USER MOD reduce.3.24.130724 H: found=0, std=0, add=1264, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1283 hydrogens (16 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 91 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 100 LYS NZ :NH3+ -127:sc= 0.905 (180deg=-0.394) USER MOD Set 2.1: A 48 GLN :FLIP amide:sc= 0.391 F(o=-1.4,f=0.81) USER MOD Set 2.2: A 74 TYR OH : rot -109:sc= 0.415 USER MOD Set 3.1: A 32 THR OG1 : rot 86:sc= 0.0559 USER MOD Set 3.2: A 33 HIS : no HD1:sc= 0.591 K(o=0.65,f=-3.3!) USER MOD Set 4.1: A 18 HIS : no HD1:sc= 0.656 K(o=1.6,f=-8!) USER MOD Set 4.2: A 105 TYR OH : rot -165:sc= 0.973 USER MOD Set 4.3: A 119 HIS : no HE2:sc= 0.0137 X(o=1.6,f=1.4) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= -0.789 USER MOD Single : A 8 CYS SG : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.0402 K(o=-0.04,f=-3.9!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 GLN : amide:sc= -3.19! X(o=-3.2!,f=-2.8) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.234 USER MOD Single : A 36 MET CE :methyl -153:sc= -2.18 (180deg=-2.77) USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 45 SER OG : rot 33:sc= 0.266 USER MOD Single : A 46 ASN :FLIP amide:sc= -0.223 F(o=-2.1!,f=-0.22) USER MOD Single : A 49 HIS : no HD1:sc= -0.135 X(o=-0.13,f=-0.27) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 HIS : no HD1:sc= 0.627 K(o=0.63,f=-4.9!) USER MOD Single : A 59 HIS : no HD1:sc= -0.122 X(o=-0.12,f=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 CYS SG : rot 140:sc= 0.269 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 174:sc= 0.126 (180deg=-0.1) USER MOD Single : A 79 SER OG : rot 92:sc= 1.26 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ -120:sc= 0.00196 (180deg=0) USER MOD Single : A 94 ASN : amide:sc= -3.47! C(o=-3.5!,f=-9.7!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 HIS : no HD1:sc= -0.685 K(o=-0.69,f=-2.5) USER MOD Single : A 114 HIS : no HD1:sc= -0.333 X(o=-0.33,f=-0.81) USER MOD Single : A 118 ASN : amide:sc= -2.26! C(o=-2.3!,f=-3.6!) USER MOD Single : A 122 CYS SG : rot 34:sc= 0.0571 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 129 ASN : amide:sc= -2.18! C(o=-2.2!,f=-6.4!) USER MOD Single : A 131 THR OG1 : rot 180:sc= -0.0357 USER MOD Single : A 137 LYS NZ :NH3+ 149:sc= 0.0629 (180deg=-2.67!) USER MOD Single : A 140 LYS NZ :NH3+ -162:sc= -0.0384 (180deg=-0.267) USER MOD Single : B 214 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 219 GLN : amide:sc= -0.206 X(o=-0.21,f=-0.33) USER MOD Single : B 222 THR OG1 : rot 180:sc= 0 USER MOD Single : B 223 LYS NZ :NH3+ 170:sc= 0.684 (180deg=0.616) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 29.902 -0.131 17.616 1.00 0.00 N ATOM 2 CA GLY A 1 30.053 -1.379 16.833 1.00 0.00 C ATOM 3 C GLY A 1 28.791 -2.213 16.845 1.00 0.00 C ATOM 4 O GLY A 1 28.328 -2.640 17.905 1.00 0.00 O ATOM 0 H1 GLY A 1 30.789 0.410 17.581 1.00 0.00 H new ATOM 0 H2 GLY A 1 29.132 0.440 17.213 1.00 0.00 H new ATOM 0 H3 GLY A 1 29.678 -0.366 18.604 1.00 0.00 H new ATOM 0 HA2 GLY A 1 30.314 -1.132 15.804 1.00 0.00 H new ATOM 0 HA3 GLY A 1 30.878 -1.964 17.239 1.00 0.00 H new ATOM 10 N SER A 2 28.225 -2.435 15.670 1.00 0.00 N ATOM 11 CA SER A 2 27.009 -3.216 15.540 1.00 0.00 C ATOM 12 C SER A 2 27.327 -4.663 15.186 1.00 0.00 C ATOM 13 O SER A 2 26.696 -5.589 15.696 1.00 0.00 O ATOM 14 CB SER A 2 26.110 -2.609 14.464 1.00 0.00 C ATOM 15 OG SER A 2 25.860 -1.236 14.715 1.00 0.00 O ATOM 0 H SER A 2 28.593 -2.081 14.787 1.00 0.00 H new ATOM 0 HA SER A 2 26.490 -3.200 16.499 1.00 0.00 H new ATOM 0 HB2 SER A 2 26.581 -2.722 13.487 1.00 0.00 H new ATOM 0 HB3 SER A 2 25.166 -3.152 14.428 1.00 0.00 H new ATOM 0 HG SER A 2 25.284 -0.874 14.010 1.00 0.00 H new ATOM 21 N HIS A 3 28.323 -4.857 14.323 1.00 0.00 N ATOM 22 CA HIS A 3 28.652 -6.193 13.838 1.00 0.00 C ATOM 23 C HIS A 3 30.002 -6.205 13.124 1.00 0.00 C ATOM 24 O HIS A 3 30.917 -6.915 13.537 1.00 0.00 O ATOM 25 CB HIS A 3 27.552 -6.706 12.900 1.00 0.00 C ATOM 26 CG HIS A 3 27.755 -8.118 12.437 1.00 0.00 C ATOM 27 ND1 HIS A 3 27.993 -8.448 11.124 1.00 0.00 N ATOM 28 CD2 HIS A 3 27.747 -9.285 13.120 1.00 0.00 C ATOM 29 CE1 HIS A 3 28.126 -9.756 11.017 1.00 0.00 C ATOM 30 NE2 HIS A 3 27.983 -10.292 12.216 1.00 0.00 N ATOM 0 H HIS A 3 28.911 -4.112 13.949 1.00 0.00 H new ATOM 0 HA HIS A 3 28.720 -6.856 14.701 1.00 0.00 H new ATOM 0 HB2 HIS A 3 26.592 -6.636 13.411 1.00 0.00 H new ATOM 0 HB3 HIS A 3 27.498 -6.053 12.029 1.00 0.00 H new ATOM 0 HD2 HIS A 3 27.585 -9.404 14.181 1.00 0.00 H new ATOM 0 HE1 HIS A 3 28.319 -10.298 10.103 1.00 0.00 H new ATOM 0 HE2 HIS A 3 28.039 -11.287 12.434 1.00 0.00 H new ATOM 39 N MET A 4 30.123 -5.422 12.057 1.00 0.00 N ATOM 40 CA MET A 4 31.352 -5.403 11.267 1.00 0.00 C ATOM 41 C MET A 4 32.289 -4.292 11.733 1.00 0.00 C ATOM 42 O MET A 4 33.287 -4.553 12.406 1.00 0.00 O ATOM 43 CB MET A 4 31.033 -5.235 9.778 1.00 0.00 C ATOM 44 CG MET A 4 32.262 -5.254 8.880 1.00 0.00 C ATOM 45 SD MET A 4 31.865 -4.951 7.147 1.00 0.00 S ATOM 46 CE MET A 4 33.499 -5.023 6.419 1.00 0.00 C ATOM 0 H MET A 4 29.392 -4.796 11.720 1.00 0.00 H new ATOM 0 HA MET A 4 31.856 -6.358 11.413 1.00 0.00 H new ATOM 0 HB2 MET A 4 30.356 -6.032 9.469 1.00 0.00 H new ATOM 0 HB3 MET A 4 30.504 -4.293 9.633 1.00 0.00 H new ATOM 0 HG2 MET A 4 32.969 -4.499 9.224 1.00 0.00 H new ATOM 0 HG3 MET A 4 32.758 -6.220 8.971 1.00 0.00 H new ATOM 0 HE1 MET A 4 33.426 -4.854 5.345 1.00 0.00 H new ATOM 0 HE2 MET A 4 34.130 -4.254 6.865 1.00 0.00 H new ATOM 0 HE3 MET A 4 33.937 -6.004 6.603 1.00 0.00 H new ATOM 56 N ALA A 5 31.964 -3.052 11.385 1.00 0.00 N ATOM 57 CA ALA A 5 32.805 -1.916 11.739 1.00 0.00 C ATOM 58 C ALA A 5 31.992 -0.632 11.769 1.00 0.00 C ATOM 59 O ALA A 5 31.489 -0.230 12.816 1.00 0.00 O ATOM 60 CB ALA A 5 33.968 -1.782 10.766 1.00 0.00 C ATOM 0 H ALA A 5 31.125 -2.809 10.859 1.00 0.00 H new ATOM 0 HA ALA A 5 33.208 -2.093 12.736 1.00 0.00 H new ATOM 0 HB1 ALA A 5 34.583 -0.928 11.049 1.00 0.00 H new ATOM 0 HB2 ALA A 5 34.572 -2.689 10.794 1.00 0.00 H new ATOM 0 HB3 ALA A 5 33.583 -1.633 9.757 1.00 0.00 H new ATOM 66 N SER A 6 31.855 -0.001 10.616 1.00 0.00 N ATOM 67 CA SER A 6 31.071 1.213 10.495 1.00 0.00 C ATOM 68 C SER A 6 29.730 0.899 9.845 1.00 0.00 C ATOM 69 O SER A 6 29.606 0.887 8.620 1.00 0.00 O ATOM 70 CB SER A 6 31.840 2.255 9.685 1.00 0.00 C ATOM 71 OG SER A 6 33.043 2.617 10.346 1.00 0.00 O ATOM 0 H SER A 6 32.281 -0.314 9.744 1.00 0.00 H new ATOM 0 HA SER A 6 30.885 1.623 11.488 1.00 0.00 H new ATOM 0 HB2 SER A 6 32.068 1.858 8.696 1.00 0.00 H new ATOM 0 HB3 SER A 6 31.220 3.139 9.538 1.00 0.00 H new ATOM 0 HG SER A 6 33.522 3.284 9.811 1.00 0.00 H new ATOM 77 N SER A 7 28.738 0.632 10.678 1.00 0.00 N ATOM 78 CA SER A 7 27.436 0.212 10.201 1.00 0.00 C ATOM 79 C SER A 7 26.589 1.420 9.821 1.00 0.00 C ATOM 80 O SER A 7 26.169 2.200 10.682 1.00 0.00 O ATOM 81 CB SER A 7 26.731 -0.619 11.277 1.00 0.00 C ATOM 82 OG SER A 7 25.585 -1.274 10.762 1.00 0.00 O ATOM 0 H SER A 7 28.813 0.700 11.693 1.00 0.00 H new ATOM 0 HA SER A 7 27.570 -0.403 9.311 1.00 0.00 H new ATOM 0 HB2 SER A 7 27.424 -1.358 11.679 1.00 0.00 H new ATOM 0 HB3 SER A 7 26.440 0.028 12.105 1.00 0.00 H new ATOM 0 HG SER A 7 25.160 -1.797 11.473 1.00 0.00 H new ATOM 88 N CYS A 8 26.358 1.579 8.530 1.00 0.00 N ATOM 89 CA CYS A 8 25.526 2.664 8.037 1.00 0.00 C ATOM 90 C CYS A 8 24.181 2.125 7.569 1.00 0.00 C ATOM 91 O CYS A 8 24.089 1.470 6.531 1.00 0.00 O ATOM 92 CB CYS A 8 26.233 3.400 6.900 1.00 0.00 C ATOM 93 SG CYS A 8 27.914 3.919 7.304 1.00 0.00 S ATOM 0 H CYS A 8 26.735 0.971 7.803 1.00 0.00 H new ATOM 0 HA CYS A 8 25.353 3.370 8.849 1.00 0.00 H new ATOM 0 HB2 CYS A 8 26.263 2.753 6.024 1.00 0.00 H new ATOM 0 HB3 CYS A 8 25.647 4.278 6.628 1.00 0.00 H new ATOM 0 HG CYS A 8 28.436 4.532 6.283 1.00 0.00 H new ATOM 99 N ALA A 9 23.148 2.376 8.357 1.00 0.00 N ATOM 100 CA ALA A 9 21.805 1.935 8.025 1.00 0.00 C ATOM 101 C ALA A 9 21.150 2.914 7.064 1.00 0.00 C ATOM 102 O ALA A 9 21.108 4.117 7.325 1.00 0.00 O ATOM 103 CB ALA A 9 20.965 1.788 9.290 1.00 0.00 C ATOM 0 H ALA A 9 23.216 2.887 9.237 1.00 0.00 H new ATOM 0 HA ALA A 9 21.870 0.962 7.538 1.00 0.00 H new ATOM 0 HB1 ALA A 9 19.961 1.457 9.024 1.00 0.00 H new ATOM 0 HB2 ALA A 9 21.426 1.053 9.950 1.00 0.00 H new ATOM 0 HB3 ALA A 9 20.906 2.749 9.801 1.00 0.00 H new ATOM 109 N VAL A 10 20.658 2.402 5.946 1.00 0.00 N ATOM 110 CA VAL A 10 19.954 3.231 4.983 1.00 0.00 C ATOM 111 C VAL A 10 18.465 2.998 5.138 1.00 0.00 C ATOM 112 O VAL A 10 18.005 1.855 5.165 1.00 0.00 O ATOM 113 CB VAL A 10 20.383 2.951 3.526 1.00 0.00 C ATOM 114 CG1 VAL A 10 19.770 3.976 2.584 1.00 0.00 C ATOM 115 CG2 VAL A 10 21.900 2.940 3.393 1.00 0.00 C ATOM 0 H VAL A 10 20.734 1.419 5.685 1.00 0.00 H new ATOM 0 HA VAL A 10 20.207 4.271 5.188 1.00 0.00 H new ATOM 0 HB VAL A 10 20.015 1.963 3.250 1.00 0.00 H new ATOM 0 HG11 VAL A 10 20.083 3.764 1.562 1.00 0.00 H new ATOM 0 HG12 VAL A 10 18.683 3.925 2.649 1.00 0.00 H new ATOM 0 HG13 VAL A 10 20.104 4.975 2.866 1.00 0.00 H new ATOM 0 HG21 VAL A 10 22.173 2.741 2.357 1.00 0.00 H new ATOM 0 HG22 VAL A 10 22.299 3.909 3.693 1.00 0.00 H new ATOM 0 HG23 VAL A 10 22.316 2.162 4.034 1.00 0.00 H new ATOM 125 N GLN A 11 17.719 4.077 5.274 1.00 0.00 N ATOM 126 CA GLN A 11 16.314 3.981 5.610 1.00 0.00 C ATOM 127 C GLN A 11 15.456 4.476 4.462 1.00 0.00 C ATOM 128 O GLN A 11 15.727 5.527 3.878 1.00 0.00 O ATOM 129 CB GLN A 11 16.015 4.787 6.878 1.00 0.00 C ATOM 130 CG GLN A 11 17.190 4.867 7.844 1.00 0.00 C ATOM 131 CD GLN A 11 18.059 6.088 7.601 1.00 0.00 C ATOM 132 OE1 GLN A 11 19.007 6.050 6.814 1.00 0.00 O ATOM 133 NE2 GLN A 11 17.744 7.180 8.274 1.00 0.00 N ATOM 0 H GLN A 11 18.063 5.030 5.157 1.00 0.00 H new ATOM 0 HA GLN A 11 16.075 2.934 5.794 1.00 0.00 H new ATOM 0 HB2 GLN A 11 15.720 5.797 6.595 1.00 0.00 H new ATOM 0 HB3 GLN A 11 15.164 4.338 7.391 1.00 0.00 H new ATOM 0 HG2 GLN A 11 16.814 4.890 8.867 1.00 0.00 H new ATOM 0 HG3 GLN A 11 17.798 3.967 7.748 1.00 0.00 H new ATOM 0 HE21 GLN A 11 16.952 7.172 8.917 1.00 0.00 H new ATOM 0 HE22 GLN A 11 18.293 8.031 8.151 1.00 0.00 H new ATOM 142 N VAL A 12 14.434 3.710 4.133 1.00 0.00 N ATOM 143 CA VAL A 12 13.520 4.081 3.082 1.00 0.00 C ATOM 144 C VAL A 12 12.120 4.264 3.651 1.00 0.00 C ATOM 145 O VAL A 12 11.722 3.551 4.576 1.00 0.00 O ATOM 146 CB VAL A 12 13.504 3.013 1.972 1.00 0.00 C ATOM 147 CG1 VAL A 12 14.851 2.944 1.266 1.00 0.00 C ATOM 148 CG2 VAL A 12 13.165 1.665 2.552 1.00 0.00 C ATOM 0 H VAL A 12 14.219 2.821 4.585 1.00 0.00 H new ATOM 0 HA VAL A 12 13.856 5.023 2.648 1.00 0.00 H new ATOM 0 HB VAL A 12 12.743 3.293 1.243 1.00 0.00 H new ATOM 0 HG11 VAL A 12 14.815 2.183 0.487 1.00 0.00 H new ATOM 0 HG12 VAL A 12 15.077 3.912 0.818 1.00 0.00 H new ATOM 0 HG13 VAL A 12 15.627 2.688 1.987 1.00 0.00 H new ATOM 0 HG21 VAL A 12 13.157 0.919 1.758 1.00 0.00 H new ATOM 0 HG22 VAL A 12 13.911 1.392 3.299 1.00 0.00 H new ATOM 0 HG23 VAL A 12 12.182 1.707 3.020 1.00 0.00 H new ATOM 158 N LYS A 13 11.389 5.239 3.136 1.00 0.00 N ATOM 159 CA LYS A 13 10.033 5.472 3.585 1.00 0.00 C ATOM 160 C LYS A 13 9.028 5.121 2.505 1.00 0.00 C ATOM 161 O LYS A 13 9.115 5.598 1.373 1.00 0.00 O ATOM 162 CB LYS A 13 9.840 6.920 4.037 1.00 0.00 C ATOM 163 CG LYS A 13 10.279 7.155 5.468 1.00 0.00 C ATOM 164 CD LYS A 13 9.984 8.578 5.919 1.00 0.00 C ATOM 165 CE LYS A 13 10.365 8.784 7.375 1.00 0.00 C ATOM 166 NZ LYS A 13 10.196 10.195 7.812 1.00 0.00 N ATOM 0 H LYS A 13 11.713 5.878 2.410 1.00 0.00 H new ATOM 0 HA LYS A 13 9.859 4.819 4.440 1.00 0.00 H new ATOM 0 HB2 LYS A 13 10.403 7.579 3.377 1.00 0.00 H new ATOM 0 HB3 LYS A 13 8.789 7.190 3.936 1.00 0.00 H new ATOM 0 HG2 LYS A 13 9.769 6.451 6.126 1.00 0.00 H new ATOM 0 HG3 LYS A 13 11.347 6.958 5.558 1.00 0.00 H new ATOM 0 HD2 LYS A 13 10.534 9.282 5.294 1.00 0.00 H new ATOM 0 HD3 LYS A 13 8.924 8.792 5.784 1.00 0.00 H new ATOM 0 HE2 LYS A 13 9.753 8.136 8.003 1.00 0.00 H new ATOM 0 HE3 LYS A 13 11.402 8.483 7.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 10.469 10.284 8.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 10.799 10.813 7.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 9.201 10.477 7.698 1.00 0.00 H new ATOM 180 N LEU A 14 8.090 4.269 2.868 1.00 0.00 N ATOM 181 CA LEU A 14 6.980 3.936 1.998 1.00 0.00 C ATOM 182 C LEU A 14 5.704 4.504 2.589 1.00 0.00 C ATOM 183 O LEU A 14 5.530 4.532 3.803 1.00 0.00 O ATOM 184 CB LEU A 14 6.851 2.426 1.813 1.00 0.00 C ATOM 185 CG LEU A 14 8.013 1.748 1.087 1.00 0.00 C ATOM 186 CD1 LEU A 14 7.825 0.245 1.091 1.00 0.00 C ATOM 187 CD2 LEU A 14 8.120 2.250 -0.339 1.00 0.00 C ATOM 0 H LEU A 14 8.075 3.791 3.769 1.00 0.00 H new ATOM 0 HA LEU A 14 7.161 4.371 1.015 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.741 1.966 2.795 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.933 2.223 1.261 1.00 0.00 H new ATOM 0 HG LEU A 14 8.936 1.995 1.612 1.00 0.00 H new ATOM 0 HD11 LEU A 14 8.659 -0.227 0.571 1.00 0.00 H new ATOM 0 HD12 LEU A 14 7.788 -0.114 2.119 1.00 0.00 H new ATOM 0 HD13 LEU A 14 6.893 -0.006 0.585 1.00 0.00 H new ATOM 0 HD21 LEU A 14 8.953 1.755 -0.838 1.00 0.00 H new ATOM 0 HD22 LEU A 14 7.195 2.030 -0.873 1.00 0.00 H new ATOM 0 HD23 LEU A 14 8.289 3.327 -0.334 1.00 0.00 H new ATOM 199 N GLU A 15 4.827 4.951 1.733 1.00 0.00 N ATOM 200 CA GLU A 15 3.637 5.659 2.153 1.00 0.00 C ATOM 201 C GLU A 15 2.391 4.825 1.889 1.00 0.00 C ATOM 202 O GLU A 15 2.163 4.370 0.767 1.00 0.00 O ATOM 203 CB GLU A 15 3.568 7.003 1.415 1.00 0.00 C ATOM 204 CG GLU A 15 2.431 7.908 1.858 1.00 0.00 C ATOM 205 CD GLU A 15 2.478 9.268 1.187 1.00 0.00 C ATOM 206 OE1 GLU A 15 2.071 9.373 0.011 1.00 0.00 O ATOM 207 OE2 GLU A 15 2.917 10.241 1.836 1.00 0.00 O ATOM 0 H GLU A 15 4.912 4.838 0.723 1.00 0.00 H new ATOM 0 HA GLU A 15 3.684 5.842 3.226 1.00 0.00 H new ATOM 0 HB2 GLU A 15 4.511 7.530 1.557 1.00 0.00 H new ATOM 0 HB3 GLU A 15 3.468 6.812 0.347 1.00 0.00 H new ATOM 0 HG2 GLU A 15 1.479 7.427 1.632 1.00 0.00 H new ATOM 0 HG3 GLU A 15 2.474 8.038 2.939 1.00 0.00 H new ATOM 214 N LEU A 16 1.607 4.615 2.937 1.00 0.00 N ATOM 215 CA LEU A 16 0.323 3.942 2.819 1.00 0.00 C ATOM 216 C LEU A 16 -0.752 4.990 2.683 1.00 0.00 C ATOM 217 O LEU A 16 -0.688 6.036 3.325 1.00 0.00 O ATOM 218 CB LEU A 16 -0.013 3.078 4.041 1.00 0.00 C ATOM 219 CG LEU A 16 0.703 1.733 4.175 1.00 0.00 C ATOM 220 CD1 LEU A 16 0.674 0.965 2.871 1.00 0.00 C ATOM 221 CD2 LEU A 16 2.125 1.923 4.650 1.00 0.00 C ATOM 0 H LEU A 16 1.842 4.904 3.887 1.00 0.00 H new ATOM 0 HA LEU A 16 0.377 3.286 1.950 1.00 0.00 H new ATOM 0 HB2 LEU A 16 0.201 3.663 4.935 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.086 2.888 4.033 1.00 0.00 H new ATOM 0 HG LEU A 16 0.169 1.147 4.923 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.191 0.014 2.998 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.360 0.781 2.580 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.171 1.547 2.095 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.612 0.952 4.737 1.00 0.00 H new ATOM 0 HD22 LEU A 16 2.669 2.539 3.934 1.00 0.00 H new ATOM 0 HD23 LEU A 16 2.121 2.416 5.622 1.00 0.00 H new ATOM 233 N GLY A 17 -1.736 4.708 1.872 1.00 0.00 N ATOM 234 CA GLY A 17 -2.790 5.660 1.653 1.00 0.00 C ATOM 235 C GLY A 17 -4.045 5.015 1.151 1.00 0.00 C ATOM 236 O GLY A 17 -4.040 3.840 0.788 1.00 0.00 O ATOM 0 H GLY A 17 -1.830 3.833 1.356 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -3.002 6.185 2.585 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -2.457 6.409 0.934 1.00 0.00 H new ATOM 240 N HIS A 18 -5.124 5.778 1.149 1.00 0.00 N ATOM 241 CA HIS A 18 -6.370 5.336 0.558 1.00 0.00 C ATOM 242 C HIS A 18 -7.396 6.459 0.608 1.00 0.00 C ATOM 243 O HIS A 18 -7.399 7.279 1.529 1.00 0.00 O ATOM 244 CB HIS A 18 -6.904 4.061 1.257 1.00 0.00 C ATOM 245 CG HIS A 18 -8.061 4.285 2.184 1.00 0.00 C ATOM 246 ND1 HIS A 18 -7.947 4.977 3.371 1.00 0.00 N ATOM 247 CD2 HIS A 18 -9.366 3.937 2.077 1.00 0.00 C ATOM 248 CE1 HIS A 18 -9.130 5.048 3.950 1.00 0.00 C ATOM 249 NE2 HIS A 18 -10.002 4.422 3.186 1.00 0.00 N ATOM 0 H HIS A 18 -5.159 6.713 1.554 1.00 0.00 H new ATOM 0 HA HIS A 18 -6.185 5.079 -0.485 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -7.204 3.344 0.493 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -6.090 3.605 1.820 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -9.818 3.382 1.269 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -9.347 5.536 4.889 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -10.996 4.316 3.390 1.00 0.00 H new ATOM 258 N ARG A 19 -8.245 6.483 -0.395 1.00 0.00 N ATOM 259 CA ARG A 19 -9.340 7.425 -0.471 1.00 0.00 C ATOM 260 C ARG A 19 -10.643 6.669 -0.325 1.00 0.00 C ATOM 261 O ARG A 19 -10.663 5.462 -0.521 1.00 0.00 O ATOM 262 CB ARG A 19 -9.318 8.129 -1.821 1.00 0.00 C ATOM 263 CG ARG A 19 -7.960 8.674 -2.209 1.00 0.00 C ATOM 264 CD ARG A 19 -7.985 9.217 -3.615 1.00 0.00 C ATOM 265 NE ARG A 19 -8.323 8.218 -4.625 1.00 0.00 N ATOM 266 CZ ARG A 19 -9.388 8.307 -5.427 1.00 0.00 C ATOM 267 NH1 ARG A 19 -10.275 9.279 -5.260 1.00 0.00 N ATOM 268 NH2 ARG A 19 -9.573 7.413 -6.390 1.00 0.00 N ATOM 0 H ARG A 19 -8.195 5.844 -1.188 1.00 0.00 H new ATOM 0 HA ARG A 19 -9.244 8.166 0.323 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -9.651 7.431 -2.589 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -10.036 8.949 -1.803 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -7.667 9.462 -1.515 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -7.211 7.886 -2.132 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -8.707 10.032 -3.667 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -7.008 9.641 -3.849 1.00 0.00 H new ATOM 0 HE ARG A 19 -7.712 7.407 -4.724 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -10.146 9.964 -4.516 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -11.086 9.341 -5.876 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -8.902 6.656 -6.519 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -10.387 7.483 -7.001 1.00 0.00 H new ATOM 282 N ALA A 20 -11.707 7.358 0.044 1.00 0.00 N ATOM 283 CA ALA A 20 -13.031 6.749 0.076 1.00 0.00 C ATOM 284 C ALA A 20 -14.118 7.796 -0.093 1.00 0.00 C ATOM 285 O ALA A 20 -14.073 8.868 0.532 1.00 0.00 O ATOM 286 CB ALA A 20 -13.254 5.987 1.370 1.00 0.00 C ATOM 0 H ALA A 20 -11.684 8.338 0.326 1.00 0.00 H new ATOM 0 HA ALA A 20 -13.084 6.048 -0.757 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -14.250 5.544 1.364 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -12.507 5.199 1.461 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -13.166 6.670 2.215 1.00 0.00 H new ATOM 292 N GLN A 21 -15.084 7.485 -0.952 1.00 0.00 N ATOM 293 CA GLN A 21 -16.275 8.283 -1.099 