USER MOD reduce.3.24.130724 H: found=0, std=0, add=1402, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1400 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 GLN : amide:sc= -2.7! C(o=-2.7!,f=-4!) USER MOD Single : A 6 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.132) USER MOD Single : A 7 HIS : no HD1:sc= -0.108 X(o=-0.11,f=0) USER MOD Single : A 15 MET CE :methyl -172:sc= -4.35! (180deg=-4.56!) USER MOD Single : A 18 LYS NZ :NH3+ 159:sc= -0.0103 (180deg=-0.233) USER MOD Single : A 22 SER OG : rot -101:sc= 1.14 USER MOD Single : A 32 LYS NZ :NH3+ -144:sc= 1.22 (180deg=0.0866) USER MOD Single : A 33 LYS NZ :NH3+ 142:sc= 0.0336 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ -157:sc= 0.00526 (180deg=0) USER MOD Single : A 43 TYR OH : rot 165:sc= 0 USER MOD Single : A 48 GLN :FLIP amide:sc= -0.16 F(o=-0.7,f=-0.16) USER MOD Single : A 53 LYS NZ :NH3+ -145:sc= 0.235 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ -167:sc= -0.236 (180deg=-0.591) USER MOD Single : A 64 LYS NZ :NH3+ -160:sc= -0.0394 (180deg=-0.513) USER MOD Single : A 66 THR OG1 : rot 73:sc= 0.867 USER MOD Single : A 67 CYS SG : rot -44:sc= 0.88 USER MOD Single : A 70 ASN : amide:sc= -0.0101 X(o=-0.01,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= -1.32! X(o=-1.3!,f=-1.8) USER MOD Single : A 74 SER OG : rot 130:sc= -0.546 USER MOD Single : A 77 CYS SG : rot -20:sc= 0.136 USER MOD Single : A 80 CYS SG : rot -130:sc= -1.69! USER MOD Single : A 85 CYS SG : rot 82:sc= 0.124 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 THR OG1 : rot 180:sc= 0 USER MOD Single : B 3 THR OG1 : rot 180:sc= 0 USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 GLN : amide:sc= -2.68! C(o=-2.7!,f=-4.2!) USER MOD Single : B 6 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.126) USER MOD Single : B 7 HIS : no HD1:sc= -0.0964 X(o=-0.096,f=0) USER MOD Single : B 15 MET CE :methyl -163:sc= -4.34! (180deg=-4.49!) USER MOD Single : B 18 LYS NZ :NH3+ 160:sc= -0.0109 (180deg=-0.22) USER MOD Single : B 22 SER OG : rot -111:sc= 1.13 USER MOD Single : B 32 LYS NZ :NH3+ -144:sc= 1.19 (180deg=0.0316) USER MOD Single : B 33 LYS NZ :NH3+ 144:sc= 0.033 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ -156:sc= 0.00542 (180deg=0) USER MOD Single : B 43 TYR OH : rot 165:sc= 0 USER MOD Single : B 48 GLN :FLIP amide:sc= -0.267 F(o=-0.79,f=-0.27) USER MOD Single : B 53 LYS NZ :NH3+ -155:sc= 0.176 (180deg=0) USER MOD Single : B 54 LYS NZ :NH3+ -163:sc= -0.221 (180deg=-0.519) USER MOD Single : B 64 LYS NZ :NH3+ -160:sc= -0.0708 (180deg=-0.49) USER MOD Single : B 66 THR OG1 : rot 74:sc= 0.811 USER MOD Single : B 67 CYS SG : rot -58:sc= 0.735 USER MOD Single : B 70 ASN : amide:sc=-0.00182 X(o=-0.0018,f=0) USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 GLN : amide:sc= -1.25! X(o=-1.3!,f=-1.7) USER MOD Single : B 74 SER OG : rot 140:sc= -0.542 USER MOD Single : B 77 CYS SG : rot -20:sc= 0.173 USER MOD Single : B 80 CYS SG : rot -139:sc= -1.66! USER MOD Single : B 85 CYS SG : rot 80:sc= 0.124 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 114.453 -7.408 11.187 1.00 0.00 N ATOM 2 CA MET A 1 115.047 -7.945 12.445 1.00 0.00 C ATOM 3 C MET A 1 116.261 -8.810 12.104 1.00 0.00 C ATOM 4 O MET A 1 117.390 -8.429 12.336 1.00 0.00 O ATOM 5 CB MET A 1 114.006 -8.793 13.179 1.00 0.00 C ATOM 6 CG MET A 1 114.564 -9.220 14.539 1.00 0.00 C ATOM 7 SD MET A 1 113.331 -10.222 15.408 1.00 0.00 S ATOM 8 CE MET A 1 114.385 -10.732 16.787 1.00 0.00 C ATOM 0 H1 MET A 1 113.627 -6.819 11.417 1.00 0.00 H new ATOM 0 H2 MET A 1 115.160 -6.832 10.687 1.00 0.00 H new ATOM 0 H3 MET A 1 114.157 -8.198 10.578 1.00 0.00 H new ATOM 0 HA MET A 1 115.357 -7.118 13.084 1.00 0.00 H new ATOM 0 HB2 MET A 1 113.086 -8.223 13.314 1.00 0.00 H new ATOM 0 HB3 MET A 1 113.753 -9.672 12.586 1.00 0.00 H new ATOM 0 HG2 MET A 1 115.483 -9.791 14.404 1.00 0.00 H new ATOM 0 HG3 MET A 1 114.818 -8.342 15.132 1.00 0.00 H new ATOM 0 HE1 MET A 1 113.816 -11.371 17.463 1.00 0.00 H new ATOM 0 HE2 MET A 1 115.244 -11.282 16.404 1.00 0.00 H new ATOM 0 HE3 MET A 1 114.730 -9.850 17.327 1.00 0.00 H new ATOM 20 N THR A 2 116.037 -9.972 11.554 1.00 0.00 N ATOM 21 CA THR A 2 117.178 -10.861 11.197 1.00 0.00 C ATOM 22 C THR A 2 117.780 -10.403 9.867 1.00 0.00 C ATOM 23 O THR A 2 117.073 -10.117 8.922 1.00 0.00 O ATOM 24 CB THR A 2 116.684 -12.302 11.067 1.00 0.00 C ATOM 25 OG1 THR A 2 116.013 -12.679 12.262 1.00 0.00 O ATOM 26 CG2 THR A 2 117.876 -13.232 10.834 1.00 0.00 C ATOM 0 H THR A 2 115.113 -10.344 11.336 1.00 0.00 H new ATOM 0 HA THR A 2 117.937 -10.810 11.977 1.00 0.00 H new ATOM 0 HB THR A 2 115.997 -12.378 10.224 1.00 0.00 H new ATOM 0 HG1 THR A 2 115.694 -13.602 12.181 1.00 0.00 H new ATOM 0 HG21 THR A 2 117.523 -14.259 10.741 1.00 0.00 H new ATOM 0 HG22 THR A 2 118.391 -12.941 9.918 1.00 0.00 H new ATOM 0 HG23 THR A 2 118.564 -13.159 11.676 1.00 0.00 H new ATOM 34 N THR A 3 119.080 -10.329 9.790 1.00 0.00 N ATOM 35 CA THR A 3 119.729 -9.886 8.525 1.00 0.00 C ATOM 36 C THR A 3 119.683 -11.015 7.494 1.00 0.00 C ATOM 37 O THR A 3 119.513 -12.171 7.827 1.00 0.00 O ATOM 38 CB THR A 3 121.185 -9.509 8.803 1.00 0.00 C ATOM 39 OG1 THR A 3 121.844 -10.599 9.433 1.00 0.00 O ATOM 40 CG2 THR A 3 121.230 -8.283 9.714 1.00 0.00 C ATOM 0 H THR A 3 119.721 -10.557 10.550 1.00 0.00 H new ATOM 0 HA THR A 3 119.196 -9.020 8.133 1.00 0.00 H new ATOM 0 HB THR A 3 121.687 -9.278 7.864 1.00 0.00 H new ATOM 0 HG1 THR A 3 122.778 -10.359 9.610 1.00 0.00 H new ATOM 0 HG21 THR A 3 122.268 -8.015 9.912 1.00 0.00 H new ATOM 0 HG22 THR A 3 120.726 -7.449 9.226 1.00 0.00 H new ATOM 0 HG23 THR A 3 120.728 -8.510 10.655 1.00 0.00 H new ATOM 48 N SER A 4 119.836 -10.684 6.241 1.00 0.00 N ATOM 49 CA SER A 4 119.807 -11.728 5.179 1.00 0.00 C ATOM 50 C SER A 4 121.066 -12.590 5.283 1.00 0.00 C ATOM 51 O SER A 4 122.051 -12.209 5.883 1.00 0.00 O ATOM 52 CB SER A 4 119.762 -11.056 3.807 1.00 0.00 C ATOM 53 OG SER A 4 121.012 -10.427 3.555 1.00 0.00 O ATOM 0 H SER A 4 119.980 -9.731 5.906 1.00 0.00 H new ATOM 0 HA SER A 4 118.924 -12.354 5.306 1.00 0.00 H new ATOM 0 HB2 SER A 4 119.550 -11.794 3.034 1.00 0.00 H new ATOM 0 HB3 SER A 4 118.958 -10.321 3.775 1.00 0.00 H new ATOM 0 HG SER A 4 120.990 -9.996 2.675 1.00 0.00 H new ATOM 59 N GLN A 5 121.020 -13.763 4.717 1.00 0.00 N ATOM 60 CA GLN A 5 122.186 -14.687 4.784 1.00 0.00 C ATOM 61 C GLN A 5 123.413 -14.052 4.126 1.00 0.00 C ATOM 62 O GLN A 5 124.535 -14.400 4.436 1.00 0.00 O ATOM 63 CB GLN A 5 121.837 -15.994 4.067 1.00 0.00 C ATOM 64 CG GLN A 5 120.761 -16.743 4.859 1.00 0.00 C ATOM 65 CD GLN A 5 119.417 -16.031 4.691 1.00 0.00 C ATOM 66 OE1 GLN A 5 119.041 -15.670 3.594 1.00 0.00 O ATOM 67 NE2 GLN A 5 118.674 -15.807 5.741 1.00 0.00 N ATOM 0 H GLN A 5 120.215 -14.125 4.205 1.00 0.00 H new ATOM 0 HA GLN A 5 122.418 -14.889 5.830 1.00 0.00 H new ATOM 0 HB2 GLN A 5 121.480 -15.783 3.059 1.00 0.00 H new ATOM 0 HB3 GLN A 5 122.727 -16.615 3.967 1.00 0.00 H new ATOM 0 HG2 GLN A 5 120.686 -17.772 4.508 1.00 0.00 H new ATOM 0 HG3 GLN A 5 121.033 -16.785 5.914 1.00 0.00 H new ATOM 0 HE21 GLN A 5 118.989 -16.110 6.663 1.00 0.00 H new ATOM 0 HE22 GLN A 5 117.779 -15.329 5.640 1.00 0.00 H new ATOM 76 N LYS A 6 123.224 -13.128 3.220 1.00 0.00 N ATOM 77 CA LYS A 6 124.393 -12.487 2.554 1.00 0.00 C ATOM 78 C LYS A 6 125.255 -11.761 3.589 1.00 0.00 C ATOM 79 O LYS A 6 126.466 -11.748 3.497 1.00 0.00 O ATOM 80 CB LYS A 6 123.899 -11.486 1.505 1.00 0.00 C ATOM 81 CG LYS A 6 123.273 -12.245 0.335 1.00 0.00 C ATOM 82 CD LYS A 6 122.776 -11.253 -0.718 1.00 0.00 C ATOM 83 CE LYS A 6 122.237 -12.020 -1.928 1.00 0.00 C ATOM 84 NZ LYS A 6 123.382 -12.554 -2.721 1.00 0.00 N ATOM 0 H LYS A 6 122.311 -12.791 2.914 1.00 0.00 H new ATOM 0 HA LYS A 6 124.993 -13.257 2.070 1.00 0.00 H new ATOM 0 HB2 LYS A 6 123.167 -10.810 1.947 1.00 0.00 H new ATOM 0 HB3 LYS A 6 124.728 -10.872 1.153 1.00 0.00 H new ATOM 0 HG2 LYS A 6 124.006 -12.921 -0.106 1.00 0.00 H new ATOM 0 HG3 LYS A 6 122.445 -12.859 0.689 1.00 0.00 H new ATOM 0 HD2 LYS A 6 121.994 -10.621 -0.297 1.00 0.00 H new ATOM 0 HD3 LYS A 6 123.588 -10.594 -1.024 1.00 0.00 H new ATOM 0 HE2 LYS A 6 121.595 -12.837 -1.599 1.00 0.00 H new ATOM 0 HE3 LYS A 6 121.626 -11.363 -2.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 123.043 -12.865 -3.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 124.097 -11.809 -2.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 123.805 -13.361 -2.220 1.00 0.00 H new ATOM 98 N HIS A 7 124.649 -11.143 4.564 1.00 0.00 N ATOM 99 CA HIS A 7 125.450 -10.405 5.583 1.00 0.00 C ATOM 100 C HIS A 7 126.430 -11.351 6.281 1.00 0.00 C ATOM 101 O HIS A 7 127.607 -11.070 6.386 1.00 0.00 O ATOM 102 CB HIS A 7 124.492 -9.795 6.616 1.00 0.00 C ATOM 103 CG HIS A 7 125.264 -9.240 7.787 1.00 0.00 C ATOM 104 ND1 HIS A 7 125.779 -7.951 7.797 1.00 0.00 N ATOM 105 CD2 HIS A 7 125.605 -9.790 8.999 1.00 0.00 C ATOM 106 CE1 HIS A 7 126.394 -7.770 8.983 1.00 0.00 C ATOM 107 NE2 HIS A 7 126.315 -8.860 9.748 1.00 0.00 N ATOM 0 H HIS A 7 123.638 -11.116 4.700 1.00 0.00 H new ATOM 0 HA HIS A 7 126.023 -9.618 5.093 1.00 0.00 H new ATOM 0 HB2 HIS A 7 123.904 -9.003 6.152 1.00 0.00 H new ATOM 0 HB3 HIS A 7 123.790 -10.553 6.962 1.00 0.00 H new ATOM 0 HD2 HIS A 7 125.359 -10.791 9.320 1.00 0.00 H new ATOM 0 HE1 HIS A 7 126.889 -6.856 9.277 1.00 0.00 H new ATOM 0 HE2 HIS A 7 126.696 -8.984 10.686 1.00 0.00 H new ATOM 115 N ARG A 8 125.958 -12.471 6.765 1.00 0.00 N ATOM 116 CA ARG A 8 126.859 -13.432 7.460 1.00 0.00 C ATOM 117 C ARG A 8 127.808 -14.083 6.455 1.00 0.00 C ATOM 118 O ARG A 8 128.936 -14.405 6.766 1.00 0.00 O ATOM 119 CB ARG A 8 126.013 -14.512 8.136 1.00 0.00 C ATOM 120 CG ARG A 8 125.259 -13.898 9.317 1.00 0.00 C ATOM 121 CD ARG A 8 124.410 -14.972 9.999 1.00 0.00 C ATOM 122 NE ARG A 8 123.668 -14.360 11.138 1.00 0.00 N ATOM 123 CZ ARG A 8 122.693 -15.012 11.711 1.00 0.00 C ATOM 124 NH1 ARG A 8 122.381 -16.211 11.301 1.00 0.00 N ATOM 125 NH2 ARG A 8 122.034 -14.466 12.697 1.00 0.00 N ATOM 0 H ARG A 8 124.982 -12.761 6.707 1.00 0.00 H new ATOM 0 HA ARG A 8 127.447 -12.899 8.207 1.00 0.00 H new ATOM 0 HB2 ARG A 8 125.308 -14.938 7.422 1.00 0.00 H new ATOM 0 HB3 ARG A 8 126.650 -15.327 8.480 1.00 0.00 H new ATOM 0 HG2 ARG A 8 125.965 -13.471 10.030 1.00 0.00 H new ATOM 0 HG3 ARG A 8 124.623 -13.083 8.971 1.00 0.00 H new ATOM 0 HD2 ARG A 8 123.710 -15.407 9.285 1.00 0.00 H new ATOM 0 HD3 ARG A 8 125.045 -15.782 10.357 1.00 0.00 H new ATOM 0 HE ARG A 8 123.923 -13.430 11.470 1.00 0.00 H new ATOM 0 HH11 ARG A 8 122.899 -16.638 10.533 1.00 0.00 H new ATOM 0 HH12 ARG A 8 121.619 -16.721 11.748 1.00 0.00 H new ATOM 0 HH21 ARG A 8 122.281 -13.530 13.019 1.00 0.00 H new ATOM 0 HH22 ARG A 8 121.272 -14.975 13.145 1.00 0.00 H new ATOM 139 N ASP A 9 127.354 -14.278 5.252 1.00 0.00 N ATOM 140 CA ASP A 9 128.224 -14.907 4.222 1.00 0.00 C ATOM 141 C ASP A 9 129.311 -13.923 3.779 1.00 0.00 C ATOM 142 O ASP A 9 130.430 -14.301 3.501 1.00 0.00 O ATOM 143 CB ASP A 9 127.383 -15.313 3.012 1.00 0.00 C ATOM 144 CG ASP A 9 126.480 -16.490 3.388 1.00 0.00 C ATOM 145 OD1 ASP A 9 126.784 -17.156 4.364 1.00 0.00 O ATOM 146 OD2 ASP A 9 125.501 -16.705 2.693 1.00 0.00 O ATOM 0 H ASP A 9 126.417 -14.029 4.936 1.00 0.00 H new ATOM 0 HA ASP A 9 128.694 -15.791 4.652 1.00 0.00 H new ATOM 0 HB2 ASP A 9 126.779 -14.470 2.677 1.00 0.00 H new ATOM 0 HB3 ASP A 9 128.032 -15.590 2.181 1.00 0.00 H new ATOM 151 N PHE A 10 128.979 -12.661 3.688 1.00 0.00 N ATOM 152 CA PHE A 10 129.984 -11.655 3.236 1.00 0.00 C ATOM 153 C PHE A 10 131.077 -11.475 4.291 1.00 0.00 C ATOM 154 O PHE A 10 132.243 -11.353 3.972 1.00 0.00 O ATOM 155 CB PHE A 10 129.280 -10.316 3.007 1.00 0.00 C ATOM 156 CG PHE A 10 130.228 -9.354 2.331 1.00 0.00 C ATOM 157 CD1 PHE A 10 130.285 -9.299 0.934 1.00 0.00 C ATOM 158 CD2 PHE A 10 131.045 -8.513 3.099 1.00 0.00 C ATOM 159 CE1 PHE A 10 131.160 -8.408 0.303 1.00 0.00 C ATOM 160 CE2 PHE A 10 131.921 -7.621 2.467 1.00 0.00 C ATOM 161 CZ PHE A 10 131.978 -7.570 1.069 1.00 0.00 C ATOM 0 H PHE A 10 128.057 -12.285 3.907 1.00 0.00 H new ATOM 0 HA PHE A 10 130.444 -12.004 2.312 1.00 0.00 H new ATOM 0 HB2 PHE A 10 128.393 -10.461 2.391 1.00 0.00 H new ATOM 0 HB3 PHE A 10 128.944 -9.903 3.958 1.00 0.00 H new ATOM 0 HD1 PHE A 10 129.653 -9.945 0.342 1.00 0.00 H new ATOM 0 HD2 PHE A 10 130.999 -8.553 4.177 1.00 0.00 H new ATOM 0 HE1 PHE A 10 131.204 -8.367 -0.775 1.00 0.00 H new ATOM 0 HE2 PHE A 10 132.552 -6.973 3.058 1.00 0.00 H new ATOM 0 HZ PHE A 10 132.654 -6.883 0.581 1.00 0.00 H new ATOM 171 N VAL A 11 130.715 -11.444 5.543 1.00 0.00 N ATOM 172 CA VAL A 11 131.739 -11.258 6.611 1.00 0.00 C ATOM 173 C VAL A 11 132.403 -12.597 6.936 1.00 0.00 C ATOM 174 O VAL A 11 133.032 -12.752 7.965 1.00 0.00 O ATOM 175 CB VAL A 11 131.062 -10.696 7.861 1.00 0.00 C ATOM 176 CG1 VAL A 11 130.375 -9.373 7.511 1.00 0.00 C ATOM 177 CG2 VAL A 11 130.019 -11.698 8.369 1.00 0.00 C ATOM 0 H VAL A 11 129.755 -11.539 5.874 1.00 0.00 H new ATOM 0 HA VAL A 11 132.504 -10.562 6.266 1.00 0.00 H new ATOM 0 HB VAL A 11 131.807 -10.525 8.638 1.00 0.00 H new ATOM 0 HG11 VAL A 11 129.891 -8.968 8.400 1.00 0.00 H new ATOM 0 HG12 VAL A 11 131.117 -8.663 7.147 1.00 0.00 H new ATOM 0 HG13 VAL A 11 129.627 -9.545 6.737 1.00 0.00 H new ATOM 0 HG21 VAL A 11 129.535 -11.299 9.260 1.00 0.00 H new ATOM 0 HG22 VAL A 11 129.270 -11.868 7.595 1.00 0.00 H new ATOM 0 HG23 VAL A 11 130.509 -12.641 8.613 1.00 0.00 H new ATOM 187 N ALA A 12 132.255 -13.571 6.068 1.00 0.00 N ATOM 188 CA ALA A 12 132.865 -14.919 6.309 1.00 0.00 C ATOM 189 C ALA A 12 133.821 -15.278 5.167 1.00 0.00 C ATOM 190 O ALA A 12 134.490 -16.291 5.208 1.00 0.00 O ATOM 191 CB ALA A 12 131.754 -15.966 6.376 1.00 0.00 C ATOM 0 H ALA A 12 131.733 -13.489 5.195 1.00 0.00 H new ATOM 0 HA ALA A 12 133.420 -14.897 7.247 1.00 0.00 H new ATOM 0 HB1 ALA A 12 132.191 -16.949 6.551 1.00 0.00 H new ATOM 0 HB2 ALA A 12 131.072 -15.721 7.191 1.00 0.00 H new ATOM 0 HB3 ALA A 12 131.205 -15.975 5.434 1.00 0.00 H new ATOM 197 N GLU A 13 133.901 -14.461 4.148 1.00 0.00 N ATOM 198 CA GLU A 13 134.827 -14.774 3.014 1.00 0.00 C ATOM 199 C GLU A 13 135.303 -13.467 2.353 1.00 0.00 C ATOM 200 O GLU A 13 134.581 -12.488 2.343 1.00 0.00 O ATOM 201 CB GLU A 13 134.085 -15.623 1.978 1.00 0.00 C ATOM 202 CG GLU A 13 132.944 -14.805 1.369 1.00 0.00 C ATOM 203 CD GLU A 13 132.017 -15.731 0.580 1.00 0.00 C ATOM 204 OE1 GLU A 13 132.286 -15.948 -0.590 1.00 0.00 O ATOM 205 OE2 GLU A 13 131.053 -16.205 1.158 1.00 0.00 O ATOM 0 H GLU A 13 133.370 -13.596 4.051 1.00 0.00 H new ATOM 0 HA GLU A 13 135.690 -15.321 3.393 1.00 0.00 H new ATOM 0 HB2 GLU A 13 134.773 -15.945 1.196 1.00 0.00 H new ATOM 0 HB3 GLU A 13 133.690 -16.525 2.447 1.00 0.00 H new ATOM 0 HG2 GLU A 13 132.385 -14.298 2.156 1.00 0.00 H new ATOM 0 HG3 GLU A 13 133.346 -14.032 0.715 1.00 0.00 H new ATOM 212 N PRO A 14 136.491 -13.441 1.779 1.00 0.00 N ATOM 213 CA PRO A 14 137.016 -12.223 1.091 1.00 0.00 C ATOM 214 C PRO A 14 135.955 -11.566 0.196 1.00 0.00 C ATOM 215 O PRO A 14 134.944 -12.162 -0.123 1.00 0.00 O ATOM 216 CB PRO A 14 138.179 -12.756 0.244 1.00 0.00 C ATOM 217 CG PRO A 14 138.673 -13.968 0.972 1.00 0.00 C ATOM 218 CD PRO A 14 137.467 -14.553 1.727 1.00 0.00 C ATOM 0 HA PRO A 14 137.315 -11.451 1.800 1.00 0.00 H new ATOM 0 HB2 PRO A 14 137.849 -13.009 -0.763 1.00 0.00 H new ATOM 0 