ATOM 1581 N LEU A 112 -4.225 -1.993 7.496 1.00 0.00 N ATOM 1582 CA LEU A 112 -4.115 -0.583 7.143 1.00 0.00 C ATOM 1583 C LEU A 112 -3.774 0.306 8.337 1.00 0.00 C ATOM 1584 O LEU A 112 -3.277 1.403 8.118 1.00 0.00 O ATOM 1585 CB LEU A 112 -5.424 -0.102 6.468 1.00 0.00 C ATOM 1586 CG LEU A 112 -5.333 1.013 5.420 1.00 0.00 C ATOM 1587 CD1 LEU A 112 -4.106 0.913 4.534 1.00 0.00 C ATOM 1588 CD2 LEU A 112 -6.525 1.036 4.450 1.00 0.00 C ATOM 0 H LEU A 112 -5.129 -2.394 7.246 1.00 0.00 H new ATOM 0 HA LEU A 112 -3.285 -0.494 6.442 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -5.891 -0.966 5.995 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.099 0.235 7.254 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.303 1.913 6.035 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -4.107 1.734 3.817 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -3.208 0.970 5.149 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -4.120 -0.037 3.999 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -6.397 1.849 3.735 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -6.577 0.088 3.915 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.447 1.188 5.011 1.00 0.00 H new ATOM 1600 N THR A 113 -4.016 -0.113 9.585 1.00 0.00 N ATOM 1601 CA THR A 113 -3.634 0.723 10.718 1.00 0.00 C ATOM 1602 C THR A 113 -2.173 0.496 11.142 1.00 0.00 C ATOM 1603 O THR A 113 -1.583 1.371 11.774 1.00 0.00 O ATOM 1604 CB THR A 113 -4.623 0.538 11.880 1.00 0.00 C ATOM 1605 OG1 THR A 113 -4.485 -0.710 12.521 1.00 0.00 O ATOM 1606 CG2 THR A 113 -6.082 0.685 11.434 1.00 0.00 C ATOM 0 H THR A 113 -4.461 -0.998 9.827 1.00 0.00 H new ATOM 0 HA THR A 113 -3.689 1.765 10.402 1.00 0.00 H new ATOM 0 HB THR A 113 -4.373 1.332 12.583 1.00 0.00 H new ATOM 0 HG1 THR A 113 -5.135 -0.776 13.252 1.00 0.00 H new ATOM 0 HG21 THR A 113 -6.740 0.546 12.291 1.00 0.00 H new ATOM 0 HG22 THR A 113 -6.236 1.680 11.016 1.00 0.00 H new ATOM 0 HG23 THR A 113 -6.308 -0.066 10.677 1.00 0.00 H new ATOM 1614 N HIS A 114 -1.574 -0.659 10.833 1.00 0.00 N ATOM 1615 CA HIS A 114 -0.310 -1.140 11.399 1.00 0.00 C ATOM 1616 C HIS A 114 0.874 -0.765 10.512 1.00 0.00 C ATOM 1617 O HIS A 114 1.806 -1.554 10.348 1.00 0.00 O ATOM 1618 CB HIS A 114 -0.399 -2.655 11.653 1.00 0.00 C ATOM 1619 CG HIS A 114 -1.288 -2.983 12.814 1.00 0.00 C ATOM 1620 ND1 HIS A 114 -0.883 -3.117 14.122 1.00 0.00 N ATOM 1621 CD2 HIS A 114 -2.638 -3.182 12.762 1.00 0.00 C ATOM 1622 CE1 HIS A 114 -1.970 -3.396 14.853 1.00 0.00 C ATOM 1623 NE2 HIS A 114 -3.065 -3.440 14.069 1.00 0.00 N ATOM 0 H HIS A 114 -1.972 -1.309 10.155 1.00 0.00 H new ATOM 0 HA HIS A 114 -0.138 -0.649 12.357 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -0.776 -3.150 10.758 1.00 0.00 H new ATOM 0 HB3 HIS A 114 0.600 -3.050 11.839 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -3.259 -3.147 11.879 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -1.969 -3.562 15.920 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -4.022 -3.626 14.371 1.00 0.00 H new ATOM 1631 N ILE A 115 0.836 0.431 9.925 1.00 0.00 N ATOM 1632 CA ILE A 115 1.917 0.985 9.141 1.00 0.00 C ATOM 1633 C ILE A 115 2.959 1.439 10.164 1.00 0.00 C ATOM 1634 O ILE A 115 2.988 2.603 10.564 1.00 0.00 O ATOM 1635 CB ILE A 115 1.413 2.138 8.236 1.00 0.00 C ATOM 1636 CG1 ILE A 115 0.032 1.922 7.574 1.00 0.00 C ATOM 1637 CG2 ILE A 115 2.501 2.432 7.193 1.00 0.00 C ATOM 1638 CD1 ILE A 115 -0.170 0.609 6.813 1.00 0.00 C ATOM 0 H ILE A 115 0.028 1.050 9.989 1.00 0.00 H new ATOM 0 HA ILE A 115 2.348 0.261 8.450 1.00 0.00 H new ATOM 0 HB ILE A 115 1.238 2.996 8.885 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -0.731 1.986 8.350 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -0.146 2.746 6.883 1.00 0.00 H new ATOM 0 HG21 ILE A 115 2.171 3.241 6.542 1.00 0.00 H new ATOM 0 HG22 ILE A 115 3.421 2.725 7.699 1.00 0.00 