1.00 0.00 C ATOM 294 C GLN A 21 -17.425 7.340 -1.449 1.00 0.00 C ATOM 295 O GLN A 21 -17.191 6.198 -1.843 1.00 0.00 O ATOM 296 CB GLN A 21 -16.071 9.367 -2.173 1.00 0.00 C ATOM 297 CG GLN A 21 -16.624 9.043 -3.540 1.00 0.00 C ATOM 298 CD GLN A 21 -16.019 7.823 -4.207 1.00 0.00 C ATOM 299 OE1 GLN A 21 -14.857 7.476 -3.989 1.00 0.00 O ATOM 300 NE2 GLN A 21 -16.821 7.182 -5.045 1.00 0.00 N ATOM 0 H GLN A 21 -15.053 6.669 -1.563 1.00 0.00 H new ATOM 0 HA GLN A 21 -16.507 8.808 -0.172 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -16.532 10.291 -1.824 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -15.003 9.561 -2.270 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -17.700 8.894 -3.453 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -16.473 9.905 -4.190 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -17.776 7.511 -5.190 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -16.484 6.360 -5.545 1.00 0.00 H new ATOM 309 N VAL A 22 -18.653 7.779 -1.272 1.00 0.00 N ATOM 310 CA VAL A 22 -19.786 6.927 -1.575 1.00 0.00 C ATOM 311 C VAL A 22 -20.432 7.339 -2.891 1.00 0.00 C ATOM 312 O VAL A 22 -20.628 8.527 -3.157 1.00 0.00 O ATOM 313 CB VAL A 22 -20.833 6.934 -0.435 1.00 0.00 C ATOM 314 CG1 VAL A 22 -21.475 8.296 -0.277 1.00 0.00 C ATOM 315 CG2 VAL A 22 -21.892 5.866 -0.659 1.00 0.00 C ATOM 0 H VAL A 22 -18.892 8.708 -0.925 1.00 0.00 H new ATOM 0 HA VAL A 22 -19.409 5.909 -1.671 1.00 0.00 H new ATOM 0 HB VAL A 22 -20.305 6.705 0.491 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -22.204 8.263 0.532 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -20.708 9.035 -0.044 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -21.975 8.572 -1.205 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -22.615 5.893 0.157 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -22.403 6.053 -1.603 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -21.418 4.885 -0.691 1.00 0.00 H new ATOM 325 N ARG A 23 -20.726 6.357 -3.720 1.00 0.00 N ATOM 326 CA ARG A 23 -21.481 6.590 -4.939 1.00 0.00 C ATOM 327 C ARG A 23 -22.948 6.332 -4.651 1.00 0.00 C ATOM 328 O ARG A 23 -23.292 5.355 -3.982 1.00 0.00 O ATOM 329 CB ARG A 23 -20.980 5.697 -6.086 1.00 0.00 C ATOM 330 CG ARG A 23 -20.399 4.370 -5.624 1.00 0.00 C ATOM 331 CD ARG A 23 -20.580 3.264 -6.655 1.00 0.00 C ATOM 332 NE ARG A 23 -20.161 3.670 -7.997 1.00 0.00 N ATOM 333 CZ ARG A 23 -19.239 3.030 -8.719 1.00 0.00 C ATOM 334 NH1 ARG A 23 -18.578 2.002 -8.203 1.00 0.00 N ATOM 335 NH2 ARG A 23 -18.960 3.444 -9.950 1.00 0.00 N ATOM 0 H ARG A 23 -20.453 5.385 -3.572 1.00 0.00 H new ATOM 0 HA ARG A 23 -21.343 7.623 -5.260 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -21.806 5.502 -6.770 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -20.221 6.238 -6.650 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -19.337 4.496 -5.413 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -20.876 4.073 -4.690 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -20.006 2.390 -6.348 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -21.628 2.965 -6.681 1.00 0.00 H new ATOM 0 HE ARG A 23 -20.601 4.494 -8.406 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -18.773 1.697 -7.250 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -17.874 1.517 -8.760 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -19.450 4.249 -10.341 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -18.256 2.957 -10.504 1.00 0.00 H new ATOM 349 N LYS A 24 -23.809 7.215 -5.139 1.00 0.00 N ATOM 350 CA LYS A 24 -25.228 7.143 -4.822 1.00 0.00 C ATOM 351 C LYS A 24 -25.868 5.937 -5.498 1.00 0.00 C ATOM 352 O LYS A 24 -26.997 5.556 -5.191 1.00 0.00 O ATOM 353 CB LYS A 24 -25.946 8.427 -5.238 1.00 0.00 C ATOM 354 CG LYS A 24 -27.345 8.532 -4.661 1.00 0.00 C ATOM 355 CD LYS A 24 -27.307 8.633 -3.150 1.00 0.00 C ATOM 356 CE LYS A 24 -28.696 8.822 -2.568 1.00 0.00 C ATOM 357 NZ LYS A 24 -28.689 8.665 -1.092 1.00 0.00 N ATOM 0 H LYS A 24 -23.550 7.987 -5.754 1.00 0.00 H new ATOM 0 HA LYS A 24 -25.326 7.030 -3.742 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -25.359 9.287 -4.915 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -26.002 8.470 -6.326 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -27.847 9.407 -5.074 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -27.929 7.660 -4.955 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -26.858 7.730 -2.736 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -26.672 9.469 -2.856 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -29.070 9.812 -2.829 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -29.379 8.097 -3.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -29.652 8.800 -0.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -28.355 7.711 -0.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -28.055 9.374 -0.671 1.00 0.00 H new ATOM 371 N LYS A 25 -25.133 5.327 -6.407 1.00 0.00 N ATOM 372 CA LYS A 25 -25.604 4.137 -7.079 1.00 0.00 C ATOM 373 C LYS A 25 -24.557 3.038 -6.988 1.00 0.00 C ATOM 374 O LYS A 25 -23.477 3.152 -7.576 1.00 0.00 O ATOM 375 CB LYS A 25 -25.924 4.423 -8.545 1.00 0.00 C ATOM 376 CG LYS A 25 -26.512 3.238 -9.266 1.00 0.00 C ATOM 377 CD LYS A 25 -27.957 3.001 -8.885 1.00 0.00 C ATOM 378 CE LYS A 25 -28.484 1.762 -9.578 1.00 0.00 C ATOM 379 NZ LYS A 25 -29.847 1.395 -9.117 1.00 0.00 N ATOM 0 H LYS A 25 -24.206 5.638 -6.696 1.00 0.00 H new ATOM 0 HA LYS A 25 -26.519 3.810 -6.585 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -26.623 5.258 -8.602 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -25.013 4.735 -9.055 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -26.443 3.398 -10.342 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -25.926 2.348 -9.037 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -28.042 2.886 -7.804 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -28.560 3.866 -9.162 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -28.500 1.930 -10.655 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -27.805 0.929 -9.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -30.165 0.542 -9.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -29.829 1.208 -8.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -30.503 2.178 -9.315 1.00 0.00 H new ATOM 393 N PRO A 26 -24.853 1.973 -6.230 1.00 0.00 N ATOM 394 CA PRO A 26 -23.977 0.811 -6.125 1.00 0.00 C ATOM 395 C PRO A 26 -23.863 0.067 -7.447 1.00 0.00 C ATOM 396 O PRO A 26 -24.564 0.369 -8.413 1.00 0.00 O ATOM 397 CB PRO A 26 -24.657 -0.089 -5.082 1.00 0.00 C ATOM 398 CG PRO A 26 -25.681 0.762 -4.418 1.00 0.00 C ATOM 399 CD PRO A 26 -26.064 1.821 -5.413 1.00 0.00 C ATOM 0 HA PRO A 26 -22.963 1.103 -5.851 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -25.117 -0.957 -5.555 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -23.933 -0.466 -4.359 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -26.549 0.170 -4.128 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -25.282 1.210 -3.508 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -26.920 1.516 -6.015 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -26.337 2.755 -4.921 1.00 0.00 H new ATOM 407 N THR A 27 -22.973 -0.903 -7.484 1.00 0.00 N ATOM 408 CA THR A 27 -22.826 -1.750 -8.653 1.00 0.00 C ATOM 409 C THR A 27 -23.876 -2.857 -8.607 1.00 0.00 C ATOM 410 O THR A 27 -24.646 -2.937 -7.647 1.00 0.00 O ATOM 411 CB THR A 27 -21.404 -2.357 -8.728 1.00 0.00 C ATOM 412 OG1 THR A 27 -21.260 -3.219 -9.865 1.00 0.00 O ATOM 413 CG2 THR A 27 -21.089 -3.127 -7.462 1.00 0.00 C ATOM 0 H THR A 27 -22.339 -1.126 -6.717 1.00 0.00 H new ATOM 0 HA THR A 27 -22.973 -1.144 -9.547 1.00 0.00 H new ATOM 0 HB THR A 27 -20.701 -1.531 -8.833 1.00 0.00 H new ATOM 0 HG1 THR A 27 -20.351 -3.585 -9.885 1.00 0.00 H new ATOM 0 HG21 THR A 27 -20.086 -3.547 -7.532 1.00 0.00 H new ATOM 0 HG22 THR A 27 -21.143 -2.456 -6.605 1.00 0.00 H new ATOM 0 HG23 THR A 27 -21.812 -3.933 -7.337 1.00 0.00 H new ATOM 421 N VAL A 28 -23.902 -3.700 -9.629 1.00 0.00 N ATOM 422 CA VAL A 28 -24.841 -4.815 -9.705 1.00 0.00 C ATOM 423 C VAL A 28 -24.903 -5.609 -8.395 1.00 0.00 C ATOM 424 O VAL A 28 -25.985 -5.954 -7.918 1.00 0.00 O ATOM 425 CB VAL A 28 -24.472 -5.748 -10.876 1.00 0.00 C ATOM 426 CG1 VAL A 28 -22.989 -6.084 -10.853 1.00 0.00 C ATOM 427 CG2 VAL A 28 -25.311 -7.016 -10.844 1.00 0.00 C ATOM 0 H VAL A 28 -23.274 -3.632 -10.430 1.00 0.00 H new ATOM 0 HA VAL A 28 -25.831 -4.393 -9.878 1.00 0.00 H new ATOM 0 HB VAL A 28 -24.687 -5.222 -11.806 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -22.752 -6.743 -11.688 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -22.407 -5.167 -10.938 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -22.744 -6.583 -9.916 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -25.032 -7.658 -11.680 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -25.136 -7.544 -9.907 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -26.367 -6.756 -10.923 1.00 0.00 H new ATOM 437 N GLU A 29 -23.745 -5.848 -7.787 1.00 0.00 N ATOM 438 CA GLU A 29 -23.670 -6.675 -6.589 1.00 0.00 C ATOM 439 C GLU A 29 -23.901 -5.861 -5.313 1.00 0.00 C ATOM 440 O GLU A 29 -23.829 -6.396 -4.206 1.00 0.00 O ATOM 441 CB GLU A 29 -22.322 -7.389 -6.533 1.00 0.00 C ATOM 442 CG GLU A 29 -22.056 -8.269 -7.747 1.00 0.00 C ATOM 443 CD GLU A 29 -20.814 -9.121 -7.589 1.00 0.00 C ATOM 444 OE1 GLU A 29 -20.836 -10.063 -6.769 1.00 0.00 O ATOM 445 OE2 GLU A 29 -19.807 -8.851 -8.279 1.00 0.00 O ATOM 0 H GLU A 29 -22.848 -5.481 -8.104 1.00 0.00 H new ATOM 0 HA GLU A 29 -24.468 -7.415 -6.646 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -21.528 -6.646 -6.450 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -22.280 -8.002 -5.633 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -22.916 -8.916 -7.917 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -21.950 -7.640 -8.631 1.00 0.00 H new ATOM 452 N GLY A 30 -24.170 -4.569 -5.471 1.00 0.00 N ATOM 453 CA GLY A 30 -24.566 -3.742 -4.344 1.00 0.00 C ATOM 454 C GLY A 30 -23.403 -3.169 -3.558 1.00 0.00 C ATOM 455 O GLY A 30 -23.492 -2.999 -2.341 1.00 0.00 O ATOM 0 H GLY A 30 -24.121 -4.077 -6.363 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -25.184 -2.921 -4.709 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -25.187 -4.335 -3.673 1.00 0.00 H new ATOM 459 N PHE A 31 -22.314 -2.865 -4.243 1.00 0.00 N ATOM 460 CA PHE A 31 -21.171 -2.227 -3.606 1.00 0.00 C ATOM 461 C PHE A 31 -21.347 -0.705 -3.686 1.00 0.00 C ATOM 462 O PHE A 31 -21.453 -0.145 -4.778 1.00 0.00 O ATOM 463 CB PHE A 31 -19.859 -2.665 -4.275 1.00 0.00 C ATOM 464 CG PHE A 31 -19.715 -4.161 -4.490 1.00 0.00 C ATOM 465 CD1 PHE A 31 -20.379 -5.077 -3.685 1.00 0.00 C ATOM 466 CD2 PHE A 31 -18.906 -4.648 -5.507 1.00 0.00 C ATOM 467 CE1 PHE A 31 -20.239 -6.437 -3.892 1.00 0.00 C ATOM 468 CE2 PHE A 31 -18.764 -6.005 -5.716 1.00 0.00 C ATOM 469 CZ PHE A 31 -19.432 -6.900 -4.909 1.00 0.00 C ATOM 0 H PHE A 31 -22.196 -3.049 -5.239 1.00 0.00 H new ATOM 0 HA PHE A 31 -21.119 -2.531 -2.560 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -19.777 -2.165 -5.240 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -19.025 -2.319 -3.665 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -21.014 -4.722 -2.886 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -18.379 -3.954 -6.145 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -20.762 -7.137 -3.257 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -18.129 -6.365 -6.512 1.00 0.00 H new ATOM 0 HZ PHE A 31 -19.324 -7.962 -5.073 1.00 0.00 H new ATOM 479 N THR A 32 -21.396 -0.056 -2.525 1.00 0.00 N ATOM 480 CA THR A 32 -21.807 1.349 -2.417 1.00 0.00 C ATOM 481 C THR A 32 -20.632 2.318 -2.249 1.00 0.00 C ATOM 482 O THR A 32 -20.693 3.467 -2.687 1.00 0.00 O ATOM 483 CB THR A 32 -22.743 1.526 -1.208 1.00 0.00 C ATOM 484 OG1 THR A 32 -22.076 1.102 -0.011 1.00 0.00 O ATOM 485 CG2 THR A 32 -24.006 0.728 -1.384 1.00 0.00 C ATOM 0 H THR A 32 -21.153 -0.485 -1.632 1.00 0.00 H new ATOM 0 HA THR A 32 -22.308 1.589 -3.355 1.00 0.00 H new ATOM 0 HB THR A 32 -23.005 2.581 -1.132 1.00 0.00 H new ATOM 0 HG1 THR A 32 -21.545 1.844 0.348 1.00 0.00 H new ATOM 0 HG21 THR A 32 -24.650 0.870 -0.516 1.00 0.00 H new ATOM 0 HG22 THR A 32 -24.526 1.063 -2.281 1.00 0.00 H new ATOM 0 HG23 THR A 32 -23.758 -0.329 -1.482 1.00 0.00 H new ATOM 493 N HIS A 33 -19.576 1.863 -1.603 1.00 0.00 N ATOM 494 CA HIS A 33 -18.461 2.730 -1.242 1.00 0.00 C ATOM 495 C HIS A 33 -17.250 2.453 -2.126 1.00 0.00 C ATOM 496 O HIS A 33 -16.803 1.313 -2.225 1.00 0.00 O ATOM 497 CB HIS A 33 -18.085 2.515 0.230 1.00 0.00 C ATOM 498 CG HIS A 33 -18.797 3.417 1.193 1.00 0.00 C ATOM 499 ND1 HIS A 33 -20.038 3.142 1.730 1.00 0.00 N ATOM 500 CD2 HIS A 33 -18.405 4.587 1.749 1.00 0.00 C ATOM 501 CE1 HIS A 33 -20.372 4.105 2.574 1.00 0.00 C ATOM 502 NE2 HIS A 33 -19.398 4.993 2.604 1.00 0.00 N ATOM 0 H HIS A 33 -19.463 0.891 -1.314 1.00 0.00 H new ATOM 0 HA HIS A 33 -18.771 3.764 -1.391 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -18.296 1.480 0.498 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -17.011 2.661 0.342 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -17.478 5.107 1.555 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -21.289 4.155 3.143 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -19.385 5.842 3.170 1.00 0.00 H new ATOM 511 N ASP A 34 -16.723 3.495 -2.754 1.00 0.00 N ATOM 512 CA ASP A 34 -15.542 3.361 -3.595 1.00 0.00 C ATOM 513 C ASP A 34 -14.326 3.804 -2.819 1.00 0.00 C ATOM 514 O ASP A 34 -14.401 4.734 -2.013 1.00 0.00 O ATOM 515 CB ASP A 34 -15.641 4.215 -4.863 1.00 0.00 C ATOM 516 CG ASP A 34 -16.784 3.835 -5.775 1.00 0.00 C ATOM 517 OD1 ASP A 34 -17.119 2.637 -5.855 1.00 0.00 O ATOM 518 OD2 ASP A 34 -17.339 4.742 -6.432 1.00 0.00 O ATOM 0 H ASP A 34 -17.095 4.443 -2.697 1.00 0.00 H new ATOM 0 HA ASP A 34 -15.464 2.314 -3.888 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -15.751 5.261 -4.576 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -14.706 4.134 -5.417 1.00 0.00 H new ATOM 523 N TRP A 35 -13.213 3.144 -3.054 1.00 0.00 N ATOM 524 CA TRP A 35 -11.974 3.538 -2.423 1.00 0.00 C ATOM 525 C TRP A 35 -10.771 3.264 -3.317 1.00 0.00 C ATOM 526 O TRP A 35 -10.822 2.423 -4.217 1.00 0.00 O ATOM 527 CB TRP A 35 -11.809 2.864 -1.052 1.00 0.00 C ATOM 528 CG TRP A 35 -11.931 1.368 -1.042 1.00 0.00 C ATOM 529 CD1 TRP A 35 -13.017 0.626 -0.651 1.00 0.00 C ATOM 530 CD2 TRP A 35 -10.912 0.429 -1.399 1.00 0.00 C ATOM 531 NE1 TRP A 35 -12.727 -0.716 -0.754 1.00 0.00 N ATOM 532 CE2 TRP A 35 -11.441 -0.861 -1.210 1.00 0.00 C ATOM 533 CE3 TRP A 35 -9.601 0.558 -1.865 1.00 0.00 C ATOM 534 CZ2 TRP A 35 -10.700 -2.013 -1.465 1.00 0.00 C ATOM 535 CZ3 TRP A 35 -8.867 -0.585 -2.114 1.00 0.00 C ATOM 536 CH2 TRP A 35 -9.416 -1.853 -1.913 1.00 0.00 C ATOM 0 H TRP A 35 -13.141 2.337 -3.674 1.00 0.00 H new ATOM 0 HA TRP A 35 -12.022 4.615 -2.264 1.00 0.00 H new ATOM 0 HB2 TRP A 35 -10.832 3.133 -0.651 1.00 0.00 H new ATOM 0 HB3 TRP A 35 -12.556 3.275 -0.373 1.00 0.00 H new ATOM 0 HD1 TRP A 35 -13.958 1.034 -0.313 1.00 0.00 H new ATOM 0 HE1 TRP A 35 -13.365 -1.479 -0.528 1.00 0.00 H new ATOM 0 HE3 TRP A 35 -9.169 1.535 -2.028 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 -11.123 -2.996 -1.315 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 -7.851 -0.497 -2.470 1.00 0.00 H new ATOM 0 HH2 TRP A 35 -8.815 -2.727 -2.115 1.00 0.00 H new ATOM 547 N MET A 36 -9.701 4.001 -3.064 1.00 0.00 N ATOM 548 CA MET A 36 -8.450 3.840 -3.791 1.00 0.00 C ATOM 549 C MET A 36 -7.280 3.826 -2.822 1.00 0.00 C ATOM 550 O MET A 36 -7.116 4.763 -2.057 1.00 0.00 O ATOM 551 CB MET A 36 -8.228 4.979 -4.789 1.00 0.00 C ATOM 552 CG MET A 36 -6.867 4.892 -5.462 1.00 0.00 C ATOM 553 SD MET A 36 -6.420 6.387 -6.338 1.00 0.00 S ATOM 554 CE MET A 36 -5.416 7.123 -5.065 1.00 0.00 C ATOM 0 H MET A 36 -9.674 4.728 -2.349 1.00 0.00 H new ATOM 0 HA MET A 36 -8.512 2.896 -4.333 1.00 0.00 H new ATOM 0 HB2 MET A 36 -9.010 4.953 -5.548 1.00 0.00 H new ATOM 0 HB3 MET A 36 -8.316 5.935 -4.273 1.00 0.00 H new ATOM 0 HG2 MET A 36 -6.109 4.679 -4.708 1.00 0.00 H new ATOM 0 HG3 MET A 36 -6.866 4.055 -6.160 1.00 0.00 H new ATOM 0 HE1 MET A 36 -5.428 8.207 -5.174 1.00 0.00 H new ATOM 0 HE2 MET A 36 -5.813 6.852 -4.087 1.00 0.00 H new ATOM 0 HE3 MET A 36 -4.392 6.760 -5.154 1.00 0.00 H new ATOM 564 N VAL A 37 -6.463 2.789 -2.871 1.00 0.00 N ATOM 565 CA VAL A 37 -5.320 2.675 -1.969 1.00 0.00 C ATOM 566 C VAL A 37 -4.033 3.195 -2.593 1.00 0.00 C ATOM 567 O VAL A 37 -3.856 3.147 -3.811 1.00 0.00 O ATOM 568 CB VAL A 37 -5.097 1.228 -1.509 1.00 0.00 C ATOM 569 CG1 VAL A 37 -5.810 0.968 -0.211 1.00 0.00 C ATOM 570 CG2 VAL A 37 -5.570 0.255 -2.568 1.00 0.00 C ATOM 0 H VAL A 37 -6.566 2.012 -3.524 1.00 0.00 H new ATOM 0 HA VAL A 37 -5.567 3.295 -1.107 1.00 0.00 H new ATOM 0 HB VAL A 37 -4.028 1.082 -1.353 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -5.639 -0.063 0.098 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -5.429 1.644 0.555 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -6.879 1.135 -0.343 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -5.404 -0.766 -2.224 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -6.633 0.407 -2.753 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -5.014 0.422 -3.490 1.00 0.00 H new ATOM 580 N PHE A 38 -3.150 3.662 -1.715 1.00 0.00 N ATOM 581 CA PHE A 38 -1.864 4.262 -2.069 1.00 0.00 C ATOM 582 C PHE A 38 -0.710 3.470 -1.461 1.00 0.00 C ATOM 583 O PHE A 38 -0.690 3.249 -0.250 1.00 0.00 O ATOM 584 CB PHE A 38 -1.771 5.679 -1.482 1.00 0.00 C ATOM 585 CG PHE A 38 -2.045 6.835 -2.405 1.00 0.00 C ATOM 586 CD1 PHE A 38 -1.080 7.264 -3.300 1.00 0.00 C ATOM 587 CD2 PHE A 38 -3.246 7.528 -2.338 1.00 0.00 C ATOM 588 CE1 PHE A 38 -1.303 8.356 -4.114 1.00 0.00 C ATOM 589 CE2 PHE A 38 -3.476 8.619 -3.153 1.00 0.00 C ATOM 590 CZ PHE A 38 -2.507 9.036 -4.042 1.00 0.00 C ATOM 0 H PHE A 38 -3.313 3.633 -0.708 1.00 0.00 H new ATOM 0 HA PHE A 38 -1.797 4.270 -3.157 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -2.469 5.743 -0.647 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -0.770 5.807 -1.071 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -0.139 6.737 -3.362 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -4.008 7.211 -1.642 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -0.540 8.680 -4.806 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -4.416 9.147 -3.094 1.00 0.00 H new ATOM 0 HZ PHE A 38 -2.687 9.889 -4.679 1.00 0.00 H new ATOM 600 N VAL A 39 0.225 3.020 -2.286 1.00 0.00 N ATOM 601 CA VAL A 39 1.547 2.652 -1.801 1.00 0.00 C ATOM 602 C VAL A 39 2.613 3.278 -2.700 1.00 0.00 C ATOM 603 O VAL A 39 2.631 3.055 -3.906 1.00 0.00 O