HB3 PRO A 14 138.967 -12.009 0.143 1.00 0.00 H new ATOM 0 HG2 PRO A 14 139.084 -14.698 0.274 1.00 0.00 H new ATOM 0 HG3 PRO A 14 139.472 -13.704 1.665 1.00 0.00 H new ATOM 0 HD2 PRO A 14 137.056 -15.419 1.209 1.00 0.00 H new ATOM 0 HD3 PRO A 14 137.747 -14.884 2.727 1.00 0.00 H new ATOM 226 N MET A 15 136.176 -10.342 -0.216 1.00 0.00 N ATOM 227 CA MET A 15 135.180 -9.652 -1.094 1.00 0.00 C ATOM 228 C MET A 15 135.529 -9.898 -2.568 1.00 0.00 C ATOM 229 O MET A 15 134.701 -9.752 -3.446 1.00 0.00 O ATOM 230 CB MET A 15 135.189 -8.149 -0.794 1.00 0.00 C ATOM 231 CG MET A 15 136.630 -7.635 -0.752 1.00 0.00 C ATOM 232 SD MET A 15 136.629 -5.826 -0.595 1.00 0.00 S ATOM 233 CE MET A 15 135.740 -5.706 0.980 1.00 0.00 C ATOM 0 H MET A 15 137.002 -9.791 0.017 1.00 0.00 H new ATOM 0 HA MET A 15 134.185 -10.050 -0.897 1.00 0.00 H new ATOM 0 HB2 MET A 15 134.625 -7.614 -1.558 1.00 0.00 H new ATOM 0 HB3 MET A 15 134.697 -7.957 0.159 1.00 0.00 H new ATOM 0 HG2 MET A 15 137.162 -8.082 0.088 1.00 0.00 H new ATOM 0 HG3 MET A 15 137.159 -7.931 -1.658 1.00 0.00 H new ATOM 0 HE1 MET A 15 135.508 -4.662 1.188 1.00 0.00 H new ATOM 0 HE2 MET A 15 134.814 -6.278 0.920 1.00 0.00 H new ATOM 0 HE3 MET A 15 136.362 -6.106 1.781 1.00 0.00 H new ATOM 243 N GLY A 16 136.748 -10.282 -2.842 1.00 0.00 N ATOM 244 CA GLY A 16 137.159 -10.557 -4.254 1.00 0.00 C ATOM 245 C GLY A 16 136.687 -9.434 -5.182 1.00 0.00 C ATOM 246 O GLY A 16 136.733 -8.268 -4.843 1.00 0.00 O ATOM 0 H GLY A 16 137.481 -10.418 -2.146 1.00 0.00 H new ATOM 0 HA2 GLY A 16 138.243 -10.651 -4.311 1.00 0.00 H new ATOM 0 HA3 GLY A 16 136.739 -11.508 -4.582 1.00 0.00 H new ATOM 250 N GLU A 17 136.255 -9.786 -6.370 1.00 0.00 N ATOM 251 CA GLU A 17 135.800 -8.761 -7.364 1.00 0.00 C ATOM 252 C GLU A 17 134.279 -8.798 -7.496 1.00 0.00 C ATOM 253 O GLU A 17 133.730 -8.434 -8.518 1.00 0.00 O ATOM 254 CB GLU A 17 136.425 -9.077 -8.725 1.00 0.00 C ATOM 255 CG GLU A 17 137.946 -8.947 -8.632 1.00 0.00 C ATOM 256 CD GLU A 17 138.570 -9.263 -9.992 1.00 0.00 C ATOM 257 OE1 GLU A 17 137.840 -9.691 -10.870 1.00 0.00 O ATOM 258 OE2 GLU A 17 139.768 -9.078 -10.129 1.00 0.00 O ATOM 0 H GLU A 17 136.198 -10.751 -6.697 1.00 0.00 H new ATOM 0 HA GLU A 17 136.107 -7.771 -7.026 1.00 0.00 H new ATOM 0 HB2 GLU A 17 136.154 -10.086 -9.036 1.00 0.00 H new ATOM 0 HB3 GLU A 17 136.037 -8.396 -9.482 1.00 0.00 H new ATOM 0 HG2 GLU A 17 138.217 -7.938 -8.322 1.00 0.00 H new ATOM 0 HG3 GLU A 17 138.334 -9.628 -7.875 1.00 0.00 H new ATOM 265 N LYS A 18 133.586 -9.232 -6.482 1.00 0.00 N ATOM 266 CA LYS A 18 132.102 -9.285 -6.575 1.00 0.00 C ATOM 267 C LYS A 18 131.584 -7.855 -6.795 1.00 0.00 C ATOM 268 O LYS A 18 132.207 -6.899 -6.379 1.00 0.00 O ATOM 269 CB LYS A 18 131.516 -9.868 -5.275 1.00 0.00 C ATOM 270 CG LYS A 18 131.611 -11.413 -5.271 1.00 0.00 C ATOM 271 CD LYS A 18 132.994 -11.871 -4.766 1.00 0.00 C ATOM 272 CE LYS A 18 132.988 -11.973 -3.236 1.00 0.00 C ATOM 273 NZ LYS A 18 132.227 -13.185 -2.825 1.00 0.00 N ATOM 0 H LYS A 18 133.980 -9.551 -5.597 1.00 0.00 H new ATOM 0 HA LYS A 18 131.798 -9.924 -7.404 1.00 0.00 H new ATOM 0 HB2 LYS A 18 132.053 -9.464 -4.416 1.00 0.00 H new ATOM 0 HB3 LYS A 18 130.475 -9.563 -5.172 1.00 0.00 H new ATOM 0 HG2 LYS A 18 130.830 -11.829 -4.635 1.00 0.00 H new ATOM 0 HG3 LYS A 18 131.440 -11.796 -6.277 1.00 0.00 H new ATOM 0 HD2 LYS A 18 133.247 -12.837 -5.202 1.00 0.00 H new ATOM 0 HD3 LYS A 18 133.760 -11.165 -5.088 1.00 0.00 H new ATOM 0 HE2 LYS A 18 134.010 -12.027 -2.860 1.00 0.00 H new ATOM 0 HE3 LYS A 18 132.535 -11.081 -2.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 132.506 -13.460 -1.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 131.208 -12.978 -2.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 132.435 -13.965 -3.481 1.00 0.00 H new ATOM 287 N PRO A 19 130.471 -7.704 -7.473 1.00 0.00 N ATOM 288 CA PRO A 19 129.892 -6.359 -7.783 1.00 0.00 C ATOM 289 C PRO A 19 129.505 -5.570 -6.529 1.00 0.00 C ATOM 290 O PRO A 19 129.215 -6.125 -5.488 1.00 0.00 O ATOM 291 CB PRO A 19 128.651 -6.678 -8.643 1.00 0.00 C ATOM 292 CG PRO A 19 128.306 -8.094 -8.311 1.00 0.00 C ATOM 293 CD PRO A 19 129.633 -8.788 -8.020 1.00 0.00 C ATOM 0 HA PRO A 19 130.616 -5.721 -8.290 1.00 0.00 H new ATOM 0 HB2 PRO A 19 127.826 -6.005 -8.410 1.00 0.00 H new ATOM 0 HB3 PRO A 19 128.866 -6.563 -9.705 1.00 0.00 H new ATOM 0 HG2 PRO A 19 127.642 -8.143 -7.448 1.00 0.00 H new ATOM 0 HG3 PRO A 19 127.787 -8.575 -9.140 1.00 0.00 H new ATOM 0 HD2 PRO A 19 129.513 -9.603 -7.306 1.00 0.00 H new ATOM 0 HD3 PRO A 19 130.069 -9.217 -8.922 1.00 0.00 H new ATOM 301 N VAL A 20 129.513 -4.270 -6.637 1.00 0.00 N ATOM 302 CA VAL A 20 129.162 -3.409 -5.476 1.00 0.00 C ATOM 303 C VAL A 20 127.797 -3.811 -4.912 1.00 0.00 C ATOM 304 O VAL A 20 127.616 -3.939 -3.717 1.00 0.00 O ATOM 305 CB VAL A 20 129.121 -1.948 -5.933 1.00 0.00 C ATOM 306 CG1 VAL A 20 128.075 -1.781 -7.043 1.00 0.00 C ATOM 307 CG2 VAL A 20 128.757 -1.052 -4.747 1.00 0.00 C ATOM 0 H VAL A 20 129.751 -3.764 -7.490 1.00 0.00 H new ATOM 0 HA VAL A 20 129.912 -3.533 -4.695 1.00 0.00 H new ATOM 0 HB VAL A 20 130.101 -1.663 -6.317 1.00 0.00 H new ATOM 0 HG11 VAL A 20 128.049 -0.740 -7.365 1.00 0.00 H new ATOM 0 HG12 VAL A 20 128.338 -2.416 -7.889 1.00 0.00 H new ATOM 0 HG13 VAL A 20 127.094 -2.068 -6.665 1.00 0.00 H new ATOM 0 HG21 VAL A 20 128.728 -0.012 -5.072 1.00 0.00 H new ATOM 0 HG22 VAL A 20 127.779 -1.339 -4.361 1.00 0.00 H new ATOM 0 HG23 VAL A 20 129.505 -1.166 -3.962 1.00 0.00 H new ATOM 317 N GLY A 21 126.828 -3.998 -5.773 1.00 0.00 N ATOM 318 CA GLY A 21 125.464 -4.377 -5.305 1.00 0.00 C ATOM 319 C GLY A 21 125.531 -5.648 -4.458 1.00 0.00 C ATOM 320 O GLY A 21 124.533 -6.106 -3.936 1.00 0.00 O ATOM 0 H GLY A 21 126.926 -3.903 -6.784 1.00 0.00 H new ATOM 0 HA2 GLY A 21 125.033 -3.564 -4.721 1.00 0.00 H new ATOM 0 HA3 GLY A 21 124.809 -4.536 -6.161 1.00 0.00 H new ATOM 324 N SER A 22 126.692 -6.227 -4.309 1.00 0.00 N ATOM 325 CA SER A 22 126.804 -7.463 -3.487 1.00 0.00 C ATOM 326 C SER A 22 126.870 -7.077 -2.011 1.00 0.00 C ATOM 327 O SER A 22 126.538 -7.851 -1.136 1.00 0.00 O ATOM 328 CB SER A 22 128.084 -8.199 -3.865 1.00 0.00 C ATOM 329 OG SER A 22 129.206 -7.457 -3.405 1.00 0.00 O ATOM 0 H SER A 22 127.565 -5.897 -4.721 1.00 0.00 H new ATOM 0 HA SER A 22 125.941 -8.104 -3.665 1.00 0.00 H new ATOM 0 HB2 SER A 22 128.087 -9.196 -3.424 1.00 0.00 H new ATOM 0 HB3 SER A 22 128.137 -8.328 -4.946 1.00 0.00 H new ATOM 0 HG SER A 22 129.597 -6.958 -4.152 1.00 0.00 H new ATOM 335 N LEU A 23 127.306 -5.883 -1.736 1.00 0.00 N ATOM 336 CA LEU A 23 127.409 -5.432 -0.319 1.00 0.00 C ATOM 337 C LEU A 23 126.022 -5.418 0.322 1.00 0.00 C ATOM 338 O LEU A 23 125.047 -5.001 -0.271 1.00 0.00 O ATOM 339 CB LEU A 23 127.997 -4.020 -0.270 1.00 0.00 C ATOM 340 CG LEU A 23 129.466 -4.041 -0.718 1.00 0.00 C ATOM 341 CD1 LEU A 23 129.970 -2.602 -0.856 1.00 0.00 C ATOM 342 CD2 LEU A 23 130.329 -4.801 0.311 1.00 0.00 C ATOM 0 H LEU A 23 127.597 -5.196 -2.432 1.00 0.00 H new ATOM 0 HA LEU A 23 128.056 -6.119 0.226 1.00 0.00 H new ATOM 0 HB2 LEU A 23 127.422 -3.356 -0.915 1.00 0.00 H new ATOM 0 HB3 LEU A 23 127.924 -3.623 0.742 1.00 0.00 H new ATOM 0 HG LEU A 23 129.541 -4.551 -1.678 1.00 0.00 H new ATOM 0 HD11 LEU A 23 131.013 -2.611 -1.174 1.00 0.00 H new ATOM 0 HD12 LEU A 23 129.369 -2.075 -1.597 1.00 0.00 H new ATOM 0 HD13 LEU A 23 129.888 -2.094 0.105 1.00 0.00 H new ATOM 0 HD21 LEU A 23 131.368 -4.808 -0.020 1.00 0.00 H new ATOM 0 HD22 LEU A 23 130.260 -4.306 1.280 1.00 0.00 H new ATOM 0 HD23 LEU A 23 129.970 -5.826 0.401 1.00 0.00 H new ATOM 354 N ALA A 24 125.938 -5.868 1.539 1.00 0.00 N ATOM 355 CA ALA A 24 124.624 -5.881 2.236 1.00 0.00 C ATOM 356 C ALA A 24 124.145 -4.440 2.448 1.00 0.00 C ATOM 357 O ALA A 24 124.896 -3.572 2.849 1.00 0.00 O ATOM 358 CB ALA A 24 124.767 -6.585 3.588 1.00 0.00 C ATOM 0 H ALA A 24 126.722 -6.228 2.083 1.00 0.00 H new ATOM 0 HA ALA A 24 123.895 -6.418 1.629 1.00 0.00 H new ATOM 0 HB1 ALA A 24 123.803 -6.594 4.097 1.00 0.00 H new ATOM 0 HB2 ALA A 24 125.104 -7.610 3.431 1.00 0.00 H new ATOM 0 HB3 ALA A 24 125.496 -6.053 4.200 1.00 0.00 H new ATOM 364 N GLY A 25 122.895 -4.189 2.169 1.00 0.00 N ATOM 365 CA GLY A 25 122.337 -2.809 2.336 1.00 0.00 C ATOM 366 C GLY A 25 122.264 -2.121 0.968 1.00 0.00 C ATOM 367 O GLY A 25 121.560 -1.148 0.793 1.00 0.00 O ATOM 0 H GLY A 25 122.229 -4.883 1.830 1.00 0.00 H new ATOM 0 HA2 GLY A 25 121.345 -2.858 2.784 1.00 0.00 H new ATOM 0 HA3 GLY A 25 122.965 -2.230 3.014 1.00 0.00 H new ATOM 371 N ILE A 26 122.975 -2.628 -0.007 1.00 0.00 N ATOM 372 CA ILE A 26 122.933 -2.017 -1.373 1.00 0.00 C ATOM 373 C ILE A 26 121.993 -2.861 -2.231 1.00 0.00 C ATOM 374 O ILE A 26 122.230 -4.035 -2.443 1.00 0.00 O ATOM 375 CB ILE A 26 124.339 -2.030 -1.988 1.00 0.00 C ATOM 376 CG1 ILE A 26 125.327 -1.306 -1.059 1.00 0.00 C ATOM 377 CG2 ILE A 26 124.311 -1.332 -3.351 1.00 0.00 C ATOM 378 CD1 ILE A 26 124.813 0.098 -0.708 1.00 0.00 C ATOM 0 H ILE A 26 123.585 -3.441 0.083 1.00 0.00 H new ATOM 0 HA ILE A 26 122.583 -0.986 -1.320 1.00 0.00 H new ATOM 0 HB ILE A 26 124.661 -3.063 -2.115 1.00 0.00 H new ATOM 0 HG12 ILE A 26 125.468 -1.886 -0.147 1.00 0.00 H new ATOM 0 HG13 ILE A 26 126.301 -1.232 -1.543 1.00 0.00 H new ATOM 0 HG21 ILE A 26 125.310 -1.342 -3.786 1.00 0.00 H new ATOM 0 HG22 ILE A 26 123.622 -1.855 -4.014 1.00 0.00 H new ATOM 0 HG23 ILE A 26 123.981 -0.301 -3.225 1.00 0.00 H new ATOM 0 HD11 ILE A 26 125.527 0.593 -0.050 1.00 0.00 H new ATOM 0 HD12 ILE A 26 124.696 0.682 -1.621 1.00 0.00 H new ATOM 0 HD13 ILE A 26 123.850 0.017 -0.204 1.00 0.00 H new ATOM 390 N GLY A 27 120.925 -2.292 -2.733 1.00 0.00 N ATOM 391 CA GLY A 27 119.982 -3.080 -3.577 1.00 0.00 C ATOM 392 C GLY A 27 120.361 -2.923 -5.050 1.00 0.00 C ATOM 393 O GLY A 27 121.251 -2.174 -5.397 1.00 0.00 O ATOM 0 H GLY A 27 120.668 -1.315 -2.593 1.00 0.00 H new ATOM 0 HA2 GLY A 27 120.015 -4.132 -3.292 1.00 0.00 H new ATOM 0 HA3 GLY A 27 118.960 -2.738 -3.415 1.00 0.00 H new ATOM 397 N GLU A 28 119.705 -3.646 -5.913 1.00 0.00 N ATOM 398 CA GLU A 28 120.038 -3.559 -7.362 1.00 0.00 C ATOM 399 C GLU A 28 119.855 -2.125 -7.864 1.00 0.00 C ATOM 400 O GLU A 28 120.644 -1.631 -8.646 1.00 0.00 O ATOM 401 CB GLU A 28 119.112 -4.492 -8.142 1.00 0.00 C ATOM 402 CG GLU A 28 119.476 -5.945 -7.836 1.00 0.00 C ATOM 403 CD GLU A 28 118.548 -6.878 -8.616 1.00 0.00 C ATOM 404 OE1 GLU A 28 117.586 -6.386 -9.182 1.00 0.00 O ATOM 405 OE2 GLU A 28 118.813 -8.069 -8.629 1.00 0.00 O ATOM 0 H GLU A 28 118.953 -4.293 -5.678 1.00 0.00 H new ATOM 0 HA GLU A 28 121.077 -3.853 -7.509 1.00 0.00 H new ATOM 0 HB2 GLU A 28 118.074 -4.301 -7.871 1.00 0.00 H new ATOM 0 HB3 GLU A 28 119.202 -4.301 -9.211 1.00 0.00 H new ATOM 0 HG2 GLU A 28 120.514 -6.136 -8.108 1.00 0.00 H new ATOM 0 HG3 GLU A 28 119.386 -6.136 -6.767 1.00 0.00 H new ATOM 412 N VAL A 29 118.829 -1.445 -7.430 1.00 0.00 N ATOM 413 CA VAL A 29 118.622 -0.046 -7.902 1.00 0.00 C ATOM 414 C VAL A 29 119.714 0.849 -7.316 1.00 0.00 C ATOM 415 O VAL A 29 120.301 1.664 -8.003 1.00 0.00 O ATOM 416 CB VAL A 29 117.242 0.448 -7.455 1.00 0.00 C ATOM 417 CG1 VAL A 29 117.106 1.943 -7.752 1.00 0.00 C ATOM 418 CG2 VAL A 29 116.160 -0.324 -8.213 1.00 0.00 C ATOM 0 H VAL A 29 118.130 -1.794 -6.774 1.00 0.00 H new ATOM 0 HA VAL A 29 118.674 -0.013 -8.990 1.00 0.00 H new ATOM 0 HB VAL A 29 117.128 0.284 -6.383 1.00 0.00 H new ATOM 0 HG11 VAL A 29 116.123 2.290 -7.432 1.00 0.00 H new ATOM 0 HG12 VAL A 29 117.878 2.493 -7.213 1.00 0.00 H new ATOM 0 HG13 VAL A 29 117.220 2.113 -8.823 1.00 0.00 H new ATOM 0 HG21 VAL A 29 115.176 0.024 -7.898 1.00 0.00 H new ATOM 0 HG22 VAL A 29 116.278 -0.159 -9.284 1.00 0.00 H new ATOM 0 HG23 VAL A 29 116.254 -1.388 -7.998 1.00 0.00 H new ATOM 428 N LEU A 30 119.996 0.700 -6.051 1.00 0.00 N ATOM 429 CA LEU A 30 121.049 1.535 -5.412 1.00 0.00 C ATOM 430 C LEU A 30 122.408 1.158 -5.996 1.00 0.00 C ATOM 431 O LEU A 30 123.252 1.998 -6.239 1.00 0.00 O ATOM 432 CB LEU A 30 121.062 1.280 -3.900 1.00 0.00 C ATOM 433 CG LEU A 30 119.735 1.724 -3.271 1.00 0.00 C ATOM 434 CD1 LEU A 30 119.715 1.307 -1.796 1.00 0.00 C ATOM 435 CD2 LEU A 30 119.574 3.253 -3.378 1.00 0.00 C ATOM 0 H LEU A 30 119.539 0.032 -5.430 1.00 0.00 H new ATOM 0 HA LEU A 30 120.842 2.589 -5.600 1.00 0.00 H new ATOM 0 HB2 LEU A 30 121.228 0.220 -3.705 1.00 0.00 H new ATOM 0 HB3 LEU A 30 121.889 1.822 -3.441 1.00 0.00 H new ATOM 0 HG LEU A 30 118.911 1.249 -3.803 1.00 0.00 H new ATOM 0 HD11 LEU A 30 118.774 1.619 -1.342 1.00 0.00 H new ATOM 0 HD12 LEU A 30 119.811 0.224 -1.723 1.00 0.00 H new ATOM 0 HD13 LEU A 30 120.545 1.781 -1.273 1.00 0.00 H new ATOM 0 HD21 LEU A 30 118.628 3.552 -2.927 1.00 0.00 H new ATOM 0 HD22 LEU A 30 120.396 3.743 -2.855 1.00 0.00 H new ATOM 0 HD23 LEU A 30 119.585 3.547 -4.427 1.00 0.00 H new ATOM 447 N GLY A 31 122.625 -0.108 -6.213 1.00 0.00 N ATOM 448 CA GLY A 31 123.927 -0.558 -6.775 1.00 0.00 C ATOM 449 C GLY A 31 124.160 0.085 -8.146 1.00 0.00 C ATOM 450 O GLY A 31 125.261 0.471 -8.477 1.00 0.00 O ATOM 0 H GLY A 31 121.954 -0.853 -6.025 1.00 0.00 H new ATOM 0 HA2 GLY A 31 124.737 -0.290 -6.097 1.00 0.00 H new ATOM 0 HA3 GLY A 31 123.936 -1.644 -6.868 1.00 0.00 H new ATOM 454 N LYS A 32 123.137 0.185 -8.951 1.00 0.00 N ATOM 455 CA LYS A 32 123.308 0.781 -10.310 1.00 0.00 C ATOM 456 C LYS A 32 123.761 2.243 -10.215 1.00 0.00 C ATOM 457 O LYS A 32 124.562 2.696 -11.008 1.00 0.00 O ATOM 458 CB LYS A 32 121.983 0.703 -11.076 1.00 0.00 C ATOM 459 CG LYS A 32 122.171 1.274 -12.485 1.00 0.00 C ATOM 460 CD LYS A 32 120.886 1.087 -13.295 1.00 0.00 C ATOM 461 CE LYS A 32 121.110 1.572 -14.730 1.00 0.00 C ATOM 462 NZ LYS A 32 121.108 3.062 -14.758 1.00 0.00 N ATOM 0 H LYS A 32 122.190 -0.120 -8.728 1.00 0.00 H new ATOM 0 HA LYS A 32 124.075 0.216 -10.840 1.00 0.00 H new ATOM 0 HB2 LYS A 32 121.645 -0.332 -11.134 1.00 0.00 H new ATOM 0 HB3 LYS A 32 121.211 1.261 -10.546 1.00 0.00 H new ATOM 0 HG2 LYS A 32 122.425 2.332 -12.428 1.00 0.00 H new ATOM 0 HG3 LYS A 32 123.002 0.773 -12.983 1.00 0.00 H new ATOM 0 HD2 LYS A 32 120.594 0.037 -13.296 1.00 0.00 H new ATOM 0 HD3 LYS A 32 120.070 1.644 -12.835 1.00 0.00 H new ATOM 0 HE2 LYS A 32 122.058 1.192 -15.110 1.00 0.00 H new ATOM 0 HE3 LYS A 32 120.327 1.185 -15.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 120.662 3.392 -15.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 120.574 3.424 -13.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 122.087 3.411 -14.714 1.00 0.00 H new ATOM 476 N LYS A 33 123.246 3.000 -9.285 1.00 0.00 N ATOM 477 CA LYS A 33 123.656 4.434 -9.204 1.00 0.00 C ATOM 478 C LYS A 33 125.138 4.543 -8.825 1.00 0.00 C ATOM 479 O LYS A 33 125.866 5.346 -9.373 1.00 0.00 O ATOM 480 CB LYS A 33 122.813 5.134 -8.137 1.00 0.00 C ATOM 481 CG LYS A 33 121.360 5.215 -8.605 1.00 0.00 C ATOM 482 CD LYS A 33 120.521 5.915 -7.536 1.00 0.00 C ATOM 483 CE LYS A 33 119.066 5.999 -8.000 1.00 0.00 C ATOM 484 NZ LYS A 33 118.208 6.432 -6.861 1.00 0.00 N ATOM 0 H LYS A 33 122.568 2.695 -8.586 1.00 0.00 H new ATOM 0 HA LYS A 33 123.503 4.904 -10.175 1.00 0.00 H new ATOM 0 HB2 LYS A 33 122.873 4.588 -7.196 1.00 0.00 H new ATOM 0 HB3 LYS A 33 123.202 6.135 -7.950 1.00 0.00 H new ATOM 0 HG2 LYS A 33 121.299 5.761 -9.546 1.00 0.00 H new ATOM 0 HG3 LYS A 33 120.970 4.214 -8.792 1.00 0.00 H new ATOM 0 HD2 LYS A 33 120.582 5.368 -6.595 1.00 0.00 H new ATOM 0 HD3 LYS A 33 120.912 6.915 -7.349 1.00 0.00 H new ATOM 0 HE2 LYS A 33 118.976 6.704 -8.826 1.00 0.00 H new ATOM 0 HE3 LYS A 33 118.735 5.029 -8.