H new ATOM 0 HG23 ILE A 115 2.684 1.538 6.597 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -1.177 0.581 6.397 1.00 0.00 H new ATOM 0 HD12 ILE A 115 0.558 0.541 6.005 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -0.035 -0.231 7.494 1.00 0.00 H new ATOM 1650 N ASP A 116 3.757 0.508 10.680 1.00 0.00 N ATOM 1651 CA ASP A 116 4.806 0.856 11.630 1.00 0.00 C ATOM 1652 C ASP A 116 6.018 1.412 10.888 1.00 0.00 C ATOM 1653 O ASP A 116 6.718 2.282 11.397 1.00 0.00 O ATOM 1654 CB ASP A 116 5.201 -0.337 12.499 1.00 0.00 C ATOM 1655 CG ASP A 116 5.700 0.185 13.845 1.00 0.00 C ATOM 1656 OD1 ASP A 116 4.835 0.549 14.676 1.00 0.00 O ATOM 1657 OD2 ASP A 116 6.929 0.299 14.038 1.00 0.00 O ATOM 0 H ASP A 116 3.697 -0.486 10.458 1.00 0.00 H new ATOM 0 HA ASP A 116 4.416 1.624 12.297 1.00 0.00 H new ATOM 0 HB2 ASP A 116 4.347 -0.999 12.643 1.00 0.00 H new ATOM 0 HB3 ASP A 116 5.979 -0.922 12.008 1.00 0.00 H new ATOM 1662 N ARG A 117 6.230 0.950 9.654 1.00 0.00 N ATOM 1663 CA ARG A 117 7.342 1.267 8.765 1.00 0.00 C ATOM 1664 C ARG A 117 6.803 1.593 7.373 1.00 0.00 C ATOM 1665 O ARG A 117 5.607 1.454 7.109 1.00 0.00 O ATOM 1666 CB ARG A 117 8.280 0.064 8.730 1.00 0.00 C ATOM 1667 CG ARG A 117 9.050 -0.083 10.040 1.00 0.00 C ATOM 1668 CD ARG A 117 10.009 -1.266 9.914 1.00 0.00 C ATOM 1669 NE ARG A 117 9.249 -2.522 9.938 1.00 0.00 N ATOM 1670 CZ ARG A 117 9.525 -3.644 10.603 1.00 0.00 C ATOM 1671 NH1 ARG A 117 10.676 -3.859 11.229 1.00 0.00 N ATOM 1672 NH2 ARG A 117 8.595 -4.580 10.638 1.00 0.00 N ATOM 0 H ARG A 117 5.578 0.296 9.221 1.00 0.00 H new ATOM 0 HA ARG A 117 7.892 2.138 9.122 1.00 0.00 H new ATOM 0 HB2 ARG A 117 7.704 -0.842 8.541 1.00 0.00 H new ATOM 0 HB3 ARG A 117 8.983 0.173 7.904 1.00 0.00 H new ATOM 0 HG2 ARG A 117 9.603 0.831 10.258 1.00 0.00 H new ATOM 0 HG3 ARG A 117 8.360 -0.243 10.868 1.00 0.00 H new ATOM 0 HD2 ARG A 117 10.576 -1.190 8.986 1.00 0.00 H new ATOM 0 HD3 ARG A 117 10.731 -1.250 10.731 1.00 0.00 H new ATOM 0 HE ARG A 117 8.400 -2.538 9.373 1.00 0.00 H new ATOM 0 HH11 ARG A 117 11.404 -3.145 11.216 1.00 0.00 H new ATOM 0 HH12 ARG A 117 10.832 -4.738 11.723 1.00 0.00 H new ATOM 0 HH21 ARG A 117 7.703 -4.431 10.166 1.00 0.00 H new ATOM 0 HH22 ARG A 117 8.768 -5.453 11.137 1.00 0.00 H new ATOM 1686 N THR A 118 7.666 2.033 6.461 1.00 0.00 N ATOM 1687 CA THR A 118 7.234 2.529 5.162 1.00 0.00 C ATOM 1688 C THR A 118 8.394 2.477 4.159 1.00 0.00 C ATOM 1689 O THR A 118 9.503 2.063 4.510 1.00 0.00 O ATOM 1690 CB THR A 118 6.664 3.944 5.395 1.00 0.00 C ATOM 1691 OG1 THR A 118 5.851 4.369 4.320 1.00 0.00 O ATOM 1692 CG2 THR A 118 7.762 4.972 5.671 1.00 0.00 C ATOM 0 H THR A 118 8.676 2.055 6.602 1.00 0.00 H new ATOM 0 HA THR A 118 6.454 1.910 4.718 1.00 0.00 H new ATOM 0 HB THR A 118 6.040 3.876 6.286 1.00 0.00 H new ATOM 0 HG1 THR A 118 5.638 5.320 4.427 1.00 0.00 H new ATOM 0 HG21 THR A 118 7.312 5.952 5.828 1.00 0.00 H new ATOM 0 HG22 THR A 118 8.318 4.681 6.562 1.00 0.00 H new ATOM 0 HG23 THR A 118 8.441 5.017 4.819 1.00 0.00 H new ATOM 1700 N GLY A 119 8.140 2.915 2.922 1.00 0.00 N ATOM 1701 CA GLY A 119 9.160 3.101 1.910 1.00 0.00 C ATOM 1702 C GLY A 119 8.608 3.783 0.657 1.00 0.00 C ATOM 1703 O GLY A 119 8.265 3.108 -0.313 1.00 0.00 O ATOM 0 H GLY A 119 7.201 3.151 2.600 1.00 0.00 H new ATOM 0 HA2 GLY A 119 9.973 3.700 2.321 1.00 0.00 H new ATOM 0 HA3 GLY A 119 9.583 2.133 1.639 1.00 0.00 H new ATOM 1707 N VAL A 120 8.532 5.117 0.623 1.00 0.00 N ATOM 1708 CA VAL A 120 8.187 5.840 -0.608 1.00 0.00 C ATOM 1709 C VAL A 120 9.457 6.142 -1.407 1.00 0.00 C ATOM 1710 O VAL A 120 10.405 6.778 -0.927 1.00 0.00 O ATOM 1711 CB VAL A 120 7.205 7.005 -0.394 1.00 0.00 C ATOM 1712 CG1 VAL A 120 7.555 7.864 0.815 1.00 0.00 C ATOM 1713 CG2 VAL A 120 7.069 7.825 -1.691 1.00 0.00 C ATOM 0 H VAL A 120 8.704 5.717 1.430 1.00 0.00 H new ATOM 0 HA VAL A 120 7.588 5.191 -1.247 1.00 0.00 H new ATOM 0 HB VAL A 120 6.229 6.581 -0.159 1.00 0.00 H new ATOM 0 HG11 VAL A 120 6.826 8.668 0.913 1.00 0.00 H new ATOM 0 HG12 VAL A 120 7.540 7.249 1.715 1.00 0.00 H new ATOM 0 HG13 VAL A 120 8.550 8.290 0.683 1.00 0.00 H new ATOM 0 HG21 VAL A 120 6.372 8.647 -1.530 1.00 0.00 H new ATOM 0 HG22 VAL A 120 8.043 8.225 -1.973 1.00 0.00 H new ATOM 0 HG23 VAL A 120 6.695 7.184 -2.489 1.00 0.00 H new ATOM 1723 N GLN A 121 9.486 5.634 -2.641 1.00 0.00 N ATOM 1724 CA GLN A 121 10.533 5.872 -3.613 1.00 0.00 C ATOM 1725 C GLN A 121 10.116 7.114 -4.406 1.00 0.00 C ATOM 1726 O GLN A 121 9.305 7.034 -5.335 1.00 0.00 O ATOM 1727 CB GLN A 121 10.656 4.626 -4.506 1.00 0.00 C ATOM 1728 CG GLN A 121 11.833 4.726 -5.486 1.00 0.00 C ATOM 1729 CD GLN A 121 11.802 3.717 -6.632 1.00 0.00 C ATOM 1730 OE1 GLN A 121 12.847 3.356 -7.173 1.00 0.00 O ATOM 1731 NE2 GLN A 121 10.626 3.303 -7.065 1.00 0.00 N ATOM 0 H GLN A 121 8.749 5.024 -2.995 1.00 0.00 H new ATOM 0 HA GLN A 121 11.508 6.046 -3.158 1.00 0.00 H new ATOM 0 HB2 GLN A 121 10.782 3.743 -3.879 1.00 0.00 H new ATOM 0 HB3 GLN A 121 9.731 4.490 -5.066 1.00 0.00 H new ATOM 0 HG2 GLN A 121 11.852 5.731 -5.907 1.00 0.00 H new ATOM 0 HG3 GLN A 121 12.762 4.595 -4.931 1.00 0.00 H new ATOM 0 HE21 GLN A 121 9.773 3.615 -6.601 1.00 0.00 H new ATOM 0 HE22 GLN A 121 10.570 2.671 -7.864 1.00 0.00 H new ATOM 1740 N MET A 122 10.620 8.287 -4.029 1.00 0.00 N ATOM 1741 CA MET A 122 10.357 9.539 -4.733 1.00 0.00 C ATOM 1742 C MET A 122 11.400 9.691 -5.843 1.00 0.00 C ATOM 1743 O MET A 122 12.197 10.631 -5.881 1.00 0.00 O ATOM 1744 CB MET A 122 10.296 10.678 -3.707 1.00 0.00 C ATOM 1745 CG MET A 122 9.847 12.036 -4.258 1.00 0.00 C ATOM 1746 SD MET A 122 8.180 12.130 -4.965 1.00 0.00 S ATOM 1747 CE MET A 122 7.138 11.599 -3.578 1.00 0.00 C ATOM 0 H MET A 122 11.229 8.396 -3.218 1.00 0.00 H new ATOM 0 HA MET A 122 9.389 9.557 -5.234 1.00 0.00 H new ATOM 0 HB2 MET A 122 9.616 10.387 -2.906 1.00 0.00 H new ATOM 0 HB3 MET A 122 11.283 10.795 -3.260 1.00 0.00 H new ATOM 0 HG2 MET A 122 9.914 12.767 -3.452 1.00 0.00 H new ATOM 0 HG3 MET A 122 10.558 12.341 -5.026 1.00 0.00 H new ATOM 0 HE1 MET A 122 6.092 11.797 -3.812 1.00 0.00 H new ATOM 0 HE2 MET A 122 7.276 10.531 -3.407 1.00 0.00 H new ATOM 0 HE3 MET A 122 7.419 12.149 -2.680 1.00 0.00 H new ATOM 1757 N ARG A 123 11.403 8.723 -6.758 1.00 0.00 N ATOM 1758 CA ARG A 123 12.143 8.689 -8.003 1.00 0.00 C ATOM 1759 C ARG A 123 11.324 7.789 -8.916 1.00 0.00 C ATOM 1760 O ARG A 123 10.830 6.760 -8.453 1.00 0.00 O ATOM 1761 CB ARG A 123 13.526 8.092 -7.753 1.00 0.00 C ATOM 1762 CG ARG A 123 14.484 8.485 -8.881 1.00 0.00 C ATOM 1763 CD ARG A 123 15.627 7.488 -8.965 1.00 0.00 C ATOM 1764 NE ARG A 123 16.433 7.436 -7.736 1.00 0.00 N ATOM 1765 CZ ARG A 123 17.710 7.055 -7.629 1.00 0.00 C ATOM 1766 NH1 ARG A 123 18.463 6.807 -8.694 1.00 0.00 N ATOM 1767 NH2 ARG A 123 18.235 6.918 -6.424 1.00 0.00 N ATOM 0 H ARG A 123 10.842 7.880 -6.631 1.00 0.00 H new ATOM 0 HA ARG A 123 12.291 9.677 -8.439 1.00 0.00 H new ATOM 0 HB2 ARG A 123 13.914 8.444 -6.797 1.00 0.00 H new ATOM 0 HB3 ARG A 123 13.455 7.006 -7.688 1.00 0.00 H new ATOM 0 HG2 ARG A 123 13.948 8.517 -9.830 1.00 0.00 H new ATOM 0 HG3 ARG A 123 14.877 9.486 -8.703 1.00 0.00 H new ATOM 0 HD2 ARG A 123 15.223 6.497 -9.171 1.00 0.00 H new ATOM 0 HD3 ARG A 123 16.271 7.751 -9.805 1.00 0.00 H new ATOM 0 HE ARG A 123 15.968 7.721 -6.874 1.00 0.00 H new ATOM 0 HH11 ARG A 123 18.070 6.905 -9.630 1.00 0.00 H new ATOM 0 HH12 ARG A 123 19.434 6.518 -8.576 1.00 0.00 H new ATOM 0 HH21 ARG A 123 17.668 7.102 -5.597 1.00 0.00 H new ATOM 0 HH22 ARG A 123 19.208 6.628 -6.321 1.00 0.00 H new ATOM 1781 N ALA A 124 11.129 8.169 -10.175 1.00 0.00 N ATOM 1782 CA ALA A 124 10.445 7.326 -11.125 1.00 0.00 C ATOM 1783 C ALA A 124 11.253 6.036 -11.371 1.00 0.00 C ATOM 1784 O