ATOM 604 CB VAL A 39 1.738 1.126 -1.699 1.00 0.00 C ATOM 605 CG1 VAL A 39 0.977 0.595 -0.505 1.00 0.00 C ATOM 606 CG2 VAL A 39 1.281 0.420 -2.957 1.00 0.00 C ATOM 0 H VAL A 39 0.093 2.901 -3.290 1.00 0.00 H new ATOM 0 HA VAL A 39 1.650 3.040 -0.788 1.00 0.00 H new ATOM 0 HB VAL A 39 2.803 0.928 -1.575 1.00 0.00 H new ATOM 0 HG11 VAL A 39 1.115 -0.484 -0.436 1.00 0.00 H new ATOM 0 HG12 VAL A 39 1.351 1.067 0.404 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.083 0.819 -0.621 1.00 0.00 H new ATOM 0 HG21 VAL A 39 1.432 -0.654 -2.847 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.223 0.623 -3.124 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.859 0.782 -3.808 1.00 0.00 H new ATOM 616 N ARG A 40 3.468 4.101 -2.112 1.00 0.00 N ATOM 617 CA ARG A 40 4.469 4.852 -2.873 1.00 0.00 C ATOM 618 C ARG A 40 5.500 5.448 -1.931 1.00 0.00 C ATOM 619 O ARG A 40 5.504 5.147 -0.746 1.00 0.00 O ATOM 620 CB ARG A 40 3.825 5.999 -3.661 1.00 0.00 C ATOM 621 CG ARG A 40 3.262 7.089 -2.753 1.00 0.00 C ATOM 622 CD ARG A 40 3.360 8.477 -3.371 1.00 0.00 C ATOM 623 NE ARG A 40 3.225 9.516 -2.353 1.00 0.00 N ATOM 624 CZ ARG A 40 3.630 10.777 -2.495 1.00 0.00 C ATOM 625 NH1 ARG A 40 4.144 11.200 -3.643 1.00 0.00 N ATOM 626 NH2 ARG A 40 3.503 11.622 -1.481 1.00 0.00 N ATOM 0 H ARG A 40 3.493 4.270 -1.106 1.00 0.00 H new ATOM 0 HA ARG A 40 4.940 4.156 -3.567 1.00 0.00 H new ATOM 0 HB2 ARG A 40 4.566 6.436 -4.331 1.00 0.00 H new ATOM 0 HB3 ARG A 40 3.025 5.602 -4.286 1.00 0.00 H new ATOM 0 HG2 ARG A 40 2.218 6.868 -2.531 1.00 0.00 H new ATOM 0 HG3 ARG A 40 3.799 7.079 -1.804 1.00 0.00 H new ATOM 0 HD2 ARG A 40 4.317 8.585 -3.881 1.00 0.00 H new ATOM 0 HD3 ARG A 40 2.582 8.599 -4.125 1.00 0.00 H new ATOM 0 HE ARG A 40 2.788 9.257 -1.468 1.00 0.00 H new ATOM 0 HH11 ARG A 40 4.233 10.557 -4.430 1.00 0.00 H new ATOM 0 HH12 ARG A 40 4.450 12.168 -3.739 1.00 0.00 H new ATOM 0 HH21 ARG A 40 3.098 11.305 -0.600 1.00 0.00 H new ATOM 0 HH22 ARG A 40 3.811 12.589 -1.582 1.00 0.00 H new ATOM 640 N GLY A 41 6.389 6.265 -2.473 1.00 0.00 N ATOM 641 CA GLY A 41 7.323 6.994 -1.645 1.00 0.00 C ATOM 642 C GLY A 41 6.950 8.458 -1.543 1.00 0.00 C ATOM 643 O GLY A 41 6.388 9.016 -2.486 1.00 0.00 O ATOM 0 H GLY A 41 6.480 6.436 -3.474 1.00 0.00 H new ATOM 0 HA2 GLY A 41 7.348 6.554 -0.648 1.00 0.00 H new ATOM 0 HA3 GLY A 41 8.327 6.901 -2.059 1.00 0.00 H new ATOM 647 N PRO A 42 7.264 9.098 -0.407 1.00 0.00 N ATOM 648 CA PRO A 42 6.910 10.500 -0.135 1.00 0.00 C ATOM 649 C PRO A 42 7.466 11.481 -1.159 1.00 0.00 C ATOM 650 O PRO A 42 8.232 11.108 -2.047 1.00 0.00 O ATOM 651 CB PRO A 42 7.531 10.780 1.238 1.00 0.00 C ATOM 652 CG PRO A 42 7.804 9.448 1.842 1.00 0.00 C ATOM 653 CD PRO A 42 7.999 8.485 0.711 1.00 0.00 C ATOM 0 HA PRO A 42 5.829 10.635 -0.176 1.00 0.00 H new ATOM 0 HB2 PRO A 42 8.449 11.360 1.141 1.00 0.00 H new ATOM 0 HB3 PRO A 42 6.852 11.360 1.863 1.00 0.00 H new ATOM 0 HG2 PRO A 42 8.692 9.486 2.474 1.00 0.00 H new ATOM 0 HG3 PRO A 42 6.975 9.135 2.476 1.00 0.00 H new ATOM 0 HD2 PRO A 42 9.055 8.357 0.473 1.00 0.00 H new ATOM 0 HD3 PRO A 42 7.606 7.498 0.954 1.00 0.00 H new ATOM 661 N GLU A 43 7.071 12.737 -1.021 1.00 0.00 N ATOM 662 CA GLU A 43 7.504 13.787 -1.923 1.00 0.00 C ATOM 663 C GLU A 43 9.024 13.870 -1.988 1.00 0.00 C ATOM 664 O GLU A 43 9.695 14.018 -0.969 1.00 0.00 O ATOM 665 CB GLU A 43 6.909 15.124 -1.497 1.00 0.00 C ATOM 666 CG GLU A 43 5.393 15.145 -1.557 1.00 0.00 C ATOM 667 CD GLU A 43 4.862 14.958 -2.962 1.00 0.00 C ATOM 668 OE1 GLU A 43 4.857 13.811 -3.458 1.00 0.00 O ATOM 669 OE2 GLU A 43 4.453 15.960 -3.582 1.00 0.00 O ATOM 0 H GLU A 43 6.443 13.054 -0.282 1.00 0.00 H new ATOM 0 HA GLU A 43 7.144 13.545 -2.923 1.00 0.00 H new ATOM 0 HB2 GLU A 43 7.230 15.351 -0.480 1.00 0.00 H new ATOM 0 HB3 GLU A 43 7.303 15.912 -2.139 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.997 14.358 -0.915 1.00 0.00 H new ATOM 0 HG3 GLU A 43 5.031 16.093 -1.159 1.00 0.00 H new ATOM 676 N HIS A 44 9.535 13.717 -3.206 1.00 0.00 N ATOM 677 CA HIS A 44 10.970 13.807 -3.523 1.00 0.00 C ATOM 678 C HIS A 44 11.685 12.484 -3.300 1.00 0.00 C ATOM 679 O HIS A 44 12.798 12.283 -3.785 1.00 0.00 O ATOM 680 CB HIS A 44 11.681 14.936 -2.766 1.00 0.00 C ATOM 681 CG HIS A 44 11.394 16.294 -3.322 1.00 0.00 C ATOM 682 ND1 HIS A 44 11.860 16.707 -4.550 1.00 0.00 N ATOM 683 CD2 HIS A 44 10.669 17.327 -2.829 1.00 0.00 C ATOM 684 CE1 HIS A 44 11.434 17.931 -4.789 1.00 0.00 C ATOM 685 NE2 HIS A 44 10.707 18.333 -3.763 1.00 0.00 N ATOM 0 H HIS A 44 8.956 13.522 -4.023 1.00 0.00 H new ATOM 0 HA HIS A 44 11.021 14.049 -4.584 1.00 0.00 H new ATOM 0 HB2 HIS A 44 11.379 14.908 -1.719 1.00 0.00 H new ATOM 0 HB3 HIS A 44 12.756 14.760 -2.792 1.00 0.00 H new ATOM 0 HD2 HIS A 44 10.157 17.354 -1.879 1.00 0.00 H new ATOM 0 HE1 HIS A 44 11.645 18.509 -5.677 1.00 0.00 H new ATOM 0 HE2 HIS A 44 10.249 19.241 -3.678 1.00 0.00 H new ATOM 694 N SER A 45 11.061 11.585 -2.565 1.00 0.00 N ATOM 695 CA SER A 45 11.577 10.236 -2.433 1.00 0.00 C ATOM 696 C SER A 45 10.840 9.306 -3.394 1.00 0.00 C ATOM 697 O SER A 45 9.650 9.033 -3.219 1.00 0.00 O ATOM 698 CB SER A 45 11.422 9.755 -0.988 1.00 0.00 C ATOM 699 OG SER A 45 10.176 10.156 -0.459 1.00 0.00 O ATOM 0 H SER A 45 10.198 11.763 -2.051 1.00 0.00 H new ATOM 0 HA SER A 45 12.637 10.228 -2.685 1.00 0.00 H new ATOM 0 HB2 SER A 45 11.506 8.669 -0.950 1.00 0.00 H new ATOM 0 HB3 SER A 45 12.229 10.159 -0.377 1.00 0.00 H new ATOM 0 HG SER A 45 9.506 10.168 -1.174 1.00 0.00 H new ATOM 705 N ASN A 46 11.534 8.818 -4.410 1.00 0.00 N ATOM 706 CA ASN A 46 10.916 7.906 -5.360 1.00 0.00 C ATOM 707 C ASN A 46 11.326 6.481 -5.063 1.00 0.00 C ATOM 708 O ASN A 46 12.514 6.167 -4.976 1.00 0.00 O ATOM 709 CB ASN A 46 11.273 8.271 -6.802 1.00 0.00 C ATOM 710 CG ASN A 46 10.343 9.314 -7.393 1.00 0.00 C ATOM 711 OD1 ASN A 46 9.089 9.310 -6.961 1.00 0.00 O flip ATOM 712 ND2 ASN A 46 10.744 10.109 -8.244 1.00 0.00 N flip ATOM 0 H ASN A 46 12.513 9.034 -4.597 1.00 0.00 H new ATOM 0 HA ASN A 46 9.835 7.995 -5.252 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.297 8.644 -6.835 1.00 0.00 H new ATOM 0 HB3 ASN A 46 11.241 7.372 -7.418 1.00 0.00 H new ATOM 0 HD21 ASN A 46 11.716 10.080 -8.551 1.00 0.00 H new ATOM 0 HD22 ASN A 46 10.104 10.796 -8.642 1.00 0.00 H new ATOM 719 N ILE A 47 10.339 5.609 -4.929 1.00 0.00 N ATOM 720 CA ILE A 47 10.608 4.245 -4.517 1.00 0.00 C ATOM 721 C ILE A 47 10.964 3.356 -5.685 1.00 0.00 C ATOM 722 O ILE A 47 11.560 2.316 -5.490 1.00 0.00 O ATOM 723 CB ILE A 47 9.439 3.610 -3.772 1.00 0.00 C ATOM 724 CG1 ILE A 47 8.274 3.347 -4.709 1.00 0.00 C ATOM 725 CG2 ILE A 47 9.030 4.493 -2.623 1.00 0.00 C ATOM 726 CD1 ILE A 47 7.178 2.539 -4.063 1.00 0.00 C ATOM 0 H ILE A 47 9.356 5.820 -5.098 1.00 0.00 H new ATOM 0 HA ILE A 47 11.460 4.322 -3.841 1.00 0.00 H new ATOM 0 HB ILE A 47 9.756 2.646 -3.374 1.00 0.00 H new ATOM 0 HG12 ILE A 47 7.866 4.298 -5.050 1.00 0.00 H new ATOM 0 HG13 ILE A 47 8.635 2.820 -5.592 1.00 0.00 H new ATOM 0 HG21 ILE A 47 8.194 4.036 -2.093 1.00 0.00 H new ATOM 0 HG22 ILE A 47 9.871 4.614 -1.940 1.00 0.00 H new ATOM 0 HG23 ILE A 47 8.728 5.469 -3.004 1.00 0.00 H new ATOM 0 HD11 ILE A 47 6.371 2.382 -4.779 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.575 1.575 -3.746 1.00 0.00 H new ATOM 0 HD13 ILE A 47 6.793 3.075 -3.196 1.00 0.00 H new ATOM 738 N GLN A 48 10.623 3.775 -6.899 1.00 0.00 N ATOM 739 CA GLN A 48 10.880 2.969 -8.099 1.00 0.00 C ATOM 740 C GLN A 48 12.383 2.700 -8.253 1.00 0.00 C ATOM 741 O GLN A 48 12.814 1.876 -9.059 1.00 0.00 O ATOM 742 CB GLN A 48 10.313 3.696 -9.333 1.00 0.00 C ATOM 743 CG GLN A 48 10.579 3.006 -10.668 1.00 0.00 C ATOM 744 CD GLN A 48 9.910 1.649 -10.797 1.00 0.00 C ATOM 745 OE1 GLN A 48 8.725 1.511 -10.233 1.00 0.00 O flip ATOM 746 NE2 GLN A 48 10.441 0.744 -11.439 1.00 0.00 N flip ATOM 0 H GLN A 48 10.167 4.669 -7.084 1.00 0.00 H new ATOM 0 HA GLN A 48 10.382 2.004 -8.003 1.00 0.00 H new ATOM 0 HB2 GLN A 48 9.236 3.807 -9.207 1.00 0.00 H new ATOM 0 HB3 GLN A 48 10.735 4.700 -9.370 1.00 0.00 H new ATOM 0 HG2 GLN A 48 10.232 3.651 -11.476 1.00 0.00 H new ATOM 0 HG3 GLN A 48 11.655 2.885 -10.796 1.00 0.00 H new ATOM 0 HE21 GLN A 48 11.358 0.888 -11.861 1.00 0.00 H new ATOM 0 HE22 GLN A 48 9.964 -0.151 -11.550 1.00 0.00 H new ATOM 755 N HIS A 49 13.167 3.389 -7.443 1.00 0.00 N ATOM 756 CA HIS A 49 14.605 3.198 -7.409 1.00 0.00 C ATOM 757 C HIS A 49 14.974 1.956 -6.603 1.00 0.00 C ATOM 758 O HIS A 49 15.890 1.229 -6.972 1.00 0.00 O ATOM 759 CB HIS A 49 15.300 4.435 -6.832 1.00 0.00 C ATOM 760 CG HIS A 49 15.497 5.530 -7.835 1.00 0.00 C ATOM 761 ND1 HIS A 49 15.958 5.307 -9.116 1.00 0.00 N ATOM 762 CD2 HIS A 49 15.274 6.860 -7.750 1.00 0.00 C ATOM 763 CE1 HIS A 49 16.004 6.450 -9.770 1.00 0.00 C ATOM 764 NE2 HIS A 49 15.594 7.409 -8.966 1.00 0.00 N ATOM 0 H HIS A 49 12.825 4.095 -6.792 1.00 0.00 H new ATOM 0 HA HIS A 49 14.948 3.052 -8.433 1.00 0.00 H new ATOM 0 HB2 HIS A 49 14.711 4.818 -5.999 1.00 0.00 H new ATOM 0 HB3 HIS A 49 16.270 4.143 -6.429 1.00 0.00 H new ATOM 0 HD2 HIS A 49 14.911 7.393 -6.884 1.00 0.00 H new ATOM 0 HE1 HIS A 49 16.324 6.579 -10.793 1.00 0.00 H new ATOM 0 HE2 HIS A 49 15.526 8.398 -9.208 1.00 0.00 H new ATOM 773 N PHE A 50 14.252 1.699 -5.519 1.00 0.00 N ATOM 774 CA PHE A 50 14.557 0.554 -4.664 1.00 0.00 C ATOM 775 C PHE A 50 13.386 -0.432 -4.592 1.00 0.00 C ATOM 776 O PHE A 50 13.477 -1.477 -3.948 1.00 0.00 O ATOM 777 CB PHE A 50 14.980 1.025 -3.264 1.00 0.00 C ATOM 778 CG PHE A 50 13.970 1.868 -2.532 1.00 0.00 C ATOM 779 CD1 PHE A 50 12.938 1.296 -1.801 1.00 0.00 C ATOM 780 CD2 PHE A 50 14.074 3.245 -2.559 1.00 0.00 C ATOM 781 CE1 PHE A 50 12.034 2.083 -1.122 1.00 0.00 C ATOM 782 CE2 PHE A 50 13.166 4.036 -1.881 1.00 0.00 C ATOM 783 CZ PHE A 50 12.144 3.454 -1.164 1.00 0.00 C ATOM 0 H PHE A 50 13.458 2.261 -5.212 1.00 0.00 H new ATOM 0 HA PHE A 50 15.394 0.018 -5.112 1.00 0.00 H new ATOM 0 HB2 PHE A 50 15.204 0.148 -2.657 1.00 0.00 H new ATOM 0 HB3 PHE A 50 15.905 1.594 -3.355 1.00 0.00 H new ATOM 0 HD1 PHE A 50 12.843 0.221 -1.764 1.00 0.00 H new ATOM 0 HD2 PHE A 50 14.874 3.709 -3.116 1.00 0.00 H new ATOM 0 HE1 PHE A 50 11.238 1.623 -0.556 1.00 0.00 H new ATOM 0 HE2 PHE A 50 13.258 5.112 -1.913 1.00 0.00 H new ATOM 0 HZ PHE A 50 11.432 4.071 -0.637 1.00 0.00 H new ATOM 793 N VAL A 51 12.305 -0.103 -5.286 1.00 0.00 N ATOM 794 CA VAL A 51 11.092 -0.906 -5.284 1.00 0.00 C ATOM 795 C VAL A 51 10.783 -1.397 -6.695 1.00 0.00 C ATOM 796 O VAL A 51 10.873 -0.643 -7.664 1.00 0.00 O ATOM 797 CB VAL A 51 9.907 -0.094 -4.703 1.00 0.00 C ATOM 798 CG1 VAL A 51 8.573 -0.785 -4.936 1.00 0.00 C ATOM 799 CG2 VAL A 51 10.120 0.123 -3.214 1.00 0.00 C ATOM 0 H VAL A 51 12.246 0.732 -5.868 1.00 0.00 H new ATOM 0 HA VAL A 51 11.246 -1.777 -4.647 1.00 0.00 H new ATOM 0 HB VAL A 51 9.876 0.865 -5.221 1.00 0.00 H new ATOM 0 HG11 VAL A 51 7.771 -0.180 -4.512 1.00 0.00 H new ATOM 0 HG12 VAL A 51 8.409 -0.907 -6.007 1.00 0.00 H new ATOM 0 HG13 VAL A 51 8.582 -1.764 -4.456 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.286 0.694 -2.807 1.00 0.00 H new ATOM 0 HG22 VAL A 51 10.179 -0.842 -2.711 1.00 0.00 H new ATOM 0 HG23 VAL A 51 11.048 0.673 -3.055 1.00 0.00 H new ATOM 809 N GLU A 52 10.438 -2.675 -6.792 1.00 0.00 N ATOM 810 CA GLU A 52 10.274 -3.347 -8.076 1.00 0.00 C ATOM 811 C GLU A 52 8.806 -3.367 -8.498 1.00 0.00 C ATOM 812 O GLU A 52 8.426 -2.776 -9.509 1.00 0.00 O ATOM 813 CB GLU A 52 10.816 -4.781 -7.967 1.00 0.00 C ATOM 814 CG GLU A 52 10.813 -5.564 -9.273 1.00 0.00 C ATOM 815 CD GLU A 52 11.736 -4.970 -10.318 1.00 0.00 C ATOM 816 OE1 GLU A 52 12.927 -5.349 -10.351 1.00 0.00 O ATOM 817 OE2 GLU A 52 11.275 -4.133 -11.121 1.00 0.00 O ATOM 0 H GLU A 52 10.264 -3.274 -5.985 1.00 0.00 H new ATOM 0 HA GLU A 52 10.832 -2.800 -8.836 1.00 0.00 H new ATOM 0 HB2 GLU A 52 11.836 -4.741 -7.586 1.00 0.00 H new ATOM 0 HB3 GLU A 52 10.222 -5.324 -7.232 1.00 0.00 H new ATOM 0 HG2 GLU A 52 11.112 -6.593 -9.074 1.00 0.00 H new ATOM 0 HG3 GLU A 52 9.798 -5.597 -9.669 1.00 0.00 H new ATOM 824 N LYS A 53 7.992 -4.058 -7.718 1.00 0.00 N ATOM 825 CA LYS A 53 6.572 -4.171 -7.991 1.00 0.00 C ATOM 826 C LYS A 53 5.786 -4.080 -6.693 1.00 0.00 C ATOM 827 O LYS A 53 6.368 -3.968 -5.619 1.00 0.00 O ATOM 828 CB LYS A 53 6.279 -5.490 -8.710 1.00 0.00 C ATOM 829 CG LYS A 53 6.734 -6.728 -7.947 1.00 0.00 C ATOM 830 CD LYS A 53 6.396 -8.008 -8.694 1.00 0.00 C ATOM 831 CE LYS A 53 4.901 -8.254 -8.743 1.00 0.00 C ATOM 832 NZ LYS A 53 4.552 -9.299 -9.737 1.00 0.00 N ATOM 0 H LYS A 53 8.297 -4.554 -6.881 1.00 0.00 H new ATOM 0 HA LYS A 53 6.265 -3.350 -8.640 1.00 0.00 H new ATOM 0 HB2 LYS A 53 5.207 -5.562 -8.892 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.767 -5.477 -9.684 1.00 0.00 H new ATOM 0 HG2 LYS A 53 7.810 -6.677 -7.781 1.00 0.00 H new ATOM 0 HG3 LYS A 53 6.261 -6.744 -6.965 1.00 0.00 H new ATOM 0 HD2 LYS A 53 6.788 -7.950 -9.709 1.00 0.00 H new ATOM 0 HD3 LYS A 53 6.887 -8.852 -8.210 1.00 0.00 H new ATOM 0 HE2 LYS A 53 4.549 -8.557 -7.757 1.00 0.00 H new ATOM 0 HE3 LYS A 53 4.387 -7.326 -8.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 3.522 -9.441 -9.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 4.866 -8.998 -10.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 5.023 -10.191 -9.483 1.00 0.00 H new ATOM 846 N VAL A 54 4.473 -4.135 -6.797 1.00 0.00 N ATOM 847 CA VAL A 54 3.597 -3.979 -5.646 1.00 0.00 C ATOM 848 C VAL A 54 2.358 -4.852 -5.804 1.00 0.00 C ATOM 849 O VAL A 54 1.953 -5.151 -6.929 1.00 0.00 O ATOM 850 CB VAL A 54 3.206 -2.496 -5.474 1.00 0.00 C ATOM 851 CG1 VAL A 54 1.888 -2.322 -4.742 1.00 0.00 C ATOM 852 CG2 VAL A 54 4.306 -1.773 -4.723 1.00 0.00 C ATOM 0 H VAL A 54 3.982 -4.288 -7.678 1.00 0.00 H new ATOM 0 HA VAL A 54 4.128 -4.300 -4.750 1.00 0.00 H new ATOM 0 HB VAL A 54 3.079 -2.072 -6.470 1.00 0.00 H new ATOM 0 HG11 VAL A 54 1.661 -1.260 -4.649 1.00 0.00 H new ATOM 0 HG12 VAL A 54 1.093 -2.815 -5.302 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.962 -2.766 -3.749 1.00 0.00 H new ATOM 0 HG21 VAL A 54 4.034 -0.725 -4.599 1.00 0.00 H new ATOM 0 HG22 VAL A 54 4.440 -2.231 -3.743 1.00 0.00 H new ATOM 0 HG23 VAL A 54 5.237 -1.842 -5.286 1.00 0.00 H new ATOM 862 N VAL A 55 1.770 -5.265 -4.689 1.00 0.00 N ATOM 863 CA VAL A 55 0.605 -6.134 -4.719 1.00 0.00 C ATOM 864 C VAL A 55 -0.364 -5.772 -3.591 1.00 0.00 C ATOM 865 O VAL A 55 0.048 -5.326 -2.517 1.00 0.00 O ATOM 866 CB VAL A 55 1.023 -7.626 -4.629 1.00 0.00 C ATOM 867 CG1 VAL A 55 0.494 -8.289 -3.369 1.00 0.00 C ATOM 868 CG2 VAL A 55 0.557 -8.384 -5.861 1.00 0.00 C ATOM 0 H VAL A 55 2.083 -5.011 -3.752 1.00 0.00 H new ATOM 0 HA VAL A 55 0.094 -5.986 -5.671 1.00 0.00 H new ATOM 0 HB VAL A 55 2.112 -7.657 -4.583 1.00 0.00 H new ATOM 0 HG11 VAL A 55 0.810 -9.332 -3.347 1.00 0.00 H new ATOM 0 HG12 VAL A 55 0.887 -7.772 -2.493 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -0.595 -8.239 -3.361 1.00 0.00 H new ATOM 0 HG21 VAL A 55 0.859 -9.428 -5.781 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.529 -8.324 -5.936 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.007 -7.944 -6.751 1.00 0.00 H new ATOM 878 N PHE A 56 -1.649 -5.955 -3.850 1.00 0.00 N ATOM 879 CA PHE A 56 -2.681 -5.705 -2.862 1.00 0.00 C ATOM 880 C PHE A 56 -3.523 -6.952 -2.692 1.00 0.00 C ATOM 881 O PHE A 56 -3.875 -7.588 -3.673 1.00 0.00 O ATOM 882 CB PHE A 56 -3.581 -4.538 -3.293 1.00 0.00 C ATOM 883 CG PHE A 56 -2.983 -3.182 -3.075 1.00 0.00 C ATOM 884 CD1 PHE A 56 -2.006 -2.690 -3.926 1.00 0.00 C ATOM 885 CD2 PHE A 56 -3.412 -2.390 -2.025 1.00 0.00 C ATOM 886 CE1 PHE A 56 -1.469 -1.436 -3.733 1.00 0.00 C ATOM 887 CE2 PHE A 56 -2.875 -1.134 -1.827 1.00 0.00 C ATOM 888 CZ PHE A 56 -1.903 -0.656 -2.682 1.00 0.00 C ATOM 0 H PHE A 56 -2.003 -6.280 -4.750 1.00 0.00 H new ATOM 0 HA PHE A 56 -2.203 -5.443 -1.918 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -3.820 -4.651 -4.351 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -4.522 -4.599 -2.746 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -1.662 -3.297 -4.750 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -4.174 -2.758 -1.354 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -0.709 -1.064 -4.404 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -3.216 -0.525 -1.003 1.00 0.00 H new ATOM 0 HZ PHE A 56 -1.483 0.327 -2.528 1.00 0.00 H new ATOM 898 N HIS A 57 -3.817 -7.323 -1.458 1.00 0.00 N ATOM 899 CA HIS A 57 -4.725 -8.435 -1.206 1.00 0.00 C ATOM 900 C HIS A 57 -5.967 -7.907 -0.529 1.00 0.00 C ATOM 901 O HIS A 57 -6.039 -7.851 0.701 1.00 0.00 O ATOM 902 CB HIS A 57 -4.090 -9.514 -0.321 1.00 0.00 C ATOM 903 CG HIS A 57 -2.813 -10.078 -0.852 1.00 0.00 C ATOM 904 ND1 HIS A 57 -2.718 -11.344 -1.379 1.00 0.00 N ATOM 905 CD2 HIS A 57 -1.568 -9.554 -0.909 1.00 0.00 C ATOM 906 CE1 HIS A 57 -1.472 -11.575 -1.736 1.00 0.00 C ATOM 907 NE2 HIS A 57 -0.751 -10.505 -1.461 1.00 0.00 N ATOM 0 H HIS A 57 -3.445 -6.877 -0.619 1.00 0.00 H new ATOM 0 HA HIS A 57 -4.966 -8.895 -2.165 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -3.903 -9.092 0.667 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -4.805 -10.326 -0.191 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -1.272 -8.569 -0.580 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -1.102 -12.488 -2.180 1.00 0.00 H new ATOM 0 HE2 HIS A 57 0.249 -10.403 -1.631 1.00 0.00 H new ATOM 916 N LEU A 58 -6.928 -7.491 -1.329 1.00 0.00 N ATOM 917 CA LEU A 58 -8.183 -6.981 -0.792 1.00 0.00 C ATOM 918 C LEU A 58 -8.942 -8.132 -0.129 1.00 0.00 C ATOM 919 O LEU A 58 -8.454 -9.263 -0.101 1.00 0.00 O ATOM 920 CB LEU A 58 -9.039 -6.327 -1.890 1.00 0.00 C ATOM 921 CG LEU A 58 -8.272 -5.644 -3.020 1.00 0.00 C ATOM 922 CD1 LEU A 58 -9.229 -4.952 -3.944 1.00 0.00 C ATOM 923 CD2 LEU A 58 -7.230 -4.670 -2.491 1.00 0.00 C ATOM 0 H LEU A 58 -6.870 -7.494 -2.347 1.00 0.00 H new ATOM 0 HA LEU A 58 -7.965 -6.210 -0.053 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -9.682 -7.092 -2.325 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -9.692 -5.589 -1.423 1.00 0.00 H new ATOM 0 HG LEU A 58 -7.736 -6.414 -3.575 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -8.673 -4.468 -4.747 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -9.917 -5.683 -4.369 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -9.793 -4.202 -3.389 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -6.708 -4.206 -3.328 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -7.721 -3.899 -1.897 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -6.514 -5.206 -1.868 1.00 0.00 H new ATOM 935 N HIS A 59 -10.123 -7.868 0.402 1.00 0.00 N ATOM 936 CA HIS A 59 -10.880 -8.930 1.056 1.00 0.00 C ATOM 937 C HIS A 59 -11.362 -9.914 0.002 1.00 0.00 C ATOM 