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 117.469 7.076 -7.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 117.764 5.599 -6.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 118.791 6.924 -6.154 1.00 0.00 H new ATOM 498 N LEU A 34 125.594 3.740 -7.905 1.00 0.00 N ATOM 499 CA LEU A 34 127.033 3.796 -7.508 1.00 0.00 C ATOM 500 C LEU A 34 127.912 3.472 -8.723 1.00 0.00 C ATOM 501 O LEU A 34 128.951 4.063 -8.935 1.00 0.00 O ATOM 502 CB LEU A 34 127.298 2.777 -6.394 1.00 0.00 C ATOM 503 CG LEU A 34 126.591 3.211 -5.098 1.00 0.00 C ATOM 504 CD1 LEU A 34 126.548 2.026 -4.130 1.00 0.00 C ATOM 505 CD2 LEU A 34 127.347 4.381 -4.434 1.00 0.00 C ATOM 0 H LEU A 34 125.034 3.046 -7.409 1.00 0.00 H new ATOM 0 HA LEU A 34 127.271 4.796 -7.146 1.00 0.00 H new ATOM 0 HB2 LEU A 34 126.942 1.793 -6.699 1.00 0.00 H new ATOM 0 HB3 LEU A 34 128.370 2.688 -6.220 1.00 0.00 H new ATOM 0 HG LEU A 34 125.580 3.538 -5.340 1.00 0.00 H new ATOM 0 HD11 LEU A 34 126.048 2.326 -3.209 1.00 0.00 H new ATOM 0 HD12 LEU A 34 126.001 1.202 -4.588 1.00 0.00 H new ATOM 0 HD13 LEU A 34 127.564 1.705 -3.903 1.00 0.00 H new ATOM 0 HD21 LEU A 34 126.832 4.674 -3.519 1.00 0.00 H new ATOM 0 HD22 LEU A 34 128.363 4.068 -4.194 1.00 0.00 H new ATOM 0 HD23 LEU A 34 127.380 5.228 -5.119 1.00 0.00 H new ATOM 517 N GLU A 35 127.496 2.523 -9.505 1.00 0.00 N ATOM 518 CA GLU A 35 128.312 2.141 -10.697 1.00 0.00 C ATOM 519 C GLU A 35 128.452 3.343 -11.639 1.00 0.00 C ATOM 520 O GLU A 35 129.501 3.581 -12.204 1.00 0.00 O ATOM 521 CB GLU A 35 127.640 0.982 -11.434 1.00 0.00 C ATOM 522 CG GLU A 35 127.695 -0.276 -10.563 1.00 0.00 C ATOM 523 CD GLU A 35 126.984 -1.426 -11.281 1.00 0.00 C ATOM 524 OE1 GLU A 35 126.371 -1.169 -12.303 1.00 0.00 O ATOM 525 OE2 GLU A 35 127.066 -2.542 -10.795 1.00 0.00 O ATOM 0 H GLU A 35 126.633 1.995 -9.377 1.00 0.00 H new ATOM 0 HA GLU A 35 129.303 1.829 -10.366 1.00 0.00 H new ATOM 0 HB2 GLU A 35 126.605 1.234 -11.663 1.00 0.00 H new ATOM 0 HB3 GLU A 35 128.142 0.802 -12.385 1.00 0.00 H new ATOM 0 HG2 GLU A 35 128.731 -0.545 -10.360 1.00 0.00 H new ATOM 0 HG3 GLU A 35 127.221 -0.086 -9.600 1.00 0.00 H new ATOM 532 N GLU A 36 127.403 4.100 -11.814 1.00 0.00 N ATOM 533 CA GLU A 36 127.472 5.285 -12.718 1.00 0.00 C ATOM 534 C GLU A 36 128.363 6.354 -12.082 1.00 0.00 C ATOM 535 O GLU A 36 128.847 7.252 -12.741 1.00 0.00 O ATOM 536 CB GLU A 36 126.066 5.852 -12.920 1.00 0.00 C ATOM 537 CG GLU A 36 125.236 4.872 -13.750 1.00 0.00 C ATOM 538 CD GLU A 36 123.831 5.438 -13.953 1.00 0.00 C ATOM 539 OE1 GLU A 36 123.523 6.443 -13.333 1.00 0.00 O ATOM 540 OE2 GLU A 36 123.086 4.859 -14.727 1.00 0.00 O ATOM 0 H GLU A 36 126.498 3.949 -11.369 1.00 0.00 H new ATOM 0 HA GLU A 36 127.887 4.987 -13.681 1.00 0.00 H new ATOM 0 HB2 GLU A 36 125.589 6.023 -11.955 1.00 0.00 H new ATOM 0 HB3 GLU A 36 126.120 6.817 -13.424 1.00 0.00 H new ATOM 0 HG2 GLU A 36 125.713 4.701 -14.715 1.00 0.00 H new ATOM 0 HG3 GLU A 36 125.182 3.907 -13.246 1.00 0.00 H new ATOM 547 N ARG A 37 128.556 6.269 -10.798 1.00 0.00 N ATOM 548 CA ARG A 37 129.388 7.290 -10.094 1.00 0.00 C ATOM 549 C ARG A 37 130.859 6.862 -10.107 1.00 0.00 C ATOM 550 O ARG A 37 131.719 7.564 -9.614 1.00 0.00 O ATOM 551 CB ARG A 37 128.899 7.419 -8.646 1.00 0.00 C ATOM 552 CG ARG A 37 127.560 8.179 -8.594 1.00 0.00 C ATOM 553 CD ARG A 37 127.805 9.695 -8.593 1.00 0.00 C ATOM 554 NE ARG A 37 128.704 10.050 -7.459 1.00 0.00 N ATOM 555 CZ ARG A 37 129.293 11.213 -7.432 1.00 0.00 C ATOM 556 NH1 ARG A 37 129.077 12.078 -8.384 1.00 0.00 N ATOM 557 NH2 ARG A 37 130.097 11.511 -6.448 1.00 0.00 N ATOM 0 H ARG A 37 128.174 5.536 -10.201 1.00 0.00 H new ATOM 0 HA ARG A 37 129.296 8.250 -10.601 1.00 0.00 H new ATOM 0 HB2 ARG A 37 128.779 6.429 -8.207 1.00 0.00 H new ATOM 0 HB3 ARG A 37 129.645 7.944 -8.049 1.00 0.00 H new ATOM 0 HG2 ARG A 37 126.945 7.904 -9.451 1.00 0.00 H new ATOM 0 HG3 ARG A 37 127.007 7.893 -7.700 1.00 0.00 H new ATOM 0 HD2 ARG A 37 128.254 10.003 -9.537 1.00 0.00 H new ATOM 0 HD3 ARG A 37 126.858 10.228 -8.502 1.00 0.00 H new ATOM 0 HE ARG A 37 128.859 9.383 -6.703 1.00 0.00 H new ATOM 0 HH11 ARG A 37 128.446 11.845 -9.151 1.00 0.00 H new ATOM 0 HH12 ARG A 37 129.539 12.987 -8.361 1.00 0.00 H new ATOM 0 HH21 ARG A 37 130.263 10.835 -5.703 1.00 0.00 H new ATOM 0 HH22 ARG A 37 130.559 12.420 -6.424 1.00 0.00 H new ATOM 571 N GLY A 38 131.158 5.733 -10.695 1.00 0.00 N ATOM 572 CA GLY A 38 132.584 5.277 -10.774 1.00 0.00 C ATOM 573 C GLY A 38 132.876 4.233 -9.699 1.00 0.00 C ATOM 574 O GLY A 38 133.949 4.203 -9.130 1.00 0.00 O ATOM 0 H GLY A 38 130.479 5.105 -11.125 1.00 0.00 H new ATOM 0 HA2 GLY A 38 132.783 4.857 -11.760 1.00 0.00 H new ATOM 0 HA3 GLY A 38 133.251 6.130 -10.651 1.00 0.00 H new ATOM 578 N PHE A 39 131.945 3.356 -9.441 1.00 0.00 N ATOM 579 CA PHE A 39 132.159 2.274 -8.434 1.00 0.00 C ATOM 580 C PHE A 39 131.702 0.963 -9.066 1.00 0.00 C ATOM 581 O PHE A 39 130.665 0.427 -8.732 1.00 0.00 O ATOM 582 CB PHE A 39 131.329 2.568 -7.183 1.00 0.00 C ATOM 583 CG PHE A 39 131.861 3.812 -6.515 1.00 0.00 C ATOM 584 CD1 PHE A 39 132.874 3.715 -5.556 1.00 0.00 C ATOM 585 CD2 PHE A 39 131.351 5.063 -6.867 1.00 0.00 C ATOM 586 CE1 PHE A 39 133.376 4.871 -4.948 1.00 0.00 C ATOM 587 CE2 PHE A 39 131.852 6.222 -6.263 1.00 0.00 C ATOM 588 CZ PHE A 39 132.867 6.127 -5.303 1.00 0.00 C ATOM 0 H PHE A 39 131.030 3.342 -9.892 1.00 0.00 H new ATOM 0 HA PHE A 39 133.208 2.213 -8.146 1.00 0.00 H new ATOM 0 HB2 PHE A 39 130.281 2.705 -7.451 1.00 0.00 H new ATOM 0 HB3 PHE A 39 131.375 1.724 -6.495 1.00 0.00 H new ATOM 0 HD1 PHE A 39 133.269 2.747 -5.284 1.00 0.00 H new ATOM 0 HD2 PHE A 39 130.568 5.137 -7.607 1.00 0.00 H new ATOM 0 HE1 PHE A 39 134.156 4.795 -4.205 1.00 0.00 H new ATOM 0 HE2 PHE A 39 131.456 7.189 -6.537 1.00 0.00 H new ATOM 0 HZ PHE A 39 133.257 7.020 -4.837 1.00 0.00 H new ATOM 598 N ASP A 40 132.457 0.460 -10.008 1.00 0.00 N ATOM 599 CA ASP A 40 132.050 -0.795 -10.696 1.00 0.00 C ATOM 600 C ASP A 40 132.386 -2.015 -9.834 1.00 0.00 C ATOM 601 O ASP A 40 131.904 -3.102 -10.088 1.00 0.00 O ATOM 602 CB ASP A 40 132.800 -0.893 -12.027 1.00 0.00 C ATOM 603 CG ASP A 40 134.307 -0.933 -11.764 1.00 0.00 C ATOM 604 OD1 ASP A 40 134.715 -0.502 -10.698 1.00 0.00 O ATOM 605 OD2 ASP A 40 135.028 -1.399 -12.632 1.00 0.00 O ATOM 0 H ASP A 40 133.336 0.866 -10.328 1.00 0.00 H new ATOM 0 HA ASP A 40 130.974 -0.776 -10.867 1.00 0.00 H new ATOM 0 HB2 ASP A 40 132.491 -1.789 -12.566 1.00 0.00 H new ATOM 0 HB3 ASP A 40 132.553 -0.040 -12.659 1.00 0.00 H new ATOM 610 N LYS A 41 133.212 -1.859 -8.823 1.00 0.00 N ATOM 611 CA LYS A 41 133.579 -3.028 -7.955 1.00 0.00 C ATOM 612 C LYS A 41 133.437 -2.649 -6.476 1.00 0.00 C ATOM 613 O LYS A 41 133.548 -1.500 -6.099 1.00 0.00 O ATOM 614 CB LYS A 41 135.028 -3.442 -8.235 1.00 0.00 C ATOM 615 CG LYS A 41 135.188 -3.842 -9.711 1.00 0.00 C ATOM 616 CD LYS A 41 134.460 -5.165 -9.993 1.00 0.00 C ATOM 617 CE LYS A 41 134.986 -5.776 -11.294 1.00 0.00 C ATOM 618 NZ LYS A 41 134.258 -7.047 -11.574 1.00 0.00 N ATOM 0 H LYS A 41 133.647 -0.974 -8.562 1.00 0.00 H new ATOM 0 HA LYS A 41 132.910 -3.859 -8.179 1.00 0.00 H new ATOM 0 HB2 LYS A 41 135.702 -2.619 -7.998 1.00 0.00 H new ATOM 0 HB3 LYS A 41 135.307 -4.277 -7.592 1.00 0.00 H new ATOM 0 HG2 LYS A 41 134.788 -3.056 -10.352 1.00 0.00 H new ATOM 0 HG3 LYS A 41 136.246 -3.944 -9.954 1.00 0.00 H new ATOM 0 HD2 LYS A 41 134.613 -5.859 -9.166 1.00 0.00 H new ATOM 0 HD3 LYS A 41 133.387 -4.992 -10.069 1.00 0.00 H new ATOM 0 HE2 LYS A 41 134.849 -5.076 -12.119 1.00 0.00 H new ATOM 0 HE3 LYS A 41 136.056 -5.967 -11.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 134.836 -7.649 -12.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 134.075 -7.546 -10.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 133.354 -6.834 -12.043 1.00 0.00 H new ATOM 632 N ALA A 42 133.169 -3.621 -5.642 1.00 0.00 N ATOM 633 CA ALA A 42 132.989 -3.355 -4.182 1.00 0.00 C ATOM 634 C ALA A 42 134.276 -2.809 -3.539 1.00 0.00 C ATOM 635 O ALA A 42 134.227 -1.936 -2.696 1.00 0.00 O ATOM 636 CB ALA A 42 132.609 -4.664 -3.487 1.00 0.00 C ATOM 0 H ALA A 42 133.066 -4.599 -5.913 1.00 0.00 H new ATOM 0 HA ALA A 42 132.206 -2.605 -4.066 1.00 0.00 H new ATOM 0 HB1 ALA A 42 132.475 -4.484 -2.420 1.00 0.00 H new ATOM 0 HB2 ALA A 42 131.680 -5.044 -3.911 1.00 0.00 H new ATOM 0 HB3 ALA A 42 133.402 -5.397 -3.634 1.00 0.00 H new ATOM 642 N TYR A 43 135.418 -3.338 -3.886 1.00 0.00 N ATOM 643 CA TYR A 43 136.682 -2.865 -3.239 1.00 0.00 C ATOM 644 C TYR A 43 136.893 -1.360 -3.458 1.00 0.00 C ATOM 645 O TYR A 43 137.637 -0.729 -2.734 1.00 0.00 O ATOM 646 CB TYR A 43 137.889 -3.654 -3.759 1.00 0.00 C ATOM 647 CG TYR A 43 138.090 -3.414 -5.235 1.00 0.00 C ATOM 648 CD1 TYR A 43 138.698 -2.234 -5.671 1.00 0.00 C ATOM 649 CD2 TYR A 43 137.688 -4.380 -6.164 1.00 0.00 C ATOM 650 CE1 TYR A 43 138.902 -2.016 -7.037 1.00 0.00 C ATOM 651 CE2 TYR A 43 137.890 -4.162 -7.531 1.00 0.00 C ATOM 652 CZ TYR A 43 138.497 -2.979 -7.968 1.00 0.00 C ATOM 653 OH TYR A 43 138.700 -2.764 -9.315 1.00 0.00 O ATOM 0 H TYR A 43 135.534 -4.072 -4.584 1.00 0.00 H new ATOM 0 HA TYR A 43 136.588 -3.040 -2.167 1.00 0.00 H new ATOM 0 HB2 TYR A 43 138.785 -3.359 -3.213 1.00 0.00 H new ATOM 0 HB3 TYR A 43 137.740 -4.718 -3.576 1.00 0.00 H new ATOM 0 HD1 TYR A 43 139.010 -1.490 -4.953 1.00 0.00 H new ATOM 0 HD2 TYR A 43 137.222 -5.294 -5.826 1.00 0.00 H new ATOM 0 HE1 TYR A 43 139.372 -1.104 -7.374 1.00 0.00 H new ATOM 0 HE2 TYR A 43 137.578 -4.906 -8.249 1.00 0.00 H new ATOM 0 HH TYR A 43 138.589 -3.608 -9.801 1.00 0.00 H new ATOM 663 N VAL A 44 136.238 -0.765 -4.419 1.00 0.00 N ATOM 664 CA VAL A 44 136.411 0.708 -4.620 1.00 0.00 C ATOM 665 C VAL A 44 135.584 1.430 -3.552 1.00 0.00 C ATOM 666 O VAL A 44 135.927 2.497 -3.079 1.00 0.00 O ATOM 667 CB VAL A 44 135.922 1.111 -6.018 1.00 0.00 C ATOM 668 CG1 VAL A 44 136.099 2.619 -6.222 1.00 0.00 C ATOM 669 CG2 VAL A 44 136.741 0.370 -7.076 1.00 0.00 C ATOM 0 H VAL A 44 135.598 -1.225 -5.067 1.00 0.00 H new ATOM 0 HA VAL A 44 137.463 0.978 -4.534 1.00 0.00 H new ATOM 0 HB VAL A 44 134.867 0.853 -6.111 1.00 0.00 H new ATOM 0 HG11 VAL A 44 135.749 2.895 -7.217 1.00 0.00 H new ATOM 0 HG12 VAL A 44 135.521 3.158 -5.471 1.00 0.00 H new ATOM 0 HG13 VAL A 44 137.153 2.878 -6.123 1.00 0.00 H new ATOM 0 HG21 VAL A 44 136.395 0.655 -8.070 1.00 0.00 H new ATOM 0 HG22 VAL A 44 137.794 0.631 -6.970 1.00 0.00 H new ATOM 0 HG23 VAL A 44 136.619 -0.705 -6.944 1.00 0.00 H new ATOM 679 N VAL A 45 134.499 0.818 -3.164 1.00 0.00 N ATOM 680 CA VAL A 45 133.624 1.412 -2.118 1.00 0.00 C ATOM 681 C VAL A 45 134.285 1.175 -0.760 1.00 0.00 C ATOM 682 O VAL A 45 134.229 2.004 0.127 1.00 0.00 O ATOM 683 CB VAL A 45 132.249 0.740 -2.146 1.00 0.00 C ATOM 684 CG1 VAL A 45 131.407 1.252 -0.976 1.00 0.00 C ATOM 685 CG2 VAL A 45 131.548 1.077 -3.463 1.00 0.00 C ATOM 0 H VAL A 45 134.179 -0.078 -3.532 1.00 0.00 H new ATOM 0 HA VAL A 45 133.493 2.479 -2.297 1.00 0.00 H new ATOM 0 HB VAL A 45 132.369 -0.340 -2.061 1.00 0.00 H new ATOM 0 HG11 VAL A 45 130.428 0.774 -0.996 1.00 0.00 H new ATOM 0 HG12 VAL A 45 131.907 1.016 -0.037 1.00 0.00 H new ATOM 0 HG13 VAL A 45 131.285 2.332 -1.061 1.00 0.00 H new ATOM 0 HG21 VAL A 45 130.568 0.600 -3.486 1.00 0.00 H new ATOM 0 HG22 VAL A 45 131.428 2.157 -3.545 1.00 0.00 H new ATOM 0 HG23 VAL A 45 132.148 0.714 -4.298 1.00 0.00 H new ATOM 695 N LEU A 46 134.943 0.059 -0.609 1.00 0.00 N ATOM 696 CA LEU A 46 135.648 -0.229 0.670 1.00 0.00 C ATOM 697 C LEU A 46 136.684 0.876 0.884 1.00 0.00 C ATOM 698 O LEU A 46 136.893 1.356 1.981 1.00 0.00 O ATOM 699 CB LEU A 46 136.353 -1.590 0.558 1.00 0.00 C ATOM 700 CG LEU A 46 137.100 -1.930 1.867 1.00 0.00 C ATOM 701 CD1 LEU A 46 136.086 -2.236 2.987 1.00 0.00 C ATOM 702 CD2 LEU A 46 138.043 -3.142 1.640 1.00 0.00 C ATOM 0 H LEU A 46 135.023 -0.668 -1.320 1.00 0.00 H new ATOM 0 HA LEU A 46 134.949 -0.261 1.506 1.00 0.00 H new ATOM 0 HB2 LEU A 46 135.621 -2.367 0.340 1.00 0.00 H new ATOM 0 HB3 LEU A 46 137.057 -1.573 -0.274 1.00 0.00 H new ATOM 0 HG LEU A 46 137.703 -1.073 2.168 1.00 0.00 H new ATOM 0 HD11 LEU A 46 136.621 -2.475 3.906 1.00 0.00 H new ATOM 0 HD12 LEU A 46 135.452 -1.365 3.152 1.00 0.00 H new ATOM 0 HD13 LEU A 46 135.468 -3.085 2.696 1.00 0.00 H new ATOM 0 HD21 LEU A 46 138.566 -3.375 2.568 1.00 0.00 H new ATOM 0 HD22 LEU A 46 137.456 -4.006 1.327 1.00 0.00 H new ATOM 0 HD23 LEU A 46 138.770 -2.897 0.866 1.00 0.00 H new ATOM 714 N GLY A 47 137.335 1.274 -0.175 1.00 0.00 N ATOM 715 CA GLY A 47 138.367 2.343 -0.077 1.00 0.00 C ATOM 716 C GLY A 47 137.737 3.634 0.447 1.00 0.00 C ATOM 717 O GLY A 47 138.307 4.318 1.272 1.00 0.00 O ATOM 0 H GLY A 47 137.194 0.900 -1.113 1.00 0.00 H new ATOM 0 HA2 GLY A 47 139.170 2.025 0.588 1.00 0.00 H new ATOM 0 HA3 GLY A 47 138.814 2.518 -1.055 1.00 0.00 H new ATOM 721 N GLN A 48 136.560 3.972 -0.013 1.00 0.00 N ATOM 722 CA GLN A 48 135.897 5.214 0.478 1.00 0.00 C ATOM 723 C GLN A 48 135.687 5.103 1.993 1.00 0.00 C ATOM 724 O GLN A 48 135.938 6.029 2.739 1.00 0.00 O ATOM 725 CB GLN A 48 134.545 5.368 -0.232 1.00 0.00 C ATOM 726 CG GLN A 48 133.837 6.645 0.232 1.00 0.00 C ATOM 727 CD GLN A 48 134.692 7.866 -0.113 1.00 0.00 C ATOM 728 OE1 GLN A 48 135.045 8.688 0.836 1.00 0.00 O flip ATOM 729 NE2 GLN A 48 135.041 8.076 -1.258 1.00 0.00 N flip ATOM 0 H GLN A 48 136.031 3.442 -0.706 1.00 0.00 H new ATOM 0 HA GLN A 48 136.517 6.085 0.266 1.00 0.00 H new ATOM 0 HB2 GLN A 48 134.696 5.401 -1.311 1.00 0.00 H new ATOM 0 HB3 GLN A 48 133.918 4.501 -0.024 1.00 0.00 H new ATOM 0 HG2 GLN A 48 132.861 6.726 -0.247 1.00 0.00 H new ATOM 0 HG3 GLN A 48 133.662 6.604 1.307 1.00 0.00 H new ATOM 0 HE21 GLN A 48 134.766 7.434 -2.001 1.00 0.00 H new ATOM 0 HE22 GLN A 48 135.609 8.894 -1.476 1.00 0.00 H new ATOM 738 N PHE A 49 135.245 3.960 2.448 1.00 0.00 N ATOM 739 CA PHE A 49 135.029 3.752 3.911 1.00 0.00 C ATOM 740 C PHE A 49 136.363 3.949 4.636 1.00 0.00 C ATOM 741 O PHE A 49 136.432 4.527 5.701 1.00 0.00 O ATOM 742 CB PHE A 49 134.517 2.324 4.124 1.00 0.00 C ATOM 743 CG PHE A 49 134.283 2.060 5.595 1.00 0.00 C ATOM 744 CD1 PHE A 49 133.235 2.706 6.263 1.00 0.00 C ATOM 745 CD2 PHE A 49 135.102 1.156 6.284 1.00 0.00 C ATOM 746 CE1 PHE A 49 133.009 2.449 7.621 1.00 0.00 C ATOM 747 CE2 PHE A 49 134.875 0.901 7.642 1.00 0.00 C ATOM 748 CZ PHE A 49 133.829 1.546 8.311 1.00 0.00 C ATOM 0 H PHE A 49 135.022 3.154 1.863 1.00 0.00 H new ATOM 0 HA PHE A 49 134.301 4.462 4.303 1.00 0.00 H new ATOM 0 HB2 PHE A 49 133.590 2.177 3.570 1.00 0.00 H new ATOM 0 HB3 PHE A 49 135.240 1.609 3.731 1.00 0.00 H new ATOM 0 HD1 PHE A 49 132.602 3.401 5.732 1.00 0.00 H new ATOM 0 HD2 PHE A 49 135.908 0.656 5.768 1.00 0.00 H new ATOM 0 HE1 PHE A 49 132.202 2.947 8.137 1.00 0.00 H new ATOM 0 HE2 PHE A 49 135.508 0.206 8.174 1.00 0.00 H new ATOM 0 HZ PHE A 49 133.654 1.348 9.358 1.00 0.00 H new ATOM 758 N LEU A 50 137.414 3.468 4.052 1.00 0.00 N ATOM 759 CA LEU A 50 138.748 3.621 4.696 1.00 0.00 C ATOM 760 C LEU A 50 139.135 5.103 4.669 1.00 0.00 C ATOM 761 O LEU A 50 139.723 5.619 5.598 1.00 0.00 O ATOM 762 CB LEU A 50 139.788 2.789 3.938 1.00 0.00 C ATOM 763 CG LEU A 50 139.514 1.290 4.148 1.00 0.00 C ATOM 764 CD1 LEU A 50 140.436 0.476 