ALA A 124 12.491 6.084 -11.303 1.00 0.00 O ATOM 1785 CB ALA A 124 10.198 8.131 -12.395 1.00 0.00 C ATOM 0 H ALA A 124 11.441 9.063 -10.554 1.00 0.00 H new ATOM 0 HA ALA A 124 9.477 7.007 -10.738 1.00 0.00 H new ATOM 0 HB1 ALA A 124 9.681 7.509 -13.125 1.00 0.00 H new ATOM 0 HB2 ALA A 124 9.585 9.001 -12.161 1.00 0.00 H new ATOM 0 HB3 ALA A 124 11.151 8.460 -12.809 1.00 0.00 H new ATOM 1791 N PRO A 125 10.604 4.904 -11.696 1.00 0.00 N ATOM 1792 CA PRO A 125 9.158 4.712 -11.672 1.00 0.00 C ATOM 1793 C PRO A 125 8.648 4.706 -10.229 1.00 0.00 C ATOM 1794 O PRO A 125 9.097 3.900 -9.414 1.00 0.00 O ATOM 1795 CB PRO A 125 8.919 3.357 -12.347 1.00 0.00 C ATOM 1796 CG PRO A 125 10.205 2.580 -12.075 1.00 0.00 C ATOM 1797 CD PRO A 125 11.266 3.677 -12.115 1.00 0.00 C ATOM 0 HA PRO A 125 8.627 5.513 -12.186 1.00 0.00 H new ATOM 0 HB2 PRO A 125 8.050 2.850 -11.929 1.00 0.00 H new ATOM 0 HB3 PRO A 125 8.739 3.469 -13.416 1.00 0.00 H new ATOM 0 HG2 PRO A 125 10.178 2.076 -11.109 1.00 0.00 H new ATOM 0 HG3 PRO A 125 10.384 1.814 -12.830 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.097 3.438 -11.451 1.00 0.00 H new ATOM 0 HD3 PRO A 125 11.679 3.782 -13.118 1.00 0.00 H new ATOM 1805 N GLN A 126 7.769 5.649 -9.882 1.00 0.00 N ATOM 1806 CA GLN A 126 7.413 5.888 -8.495 1.00 0.00 C ATOM 1807 C GLN A 126 6.543 4.738 -8.015 1.00 0.00 C ATOM 1808 O GLN A 126 5.532 4.376 -8.628 1.00 0.00 O ATOM 1809 CB GLN A 126 6.716 7.236 -8.308 1.00 0.00 C ATOM 1810 CG GLN A 126 7.620 8.397 -8.730 1.00 0.00 C ATOM 1811 CD GLN A 126 6.926 9.733 -8.543 1.00 0.00 C ATOM 1812 OE1 GLN A 126 6.164 10.196 -9.379 1.00 0.00 O ATOM 1813 NE2 GLN A 126 7.201 10.415 -7.453 1.00 0.00 N ATOM 0 H GLN A 126 7.294 6.257 -10.549 1.00 0.00 H new ATOM 0 HA GLN A 126 8.322 5.934 -7.895 1.00 0.00 H new ATOM 0 HB2 GLN A 126 5.798 7.257 -8.895 1.00 0.00 H new ATOM 0 HB3 GLN A 126 6.430 7.357 -7.263 1.00 0.00 H new ATOM 0 HG2 GLN A 126 8.539 8.377 -8.144 1.00 0.00 H new ATOM 0 HG3 GLN A 126 7.906 8.277 -9.775 1.00 0.00 H new ATOM 0 HE21 GLN A 126 7.837 10.028 -6.756 1.00 0.00 H new ATOM 0 HE22 GLN A 126 6.778 11.331 -7.304 1.00 0.00 H new ATOM 1822 N GLN A 127 6.967 4.164 -6.901 1.00 0.00 N ATOM 1823 CA GLN A 127 6.350 3.038 -6.230 1.00 0.00 C ATOM 1824 C GLN A 127 6.494 3.294 -4.728 1.00 0.00 C ATOM 1825 O GLN A 127 7.308 4.121 -4.298 1.00 0.00 O ATOM 1826 CB GLN A 127 6.997 1.713 -6.690 1.00 0.00 C ATOM 1827 CG GLN A 127 6.603 1.353 -8.136 1.00 0.00 C ATOM 1828 CD GLN A 127 7.216 0.048 -8.634 1.00 0.00 C ATOM 1829 OE1 GLN A 127 8.379 0.009 -9.029 1.00 0.00 O ATOM 1830 NE2 GLN A 127 6.472 -1.046 -8.676 1.00 0.00 N ATOM 0 H GLN A 127 7.801 4.493 -6.414 1.00 0.00 H new ATOM 0 HA GLN A 127 5.293 2.940 -6.478 1.00 0.00 H new ATOM 0 HB2 GLN A 127 8.082 1.795 -6.619 1.00 0.00 H new ATOM 0 HB3 GLN A 127 6.693 0.909 -6.020 1.00 0.00 H new ATOM 0 HG2 GLN A 127 5.517 1.281 -8.200 1.00 0.00 H new ATOM 0 HG3 GLN A 127 6.908 2.163 -8.798 1.00 0.00 H new ATOM 0 HE21 GLN A 127 5.506 -1.019 -8.349 1.00 0.00 H new ATOM 0 HE22 GLN A 127 6.865 -1.916 -9.035 1.00 0.00 H new ATOM 1839 N MET A 128 5.662 2.633 -3.933 1.00 0.00 N ATOM 1840 CA MET A 128 5.443 2.966 -2.536 1.00 0.00 C ATOM 1841 C MET A 128 5.287 1.650 -1.786 1.00 0.00 C ATOM 1842 O MET A 128 4.282 0.958 -1.941 1.00 0.00 O ATOM 1843 CB MET A 128 4.220 3.888 -2.440 1.00 0.00 C ATOM 1844 CG MET A 128 3.900 4.328 -1.012 1.00 0.00 C ATOM 1845 SD MET A 128 2.407 5.342 -0.797 1.00 0.00 S ATOM 1846 CE MET A 128 1.194 4.325 -1.672 1.00 0.00 C ATOM 0 H MET A 128 5.111 1.835 -4.250 1.00 0.00 H new ATOM 0 HA MET A 128 6.272 3.512 -2.086 1.00 0.00 H new ATOM 0 HB2 MET A 128 4.392 4.772 -3.054 1.00 0.00 H new ATOM 0 HB3 MET A 128 3.354 3.374 -2.856 1.00 0.00 H new ATOM 0 HG2 MET A 128 3.800 3.436 -0.394 1.00 0.00 H new ATOM 0 HG3 MET A 128 4.752 4.888 -0.628 1.00 0.00 H new ATOM 0 HE1 MET A 