938 O HIS A 59 -11.704 -9.528 -1.107 1.00 0.00 O ATOM 939 CB HIS A 59 -12.058 -8.357 1.852 1.00 0.00 C ATOM 940 CG HIS A 59 -12.078 -8.797 3.287 1.00 0.00 C ATOM 941 ND1 HIS A 59 -13.213 -9.253 3.926 1.00 0.00 N ATOM 942 CD2 HIS A 59 -11.091 -8.832 4.215 1.00 0.00 C ATOM 943 CE1 HIS A 59 -12.923 -9.546 5.180 1.00 0.00 C ATOM 944 NE2 HIS A 59 -11.644 -9.299 5.379 1.00 0.00 N ATOM 0 H HIS A 59 -10.573 -6.953 0.397 1.00 0.00 H new ATOM 0 HA HIS A 59 -10.234 -9.448 1.765 1.00 0.00 H new ATOM 0 HB2 HIS A 59 -12.017 -7.268 1.814 1.00 0.00 H new ATOM 0 HB3 HIS A 59 -12.990 -8.658 1.374 1.00 0.00 H new ATOM 0 HD2 HIS A 59 -10.061 -8.545 4.065 1.00 0.00 H new ATOM 0 HE1 HIS A 59 -13.616 -9.924 5.917 1.00 0.00 H new ATOM 0 HE2 HIS A 59 -11.145 -9.434 6.259 1.00 0.00 H new ATOM 953 N GLU A 60 -11.349 -11.189 0.357 1.00 0.00 N ATOM 954 CA GLU A 60 -11.647 -12.271 -0.584 1.00 0.00 C ATOM 955 C GLU A 60 -13.056 -12.161 -1.160 1.00 0.00 C ATOM 956 O GLU A 60 -13.355 -12.745 -2.201 1.00 0.00 O ATOM 957 CB GLU A 60 -11.464 -13.616 0.107 1.00 0.00 C ATOM 958 CG GLU A 60 -10.069 -13.802 0.682 1.00 0.00 C ATOM 959 CD GLU A 60 -9.855 -15.170 1.284 1.00 0.00 C ATOM 960 OE1 GLU A 60 -10.654 -15.569 2.156 1.00 0.00 O ATOM 961 OE2 GLU A 60 -8.876 -15.845 0.901 1.00 0.00 O ATOM 0 H GLU A 60 -11.133 -11.508 1.301 1.00 0.00 H new ATOM 0 HA GLU A 60 -10.951 -12.187 -1.419 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -12.197 -13.710 0.908 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -11.667 -14.415 -0.606 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -9.333 -13.639 -0.105 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -9.893 -13.044 1.445 1.00 0.00 H new ATOM 968 N SER A 61 -13.916 -11.430 -0.465 1.00 0.00 N ATOM 969 CA SER A 61 -15.245 -11.107 -0.969 1.00 0.00 C ATOM 970 C SER A 61 -15.150 -10.264 -2.250 1.00 0.00 C ATOM 971 O SER A 61 -16.061 -10.268 -3.080 1.00 0.00 O ATOM 972 CB SER A 61 -16.039 -10.357 0.107 1.00 0.00 C ATOM 973 OG SER A 61 -17.394 -10.183 -0.269 1.00 0.00 O ATOM 0 H SER A 61 -13.715 -11.046 0.458 1.00 0.00 H new ATOM 0 HA SER A 61 -15.763 -12.035 -1.212 1.00 0.00 H new ATOM 0 HB2 SER A 61 -15.990 -10.908 1.046 1.00 0.00 H new ATOM 0 HB3 SER A 61 -15.582 -9.383 0.284 1.00 0.00 H new ATOM 0 HG SER A 61 -17.871 -9.703 0.440 1.00 0.00 H new ATOM 979 N PHE A 62 -14.036 -9.554 -2.405 1.00 0.00 N ATOM 980 CA PHE A 62 -13.792 -8.733 -3.582 1.00 0.00 C ATOM 981 C PHE A 62 -13.366 -9.613 -4.752 1.00 0.00 C ATOM 982 O PHE A 62 -12.521 -10.495 -4.592 1.00 0.00 O ATOM 983 CB PHE A 62 -12.690 -7.699 -3.299 1.00 0.00 C ATOM 984 CG PHE A 62 -13.075 -6.622 -2.321 1.00 0.00 C ATOM 985 CD1 PHE A 62 -13.306 -6.920 -0.989 1.00 0.00 C ATOM 986 CD2 PHE A 62 -13.195 -5.308 -2.736 1.00 0.00 C ATOM 987 CE1 PHE A 62 -13.651 -5.927 -0.092 1.00 0.00 C ATOM 988 CE2 PHE A 62 -13.542 -4.311 -1.845 1.00 0.00 C ATOM 989 CZ PHE A 62 -13.771 -4.621 -0.522 1.00 0.00 C ATOM 0 H PHE A 62 -13.281 -9.533 -1.720 1.00 0.00 H new ATOM 0 HA PHE A 62 -14.715 -8.211 -3.833 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -11.811 -8.220 -2.918 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -12.400 -7.230 -4.239 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -13.216 -7.940 -0.647 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -13.015 -5.058 -3.771 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -13.827 -6.173 0.945 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -13.634 -3.290 -2.185 1.00 0.00 H new ATOM 0 HZ PHE A 62 -14.044 -3.844 0.177 1.00 0.00 H new ATOM 999 N PRO A 63 -13.959 -9.401 -5.935 1.00 0.00 N ATOM 1000 CA PRO A 63 -13.585 -10.139 -7.144 1.00 0.00 C ATOM 1001 C PRO A 63 -12.147 -9.830 -7.550 1.00 0.00 C ATOM 1002 O PRO A 63 -11.819 -8.673 -7.833 1.00 0.00 O ATOM 1003 CB PRO A 63 -14.566 -9.631 -8.209 1.00 0.00 C ATOM 1004 CG PRO A 63 -15.663 -8.966 -7.449 1.00 0.00 C ATOM 1005 CD PRO A 63 -15.038 -8.438 -6.191 1.00 0.00 C ATOM 0 HA PRO A 63 -13.635 -11.219 -7.004 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -14.080 -8.932 -8.890 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -14.949 -10.452 -8.815 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -16.107 -8.159 -8.032 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -16.462 -9.671 -7.221 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -14.654 -7.426 -6.324 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -15.752 -8.403 -5.368 1.00 0.00 H new ATOM 1013 N ARG A 64 -11.306 -10.868 -7.572 1.00 0.00 N ATOM 1014 CA ARG A 64 -9.871 -10.712 -7.821 1.00 0.00 C ATOM 1015 C ARG A 64 -9.270 -9.713 -6.833 1.00 0.00 C ATOM 1016 O ARG A 64 -8.981 -8.580 -7.196 1.00 0.00 O ATOM 1017 CB ARG A 64 -9.612 -10.236 -9.255 1.00 0.00 C ATOM 1018 CG ARG A 64 -10.045 -11.224 -10.324 1.00 0.00 C ATOM 1019 CD ARG A 64 -9.878 -10.636 -11.709 1.00 0.00 C ATOM 1020 NE ARG A 64 -10.637 -9.395 -11.870 1.00 0.00 N ATOM 1021 CZ ARG A 64 -10.186 -8.321 -12.517 1.00 0.00 C ATOM 1022 NH1 ARG A 64 -8.971 -8.318 -13.051 1.00 0.00 N ATOM 1023 NH2 ARG A 64 -10.954 -7.246 -12.619 1.00 0.00 N ATOM 0 H ARG A 64 -11.598 -11.833 -7.419 1.00 0.00 H new ATOM 0 HA ARG A 64 -9.398 -11.685 -7.686 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -10.135 -9.293 -9.414 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -8.547 -10.033 -9.372 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -9.456 -12.137 -10.240 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -11.087 -11.501 -10.167 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -8.822 -10.443 -11.896 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -10.206 -11.361 -12.453 1.00 0.00 H new ATOM 0 HE ARG A 64 -11.570 -9.349 -11.461 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -8.375 -9.142 -12.968 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -8.633 -7.492 -13.545 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -11.885 -7.243 -12.203 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -10.614 -6.421 -13.113 1.00 0.00 H new ATOM 1037 N PRO A 65 -9.076 -10.107 -5.568 1.00 0.00 N ATOM 1038 CA PRO A 65 -8.622 -9.179 -4.537 1.00 0.00 C ATOM 1039 C PRO A 65 -7.154 -8.792 -4.678 1.00 0.00 C ATOM 1040 O PRO A 65 -6.724 -7.758 -4.174 1.00 0.00 O ATOM 1041 CB PRO A 65 -8.847 -9.939 -3.235 1.00 0.00 C ATOM 1042 CG PRO A 65 -8.818 -11.379 -3.611 1.00 0.00 C ATOM 1043 CD PRO A 65 -9.296 -11.463 -5.037 1.00 0.00 C ATOM 0 HA PRO A 65 -9.163 -8.234 -4.596 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -8.071 -9.707 -2.505 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -9.801 -9.670 -2.782 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -7.810 -11.784 -3.516 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -9.460 -11.964 -2.952 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -8.736 -12.208 -5.602 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -10.347 -11.746 -5.089 1.00 0.00 H new ATOM 1051 N LYS A 66 -6.384 -9.620 -5.351 1.00 0.00 N ATOM 1052 CA LYS A 66 -4.982 -9.346 -5.535 1.00 0.00 C ATOM 1053 C LYS A 66 -4.745 -8.527 -6.786 1.00 0.00 C ATOM 1054 O LYS A 66 -4.902 -9.011 -7.907 1.00 0.00 O ATOM 1055 CB LYS A 66 -4.172 -10.632 -5.588 1.00 0.00 C ATOM 1056 CG LYS A 66 -2.675 -10.389 -5.734 1.00 0.00 C ATOM 1057 CD LYS A 66 -1.897 -11.679 -5.588 1.00 0.00 C ATOM 1058 CE LYS A 66 -0.640 -11.691 -6.436 1.00 0.00 C ATOM 1059 NZ LYS A 66 0.041 -13.009 -6.372 1.00 0.00 N ATOM 0 H LYS A 66 -6.709 -10.487 -5.778 1.00 0.00 H new ATOM 0 HA LYS A 66 -4.649 -8.766 -4.675 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -4.354 -11.207 -4.680 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -4.519 -11.239 -6.424 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -2.469 -9.945 -6.708 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -2.344 -9.674 -4.981 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -1.628 -11.822 -4.541 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -2.532 -12.518 -5.872 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -0.894 -11.460 -7.471 1.00 0.00 H new ATOM 0 HE3 LYS A 66 0.040 -10.911 -6.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 0.897 -12.986 -6.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 0.304 -13.216 -5.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -0.601 -13.749 -6.722 1.00 0.00 H new ATOM 1073 N ARG A 67 -4.387 -7.277 -6.578 1.00 0.00 N ATOM 1074 CA ARG A 67 -4.050 -6.389 -7.669 1.00 0.00 C ATOM 1075 C ARG A 67 -2.564 -6.098 -7.627 1.00 0.00 C ATOM 1076 O ARG A 67 -2.004 -5.899 -6.550 1.00 0.00 O ATOM 1077 CB ARG A 67 -4.844 -5.090 -7.554 1.00 0.00 C ATOM 1078 CG ARG A 67 -6.311 -5.313 -7.243 1.00 0.00 C ATOM 1079 CD ARG A 67 -6.974 -6.196 -8.288 1.00 0.00 C ATOM 1080 NE ARG A 67 -8.426 -6.237 -8.142 1.00 0.00 N ATOM 1081 CZ ARG A 67 -9.269 -5.361 -8.690 1.00 0.00 C ATOM 1082 NH1 ARG A 67 -8.818 -4.333 -9.399 1.00 0.00 N ATOM 1083 NH2 ARG A 67 -10.575 -5.521 -8.530 1.00 0.00 N ATOM 0 H ARG A 67 -4.322 -6.851 -5.654 1.00 0.00 H new ATOM 0 HA ARG A 67 -4.302 -6.864 -8.617 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -4.404 -4.470 -6.773 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -4.757 -4.535 -8.488 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -6.410 -5.774 -6.260 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -6.825 -4.353 -7.198 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -6.722 -5.829 -9.283 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -6.575 -7.207 -8.211 1.00 0.00 H new ATOM 0 HE ARG A 67 -8.824 -6.990 -7.581 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -7.815 -4.205 -9.531 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -9.475 -3.671 -9.812 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -10.930 -6.311 -7.990 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -11.225 -4.855 -8.946 1.00 0.00 H new ATOM 1097 N VAL A 68 -1.922 -6.089 -8.779 1.00 0.00 N ATOM 1098 CA VAL A 68 -0.491 -5.861 -8.829 1.00 0.00 C ATOM 1099 C VAL A 68 -0.189 -4.549 -9.555 1.00 0.00 C ATOM 1100 O VAL A 68 -0.868 -4.183 -10.521 1.00 0.00 O ATOM 1101 CB VAL A 68 0.265 -7.043 -9.496 1.00 0.00 C ATOM 1102 CG1 VAL A 68 -0.411 -8.377 -9.189 1.00 0.00 C ATOM 1103 CG2 VAL A 68 0.406 -6.839 -10.994 1.00 0.00 C ATOM 0 H VAL A 68 -2.364 -6.236 -9.686 1.00 0.00 H new ATOM 0 HA VAL A 68 -0.133 -5.790 -7.802 1.00 0.00 H new ATOM 0 HB VAL A 68 1.268 -7.069 -9.069 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.142 -9.184 -9.670 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -0.425 -8.538 -8.111 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -1.433 -8.362 -9.567 1.00 0.00 H new ATOM 0 HG21 VAL A 68 0.940 -7.685 -11.428 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -0.583 -6.764 -11.446 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.963 -5.922 -11.185 1.00 0.00 H new ATOM 1113 N CYS A 69 0.801 -3.828 -9.062 1.00 0.00 N ATOM 1114 CA CYS A 69 1.218 -2.578 -9.671 1.00 0.00 C ATOM 1115 C CYS A 69 2.721 -2.611 -9.943 1.00 0.00 C ATOM 1116 O CYS A 69 3.523 -2.731 -9.022 1.00 0.00 O ATOM 1117 CB CYS A 69 0.858 -1.404 -8.759 1.00 0.00 C ATOM 1118 SG CYS A 69 -0.919 -1.176 -8.522 1.00 0.00 S ATOM 0 H CYS A 69 1.336 -4.090 -8.234 1.00 0.00 H new ATOM 0 HA CYS A 69 0.696 -2.448 -10.619 1.00 0.00 H new ATOM 0 HB2 CYS A 69 1.327 -1.555 -7.787 1.00 0.00 H new ATOM 0 HB3 CYS A 69 1.279 -0.490 -9.178 1.00 0.00 H new ATOM 0 HG CYS A 69 -1.155 -0.866 -7.282 1.00 0.00 H new ATOM 1124 N LYS A 70 3.094 -2.549 -11.213 1.00 0.00 N ATOM 1125 CA LYS A 70 4.498 -2.609 -11.609 1.00 0.00 C ATOM 1126 C LYS A 70 4.971 -1.232 -12.075 1.00 0.00 C ATOM 1127 O LYS A 70 6.069 -1.080 -12.618 1.00 0.00 O ATOM 1128 CB LYS A 70 4.676 -3.631 -12.740 1.00 0.00 C ATOM 1129 CG LYS A 70 3.995 -4.972 -12.483 1.00 0.00 C ATOM 1130 CD LYS A 70 3.769 -5.733 -13.781 1.00 0.00 C ATOM 1131 CE LYS A 70 3.039 -7.048 -13.547 1.00 0.00 C ATOM 1132 NZ LYS A 70 2.521 -7.626 -14.815 1.00 0.00 N ATOM 0 H LYS A 70 2.442 -2.457 -11.992 1.00 0.00 H new ATOM 0 HA LYS A 70 5.095 -2.916 -10.751 1.00 0.00 H new ATOM 0 HB2 LYS A 70 4.282 -3.207 -13.663 1.00 0.00 H new ATOM 0 HB3 LYS A 70 5.741 -3.801 -12.897 1.00 0.00 H new ATOM 0 HG2 LYS A 70 4.608 -5.571 -11.810 1.00 0.00 H new ATOM 0 HG3 LYS A 70 3.040 -4.808 -11.984 1.00 0.00 H new ATOM 0 HD2 LYS A 70 3.192 -5.115 -14.469 1.00 0.00 H new ATOM 0 HD3 LYS A 70 4.729 -5.930 -14.258 1.00 0.00 H new ATOM 0 HE2 LYS A 70 3.715 -7.759 -13.073 1.00 0.00 H new ATOM 0 HE3 LYS A 70 2.211 -6.886 -12.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 2.030 -8.521 -14.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 1.856 -6.958 -15.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 3.313 -7.804 -15.464 1.00 0.00 H new ATOM 1146 N ASP A 71 4.127 -0.234 -11.865 1.00 0.00 N ATOM 1147 CA ASP A 71 4.370 1.111 -12.371 1.00 0.00 C ATOM 1148 C ASP A 71 4.333 2.137 -11.247 1.00 0.00 C ATOM 1149 O ASP A 71 4.025 1.784 -10.113 1.00 0.00 O ATOM 1150 CB ASP A 71 3.314 1.464 -13.430 1.00 0.00 C ATOM 1151 CG ASP A 71 3.612 0.848 -14.776 1.00 0.00 C ATOM 1152 OD1 ASP A 71 4.417 1.429 -15.533 1.00 0.00 O ATOM 1153 OD2 ASP A 71 3.048 -0.223 -15.083 1.00 0.00 O ATOM 0 H ASP A 71 3.257 -0.331 -11.341 1.00 0.00 H new ATOM 0 HA ASP A 71 5.363 1.133 -12.819 1.00 0.00 H new ATOM 0 HB2 ASP A 71 2.336 1.126 -13.089 1.00 0.00 H new ATOM 0 HB3 ASP A 71 3.258 2.548 -13.535 1.00 0.00 H new ATOM 1158 N PRO A 72 4.705 3.407 -11.541 1.00 0.00 N ATOM 1159 CA PRO A 72 4.465 4.573 -10.660 1.00 0.00 C ATOM 1160 C PRO A 72 3.110 4.531 -9.903 1.00 0.00 C ATOM 1161 O PRO A 72 2.293 3.641 -10.155 1.00 0.00 O ATOM 1162 CB PRO A 72 4.528 5.712 -11.669 1.00 0.00 C ATOM 1163 CG PRO A 72 5.622 5.301 -12.586 1.00 0.00 C ATOM 1164 CD PRO A 72 5.480 3.811 -12.741 1.00 0.00 C ATOM 0 HA PRO A 72 5.179 4.644 -9.839 1.00 0.00 H new ATOM 0 HB2 PRO A 72 3.583 5.832 -12.199 1.00 0.00 H new ATOM 0 HB3 PRO A 72 4.745 6.665 -11.186 1.00 0.00 H new ATOM 0 HG2 PRO A 72 5.537 5.805 -13.549 1.00 0.00 H new ATOM 0 HG3 PRO A 72 6.597 5.561 -12.175 1.00 0.00 H new ATOM 0 HD2 PRO A 72 4.957 3.552 -13.662 1.00 0.00 H new ATOM 0 HD3 PRO A 72 6.451 3.317 -12.776 1.00 0.00 H new ATOM 1172 N PRO A 73 2.791 5.570 -9.071 1.00 0.00 N ATOM 1173 CA PRO A 73 1.914 5.459 -7.904 1.00 0.00 C ATOM 1174 C PRO A 73 1.032 4.224 -7.885 1.00 0.00 C ATOM 1175 O PRO A 73 0.048 4.108 -8.625 1.00 0.00 O ATOM 1176 CB PRO A 73 1.081 6.718 -8.044 1.00 0.00 C ATOM 1177 CG PRO A 73 2.035 7.734 -8.606 1.00 0.00 C ATOM 1178 CD PRO A 73 3.188 6.974 -9.228 1.00 0.00 C ATOM 0 HA PRO A 73 2.477 5.361 -6.976 1.00 0.00 H new ATOM 0 HB2 PRO A 73 0.231 6.561 -8.708 1.00 0.00 H new ATOM 0 HB3 PRO A 73 0.680 7.038 -7.083 1.00 0.00 H new ATOM 0 HG2 PRO A 73 1.539 8.356 -9.351 1.00 0.00 H new ATOM 0 HG3 PRO A 73 2.393 8.400 -7.821 1.00 0.00 H new ATOM 0 HD2 PRO A 73 3.325 7.238 -10.277 1.00 0.00 H new ATOM 0 HD3 PRO A 73 4.129 7.185 -8.720 1.00 0.00 H new ATOM 1186 N TYR A 74 1.390 3.338 -6.974 1.00 0.00 N ATOM 1187 CA TYR A 74 0.798 2.023 -6.865 1.00 0.00 C ATOM 1188 C TYR A 74 -0.522 2.140 -6.135 1.00 0.00 C ATOM 1189 O TYR A 74 -0.579 2.661 -5.017 1.00 0.00 O ATOM 1190 CB TYR A 74 1.758 1.097 -6.114 1.00 0.00 C ATOM 1191 CG TYR A 74 3.188 1.139 -6.632 1.00 0.00 C ATOM 1192 CD1 TYR A 74 4.005 2.234 -6.382 1.00 0.00 C ATOM 1193 CD2 TYR A 74 3.722 0.087 -7.362 1.00 0.00 C ATOM 1194 CE1 TYR A 74 5.300 2.281 -6.843 1.00 0.00 C ATOM 1195 CE2 TYR A 74 5.025 0.123 -7.824 1.00 0.00 C ATOM 1196 CZ TYR A 74 5.807 1.224 -7.561 1.00 0.00 C ATOM 1197 OH TYR A 74 7.105 1.266 -8.010 1.00 0.00 O ATOM 0 H TYR A 74 2.114 3.518 -6.278 1.00 0.00 H new ATOM 0 HA TYR A 74 0.617 1.602 -7.854 1.00 0.00 H new ATOM 0 HB2 TYR A 74 1.757 1.368 -5.058 1.00 0.00 H new ATOM 0 HB3 TYR A 74 1.388 0.074 -6.181 1.00 0.00 H new ATOM 0 HD1 TYR A 74 3.615 3.066 -5.814 1.00 0.00 H new ATOM 0 HD2 TYR A 74 3.109 -0.776 -7.573 1.00 0.00 H new ATOM 0 HE1 TYR A 74 5.916 3.145 -6.642 1.00 0.00 H new ATOM 0 HE2 TYR A 74 5.426 -0.707 -8.387 1.00 0.00 H new ATOM 0 HH TYR A 74 7.111 1.378 -8.984 1.00 0.00 H new ATOM 1207 N LYS A 75 -1.575 1.671 -6.766 1.00 0.00 N ATOM 1208 CA LYS A 75 -2.916 1.949 -6.298 1.00 0.00 C ATOM 1209 C LYS A 75 -3.886 0.850 -6.674 1.00 0.00 C ATOM 1210 O LYS A 75 -3.713 0.150 -7.672 1.00 0.00 O ATOM 1211 CB LYS A 75 -3.403 3.266 -6.902 1.00 0.00 C ATOM 1212 CG LYS A 75 -3.156 3.358 -8.401 1.00 0.00 C ATOM 1213 CD LYS A 75 -3.978 4.458 -9.050 1.00 0.00 C ATOM 1214 CE LYS A 75 -3.358 5.815 -8.825 1.00 0.00 C ATOM 1215 NZ LYS A 75 -2.072 5.960 -9.559 1.00 0.00 N ATOM 0 H LYS A 75 -1.529 1.094 -7.606 1.00 0.00 H new ATOM 0 HA LYS A 75 -2.879 2.013 -5.211 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -4.470 3.377 -6.707 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -2.901 4.096 -6.405 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -2.097 3.542 -8.583 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -3.398 2.403 -8.867 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -4.062 4.268 -10.120 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -4.989 4.447 -8.643 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -4.052 6.591 -9.149 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -3.188 5.965 -7.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -1.726 6.936 -9.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -1.370 5.304 -9.