3.235 1.00 0.00 C ATOM 765 CD2 LEU A 50 139.760 0.896 5.621 1.00 0.00 C ATOM 0 H LEU A 50 137.413 2.976 3.159 1.00 0.00 H new ATOM 0 HA LEU A 50 138.709 3.270 5.727 1.00 0.00 H new ATOM 0 HB2 LEU A 50 139.753 3.028 2.875 1.00 0.00 H new ATOM 0 HB3 LEU A 50 140.790 3.037 4.288 1.00 0.00 H new ATOM 0 HG LEU A 50 138.473 1.082 3.903 1.00 0.00 H new ATOM 0 HD11 LEU A 50 140.246 -0.587 3.380 1.00 0.00 H new ATOM 0 HD12 LEU A 50 140.244 0.740 2.195 1.00 0.00 H new ATOM 0 HD13 LEU A 50 141.476 0.695 3.479 1.00 0.00 H new ATOM 0 HD21 LEU A 50 139.561 -0.168 5.751 1.00 0.00 H new ATOM 0 HD22 LEU A 50 140.796 1.107 5.886 1.00 0.00 H new ATOM 0 HD23 LEU A 50 139.096 1.471 6.267 1.00 0.00 H new ATOM 777 N VAL A 51 138.811 5.785 3.608 1.00 0.00 N ATOM 778 CA VAL A 51 139.153 7.234 3.501 1.00 0.00 C ATOM 779 C VAL A 51 138.392 8.041 4.567 1.00 0.00 C ATOM 780 O VAL A 51 138.850 9.072 5.016 1.00 0.00 O ATOM 781 CB VAL A 51 138.774 7.736 2.101 1.00 0.00 C ATOM 782 CG1 VAL A 51 138.885 9.265 2.041 1.00 0.00 C ATOM 783 CG2 VAL A 51 139.722 7.121 1.065 1.00 0.00 C ATOM 0 H VAL A 51 138.319 5.399 2.802 1.00 0.00 H new ATOM 0 HA VAL A 51 140.223 7.365 3.664 1.00 0.00 H new ATOM 0 HB VAL A 51 137.747 7.442 1.885 1.00 0.00 H new ATOM 0 HG11 VAL A 51 138.614 9.611 1.043 1.00 0.00 H new ATOM 0 HG12 VAL A 51 138.211 9.708 2.774 1.00 0.00 H new ATOM 0 HG13 VAL A 51 139.909 9.564 2.263 1.00 0.00 H new ATOM 0 HG21 VAL A 51 139.454 7.477 0.070 1.00 0.00 H new ATOM 0 HG22 VAL A 51 140.747 7.414 1.291 1.00 0.00 H new ATOM 0 HG23 VAL A 51 139.640 6.035 1.096 1.00 0.00 H new ATOM 793 N LEU A 52 137.231 7.589 4.961 1.00 0.00 N ATOM 794 CA LEU A 52 136.437 8.347 5.982 1.00 0.00 C ATOM 795 C LEU A 52 136.823 7.908 7.395 1.00 0.00 C ATOM 796 O LEU A 52 136.140 8.219 8.350 1.00 0.00 O ATOM 797 CB LEU A 52 134.940 8.092 5.781 1.00 0.00 C ATOM 798 CG LEU A 52 134.486 8.590 4.401 1.00 0.00 C ATOM 799 CD1 LEU A 52 132.990 8.296 4.232 1.00 0.00 C ATOM 800 CD2 LEU A 52 134.727 10.109 4.275 1.00 0.00 C ATOM 0 H LEU A 52 136.796 6.730 4.623 1.00 0.00 H new ATOM 0 HA LEU A 52 136.653 9.408 5.858 1.00 0.00 H new ATOM 0 HB2 LEU A 52 134.731 7.026 5.875 1.00 0.00 H new ATOM 0 HB3 LEU A 52 134.372 8.598 6.561 1.00 0.00 H new ATOM 0 HG LEU A 52 135.059 8.078 3.628 1.00 0.00 H new ATOM 0 HD11 LEU A 52 132.659 8.646 3.255 1.00 0.00 H new ATOM 0 HD12 LEU A 52 132.819 7.222 4.310 1.00 0.00 H new ATOM 0 HD13 LEU A 52 132.428 8.810 5.012 1.00 0.00 H new ATOM 0 HD21 LEU A 52 134.401 10.449 3.292 1.00 0.00 H new ATOM 0 HD22 LEU A 52 134.161 10.632 5.046 1.00 0.00 H new ATOM 0 HD23 LEU A 52 135.789 10.320 4.398 1.00 0.00 H new ATOM 812 N LYS A 53 137.911 7.211 7.556 1.00 0.00 N ATOM 813 CA LYS A 53 138.317 6.792 8.926 1.00 0.00 C ATOM 814 C LYS A 53 137.119 6.175 9.663 1.00 0.00 C ATOM 815 O LYS A 53 136.958 6.351 10.852 1.00 0.00 O ATOM 816 CB LYS A 53 138.809 8.022 9.691 1.00 0.00 C ATOM 817 CG LYS A 53 140.086 8.550 9.034 1.00 0.00 C ATOM 818 CD LYS A 53 140.586 9.779 9.793 1.00 0.00 C ATOM 819 CE LYS A 53 141.862 10.302 9.131 1.00 0.00 C ATOM 820 NZ LYS A 53 142.394 11.447 9.920 1.00 0.00 N ATOM 0 H LYS A 53 138.534 6.914 6.804 1.00 0.00 H new ATOM 0 HA LYS A 53 139.112 6.049 8.861 1.00 0.00 H new ATOM 0 HB2 LYS A 53 138.041 8.795 9.692 1.00 0.00 H new ATOM 0 HB3 LYS A 53 139.002 7.763 10.732 1.00 0.00 H new ATOM 0 HG2 LYS A 53 140.853 7.775 9.032 1.00 0.00 H new ATOM 0 HG3 LYS A 53 139.891 8.808 7.993 1.00 0.00 H new ATOM 0 HD2 LYS A 53 139.820 10.555 9.795 1.00 0.00 H new ATOM 0 HD3 LYS A 53 140.782 9.522 10.834 1.00 0.00 H new ATOM 0 HE2 LYS A 53 142.607 9.508 9.074 1.00 0.00 H new ATOM 0 HE3 LYS A 53 141.652 10.617 8.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 142.821 12.144 9.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 141.618 11.894 10.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 143.115 11.104 10.586 1.00 0.00 H new ATOM 834 N LYS A 54 136.286 5.449 8.956 1.00 0.00 N ATOM 835 CA LYS A 54 135.093 4.797 9.586 1.00 0.00 C ATOM 836 C LYS A 54 134.164 5.852 10.206 1.00 0.00 C ATOM 837 O LYS A 54 133.347 5.539 11.049 1.00 0.00 O ATOM 838 CB LYS A 54 135.559 3.827 10.678 1.00 0.00 C ATOM 839 CG LYS A 54 136.646 2.914 10.110 1.00 0.00 C ATOM 840 CD LYS A 54 136.973 1.810 11.118 1.00 0.00 C ATOM 841 CE LYS A 54 138.224 1.058 10.661 1.00 0.00 C ATOM 842 NZ LYS A 54 138.071 0.654 9.235 1.00 0.00 N ATOM 0 H LYS A 54 136.383 5.278 7.955 1.00 0.00 H new ATOM 0 HA LYS A 54 134.544 4.255 8.816 1.00 0.00 H new ATOM 0 HB2 LYS A 54 135.944 4.382 11.534 1.00 0.00 H new ATOM 0 HB3 LYS A 54 134.718 3.232 11.036 1.00 0.00 H new ATOM 0 HG2 LYS A 54 136.310 2.474 9.171 1.00 0.00 H new ATOM 0 HG3 LYS A 54 137.542 3.494 9.888 1.00 0.00 H new ATOM 0 HD2 LYS A 54 137.135 2.241 12.106 1.00 0.00 H new ATOM 0 HD3 LYS A 54 136.133 1.121 11.205 1.00 0.00 H new ATOM 0 HE2 LYS A 54 139.104 1.691 10.778 1.00 0.00 H new ATOM 0 HE3 LYS A 54 138.379 0.177 11.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 138.808 -0.037 8.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 137.134 0.225 9.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 138.164 1.491 8.625 1.00 0.00 H new ATOM 856 N ASP A 55 134.254 7.087 9.794 1.00 0.00 N ATOM 857 CA ASP A 55 133.338 8.118 10.369 1.00 0.00 C ATOM 858 C ASP A 55 131.905 7.807 9.905 1.00 0.00 C ATOM 859 O ASP A 55 131.590 7.876 8.733 1.00 0.00 O ATOM 860 CB ASP A 55 133.765 9.502 9.879 1.00 0.00 C ATOM 861 CG ASP A 55 132.768 10.554 10.368 1.00 0.00 C ATOM 862 OD1 ASP A 55 131.591 10.403 10.084 1.00 0.00 O ATOM 863 OD2 ASP A 55 133.200 11.492 11.018 1.00 0.00 O ATOM 0 H ASP A 55 134.913 7.426 9.093 1.00 0.00 H new ATOM 0 HA ASP A 55 133.381 8.104 11.458 1.00 0.00 H new ATOM 0 HB2 ASP A 55 134.764 9.736 10.246 1.00 0.00 H new ATOM 0 HB3 ASP A 55 133.815 9.513 8.790 1.00 0.00 H new ATOM 868 N GLU A 56 131.051 7.426 10.819 1.00 0.00 N ATOM 869 CA GLU A 56 129.644 7.056 10.467 1.00 0.00 C ATOM 870 C GLU A 56 128.835 8.232 9.892 1.00 0.00 C ATOM 871 O GLU A 56 128.080 8.066 8.958 1.00 0.00 O ATOM 872 CB GLU A 56 128.952 6.546 11.736 1.00 0.00 C ATOM 873 CG GLU A 56 127.521 6.099 11.420 1.00 0.00 C ATOM 874 CD GLU A 56 126.897 5.484 12.673 1.00 0.00 C ATOM 875 OE1 GLU A 56 127.545 5.510 13.707 1.00 0.00 O ATOM 876 OE2 GLU A 56 125.785 4.991 12.578 1.00 0.00 O ATOM 0 H GLU A 56 131.272 7.354 11.812 1.00 0.00 H new ATOM 0 HA GLU A 56 129.686 6.292 9.691 1.00 0.00 H new ATOM 0 HB2 GLU A 56 129.516 5.713 12.156 1.00 0.00 H new ATOM 0 HB3 GLU A 56 128.936 7.332 12.491 1.00 0.00 H new ATOM 0 HG2 GLU A 56 126.928 6.949 11.084 1.00 0.00 H new ATOM 0 HG3 GLU A 56 127.525 5.372 10.608 1.00 0.00 H new ATOM 883 N ASP A 57 128.958 9.408 10.444 1.00 0.00 N ATOM 884 CA ASP A 57 128.156 10.560 9.924 1.00 0.00 C ATOM 885 C ASP A 57 128.638 10.961 8.530 1.00 0.00 C ATOM 886 O ASP A 57 127.853 11.264 7.654 1.00 0.00 O ATOM 887 CB ASP A 57 128.317 11.754 10.870 1.00 0.00 C ATOM 888 CG ASP A 57 127.601 11.467 12.190 1.00 0.00 C ATOM 889 OD1 ASP A 57 126.763 10.582 12.206 1.00 0.00 O ATOM 890 OD2 ASP A 57 127.903 12.139 13.163 1.00 0.00 O ATOM 0 H ASP A 57 129.574 9.624 11.228 1.00 0.00 H new ATOM 0 HA ASP A 57 127.109 10.262 9.866 1.00 0.00 H new ATOM 0 HB2 ASP A 57 129.374 11.945 11.053 1.00 0.00 H new ATOM 0 HB3 ASP A 57 127.906 12.653 10.410 1.00 0.00 H new ATOM 895 N LEU A 58 129.911 10.951 8.314 1.00 0.00 N ATOM 896 CA LEU A 58 130.420 11.318 6.965 1.00 0.00 C ATOM 897 C LEU A 58 130.055 10.212 5.976 1.00 0.00 C ATOM 898 O LEU A 58 129.685 10.468 4.848 1.00 0.00 O ATOM 899 CB LEU A 58 131.937 11.506 6.995 1.00 0.00 C ATOM 900 CG LEU A 58 132.303 12.705 7.882 1.00 0.00 C ATOM 901 CD1 LEU A 58 133.826 12.773 8.030 1.00 0.00 C ATOM 902 CD2 LEU A 58 131.781 14.015 7.254 1.00 0.00 C ATOM 0 H LEU A 58 130.623 10.708 9.003 1.00 0.00 H new ATOM 0 HA LEU A 58 129.964 12.258 6.655 1.00 0.00 H new ATOM 0 HB2 LEU A 58 132.416 10.603 7.375 1.00 0.00 H new ATOM 0 HB3 LEU A 58 132.312 11.664 5.984 1.00 0.00 H new ATOM 0 HG LEU A 58 131.842 12.581 8.862 1.00 0.00 H new ATOM 0 HD11 LEU A 58 134.093 13.622 8.659 1.00 0.00 H new ATOM 0 HD12 LEU A 58 134.188 11.853 8.489 1.00 0.00 H new ATOM 0 HD13 LEU A 58 134.282 12.892 7.047 1.00 0.00 H new ATOM 0 HD21 LEU A 58 132.048 14.857 7.893 1.00 0.00 H new ATOM 0 HD22 LEU A 58 132.230 14.151 6.270 1.00 0.00 H new ATOM 0 HD23 LEU A 58 130.697 13.964 7.155 1.00 0.00 H new ATOM 914 N PHE A 59 130.137 8.981 6.401 1.00 0.00 N ATOM 915 CA PHE A 59 129.774 7.853 5.499 1.00 0.00 C ATOM 916 C PHE A 59 128.289 7.939 5.130 1.00 0.00 C ATOM 917 O PHE A 59 127.919 7.830 3.977 1.00 0.00 O ATOM 918 CB PHE A 59 130.066 6.523 6.198 1.00 0.00 C ATOM 919 CG PHE A 59 129.646 5.375 5.306 1.00 0.00 C ATOM 920 CD1 PHE A 59 130.367 5.096 4.138 1.00 0.00 C ATOM 921 CD2 PHE A 59 128.539 4.585 5.651 1.00 0.00 C ATOM 922 CE1 PHE A 59 129.982 4.030 3.314 1.00 0.00 C ATOM 923 CE2 PHE A 59 128.155 3.520 4.827 1.00 0.00 C ATOM 924 CZ PHE A 59 128.875 3.242 3.659 1.00 0.00 C ATOM 0 H PHE A 59 130.440 8.708 7.336 1.00 0.00 H new ATOM 0 HA PHE A 59 130.367 7.914 4.587 1.00 0.00 H new ATOM 0 HB2 PHE A 59 131.129 6.448 6.428 1.00 0.00 H new ATOM 0 HB3 PHE A 59 129.531 6.474 7.146 1.00 0.00 H new ATOM 0 HD1 PHE A 59 131.220 5.703 3.872 1.00 0.00 H new ATOM 0 HD2 PHE A 59 127.983 4.798 6.552 1.00 0.00 H new ATOM 0 HE1 PHE A 59 130.538 3.815 2.413 1.00 0.00 H new ATOM 0 HE2 PHE A 59 127.303 2.912 5.093 1.00 0.00 H new ATOM 0 HZ PHE A 59 128.578 2.421 3.024 1.00 0.00 H new ATOM 934 N ARG A 60 127.429 8.111 6.106 1.00 0.00 N ATOM 935 CA ARG A 60 125.966 8.179 5.808 1.00 0.00 C ATOM 936 C ARG A 60 125.651 9.336 4.865 1.00 0.00 C ATOM 937 O ARG A 60 124.931 9.175 3.899 1.00 0.00 O ATOM 938 CB ARG A 60 125.173 8.379 7.104 1.00 0.00 C ATOM 939 CG ARG A 60 125.214 7.109 7.956 1.00 0.00 C ATOM 940 CD ARG A 60 124.382 7.325 9.221 1.00 0.00 C ATOM 941 NE ARG A 60 124.855 8.551 9.924 1.00 0.00 N ATOM 942 CZ ARG A 60 124.121 9.090 10.861 1.00 0.00 C ATOM 943 NH1 ARG A 60 123.001 8.526 11.219 1.00 0.00 N ATOM 944 NH2 ARG A 60 124.514 10.189 11.444 1.00 0.00 N ATOM 0 H ARG A 60 127.677 8.207 7.091 1.00 0.00 H new ATOM 0 HA ARG A 60 125.682 7.240 5.333 1.00 0.00 H new ATOM 0 HB2 ARG A 60 125.588 9.215 7.666 1.00 0.00 H new ATOM 0 HB3 ARG A 60 124.140 8.634 6.870 1.00 0.00 H new ATOM 0 HG2 ARG A 60 124.823 6.264 7.389 1.00 0.00 H new ATOM 0 HG3 ARG A 60 126.243 6.867 8.220 1.00 0.00 H new ATOM 0 HD2 ARG A 60 123.328 7.425 8.963 1.00 0.00 H new ATOM 0 HD3 ARG A 60 124.469 6.460 9.878 1.00 0.00 H new ATOM 0 HE ARG A 60 125.751 8.969 9.674 1.00 0.00 H new ATOM 0 HH11 ARG A 60 122.697 7.663 10.767 1.00 0.00 H new ATOM 0 HH12 ARG A 60 122.429 8.948 11.951 1.00 0.00 H new ATOM 0 HH21 ARG A 60 125.393 10.626 11.168 1.00 0.00 H new ATOM 0 HH22 ARG A 60 123.942 10.611 12.176 1.00 0.00 H new ATOM 958 N GLU A 61 126.172 10.503 5.124 1.00 0.00 N ATOM 959 CA GLU A 61 125.884 11.653 4.228 1.00 0.00 C ATOM 960 C GLU A 61 126.439 11.343 2.836 1.00 0.00 C ATOM 961 O GLU A 61 125.841 11.671 1.830 1.00 0.00 O ATOM 962 CB GLU A 61 126.552 12.910 4.799 1.00 0.00 C ATOM 963 CG GLU A 61 126.203 14.133 3.945 1.00 0.00 C ATOM 964 CD GLU A 61 124.708 14.438 4.067 1.00 0.00 C ATOM 965 OE1 GLU A 61 124.080 13.887 4.956 1.00 0.00 O ATOM 966 OE2 GLU A 61 124.216 15.222 3.271 1.00 0.00 O ATOM 0 H GLU A 61 126.782 10.708 5.915 1.00 0.00 H new ATOM 0 HA GLU A 61 124.810 11.823 4.157 1.00 0.00 H new ATOM 0 HB2 GLU A 61 126.224 13.070 5.826 1.00 0.00 H new ATOM 0 HB3 GLU A 61 127.633 12.774 4.827 1.00 0.00 H new ATOM 0 HG2 GLU A 61 126.787 14.994 4.270 1.00 0.00 H new ATOM 0 HG3 GLU A 61 126.462 13.947 2.903 1.00 0.00 H new ATOM 973 N TRP A 62 127.577 10.712 2.770 1.00 0.00 N ATOM 974 CA TRP A 62 128.174 10.380 1.444 1.00 0.00 C ATOM 975 C TRP A 62 127.280 9.417 0.647 1.00 0.00 C ATOM 976 O TRP A 62 127.022 9.627 -0.520 1.00 0.00 O ATOM 977 CB TRP A 62 129.553 9.729 1.655 1.00 0.00 C ATOM 978 CG TRP A 62 130.046 9.154 0.358 1.00 0.00 C ATOM 979 CD1 TRP A 62 130.703 9.837 -0.608 1.00 0.00 C ATOM 980 CD2 TRP A 62 129.902 7.789 -0.133 1.00 0.00 C ATOM 981 NE1 TRP A 62 130.975 8.974 -1.657 1.00 0.00 N ATOM 982 CE2 TRP A 62 130.500 7.700 -1.410 1.00 0.00 C ATOM 983 CE3 TRP A 62 129.317 6.631 0.409 1.00 0.00 C ATOM 984 CZ2 TRP A 62 130.513 6.500 -2.128 1.00 0.00 C ATOM 985 CZ3 TRP A 62 129.331 5.425 -0.308 1.00 0.00 C ATOM 986 CH2 TRP A 62 129.926 5.360 -1.574 1.00 0.00 C ATOM 0 H TRP A 62 128.122 10.411 3.578 1.00 0.00 H new ATOM 0 HA TRP A 62 128.270 11.305 0.876 1.00 0.00 H new ATOM 0 HB2 TRP A 62 130.261 10.468 2.029 1.00 0.00 H new ATOM 0 HB3 TRP A 62 129.484 8.945 2.409 1.00 0.00 H new ATOM 0 HD1 TRP A 62 130.971 10.882 -0.568 1.00 0.00 H new ATOM 0 HE1 TRP A 62 131.466 9.246 -2.508 1.00 0.00 H new ATOM 0 HE3 TRP A 62 128.854 6.670 1.384 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 130.974 6.455 -3.104 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 128.880 4.541 0.119 1.00 0.00 H new ATOM 0 HH2 TRP A 62 129.931 4.429 -2.122 1.00 0.00 H new ATOM 997 N LEU A 63 126.831 8.354 1.252 1.00 0.00 N ATOM 998 CA LEU A 63 125.986 7.377 0.502 1.00 0.00 C ATOM 999 C LEU A 63 124.615 7.973 0.170 1.00 0.00 C ATOM 1000 O LEU A 63 124.148 7.884 -0.947 1.00 0.00 O ATOM 1001 CB LEU A 63 125.812 6.106 1.349 1.00 0.00 C ATOM 1002 CG LEU A 63 124.947 5.076 0.610 1.00 0.00 C ATOM 1003 CD1 LEU A 63 125.597 4.692 -0.731 1.00 0.00 C ATOM 1004 CD2 LEU A 63 124.813 3.825 1.486 1.00 0.00 C ATOM 0 H LEU A 63 127.010 8.118 2.228 1.00 0.00 H new ATOM 0 HA LEU A 63 126.483 7.134 -0.437 1.00 0.00 H new ATOM 0 HB2 LEU A 63 126.788 5.675 1.572 1.00 0.00 H new ATOM 0 HB3 LEU A 63 125.350 6.359 2.303 1.00 0.00 H new ATOM 0 HG LEU A 63 123.966 5.507 0.412 1.00 0.00 H new ATOM 0 HD11 LEU A 63 124.971 3.961 -1.243 1.00 0.00 H new ATOM 0 HD12 LEU A 63 125.699 5.581 -1.353 1.00 0.00 H new ATOM 0 HD13 LEU A 63 126.582 4.262 -0.548 1.00 0.00 H new ATOM 0 HD21 LEU A 63 124.200 3.085 0.972 1.00 0.00 H new ATOM 0 HD22 LEU A 63 125.801 3.408 1.678 1.00 0.00 H new ATOM 0 HD23 LEU A 63 124.342 4.092 2.432 1.00 0.00 H new ATOM 1016 N LYS A 64 123.964 8.573 1.124 1.00 0.00 N ATOM 1017 CA LYS A 64 122.622 9.165 0.852 1.00 0.00 C ATOM 1018 C LYS A 64 122.742 10.266 -0.200 1.00 0.00 C ATOM 1019 O LYS A 64 121.983 10.327 -1.147 1.00 0.00 O ATOM 1020 CB LYS A 64 122.039 9.752 2.139 1.00 0.00 C ATOM 1021 CG LYS A 64 120.611 10.244 1.873 1.00 0.00 C ATOM 1022 CD LYS A 64 120.024 10.831 3.155 1.00 0.00 C ATOM 1023 CE LYS A 64 118.593 11.304 2.894 1.00 0.00 C ATOM 1024 NZ LYS A 64 118.605 12.400 1.884 1.00 0.00 N ATOM 0 H LYS A 64 124.301 8.680 2.081 1.00 0.00 H new ATOM 0 HA LYS A 64 121.961 8.382 0.481 1.00 0.00 H new ATOM 0 HB2 LYS A 64 122.035 8.998 2.926 1.00 0.00 H new ATOM 0 HB3 LYS A 64 122.660 10.576 2.490 1.00 0.00 H new ATOM 0 HG2 LYS A 64 120.616 10.997 1.085 1.00 0.00 H new ATOM 0 HG3 LYS A 64 119.991 9.419 1.522 1.00 0.00 H new ATOM 0 HD2 LYS A 64 120.032 10.082 3.947 1.00 0.00 H new ATOM 0 HD3 LYS A 64 120.636 11.665 3.499 1.00 0.00 H new ATOM 0 HE2 LYS A 64 117.984 10.473 2.537 1.00 0.00 H new ATOM 0 HE3 LYS A 64 118.141 11.655 3.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 117.720 12.943 1.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 119.412 13.030 2.