128 0.214 4.800 -1.618 1.00 0.00 H new ATOM 0 HE2 MET A 128 1.491 4.222 -2.716 1.00 0.00 H new ATOM 0 HE3 MET A 128 1.145 3.339 -1.210 1.00 0.00 H new ATOM 1856 N GLN A 129 6.322 1.249 -1.047 1.00 0.00 N ATOM 1857 CA GLN A 129 6.176 0.257 0.006 1.00 0.00 C ATOM 1858 C GLN A 129 5.386 0.883 1.141 1.00 0.00 C ATOM 1859 O GLN A 129 5.585 2.050 1.488 1.00 0.00 O ATOM 1860 CB GLN A 129 7.539 -0.224 0.549 1.00 0.00 C ATOM 1861 CG GLN A 129 8.063 -1.376 -0.301 1.00 0.00 C ATOM 1862 CD GLN A 129 9.366 -2.008 0.192 1.00 0.00 C ATOM 1863 OE1 GLN A 129 9.858 -1.754 1.287 1.00 0.00 O ATOM 1864 NE2 GLN A 129 9.952 -2.870 -0.621 1.00 0.00 N ATOM 0 H GLN A 129 7.272 1.601 -1.163 1.00 0.00 H new ATOM 0 HA GLN A 129 5.663 -0.611 -0.410 1.00 0.00 H new ATOM 0 HB2 GLN A 129 8.254 0.599 0.541 1.00 0.00 H new ATOM 0 HB3 GLN A 129 7.434 -0.545 1.585 1.00 0.00 H new ATOM 0 HG2 GLN A 129 7.297 -2.150 -0.347 1.00 0.00 H new ATOM 0 HG3 GLN A 129 8.215 -1.016 -1.319 1.00 0.00 H new ATOM 0 HE21 GLN A 129 9.538 -3.077 -1.530 1.00 0.00 H new ATOM 0 HE22 GLN A 129 10.819 -3.329 -0.339 1.00 0.00 H new ATOM 1873 N LEU A 130 4.563 0.065 1.778 1.00 0.00 N ATOM 1874 CA LEU A 130 4.218 0.192 3.177 1.00 0.00 C ATOM 1875 C LEU A 130 4.775 -1.072 3.830 1.00 0.00 C ATOM 1876 O LEU A 130 4.928 -2.087 3.136 1.00 0.00 O ATOM 1877 CB LEU A 130 2.697 0.304 3.316 1.00 0.00 C ATOM 1878 CG LEU A 130 2.098 1.591 2.710 1.00 0.00 C ATOM 1879 CD1 LEU A 130 0.580 1.575 2.897 1.00 0.00 C ATOM 1880 CD2 LEU A 130 2.651 2.889 3.309 1.00 0.00 C ATOM 0 H LEU A 130 4.107 -0.725 1.321 1.00 0.00 H new ATOM 0 HA LEU A 130 4.630 1.082 3.652 1.00 0.00 H new ATOM 0 HB2 LEU A 130 2.235 -0.559 2.836 1.00 0.00 H new ATOM 0 HB3 LEU A 130 2.436 0.258 4.373 1.00 0.00 H new ATOM 0 HG LEU A 130 2.381 1.588 1.657 1.00 0.00 H new ATOM 0 HD11 LEU A 130 0.151 2.482 2.471 1.00 0.00 H new ATOM 0 HD12 LEU A 130 0.161 0.704 2.393 1.00 0.00 H new ATOM 0 HD13 LEU A 130 0.345 1.528 3.960 1.00 0.00 H new ATOM 0 HD21 LEU A 130 2.177 3.743 2.826 1.00 0.00 H new ATOM 0 HD22 LEU A 130 2.442 2.914 4.378 1.00 0.00 H new ATOM 0 HD23 LEU A 130 3.728 2.934 3.149 1.00 0.00 H new ATOM 1892 N VAL A 131 5.124 -1.011 5.116 1.00 0.00 N ATOM 1893 CA VAL A 131 5.736 -2.129 5.822 1.00 0.00 C ATOM 1894 C VAL A 131 5.050 -2.258 7.178 1.00 0.00 C ATOM 1895 O VAL A 131 5.057 -1.321 7.983 1.00 0.00 O ATOM 1896 CB VAL A 131 7.260 -1.915 5.928 1.00 0.00 C ATOM 1897 CG1 VAL A 131 7.979 -2.926 6.833 1.00 0.00 C ATOM 1898 CG2 VAL A 131 7.944 -1.991 4.562 1.00 0.00 C ATOM 0 H VAL A 131 4.989 -0.182 5.695 1.00 0.00 H new ATOM 0 HA VAL A 131 5.601 -3.066 5.282 1.00 0.00 H new ATOM 0 HB VAL A 131 7.345 -0.920 6.365 1.00 0.00 H new ATOM 0 HG11 VAL A 131 9.046 -2.704 6.851 1.00 0.00 H new ATOM 0 HG12 VAL A 131 7.577 -2.859 7.844 1.00 0.00 H new ATOM 0 HG13 VAL A 131 7.825 -3.934 6.447 1.00 0.00 H new ATOM 0 HG21 VAL A 131 9.016 -1.835 4.683 1.00 0.00 H new ATOM 0 HG22 VAL A 131 7.768 -2.972 4.121 1.00 0.00 H new ATOM 0 HG23 VAL A 131 7.537 -1.220 3.908 1.00 0.00 H new ATOM 1908 N LEU A 132 4.436 -3.414 7.438 1.00 0.00 N ATOM 1909 CA LEU A 132 3.790 -3.645 8.722 1.00 0.00 C ATOM 1910 C LEU A 132 4.816 -3.795 9.830 1.00 0.00 C ATOM 1911 O LEU A 132 5.986 -4.123 9.623 1.00 0.00 O ATOM 1912 CB LEU A 132 2.864 -4.875 8.702 1.00 0.00 C ATOM 1913 CG LEU A 132 1.360 -4.559 8.718 1.00 0.00 C ATOM 1914 CD1 LEU A 132 0.892 -3.602 7.618 1.00 0.00 C ATOM 1915 CD2 LEU A 132 0.533 -5.841 8.609 1.00 0.00 C ATOM 0 H LEU A 132 4.375 -4.193 6.783 1.00 0.00 H new ATOM 0 HA LEU A 132 3.174 -2.767 8.918 1.00 0.00 H new ATOM 0 HB2 LEU A 132 3.086 -5.463 7.812 1.00 0.00 H new ATOM 0 HB3 LEU A 132 3.097 -5.500 9.564 1.00 0.00 H new ATOM 0 HG LEU A 132 1.202 -4.059 9.673 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -0.182 -3.439 7.710 1.00 0.00 H new ATOM 0 HD12 LEU A 132 1.413 -2.650 7.718 1.00 0.00 H