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -2.220 5.742 -10.565 1.00 0.00 H new ATOM 1229 N VAL A 76 -4.907 0.724 -5.858 1.00 0.00 N ATOM 1230 CA VAL A 76 -6.034 -0.145 -6.160 1.00 0.00 C ATOM 1231 C VAL A 76 -7.334 0.633 -6.022 1.00 0.00 C ATOM 1232 O VAL A 76 -7.567 1.285 -5.005 1.00 0.00 O ATOM 1233 CB VAL A 76 -6.087 -1.399 -5.261 1.00 0.00 C ATOM 1234 CG1 VAL A 76 -7.459 -2.040 -5.330 1.00 0.00 C ATOM 1235 CG2 VAL A 76 -5.031 -2.403 -5.679 1.00 0.00 C ATOM 0 H VAL A 76 -4.985 1.216 -4.968 1.00 0.00 H new ATOM 0 HA VAL A 76 -5.901 -0.490 -7.185 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.889 -1.089 -4.235 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.481 -2.923 -4.691 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -8.211 -1.328 -4.990 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.673 -2.331 -6.358 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -5.086 -3.279 -5.033 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -5.203 -2.703 -6.713 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -4.044 -1.950 -5.593 1.00 0.00 H new ATOM 1245 N GLU A 77 -8.154 0.586 -7.056 1.00 0.00 N ATOM 1246 CA GLU A 77 -9.461 1.217 -7.023 1.00 0.00 C ATOM 1247 C GLU A 77 -10.539 0.171 -7.070 1.00 0.00 C ATOM 1248 O GLU A 77 -10.670 -0.575 -8.040 1.00 0.00 O ATOM 1249 CB GLU A 77 -9.635 2.199 -8.172 1.00 0.00 C ATOM 1250 CG GLU A 77 -8.673 3.351 -8.115 1.00 0.00 C ATOM 1251 CD GLU A 77 -8.744 4.237 -9.340 1.00 0.00 C ATOM 1252 OE1 GLU A 77 -8.427 3.756 -10.451 1.00 0.00 O ATOM 1253 OE2 GLU A 77 -9.125 5.418 -9.199 1.00 0.00 O ATOM 0 H GLU A 77 -7.936 0.115 -7.934 1.00 0.00 H new ATOM 0 HA GLU A 77 -9.540 1.776 -6.091 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -9.504 1.671 -9.116 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -10.655 2.584 -8.161 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.882 3.949 -7.228 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -7.659 2.966 -8.009 1.00 0.00 H new ATOM 1260 N GLU A 78 -11.305 0.131 -6.011 1.00 0.00 N ATOM 1261 CA GLU A 78 -12.351 -0.866 -5.873 1.00 0.00 C ATOM 1262 C GLU A 78 -13.587 -0.283 -5.227 1.00 0.00 C ATOM 1263 O GLU A 78 -13.637 0.908 -4.908 1.00 0.00 O ATOM 1264 CB GLU A 78 -11.863 -2.070 -5.061 1.00 0.00 C ATOM 1265 CG GLU A 78 -11.453 -3.262 -5.912 1.00 0.00 C ATOM 1266 CD GLU A 78 -12.494 -3.634 -6.953 1.00 0.00 C ATOM 1267 OE1 GLU A 78 -13.437 -4.380 -6.622 1.00 0.00 O ATOM 1268 OE2 GLU A 78 -12.371 -3.194 -8.115 1.00 0.00 O ATOM 0 H GLU A 78 -11.229 0.777 -5.225 1.00 0.00 H new ATOM 0 HA GLU A 78 -12.609 -1.200 -6.878 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -11.014 -1.764 -4.450 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -12.653 -2.379 -4.377 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -10.511 -3.037 -6.412 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -11.273 -4.120 -5.264 1.00 0.00 H new ATOM 1275 N SER A 79 -14.580 -1.132 -5.046 1.00 0.00 N ATOM 1276 CA SER A 79 -15.853 -0.718 -4.508 1.00 0.00 C ATOM 1277 C SER A 79 -16.412 -1.821 -3.612 1.00 0.00 C ATOM 1278 O SER A 79 -16.253 -3.008 -3.900 1.00 0.00 O ATOM 1279 CB SER A 79 -16.807 -0.394 -5.661 1.00 0.00 C ATOM 1280 OG SER A 79 -18.004 0.206 -5.203 1.00 0.00 O ATOM 0 H SER A 79 -14.523 -2.126 -5.269 1.00 0.00 H new ATOM 0 HA SER A 79 -15.733 0.180 -3.901 1.00 0.00 H new ATOM 0 HB2 SER A 79 -16.312 0.275 -6.365 1.00 0.00 H new ATOM 0 HB3 SER A 79 -17.044 -1.309 -6.204 1.00 0.00 H new ATOM 0 HG SER A 79 -17.905 1.181 -5.210 1.00 0.00 H new ATOM 1286 N GLY A 80 -17.045 -1.416 -2.526 1.00 0.00 N ATOM 1287 CA GLY A 80 -17.568 -2.355 -1.555 1.00 0.00 C ATOM 1288 C GLY A 80 -18.586 -1.684 -0.662 1.00 0.00 C ATOM 1289 O GLY A 80 -19.172 -0.683 -1.052 1.00 0.00 O ATOM 0 H GLY A 80 -17.209 -0.436 -2.295 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -18.027 -3.200 -2.069 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -16.753 -2.754 -0.951 1.00 0.00 H new ATOM 1293 N TYR A 81 -18.811 -2.207 0.532 1.00 0.00 N ATOM 1294 CA TYR A 81 -19.785 -1.592 1.431 1.00 0.00 C ATOM 1295 C TYR A 81 -19.337 -1.644 2.891 1.00 0.00 C ATOM 1296 O TYR A 81 -20.154 -1.508 3.801 1.00 0.00 O ATOM 1297 CB TYR A 81 -21.167 -2.246 1.251 1.00 0.00 C ATOM 1298 CG TYR A 81 -21.162 -3.756 1.412 1.00 0.00 C ATOM 1299 CD1 TYR A 81 -21.276 -4.350 2.664 1.00 0.00 C ATOM 1300 CD2 TYR A 81 -21.038 -4.589 0.305 1.00 0.00 C ATOM 1301 CE1 TYR A 81 -21.265 -5.725 2.806 1.00 0.00 C ATOM 1302 CE2 TYR A 81 -21.026 -5.964 0.442 1.00 0.00 C ATOM 1303 CZ TYR A 81 -21.140 -6.526 1.693 1.00 0.00 C ATOM 1304 OH TYR A 81 -21.121 -7.894 1.834 1.00 0.00 O ATOM 0 H TYR A 81 -18.346 -3.037 0.900 1.00 0.00 H new ATOM 0 HA TYR A 81 -19.859 -0.538 1.163 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -21.858 -1.816 1.976 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -21.549 -1.998 0.261 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -21.375 -3.727 3.540 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -20.950 -4.153 -0.679 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -21.354 -6.169 3.786 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -20.928 -6.595 -0.429 1.00 0.00 H new ATOM 0 HH TYR A 81 -21.028 -8.312 0.953 1.00 0.00 H new ATOM 1314 N ALA A 82 -18.035 -1.819 3.112 1.00 0.00 N ATOM 1315 CA ALA A 82 -17.482 -1.847 4.463 1.00 0.00 C ATOM 1316 C ALA A 82 -15.963 -1.754 4.435 1.00 0.00 C ATOM 1317 O ALA A 82 -15.340 -1.957 3.393 1.00 0.00 O ATOM 1318 CB ALA A 82 -17.907 -3.112 5.193 1.00 0.00 C ATOM 0 H ALA A 82 -17.344 -1.943 2.372 1.00 0.00 H new ATOM 0 HA ALA A 82 -17.873 -0.981 4.997 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -17.484 -3.112 6.197 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -18.995 -3.147 5.257 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -17.548 -3.985 4.648 1.00 0.00 H new ATOM 1324 N GLY A 83 -15.382 -1.443 5.591 1.00 0.00 N ATOM 1325 CA GLY A 83 -13.942 -1.337 5.700 1.00 0.00 C ATOM 1326 C GLY A 83 -13.313 -2.591 6.274 1.00 0.00 C ATOM 1327 O GLY A 83 -14.023 -3.513 6.690 1.00 0.00 O ATOM 0 H GLY A 83 -15.889 -1.262 6.457 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -13.519 -1.140 4.715 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -13.690 -0.485 6.332 1.00 0.00 H new ATOM 1331 N PHE A 84 -11.982 -2.608 6.309 1.00 0.00 N ATOM 1332 CA PHE A 84 -11.213 -3.780 6.731 1.00 0.00 C ATOM 1333 C PHE A 84 -9.716 -3.478 6.654 1.00 0.00 C ATOM 1334 O PHE A 84 -9.302 -2.563 5.944 1.00 0.00 O ATOM 1335 CB PHE A 84 -11.544 -4.995 5.839 1.00 0.00 C ATOM 1336 CG PHE A 84 -11.271 -4.788 4.366 1.00 0.00 C ATOM 1337 CD1 PHE A 84 -12.110 -3.995 3.597 1.00 0.00 C ATOM 1338 CD2 PHE A 84 -10.184 -5.393 3.749 1.00 0.00 C ATOM 1339 CE1 PHE A 84 -11.872 -3.803 2.252 1.00 0.00 C ATOM 1340 CE2 PHE A 84 -9.940 -5.207 2.404 1.00 0.00 C ATOM 1341 CZ PHE A 84 -10.782 -4.411 1.652 1.00 0.00 C ATOM 0 H PHE A 84 -11.405 -1.810 6.046 1.00 0.00 H new ATOM 0 HA PHE A 84 -11.482 -4.017 7.761 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -10.966 -5.852 6.185 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -12.596 -5.248 5.968 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -12.963 -3.520 4.059 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -9.521 -6.017 4.330 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -12.534 -3.180 1.668 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -9.090 -5.684 1.939 1.00 0.00 H new ATOM 0 HZ PHE A 84 -10.591 -4.263 0.599 1.00 0.00 H new ATOM 1351 N ILE A 85 -8.912 -4.219 7.410 1.00 0.00 N ATOM 1352 CA ILE A 85 -7.463 -4.161 7.255 1.00 0.00 C ATOM 1353 C ILE A 85 -7.074 -4.743 5.903 1.00 0.00 C ATOM 1354 O ILE A 85 -7.469 -5.859 5.565 1.00 0.00 O ATOM 1355 CB ILE A 85 -6.727 -4.944 8.372 1.00 0.00 C ATOM 1356 CG1 ILE A 85 -6.746 -4.165 9.686 1.00 0.00 C ATOM 1357 CG2 ILE A 85 -5.293 -5.258 7.967 1.00 0.00 C ATOM 1358 CD1 ILE A 85 -5.970 -2.864 9.636 1.00 0.00 C ATOM 0 H ILE A 85 -9.237 -4.863 8.132 1.00 0.00 H new ATOM 0 HA ILE A 85 -7.166 -3.115 7.324 1.00 0.00 H new ATOM 0 HB ILE A 85 -7.256 -5.886 8.519 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -7.780 -3.950 9.956 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -6.334 -4.793 10.476 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -4.800 -5.808 8.769 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -5.295 -5.863 7.060 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -4.756 -4.328 7.781 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -6.029 -2.368 10.605 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -4.927 -3.072 9.398 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -6.395 -2.216 8.870 1.00 0.00 H new ATOM 1370 N LEU A 86 -6.319 -3.990 5.126 1.00 0.00 N ATOM 1371 CA LEU A 86 -5.884 -4.465 3.829 1.00 0.00 C ATOM 1372 C LEU A 86 -4.384 -4.714 3.832 1.00 0.00 C ATOM 1373 O LEU A 86 -3.585 -3.778 3.858 1.00 0.00 O ATOM 1374 CB LEU A 86 -6.261 -3.462 2.739 1.00 0.00 C ATOM 1375 CG LEU A 86 -6.448 -4.081 1.355 1.00 0.00 C ATOM 1376 CD1 LEU A 86 -7.487 -3.320 0.559 1.00 0.00 C ATOM 1377 CD2 LEU A 86 -5.149 -4.094 0.592 1.00 0.00 C ATOM 0 H LEU A 86 -5.997 -3.053 5.369 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.389 -5.408 3.617 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -7.184 -2.959 3.027 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -5.486 -2.697 2.681 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.788 -5.106 1.499 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -7.602 -3.780 -0.422 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -8.441 -3.347 1.086 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -7.167 -2.285 0.439 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -5.308 -4.539 -0.390 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -4.787 -3.073 0.473 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.411 -4.679 1.140 1.00 0.00 H new ATOM 1389 N PRO A 87 -3.992 -5.995 3.852 1.00 0.00 N ATOM 1390 CA PRO A 87 -2.593 -6.403 3.734 1.00 0.00 C ATOM 1391 C PRO A 87 -1.984 -5.993 2.391 1.00 0.00 C ATOM 1392 O PRO A 87 -2.225 -6.635 1.361 1.00 0.00 O ATOM 1393 CB PRO A 87 -2.645 -7.934 3.837 1.00 0.00 C ATOM 1394 CG PRO A 87 -4.061 -8.298 3.549 1.00 0.00 C ATOM 1395 CD PRO A 87 -4.884 -7.145 4.041 1.00 0.00 C ATOM 0 HA PRO A 87 -1.973 -5.932 4.497 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -1.966 -8.400 3.123 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -2.346 -8.272 4.829 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -4.214 -8.461 2.482 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -4.339 -9.222 4.056 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -5.807 -7.037 3.472 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -5.167 -7.268 5.086 1.00 0.00 H new ATOM 1403 N ILE A 88 -1.212 -4.921 2.402 1.00 0.00 N ATOM 1404 CA ILE A 88 -0.555 -4.445 1.201 1.00 0.00 C ATOM 1405 C ILE A 88 0.900 -4.892 1.189 1.00 0.00 C ATOM 1406 O ILE A 88 1.532 -4.984 2.239 1.00 0.00 O ATOM 1407 CB ILE A 88 -0.614 -2.909 1.097 1.00 0.00 C ATOM 1408 CG1 ILE A 88 -2.044 -2.426 1.357 1.00 0.00 C ATOM 1409 CG2 ILE A 88 -0.147 -2.479 -0.282 1.00 0.00 C ATOM 1410 CD1 ILE A 88 -2.139 -0.987 1.813 1.00 0.00 C ATOM 0 H ILE A 88 -1.025 -4.362 3.235 1.00 0.00 H new ATOM 0 HA ILE A 88 -1.082 -4.870 0.347 1.00 0.00 H new ATOM 0 HB ILE A 88 0.042 -2.465 1.846 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -2.627 -2.545 0.444 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -2.500 -3.066 2.113 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -0.188 -1.392 -0.358 1.00 0.00 H new ATOM 0 HG22 ILE A 88 0.878 -2.815 -0.440 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -0.795 -2.920 -1.039 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -3.185 -0.725 1.975 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -1.586 -0.863 2.744 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.715 -0.335 1.049 1.00 0.00 H new ATOM 1422 N GLU A 89 1.429 -5.174 0.009 1.00 0.00 N ATOM 1423 CA GLU A 89 2.808 -5.620 -0.108 1.00 0.00 C ATOM 1424 C GLU A 89 3.566 -4.803 -1.140 1.00 0.00 C ATOM 1425 O GLU A 89 3.084 -4.580 -2.252 1.00 0.00 O ATOM 1426 CB GLU A 89 2.882 -7.095 -0.495 1.00 0.00 C ATOM 1427 CG GLU A 89 2.279 -8.042 0.527 1.00 0.00 C ATOM 1428 CD GLU A 89 2.486 -9.492 0.151 1.00 0.00 C ATOM 1429 OE1 GLU A 89 3.520 -10.065 0.534 1.00 0.00 O ATOM 1430 OE2 GLU A 89 1.623 -10.067 -0.542 1.00 0.00 O ATOM 0 H GLU A 89 0.928 -5.103 -0.877 1.00 0.00 H new ATOM 0 HA GLU A 89 3.268 -5.481 0.870 1.00 0.00 H new ATOM 0 HB2 GLU A 89 2.371 -7.234 -1.448 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.926 -7.365 -0.651 1.00 0.00 H new ATOM 0 HG2 GLU A 89 2.726 -7.854 1.503 1.00 0.00 H new ATOM 0 HG3 GLU A 89 1.212 -7.841 0.621 1.00 0.00 H new ATOM 1437 N VAL A 90 4.755 -4.369 -0.766 1.00 0.00 N ATOM 1438 CA VAL A 90 5.645 -3.700 -1.695 1.00 0.00 C ATOM 1439 C VAL A 90 6.868 -4.570 -1.944 1.00 0.00 C ATOM 1440 O VAL A 90 7.499 -5.049 -0.999 1.00 0.00 O ATOM 1441 CB VAL A 90 6.098 -2.316 -1.211 1.00 0.00 C ATOM 1442 CG1 VAL A 90 6.890 -1.653 -2.310 1.00 0.00 C ATOM 1443 CG2 VAL A 90 4.898 -1.470 -0.823 1.00 0.00 C ATOM 0 H VAL A 90 5.127 -4.469 0.178 1.00 0.00 H new ATOM 0 HA VAL A 90 5.081 -3.547 -2.615 1.00 0.00 H new ATOM 0 HB VAL A 90 6.726 -2.422 -0.327 1.00 0.00 H new ATOM 0 HG11 VAL A 90 7.218 -0.668 -1.979 1.00 0.00 H new ATOM 0 HG12 VAL A 90 7.760 -2.263 -2.550 1.00 0.00 H new ATOM 0 HG13 VAL A 90 6.265 -1.548 -3.197 1.00 0.00 H new ATOM 0 HG21 VAL A 90 5.237 -0.492 -0.482 1.00 0.00 H new ATOM 0 HG22 VAL A 90 4.245 -1.347 -1.687 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.349 -1.963 -0.021 1.00 0.00 H new ATOM 1453 N TYR A 91 7.179 -4.800 -3.209 1.00 0.00 N ATOM 1454 CA TYR A 91 8.345 -5.609 -3.569 1.00 0.00 C ATOM 1455 C TYR A 91 9.590 -4.749 -3.700 1.00 0.00 C ATOM 1456 O TYR A 91 9.573 -3.700 -4.341 1.00 0.00 O ATOM 1457 CB TYR A 91 8.116 -6.374 -4.870 1.00 0.00 C ATOM 1458 CG TYR A 91 7.344 -7.666 -4.701 1.00 0.00 C ATOM 1459 CD1 TYR A 91 6.175 -7.709 -3.958 1.00 0.00 C ATOM 1460 CD2 TYR A 91 7.796 -8.845 -5.284 1.00 0.00 C ATOM 1461 CE1 TYR A 91 5.481 -8.887 -3.793 1.00 0.00 C ATOM 1462 CE2 TYR A 91 7.100 -10.030 -5.131 1.00 0.00 C ATOM 1463 CZ TYR A 91 5.943 -10.044 -4.381 1.00 0.00 C ATOM 1464 OH TYR A 91 5.253 -11.222 -4.204 1.00 0.00 O ATOM 0 H TYR A 91 6.648 -4.443 -4.003 1.00 0.00 H new ATOM 0 HA TYR A 91 8.492 -6.328 -2.763 1.00 0.00 H new ATOM 0 HB2 TYR A 91 7.579 -5.731 -5.567 1.00 0.00 H new ATOM 0 HB3 TYR A 91 9.082 -6.597 -5.322 1.00 0.00 H new ATOM 0 HD1 TYR A 91 5.802 -6.804 -3.501 1.00 0.00 H new ATOM 0 HD2 TYR A 91 8.706 -8.835 -5.866 1.00 0.00 H new ATOM 0 HE1 TYR A 91 4.576 -8.904 -3.204 1.00 0.00 H new ATOM 0 HE2 TYR A 91 7.459 -10.937 -5.595 1.00 0.00 H new ATOM 0 HH TYR A 91 5.709 -11.944 -4.685 1.00 0.00 H new ATOM 1474 N PHE A 92 10.667 -5.222 -3.112 1.00 0.00 N ATOM 1475 CA PHE A 92 11.923 -4.491 -3.084 1.00 0.00 C ATOM 1476 C PHE A 92 12.917 -5.085 -4.086 1.00 0.00 C ATOM 1477 O PHE A 92 12.751 -6.222 -4.533 1.00 0.00 O ATOM 1478 CB PHE A 92 12.510 -4.553 -1.671 1.00 0.00 C ATOM 1479 CG PHE A 92 11.709 -3.802 -0.643 1.00 0.00 C ATOM 1480 CD1 PHE A 92 11.069 -2.621 -0.974 1.00 0.00 C ATOM 1481 CD2 PHE A 92 11.622 -4.259 0.663 1.00 0.00 C ATOM 1482 CE1 PHE A 92 10.363 -1.909 -0.031 1.00 0.00 C ATOM 1483 CE2 PHE A 92 10.906 -3.551 1.610 1.00 0.00 C ATOM 1484 CZ PHE A 92 10.280 -2.375 1.258 1.00 0.00 C ATOM 0 H PHE A 92 10.701 -6.125 -2.638 1.00 0.00 H new ATOM 0 HA PHE A 92 11.736 -3.454 -3.361 1.00 0.00 H new ATOM 0 HB2 PHE A 92 12.587 -5.597 -1.366 1.00 0.00 H new ATOM 0 HB3 PHE A 92 13.523 -4.152 -1.691 1.00 0.00 H new ATOM 0 HD1 PHE A 92 11.124 -2.252 -1.988 1.00 0.00 H new ATOM 0 HD2 PHE A 92 12.118 -5.177 0.943 1.00 0.00 H new ATOM 0 HE1 PHE A 92 9.875 -0.985 -0.305 1.00 0.00 H new ATOM 0 HE2 PHE A 92 10.837 -3.919 2.623 1.00 0.00 H new ATOM 0 HZ PHE A 92 9.723 -1.819 1.997 1.00 0.00 H new ATOM 1494 N LYS A 93 13.942 -4.315 -4.446 1.00 0.00 N ATOM 1495 CA LYS A 93 15.003 -4.808 -5.321 1.00 0.00 C ATOM 1496 C LYS A 93 16.278 -5.027 -4.515 1.00 0.00 C ATOM 1497 O LYS A 93 17.073 -4.097 -4.365 1.00 0.00 O ATOM 1498 CB LYS A 93 15.343 -3.781 -6.407 1.00 0.00 C ATOM 1499 CG LYS A 93 14.185 -3.275 -7.240 1.00 0.00 C ATOM 1500 CD LYS A 93 14.633 -2.063 -8.058 1.00 0.00 C ATOM 1501 CE LYS A 93 13.594 -1.639 -9.089 1.00 0.00 C ATOM 1502 NZ LYS A 93 14.202 -0.884 -10.218 1.00 0.00 N ATOM 0 H LYS A 93 14.060 -3.348 -4.145 1.00 0.00 H new ATOM 0 HA LYS A 93 14.647 -5.735 -5.771 1.00 0.00 H new ATOM 0 HB2 LYS A 93 15.821 -2.925 -5.930 1.00 0.00 H new ATOM 0 HB3 LYS A 93 16.079 -4.224 -7.078 1.00 0.00 H new ATOM 0 HG2 LYS A 93 13.829 -4.063 -7.904 1.00 0.00 H new ATOM 0 HG3 LYS A 93 13.351 -3.002 -6.594 1.00 0.00 H new ATOM 0 HD2 LYS A 93 14.834 -1.229 -7.386 1.00 0.00 H new ATOM 0 HD3 LYS A 93 15.569 -2.297 -8.565 1.00 0.00 H new ATOM 0 HE2 LYS A 93 13.086 -2.522 -9.476 1.00 0.00 H new ATOM 0 HE3 LYS A 93 12.836 -1.021 -8.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 13.781 0.066 -10.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 15.228 -0.801 -10.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 14.023 -1.389 -11.110 1.00 0.00 H new ATOM 1516 N ASN A 94 16.485 -6.225 -3.993 1.00 0.00 N ATOM 1517 CA ASN A 94 17.698 -6.495 -3.230 1.00 0.00 C ATOM 1518 C ASN A 94 18.040 -7.977 -3.141 1.00 0.00 C ATOM 1519 O ASN A 94 17.215 -8.851 -3.407 1.00 0.00 O ATOM 1520 CB ASN A 94 17.609 -5.898 -1.822 1.00 0.00 C ATOM 1521 CG ASN A 94 16.408 -6.370 -1.025 1.00 0.00 C ATOM 1522 OD1 ASN A 94 15.373 -6.737 -1.576 1.00 0.00 O ATOM 1523 ND2 ASN A 94 16.530 -6.325 0.286 1.00 0.00 N ATOM 0 H ASN A 94 15.844 -7.014 -4.079 1.00 0.00 H new ATOM 0 HA ASN A 94 18.505 -6.012 -3.781 1.00 0.00 H new ATOM 0 HB2 ASN A 94 18.517 -6.150 -1.274 1.00 0.00 H new ATOM 0 HB3 ASN A 94 17.575 -4.811 -1.901 1.00 0.00 H new ATOM 0 HD21 ASN A 94 15.749 -6.601 0.881 1.00 0.00 H new ATOM 0 HD22 ASN A 94 17.406 -6.014 0.706 1.00 0.00 H new ATOM 1530 N LYS A 95 19.290 -8.223 -2.768 1.00 0.00 N ATOM 1531 CA LYS A 95 19.794 -9.551 -2.427 1.00 0.00 C ATOM 1532 C LYS A 95 19.986 -9.593 -0.909 1.00 0.00 C ATOM 1533 O LYS A 95 20.521 -10.539 -0.326 1.00 0.00 O ATOM 1534 CB LYS A 95 21.114 -9.760 -3.172 1.00 0.00 C ATOM 1535 CG LYS A 95 21.767 -11.131 -3.007 1.00 0.00 C ATOM 1536 CD LYS A 95 22.863 -11.138 -1.939 1.00 0.00 C ATOM 1537 CE LYS A 95 24.007 -10.188 -2.272 1.00 0.00 C ATOM 1538 NZ LYS A 95 25.152 -10.356 -1.339 1.00 0.00 N ATOM 0 H LYS A 95 19.997 -7.492 -2.692 1.00 0.00 H new ATOM 0 HA LYS A 95 19.107 -10.346 -2.717 1.00 0.00 H new ATOM 0 HB2 LYS A 95 20.940 -9.588 -4.234 1.00 0.00 H new ATOM 0 HB3 LYS A 95 21.821 -9.000 -2.838 1.00 0.00 H new ATOM 0 HG2 LYS A 95 21.004 -11.863 -2.743 1.00 0.00 H new ATOM 0 HG3 LYS A 95 22.193 -11.443 -3.961 1.00 0.00 H new ATOM 0 HD2 LYS A 95 22.431 -10.859 -0.978 1.00 0.00 H new ATOM 0 HD3 LYS A 95 23.254 -12.150 -1.831 1.00 0.00 H new ATOM 0 HE2 LYS A 95 24.342 -10.366 -3.294 1.00 0.00 H new ATOM 0 HE3 LYS A 95 23.650 -9.159 -2.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 25.910 -9.693 -1.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 24.839 -10.162 -0.