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 118.691 11.993 0.931 1.00 0.00 H new ATOM 1038 N ASP A 65 123.691 11.140 -0.030 1.00 0.00 N ATOM 1039 CA ASP A 65 123.874 12.253 -1.001 1.00 0.00 C ATOM 1040 C ASP A 65 124.358 11.693 -2.339 1.00 0.00 C ATOM 1041 O ASP A 65 124.133 12.270 -3.383 1.00 0.00 O ATOM 1042 CB ASP A 65 124.908 13.238 -0.451 1.00 0.00 C ATOM 1043 CG ASP A 65 124.910 14.507 -1.303 1.00 0.00 C ATOM 1044 OD1 ASP A 65 124.799 14.386 -2.511 1.00 0.00 O ATOM 1045 OD2 ASP A 65 125.022 15.580 -0.733 1.00 0.00 O ATOM 0 H ASP A 65 124.353 11.132 0.746 1.00 0.00 H new ATOM 0 HA ASP A 65 122.924 12.767 -1.150 1.00 0.00 H new ATOM 0 HB2 ASP A 65 124.676 13.484 0.585 1.00 0.00 H new ATOM 0 HB3 ASP A 65 125.898 12.782 -0.456 1.00 0.00 H new ATOM 1050 N THR A 66 125.050 10.586 -2.313 1.00 0.00 N ATOM 1051 CA THR A 66 125.583 10.006 -3.577 1.00 0.00 C ATOM 1052 C THR A 66 124.494 9.247 -4.344 1.00 0.00 C ATOM 1053 O THR A 66 124.517 9.223 -5.560 1.00 0.00 O ATOM 1054 CB THR A 66 126.739 9.054 -3.246 1.00 0.00 C ATOM 1055 OG1 THR A 66 127.826 9.803 -2.720 1.00 0.00 O ATOM 1056 CG2 THR A 66 127.197 8.322 -4.510 1.00 0.00 C ATOM 0 H THR A 66 125.269 10.058 -1.468 1.00 0.00 H new ATOM 0 HA THR A 66 125.936 10.821 -4.210 1.00 0.00 H new ATOM 0 HB THR A 66 126.400 8.322 -2.513 1.00 0.00 H new ATOM 0 HG1 THR A 66 127.608 10.104 -1.813 1.00 0.00 H new ATOM 0 HG21 THR A 66 128.018 7.649 -4.263 1.00 0.00 H new ATOM 0 HG22 THR A 66 126.366 7.747 -4.918 1.00 0.00 H new ATOM 0 HG23 THR A 66 127.533 9.049 -5.250 1.00 0.00 H new ATOM 1064 N CYS A 67 123.564 8.591 -3.680 1.00 0.00 N ATOM 1065 CA CYS A 67 122.520 7.805 -4.425 1.00 0.00 C ATOM 1066 C CYS A 67 121.104 8.087 -3.909 1.00 0.00 C ATOM 1067 O CYS A 67 120.146 8.022 -4.654 1.00 0.00 O ATOM 1068 CB CYS A 67 122.815 6.316 -4.248 1.00 0.00 C ATOM 1069 SG CYS A 67 122.515 5.846 -2.526 1.00 0.00 S ATOM 0 H CYS A 67 123.483 8.566 -2.664 1.00 0.00 H new ATOM 0 HA CYS A 67 122.560 8.101 -5.473 1.00 0.00 H new ATOM 0 HB2 CYS A 67 122.183 5.727 -4.913 1.00 0.00 H new ATOM 0 HB3 CYS A 67 123.849 6.104 -4.520 1.00 0.00 H new ATOM 0 HG CYS A 67 123.025 6.744 -1.736 1.00 0.00 H new ATOM 1075 N GLY A 68 120.962 8.383 -2.639 1.00 0.00 N ATOM 1076 CA GLY A 68 119.602 8.657 -2.063 1.00 0.00 C ATOM 1077 C GLY A 68 119.208 7.508 -1.126 1.00 0.00 C ATOM 1078 O GLY A 68 118.058 7.360 -0.767 1.00 0.00 O ATOM 0 H GLY A 68 121.731 8.447 -1.972 1.00 0.00 H new ATOM 0 HA2 GLY A 68 119.609 9.601 -1.517 1.00 0.00 H new ATOM 0 HA3 GLY A 68 118.869 8.757 -2.863 1.00 0.00 H new ATOM 1082 N ALA A 69 120.150 6.694 -0.728 1.00 0.00 N ATOM 1083 CA ALA A 69 119.824 5.557 0.184 1.00 0.00 C ATOM 1084 C ALA A 69 119.055 6.075 1.402 1.00 0.00 C ATOM 1085 O ALA A 69 119.191 7.218 1.791 1.00 0.00 O ATOM 1086 CB ALA A 69 121.123 4.892 0.650 1.00 0.00 C ATOM 0 H ALA A 69 121.132 6.767 -0.995 1.00 0.00 H new ATOM 0 HA ALA A 69 119.209 4.832 -0.349 1.00 0.00 H new ATOM 0 HB1 ALA A 69 120.888 4.062 1.316 1.00 0.00 H new ATOM 0 HB2 ALA A 69 121.672 4.519 -0.215 1.00 0.00 H new ATOM 0 HB3 ALA A 69 121.735 5.621 1.181 1.00 0.00 H new ATOM 1092 N ASN A 70 118.239 5.247 2.006 1.00 0.00 N ATOM 1093 CA ASN A 70 117.451 5.698 3.194 1.00 0.00 C ATOM 1094 C ASN A 70 118.212 5.380 4.483 1.00 0.00 C ATOM 1095 O ASN A 70 119.237 4.728 4.473 1.00 0.00 O ATOM 1096 CB ASN A 70 116.103 4.973 3.212 1.00 0.00 C ATOM 1097 CG ASN A 70 115.325 5.307 1.938 1.00 0.00 C ATOM 1098 OD1 ASN A 70 114.949 4.423 1.195 1.00 0.00 O ATOM 1099 ND2 ASN A 70 115.067 6.555 1.652 1.00 0.00 N ATOM 0 H ASN A 70 118.085 4.278 1.727 1.00 0.00 H new ATOM 0 HA ASN A 70 117.294 6.775 3.129 1.00 0.00 H new ATOM 0 HB2 ASN A 70 116.258 3.897 3.284 1.00 0.00 H new ATOM 0 HB3 ASN A 70 115.529 5.272 4.090 1.00 0.00 H new ATOM 0 HD21 ASN A 70 114.550 6.787 0.804 1.00 0.00 H new ATOM 0 HD22 ASN A 70 115.383 7.297 2.276 1.00 0.00 H new ATOM 1106 N ALA A 71 117.718 5.859 5.593 1.00 0.00 N ATOM 1107 CA ALA A 71 118.398 5.620 6.900 1.00 0.00 C ATOM 1108 C ALA A 71 118.500 4.122 7.214 1.00 0.00 C ATOM 1109 O ALA A 71 119.461 3.679 7.805 1.00 0.00 O ATOM 1110 CB ALA A 71 117.609 6.308 8.014 1.00 0.00 C ATOM 0 H ALA A 71 116.863 6.412 5.651 1.00 0.00 H new ATOM 0 HA ALA A 71 119.407 6.028 6.836 1.00 0.00 H new ATOM 0 HB1 ALA A 71 118.103 6.135 8.970 1.00 0.00 H new ATOM 0 HB2 ALA A 71 117.562 7.379 7.818 1.00 0.00 H new ATOM 0 HB3 ALA A 71 116.599 5.901 8.049 1.00 0.00 H new ATOM 1116 N LYS A 72 117.523 3.336 6.851 1.00 0.00 N ATOM 1117 CA LYS A 72 117.609 1.880 7.178 1.00 0.00 C ATOM 1118 C LYS A 72 118.661 1.206 6.296 1.00 0.00 C ATOM 1119 O LYS A 72 119.403 0.350 6.738 1.00 0.00 O ATOM 1120 CB LYS A 72 116.247 1.220 6.954 1.00 0.00 C ATOM 1121 CG LYS A 72 115.267 1.726 8.012 1.00 0.00 C ATOM 1122 CD LYS A 72 113.898 1.075 7.804 1.00 0.00 C ATOM 1123 CE LYS A 72 112.925 1.589 8.868 1.00 0.00 C ATOM 1124 NZ LYS A 72 111.721 0.714 8.906 1.00 0.00 N ATOM 0 H LYS A 72 116.683 3.629 6.352 1.00 0.00 H new ATOM 0 HA LYS A 72 117.897 1.767 8.223 1.00 0.00 H new ATOM 0 HB2 LYS A 72 115.876 1.452 5.956 1.00 0.00 H new ATOM 0 HB3 LYS A 72 116.340 0.136 7.015 1.00 0.00 H new ATOM 0 HG2 LYS A 72 115.642 1.494 9.009 1.00 0.00 H new ATOM 0 HG3 LYS A 72 115.178 2.810 7.949 1.00 0.00 H new ATOM 0 HD2 LYS A 72 113.521 1.306 6.808 1.00 0.00 H new ATOM 0 HD3 LYS A 72 113.985 -0.010 7.868 1.00 0.00 H new ATOM 0 HE2 LYS A 72 113.410 1.600 9.844 1.00 0.00 H new ATOM 0 HE3 LYS A 72 112.634 2.616 8.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 111.060 1.064 9.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 111.255 0.725 7.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 112.006 -0.259 9.139 1.00 0.00 H new ATOM 1138 N GLN A 73 118.716 1.577 5.048 1.00 0.00 N ATOM 1139 CA GLN A 73 119.697 0.958 4.116 1.00 0.00 C ATOM 1140 C GLN A 73 121.119 1.332 4.520 1.00 0.00 C ATOM 1141 O GLN A 73 122.033 0.536 4.427 1.00 0.00 O ATOM 1142 CB GLN A 73 119.426 1.456 2.694 1.00 0.00 C ATOM 1143 CG GLN A 73 118.100 0.880 2.185 1.00 0.00 C ATOM 1144 CD GLN A 73 118.222 -0.636 2.018 1.00 0.00 C ATOM 1145 OE1 GLN A 73 117.400 -1.381 2.513 1.00 0.00 O ATOM 1146 NE2 GLN A 73 119.218 -1.126 1.336 1.00 0.00 N ATOM 0 H GLN A 73 118.117 2.289 4.630 1.00 0.00 H new ATOM 0 HA GLN A 73 119.591 -0.126 4.157 1.00 0.00 H new ATOM 0 HB2 GLN A 73 119.388 2.545 2.682 1.00 0.00 H new ATOM 0 HB3 GLN A 73 120.240 1.158 2.033 1.00 0.00 H new ATOM 0 HG2 GLN A 73 117.299 1.114 2.886 1.00 0.00 H new ATOM 0 HG3 GLN A 73 117.835 1.340 1.233 1.00 0.00 H new ATOM 0 HE21 GLN A 73 119.908 -0.500 0.920 1.00 0.00 H new ATOM 0 HE22 GLN A 73 119.308 -2.135 1.218 1.00 0.00 H new ATOM 1155 N SER A 74 121.318 2.542 4.955 1.00 0.00 N ATOM 1156 CA SER A 74 122.683 2.969 5.351 1.00 0.00 C ATOM 1157 C SER A 74 123.131 2.199 6.595 1.00 0.00 C ATOM 1158 O SER A 74 124.287 1.847 6.729 1.00 0.00 O ATOM 1159 CB SER A 74 122.682 4.467 5.644 1.00 0.00 C ATOM 1160 OG SER A 74 124.022 4.940 5.657 1.00 0.00 O ATOM 0 H SER A 74 120.594 3.253 5.053 1.00 0.00 H new ATOM 0 HA SER A 74 123.376 2.759 4.536 1.00 0.00 H new ATOM 0 HB2 SER A 74 122.103 4.998 4.888 1.00 0.00 H new ATOM 0 HB3 SER A 74 122.205 4.662 6.605 1.00 0.00 H new ATOM 0 HG SER A 74 124.095 5.732 5.084 1.00 0.00 H new ATOM 1166 N ARG A 75 122.237 1.935 7.515 1.00 0.00 N ATOM 1167 CA ARG A 75 122.623 1.194 8.750 1.00 0.00 C ATOM 1168 C ARG A 75 123.170 -0.181 8.372 1.00 0.00 C ATOM 1169 O ARG A 75 124.101 -0.667 8.981 1.00 0.00 O ATOM 1170 CB ARG A 75 121.389 1.013 9.647 1.00 0.00 C ATOM 1171 CG ARG A 75 120.915 2.365 10.204 1.00 0.00 C ATOM 1172 CD ARG A 75 121.748 2.780 11.423 1.00 0.00 C ATOM 1173 NE ARG A 75 121.283 4.118 11.886 1.00 0.00 N ATOM 1174 CZ ARG A 75 121.639 4.567 13.058 1.00 0.00 C ATOM 1175 NH1 ARG A 75 122.417 3.851 13.822 1.00 0.00 N ATOM 1176 NH2 ARG A 75 121.218 5.734 13.463 1.00 0.00 N ATOM 0 H ARG A 75 121.254 2.203 7.462 1.00 0.00 H new ATOM 0 HA ARG A 75 123.387 1.759 9.284 1.00 0.00 H new ATOM 0 HB2 ARG A 75 120.585 0.548 9.077 1.00 0.00 H new ATOM 0 HB3 ARG A 75 121.628 0.339 10.470 1.00 0.00 H new ATOM 0 HG2 ARG A 75 120.992 3.128 9.430 1.00 0.00 H new ATOM 0 HG3 ARG A 75 119.863 2.299 10.483 1.00 0.00 H new ATOM 0 HD2 ARG A 75 121.641 2.046 12.221 1.00 0.00 H new ATOM 0 HD3 ARG A 75 122.806 2.817 11.163 1.00 0.00 H new ATOM 0 HE ARG A 75 120.685 4.684 11.285 1.00 0.00 H new ATOM 0 HH11 ARG A 75 122.747 2.940 13.503 1.00 0.00 H new ATOM 0 HH12 ARG A 75 122.695 4.202 14.738 1.00 0.00 H new ATOM 0 HH21 ARG A 75 120.612 6.294 12.863 1.00 0.00 H new ATOM 0 HH22 ARG A 75 121.495 6.086 14.379 1.00 0.00 H new ATOM 1190 N ASP A 76 122.591 -0.835 7.401 1.00 0.00 N ATOM 1191 CA ASP A 76 123.063 -2.196 7.023 1.00 0.00 C ATOM 1192 C ASP A 76 124.466 -2.136 6.420 1.00 0.00 C ATOM 1193 O ASP A 76 125.295 -2.981 6.688 1.00 0.00 O ATOM 1194 CB ASP A 76 122.100 -2.795 5.998 1.00 0.00 C ATOM 1195 CG ASP A 76 120.768 -3.119 6.676 1.00 0.00 C ATOM 1196 OD1 ASP A 76 120.745 -3.180 7.894 1.00 0.00 O ATOM 1197 OD2 ASP A 76 119.793 -3.302 5.965 1.00 0.00 O ATOM 0 H ASP A 76 121.808 -0.482 6.851 1.00 0.00 H new ATOM 0 HA ASP A 76 123.095 -2.816 7.919 1.00 0.00 H new ATOM 0 HB2 ASP A 76 121.942 -2.093 5.179 1.00 0.00 H new ATOM 0 HB3 ASP A 76 122.529 -3.699 5.565 1.00 0.00 H new ATOM 1202 N CYS A 77 124.747 -1.155 5.613 1.00 0.00 N ATOM 1203 CA CYS A 77 126.105 -1.068 5.009 1.00 0.00 C ATOM 1204 C CYS A 77 127.141 -0.758 6.091 1.00 0.00 C ATOM 1205 O CYS A 77 128.239 -1.280 6.067 1.00 0.00 O ATOM 1206 CB CYS A 77 126.123 0.042 3.957 1.00 0.00 C ATOM 1207 SG CYS A 77 125.136 -0.465 2.527 1.00 0.00 S ATOM 0 H CYS A 77 124.100 -0.413 5.346 1.00 0.00 H new ATOM 0 HA CYS A 77 126.350 -2.022 4.543 1.00 0.00 H new ATOM 0 HB2 CYS A 77 125.724 0.964 4.379 1.00 0.00 H new ATOM 0 HB3 CYS A 77 127.148 0.250 3.650 1.00 0.00 H new ATOM 0 HG CYS A 77 125.004 -1.758 2.527 1.00 0.00 H new ATOM 1213 N PHE A 78 126.828 0.100 7.024 1.00 0.00 N ATOM 1214 CA PHE A 78 127.834 0.438 8.069 1.00 0.00 C ATOM 1215 C PHE A 78 128.255 -0.820 8.827 1.00 0.00 C ATOM 1216 O PHE A 78 129.413 -1.192 8.840 1.00 0.00 O ATOM 1217 CB PHE A 78 127.220 1.432 9.054 1.00 0.00 C ATOM 1218 CG PHE A 78 128.229 1.767 10.125 1.00 0.00 C ATOM 1219 CD1 PHE A 78 128.287 0.997 11.294 1.00 0.00 C ATOM 1220 CD2 PHE A 78 129.107 2.841 9.951 1.00 0.00 C ATOM 1221 CE1 PHE A 78 129.222 1.304 12.288 1.00 0.00 C ATOM 1222 CE2 PHE A 78 130.044 3.148 10.945 1.00 0.00 C ATOM 1223 CZ PHE A 78 130.101 2.379 12.114 1.00 0.00 C ATOM 0 H PHE A 78 125.930 0.576 7.107 1.00 0.00 H new ATOM 0 HA PHE A 78 128.710 0.875 7.589 1.00 0.00 H new ATOM 0 HB2 PHE A 78 126.915 2.338 8.530 1.00 0.00 H new ATOM 0 HB3 PHE A 78 126.323 1.007 9.504 1.00 0.00 H new ATOM 0 HD1 PHE A 78 127.610 0.166 11.428 1.00 0.00 H new ATOM 0 HD2 PHE A 78 129.062 3.434 9.050 1.00 0.00 H new ATOM 0 HE1 PHE A 78 129.266 0.711 13.190 1.00 0.00 H new ATOM 0 HE2 PHE A 78 130.722 3.977 10.810 1.00 0.00 H new ATOM 0 HZ PHE A 78 130.823 2.616 12.881 1.00 0.00 H new ATOM 1233 N GLY A 79 127.329 -1.469 9.474 1.00 0.00 N ATOM 1234 CA GLY A 79 127.673 -2.694 10.249 1.00 0.00 C ATOM 1235 C GLY A 79 128.222 -3.778 9.319 1.00 0.00 C ATOM 1236 O GLY A 79 129.067 -4.561 9.697 1.00 0.00 O ATOM 0 H GLY A 79 126.345 -1.203 9.500 1.00 0.00 H new ATOM 0 HA2 GLY A 79 128.412 -2.453 11.013 1.00 0.00 H new ATOM 0 HA3 GLY A 79 126.788 -3.064 10.767 1.00 0.00 H new ATOM 1240 N CYS A 80 127.750 -3.831 8.110 1.00 0.00 N ATOM 1241 CA CYS A 80 128.256 -4.873 7.173 1.00 0.00 C ATOM 1242 C CYS A 80 129.712 -4.575 6.807 1.00 0.00 C ATOM 1243 O CYS A 80 130.569 -5.433 6.885 1.00 0.00 O ATOM 1244 CB CYS A 80 127.400 -4.880 5.906 1.00 0.00 C ATOM 1245 SG CYS A 80 127.968 -6.197 4.801 1.00 0.00 S ATOM 0 H CYS A 80 127.041 -3.205 7.729 1.00 0.00 H new ATOM 0 HA CYS A 80 128.199 -5.849 7.655 1.00 0.00 H new ATOM 0 HB2 CYS A 80 126.352 -5.033 6.163 1.00 0.00 H new ATOM 0 HB3 CYS A 80 127.467 -3.915 5.404 1.00 0.00 H new ATOM 0 HG CYS A 80 128.144 -5.715 3.607 1.00 0.00 H new ATOM 1251 N LEU A 81 130.004 -3.363 6.425 1.00 0.00 N ATOM 1252 CA LEU A 81 131.413 -3.029 6.079 1.00 0.00 C ATOM 1253 C LEU A 81 132.261 -3.031 7.357 1.00 0.00 C ATOM 1254 O LEU A 81 133.386 -3.490 7.364 1.00 0.00 O ATOM 1255 CB LEU A 81 131.468 -1.644 5.431 1.00 0.00 C ATOM 1256 CG LEU A 81 130.669 -1.646 4.121 1.00 0.00 C ATOM 1257 CD1 LEU A 81 130.542 -0.208 3.610 1.00 0.00 C ATOM 1258 CD2 LEU A 81 131.378 -2.511 3.059 1.00 0.00 C ATOM 0 H LEU A 81 129.336 -2.597 6.338 1.00 0.00 H new ATOM 0 HA LEU A 81 131.802 -3.769 5.380 1.00 0.00 H new ATOM 0 HB2 LEU A 81 131.061 -0.898 6.113 1.00 0.00 H new ATOM 0 HB3 LEU A 81 132.504 -1.366 5.235 1.00 0.00 H new ATOM 0 HG LEU A 81 129.680 -2.064 4.307 1.00 0.00 H new ATOM 0 HD11 LEU A 81 129.975 -0.201 2.679 1.00 0.00 H new ATOM 0 HD12 LEU A 81 130.025 0.398 4.354 1.00 0.00 H new ATOM 0 HD13 LEU A 81 131.535 0.204 3.433 1.00 0.00 H new ATOM 0 HD21 LEU A 81 130.798 -2.502 2.136 1.00 0.00 H new ATOM 0 HD22 LEU A 81 132.373 -2.109 2.867 1.00 0.00 H new ATOM 0 HD23 LEU A 81 131.465 -3.535 3.423 1.00 0.00 H new ATOM 1270 N ARG A 82 131.733 -2.519 8.438 1.00 0.00 N ATOM 1271 CA ARG A 82 132.518 -2.494 9.709 1.00 0.00 C ATOM 1272 C ARG A 82 132.852 -3.927 10.132 1.00 0.00 C ATOM 1273 O ARG A 82 133.936 -4.207 10.604 1.00 0.00 O ATOM 1274 CB ARG A 82 131.703 -1.801 10.810 1.00 0.00 C ATOM 1275 CG ARG A 82 132.510 -1.775 12.117 1.00 0.00 C ATOM 1276 CD ARG A 82 131.709 -1.051 13.203 1.00 0.00 C ATOM 1277 NE ARG A 82 132.499 -1.031 14.468 1.00 0.00 N ATOM 1278 CZ ARG A 82 132.152 -0.234 15.443 1.00 0.00 C ATOM 1279 NH1 ARG A 82 131.120 0.554 15.310 1.00 0.00 N ATOM 1280 NH2 ARG A 82 132.840 -0.225 16.553 1.00 0.00 N ATOM 0 H ARG A 82 130.797 -2.119 8.497 1.00 0.00 H new ATOM 0 HA ARG A 82 133.444 -1.940 9.551 1.00 0.00 H new ATOM 0 HB2 ARG A 82 131.454 -0.784 10.505 1.00 0.00 H new ATOM 0 HB3 ARG A 82 130.761 -2.328 10.964 1.00 0.00 H new ATOM 0 HG2 ARG A 82 132.737 -2.792 12.436 1.00 0.00 H new ATOM 0 HG3 ARG A 82 133.463 -1.271 11.957 1.00 0.00 H new ATOM 0 HD2 ARG A 82 131.483 -0.033 12.886 1.00 0.00 H new ATOM 0 HD3 ARG A 82 130.756 -1.554 13.364 1.00 0.00 H new ATOM 0 HE ARG A 82 133.311 -1.640 14.572 1.00 0.00 H new ATOM 0 HH11 ARG A 82 130.582 0.548 14.443 1.00 0.00 H new ATOM 0 HH12 ARG A 82 130.851 1.175 16.073 1.00 0.00 H new ATOM 0 HH21 ARG A 82 133.647 -0.840 16.658 1.00 0.00 H new ATOM 0 HH22 ARG A 82 132.570 0.397 17.315 1.00 0.00 H new ATOM 1294 N GLU A 83 131.928 -4.835 9.978 1.00 0.00 N ATOM 1295 CA GLU A 83 132.184 -6.248 10.380 1.00 0.00 C ATOM 1296 C GLU A 83 133.198 -6.907 9.441 1.00 0.00 C ATOM 1297 O GLU A 83 134.059 -7.643 9.881 1.00 0.00 O ATOM 1298 CB GLU A 83 130.868 -7.031 10.350 1.00 0.00 C ATOM 1299 CG GLU A 83 129.992 -6.605 11.531 1.00 0.00 C ATOM 1300 CD GLU A 83 130.558 -7.191 12.825 1.00 0.00 C ATOM 1301 OE1 GLU A 83 131.077 -8.294 12.774 1.00 0.00 O ATOM 1302 OE2 GLU A 83 130.464 -6.527 13.844 1.00 0.00 O ATOM 0 H GLU A 83 131.002 -4.658 9.589 1.00 0.00 H new ATOM 0 HA GLU A 83 132.596 -6.255 11.389 1.00 0.00 H new ATOM 0 HB2 GLU A 83 130.345 -6.848 9.411 1.00 0.00 H new ATOM 0 HB3 GLU A 83 131.068 -8.101 10.400 1.00 0.00 H new ATOM 0 HG2 GLU A 83 129.956 -5.518 11.597 1.00 0.00 H new ATOM 0 HG3 GLU A 83 128.969 -6.949 11.381 1.00 0.00 H new ATOM 1309 N TRP A 84 133.135 -6.648 8.159 1.00 0.00 N ATOM 1310 CA TRP A 84 134.125 -7.264 7.228 1.00 0.00 C ATOM 1311 C TRP A 84 135.530 -6.800 7.630 1.00 0.00 C ATOM 1312 O TRP A 84 136.470 -7.568 7.655 1.00 0.00 O ATOM 1313 CB TRP A 84 133.821 -6.825 5.793 