new ATOM 0 HD13 LEU A 132 1.111 -4.035 6.642 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -0.528 -5.592 8.622 1.00 0.00 H new ATOM 0 HD22 LEU A 132 0.774 -6.351 7.677 1.00 0.00 H new ATOM 0 HD23 LEU A 132 0.763 -6.495 9.450 1.00 0.00 H new ATOM 1927 N ASP A 133 4.280 -3.705 11.036 1.00 0.00 N ATOM 1928 CA ASP A 133 4.940 -3.965 12.312 1.00 0.00 C ATOM 1929 C ASP A 133 5.584 -5.357 12.332 1.00 0.00 C ATOM 1930 O ASP A 133 6.705 -5.550 12.796 1.00 0.00 O ATOM 1931 CB ASP A 133 3.866 -3.850 13.403 1.00 0.00 C ATOM 1932 CG ASP A 133 4.420 -3.655 14.811 1.00 0.00 C ATOM 1933 OD1 ASP A 133 5.625 -3.872 15.043 1.00 0.00 O ATOM 1934 OD2 ASP A 133 3.614 -3.220 15.662 1.00 0.00 O ATOM 0 H ASP A 133 3.306 -3.430 11.162 1.00 0.00 H new ATOM 0 HA ASP A 133 5.743 -3.247 12.477 1.00 0.00 H new ATOM 0 HB2 ASP A 133 3.210 -3.013 13.164 1.00 0.00 H new ATOM 0 HB3 ASP A 133 3.252 -4.750 13.388 1.00 0.00 H new ATOM 1939 N ASN A 134 4.921 -6.336 11.708 1.00 0.00 N ATOM 1940 CA ASN A 134 5.366 -7.724 11.714 1.00 0.00 C ATOM 1941 C ASN A 134 6.442 -7.942 10.658 1.00 0.00 C ATOM 1942 O ASN A 134 7.027 -9.019 10.635 1.00 0.00 O ATOM 1943 CB ASN A 134 4.219 -8.718 11.444 1.00 0.00 C ATOM 1944 CG ASN A 134 2.895 -8.315 12.068 1.00 0.00 C ATOM 1945 OD1 ASN A 134 2.627 -8.533 13.242 1.00 0.00 O ATOM 1946 ND2 ASN A 134 2.041 -7.702 11.266 1.00 0.00 N ATOM 0 H ASN A 134 4.059 -6.183 11.185 1.00 0.00 H new ATOM 0 HA ASN A 134 5.759 -7.912 12.713 1.00 0.00 H new ATOM 0 HB2 ASN A 134 4.086 -8.820 10.367 1.00 0.00 H new ATOM 0 HB3 ASN A 134 4.505 -9.699 11.824 1.00 0.00 H new ATOM 0 HD21 ASN A 134 1.135 -7.399 11.622 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.289 -7.532 10.291 1.00 0.00 H new ATOM 1953 N GLY A 135 6.658 -6.976 9.755 1.00 0.00 N ATOM 1954 CA GLY A 135 7.613 -7.082 8.665 1.00 0.00 C ATOM 1955 C GLY A 135 6.971 -7.342 7.302 1.00 0.00 C ATOM 1956 O GLY A 135 7.679 -7.706 6.363 1.00 0.00 O ATOM 0 H GLY A 135 6.160 -6.086 9.770 1.00 0.00 H new ATOM 0 HA2 GLY A 135 8.193 -6.161 8.613 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.313 -7.888 8.885 1.00 0.00 H new ATOM 1960 N ASP A 136 5.643 -7.206 7.168 1.00 0.00 N ATOM 1961 CA ASP A 136 4.985 -7.322 5.859 1.00 0.00 C ATOM 1962 C ASP A 136 5.487 -6.223 4.901 1.00 0.00 C ATOM 1963 O ASP A 136 6.186 -5.301 5.326 1.00 0.00 O ATOM 1964 CB ASP A 136 3.452 -7.404 6.040 1.00 0.00 C ATOM 1965 CG ASP A 136 2.584 -6.272 5.477 1.00 0.00 C ATOM 1966 OD1 ASP A 136 3.025 -5.110 5.343 1.00 0.00 O ATOM 1967 OD2 ASP A 136 1.397 -6.593 5.273 1.00 0.00 O ATOM 0 H ASP A 136 5.008 -7.017 7.944 1.00 0.00 H new ATOM 0 HA ASP A 136 5.261 -8.256 5.370 1.00 0.00 H new ATOM 0 HB2 ASP A 136 3.115 -8.336 5.587 1.00 0.00 H new ATOM 0 HB3 ASP A 136 3.248 -7.477 7.108 1.00 0.00 H new ATOM 1972 N THR A 137 5.223 -6.325 3.595 1.00 0.00 N ATOM 1973 CA THR A 137 5.731 -5.376 2.608 1.00 0.00 C ATOM 1974 C THR A 137 4.765 -5.287 1.423 1.00 0.00 C ATOM 1975 O THR A 137 4.761 -6.155 0.542 1.00 0.00 O ATOM 1976 CB THR A 137 7.146 -5.797 2.173 1.00 0.00 C ATOM 1977 OG1 THR A 137 7.975 -6.014 3.301 1.00 0.00 O ATOM 1978 CG2 THR A 137 7.791 -4.732 1.290 1.00 0.00 C ATOM 0 H THR A 137 4.651 -7.069 3.195 1.00 0.00 H new ATOM 0 HA THR A 137 5.799 -4.380 3.046 1.00 0.00 H new ATOM 0 HB THR A 137 7.046 -6.723 1.607 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.869 -6.282 3.003 1.00 0.00 H new ATOM 0 HG21 THR A 137 8.790 -5.057 0.998 1.00 0.00 H new ATOM 0 HG22 THR A 137 7.183 -4.582 0.398 1.00 0.00 H new ATOM 0 HG23 THR A 137 7.861 -3.795 1.843 1.00 0.00 H new ATOM 1986 N LEU A 138 3.913 -4.261 1.384 1.00 0.00 N ATOM 1987 CA LEU A 138 3.029 -4.044 0.236 1.00 0.00 C ATOM 1988 C LEU A 138 3.819 -3.411 -0.914 1.00 0.00 C ATOM 1989 O LEU A 138 4.940 -2.926 -0.729 1.00 0.00 O ATOM 1990 CB LEU A 138 1.775 -3.233 0.628 1.00 0.00 C ATOM 1991 CG LEU A 138 0.676 -4.115 1.265 1.00 0.00 C ATOM 1992 CD1 LEU A 138 1.069 -4.623 2.653 1.00 0.00 C ATOM 1993 CD2 LEU A 138 -0.635 -3.345 1.435 1.00 0.00 C ATOM 0 H LEU A 138 3.816 -3.571 2.129 1.00 0.00 H new ATOM 0 HA LEU A 138 2.655 -5.007 -0.113 1.00 0.00 H new ATOM 0 HB2 LEU A 138 2.058 -2.448 1.329 1.00 0.00 H new ATOM 0 HB3 LEU A 138 1.373 -2.740 -0.257 1.00 0.00 H new ATOM 0 HG LEU A 138 0.551 -4.953 0.579 1.00 0.00 H new ATOM 0 HD11 LEU A 138 0.264 -5.237 3.057 1.00 0.00 H new ATOM 0 HD12 LEU A 138 1.978 -5.220 2.578 1.00 0.00 H new ATOM 0 HD13 LEU A 138 1.245 -3.775 3.314 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -1.384 -3.997 1.885 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -0.469 -2.482 2.080 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -0.987 -3.007 0.461 1.00 0.00 H new ATOM 2005 N THR A 139 3.235 -3.408 -2.107 1.00 0.00 N ATOM 2006 CA THR A 139 3.759 -2.748 -3.291 1.00 0.00 C ATOM 2007 C THR A 139 2.613 -1.960 -3.911 1.00 0.00 C ATOM 2008 O THR A 139 1.595 -2.558 -4.273 1.00 0.00 O ATOM 2009 CB THR A 139 4.306 -3.768 -4.310 1.00 0.00 C ATOM 2010 OG1 THR A 139 5.182 -4.726 -3.728 1.00 0.00 O ATOM 2011 CG2 THR A 139 5.032 -3.039 -5.442 1.00 0.00 C ATOM 0 H THR A 139 2.350 -3.884 -2.280 1.00 0.00 H new ATOM 0 HA THR A 139 4.587 -2.095 -3.015 1.00 0.00 H new ATOM 0 HB THR A 139 3.444 -4.312 -4.696 1.00 0.00 H new ATOM 0 HG1 THR A 139 5.495 -5.346 -4.420 1.00 0.00 H new ATOM 0 HG21 THR A 139 5.415 -3.767 -6.157 1.00 0.00 H new ATOM 0 HG22 THR A 139 4.338 -2.366 -5.946 1.00 0.00 H new ATOM 0 HG23 THR A 139 5.861 -2.463 -5.031 1.00 0.00 H new ATOM 2019 N PHE A 140 2.785 -0.644 -4.036 1.00 0.00 N ATOM 2020 CA PHE A 140 1.884 0.195 -4.816 1.00 0.00 C ATOM 2021 C PHE A 140 2.649 0.876 -5.946 1.00 0.00 C ATOM 2022 O PHE A 140 3.844 1.157 -5.811 1.00 0.00 O ATOM 2023 CB PHE A 140 1.279 1.304 -3.948 1.00 0.00 C ATOM 2024 CG PHE A 140 0.304 0.922 -2.862 1.00 0.00 C ATOM 2025 CD1 PHE A 140 0.757 0.290 -1.686 1.00 0.00 C ATOM 2026 CD2 PHE A 140 -1.042 1.315 -2.977 1.00 0.00 C ATOM 2027 CE1 PHE A 140 -0.140 0.056 -0.626 1.00 0.00 C ATOM 2028 CE2 PHE A 140 -1.937 1.024 -1.946 1.00 0.00 C ATOM 2029 CZ PHE A 140 -1.490 0.425 -0.766 1.00 0.00 C ATOM 0 H PHE A 140 3.552 -0.133 -3.599 1.00 0.00 H new ATOM 0 HA PHE A 140 1.097 -0.450 -5.207 1.00 0.00 H new ATOM 0 HB2 PHE A 140 2.102 1.843 -3.479 1.00 0.00 H new ATOM 0 HB3 PHE A 140 0.776 2.006 -4.612 1.00 0.00 H new ATOM 0 HD1 PHE A 140 1.790 -0.014 -1.598 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -1.381 1.839 -3.858 1.00 0.00 H new ATOM 0 HE1 PHE A 140 0.206 -0.404 0.288 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -2.984 1.264 -2.062 1.00 0.00 H new ATOM 0 HZ PHE A 140 -2.184 0.245 0.042 1.00 0.00 H new ATOM 2039 N ASP A 141 1.922 1.264 -6.995 1.00 0.00 N ATOM 2040 CA ASP A 141 2.411 1.903 -8.208 1.00 0.00 C ATOM 2041 C ASP A 141 1.683 3.230 -8.383 1.00 0.00 C ATOM 2042 O ASP A 141 0.462 3.291 -8.256 1.00 0.00 O ATOM 2043 CB ASP A 141 2.162 0.990 -9.417 1.00 0.00 C ATOM 2044 CG ASP A 141 3.452 0.267 -9.792 1.00 0.00 C ATOM 2045 OD1 ASP A 141 4.267 0.883 -10.515 1.00 0.00 O ATOM 2046 OD2 ASP A 141 3.710 -0.854 -9.299 1.00 0.00 O ATOM 0 H ASP A 141 0.911 1.129 -7.017 1.00 0.00 H new ATOM 0 HA ASP A 141 3.484 2.082 -8.132 1.00 0.00 H new ATOM 0 HB2 ASP A 141 1.383 0.265 -9.182 1.00 0.00 H new ATOM 0 HB3 ASP A 141 1.805 1.579 -10.262 1.00 0.00 H new ATOM 2051 N ARG A 142 2.421 4.313 -8.635 1.00 0.00 N ATOM 2052 CA ARG A 142 1.905 5.680 -8.765 1.00 0.00 C ATOM 2053 C ARG A 142 0.993 5.793 -9.991 1.00 0.00 C ATOM 2054 O ARG A 142 1.498 5.834 -11.115 1.00 0.00 O ATOM 2055 CB ARG A 142 3.103 6.635 -8.889 1.00 0.00 C ATOM 2056 CG ARG A 142 2.723 8.113 -9.066 1.00 0.00 C ATOM 2057 CD ARG A 142 2.636 8.930 -7.773 1.00 0.00 C ATOM 2058 NE ARG A 142 3.193 10.281 -7.941 1.00 0.00 N ATOM 2059 CZ ARG A 142 2.963 