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 25.509 -11.331 -1.400 1.00 0.00 H new ATOM 1552 N GLU A 96 19.487 -8.544 -0.295 1.00 0.00 N ATOM 1553 CA GLU A 96 19.648 -8.275 1.127 1.00 0.00 C ATOM 1554 C GLU A 96 18.411 -8.717 1.910 1.00 0.00 C ATOM 1555 O GLU A 96 17.746 -9.678 1.519 1.00 0.00 O ATOM 1556 CB GLU A 96 19.886 -6.772 1.314 1.00 0.00 C ATOM 1557 CG GLU A 96 21.226 -6.296 0.784 1.00 0.00 C ATOM 1558 CD GLU A 96 22.385 -6.758 1.639 1.00 0.00 C ATOM 1559 OE1 GLU A 96 22.621 -7.981 1.723 1.00 0.00 O ATOM 1560 OE2 GLU A 96 23.057 -5.900 2.245 1.00 0.00 O ATOM 0 H GLU A 96 18.942 -7.831 -0.779 1.00 0.00 H new ATOM 0 HA GLU A 96 20.499 -8.839 1.508 1.00 0.00 H new ATOM 0 HB2 GLU A 96 19.090 -6.222 0.812 1.00 0.00 H new ATOM 0 HB3 GLU A 96 19.819 -6.532 2.375 1.00 0.00 H new ATOM 0 HG2 GLU A 96 21.361 -6.662 -0.234 1.00 0.00 H new ATOM 0 HG3 GLU A 96 21.227 -5.207 0.734 1.00 0.00 H new ATOM 1567 N GLU A 97 18.178 -8.056 3.055 1.00 0.00 N ATOM 1568 CA GLU A 97 16.986 -8.255 3.904 1.00 0.00 C ATOM 1569 C GLU A 97 15.693 -8.472 3.096 1.00 0.00 C ATOM 1570 O GLU A 97 15.676 -8.250 1.890 1.00 0.00 O ATOM 1571 CB GLU A 97 16.796 -7.033 4.809 1.00 0.00 C ATOM 1572 CG GLU A 97 17.928 -6.794 5.798 1.00 0.00 C ATOM 1573 CD GLU A 97 18.036 -7.883 6.841 1.00 0.00 C ATOM 1574 OE1 GLU A 97 18.658 -8.927 6.561 1.00 0.00 O ATOM 1575 OE2 GLU A 97 17.503 -7.694 7.952 1.00 0.00 O ATOM 0 H GLU A 97 18.821 -7.356 3.425 1.00 0.00 H new ATOM 0 HA GLU A 97 17.165 -9.159 4.486 1.00 0.00 H new ATOM 0 HB2 GLU A 97 16.685 -6.148 4.183 1.00 0.00 H new ATOM 0 HB3 GLU A 97 15.865 -7.150 5.364 1.00 0.00 H new ATOM 0 HG2 GLU A 97 18.870 -6.724 5.254 1.00 0.00 H new ATOM 0 HG3 GLU A 97 17.774 -5.836 6.295 1.00 0.00 H new ATOM 1582 N PRO A 98 14.581 -8.870 3.761 1.00 0.00 N ATOM 1583 CA PRO A 98 13.317 -9.225 3.105 1.00 0.00 C ATOM 1584 C PRO A 98 13.015 -8.393 1.859 1.00 0.00 C ATOM 1585 O PRO A 98 13.005 -7.160 1.897 1.00 0.00 O ATOM 1586 CB PRO A 98 12.257 -8.976 4.198 1.00 0.00 C ATOM 1587 CG PRO A 98 13.017 -8.463 5.379 1.00 0.00 C ATOM 1588 CD PRO A 98 14.419 -8.968 5.211 1.00 0.00 C ATOM 0 HA PRO A 98 13.342 -10.251 2.737 1.00 0.00 H new ATOM 0 HB2 PRO A 98 11.512 -8.253 3.866 1.00 0.00 H new ATOM 0 HB3 PRO A 98 11.723 -9.894 4.443 1.00 0.00 H new ATOM 0 HG2 PRO A 98 12.995 -7.374 5.415 1.00 0.00 H new ATOM 0 HG3 PRO A 98 12.581 -8.822 6.311 1.00 0.00 H new ATOM 0 HD2 PRO A 98 15.144 -8.357 5.749 1.00 0.00 H new ATOM 0 HD3 PRO A 98 14.535 -9.991 5.570 1.00 0.00 H new ATOM 1596 N ARG A 99 12.765 -9.089 0.760 1.00 0.00 N ATOM 1597 CA ARG A 99 12.568 -8.460 -0.540 1.00 0.00 C ATOM 1598 C ARG A 99 11.128 -8.032 -0.721 1.00 0.00 C ATOM 1599 O ARG A 99 10.700 -7.651 -1.811 1.00 0.00 O ATOM 1600 CB ARG A 99 12.960 -9.434 -1.633 1.00 0.00 C ATOM 1601 CG ARG A 99 14.452 -9.647 -1.683 1.00 0.00 C ATOM 1602 CD ARG A 99 14.839 -10.867 -2.495 1.00 0.00 C ATOM 1603 NE ARG A 99 14.006 -11.035 -3.688 1.00 0.00 N ATOM 1604 CZ ARG A 99 14.494 -11.283 -4.902 1.00 0.00 C ATOM 1605 NH1 ARG A 99 15.807 -11.331 -5.091 1.00 0.00 N ATOM 1606 NH2 ARG A 99 13.669 -11.468 -5.927 1.00 0.00 N ATOM 0 H ARG A 99 12.693 -10.106 0.743 1.00 0.00 H new ATOM 0 HA ARG A 99 13.195 -7.570 -0.597 1.00 0.00 H new ATOM 0 HB2 ARG A 99 12.462 -10.389 -1.465 1.00 0.00 H new ATOM 0 HB3 ARG A 99 12.614 -9.059 -2.596 1.00 0.00 H new ATOM 0 HG2 ARG A 99 14.927 -8.764 -2.111 1.00 0.00 H new ATOM 0 HG3 ARG A 99 14.834 -9.754 -0.668 1.00 0.00 H new ATOM 0 HD2 ARG A 99 15.884 -10.784 -2.794 1.00 0.00 H new ATOM 0 HD3 ARG A 99 14.756 -11.756 -1.870 1.00 0.00 H new ATOM 0 HE ARG A 99 12.994 -10.958 -3.583 1.00 0.00 H new ATOM 0 HH11 ARG A 99 16.441 -11.178 -4.307 1.00 0.00 H new ATOM 0 HH12 ARG A 99 16.182 -11.521 -6.020 1.00 0.00 H new ATOM 0 HH21 ARG A 99 12.660 -11.420 -5.785 1.00 0.00 H new ATOM 0 HH22 ARG A 99 14.045 -11.658 -6.856 1.00 0.00 H new ATOM 1620 N LYS A 100 10.388 -8.120 0.357 1.00 0.00 N ATOM 1621 CA LYS A 100 8.986 -7.753 0.353 1.00 0.00 C ATOM 1622 C LYS A 100 8.557 -7.271 1.721 1.00 0.00 C ATOM 1623 O LYS A 100 8.918 -7.856 2.744 1.00 0.00 O ATOM 1624 CB LYS A 100 8.124 -8.933 -0.093 1.00 0.00 C ATOM 1625 CG LYS A 100 8.436 -10.228 0.645 1.00 0.00 C ATOM 1626 CD LYS A 100 7.788 -11.448 -0.007 1.00 0.00 C ATOM 1627 CE LYS A 100 6.272 -11.468 0.142 1.00 0.00 C ATOM 1628 NZ LYS A 100 5.587 -10.693 -0.926 1.00 0.00 N ATOM 0 H LYS A 100 10.735 -8.446 1.259 1.00 0.00 H new ATOM 0 HA LYS A 100 8.848 -6.937 -0.357 1.00 0.00 H new ATOM 0 HB2 LYS A 100 7.074 -8.683 0.057 1.00 0.00 H new ATOM 0 HB3 LYS A 100 8.264 -9.091 -1.162 1.00 0.00 H new ATOM 0 HG2 LYS A 100 9.516 -10.370 0.680 1.00 0.00 H new ATOM 0 HG3 LYS A 100 8.092 -10.146 1.676 1.00 0.00 H new ATOM 0 HD2 LYS A 100 8.044 -11.466 -1.066 1.00 0.00 H new ATOM 0 HD3 LYS A 100 8.203 -12.353 0.436 1.00 0.00 H new ATOM 0 HE2 LYS A 100 5.921 -12.500 0.120 1.00 0.00 H new ATOM 0 HE3 LYS A 100 6.000 -11.059 1.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 4.939 -10.004 -0.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 6.295 -10.191 -1.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 5.047 -11.342 -1.534 1.00 0.00 H new ATOM 1642 N VAL A 101 7.790 -6.204 1.731 1.00 0.00 N ATOM 1643 CA VAL A 101 7.305 -5.629 2.966 1.00 0.00 C ATOM 1644 C VAL A 101 5.782 -5.659 2.986 1.00 0.00 C ATOM 1645 O VAL A 101 5.136 -5.436 1.960 1.00 0.00 O ATOM 1646 CB VAL A 101 7.821 -4.185 3.154 1.00 0.00 C ATOM 1647 CG1 VAL A 101 7.293 -3.260 2.062 1.00 0.00 C ATOM 1648 CG2 VAL A 101 7.467 -3.668 4.537 1.00 0.00 C ATOM 0 H VAL A 101 7.486 -5.713 0.890 1.00 0.00 H new ATOM 0 HA VAL A 101 7.686 -6.225 3.795 1.00 0.00 H new ATOM 0 HB VAL A 101 8.907 -4.200 3.067 1.00 0.00 H new ATOM 0 HG11 VAL A 101 7.675 -2.252 2.223 1.00 0.00 H new ATOM 0 HG12 VAL A 101 7.623 -3.621 1.088 1.00 0.00 H new ATOM 0 HG13 VAL A 101 6.204 -3.245 2.093 1.00 0.00 H new ATOM 0 HG21 VAL A 101 7.839 -2.650 4.651 1.00 0.00 H new ATOM 0 HG22 VAL A 101 6.384 -3.675 4.662 1.00 0.00 H new ATOM 0 HG23 VAL A 101 7.924 -4.307 5.292 1.00 0.00 H new ATOM 1658 N ARG A 102 5.213 -5.962 4.142 1.00 0.00 N ATOM 1659 CA ARG A 102 3.778 -6.104 4.268 1.00 0.00 C ATOM 1660 C ARG A 102 3.211 -5.039 5.192 1.00 0.00 C ATOM 1661 O ARG A 102 3.506 -5.015 6.388 1.00 0.00 O ATOM 1662 CB ARG A 102 3.452 -7.494 4.798 1.00 0.00 C ATOM 1663 CG ARG A 102 1.964 -7.815 4.803 1.00 0.00 C ATOM 1664 CD ARG A 102 1.717 -9.299 5.038 1.00 0.00 C ATOM 1665 NE ARG A 102 2.247 -9.750 6.327 1.00 0.00 N ATOM 1666 CZ ARG A 102 3.144 -10.727 6.471 1.00 0.00 C ATOM 1667 NH1 ARG A 102 3.604 -11.377 5.408 1.00 0.00 N ATOM 1668 NH2 ARG A 102 3.580 -11.061 7.678 1.00 0.00 N ATOM 0 H ARG A 102 5.729 -6.114 5.008 1.00 0.00 H new ATOM 0 HA ARG A 102 3.322 -5.975 3.287 1.00 0.00 H new ATOM 0 HB2 ARG A 102 3.972 -8.235 4.192 1.00 0.00 H new ATOM 0 HB3 ARG A 102 3.838 -7.585 5.813 1.00 0.00 H new ATOM 0 HG2 ARG A 102 1.468 -7.234 5.580 1.00 0.00 H new ATOM 0 HG3 ARG A 102 1.523 -7.517 3.852 1.00 0.00 H new ATOM 0 HD2 ARG A 102 0.646 -9.498 4.997 1.00 0.00 H new ATOM 0 HD3 ARG A 102 2.179 -9.874 4.236 1.00 0.00 H new ATOM 0 HE ARG A 102 1.908 -9.287 7.170 1.00 0.00 H new ATOM 0 HH11 ARG A 102 3.272 -11.130 4.476 1.00 0.00 H new ATOM 0 HH12 ARG A 102 4.290 -12.123 5.524 1.00 0.00 H new ATOM 0 HH21 ARG A 102 3.229 -10.570 8.501 1.00 0.00 H new ATOM 0 HH22 ARG A 102 4.266 -11.809 7.784 1.00 0.00 H new ATOM 1682 N PHE A 103 2.403 -4.158 4.634 1.00 0.00 N ATOM 1683 CA PHE A 103 1.787 -3.098 5.401 1.00 0.00 C ATOM 1684 C PHE A 103 0.303 -3.377 5.590 1.00 0.00 C ATOM 1685 O PHE A 103 -0.470 -3.358 4.632 1.00 0.00 O ATOM 1686 CB PHE A 103 1.981 -1.752 4.704 1.00 0.00 C ATOM 1687 CG PHE A 103 3.418 -1.344 4.541 1.00 0.00 C ATOM 1688 CD1 PHE A 103 4.313 -1.469 5.591 1.00 0.00 C ATOM 1689 CD2 PHE A 103 3.864 -0.805 3.345 1.00 0.00 C ATOM 1690 CE1 PHE A 103 5.626 -1.064 5.449 1.00 0.00 C ATOM 1691 CE2 PHE A 103 5.174 -0.403 3.198 1.00 0.00 C ATOM 1692 CZ PHE A 103 6.056 -0.532 4.251 1.00 0.00 C ATOM 0 H PHE A 103 2.158 -4.158 3.644 1.00 0.00 H new ATOM 0 HA PHE A 103 2.266 -3.058 6.379 1.00 0.00 H new ATOM 0 HB2 PHE A 103 1.513 -1.794 3.720 1.00 0.00 H new ATOM 0 HB3 PHE A 103 1.459 -0.983 5.273 1.00 0.00 H new ATOM 0 HD1 PHE A 103 3.981 -1.887 6.530 1.00 0.00 H new ATOM 0 HD2 PHE A 103 3.177 -0.699 2.518 1.00 0.00 H new ATOM 0 HE1 PHE A 103 6.315 -1.164 6.275 1.00 0.00 H new ATOM 0 HE2 PHE A 103 5.510 0.013 2.259 1.00 0.00 H new ATOM 0 HZ PHE A 103 7.083 -0.217 4.137 1.00 0.00 H new ATOM 1702 N ASP A 104 -0.085 -3.666 6.822 1.00 0.00 N ATOM 1703 CA ASP A 104 -1.486 -3.868 7.153 1.00 0.00 C ATOM 1704 C ASP A 104 -2.173 -2.515 7.302 1.00 0.00 C ATOM 1705 O ASP A 104 -2.241 -1.944 8.391 1.00 0.00 O ATOM 1706 CB ASP A 104 -1.631 -4.708 8.435 1.00 0.00 C ATOM 1707 CG ASP A 104 -0.894 -4.120 9.627 1.00 0.00 C ATOM 1708 OD1 ASP A 104 0.356 -4.143 9.632 1.00 0.00 O ATOM 1709 OD2 ASP A 104 -1.555 -3.632 10.569 1.00 0.00 O ATOM 0 H ASP A 104 0.553 -3.766 7.611 1.00 0.00 H new ATOM 0 HA ASP A 104 -1.967 -4.420 6.346 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -2.689 -4.802 8.681 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -1.257 -5.714 8.246 1.00 0.00 H new ATOM 1714 N TYR A 105 -2.654 -1.981 6.194 1.00 0.00 N ATOM 1715 CA TYR A 105 -3.237 -0.655 6.202 1.00 0.00 C ATOM 1716 C TYR A 105 -4.738 -0.725 6.451 1.00 0.00 C ATOM 1717 O TYR A 105 -5.452 -1.494 5.809 1.00 0.00 O ATOM 1718 CB TYR A 105 -2.944 0.080 4.892 1.00 0.00 C ATOM 1719 CG TYR A 105 -3.562 1.455 4.847 1.00 0.00 C ATOM 1720 CD1 TYR A 105 -3.114 2.472 5.678 1.00 0.00 C ATOM 1721 CD2 TYR A 105 -4.616 1.723 3.994 1.00 0.00 C ATOM 1722 CE1 TYR A 105 -3.702 3.719 5.661 1.00 0.00 C ATOM 1723 CE2 TYR A 105 -5.204 2.965 3.962 1.00 0.00 C ATOM 1724 CZ TYR A 105 -4.747 3.963 4.797 1.00 0.00 C ATOM 1725 OH TYR A 105 -5.361 5.198 4.801 1.00 0.00 O ATOM 0 H TYR A 105 -2.652 -2.442 5.284 1.00 0.00 H new ATOM 0 HA TYR A 105 -2.780 -0.093 7.017 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -1.865 0.166 4.762 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -3.320 -0.511 4.057 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -2.290 2.283 6.350 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -4.983 0.944 3.342 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -3.346 4.498 6.319 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -6.022 3.159 3.284 1.00 0.00 H new ATOM 0 HH TYR A 105 -6.214 5.141 4.321 1.00 0.00 H new ATOM 1735 N ASP A 106 -5.200 0.074 7.400 1.00 0.00 N ATOM 1736 CA ASP A 106 -6.608 0.111 7.758 1.00 0.00 C ATOM 1737 C ASP A 106 -7.422 0.856 6.704 1.00 0.00 C ATOM 1738 O ASP A 106 -7.256 2.067 6.510 1.00 0.00 O ATOM 1739 CB ASP A 106 -6.784 0.782 9.120 1.00 0.00 C ATOM 1740 CG ASP A 106 -8.211 0.714 9.626 1.00 0.00 C ATOM 1741 OD1 ASP A 106 -9.059 1.504 9.166 1.00 0.00 O ATOM 1742 OD2 ASP A 106 -8.489 -0.124 10.509 1.00 0.00 O ATOM 0 H ASP A 106 -4.614 0.711 7.940 1.00 0.00 H new ATOM 0 HA ASP A 106 -6.972 -0.915 7.810 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -6.123 0.305 9.844 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -6.478 1.826 9.049 1.00 0.00 H new ATOM 1747 N LEU A 107 -8.289 0.129 6.016 1.00 0.00 N ATOM 1748 CA LEU A 107 -9.175 0.721 5.033 1.00 0.00 C ATOM 1749 C LEU A 107 -10.469 1.178 5.693 1.00 0.00 C ATOM 1750 O LEU A 107 -11.388 0.382 5.886 1.00 0.00 O ATOM 1751 CB LEU A 107 -9.494 -0.290 3.935 1.00 0.00 C ATOM 1752 CG LEU A 107 -8.876 -0.007 2.571 1.00 0.00 C ATOM 1753 CD1 LEU A 107 -7.370 -0.172 2.614 1.00 0.00 C ATOM 1754 CD2 LEU A 107 -9.485 -0.923 1.534 1.00 0.00 C ATOM 0 H LEU A 107 -8.396 -0.880 6.124 1.00 0.00 H new ATOM 0 HA LEU A 107 -8.674 1.584 4.594 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -9.162 -1.274 4.266 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -10.577 -0.342 3.818 1.00 0.00 H new ATOM 0 HG LEU A 107 -9.089 1.027 2.298 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -6.953 0.035 1.629 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -6.948 0.523 3.340 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -7.124 -1.193 2.904 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -9.040 -0.717 0.560 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -9.294 -1.961 1.808 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -10.560 -0.753 1.485 1.00 0.00 H new ATOM 1766 N PHE A 108 -10.542 2.450 6.050 1.00 0.00 N ATOM 1767 CA PHE A 108 -11.758 2.984 6.654 1.00 0.00 C ATOM 1768 C PHE A 108 -12.563 3.782 5.636 1.00 0.00 C ATOM 1769 O PHE A 108 -12.013 4.553 4.853 1.00 0.00 O ATOM 1770 CB PHE A 108 -11.456 3.841 7.899 1.00 0.00 C ATOM 1771 CG PHE A 108 -10.619 5.073 7.648 1.00 0.00 C ATOM 1772 CD1 PHE A 108 -11.213 6.259 7.237 1.00 0.00 C ATOM 1773 CD2 PHE A 108 -9.247 5.053 7.843 1.00 0.00 C ATOM 1774 CE1 PHE A 108 -10.455 7.393 7.020 1.00 0.00 C ATOM 1775 CE2 PHE A 108 -8.485 6.187 7.630 1.00 0.00 C ATOM 1776 CZ PHE A 108 -9.090 7.357 7.216 1.00 0.00 C ATOM 0 H PHE A 108 -9.787 3.126 5.936 1.00 0.00 H new ATOM 0 HA PHE A 108 -12.355 2.133 6.981 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -12.401 4.149 8.345 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -10.945 3.218 8.633 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -12.282 6.295 7.085 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -8.767 4.141 8.165 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -10.931 8.307 6.697 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -7.417 6.158 7.787 1.00 0.00 H new ATOM 0 HZ PHE A 108 -8.496 8.243 7.046 1.00 0.00 H new ATOM 1786 N LEU A 109 -13.862 3.573 5.629 1.00 0.00 N ATOM 1787 CA LEU A 109 -14.749 4.320 4.756 1.00 0.00 C ATOM 1788 C LEU A 109 -15.683 5.152 5.626 1.00 0.00 C ATOM 1789 O LEU A 109 -16.194 4.652 6.625 1.00 0.00 O ATOM 1790 CB LEU A 109 -15.562 3.365 3.869 1.00 0.00 C ATOM 1791 CG LEU A 109 -14.759 2.253 3.181 1.00 0.00 C ATOM 1792 CD1 LEU A 109 -15.657 1.406 2.295 1.00 0.00 C ATOM 1793 CD2 LEU A 109 -13.621 2.834 2.362 1.00 0.00 C ATOM 0 H LEU A 109 -14.332 2.888 6.221 1.00 0.00 H new ATOM 0 HA LEU A 109 -14.166 4.968 4.102 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -16.338 2.903 4.479 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -16.067 3.952 3.102 1.00 0.00 H new ATOM 0 HG LEU A 109 -14.338 1.618 3.960 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -15.065 0.625 1.818 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -16.440 0.950 2.901 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -16.111 2.035 1.530 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -13.067 2.026 1.884 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -14.025 3.498 1.598 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -12.953 3.396 3.015 1.00 0.00 H new ATOM 1805 N HIS A 110 -15.889 6.415 5.280 1.00 0.00 N ATOM 1806 CA HIS A 110 -16.761 7.270 6.080 1.00 0.00 C ATOM 1807 C HIS A 110 -18.220 7.104 5.665 1.00 0.00 C ATOM 1808 O HIS A 110 -18.513 6.461 4.655 1.00 0.00 O ATOM 1809 CB HIS A 110 -16.328 8.740 6.013 1.00 0.00 C ATOM 1810 CG HIS A 110 -15.142 9.049 6.882 1.00 0.00 C ATOM 1811 ND1 HIS A 110 -14.231 10.050 6.601 1.00 0.00 N ATOM 1812 CD2 HIS A 110 -14.723 8.484 8.040 1.00 0.00 C ATOM 1813 CE1 HIS A 110 -13.309 10.081 7.547 1.00 0.00 C ATOM 1814 NE2 HIS A 110 -13.585 9.143 8.429 1.00 0.00 N ATOM 0 H HIS A 110 -15.473 6.867 4.465 1.00 0.00 H new ATOM 0 HA HIS A 110 -16.669 6.953 7.119 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -16.090 8.995 4.980 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -17.164 9.372 6.312 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -15.198 7.666 8.561 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -12.471 10.761 7.590 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -13.040 8.939 9.267 1.00 0.00 H new ATOM 1823 N LEU A 111 -19.118 7.702 6.437 1.00 0.00 N ATOM 1824 CA LEU A 111 -20.555 7.438 6.328 1.00 0.00 C ATOM 1825 C LEU A 111 -21.123 7.735 4.943 1.00 0.00 C ATOM 1826 O LEU A 111 -20.761 8.721 4.294 1.00 0.00 O ATOM 1827 CB LEU A 111 -21.313 8.244 7.382 1.00 0.00 C ATOM 1828 CG LEU A 111 -22.058 7.401 8.418 1.00 0.00 C ATOM 1829 CD1 LEU A 111 -23.246 6.702 7.782 1.00 0.00 C ATOM 1830 CD2 LEU A 111 -21.126 6.379 9.041 1.00 0.00 C ATOM 0 H LEU A 111 -18.876 8.383 7.157 1.00 0.00 H new ATOM 0 HA LEU A 111 -20.688 6.370 6.498 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -20.607 8.892 7.901 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -22.030 8.892 6.878 1.00 0.00 H new ATOM 0 HG LEU A 111 -22.422 8.066 9.201 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -23.764 6.107 8.534 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -23.930 7.446 7.374 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -22.898 6.050 6.980 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -21.673 5.788 9.776 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -20.736 5.721 8.264 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -20.299 6.892 9.531 1.00 0.00 H new ATOM 1842 N GLU A 112 -22.020 6.852 4.508 1.00 0.00 N ATOM 1843 CA GLU A 112 -22.736 7.007 3.253 1.00 0.00 C ATOM 1844 C GLU A 112 -23.513 8.314 3.255 1.00 0.00 C ATOM 1845 O GLU A 112 -24.352 8.549 4.127 1.00 0.00 O ATOM 1846 CB GLU A 112 -23.687 5.825 3.052 1.00 0.00 C ATOM 1847 CG GLU A 112 -24.395 5.822 1.709 1.00 0.00 C ATOM 1848 CD GLU A 112 -25.312 4.631 1.543 1.00 0.00 C ATOM 1849 OE1 GLU A 112 -24.811 3.488 1.531 1.00 0.00 O ATOM 1850 OE2 GLU A 112 -26.537 4.835 1.424 1.00 0.00 O ATOM 0 H GLU A 112 -22.268 6.007 5.022 1.00 0.00 H new ATOM 0 HA GLU A 112 -22.020 7.029 2.432 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -23.124 4.897 3.156 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -24.435 5.835 3.845 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -24.974 6.740 1.604 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -23.653 5.820 0.910 1.00 0.00 H new ATOM 1857 N GLY A 113 -23.212 9.164 2.293 1.00 0.00 N ATOM 1858 CA GLY A 113 -23.840 10.460 2.220 1.00 0.00 C ATOM 1859 C GLY A 113 -22.823 11.572 2.306 1.00 0.00 C ATOM 1860 O GLY A 113 -22.828 12.495 1.490 1.00 0.00 O ATOM 0 H GLY A 113 -22.536 8.977 1.553 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -24.395 10.545 1.286 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -24.562 10.562 3.030 1.00 0.00 H new ATOM 1864 N HIS A 114 -21.934 11.475 3.285 1.00 0.00 N ATOM 1865 CA HIS A 114 -20.903 12.490 3.474 1.00 0.00 C ATOM 1866 C HIS A 114 -19.584 11.856 3.927 1.00 0.00 C ATOM 1867 O HIS A 114 -19.207 11.941 5.095 1.00 0.00 O ATOM 1868 CB HIS A 114 -21.374 13.550 4.491 1.00 0.00 C ATOM 1869 CG HIS A 114 -21.838 12.991 5.810 1.00 0.00 C ATOM 1870 ND1 HIS A 114 -21.074 13.028 6.959 1.00 0.00 N ATOM 1871 CD2 HIS A 114 -22.997 12.378 6.157 1.00 0.00 C ATOM 1872 CE1 HIS A 114 -21.738 12.463 7.948 1.00 0.00 C ATOM 1873 NE2 HIS A 114 -22.906 12.060 7.491 1.00 0.00 N ATOM 0 H HIS A 114 -21.904 10.709 3.958 1.00 0.00 H new ATOM 0 HA HIS A 114 -20.728 12.980 2.516 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -20.556 14.247 4.674 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -22.188 14.123 4.048 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -23.835 12.177 5.506 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -21.384 12.350 8.962 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -23.626 11.588 8.038 1.00 0.00 H new ATOM 1882 N PRO A 115 -18.863 11.196 3.011 1.00 0.00 N ATOM 1883 CA PRO A 115 -17.567 10.624 3.299 1.00 0.00 C ATOM 1884 C PRO A 115 -16.409 11.406 2.669 1.00 0.00 C ATOM 1885 O PRO A 115 -16.217 11.375 1.450 1.00 0.00 O ATOM 1886 CB PRO