1.00 0.00 C ATOM 1314 CG TRP A 84 134.674 -7.597 4.839 1.00 0.00 C ATOM 1315 CD1 TRP A 84 134.310 -8.751 4.232 1.00 0.00 C ATOM 1316 CD2 TRP A 84 136.023 -7.299 4.372 1.00 0.00 C ATOM 1317 NE1 TRP A 84 135.346 -9.178 3.421 1.00 0.00 N ATOM 1318 CE2 TRP A 84 136.423 -8.317 3.474 1.00 0.00 C ATOM 1319 CE3 TRP A 84 136.927 -6.255 4.637 1.00 0.00 C ATOM 1320 CZ2 TRP A 84 137.676 -8.300 2.861 1.00 0.00 C ATOM 1321 CZ3 TRP A 84 138.191 -6.235 4.021 1.00 0.00 C ATOM 1322 CH2 TRP A 84 138.564 -7.256 3.136 1.00 0.00 C ATOM 0 H TRP A 84 132.444 -6.040 7.720 1.00 0.00 H new ATOM 0 HA TRP A 84 134.066 -8.351 7.283 1.00 0.00 H new ATOM 0 HB2 TRP A 84 132.767 -6.989 5.568 1.00 0.00 H new ATOM 0 HB3 TRP A 84 134.009 -5.757 5.682 1.00 0.00 H new ATOM 0 HD1 TRP A 84 133.364 -9.256 4.360 1.00 0.00 H new ATOM 0 HE1 TRP A 84 135.317 -10.025 2.854 1.00 0.00 H new ATOM 0 HE3 TRP A 84 136.649 -5.464 5.318 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 137.958 -9.088 2.179 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 138.878 -5.429 4.231 1.00 0.00 H new ATOM 0 HH2 TRP A 84 139.537 -7.236 2.667 1.00 0.00 H new ATOM 1333 N CYS A 85 135.672 -5.538 7.935 1.00 0.00 N ATOM 1334 CA CYS A 85 137.010 -5.007 8.332 1.00 0.00 C ATOM 1335 C CYS A 85 137.495 -5.730 9.591 1.00 0.00 C ATOM 1336 O CYS A 85 138.658 -6.054 9.729 1.00 0.00 O ATOM 1337 CB CYS A 85 136.897 -3.508 8.617 1.00 0.00 C ATOM 1338 SG CYS A 85 136.613 -2.618 7.066 1.00 0.00 S ATOM 0 H CYS A 85 134.919 -4.850 7.927 1.00 0.00 H new ATOM 0 HA CYS A 85 137.721 -5.172 7.523 1.00 0.00 H new ATOM 0 HB2 CYS A 85 136.078 -3.320 9.312 1.00 0.00 H new ATOM 0 HB3 CYS A 85 137.809 -3.148 9.094 1.00 0.00 H new ATOM 0 HG CYS A 85 135.351 -2.676 6.757 1.00 0.00 H new ATOM 1344 N ASP A 86 136.607 -5.978 10.511 1.00 0.00 N ATOM 1345 CA ASP A 86 136.993 -6.670 11.772 1.00 0.00 C ATOM 1346 C ASP A 86 137.586 -8.048 11.461 1.00 0.00 C ATOM 1347 O ASP A 86 138.438 -8.542 12.172 1.00 0.00 O ATOM 1348 CB ASP A 86 135.753 -6.846 12.652 1.00 0.00 C ATOM 1349 CG ASP A 86 135.304 -5.486 13.186 1.00 0.00 C ATOM 1350 OD1 ASP A 86 136.128 -4.587 13.230 1.00 0.00 O ATOM 1351 OD2 ASP A 86 134.143 -5.366 13.542 1.00 0.00 O ATOM 0 H ASP A 86 135.620 -5.729 10.443 1.00 0.00 H new ATOM 0 HA ASP A 86 137.739 -6.069 12.291 1.00 0.00 H new ATOM 0 HB2 ASP A 86 134.949 -7.305 12.077 1.00 0.00 H new ATOM 0 HB3 ASP A 86 135.976 -7.518 13.481 1.00 0.00 H new ATOM 1356 N ALA A 87 137.127 -8.683 10.416 1.00 0.00 N ATOM 1357 CA ALA A 87 137.650 -10.042 10.081 1.00 0.00 C ATOM 1358 C ALA A 87 138.908 -9.931 9.219 1.00 0.00 C ATOM 1359 O ALA A 87 139.795 -10.758 9.301 1.00 0.00 O ATOM 1360 CB ALA A 87 136.583 -10.819 9.306 1.00 0.00 C ATOM 0 H ALA A 87 136.415 -8.322 9.781 1.00 0.00 H new ATOM 0 HA ALA A 87 137.896 -10.562 11.007 1.00 0.00 H new ATOM 0 HB1 ALA A 87 136.962 -11.811 9.060 1.00 0.00 H new ATOM 0 HB2 ALA A 87 135.686 -10.915 9.918 1.00 0.00 H new ATOM 0 HB3 ALA A 87 136.340 -10.286 8.387 1.00 0.00 H new ATOM 1366 N PHE A 88 138.976 -8.942 8.362 1.00 0.00 N ATOM 1367 CA PHE A 88 140.161 -8.804 7.459 1.00 0.00 C ATOM 1368 C PHE A 88 141.043 -7.633 7.892 1.00 0.00 C ATOM 1369 O PHE A 88 141.986 -7.799 8.641 1.00 0.00 O ATOM 1370 CB PHE A 88 139.673 -8.552 6.031 1.00 0.00 C ATOM 1371 CG PHE A 88 139.002 -9.794 5.493 1.00 0.00 C ATOM 1372 CD1 PHE A 88 139.775 -10.813 4.923 1.00 0.00 C ATOM 1373 CD2 PHE A 88 137.609 -9.928 5.560 1.00 0.00 C ATOM 1374 CE1 PHE A 88 139.157 -11.965 4.421 1.00 0.00 C ATOM 1375 CE2 PHE A 88 136.990 -11.080 5.056 1.00 0.00 C ATOM 1376 CZ PHE A 88 137.765 -12.098 4.486 1.00 0.00 C ATOM 0 H PHE A 88 138.261 -8.223 8.249 1.00 0.00 H new ATOM 0 HA PHE A 88 140.746 -9.722 7.510 1.00 0.00 H new ATOM 0 HB2 PHE A 88 138.974 -7.715 6.018 1.00 0.00 H new ATOM 0 HB3 PHE A 88 140.513 -8.276 5.393 1.00 0.00 H new ATOM 0 HD1 PHE A 88 140.849 -10.710 4.870 1.00 0.00 H new ATOM 0 HD2 PHE A 88 137.012 -9.143 6.000 1.00 0.00 H new ATOM 0 HE1 PHE A 88 139.755 -12.751 3.984 1.00 0.00 H new ATOM 0 HE2 PHE A 88 135.916 -11.183 5.107 1.00 0.00 H new ATOM 0 HZ PHE A 88 137.289 -12.986 4.097 1.00 0.00 H new ATOM 1386 N LEU A 89 140.752 -6.449 7.419 1.00 0.00 N ATOM 1387 CA LEU A 89 141.575 -5.257 7.785 1.00 0.00 C ATOM 1388 C LEU A 89 141.042 -4.645 9.082 1.00 0.00 C ATOM 1389 O LEU A 89 141.653 -4.869 10.114 1.00 0.00 O ATOM 1390 CB LEU A 89 141.487 -4.233 6.642 1.00 0.00 C ATOM 1391 CG LEU A 89 142.088 -2.885 7.069 1.00 0.00 C ATOM 1392 CD1 LEU A 89 143.487 -3.098 7.656 1.00 0.00 C ATOM 1393 CD2 LEU A 89 142.183 -1.962 5.845 1.00 0.00 C ATOM 1394 OXT LEU A 89 140.032 -3.963 9.023 1.00 0.00 O ATOM 0 H LEU A 89 139.973 -6.255 6.790 1.00 0.00 H new ATOM 0 HA LEU A 89 142.614 -5.549 7.938 1.00 0.00 H new ATOM 0 HB2 LEU A 89 142.016 -4.611 5.767 1.00 0.00 H new ATOM 0 HB3 LEU A 89 140.446 -4.096 6.350 1.00 0.00 H new ATOM 0 HG LEU A 89 141.449 -2.430 7.826 1.00 0.00 H new ATOM 0 HD11 LEU A 89 143.906 -2.137 7.956 1.00 0.00 H new ATOM 0 HD12 LEU A 89 143.421 -3.753 8.525 1.00 0.00 H new ATOM 0 HD13 LEU A 89 144.131 -3.556 6.905 1.00 0.00 H new ATOM 0 HD21 LEU A 89 142.609 -1.004 6.144 1.00 0.00 H new ATOM 0 HD22 LEU A 89 142.820 -2.423 5.090 1.00 0.00 H new ATOM 0 HD23 LEU A 89 141.187 -1.803 5.431 1.00 0.00 H new TER 1406 LEU A 89 ATOM 1407 N MET B 1 169.105 -3.565 -4.222 1.00 0.00 N ATOM 1408 CA MET B 1 168.862 -4.964 -4.670 1.00 0.00 C ATOM 1409 C MET B 1 167.945 -5.666 -3.667 1.00 0.00 C ATOM 1410 O MET B 1 166.789 -5.920 -3.941 1.00 0.00 O ATOM 1411 CB MET B 1 170.194 -5.713 -4.753 1.00 0.00 C ATOM 1412 CG MET B 1 169.966 -7.100 -5.355 1.00 0.00 C ATOM 1413 SD MET B 1 171.543 -7.982 -5.452 1.00 0.00 S ATOM 1414 CE MET B 1 170.875 -9.591 -5.943 1.00 0.00 C ATOM 0 H1 MET B 1 169.728 -3.086 -4.903 1.00 0.00 H new ATOM 0 H2 MET B 1 168.200 -3.057 -4.164 1.00 0.00 H new ATOM 0 H3 MET B 1 169.557 -3.574 -3.285 1.00 0.00 H new ATOM 0 HA MET B 1 168.390 -4.954 -5.652 1.00 0.00 H new ATOM 0 HB2 MET B 1 170.901 -5.152 -5.364 1.00 0.00 H new ATOM 0 HB3 MET B 1 170.634 -5.804 -3.760 1.00 0.00 H new ATOM 0 HG2 MET B 1 169.260 -7.662 -4.744 1.00 0.00 H new ATOM 0 HG3 MET B 1 169.526 -7.009 -6.348 1.00 0.00 H new ATOM 0 HE1 MET B 1 171.692 -10.303 -6.062 1.00 0.00 H new ATOM 0 HE2 MET B 1 170.189 -9.950 -5.175 1.00 0.00 H new ATOM 0 HE3 MET B 1 170.341 -9.490 -6.888 1.00 0.00 H new ATOM 1426 N THR B 2 168.452 -5.982 -2.507 1.00 0.00 N ATOM 1427 CA THR B 2 167.609 -6.666 -1.487 1.00 0.00 C ATOM 1428 C THR B 2 166.740 -5.631 -0.771 1.00 0.00 C ATOM 1429 O THR B 2 167.202 -4.575 -0.386 1.00 0.00 O ATOM 1430 CB THR B 2 168.508 -7.372 -0.470 1.00 0.00 C ATOM 1431 OG1 THR B 2 169.402 -8.240 -1.154 1.00 0.00 O ATOM 1432 CG2 THR B 2 167.645 -8.184 0.497 1.00 0.00 C ATOM 0 H THR B 2 169.413 -5.796 -2.222 1.00 0.00 H new ATOM 0 HA THR B 2 166.970 -7.402 -1.976 1.00 0.00 H new ATOM 0 HB THR B 2 169.078 -6.631 0.090 1.00 0.00 H new ATOM 0 HG1 THR B 2 169.980 -8.692 -0.505 1.00 0.00 H new ATOM 0 HG21 THR B 2 168.285 -8.687 1.222 1.00 0.00 H new ATOM 0 HG22 THR B 2 166.959 -7.518 1.020 1.00 0.00 H new ATOM 0 HG23 THR B 2 167.075 -8.927 -0.060 1.00 0.00 H new ATOM 1440 N THR B 3 165.482 -5.924 -0.592 1.00 0.00 N ATOM 1441 CA THR B 3 164.580 -4.958 0.095 1.00 0.00 C ATOM 1442 C THR B 3 164.850 -4.974 1.601 1.00 0.00 C ATOM 1443 O THR B 3 165.408 -5.912 2.135 1.00 0.00 O ATOM 1444 CB THR B 3 163.123 -5.348 -0.165 1.00 0.00 C ATOM 1445 OG1 THR B 3 162.919 -6.700 0.221 1.00 0.00 O ATOM 1446 CG2 THR B 3 162.810 -5.183 -1.653 1.00 0.00 C ATOM 0 H THR B 3 165.039 -6.792 -0.892 1.00 0.00 H new ATOM 0 HA THR B 3 164.766 -3.956 -0.292 1.00 0.00 H new ATOM 0 HB THR B 3 162.463 -4.704 0.416 1.00 0.00 H new ATOM 0 HG1 THR B 3 161.986 -6.950 0.056 1.00 0.00 H new ATOM 0 HG21 THR B 3 161.773 -5.460 -1.840 1.00 0.00 H new ATOM 0 HG22 THR B 3 162.966 -4.144 -1.945 1.00 0.00 H new ATOM 0 HG23 THR B 3 163.468 -5.826 -2.237 1.00 0.00 H new ATOM 1454 N SER B 4 164.452 -3.938 2.288 1.00 0.00 N ATOM 1455 CA SER B 4 164.676 -3.881 3.759 1.00 0.00 C ATOM 1456 C SER B 4 163.769 -4.902 4.447 1.00 0.00 C ATOM 1457 O SER B 4 162.793 -5.365 3.891 1.00 0.00 O ATOM 1458 CB SER B 4 164.346 -2.480 4.270 1.00 0.00 C ATOM 1459 OG SER B 4 162.941 -2.272 4.187 1.00 0.00 O ATOM 0 H SER B 4 163.979 -3.126 1.891 1.00 0.00 H new ATOM 0 HA SER B 4 165.718 -4.111 3.980 1.00 0.00 H new ATOM 0 HB2 SER B 4 164.682 -2.367 5.301 1.00 0.00 H new ATOM 0 HB3 SER B 4 164.872 -1.731 3.679 1.00 0.00 H new ATOM 0 HG SER B 4 162.723 -1.375 4.515 1.00 0.00 H new ATOM 1465 N GLN B 5 164.109 -5.270 5.650 1.00 0.00 N ATOM 1466 CA GLN B 5 163.304 -6.277 6.395 1.00 0.00 C ATOM 1467 C GLN B 5 161.870 -5.781 6.595 1.00 0.00 C ATOM 1468 O GLN B 5 160.958 -6.564 6.763 1.00 0.00 O ATOM 1469 CB GLN B 5 163.951 -6.536 7.759 1.00 0.00 C ATOM 1470 CG GLN B 5 165.294 -7.247 7.563 1.00 0.00 C ATOM 1471 CD GLN B 5 166.318 -6.253 7.012 1.00 0.00 C ATOM 1472 OE1 GLN B 5 166.427 -5.145 7.498 1.00 0.00 O ATOM 1473 NE2 GLN B 5 167.076 -6.603 6.009 1.00 0.00 N ATOM 0 H GLN B 5 164.920 -4.912 6.155 1.00 0.00 H new ATOM 0 HA GLN B 5 163.275 -7.200 5.816 1.00 0.00 H new ATOM 0 HB2 GLN B 5 164.100 -5.594 8.287 1.00 0.00 H new ATOM 0 HB3 GLN B 5 163.291 -7.146 8.376 1.00 0.00 H new ATOM 0 HG2 GLN B 5 165.643 -7.658 8.511 1.00 0.00 H new ATOM 0 HG3 GLN B 5 165.178 -8.085 6.876 1.00 0.00 H new ATOM 0 HE21 GLN B 5 166.985 -7.533 5.601 1.00 0.00 H new ATOM 0 HE22 GLN B 5 167.760 -5.946 5.633 1.00 0.00 H new ATOM 1482 N LYS B 6 161.654 -4.490 6.581 1.00 0.00 N ATOM 1483 CA LYS B 6 160.272 -3.966 6.774 1.00 0.00 C ATOM 1484 C LYS B 6 159.358 -4.466 5.652 1.00 0.00 C ATOM 1485 O LYS B 6 158.201 -4.763 5.874 1.00 0.00 O ATOM 1486 CB LYS B 6 160.300 -2.435 6.767 1.00 0.00 C ATOM 1487 CG LYS B 6 160.985 -1.936 8.041 1.00 0.00 C ATOM 1488 CD LYS B 6 161.018 -0.406 8.044 1.00 0.00 C ATOM 1489 CE LYS B 6 161.618 0.088 9.363 1.00 0.00 C ATOM 1490 NZ LYS B 6 160.609 -0.063 10.449 1.00 0.00 N ATOM 0 H LYS B 6 162.373 -3.780 6.445 1.00 0.00 H new ATOM 0 HA LYS B 6 159.888 -4.321 7.730 1.00 0.00 H new ATOM 0 HB2 LYS B 6 160.834 -2.074 5.888 1.00 0.00 H new ATOM 0 HB3 LYS B 6 159.285 -2.042 6.708 1.00 0.00 H new ATOM 0 HG2 LYS B 6 160.451 -2.299 8.919 1.00 0.00 H new ATOM 0 HG3 LYS B 6 161.999 -2.331 8.099 1.00 0.00 H new ATOM 0 HD2 LYS B 6 161.610 -0.043 7.204 1.00 0.00 H new ATOM 0 HD3 LYS B 6 160.010 -0.009 7.919 1.00 0.00 H new ATOM 0 HE2 LYS B 6 162.516 -0.481 9.603 1.00 0.00 H new ATOM 0 HE3 LYS B 6 161.917 1.132 9.271 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 160.921 0.465 11.289 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 159.693 0.309 10.126 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 160.507 -1.069 10.691 1.00 0.00 H new ATOM 1504 N HIS B 7 159.854 -4.548 4.450 1.00 0.00 N ATOM 1505 CA HIS B 7 158.994 -5.010 3.323 1.00 0.00 C ATOM 1506 C HIS B 7 158.446 -6.413 3.608 1.00 0.00 C ATOM 1507 O HIS B 7 157.261 -6.657 3.500 1.00 0.00 O ATOM 1508 CB HIS B 7 159.831 -5.031 2.037 1.00 0.00 C ATOM 1509 CG HIS B 7 159.072 -5.709 0.925 1.00 0.00 C ATOM 1510 ND1 HIS B 7 158.187 -5.027 0.101 1.00 0.00 N ATOM 1511 CD2 HIS B 7 159.068 -7.010 0.482 1.00 0.00 C ATOM 1512 CE1 HIS B 7 157.695 -5.914 -0.788 1.00 0.00 C ATOM 1513 NE2 HIS B 7 158.201 -7.132 -0.595 1.00 0.00 N ATOM 0 H HIS B 7 160.815 -4.316 4.198 1.00 0.00 H new ATOM 0 HA HIS B 7 158.151 -4.328 3.209 1.00 0.00 H new ATOM 0 HB2 HIS B 7 160.084 -4.012 1.744 1.00 0.00 H new ATOM 0 HB3 HIS B 7 160.770 -5.554 2.216 1.00 0.00 H new ATOM 0 HD2 HIS B 7 159.650 -7.814 0.907 1.00 0.00 H new ATOM 0 HE1 HIS B 7 156.980 -5.668 -1.560 1.00 0.00 H new ATOM 0 HE2 HIS B 7 157.994 -7.977 -1.127 1.00 0.00 H new ATOM 1521 N ARG B 8 159.297 -7.338 3.969 1.00 0.00 N ATOM 1522 CA ARG B 8 158.829 -8.722 4.256 1.00 0.00 C ATOM 1523 C ARG B 8 158.017 -8.744 5.550 1.00 0.00 C ATOM 1524 O ARG B 8 157.089 -9.515 5.701 1.00 0.00 O ATOM 1525 CB ARG B 8 160.044 -9.640 4.401 1.00 0.00 C ATOM 1526 CG ARG B 8 160.706 -9.824 3.034 1.00 0.00 C ATOM 1527 CD ARG B 8 161.922 -10.741 3.172 1.00 0.00 C ATOM 1528 NE ARG B 8 162.568 -10.901 1.838 1.00 0.00 N ATOM 1529 CZ ARG B 8 163.760 -11.425 1.746 1.00 0.00 C ATOM 1530 NH1 ARG B 8 164.377 -11.834 2.821 1.00 0.00 N ATOM 1531 NH2 ARG B 8 164.332 -11.545 0.580 1.00 0.00 N ATOM 0 H ARG B 8 160.301 -7.191 4.077 1.00 0.00 H new ATOM 0 HA ARG B 8 158.198 -9.067 3.437 1.00 0.00 H new ATOM 0 HB2 ARG B 8 160.755 -9.212 5.107 1.00 0.00 H new ATOM 0 HB3 ARG B 8 159.738 -10.606 4.803 1.00 0.00 H new ATOM 0 HG2 ARG B 8 159.994 -10.252 2.328 1.00 0.00 H new ATOM 0 HG3 ARG B 8 161.011 -8.857 2.633 1.00 0.00 H new ATOM 0 HD2 ARG B 8 162.631 -10.320 3.885 1.00 0.00 H new ATOM 0 HD3 ARG B 8 161.618 -11.713 3.561 1.00 0.00 H new ATOM 0 HE ARG B 8 162.078 -10.600 0.996 1.00 0.00 H new ATOM 0 HH11 ARG B 8 163.928 -11.744 3.732 1.00 0.00 H new ATOM 0 HH12 ARG B 8 165.308 -12.244 2.750 1.00 0.00 H new ATOM 0 HH21 ARG B 8 163.848 -11.229 -0.260 1.00 0.00 H new ATOM 0 HH22 ARG B 8 165.263 -11.954 0.509 1.00 0.00 H new ATOM 1545 N ASP B 9 158.358 -7.905 6.481 1.00 0.00 N ATOM 1546 CA ASP B 9 157.610 -7.873 7.766 1.00 0.00 C ATOM 1547 C ASP B 9 156.227 -7.252 7.551 1.00 0.00 C ATOM 1548 O ASP B 9 155.254 -7.652 8.160 1.00 0.00 O ATOM 1549 CB ASP B 9 158.384 -7.048 8.794 1.00 0.00 C ATOM 1550 CG ASP B 9 159.646 -7.805 9.212 1.00 0.00 C ATOM 1551 OD1 ASP B 9 159.686 -9.008 9.014 1.00 0.00 O ATOM 1552 OD2 ASP B 9 160.551 -7.169 9.725 1.00 0.00 O ATOM 0 H ASP B 9 159.125 -7.237 6.409 1.00 0.00 H new ATOM 0 HA ASP B 9 157.493 -8.893 8.132 1.00 0.00 H new ATOM 0 HB2 ASP B 9 158.652 -6.080 8.371 1.00 0.00 H new ATOM 0 HB3 ASP B 9 157.758 -6.854 9.665 1.00 0.00 H new ATOM 1557 N PHE B 10 156.138 -6.258 6.706 1.00 0.00 N ATOM 1558 CA PHE B 10 154.825 -5.590 6.472 1.00 0.00 C ATOM 1559 C PHE B 10 153.863 -6.532 5.743 1.00 0.00 C ATOM 1560 O PHE B 10 152.688 -6.587 6.044 1.00 0.00 O ATOM 1561 CB PHE B 10 155.045 -4.339 5.620 1.00 0.00 C ATOM 1562 CG PHE B 10 153.771 -3.531 5.568 1.00 0.00 C ATOM 1563 CD1 PHE B 10 153.531 -2.549 6.535 1.00 0.00 C ATOM 1564 CD2 PHE B 10 152.833 -3.759 4.552 1.00 0.00 C ATOM 1565 CE1 PHE B 10 152.352 -1.794 6.491 1.00 0.00 C ATOM 1566 CE2 PHE B 10 151.654 -3.004 4.507 1.00 0.00 C ATOM 1567 CZ PHE B 10 151.414 -2.023 5.478 1.00 0.00 C ATOM 0 H PHE B 10 156.918 -5.881 6.168 1.00 0.00 H new ATOM 0 HA PHE B 10 154.390 -5.321 7.435 1.00 0.00 H new ATOM 0 HB2 PHE B 10 155.852 -3.738 6.040 1.00 0.00 H new ATOM 0 HB3 PHE B 10 155.349 -4.622 4.612 1.00 0.00 H new ATOM 0 HD1 PHE B 10 154.256 -2.373 7.316 1.00 0.00 H new ATOM 0 HD2 PHE B 10 153.019 -4.516 3.805 1.00 0.00 H new ATOM 0 HE1 PHE B 10 152.167 -1.036 7.238 1.00 0.00 H new ATOM 0 HE2 PHE B 10 150.930 -3.178 3.724 1.00 0.00 H new ATOM 0 HZ PHE B 10 150.504 -1.443 5.445 1.00 0.00 H new ATOM 1577 N VAL B 11 154.347 -7.267 4.780 1.00 0.00 N ATOM 1578 CA VAL B 11 153.451 -8.194 4.029 1.00 0.00 C ATOM 1579 C VAL B 11 153.284 -9.501 4.806 1.00 0.00 C ATOM 1580 O VAL B 11 152.865 -10.504 4.262 1.00 0.00 O ATOM 1581 CB VAL B 11 154.065 -8.481 2.658 1.00 0.00 C ATOM 1582 CG1 VAL B 11 154.259 -7.162 1.907 1.00 0.00 C ATOM 1583 CG2 VAL B 11 155.421 -9.171 2.844 1.00 0.00 C ATOM 0 H VAL B 11 155.322 -7.267 4.480 1.00 0.00 H new ATOM 0 HA VAL B 11 152.472 -7.732 3.903 1.00 0.00 H new ATOM 0 HB VAL B 11 153.403 -9.131 2.086 1.00 0.00 H new ATOM 0 HG11 VAL B 11 154.697 -7.361 0.929 1.00 