11.179 -8.914 1.00 0.00 C ATOM 2060 NH1 ARG A 142 1.968 11.028 -9.784 1.00 0.00 N ATOM 2061 NH2 ARG A 142 3.752 12.235 -9.019 1.00 0.00 N ATOM 0 H ARG A 142 3.432 4.262 -8.759 1.00 0.00 H new ATOM 0 HA ARG A 142 1.312 5.942 -7.889 1.00 0.00 H new ATOM 0 HB2 ARG A 142 3.724 6.537 -7.998 1.00 0.00 H new ATOM 0 HB3 ARG A 142 3.712 6.325 -9.738 1.00 0.00 H new ATOM 0 HG2 ARG A 142 3.455 8.582 -9.723 1.00 0.00 H new ATOM 0 HG3 ARG A 142 1.760 8.164 -9.573 1.00 0.00 H new ATOM 0 HD2 ARG A 142 1.595 9.003 -7.459 1.00 0.00 H new ATOM 0 HD3 ARG A 142 3.173 8.412 -6.979 1.00 0.00 H new ATOM 0 HE ARG A 142 3.846 10.578 -7.216 1.00 0.00 H new ATOM 0 HH11 ARG A 142 1.356 10.214 -9.723 1.00 0.00 H new ATOM 0 HH12 ARG A 142 1.817 11.726 -10.512 1.00 0.00 H new ATOM 0 HH21 ARG A 142 4.525 12.361 -8.366 1.00 0.00 H new ATOM 0 HH22 ARG A 142 3.588 12.923 -9.753 1.00 0.00 H new ATOM 2075 N SER A 143 -0.315 5.970 -9.798 1.00 0.00 N ATOM 2076 CA SER A 143 -1.247 6.280 -10.876 1.00 0.00 C ATOM 2077 C SER A 143 -2.140 7.420 -10.401 1.00 0.00 C ATOM 2078 O SER A 143 -3.297 7.221 -10.045 1.00 0.00 O ATOM 2079 CB SER A 143 -1.996 5.013 -11.302 1.00 0.00 C ATOM 2080 OG SER A 143 -2.269 5.007 -12.690 1.00 0.00 O ATOM 0 H SER A 143 -0.758 5.901 -8.882 1.00 0.00 H new ATOM 0 HA SER A 143 -0.738 6.620 -11.778 1.00 0.00 H new ATOM 0 HB2 SER A 143 -1.403 4.136 -11.044 1.00 0.00 H new ATOM 0 HB3 SER A 143 -2.931 4.939 -10.747 1.00 0.00 H new ATOM 0 HG SER A 143 -2.746 4.184 -12.926 1.00 0.00 H new ATOM 2086 N THR A 144 -1.574 8.623 -10.351 1.00 0.00 N ATOM 2087 CA THR A 144 -2.320 9.866 -10.149 1.00 0.00 C ATOM 2088 C THR A 144 -2.766 10.401 -11.528 1.00 0.00 C ATOM 2089 O THR A 144 -2.592 11.582 -11.828 1.00 0.00 O ATOM 2090 CB THR A 144 -1.449 10.880 -9.368 1.00 0.00 C ATOM 2091 OG1 THR A 144 -0.585 10.272 -8.415 1.00 0.00 O ATOM 2092 CG2 THR A 144 -2.307 11.888 -8.605 1.00 0.00 C ATOM 0 H THR A 144 -0.569 8.766 -10.451 1.00 0.00 H new ATOM 0 HA THR A 144 -3.213 9.693 -9.549 1.00 0.00 H new ATOM 0 HB THR A 144 -0.851 11.369 -10.137 1.00 0.00 H new ATOM 0 HG1 THR A 144 -0.063 10.964 -7.958 1.00 0.00 H new ATOM 0 HG21 THR A 144 -1.661 12.583 -8.069 1.00 0.00 H new ATOM 0 HG22 THR A 144 -2.931 12.440 -9.308 1.00 0.00 H new ATOM 0 HG23 THR A 144 -2.942 11.360 -7.893 1.00 0.00 H new ATOM 2100 N ARG A 145 -3.147 9.523 -12.463 1.00 0.00 N ATOM 2101 CA ARG A 145 -3.428 9.925 -13.846 1.00 0.00 C ATOM 2102 C ARG A 145 -4.867 10.387 -13.998 1.00 0.00 C ATOM 2103 O ARG A 145 -5.108 11.225 -14.895 1.00 0.00 O ATOM 2104 CB ARG A 145 -3.070 8.780 -14.809 1.00 0.00 C ATOM 2105 CG ARG A 145 -2.255 9.259 -16.015 1.00 0.00 C ATOM 2106 CD ARG A 145 -3.077 9.982 -17.087 1.00 0.00 C ATOM 2107 NE ARG A 145 -2.247 10.326 -18.252 1.00 0.00 N ATOM 2108 CZ ARG A 145 -1.655 9.470 -19.092 1.00 0.00 C ATOM 2109 NH1 ARG A 145 -1.894 8.162 -19.032 1.00 0.00 N ATOM 2110 NH2 ARG A 145 -0.799 9.937 -19.992 1.00 0.00 N ATOM 0 H ARG A 145 -3.268 8.526 -12.286 1.00 0.00 H new ATOM 0 HA ARG A 145 -2.802 10.779 -14.105 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -2.503 8.021 -14.270 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -3.986 8.305 -15.160 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -1.469 9.928 -15.664 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -1.763 8.400 -16.470 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -3.906 9.348 -17.402 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -3.511 10.889 -16.666 1.00 0.00 H new ATOM 0 HE ARG A 145 -2.109 11.319 -18.438 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -2.541 7.793 -18.335 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -1.431 7.528 -19.683 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -0.600 10.936 -20.036 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -0.340 9.296 -20.639 1.00 0.00 H new TER 2124 ARG A 145