A 115 -17.701 9.262 2.614 1.00 0.00 C ATOM 1887 CG PRO A 115 -18.667 9.480 1.477 1.00 0.00 C ATOM 1888 CD PRO A 115 -19.271 10.858 1.653 1.00 0.00 C ATOM 0 HA PRO A 115 -17.337 10.608 4.364 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -16.737 8.909 2.248 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -18.074 8.508 3.307 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -18.154 9.405 0.518 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -19.445 8.716 1.483 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -18.885 11.569 0.922 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -20.355 10.845 1.544 1.00 0.00 H new ATOM 1896 N PRO A 116 -15.624 12.124 3.479 1.00 0.00 N ATOM 1897 CA PRO A 116 -14.351 12.677 3.047 1.00 0.00 C ATOM 1898 C PRO A 116 -13.180 11.787 3.465 1.00 0.00 C ATOM 1899 O PRO A 116 -12.744 11.824 4.619 1.00 0.00 O ATOM 1900 CB PRO A 116 -14.311 14.007 3.793 1.00 0.00 C ATOM 1901 CG PRO A 116 -15.079 13.772 5.062 1.00 0.00 C ATOM 1902 CD PRO A 116 -15.950 12.551 4.849 1.00 0.00 C ATOM 0 HA PRO A 116 -14.265 12.770 1.964 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -13.285 14.309 4.004 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -14.762 14.804 3.202 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -14.398 13.616 5.899 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -15.690 14.641 5.306 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -15.728 11.769 5.575 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -17.008 12.791 4.952 1.00 0.00 H new ATOM 1910 N VAL A 117 -12.688 10.959 2.554 1.00 0.00 N ATOM 1911 CA VAL A 117 -11.560 10.103 2.877 1.00 0.00 C ATOM 1912 C VAL A 117 -10.419 10.235 1.874 1.00 0.00 C ATOM 1913 O VAL A 117 -10.548 9.844 0.715 1.00 0.00 O ATOM 1914 CB VAL A 117 -11.971 8.623 2.973 1.00 0.00 C ATOM 1915 CG1 VAL A 117 -10.750 7.746 3.158 1.00 0.00 C ATOM 1916 CG2 VAL A 117 -12.951 8.401 4.109 1.00 0.00 C ATOM 0 H VAL A 117 -13.045 10.863 1.603 1.00 0.00 H new ATOM 0 HA VAL A 117 -11.208 10.443 3.851 1.00 0.00 H new ATOM 0 HB VAL A 117 -12.464 8.350 2.040 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -11.058 6.703 3.224 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -10.079 7.873 2.309 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -10.233 8.030 4.075 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -13.224 7.347 4.153 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -12.489 8.696 5.051 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -13.845 9.001 3.940 1.00 0.00 H new ATOM 1926 N ASN A 118 -9.323 10.817 2.332 1.00 0.00 N ATOM 1927 CA ASN A 118 -8.051 10.763 1.625 1.00 0.00 C ATOM 1928 C ASN A 118 -6.932 10.744 2.662 1.00 0.00 C ATOM 1929 O ASN A 118 -6.527 11.795 3.157 1.00 0.00 O ATOM 1930 CB ASN A 118 -7.885 11.965 0.692 1.00 0.00 C ATOM 1931 CG ASN A 118 -6.740 11.779 -0.298 1.00 0.00 C ATOM 1932 OD1 ASN A 118 -6.961 11.394 -1.442 1.00 0.00 O ATOM 1933 ND2 ASN A 118 -5.506 12.022 0.126 1.00 0.00 N ATOM 0 H ASN A 118 -9.289 11.342 3.206 1.00 0.00 H new ATOM 0 HA ASN A 118 -8.016 9.865 1.009 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -8.813 12.127 0.144 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -7.706 12.861 1.286 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -4.715 11.889 -0.504 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -5.349 12.341 1.082 1.00 0.00 H new ATOM 1940 N HIS A 119 -6.434 9.565 2.996 1.00 0.00 N ATOM 1941 CA HIS A 119 -5.478 9.439 4.093 1.00 0.00 C ATOM 1942 C HIS A 119 -4.156 8.862 3.608 1.00 0.00 C ATOM 1943 O HIS A 119 -4.137 8.024 2.710 1.00 0.00 O ATOM 1944 CB HIS A 119 -6.054 8.551 5.198 1.00 0.00 C ATOM 1945 CG HIS A 119 -5.263 8.574 6.471 1.00 0.00 C ATOM 1946 ND1 HIS A 119 -4.568 7.483 6.945 1.00 0.00 N ATOM 1947 CD2 HIS A 119 -5.069 9.562 7.377 1.00 0.00 C ATOM 1948 CE1 HIS A 119 -3.982 7.800 8.085 1.00 0.00 C ATOM 1949 NE2 HIS A 119 -4.270 9.055 8.370 1.00 0.00 N ATOM 0 H HIS A 119 -6.670 8.688 2.532 1.00 0.00 H new ATOM 0 HA HIS A 119 -5.293 10.437 4.490 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -7.075 8.869 5.410 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -6.109 7.525 4.834 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -4.515 6.573 6.487 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -5.469 10.564 7.327 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -3.370 7.142 8.684 1.00 0.00 H new ATOM 1958 N LEU A 120 -3.064 9.323 4.212 1.00 0.00 N ATOM 1959 CA LEU A 120 -1.727 8.845 3.892 1.00 0.00 C ATOM 1960 C LEU A 120 -0.838 8.830 5.134 1.00 0.00 C ATOM 1961 O LEU A 120 -0.951 9.696 5.999 1.00 0.00 O ATOM 1962 CB LEU A 120 -1.109 9.721 2.804 1.00 0.00 C ATOM 1963 CG LEU A 120 -1.565 9.401 1.388 1.00 0.00 C ATOM 1964 CD1 LEU A 120 -1.277 10.565 0.471 1.00 0.00 C ATOM 1965 CD2 LEU A 120 -0.852 8.162 0.880 1.00 0.00 C ATOM 0 H LEU A 120 -3.084 10.039 4.938 1.00 0.00 H new ATOM 0 HA LEU A 120 -1.805 7.822 3.524 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -1.345 10.763 3.019 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -0.024 9.623 2.852 1.00 0.00 H new ATOM 0 HG LEU A 120 -2.639 9.217 1.401 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -1.608 10.323 -0.539 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -1.809 11.448 0.826 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -0.206 10.766 0.463 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -1.185 7.941 -0.134 1.00 0.00 H new ATOM 0 HD22 LEU A 120 0.224 8.336 0.879 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -1.082 7.318 1.530 1.00 0.00 H new ATOM 1977 N ARG A 121 0.031 7.830 5.215 1.00 0.00 N ATOM 1978 CA ARG A 121 0.947 7.682 6.340 1.00 0.00 C ATOM 1979 C ARG A 121 2.265 7.071 5.873 1.00 0.00 C ATOM 1980 O ARG A 121 2.283 6.279 4.936 1.00 0.00 O ATOM 1981 CB ARG A 121 0.298 6.831 7.442 1.00 0.00 C ATOM 1982 CG ARG A 121 -0.173 5.444 7.002 1.00 0.00 C ATOM 1983 CD ARG A 121 0.904 4.380 7.193 1.00 0.00 C ATOM 1984 NE ARG A 121 1.614 4.558 8.459 1.00 0.00 N ATOM 1985 CZ ARG A 121 1.676 3.646 9.426 1.00 0.00 C ATOM 1986 NH1 ARG A 121 1.054 2.482 9.301 1.00 0.00 N ATOM 1987 NH2 ARG A 121 2.349 3.918 10.534 1.00 0.00 N ATOM 0 H ARG A 121 0.121 7.102 4.507 1.00 0.00 H new ATOM 0 HA ARG A 121 1.163 8.666 6.756 1.00 0.00 H new ATOM 0 HB2 ARG A 121 1.013 6.713 8.256 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -0.556 7.376 7.844 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -1.060 5.166 7.571 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -0.465 5.478 5.952 1.00 0.00 H new ATOM 0 HD2 ARG A 121 0.448 3.390 7.166 1.00 0.00 H new ATOM 0 HD3 ARG A 121 1.614 4.427 6.367 1.00 0.00 H new ATOM 0 HE ARG A 121 2.096 5.444 8.612 1.00 0.00 H new ATOM 0 HH11 ARG A 121 0.520 2.277 8.456 1.00 0.00 H new ATOM 0 HH12 ARG A 121 1.109 1.791 10.049 1.00 0.00 H new ATOM 0 HH21 ARG A 121 2.814 4.820 10.640 1.00 0.00 H new ATOM 0 HH22 ARG A 121 2.403 3.226 11.281 1.00 0.00 H new ATOM 2001 N CYS A 122 3.363 7.431 6.523 1.00 0.00 N ATOM 2002 CA CYS A 122 4.681 7.014 6.067 1.00 0.00 C ATOM 2003 C CYS A 122 5.305 5.966 6.986 1.00 0.00 C ATOM 2004 O CYS A 122 5.368 6.140 8.205 1.00 0.00 O ATOM 2005 CB CYS A 122 5.599 8.227 5.952 1.00 0.00 C ATOM 2006 SG CYS A 122 5.704 9.216 7.460 1.00 0.00 S ATOM 0 H CYS A 122 3.367 8.008 7.364 1.00 0.00 H new ATOM 0 HA CYS A 122 4.559 6.553 5.087 1.00 0.00 H new ATOM 0 HB2 CYS A 122 6.599 7.888 5.682 1.00 0.00 H new ATOM 0 HB3 CYS A 122 5.246 8.861 5.138 1.00 0.00 H new ATOM 0 HG CYS A 122 5.615 8.437 8.497 1.00 0.00 H new ATOM 2012 N GLU A 123 5.762 4.882 6.385 1.00 0.00 N ATOM 2013 CA GLU A 123 6.458 3.820 7.092 1.00 0.00 C ATOM 2014 C GLU A 123 7.958 3.953 6.889 1.00 0.00 C ATOM 2015 O GLU A 123 8.402 4.582 5.932 1.00 0.00 O ATOM 2016 CB GLU A 123 5.978 2.466 6.581 1.00 0.00 C ATOM 2017 CG GLU A 123 4.562 2.140 7.011 1.00 0.00 C ATOM 2018 CD GLU A 123 4.524 1.500 8.385 1.00 0.00 C ATOM 2019 OE1 GLU A 123 4.690 2.223 9.390 1.00 0.00 O ATOM 2020 OE2 GLU A 123 4.372 0.266 8.467 1.00 0.00 O ATOM 0 H GLU A 123 5.660 4.712 5.384 1.00 0.00 H new ATOM 0 HA GLU A 123 6.242 3.898 8.158 1.00 0.00 H new ATOM 0 HB2 GLU A 123 6.033 2.454 5.492 1.00 0.00 H new ATOM 0 HB3 GLU A 123 6.650 1.688 6.943 1.00 0.00 H new ATOM 0 HG2 GLU A 123 3.965 3.052 7.018 1.00 0.00 H new ATOM 0 HG3 GLU A 123 4.107 1.467 6.284 1.00 0.00 H new ATOM 2027 N LYS A 124 8.734 3.356 7.776 1.00 0.00 N ATOM 2028 CA LYS A 124 10.175 3.490 7.734 1.00 0.00 C ATOM 2029 C LYS A 124 10.848 2.130 7.788 1.00 0.00 C ATOM 2030 O LYS A 124 10.631 1.352 8.719 1.00 0.00 O ATOM 2031 CB LYS A 124 10.641 4.345 8.904 1.00 0.00 C ATOM 2032 CG LYS A 124 12.144 4.557 8.950 1.00 0.00 C ATOM 2033 CD LYS A 124 12.537 5.414 10.120 1.00 0.00 C ATOM 2034 CE LYS A 124 12.275 6.859 9.790 1.00 0.00 C ATOM 2035 NZ LYS A 124 13.418 7.482 9.075 1.00 0.00 N ATOM 0 H LYS A 124 8.386 2.772 8.536 1.00 0.00 H new ATOM 0 HA LYS A 124 10.452 3.970 6.796 1.00 0.00 H new ATOM 0 HB2 LYS A 124 10.148 5.316 8.851 1.00 0.00 H new ATOM 0 HB3 LYS A 124 10.321 3.876 9.834 1.00 0.00 H new ATOM 0 HG2 LYS A 124 12.648 3.593 9.017 1.00 0.00 H new ATOM 0 HG3 LYS A 124 12.476 5.027 8.024 1.00 0.00 H new ATOM 0 HD2 LYS A 124 11.971 5.123 11.005 1.00 0.00 H new ATOM 0 HD3 LYS A 124 13.592 5.268 10.354 1.00 0.00 H new ATOM 0 HE2 LYS A 124 11.378 6.934 9.175 1.00 0.00 H new ATOM 0 HE3 LYS A 124 12.078 7.411 10.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 13.197 8.477 8.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 14.268 7.434 9.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 13.590 6.972 8.185 1.00 0.00 H new ATOM 2049 N LEU A 125 11.659 1.848 6.787 1.00 0.00 N ATOM 2050 CA LEU A 125 12.399 0.601 6.728 1.00 0.00 C ATOM 2051 C LEU A 125 13.892 0.889 6.847 1.00 0.00 C ATOM 2052 O LEU A 125 14.468 1.543 5.977 1.00 0.00 O ATOM 2053 CB LEU A 125 12.106 -0.099 5.403 1.00 0.00 C ATOM 2054 CG LEU A 125 10.622 -0.198 5.033 1.00 0.00 C ATOM 2055 CD1 LEU A 125 10.431 -0.138 3.526 1.00 0.00 C ATOM 2056 CD2 LEU A 125 10.029 -1.483 5.587 1.00 0.00 C ATOM 0 H LEU A 125 11.823 2.471 5.997 1.00 0.00 H new ATOM 0 HA LEU A 125 12.095 -0.046 7.550 1.00 0.00 H new ATOM 0 HB2 LEU A 125 12.628 0.431 4.607 1.00 0.00 H new ATOM 0 HB3 LEU A 125 12.522 -1.106 5.442 1.00 0.00 H new ATOM 0 HG LEU A 125 10.103 0.652 5.475 1.00 0.00 H new ATOM 0 HD11 LEU A 125 9.369 -0.210 3.291 1.00 0.00 H new ATOM 0 HD12 LEU A 125 10.823 0.806 3.147 1.00 0.00 H new ATOM 0 HD13 LEU A 125 10.963 -0.966 3.058 1.00 0.00 H new ATOM 0 HD21 LEU A 125 8.974 -1.543 5.318 1.00 0.00 H new ATOM 0 HD22 LEU A 125 10.559 -2.338 5.168 1.00 0.00 H new ATOM 0 HD23 LEU A 125 10.128 -1.491 6.673 1.00 0.00 H new ATOM 2068 N THR A 126 14.507 0.427 7.923 1.00 0.00 N ATOM 2069 CA THR A 126 15.928 0.653 8.134 1.00 0.00 C ATOM 2070 C THR A 126 16.721 -0.588 7.764 1.00 0.00 C ATOM 2071 O THR A 126 16.404 -1.695 8.204 1.00 0.00 O ATOM 2072 CB THR A 126 16.236 1.018 9.596 1.00 0.00 C ATOM 2073 OG1 THR A 126 15.059 1.548 10.223 1.00 0.00 O ATOM 2074 CG2 THR A 126 17.353 2.046 9.660 1.00 0.00 C ATOM 0 H THR A 126 14.047 -0.105 8.662 1.00 0.00 H new ATOM 0 HA THR A 126 16.217 1.488 7.496 1.00 0.00 H new ATOM 0 HB THR A 126 16.554 0.117 10.121 1.00 0.00 H new ATOM 0 HG1 THR A 126 15.260 1.777 11.154 1.00 0.00 H new ATOM 0 HG21 THR A 126 17.560 2.294 10.701 1.00 0.00 H new ATOM 0 HG22 THR A 126 18.252 1.636 9.199 1.00 0.00 H new ATOM 0 HG23 THR A 126 17.050 2.946 9.126 1.00 0.00 H new ATOM 2082 N PHE A 127 17.731 -0.408 6.935 1.00 0.00 N ATOM 2083 CA PHE A 127 18.588 -1.507 6.534 1.00 0.00 C ATOM 2084 C PHE A 127 20.003 -1.263 7.015 1.00 0.00 C ATOM 2085 O PHE A 127 20.745 -0.470 6.434 1.00 0.00 O ATOM 2086 CB PHE A 127 18.544 -1.674 5.018 1.00 0.00 C ATOM 2087 CG PHE A 127 17.148 -1.878 4.520 1.00 0.00 C ATOM 2088 CD1 PHE A 127 16.589 -3.142 4.485 1.00 0.00 C ATOM 2089 CD2 PHE A 127 16.382 -0.796 4.126 1.00 0.00 C ATOM 2090 CE1 PHE A 127 15.288 -3.323 4.069 1.00 0.00 C ATOM 2091 CE2 PHE A 127 15.087 -0.969 3.700 1.00 0.00 C ATOM 2092 CZ PHE A 127 14.533 -2.234 3.674 1.00 0.00 C ATOM 0 H PHE A 127 17.979 0.492 6.525 1.00 0.00 H new ATOM 0 HA PHE A 127 18.229 -2.430 6.989 1.00 0.00 H new ATOM 0 HB2 PHE A 127 18.974 -0.792 4.543 1.00 0.00 H new ATOM 0 HB3 PHE A 127 19.161 -2.525 4.728 1.00 0.00 H new ATOM 0 HD1 PHE A 127 17.178 -3.996 4.787 1.00 0.00 H new ATOM 0 HD2 PHE A 127 16.807 0.197 4.153 1.00 0.00 H new ATOM 0 HE1 PHE A 127 14.859 -4.314 4.051 1.00 0.00 H new ATOM 0 HE2 PHE A 127 14.503 -0.117 3.386 1.00 0.00 H new ATOM 0 HZ PHE A 127 13.513 -2.372 3.346 1.00 0.00 H new ATOM 2102 N ASN A 128 20.359 -1.940 8.092 1.00 0.00 N ATOM 2103 CA ASN A 128 21.642 -1.737 8.736 1.00 0.00 C ATOM 2104 C ASN A 128 22.773 -2.302 7.888 1.00 0.00 C ATOM 2105 O ASN A 128 22.831 -3.506 7.630 1.00 0.00 O ATOM 2106 CB ASN A 128 21.650 -2.382 10.124 1.00 0.00 C ATOM 2107 CG ASN A 128 20.666 -1.727 11.080 1.00 0.00 C ATOM 2108 OD1 ASN A 128 21.007 -0.783 11.791 1.00 0.00 O ATOM 2109 ND2 ASN A 128 19.437 -2.219 11.104 1.00 0.00 N ATOM 0 H ASN A 128 19.770 -2.641 8.542 1.00 0.00 H new ATOM 0 HA ASN A 128 21.799 -0.664 8.845 1.00 0.00 H new ATOM 0 HB2 ASN A 128 21.409 -3.441 10.030 1.00 0.00 H new ATOM 0 HB3 ASN A 128 22.654 -2.320 10.543 1.00 0.00 H new ATOM 0 HD21 ASN A 128 18.738 -1.814 11.726 1.00 0.00 H new ATOM 0 HD22 ASN A 128 19.190 -3.003 10.500 1.00 0.00 H new ATOM 2116 N ASN A 129 23.652 -1.403 7.453 1.00 0.00 N ATOM 2117 CA ASN A 129 24.859 -1.750 6.697 1.00 0.00 C ATOM 2118 C ASN A 129 24.551 -2.652 5.496 1.00 0.00 C ATOM 2119 O ASN A 129 24.922 -3.828 5.478 1.00 0.00 O ATOM 2120 CB ASN A 129 25.883 -2.420 7.619 1.00 0.00 C ATOM 2121 CG ASN A 129 27.306 -2.218 7.141 1.00 0.00 C ATOM 2122 OD1 ASN A 129 27.928 -1.202 7.450 1.00 0.00 O ATOM 2123 ND2 ASN A 129 27.843 -3.182 6.411 1.00 0.00 N ATOM 0 H ASN A 129 23.548 -0.401 7.616 1.00 0.00 H new ATOM 0 HA ASN A 129 25.277 -0.823 6.304 1.00 0.00 H new ATOM 0 HB2 ASN A 129 25.780 -2.017 8.626 1.00 0.00 H new ATOM 0 HB3 ASN A 129 25.670 -3.487 7.679 1.00 0.00 H new ATOM 0 HD21 ASN A 129 28.805 -3.098 6.084 1.00 0.00 H new ATOM 0 HD22 ASN A 129 27.295 -4.009 6.176 1.00 0.00 H new ATOM 2130 N PRO A 130 23.871 -2.112 4.471 1.00 0.00 N ATOM 2131 CA PRO A 130 23.534 -2.863 3.270 1.00 0.00 C ATOM 2132 C PRO A 130 24.645 -2.796 2.226 1.00 0.00 C ATOM 2133 O PRO A 130 25.470 -1.873 2.236 1.00 0.00 O ATOM 2134 CB PRO A 130 22.278 -2.149 2.774 1.00 0.00 C ATOM 2135 CG PRO A 130 22.438 -0.729 3.210 1.00 0.00 C ATOM 2136 CD PRO A 130 23.380 -0.725 4.394 1.00 0.00 C ATOM 0 HA PRO A 130 23.392 -3.927 3.461 1.00 0.00 H new ATOM 0 HB2 PRO A 130 22.186 -2.220 1.690 1.00 0.00 H new ATOM 0 HB3 PRO A 130 21.378 -2.593 3.200 1.00 0.00 H new ATOM 0 HG2 PRO A 130 22.838 -0.121 2.399 1.00 0.00 H new ATOM 0 HG3 PRO A 130 21.474 -0.300 3.484 1.00 0.00 H new ATOM 0 HD2 PRO A 130 24.199 -0.020 4.249 1.00 0.00 H new ATOM 0 HD3 PRO A 130 22.867 -0.433 5.310 1.00 0.00 H new ATOM 2144 N THR A 131 24.664 -3.781 1.336 1.00 0.00 N ATOM 2145 CA THR A 131 25.665 -3.843 0.277 1.00 0.00 C ATOM 2146 C THR A 131 25.473 -2.681 -0.697 1.00 0.00 C ATOM 2147 O THR A 131 24.382 -2.101 -0.756 1.00 0.00 O ATOM 2148 CB THR A 131 25.618 -5.191 -0.490 1.00 0.00 C ATOM 2149 OG1 THR A 131 26.635 -5.229 -1.499 1.00 0.00 O ATOM 2150 CG2 THR A 131 24.255 -5.415 -1.131 1.00 0.00 C ATOM 0 H THR A 131 23.995 -4.551 1.327 1.00 0.00 H new ATOM 0 HA THR A 131 26.645 -3.766 0.749 1.00 0.00 H new ATOM 0 HB THR A 131 25.796 -5.987 0.233 1.00 0.00 H new ATOM 0 HG1 THR A 131 26.594 -6.086 -1.973 1.00 0.00 H new ATOM 0 HG21 THR A 131 24.254 -6.368 -1.661 1.00 0.00 H new ATOM 0 HG22 THR A 131 23.487 -5.429 -0.358 1.00 0.00 H new ATOM 0 HG23 THR A 131 24.047 -4.609 -1.834 1.00 0.00 H new ATOM 2158 N GLU A 132 26.521 -2.346 -1.452 1.00 0.00 N ATOM 2159 CA GLU A 132 26.517 -1.152 -2.300 1.00 0.00 C ATOM 2160 C GLU A 132 25.289 -1.108 -3.200 1.00 0.00 C ATOM 2161 O GLU A 132 24.628 -0.093 -3.261 1.00 0.00 O ATOM 2162 CB GLU A 132 27.772 -1.072 -3.171 1.00 0.00 C ATOM 2163 CG GLU A 132 27.976 0.297 -3.798 1.00 0.00 C ATOM 2164 CD GLU A 132 28.252 1.358 -2.755 1.00 0.00 C ATOM 2165 OE1 GLU A 132 29.391 1.406 -2.241 1.00 0.00 O ATOM 2166 OE2 GLU A 132 27.338 2.143 -2.439 1.00 0.00 O ATOM 0 H GLU A 132 27.385 -2.886 -1.494 1.00 0.00 H new ATOM 0 HA GLU A 132 26.497 -0.298 -1.623 1.00 0.00 H new ATOM 0 HB2 GLU A 132 28.644 -1.321 -2.566 1.00 0.00 H new ATOM 0 HB3 GLU A 132 27.707 -1.821 -3.961 1.00 0.00 H new ATOM 0 HG2 GLU A 132 28.807 0.254 -4.502 1.00 0.00 H new ATOM 0 HG3 GLU A 132 27.089 0.571 -4.369 1.00 0.00 H new ATOM 2173 N ASP A 133 24.976 -2.217 -3.874 1.00 0.00 N ATOM 2174 CA ASP A 133 23.866 -2.248 -4.842 1.00 0.00 C ATOM 2175 C ASP A 133 22.571 -1.741 -4.215 1.00 0.00 C ATOM 2176 O ASP A 133 21.901 -0.860 -4.762 1.00 0.00 O ATOM 2177 CB ASP A 133 23.623 -3.665 -5.366 1.00 0.00 C ATOM 2178 CG ASP A 133 24.808 -4.253 -6.095 1.00 0.00 C ATOM 2179 OD1 ASP A 133 25.079 -3.833 -7.239 1.00 0.00 O ATOM 2180 OD2 ASP A 133 25.468 -5.147 -5.529 1.00 0.00 O ATOM 0 H ASP A 133 25.470 -3.104 -3.771 1.00 0.00 H new ATOM 0 HA ASP A 133 24.155 -1.597 -5.667 1.00 0.00 H new ATOM 0 HB2 ASP A 133 23.364 -4.313 -4.529 1.00 0.00 H new ATOM 0 HB3 ASP A 133 22.764 -3.653 -6.037 1.00 0.00 H new ATOM 2185 N PHE A 134 22.226 -2.303 -3.061 1.00 0.00 N ATOM 2186 CA PHE A 134 21.005 -1.928 -2.362 1.00 0.00 C ATOM 2187 C PHE A 134 21.113 -0.486 -1.886 1.00 0.00 C ATOM 2188 O PHE A 134 20.263 0.349 -2.194 1.00 0.00 O ATOM 2189 CB PHE A 134 20.771 -2.862 -1.162 1.00 0.00 C ATOM 2190 CG PHE A 134 19.379 -2.773 -0.621 1.00 0.00 C ATOM 2191 CD1 PHE A 134 18.315 -2.618 -1.485 1.00 0.00 C ATOM 2192 CD2 PHE A 134 19.129 -2.845 0.738 1.00 0.00 C ATOM 2193 CE1 PHE A 134 17.027 -2.533 -1.013 1.00 0.00 C ATOM 2194 CE2 PHE A 134 17.838 -2.761 1.220 1.00 0.00 C ATOM 2195 CZ PHE A 134 16.785 -2.603 0.339 1.00 0.00 C ATOM 0 H PHE A 134 22.777 -3.021 -2.590 1.00 0.00 H new ATOM 0 HA PHE A 134 20.161 -2.020 -3.045 1.00 0.00 H new ATOM 0 HB2 PHE A 134 20.974 -3.890 -1.462 1.00 0.00 H new ATOM 0 HB3 PHE A 134 21.480 -2.615 -0.372 1.00 0.00 H new ATOM 0 HD1 PHE A 134 18.497 -2.563 -2.548 1.00 0.00 H new ATOM 0 HD2 PHE A 134 19.951 -2.968 1.428 1.00 0.00 H new ATOM 0 HE1 PHE A 134 16.205 -2.411 -1.703 1.00 0.00 H new ATOM 0 HE2 PHE A 134 17.652 -2.819 2.282 1.00 0.00 H new ATOM 0 HZ PHE A 134 15.774 -2.535 0.712 1.00 0.00 H new ATOM 2205 N ARG A 135 22.181 -0.227 -1.148 1.00 0.00 N ATOM 2206 CA ARG A 135 22.543 1.111 -0.681 1.00 0.00 C ATOM 2207 C ARG A 135 22.409 2.154 -1.791 1.00 0.00 C ATOM 2208 O ARG A 135 21.747 3.170 -1.628 1.00 0.00 O ATOM 2209 CB ARG A 135 23.966 1.032 -0.152 1.00 0.00 C ATOM 2210 CG ARG A 135 24.694 2.364 -0.081 1.00 0.00 