0.00 H new ATOM 0 HG12 VAL B 11 153.294 -6.670 1.780 1.00 0.00 H new ATOM 0 HG13 VAL B 11 154.924 -6.513 2.477 1.00 0.00 H new ATOM 0 HG21 VAL B 11 155.861 -9.377 1.868 1.00 0.00 H new ATOM 0 HG22 VAL B 11 156.086 -8.520 3.412 1.00 0.00 H new ATOM 0 HG23 VAL B 11 155.282 -10.107 3.384 1.00 0.00 H new ATOM 1593 N ALA B 12 153.617 -9.494 6.075 1.00 0.00 N ATOM 1594 CA ALA B 12 153.490 -10.732 6.913 1.00 0.00 C ATOM 1595 C ALA B 12 152.563 -10.471 8.103 1.00 0.00 C ATOM 1596 O ALA B 12 152.251 -11.369 8.860 1.00 0.00 O ATOM 1597 CB ALA B 12 154.872 -11.127 7.433 1.00 0.00 C ATOM 0 H ALA B 12 153.974 -8.678 6.571 1.00 0.00 H new ATOM 0 HA ALA B 12 153.073 -11.534 6.305 1.00 0.00 H new ATOM 0 HB1 ALA B 12 154.788 -12.026 8.043 1.00 0.00 H new ATOM 0 HB2 ALA B 12 155.536 -11.321 6.591 1.00 0.00 H new ATOM 0 HB3 ALA B 12 155.279 -10.316 8.037 1.00 0.00 H new ATOM 1603 N GLU B 13 152.112 -9.255 8.280 1.00 0.00 N ATOM 1604 CA GLU B 13 151.200 -8.959 9.429 1.00 0.00 C ATOM 1605 C GLU B 13 150.265 -7.789 9.067 1.00 0.00 C ATOM 1606 O GLU B 13 150.639 -6.920 8.305 1.00 0.00 O ATOM 1607 CB GLU B 13 152.038 -8.576 10.651 1.00 0.00 C ATOM 1608 CG GLU B 13 152.786 -7.271 10.370 1.00 0.00 C ATOM 1609 CD GLU B 13 153.853 -7.051 11.444 1.00 0.00 C ATOM 1610 OE1 GLU B 13 153.527 -6.471 12.466 1.00 0.00 O ATOM 1611 OE2 GLU B 13 154.979 -7.468 11.226 1.00 0.00 O ATOM 0 H GLU B 13 152.333 -8.458 7.683 1.00 0.00 H new ATOM 0 HA GLU B 13 150.601 -9.842 9.651 1.00 0.00 H new ATOM 0 HB2 GLU B 13 151.395 -8.458 11.523 1.00 0.00 H new ATOM 0 HB3 GLU B 13 152.747 -9.371 10.882 1.00 0.00 H new ATOM 0 HG2 GLU B 13 153.250 -7.311 9.385 1.00 0.00 H new ATOM 0 HG3 GLU B 13 152.087 -6.434 10.360 1.00 0.00 H new ATOM 1618 N PRO B 14 149.067 -7.741 9.620 1.00 0.00 N ATOM 1619 CA PRO B 14 148.111 -6.626 9.345 1.00 0.00 C ATOM 1620 C PRO B 14 148.799 -5.252 9.390 1.00 0.00 C ATOM 1621 O PRO B 14 149.897 -5.117 9.892 1.00 0.00 O ATOM 1622 CB PRO B 14 147.077 -6.745 10.473 1.00 0.00 C ATOM 1623 CG PRO B 14 147.076 -8.194 10.851 1.00 0.00 C ATOM 1624 CD PRO B 14 148.486 -8.731 10.553 1.00 0.00 C ATOM 0 HA PRO B 14 147.676 -6.700 8.348 1.00 0.00 H new ATOM 0 HB2 PRO B 14 147.346 -6.116 11.322 1.00 0.00 H new ATOM 0 HB3 PRO B 14 146.090 -6.424 10.139 1.00 0.00 H new ATOM 0 HG2 PRO B 14 146.830 -8.318 11.905 1.00 0.00 H new ATOM 0 HG3 PRO B 14 146.325 -8.742 10.281 1.00 0.00 H new ATOM 0 HD2 PRO B 14 149.080 -8.815 11.463 1.00 0.00 H new ATOM 0 HD3 PRO B 14 148.447 -9.724 10.105 1.00 0.00 H new ATOM 1632 N MET B 15 148.162 -4.232 8.871 1.00 0.00 N ATOM 1633 CA MET B 15 148.781 -2.870 8.888 1.00 0.00 C ATOM 1634 C MET B 15 148.350 -2.118 10.156 1.00 0.00 C ATOM 1635 O MET B 15 148.980 -1.164 10.570 1.00 0.00 O ATOM 1636 CB MET B 15 148.343 -2.093 7.643 1.00 0.00 C ATOM 1637 CG MET B 15 146.829 -2.224 7.453 1.00 0.00 C ATOM 1638 SD MET B 15 146.287 -1.144 6.099 1.00 0.00 S ATOM 1639 CE MET B 15 147.277 -1.882 4.771 1.00 0.00 C ATOM 0 H MET B 15 147.241 -4.283 8.436 1.00 0.00 H new ATOM 0 HA MET B 15 149.867 -2.966 8.887 1.00 0.00 H new ATOM 0 HB2 MET B 15 148.616 -1.043 7.744 1.00 0.00 H new ATOM 0 HB3 MET B 15 148.863 -2.474 6.764 1.00 0.00 H new ATOM 0 HG2 MET B 15 146.569 -3.259 7.232 1.00 0.00 H new ATOM 0 HG3 MET B 15 146.312 -1.955 8.374 1.00 0.00 H new ATOM 0 HE1 MET B 15 147.327 -1.192 3.928 1.00 0.00 H new ATOM 0 HE2 MET B 15 148.284 -2.082 5.136 1.00 0.00 H new ATOM 0 HE3 MET B 15 146.815 -2.815 4.449 1.00 0.00 H new ATOM 1649 N GLY B 16 147.289 -2.553 10.781 1.00 0.00 N ATOM 1650 CA GLY B 16 146.817 -1.885 12.032 1.00 0.00 C ATOM 1651 C GLY B 16 146.802 -0.362 11.858 1.00 0.00 C ATOM 1652 O GLY B 16 146.440 0.154 10.820 1.00 0.00 O ATOM 0 H GLY B 16 146.725 -3.347 10.478 1.00 0.00 H new ATOM 0 HA2 GLY B 16 145.817 -2.238 12.284 1.00 0.00 H new ATOM 0 HA3 GLY B 16 147.469 -2.155 12.863 1.00 0.00 H new ATOM 1656 N GLU B 17 147.172 0.358 12.890 1.00 0.00 N ATOM 1657 CA GLU B 17 147.164 1.854 12.834 1.00 0.00 C ATOM 1658 C GLU B 17 148.594 2.384 12.747 1.00 0.00 C ATOM 1659 O GLU B 17 148.875 3.495 13.154 1.00 0.00 O ATOM 1660 CB GLU B 17 146.510 2.396 14.107 1.00 0.00 C ATOM 1661 CG GLU B 17 145.047 1.954 14.159 1.00 0.00 C ATOM 1662 CD GLU B 17 144.394 2.495 15.431 1.00 0.00 C ATOM 1663 OE1 GLU B 17 145.109 3.045 16.252 1.00 0.00 O ATOM 1664 OE2 GLU B 17 143.190 2.347 15.565 1.00 0.00 O ATOM 0 H GLU B 17 147.483 -0.033 13.779 1.00 0.00 H new ATOM 0 HA GLU B 17 146.607 2.177 11.954 1.00 0.00 H new ATOM 0 HB2 GLU B 17 147.042 2.031 14.985 1.00 0.00 H new ATOM 0 HB3 GLU B 17 146.573 3.484 14.126 1.00 0.00 H new ATOM 0 HG2 GLU B 17 144.515 2.319 13.281 1.00 0.00 H new ATOM 0 HG3 GLU B 17 144.984 0.866 14.140 1.00 0.00 H new ATOM 1671 N LYS B 18 149.504 1.609 12.228 1.00 0.00 N ATOM 1672 CA LYS B 18 150.907 2.091 12.131 1.00 0.00 C ATOM 1673 C LYS B 18 150.926 3.339 11.236 1.00 0.00 C ATOM 1674 O LYS B 18 150.091 3.491 10.365 1.00 0.00 O ATOM 1675 CB LYS B 18 151.799 0.990 11.525 1.00 0.00 C ATOM 1676 CG LYS B 18 152.191 -0.055 12.595 1.00 0.00 C ATOM 1677 CD LYS B 18 151.092 -1.127 12.738 1.00 0.00 C ATOM 1678 CE LYS B 18 151.311 -2.247 11.714 1.00 0.00 C ATOM 1679 NZ LYS B 18 152.456 -3.097 12.150 1.00 0.00 N ATOM 0 H LYS B 18 149.338 0.669 11.869 1.00 0.00 H new ATOM 0 HA LYS B 18 151.290 2.337 13.121 1.00 0.00 H new ATOM 0 HB2 LYS B 18 151.272 0.499 10.707 1.00 0.00 H new ATOM 0 HB3 LYS B 18 152.698 1.437 11.101 1.00 0.00 H new ATOM 0 HG2 LYS B 18 153.134 -0.528 12.320 1.00 0.00 H new ATOM 0 HG3 LYS B 18 152.350 0.440 13.553 1.00 0.00 H new ATOM 0 HD2 LYS B 18 151.104 -1.539 13.747 1.00 0.00 H new ATOM 0 HD3 LYS B 18 150.111 -0.675 12.590 1.00 0.00 H new ATOM 0 HE2 LYS B 18 150.409 -2.852 11.621 1.00 0.00 H new ATOM 0 HE3 LYS B 18 151.512 -1.822 10.731 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 152.403 -4.021 11.676 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 153.351 -2.630 11.899 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 152.414 -3.234 13.180 1.00 0.00 H new ATOM 1693 N PRO B 19 151.847 4.245 11.466 1.00 0.00 N ATOM 1694 CA PRO B 19 151.939 5.518 10.684 1.00 0.00 C ATOM 1695 C PRO B 19 152.209 5.288 9.193 1.00 0.00 C ATOM 1696 O PRO B 19 152.777 4.292 8.792 1.00 0.00 O ATOM 1697 CB PRO B 19 153.104 6.280 11.349 1.00 0.00 C ATOM 1698 CG PRO B 19 153.910 5.225 12.038 1.00 0.00 C ATOM 1699 CD PRO B 19 152.907 4.164 12.486 1.00 0.00 C ATOM 0 HA PRO B 19 150.997 6.066 10.705 1.00 0.00 H new ATOM 0 HB2 PRO B 19 153.701 6.813 10.609 1.00 0.00 H new ATOM 0 HB3 PRO B 19 152.737 7.023 12.057 1.00 0.00 H new ATOM 0 HG2 PRO B 19 154.655 4.800 11.365 1.00 0.00 H new ATOM 0 HG3 PRO B 19 154.449 5.639 12.890 1.00 0.00 H new ATOM 0 HD2 PRO B 19 153.358 3.172 12.519 1.00 0.00 H new ATOM 0 HD3 PRO B 19 152.521 4.372 13.484 1.00 0.00 H new ATOM 1707 N VAL B 20 151.786 6.215 8.378 1.00 0.00 N ATOM 1708 CA VAL B 20 151.989 6.085 6.910 1.00 0.00 C ATOM 1709 C VAL B 20 153.469 5.847 6.600 1.00 0.00 C ATOM 1710 O VAL B 20 153.822 4.994 5.811 1.00 0.00 O ATOM 1711 CB VAL B 20 151.519 7.373 6.227 1.00 0.00 C ATOM 1712 CG1 VAL B 20 152.319 8.566 6.763 1.00 0.00 C ATOM 1713 CG2 VAL B 20 151.728 7.254 4.714 1.00 0.00 C ATOM 0 H VAL B 20 151.304 7.065 8.671 1.00 0.00 H new ATOM 0 HA VAL B 20 151.414 5.237 6.539 1.00 0.00 H new ATOM 0 HB VAL B 20 150.461 7.527 6.438 1.00 0.00 H new ATOM 0 HG11 VAL B 20 151.981 9.480 6.274 1.00 0.00 H new ATOM 0 HG12 VAL B 20 152.167 8.652 7.839 1.00 0.00 H new ATOM 0 HG13 VAL B 20 153.379 8.415 6.558 1.00 0.00 H new ATOM 0 HG21 VAL B 20 151.394 8.170 4.227 1.00 0.00 H new ATOM 0 HG22 VAL B 20 152.786 7.097 4.504 1.00 0.00 H new ATOM 0 HG23 VAL B 20 151.153 6.410 4.333 1.00 0.00 H new ATOM 1723 N GLY B 21 154.337 6.613 7.213 1.00 0.00 N ATOM 1724 CA GLY B 21 155.797 6.457 6.955 1.00 0.00 C ATOM 1725 C GLY B 21 156.232 5.017 7.235 1.00 0.00 C ATOM 1726 O GLY B 21 157.378 4.662 7.044 1.00 0.00 O ATOM 0 H GLY B 21 154.093 7.342 7.883 1.00 0.00 H new ATOM 0 HA2 GLY B 21 156.021 6.718 5.921 1.00 0.00 H new ATOM 0 HA3 GLY B 21 156.361 7.144 7.586 1.00 0.00 H new ATOM 1730 N SER B 22 155.335 4.182 7.680 1.00 0.00 N ATOM 1731 CA SER B 22 155.712 2.768 7.959 1.00 0.00 C ATOM 1732 C SER B 22 155.707 1.983 6.650 1.00 0.00 C ATOM 1733 O SER B 22 156.365 0.971 6.512 1.00 0.00 O ATOM 1734 CB SER B 22 154.688 2.155 8.908 1.00 0.00 C ATOM 1735 OG SER B 22 153.455 1.985 8.221 1.00 0.00 O ATOM 0 H SER B 22 154.359 4.417 7.862 1.00 0.00 H new ATOM 0 HA SER B 22 156.703 2.733 8.410 1.00 0.00 H new ATOM 0 HB2 SER B 22 155.047 1.195 9.278 1.00 0.00 H new ATOM 0 HB3 SER B 22 154.548 2.799 9.776 1.00 0.00 H new ATOM 0 HG SER B 22 152.791 2.609 8.581 1.00 0.00 H new ATOM 1741 N LEU B 23 154.958 2.444 5.692 1.00 0.00 N ATOM 1742 CA LEU B 23 154.890 1.732 4.384 1.00 0.00 C ATOM 1743 C LEU B 23 156.270 1.720 3.728 1.00 0.00 C ATOM 1744 O LEU B 23 156.987 2.702 3.730 1.00 0.00 O ATOM 1745 CB LEU B 23 153.901 2.447 3.459 1.00 0.00 C ATOM 1746 CG LEU B 23 152.471 2.294 3.992 1.00 0.00 C ATOM 1747 CD1 LEU B 23 151.532 3.182 3.169 1.00 0.00 C ATOM 1748 CD2 LEU B 23 152.017 0.823 3.894 1.00 0.00 C ATOM 0 H LEU B 23 154.387 3.286 5.756 1.00 0.00 H new ATOM 0 HA LEU B 23 154.559 0.708 4.555 1.00 0.00 H new ATOM 0 HB2 LEU B 23 154.159 3.504 3.386 1.00 0.00 H new ATOM 0 HB3 LEU B 23 153.968 2.033 2.453 1.00 0.00 H new ATOM 0 HG LEU B 23 152.443 2.597 5.039 1.00 0.00 H new ATOM 0 HD11 LEU B 23 150.513 3.078 3.542 1.00 0.00 H new ATOM 0 HD12 LEU B 23 151.846 4.222 3.256 1.00 0.00 H new ATOM 0 HD13 LEU B 23 151.568 2.878 2.123 1.00 0.00 H new ATOM 0 HD21 LEU B 23 151.000 0.730 4.276 1.00 0.00 H new ATOM 0 HD22 LEU B 23 152.044 0.502 2.853 1.00 0.00 H new ATOM 0 HD23 LEU B 23 152.685 0.196 4.484 1.00 0.00 H new ATOM 1760 N ALA B 24 156.636 0.610 3.159 1.00 0.00 N ATOM 1761 CA ALA B 24 157.963 0.522 2.492 1.00 0.00 C ATOM 1762 C ALA B 24 157.994 1.465 1.283 1.00 0.00 C ATOM 1763 O ALA B 24 157.065 1.529 0.502 1.00 0.00 O ATOM 1764 CB ALA B 24 158.211 -0.918 2.030 1.00 0.00 C ATOM 0 H ALA B 24 156.075 -0.241 3.126 1.00 0.00 H new ATOM 0 HA ALA B 24 158.742 0.814 3.196 1.00 0.00 H new ATOM 0 HB1 ALA B 24 159.183 -0.981 1.542 1.00 0.00 H new ATOM 0 HB2 ALA B 24 158.194 -1.585 2.892 1.00 0.00 H new ATOM 0 HB3 ALA B 24 157.432 -1.214 1.327 1.00 0.00 H new ATOM 1770 N GLY B 25 159.062 2.204 1.143 1.00 0.00 N ATOM 1771 CA GLY B 25 159.181 3.165 0.000 1.00 0.00 C ATOM 1772 C GLY B 25 158.869 4.581 0.492 1.00 0.00 C ATOM 1773 O GLY B 25 159.208 5.555 -0.147 1.00 0.00 O ATOM 0 H GLY B 25 159.864 2.185 1.773 1.00 0.00 H new ATOM 0 HA2 GLY B 25 160.187 3.127 -0.418 1.00 0.00 H new ATOM 0 HA3 GLY B 25 158.493 2.885 -0.798 1.00 0.00 H new ATOM 1777 N ILE B 26 158.240 4.706 1.635 1.00 0.00 N ATOM 1778 CA ILE B 26 157.925 6.062 2.184 1.00 0.00 C ATOM 1779 C ILE B 26 158.971 6.386 3.249 1.00 0.00 C ATOM 1780 O ILE B 26 159.088 5.690 4.237 1.00 0.00 O ATOM 1781 CB ILE B 26 156.531 6.050 2.821 1.00 0.00 C ATOM 1782 CG1 ILE B 26 155.485 5.585 1.794 1.00 0.00 C ATOM 1783 CG2 ILE B 26 156.173 7.456 3.311 1.00 0.00 C ATOM 1784 CD1 ILE B 26 155.575 6.422 0.510 1.00 0.00 C ATOM 0 H ILE B 26 157.930 3.925 2.213 1.00 0.00 H new ATOM 0 HA ILE B 26 157.940 6.809 1.390 1.00 0.00 H new ATOM 0 HB ILE B 26 156.536 5.360 3.665 1.00 0.00 H new ATOM 0 HG12 ILE B 26 155.642 4.532 1.559 1.00 0.00 H new ATOM 0 HG13 ILE B 26 154.486 5.671 2.221 1.00 0.00 H new ATOM 0 HG21 ILE B 26 155.181 7.442 3.763 1.00 0.00 H new ATOM 0 HG22 ILE B 26 156.905 7.781 4.051 1.00 0.00 H new ATOM 0 HG23 ILE B 26 156.178 8.147 2.468 1.00 0.00 H new ATOM 0 HD11 ILE B 26 154.826 6.076 -0.203 1.00 0.00 H new ATOM 0 HD12 ILE B 26 155.394 7.471 0.746 1.00 0.00 H new ATOM 0 HD13 ILE B 26 156.568 6.314 0.074 1.00 0.00 H new ATOM 1796 N GLY B 27 159.740 7.432 3.070 1.00 0.00 N ATOM 1797 CA GLY B 27 160.773 7.785 4.087 1.00 0.00 C ATOM 1798 C GLY B 27 160.189 8.789 5.082 1.00 0.00 C ATOM 1799 O GLY B 27 159.077 9.251 4.934 1.00 0.00 O ATOM 0 H GLY B 27 159.695 8.055 2.263 1.00 0.00 H new ATOM 0 HA2 GLY B 27 161.104 6.888 4.611 1.00 0.00 H new ATOM 0 HA3 GLY B 27 161.650 8.210 3.598 1.00 0.00 H new ATOM 1803 N GLU B 28 160.927 9.110 6.106 1.00 0.00 N ATOM 1804 CA GLU B 28 160.410 10.065 7.126 1.00 0.00 C ATOM 1805 C GLU B 28 160.077 11.409 6.472 1.00 0.00 C ATOM 1806 O GLU B 28 159.086 12.032 6.798 1.00 0.00 O ATOM 1807 CB GLU B 28 161.481 10.272 8.197 1.00 0.00 C ATOM 1808 CG GLU B 28 161.626 8.996 9.026 1.00 0.00 C ATOM 1809 CD GLU B 28 162.696 9.202 10.098 1.00 0.00 C ATOM 1810 OE1 GLU B 28 163.385 10.207 10.034 1.00 0.00 O ATOM 1811 OE2 GLU B 28 162.815 8.349 10.961 1.00 0.00 O ATOM 0 H GLU B 28 161.866 8.753 6.282 1.00 0.00 H new ATOM 0 HA GLU B 28 159.504 9.659 7.575 1.00 0.00 H new ATOM 0 HB2 GLU B 28 162.433 10.525 7.730 1.00 0.00 H new ATOM 0 HB3 GLU B 28 161.209 11.108 8.841 1.00 0.00 H new ATOM 0 HG2 GLU B 28 160.674 8.742 9.492 1.00 0.00 H new ATOM 0 HG3 GLU B 28 161.898 8.160 8.382 1.00 0.00 H new ATOM 1818 N VAL B 29 160.886 11.867 5.557 1.00 0.00 N ATOM 1819 CA VAL B 29 160.591 13.174 4.904 1.00 0.00 C ATOM 1820 C VAL B 29 159.352 13.025 4.019 1.00 0.00 C ATOM 1821 O VAL B 29 158.462 13.854 4.027 1.00 0.00 O ATOM 1822 CB VAL B 29 161.792 13.610 4.058 1.00 0.00 C ATOM 1823 CG1 VAL B 29 161.419 14.836 3.223 1.00 0.00 C ATOM 1824 CG2 VAL B 29 162.961 13.956 4.983 1.00 0.00 C ATOM 0 H VAL B 29 161.732 11.397 5.235 1.00 0.00 H new ATOM 0 HA VAL B 29 160.402 13.932 5.665 1.00 0.00 H new ATOM 0 HB VAL B 29 162.080 12.798 3.391 1.00 0.00 H new ATOM 0 HG11 VAL B 29 162.276 15.142 2.623 1.00 0.00 H new ATOM 0 HG12 VAL B 29 160.586 14.588 2.565 1.00 0.00 H new ATOM 0 HG13 VAL B 29 161.129 15.652 3.885 1.00 0.00 H new ATOM 0 HG21 VAL B 29 163.818 14.267 4.386 1.00 0.00 H new ATOM 0 HG22 VAL B 29 162.670 14.768 5.649 1.00 0.00 H new ATOM 0 HG23 VAL B 29 163.229 13.080 5.574 1.00 0.00 H new ATOM 1834 N LEU B 30 159.288 11.969 3.255 1.00 0.00 N ATOM 1835 CA LEU B 30 158.112 11.754 2.367 1.00 0.00 C ATOM 1836 C LEU B 30 156.876 11.497 3.228 1.00 0.00 C ATOM 1837 O LEU B 30 155.792 11.961 2.938 1.00 0.00 O ATOM 1838 CB LEU B 30 158.360 10.539 1.466 1.00 0.00 C ATOM 1839 CG LEU B 30 159.551 10.800 0.533 1.00 0.00 C ATOM 1840 CD1 LEU B 30 159.875 9.514 -0.234 1.00 0.00 C ATOM 1841 CD2 LEU B 30 159.215 11.926 -0.463 1.00 0.00 C ATOM 0 H LEU B 30 160.003 11.243 3.208 1.00 0.00 H new ATOM 0 HA LEU B 30 157.958 12.638 1.748 1.00 0.00 H new ATOM 0 HB2 LEU B 30 158.555 9.658 2.078 1.00 0.00 H new ATOM 0 HB3 LEU B 30 157.468 10.327 0.877 1.00 0.00 H new ATOM 0 HG LEU B 30 160.412 11.106 1.127 1.00 0.00 H new ATOM 0 HD11 LEU B 30 160.720 9.690 -0.899 1.00 0.00 H new ATOM 0 HD12 LEU B 30 160.128 8.723 0.472 1.00 0.00 H new ATOM 0 HD13 LEU B 30 159.008 9.212 -0.821 1.00 0.00 H new ATOM 0 HD21 LEU B 30 160.069 12.100 -1.118 1.00 0.00 H new ATOM 0 HD22 LEU B 30 158.352 11.636 -1.062 1.00 0.00 H new ATOM 0 HD23 LEU B 30 158.986 12.840 0.085 1.00 0.00 H new ATOM 1853 N GLY B 31 157.038 10.750 4.282 1.00 0.00 N ATOM 1854 CA GLY B 31 155.882 10.446 5.168 1.00 0.00 C ATOM 1855 C GLY B 31 155.297 11.743 5.738 1.00 0.00 C ATOM 1856 O GLY B 31 154.100 11.891 5.858 1.00 0.00 O ATOM 0 H GLY B 31 157.924 10.335 4.569 1.00 0.00 H new ATOM 0 HA2 GLY B 31 155.117 9.908 4.608 1.00 0.00 H new ATOM 0 HA3 GLY B 31 156.199 9.793 5.981 1.00 0.00 H new ATOM 1860 N LYS B 32 156.133 12.676 6.105 1.00 0.00 N ATOM 1861 CA LYS B 32 155.624 