C ATOM 2211 CD ARG A 135 25.135 2.661 1.340 1.00 0.00 C ATOM 2212 NE ARG A 135 25.684 1.469 1.989 1.00 0.00 N ATOM 2213 CZ ARG A 135 26.652 1.490 2.899 1.00 0.00 C ATOM 2214 NH1 ARG A 135 27.180 2.643 3.294 1.00 0.00 N ATOM 2215 NH2 ARG A 135 27.097 0.346 3.408 1.00 0.00 N ATOM 0 H ARG A 135 22.835 -0.950 -0.849 1.00 0.00 H new ATOM 0 HA ARG A 135 21.863 1.433 0.108 1.00 0.00 H new ATOM 0 HB2 ARG A 135 23.944 0.592 0.845 1.00 0.00 H new ATOM 0 HB3 ARG A 135 24.538 0.355 -0.787 1.00 0.00 H new ATOM 0 HG2 ARG A 135 25.562 2.345 -0.740 1.00 0.00 H new ATOM 0 HG3 ARG A 135 24.041 3.160 -0.438 1.00 0.00 H new ATOM 0 HD2 ARG A 135 25.886 3.451 1.332 1.00 0.00 H new ATOM 0 HD3 ARG A 135 24.287 3.033 1.916 1.00 0.00 H new ATOM 0 HE ARG A 135 25.298 0.563 1.725 1.00 0.00 H new ATOM 0 HH11 ARG A 135 26.843 3.521 2.898 1.00 0.00 H new ATOM 0 HH12 ARG A 135 27.923 2.651 3.993 1.00 0.00 H new ATOM 0 HH21 ARG A 135 26.696 -0.540 3.100 1.00 0.00 H new ATOM 0 HH22 ARG A 135 27.840 0.354 4.107 1.00 0.00 H new ATOM 2229 N ARG A 136 22.993 1.834 -2.920 1.00 0.00 N ATOM 2230 CA ARG A 136 23.059 2.698 -4.088 1.00 0.00 C ATOM 2231 C ARG A 136 21.667 3.123 -4.556 1.00 0.00 C ATOM 2232 O ARG A 136 21.425 4.298 -4.849 1.00 0.00 O ATOM 2233 CB ARG A 136 23.802 1.906 -5.162 1.00 0.00 C ATOM 2234 CG ARG A 136 23.927 2.539 -6.519 1.00 0.00 C ATOM 2235 CD ARG A 136 24.355 1.477 -7.512 1.00 0.00 C ATOM 2236 NE ARG A 136 23.248 0.623 -7.938 1.00 0.00 N ATOM 2237 CZ ARG A 136 23.345 -0.702 -8.043 1.00 0.00 C ATOM 2238 NH1 ARG A 136 24.503 -1.300 -7.787 1.00 0.00 N ATOM 2239 NH2 ARG A 136 22.299 -1.426 -8.427 1.00 0.00 N ATOM 0 H ARG A 136 23.453 0.935 -3.062 1.00 0.00 H new ATOM 0 HA ARG A 136 23.581 3.627 -3.859 1.00 0.00 H new ATOM 0 HB2 ARG A 136 24.806 1.696 -4.793 1.00 0.00 H new ATOM 0 HB3 ARG A 136 23.300 0.946 -5.282 1.00 0.00 H new ATOM 0 HG2 ARG A 136 22.976 2.977 -6.821 1.00 0.00 H new ATOM 0 HG3 ARG A 136 24.657 3.348 -6.493 1.00 0.00 H new ATOM 0 HD2 ARG A 136 24.794 1.959 -8.386 1.00 0.00 H new ATOM 0 HD3 ARG A 136 25.133 0.859 -7.064 1.00 0.00 H new ATOM 0 HE ARG A 136 22.357 1.063 -8.166 1.00 0.00 H new ATOM 0 HH11 ARG A 136 25.313 -0.745 -7.511 1.00 0.00 H new ATOM 0 HH12 ARG A 136 24.582 -2.314 -7.866 1.00 0.00 H new ATOM 0 HH21 ARG A 136 21.414 -0.968 -8.644 1.00 0.00 H new ATOM 0 HH22 ARG A 136 22.381 -2.440 -8.505 1.00 0.00 H new ATOM 2253 N LYS A 137 20.746 2.173 -4.602 1.00 0.00 N ATOM 2254 CA LYS A 137 19.378 2.466 -5.001 1.00 0.00 C ATOM 2255 C LYS A 137 18.635 3.220 -3.900 1.00 0.00 C ATOM 2256 O LYS A 137 17.908 4.176 -4.176 1.00 0.00 O ATOM 2257 CB LYS A 137 18.635 1.178 -5.363 1.00 0.00 C ATOM 2258 CG LYS A 137 19.065 0.580 -6.702 1.00 0.00 C ATOM 2259 CD LYS A 137 18.327 -0.713 -7.011 1.00 0.00 C ATOM 2260 CE LYS A 137 19.109 -1.916 -6.512 1.00 0.00 C ATOM 2261 NZ LYS A 137 18.337 -3.177 -6.596 1.00 0.00 N ATOM 0 H LYS A 137 20.920 1.195 -4.369 1.00 0.00 H new ATOM 0 HA LYS A 137 19.415 3.105 -5.883 1.00 0.00 H new ATOM 0 HB2 LYS A 137 18.798 0.441 -4.576 1.00 0.00 H new ATOM 0 HB3 LYS A 137 17.565 1.382 -5.392 1.00 0.00 H new ATOM 0 HG2 LYS A 137 18.880 1.302 -7.498 1.00 0.00 H new ATOM 0 HG3 LYS A 137 20.138 0.390 -6.686 1.00 0.00 H new ATOM 0 HD2 LYS A 137 17.342 -0.695 -6.544 1.00 0.00 H new ATOM 0 HD3 LYS A 137 18.168 -0.798 -8.086 1.00 0.00 H new ATOM 0 HE2 LYS A 137 20.024 -2.016 -7.095 1.00 0.00 H new ATOM 0 HE3 LYS A 137 19.407 -1.746 -5.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 18.987 -3.972 -6.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 17.824 -3.330 -5.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 17.657 -3.116 -7.380 1.00 0.00 H new ATOM 2275 N LEU A 138 18.829 2.786 -2.658 1.00 0.00 N ATOM 2276 CA LEU A 138 18.230 3.450 -1.497 1.00 0.00 C ATOM 2277 C LEU A 138 18.613 4.934 -1.441 1.00 0.00 C ATOM 2278 O LEU A 138 17.826 5.775 -0.998 1.00 0.00 O ATOM 2279 CB LEU A 138 18.664 2.767 -0.197 1.00 0.00 C ATOM 2280 CG LEU A 138 18.378 1.266 -0.089 1.00 0.00 C ATOM 2281 CD1 LEU A 138 18.610 0.783 1.334 1.00 0.00 C ATOM 2282 CD2 LEU A 138 16.965 0.950 -0.531 1.00 0.00 C ATOM 0 H LEU A 138 19.399 1.973 -2.426 1.00 0.00 H new ATOM 0 HA LEU A 138 17.148 3.371 -1.604 1.00 0.00 H new ATOM 0 HB2 LEU A 138 19.736 2.921 -0.071 1.00 0.00 H new ATOM 0 HB3 LEU A 138 18.170 3.270 0.635 1.00 0.00 H new ATOM 0 HG LEU A 138 19.065 0.741 -0.752 1.00 0.00 H new ATOM 0 HD11 LEU A 138 18.402 -0.285 1.394 1.00 0.00 H new ATOM 0 HD12 LEU A 138 19.646 0.968 1.617 1.00 0.00 H new ATOM 0 HD13 LEU A 138 17.948 1.320 2.013 1.00 0.00 H new ATOM 0 HD21 LEU A 138 16.788 -0.122 -0.445 1.00 0.00 H new ATOM 0 HD22 LEU A 138 16.257 1.487 0.101 1.00 0.00 H new ATOM 0 HD23 LEU A 138 16.831 1.257 -1.568 1.00 0.00 H new ATOM 2294 N LEU A 139 19.828 5.242 -1.885 1.00 0.00 N ATOM 2295 CA LEU A 139 20.339 6.612 -1.874 1.00 0.00 C ATOM 2296 C LEU A 139 19.751 7.439 -3.012 1.00 0.00 C ATOM 2297 O LEU A 139 19.510 8.637 -2.861 1.00 0.00 O ATOM 2298 CB LEU A 139 21.864 6.594 -1.983 1.00 0.00 C ATOM 2299 CG LEU A 139 22.564 5.757 -0.919 1.00 0.00 C ATOM 2300 CD1 LEU A 139 24.034 5.587 -1.246 1.00 0.00 C ATOM 2301 CD2 LEU A 139 22.380 6.391 0.445 1.00 0.00 C ATOM 0 H LEU A 139 20.483 4.556 -2.260 1.00 0.00 H new ATOM 0 HA LEU A 139 20.040 7.075 -0.934 1.00 0.00 H new ATOM 0 HB2 LEU A 139 22.141 6.214 -2.966 1.00 0.00 H new ATOM 0 HB3 LEU A 139 22.232 7.618 -1.922 1.00 0.00 H new ATOM 0 HG LEU A 139 22.113 4.765 -0.903 1.00 0.00 H new ATOM 0 HD11 LEU A 139 24.512 4.986 -0.472 1.00 0.00 H new ATOM 0 HD12 LEU A 139 24.137 5.087 -2.209 1.00 0.00 H new ATOM 0 HD13 LEU A 139 24.512 6.566 -1.292 1.00 0.00 H new ATOM 0 HD21 LEU A 139 22.884 5.786 1.199 1.00 0.00 H new ATOM 0 HD22 LEU A 139 22.807 7.394 0.441 1.00 0.00 H new ATOM 0 HD23 LEU A 139 21.317 6.450 0.678 1.00 0.00 H new ATOM 2313 N LYS A 140 19.531 6.800 -4.152 1.00 0.00 N ATOM 2314 CA LYS A 140 18.960 7.474 -5.313 1.00 0.00 C ATOM 2315 C LYS A 140 17.497 7.834 -5.087 1.00 0.00 C ATOM 2316 O LYS A 140 16.962 8.727 -5.741 1.00 0.00 O ATOM 2317 CB LYS A 140 19.071 6.596 -6.550 1.00 0.00 C ATOM 2318 CG LYS A 140 19.935 7.190 -7.643 1.00 0.00 C ATOM 2319 CD LYS A 140 20.254 6.161 -8.710 1.00 0.00 C ATOM 2320 CE LYS A 140 21.335 5.206 -8.256 1.00 0.00 C ATOM 2321 NZ LYS A 140 22.662 5.870 -8.149 1.00 0.00 N ATOM 0 H LYS A 140 19.739 5.812 -4.300 1.00 0.00 H new ATOM 0 HA LYS A 140 19.527 8.393 -5.463 1.00 0.00 H new ATOM 0 HB2 LYS A 140 19.480 5.628 -6.262 1.00 0.00 H new ATOM 0 HB3 LYS A 140 18.072 6.415 -6.947 1.00 0.00 H new ATOM 0 HG2 LYS A 140 19.422 8.039 -8.095 1.00 0.00 H new ATOM 0 HG3 LYS A 140 20.861 7.570 -7.212 1.00 0.00 H new ATOM 0 HD2 LYS A 140 19.352 5.600 -8.957 1.00 0.00 H new ATOM 0 HD3 LYS A 140 20.574 6.667 -9.621 1.00 0.00 H new ATOM 0 HE2 LYS A 140 21.062 4.785 -7.288 1.00 0.00 H new ATOM 0 HE3 LYS A 140 21.402 4.375 -8.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 23.411 5.149 -8.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 22.801 6.501 -8.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 22.703 6.425 -7.270 1.00 0.00 H new ATOM 2335 N ALA A 141 16.867 7.103 -4.181 1.00 0.00 N ATOM 2336 CA ALA A 141 15.461 7.294 -3.840 1.00 0.00 C ATOM 2337 C ALA A 141 15.122 8.748 -3.527 1.00 0.00 C ATOM 2338 O ALA A 141 15.554 9.244 -2.463 1.00 0.00 O ATOM 2339 CB ALA A 141 15.103 6.418 -2.662 1.00 0.00 C ATOM 2340 OXT ALA A 141 14.405 9.381 -4.334 1.00 0.00 O ATOM 0 H ALA A 141 17.318 6.354 -3.656 1.00 0.00 H new ATOM 0 HA ALA A 141 14.874 7.012 -4.714 1.00 0.00 H new ATOM 0 HB1 ALA A 141 14.053 6.561 -2.408 1.00 0.00 H new ATOM 0 HB2 ALA A 141 15.275 5.373 -2.920 1.00 0.00 H new ATOM 0 HB3 ALA A 141 15.723 6.687 -1.807 1.00 0.00 H new TER 2346 ALA A 141 ATOM 2347 N GLY B 212 -18.216 13.779 12.020 1.00 0.00 N ATOM 2348 CA GLY B 212 -17.399 12.653 11.511 1.00 0.00 C ATOM 2349 C GLY B 212 -17.902 11.314 12.009 1.00 0.00 C ATOM 2350 O GLY B 212 -18.403 11.211 13.130 1.00 0.00 O ATOM 0 HA2 GLY B 212 -17.410 12.661 10.421 1.00 0.00 H new ATOM 0 HA3 GLY B 212 -16.363 12.789 11.821 1.00 0.00 H new ATOM 2356 N GLY B 213 -17.773 10.290 11.179 1.00 0.00 N ATOM 2357 CA GLY B 213 -18.219 8.967 11.558 1.00 0.00 C ATOM 2358 C GLY B 213 -17.706 7.905 10.611 1.00 0.00 C ATOM 2359 O GLY B 213 -17.516 8.170 9.421 1.00 0.00 O ATOM 0 H GLY B 213 -17.366 10.353 10.246 1.00 0.00 H new ATOM 0 HA2 GLY B 213 -17.879 8.746 12.570 1.00 0.00 H new ATOM 0 HA3 GLY B 213 -19.309 8.942 11.575 1.00 0.00 H new ATOM 2363 N LYS B 214 -17.475 6.711 11.130 1.00 0.00 N ATOM 2364 CA LYS B 214 -16.980 5.614 10.317 1.00 0.00 C ATOM 2365 C LYS B 214 -18.135 4.724 9.876 1.00 0.00 C ATOM 2366 O LYS B 214 -19.022 4.394 10.667 1.00 0.00 O ATOM 2367 CB LYS B 214 -15.933 4.796 11.084 1.00 0.00 C ATOM 2368 CG LYS B 214 -16.463 4.115 12.336 1.00 0.00 C ATOM 2369 CD LYS B 214 -15.391 3.272 13.006 1.00 0.00 C ATOM 2370 CE LYS B 214 -15.958 2.467 14.163 1.00 0.00 C ATOM 2371 NZ LYS B 214 -14.925 1.607 14.799 1.00 0.00 N ATOM 0 H LYS B 214 -17.623 6.477 12.112 1.00 0.00 H new ATOM 0 HA LYS B 214 -16.501 6.031 9.431 1.00 0.00 H new ATOM 0 HB2 LYS B 214 -15.523 4.037 10.418 1.00 0.00 H new ATOM 0 HB3 LYS B 214 -15.109 5.453 11.363 1.00 0.00 H new ATOM 0 HG2 LYS B 214 -16.826 4.868 13.036 1.00 0.00 H new ATOM 0 HG3 LYS B 214 -17.314 3.485 12.077 1.00 0.00 H new ATOM 0 HD2 LYS B 214 -14.948 2.597 12.274 1.00 0.00 H new ATOM 0 HD3 LYS B 214 -14.592 3.919 13.368 1.00 0.00 H new ATOM 0 HE2 LYS B 214 -16.374 3.145 14.908 1.00 0.00 H new ATOM 0 HE3 LYS B 214 -16.778 1.845 13.805 1.00 0.00 H new ATOM 0 HZ1 LYS B 214 -15.352 1.074 15.584 1.00 0.00 H new ATOM 0 HZ2 LYS B 214 -14.545 0.942 14.095 1.00 0.00 H new ATOM 0 HZ3 LYS B 214 -14.154 2.202 15.164 1.00 0.00 H new ATOM 2385 N ALA B 215 -18.128 4.354 8.605 1.00 0.00 N ATOM 2386 CA ALA B 215 -19.176 3.520 8.041 1.00 0.00 C ATOM 2387 C ALA B 215 -18.948 2.060 8.426 1.00 0.00 C ATOM 2388 O ALA B 215 -17.891 1.729 8.965 1.00 0.00 O ATOM 2389 CB ALA B 215 -19.219 3.704 6.528 1.00 0.00 C ATOM 0 H ALA B 215 -17.402 4.621 7.940 1.00 0.00 H new ATOM 0 HA ALA B 215 -20.143 3.820 8.445 1.00 0.00 H new ATOM 0 HB1 ALA B 215 -20.006 3.078 6.108 1.00 0.00 H new ATOM 0 HB2 ALA B 215 -19.423 4.749 6.294 1.00 0.00 H new ATOM 0 HB3 ALA B 215 -18.259 3.417 6.099 1.00 0.00 H new ATOM 2395 N PRO B 216 -19.936 1.174 8.177 1.00 0.00 N ATOM 2396 CA PRO B 216 -19.865 -0.241 8.570 1.00 0.00 C ATOM 2397 C PRO B 216 -18.561 -0.925 8.147 1.00 0.00 C ATOM 2398 O PRO B 216 -17.885 -0.502 7.205 1.00 0.00 O ATOM 2399 CB PRO B 216 -21.072 -0.883 7.867 1.00 0.00 C ATOM 2400 CG PRO B 216 -21.578 0.146 6.911 1.00 0.00 C ATOM 2401 CD PRO B 216 -21.201 1.472 7.491 1.00 0.00 C ATOM 0 HA PRO B 216 -19.884 -0.348 9.655 1.00 0.00 H new ATOM 0 HB2 PRO B 216 -20.781 -1.794 7.344 1.00 0.00 H new ATOM 0 HB3 PRO B 216 -21.842 -1.161 8.587 1.00 0.00 H new ATOM 0 HG2 PRO B 216 -21.135 0.012 5.924 1.00 0.00 H new ATOM 0 HG3 PRO B 216 -22.658 0.067 6.789 1.00 0.00 H new ATOM 0 HD2 PRO B 216 -21.074 2.231 6.719 1.00 0.00 H new ATOM 0 HD3 PRO B 216 -21.959 1.843 8.181 1.00 0.00 H new ATOM 2409 N ARG B 217 -18.211 -1.981 8.863 1.00 0.00 N ATOM 2410 CA ARG B 217 -16.959 -2.679 8.639 1.00 0.00 C ATOM 2411 C ARG B 217 -17.158 -4.183 8.785 1.00 0.00 C ATOM 2412 O ARG B 217 -17.978 -4.633 9.582 1.00 0.00 O ATOM 2413 CB ARG B 217 -15.904 -2.161 9.627 1.00 0.00 C ATOM 2414 CG ARG B 217 -14.585 -2.911 9.592 1.00 0.00 C ATOM 2415 CD ARG B 217 -13.525 -2.223 10.436 1.00 0.00 C ATOM 2416 NE ARG B 217 -13.147 -0.924 9.885 1.00 0.00 N ATOM 2417 CZ ARG B 217 -11.894 -0.477 9.826 1.00 0.00 C ATOM 2418 NH1 ARG B 217 -10.894 -1.219 10.285 1.00 0.00 N ATOM 2419 NH2 ARG B 217 -11.642 0.715 9.306 1.00 0.00 N ATOM 0 H ARG B 217 -18.783 -2.375 9.610 1.00 0.00 H new ATOM 0 HA ARG B 217 -16.611 -2.488 7.624 1.00 0.00 H new ATOM 0 HB2 ARG B 217 -15.714 -1.108 9.417 1.00 0.00 H new ATOM 0 HB3 ARG B 217 -16.312 -2.216 10.636 1.00 0.00 H new ATOM 0 HG2 ARG B 217 -14.735 -3.928 9.954 1.00 0.00 H new ATOM 0 HG3 ARG B 217 -14.237 -2.987 8.562 1.00 0.00 H new ATOM 0 HD2 ARG B 217 -13.899 -2.092 11.451 1.00 0.00 H new ATOM 0 HD3 ARG B 217 -12.643 -2.860 10.501 1.00 0.00 H new ATOM 0 HE ARG B 217 -13.888 -0.323 9.524 1.00 0.00 H new ATOM 0 HH11 ARG B 217 -11.083 -2.138 10.686 1.00 0.00 H new ATOM 0 HH12 ARG B 217 -9.937 -0.871 10.237 1.00 0.00 H new ATOM 0 HH21 ARG B 217 -12.407 1.289 8.952 1.00 0.00 H new ATOM 0 HH22 ARG B 217 -10.683 1.059 9.260 1.00 0.00 H new HETATM 2433 N KCR B 218 -16.410 -4.958 8.008 1.00 0.00 N HETATM 2434 CA KCR B 218 -16.574 -6.407 7.991 1.00 0.00 C HETATM 2435 CB KCR B 218 -16.264 -6.957 6.601 1.00 0.00 C HETATM 2436 CG KCR B 218 -17.196 -6.410 5.536 1.00 0.00 C HETATM 2437 CD KCR B 218 -16.837 -6.915 4.156 1.00 0.00 C HETATM 2438 CE KCR B 218 -17.693 -6.255 3.094 1.00 0.00 C HETATM 2439 NZ KCR B 218 -17.392 -6.766 1.767 1.00 0.00 N HETATM 2440 CH KCR B 218 -17.351 -6.005 0.686 1.00 0.00 C HETATM 2441 OH KCR B 218 -17.571 -4.792 0.731 1.00 0.00 O HETATM 2442 CX KCR B 218 -17.022 -6.643 -0.629 1.00 0.00 C HETATM 2443 CY KCR B 218 -16.966 -5.882 -1.776 1.00 0.00 C HETATM 2444 CH3 KCR B 218 -16.628 -6.532 -3.082 1.00 0.00 C HETATM 2445 C KCR B 218 -15.700 -7.078 9.041 1.00 0.00 C HETATM 2446 O KCR B 218 -15.591 -8.304 9.083 1.00 0.00 O ATOM 2463 N GLN B 219 -15.079 -6.269 9.884 1.00 0.00 N ATOM 2464 CA GLN B 219 -14.346 -6.780 11.028 1.00 0.00 C ATOM 2465 C GLN B 219 -15.317 -7.025 12.168 1.00 0.00 C ATOM 2466 O GLN B 219 -15.852 -6.078 12.749 1.00 0.00 O ATOM 2467 CB GLN B 219 -13.253 -5.802 11.459 1.00 0.00 C ATOM 2468 CG GLN B 219 -12.168 -5.607 10.415 1.00 0.00 C ATOM 2469 CD GLN B 219 -11.487 -6.906 10.043 1.00 0.00 C ATOM 2470 OE1 GLN B 219 -11.913 -7.600 9.119 1.00 0.00 O ATOM 2471 NE2 GLN B 219 -10.429 -7.247 10.759 1.00 0.00 N ATOM 0 H GLN B 219 -15.069 -5.253 9.796 1.00 0.00 H new ATOM 0 HA GLN B 219 -13.861 -7.716 10.752 1.00 0.00 H new ATOM 0 HB2 GLN B 219 -13.708 -4.837 11.683 1.00 0.00 H new ATOM 0 HB3 GLN B 219 -12.798 -6.162 12.382 1.00 0.00 H new ATOM 0 HG2 GLN B 219 -12.603 -5.159 9.522 1.00 0.00 H new ATOM 0 HG3 GLN B 219 -11.425 -4.905 10.794 1.00 0.00 H new ATOM 0 HE21 GLN B 219 -10.109 -6.643 11.516 1.00 0.00 H new ATOM 0 HE22 GLN B 219 -9.933 -8.114 10.554 1.00 0.00 H new ATOM 2480 N LEU B 220 -15.560 -8.302 12.454 1.00 0.00 N ATOM 2481 CA LEU B 220 -16.557 -8.706 13.440 1.00 0.00 C ATOM 2482 C LEU B 220 -17.937 -8.198 13.037 1.00 0.00 C ATOM 2483 O LEU B 220 -18.703 -7.708 13.869 1.00 0.00 O ATOM 2484 CB LEU B 220 -16.189 -8.207 14.843 1.00 0.00 C ATOM 2485 CG LEU B 220 -14.909 -8.800 15.435 1.00 0.00 C ATOM 2486 CD1 LEU B 220 -14.663 -8.240 16.825 1.00 0.00 C ATOM 2487 CD2 LEU B 220 -14.993 -10.318 15.481 1.00 0.00 C ATOM 0 H LEU B 220 -15.074 -9.082 12.011 1.00 0.00 H new ATOM 0 HA LEU B 220 -16.578 -9.795 13.469 1.00 0.00 H new ATOM 0 HB2 LEU B 220 -16.085 -7.123 14.809 1.00 0.00 H new ATOM 0 HB3 LEU B 220 -17.017 -8.427 15.517 1.00 0.00 H new ATOM 0 HG LEU B 220 -14.072 -8.523 14.794 1.00 0.00 H new ATOM 0 HD11 LEU B 220 -13.749 -8.671 17.234 1.00 0.00 H new ATOM 0 HD12 LEU B 220 -14.560 -7.156 16.768 1.00 0.00 H new ATOM 0 HD13 LEU B 220 -15.504 -8.491 17.472 1.00 0.00 H new ATOM 0 HD21 LEU B 220 -14.073 -10.721 15.905 1.00 0.00 H new ATOM 0 HD22 LEU B 220 -15.839 -10.617 16.100 1.00 0.00 H new ATOM 0 HD23 LEU B 220 -15.127 -10.706 14.471 1.00 0.00 H new ATOM 2499 N ALA B 221 -18.236 -8.305 11.748 1.00 0.00 N ATOM 2500 CA ALA B 221 -19.537 -7.914 11.229 1.00 0.00 C ATOM 2501 C ALA B 221 -20.567 -8.966 11.599 1.00 0.00 C ATOM 2502 O ALA B 221 -21.689 -8.646 11.993 1.00 0.00 O ATOM 2503 CB ALA B 221 -19.479 -7.731 9.721 1.00 0.00 C ATOM 0 H ALA B 221 -17.591 -8.661 11.042 1.00 0.00 H new ATOM 0 HA ALA B 221 -19.825 -6.961 11.672 1.00 0.00 H new ATOM 0 HB1 ALA B 221 -20.462 -7.439 9.352 1.00 0.00 H new ATOM 0 HB2 ALA B 221 -18.754 -6.955 9.476 1.00 0.00 H new ATOM 0 HB3 ALA B 221 -19.179 -8.668 9.252 1.00 0.00 H new ATOM 2509 N THR B 222 -20.168 -10.222 11.480 1.00 0.00 N ATOM 2510 CA THR B 222 -21.004 -11.331 11.896 1.00 0.00 C ATOM 2511 C THR B 222 -20.769 -11.618 13.377 1.00 0.00 C ATOM 2512 O THR B 222 -20.163 -12.627 13.752 1.00 0.00 O ATOM 2513 CB THR B 222 -20.712 -12.590 11.056 1.00 0.00 C ATOM 2514 OG1 THR B 222 -20.720 -12.250 9.661 1.00 0.00 O ATOM 2515 CG2 THR B 222 -21.747 -13.674 11.317 1.00 0.00 C ATOM 0 H THR B 222 -19.264 -10.498 11.096 1.00 0.00 H new ATOM 0 HA THR B 222 -22.048 -11.059 11.739 1.00 0.00 H new ATOM 0 HB THR B 222 -19.732 -12.972 11.342 1.00 0.00 H new ATOM 0 HG1 THR B 222 -20.533 -13.051 9.128 1.00 0.00 H new ATOM 0 HG21 THR B 222 -21.517 -14.550 10.711 1.00 0.00 H new ATOM 0 HG22 THR B 222 -21.730 -13.947 12.372 1.00 0.00 H new ATOM 0 HG23 THR B 222 -22.737 -13.302 11.055 1.00 0.00 H new ATOM 2523 N LYS B 223 -21.234 -10.700 14.208 1.00 0.00 N ATOM 2524 CA LYS B 223 -21.038 -10.783 15.642 1.00 0.00 C ATOM 2525 C LYS B 223 -22.268 -10.250 16.362 1.00 0.00 C ATOM 2526 O LYS B 223 -22.952 -9.359 15.856 1.00 0.00 O ATOM 2527 CB LYS B 223 -19.805 -9.967 16.050 1.00 0.00 C ATOM 2528 CG LYS B 223 -19.487 -10.024 17.536 1.00 0.00 C ATOM 2529 CD LYS B 223 -18.376 -9.056 17.913 1.00 0.00 C ATOM 2530 CE LYS B 223 -18.811 -7.607 17.743 1.00 0.00 C ATOM 2531 NZ LYS B 223 -19.903 -7.230 18.683 1.00 0.00 N ATOM 0 H LYS B 223 -21.757 -9.878 13.906 1.00 0.00 H new ATOM 0 HA LYS B 223 -20.883 -11.826 15.919 1.00 0.00 H new ATOM 0 HB2 LYS B 223 -18.942 -10.328 15.491 1.00 0.00 H new ATOM 0 HB3 LYS B 223 -19.959 -8.927 15.762 1.00 0.00 H new ATOM 0 HG2 LYS B 223 -20.384 -9.789 18.109 1.00 0.00 H new ATOM 0 HG3 LYS B 223 -19.193 -11.038 17.806 1.00 0.00 H new ATOM 0 HD2 LYS B 223 -18.079 -9.228 18.948 1.00 0.00 H new ATOM 0 HD3 LYS B 223 -17.500 -9.248 17.294 1.00 0.00 H new ATOM 0 HE2 LYS B 223 -17.955 -6.952 17.903 1.00 0.00 H new ATOM 0 HE3 LYS B 223 -19.146 -7.449 16.718 1.00 0.00 H new ATOM 0 HZ1 LYS B 223 -20.049 -6.201 18.650 1.00 0.00 H new ATOM 0 HZ2 LYS B 223 -20.781 -7.713 18.407 1.00 0.00 H new ATOM 0 HZ3 LYS B 223 -19.642 -7.512 19.649 1.00 0.00 H new ATOM 2545 N ALA B 224 -22.553 -10.798 17.527 1.00 0.00 N ATOM 2546 CA ALA B 224 -23.636 -10.300 18.352 1.00 0.00 C ATOM 2547 C ALA B 224 -23.080 -9.373 19.427 1.00 0.00 C ATOM 2548 O ALA B 224 -23.176 -9.712 20.625 1.00 0.00 O ATOM 2549 CB ALA B 224 -24.404 -11.457 18.973 1.00 0.00 C ATOM 2550 OXT ALA B 224 -22.502 -8.326 19.066 1.00 0.00 O ATOM 0 H ALA B 224 -22.048 -11.590 17.924 1.00 0.00 H new ATOM 0 HA ALA B 224 -24.329 -9.733 17.730 1.00 0.00 H new ATOM 0 HB1 ALA B 224 -25.214 -11.067 19.590 1.00 0.00 H new ATOM 0 HB2 ALA B 224 -24.819 -12.084 18.184 1.00 0.00 H new ATOM 0 HB3 ALA B 224 -23.731 -12.050 19.592 1.00 0.00 H new TER 2556 ALA B 224