13.955 6.688 1.00 0.00 C ATOM 1862 C LYS B 32 154.753 14.709 5.677 1.00 0.00 C ATOM 1863 O LYS B 32 153.759 15.307 6.039 1.00 0.00 O ATOM 1864 CB LYS B 32 156.805 14.835 7.110 1.00 0.00 C ATOM 1865 CG LYS B 32 156.282 16.126 7.748 1.00 0.00 C ATOM 1866 CD LYS B 32 157.455 16.952 8.279 1.00 0.00 C ATOM 1867 CE LYS B 32 156.922 18.194 9.000 1.00 0.00 C ATOM 1868 NZ LYS B 32 156.456 19.192 7.997 1.00 0.00 N ATOM 0 H LYS B 32 157.148 12.610 6.027 1.00 0.00 H new ATOM 0 HA LYS B 32 155.013 13.718 7.559 1.00 0.00 H new ATOM 0 HB2 LYS B 32 157.437 14.298 7.817 1.00 0.00 H new ATOM 0 HB3 LYS B 32 157.424 15.070 6.244 1.00 0.00 H new ATOM 0 HG2 LYS B 32 155.721 16.704 7.014 1.00 0.00 H new ATOM 0 HG3 LYS B 32 155.595 15.889 8.560 1.00 0.00 H new ATOM 0 HD2 LYS B 32 158.056 16.352 8.962 1.00 0.00 H new ATOM 0 HD3 LYS B 32 158.107 17.248 7.457 1.00 0.00 H new ATOM 0 HE2 LYS B 32 156.101 17.918 9.662 1.00 0.00 H new ATOM 0 HE3 LYS B 32 157.703 18.628 9.624 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 156.670 20.151 8.337 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 156.943 19.029 7.093 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 155.430 19.094 7.860 1.00 0.00 H new ATOM 1882 N LYS B 33 155.118 14.723 4.425 1.00 0.00 N ATOM 1883 CA LYS B 33 154.297 15.484 3.435 1.00 0.00 C ATOM 1884 C LYS B 33 152.911 14.842 3.290 1.00 0.00 C ATOM 1885 O LYS B 33 151.909 15.526 3.227 1.00 0.00 O ATOM 1886 CB LYS B 33 155.002 15.463 2.080 1.00 0.00 C ATOM 1887 CG LYS B 33 156.292 16.282 2.160 1.00 0.00 C ATOM 1888 CD LYS B 33 156.994 16.259 0.803 1.00 0.00 C ATOM 1889 CE LYS B 33 158.285 17.076 0.879 1.00 0.00 C ATOM 1890 NZ LYS B 33 159.096 16.834 -0.346 1.00 0.00 N ATOM 0 H LYS B 33 155.937 14.248 4.046 1.00 0.00 H new ATOM 0 HA LYS B 33 154.180 16.510 3.783 1.00 0.00 H new ATOM 0 HB2 LYS B 33 155.228 14.436 1.792 1.00 0.00 H new ATOM 0 HB3 LYS B 33 154.347 15.872 1.311 1.00 0.00 H new ATOM 0 HG2 LYS B 33 156.066 17.309 2.447 1.00 0.00 H new ATOM 0 HG3 LYS B 33 156.948 15.873 2.928 1.00 0.00 H new ATOM 0 HD2 LYS B 33 157.218 15.232 0.516 1.00 0.00 H new ATOM 0 HD3 LYS B 33 156.337 16.669 0.036 1.00 0.00 H new ATOM 0 HE2 LYS B 33 158.052 18.137 0.971 1.00 0.00 H new ATOM 0 HE3 LYS B 33 158.854 16.797 1.766 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 159.579 17.713 -0.622 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 159.803 16.096 -0.154 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 158.473 16.524 -1.119 1.00 0.00 H new ATOM 1904 N LEU B 34 152.840 13.541 3.249 1.00 0.00 N ATOM 1905 CA LEU B 34 151.514 12.866 3.121 1.00 0.00 C ATOM 1906 C LEU B 34 150.639 13.224 4.330 1.00 0.00 C ATOM 1907 O LEU B 34 149.450 13.442 4.215 1.00 0.00 O ATOM 1908 CB LEU B 34 151.715 11.347 3.062 1.00 0.00 C ATOM 1909 CG LEU B 34 152.402 10.954 1.744 1.00 0.00 C ATOM 1910 CD1 LEU B 34 152.928 9.520 1.861 1.00 0.00 C ATOM 1911 CD2 LEU B 34 151.407 11.033 0.567 1.00 0.00 C ATOM 0 H LEU B 34 153.643 12.913 3.298 1.00 0.00 H new ATOM 0 HA LEU B 34 151.023 13.200 2.207 1.00 0.00 H new ATOM 0 HB2 LEU B 34 152.320 11.020 3.908 1.00 0.00 H new ATOM 0 HB3 LEU B 34 150.753 10.842 3.144 1.00 0.00 H new ATOM 0 HG LEU B 34 153.224 11.645 1.556 1.00 0.00 H new ATOM 0 HD11 LEU B 34 153.417 9.235 0.929 1.00 0.00 H new ATOM 0 HD12 LEU B 34 153.645 9.461 2.680 1.00 0.00 H new ATOM 0 HD13 LEU B 34 152.097 8.843 2.057 1.00 0.00 H new ATOM 0 HD21 LEU B 34 151.913 10.751 -0.357 1.00 0.00 H new ATOM 0 HD22 LEU B 34 150.575 10.352 0.748 1.00 0.00 H new ATOM 0 HD23 LEU B 34 151.029 12.052 0.478 1.00 0.00 H new ATOM 1923 N GLU B 35 151.231 13.268 5.484 1.00 0.00 N ATOM 1924 CA GLU B 35 150.437 13.592 6.707 1.00 0.00 C ATOM 1925 C GLU B 35 149.819 14.989 6.572 1.00 0.00 C ATOM 1926 O GLU B 35 148.687 15.218 6.953 1.00 0.00 O ATOM 1927 CB GLU B 35 151.344 13.543 7.938 1.00 0.00 C ATOM 1928 CG GLU B 35 151.787 12.100 8.190 1.00 0.00 C ATOM 1929 CD GLU B 35 152.728 12.057 9.395 1.00 0.00 C ATOM 1930 OE1 GLU B 35 153.108 13.118 9.864 1.00 0.00 O ATOM 1931 OE2 GLU B 35 153.056 10.965 9.827 1.00 0.00 O ATOM 0 H GLU B 35 152.224 13.096 5.640 1.00 0.00 H new ATOM 0 HA GLU B 35 149.638 12.859 6.820 1.00 0.00 H new ATOM 0 HB2 GLU B 35 152.215 14.181 7.786 1.00 0.00 H new ATOM 0 HB3 GLU B 35 150.814 13.929 8.809 1.00 0.00 H new ATOM 0 HG2 GLU B 35 150.918 11.468 8.372 1.00 0.00 H new ATOM 0 HG3 GLU B 35 152.290 11.704 7.308 1.00 0.00 H new ATOM 1938 N GLU B 36 150.553 15.924 6.033 1.00 0.00 N ATOM 1939 CA GLU B 36 150.012 17.307 5.872 1.00 0.00 C ATOM 1940 C GLU B 36 148.916 17.298 4.805 1.00 0.00 C ATOM 1941 O GLU B 36 148.101 18.195 4.722 1.00 0.00 O ATOM 1942 CB GLU B 36 151.137 18.245 5.436 1.00 0.00 C ATOM 1943 CG GLU B 36 152.125 18.428 6.590 1.00 0.00 C ATOM 1944 CD GLU B 36 153.252 19.366 6.155 1.00 0.00 C ATOM 1945 OE1 GLU B 36 153.305 19.690 4.980 1.00 0.00 O ATOM 1946 OE2 GLU B 36 154.039 19.748 7.005 1.00 0.00 O ATOM 0 H GLU B 36 151.506 15.791 5.696 1.00 0.00 H new ATOM 0 HA GLU B 36 149.598 17.651 6.820 1.00 0.00 H new ATOM 0 HB2 GLU B 36 151.650 17.835 4.566 1.00 0.00 H new ATOM 0 HB3 GLU B 36 150.726 19.210 5.139 1.00 0.00 H new ATOM 0 HG2 GLU B 36 151.612 18.838 7.460 1.00 0.00 H new ATOM 0 HG3 GLU B 36 152.535 17.463 6.887 1.00 0.00 H new ATOM 1953 N ARG B 37 148.916 16.297 3.973 1.00 0.00 N ATOM 1954 CA ARG B 37 147.899 16.228 2.881 1.00 0.00 C ATOM 1955 C ARG B 37 146.644 15.508 3.382 1.00 0.00 C ATOM 1956 O ARG B 37 145.676 15.365 2.663 1.00 0.00 O ATOM 1957 CB ARG B 37 148.495 15.462 1.693 1.00 0.00 C ATOM 1958 CG ARG B 37 149.527 16.333 0.951 1.00 0.00 C ATOM 1959 CD ARG B 37 148.825 17.253 -0.058 1.00 0.00 C ATOM 1960 NE ARG B 37 148.002 16.431 -0.989 1.00 0.00 N ATOM 1961 CZ ARG B 37 147.090 16.996 -1.729 1.00 0.00 C ATOM 1962 NH1 ARG B 37 146.909 18.287 -1.670 1.00 0.00 N ATOM 1963 NH2 ARG B 37 146.357 16.269 -2.528 1.00 0.00 N ATOM 0 H ARG B 37 149.576 15.520 3.999 1.00 0.00 H new ATOM 0 HA ARG B 37 147.626 17.237 2.571 1.00 0.00 H new ATOM 0 HB2 ARG B 37 148.970 14.546 2.045 1.00 0.00 H new ATOM 0 HB3 ARG B 37 147.700 15.166 1.008 1.00 0.00 H new ATOM 0 HG2 ARG B 37 150.090 16.931 1.668 1.00 0.00 H new ATOM 0 HG3 ARG B 37 150.245 15.696 0.434 1.00 0.00 H new ATOM 0 HD2 ARG B 37 148.194 17.971 0.466 1.00 0.00 H new ATOM 0 HD3 ARG B 37 149.563 17.827 -0.618 1.00 0.00 H new ATOM 0 HE ARG B 37 148.153 15.424 -1.047 1.00 0.00 H new ATOM 0 HH11 ARG B 37 147.481 18.854 -1.045 1.00 0.00 H new ATOM 0 HH12 ARG B 37 146.195 18.729 -2.249 1.00 0.00 H new ATOM 0 HH21 ARG B 37 146.498 15.260 -2.573 1.00 0.00 H new ATOM 0 HH22 ARG B 37 145.643 16.710 -3.108 1.00 0.00 H new ATOM 1977 N GLY B 38 146.639 15.081 4.619 1.00 0.00 N ATOM 1978 CA GLY B 38 145.425 14.402 5.178 1.00 0.00 C ATOM 1979 C GLY B 38 145.605 12.885 5.168 1.00 0.00 C ATOM 1980 O GLY B 38 144.673 12.144 4.927 1.00 0.00 O ATOM 0 H GLY B 38 147.421 15.172 5.268 1.00 0.00 H new ATOM 0 HA2 GLY B 38 145.246 14.746 6.197 1.00 0.00 H new ATOM 0 HA3 GLY B 38 144.547 14.673 4.591 1.00 0.00 H new ATOM 1984 N PHE B 39 146.787 12.417 5.464 1.00 0.00 N ATOM 1985 CA PHE B 39 147.045 10.947 5.519 1.00 0.00 C ATOM 1986 C PHE B 39 147.807 10.663 6.810 1.00 0.00 C ATOM 1987 O PHE B 39 148.993 10.398 6.799 1.00 0.00 O ATOM 1988 CB PHE B 39 147.887 10.529 4.313 1.00 0.00 C ATOM 1989 CG PHE B 39 147.079 10.722 3.052 1.00 0.00 C ATOM 1990 CD1 PHE B 39 146.270 9.688 2.572 1.00 0.00 C ATOM 1991 CD2 PHE B 39 147.128 11.942 2.374 1.00 0.00 C ATOM 1992 CE1 PHE B 39 145.509 9.875 1.411 1.00 0.00 C ATOM 1993 CE2 PHE B 39 146.367 12.133 1.215 1.00 0.00 C ATOM 1994 CZ PHE B 39 145.557 11.098 0.733 1.00 0.00 C ATOM 0 H PHE B 39 147.598 12.999 5.673 1.00 0.00 H new ATOM 0 HA PHE B 39 146.110 10.388 5.497 1.00 0.00 H new ATOM 0 HB2 PHE B 39 148.800 11.123 4.269 1.00 0.00 H new ATOM 0 HB3 PHE B 39 148.189 9.486 4.409 1.00 0.00 H new ATOM 0 HD1 PHE B 39 146.232 8.745 3.096 1.00 0.00 H new ATOM 0 HD2 PHE B 39 147.754 12.740 2.745 1.00 0.00 H new ATOM 0 HE1 PHE B 39 144.885 9.075 1.039 1.00 0.00 H new ATOM 0 HE2 PHE B 39 146.405 13.078 0.693 1.00 0.00 H new ATOM 0 HZ PHE B 39 144.970 11.243 -0.162 1.00 0.00 H new ATOM 2004 N ASP B 40 147.137 10.750 7.930 1.00 0.00 N ATOM 2005 CA ASP B 40 147.825 10.527 9.228 1.00 0.00 C ATOM 2006 C ASP B 40 147.991 9.027 9.498 1.00 0.00 C ATOM 2007 O ASP B 40 148.751 8.636 10.362 1.00 0.00 O ATOM 2008 CB ASP B 40 146.988 11.152 10.347 1.00 0.00 C ATOM 2009 CG ASP B 40 145.612 10.484 10.390 1.00 0.00 C ATOM 2010 OD1 ASP B 40 145.223 9.906 9.387 1.00 0.00 O ATOM 2011 OD2 ASP B 40 144.972 10.558 11.426 1.00 0.00 O ATOM 0 H ASP B 40 146.142 10.966 7.998 1.00 0.00 H new ATOM 0 HA ASP B 40 148.812 10.987 9.191 1.00 0.00 H new ATOM 0 HB2 ASP B 40 147.493 11.030 11.305 1.00 0.00 H new ATOM 0 HB3 ASP B 40 146.879 12.223 10.179 1.00 0.00 H new ATOM 2016 N LYS B 41 147.285 8.182 8.780 1.00 0.00 N ATOM 2017 CA LYS B 41 147.406 6.702 9.014 1.00 0.00 C ATOM 2018 C LYS B 41 147.602 5.975 7.679 1.00 0.00 C ATOM 2019 O LYS B 41 147.186 6.435 6.634 1.00 0.00 O ATOM 2020 CB LYS B 41 146.135 6.185 9.696 1.00 0.00 C ATOM 2021 CG LYS B 41 145.933 6.892 11.046 1.00 0.00 C ATOM 2022 CD LYS B 41 146.996 6.436 12.059 1.00 0.00 C ATOM 2023 CE LYS B 41 146.532 6.770 13.479 1.00 0.00 C ATOM 2024 NZ LYS B 41 147.581 6.355 14.453 1.00 0.00 N ATOM 0 H LYS B 41 146.632 8.451 8.044 1.00 0.00 H new ATOM 0 HA LYS B 41 148.267 6.512 9.654 1.00 0.00 H new ATOM 0 HB2 LYS B 41 145.272 6.359 9.053 1.00 0.00 H new ATOM 0 HB3 LYS B 41 146.207 5.108 9.848 1.00 0.00 H new ATOM 0 HG2 LYS B 41 145.992 7.972 10.910 1.00 0.00 H new ATOM 0 HG3 LYS B 41 144.937 6.673 11.432 1.00 0.00 H new ATOM 0 HD2 LYS B 41 147.166 5.364 11.964 1.00 0.00 H new ATOM 0 HD3 LYS B 41 147.946 6.929 11.851 1.00 0.00 H new ATOM 0 HE2 LYS B 41 146.340 7.839 13.569 1.00 0.00 H new ATOM 0 HE3 LYS B 41 145.595 6.258 13.697 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 147.146 6.193 15.384 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 148.032 5.477 14.125 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 148.298 7.104 14.531 1.00 0.00 H new ATOM 2038 N ALA B 42 148.255 4.842 7.717 1.00 0.00 N ATOM 2039 CA ALA B 42 148.519 4.062 6.469 1.00 0.00 C ATOM 2040 C ALA B 42 147.215 3.584 5.808 1.00 0.00 C ATOM 2041 O ALA B 42 147.094 3.587 4.600 1.00 0.00 O ATOM 2042 CB ALA B 42 149.368 2.840 6.823 1.00 0.00 C ATOM 0 H ALA B 42 148.621 4.419 8.570 1.00 0.00 H new ATOM 0 HA ALA B 42 149.038 4.712 5.765 1.00 0.00 H new ATOM 0 HB1 ALA B 42 149.568 2.262 5.921 1.00 0.00 H new ATOM 0 HB2 ALA B 42 150.311 3.167 7.261 1.00 0.00 H new ATOM 0 HB3 ALA B 42 148.831 2.219 7.540 1.00 0.00 H new ATOM 2048 N TYR B 43 146.259 3.131 6.573 1.00 0.00 N ATOM 2049 CA TYR B 43 145.000 2.608 5.956 1.00 0.00 C ATOM 2050 C TYR B 43 144.308 3.683 5.105 1.00 0.00 C ATOM 2051 O TYR B 43 143.499 3.370 4.252 1.00 0.00 O ATOM 2052 CB TYR B 43 144.044 2.079 7.033 1.00 0.00 C ATOM 2053 CG TYR B 43 143.602 3.193 7.947 1.00 0.00 C ATOM 2054 CD1 TYR B 43 142.610 4.082 7.529 1.00 0.00 C ATOM 2055 CD2 TYR B 43 144.170 3.324 9.220 1.00 0.00 C ATOM 2056 CE1 TYR B 43 142.186 5.106 8.380 1.00 0.00 C ATOM 2057 CE2 TYR B 43 143.745 4.350 10.073 1.00 0.00 C ATOM 2058 CZ TYR B 43 142.754 5.241 9.652 1.00 0.00 C ATOM 2059 OH TYR B 43 142.333 6.254 10.491 1.00 0.00 O ATOM 0 H TYR B 43 146.292 3.099 7.592 1.00 0.00 H new ATOM 0 HA TYR B 43 145.272 1.782 5.299 1.00 0.00 H new ATOM 0 HB2 TYR B 43 143.174 1.622 6.561 1.00 0.00 H new ATOM 0 HB3 TYR B 43 144.538 1.300 7.614 1.00 0.00 H new ATOM 0 HD1 TYR B 43 142.170 3.978 6.548 1.00 0.00 H new ATOM 0 HD2 TYR B 43 144.935 2.634 9.544 1.00 0.00 H new ATOM 0 HE1 TYR B 43 141.419 5.794 8.056 1.00 0.00 H new ATOM 0 HE2 TYR B 43 144.183 4.453 11.055 1.00 0.00 H new ATOM 0 HH TYR B 43 142.639 6.071 11.404 1.00 0.00 H new ATOM 2069 N VAL B 44 144.621 4.938 5.294 1.00 0.00 N ATOM 2070 CA VAL B 44 143.976 5.990 4.450 1.00 0.00 C ATOM 2071 C VAL B 44 144.662 5.981 3.079 1.00 0.00 C ATOM 2072 O VAL B 44 144.065 6.250 2.054 1.00 0.00 O ATOM 2073 CB VAL B 44 144.145 7.368 5.105 1.00 0.00 C ATOM 2074 CG1 VAL B 44 143.485 8.446 4.238 1.00 0.00 C ATOM 2075 CG2 VAL B 44 143.475 7.363 6.480 1.00 0.00 C ATOM 0 H VAL B 44 145.287 5.279 5.987 1.00 0.00 H new ATOM 0 HA VAL B 44 142.910 5.787 4.346 1.00 0.00 H new ATOM 0 HB VAL B 44 145.209 7.583 5.206 1.00 0.00 H new ATOM 0 HG11 VAL B 44 143.610 9.420 4.711 1.00 0.00 H new ATOM 0 HG12 VAL B 44 143.953 8.458 3.253 1.00 0.00 H new ATOM 0 HG13 VAL B 44 142.422 8.228 4.132 1.00 0.00 H new ATOM 0 HG21 VAL B 44 143.594 8.341 6.946 1.00 0.00 H new ATOM 0 HG22 VAL B 44 142.414 7.142 6.367 1.00 0.00 H new ATOM 0 HG23 VAL B 44 143.939 6.603 7.108 1.00 0.00 H new ATOM 2085 N VAL B 45 145.922 5.641 3.079 1.00 0.00 N ATOM 2086 CA VAL B 45 146.689 5.576 1.805 1.00 0.00 C ATOM 2087 C VAL B 45 146.302 4.282 1.090 1.00 0.00 C ATOM 2088 O VAL B 45 146.204 4.231 -0.120 1.00 0.00 O ATOM 2089 CB VAL B 45 148.191 5.573 2.100 1.00 0.00 C ATOM 2090 CG1 VAL B 45 148.967 5.357 0.800 1.00 0.00 C ATOM 2091 CG2 VAL B 45 148.590 6.915 2.714 1.00 0.00 C ATOM 0 H VAL B 45 146.456 5.404 3.915 1.00 0.00 H new ATOM 0 HA VAL B 45 146.461 6.440 1.181 1.00 0.00 H new ATOM 0 HB VAL B 45 148.423 4.769 2.798 1.00 0.00 H new ATOM 0 HG11 VAL B 45 150.036 5.355 1.011 1.00 0.00 H new ATOM 0 HG12 VAL B 45 148.682 4.401 0.361 1.00 0.00 H new ATOM 0 HG13 VAL B 45 148.736 6.161 0.101 1.00 0.00 H new ATOM 0 HG21 VAL B 45 149.659 6.915 2.925 1.00 0.00 H new ATOM 0 HG22 VAL B 45 148.358 7.718 2.015 1.00 0.00 H new ATOM 0 HG23 VAL B 45 148.037 7.070 3.641 1.00 0.00 H new ATOM 2101 N LEU B 46 146.046 3.245 1.838 1.00 0.00 N ATOM 2102 CA LEU B 46 145.626 1.960 1.218 1.00 0.00 C ATOM 2103 C LEU B 46 144.332 2.221 0.444 1.00 0.00 C ATOM 2104 O LEU B 46 144.121 1.713 -0.639 1.00 0.00 O ATOM 2105 CB LEU B 46 145.369 0.928 2.328 1.00 0.00 C ATOM 2106 CG LEU B 46 144.931 -0.427 1.729 1.00 0.00 C ATOM 2107 CD1 LEU B 46 146.116 -1.089 1.003 1.00 0.00 C ATOM 2108 CD2 LEU B 46 144.390 -1.355 2.851 1.00 0.00 C ATOM 0 H LEU B 46 146.110 3.233 2.856 1.00 0.00 H new ATOM 0 HA LEU B 46 146.397 1.577 0.550 1.00 0.00 H new ATOM 0 HB2 LEU B 46 146.273 0.793 2.921 1.00 0.00 H new ATOM 0 HB3 LEU B 46 144.598 1.298 3.003 1.00 0.00 H new ATOM 0 HG LEU B 46 144.133 -0.257 1.006 1.00 0.00 H new ATOM 0 HD11 LEU B 46 145.798 -2.044 0.584 1.00 0.00 H new ATOM 0 HD12 LEU B 46 146.461 -0.437 0.201 1.00 0.00 H new ATOM 0 HD13 LEU B 46 146.929 -1.256 1.710 1.00 0.00 H new ATOM 0 HD21 LEU B 46 144.084 -2.308 2.419 1.00 0.00 H new ATOM 0 HD22 LEU B 46 145.173 -1.527 3.590 1.00 0.00 H new ATOM 0 HD23 LEU B 46 143.534 -0.883 3.332 1.00 0.00 H new ATOM 2120 N GLY B 47 143.464 3.015 1.012 1.00 0.00 N ATOM 2121 CA GLY B 47 142.172 3.334 0.344 1.00 0.00 C ATOM 2122 C GLY B 47 142.430 4.009 -1.003 1.00 0.00 C ATOM 2123 O GLY B 47 141.781 3.715 -1.986 1.00 0.00 O ATOM 0 H GLY B 47 143.598 3.460 1.920 1.00 0.00 H new ATOM 0 HA2 GLY B 47 141.594 2.421 0.198 1.00 0.00 H new ATOM 0 HA3 GLY B 47 141.577 3.989 0.980 1.00 0.00 H new ATOM 2127 N GLN B 48 143.377 4.909 -1.063 1.00 0.00 N ATOM 2128 CA GLN B 48 143.678 5.589 -2.356 1.00 0.00 C ATOM 2129 C GLN B 48 144.092 4.533 -3.388 1.00 0.00 C ATOM 2130 O GLN B 48 143.659 4.548 -4.523 1.00 0.00 O ATOM 2131 CB GLN B 48 144.819 6.591 -2.136 1.00 0.00 C ATOM 2132 CG GLN B 48 145.146 7.325 -3.442 1.00 0.00 C ATOM 2133 CD GLN B 48 143.920 8.105 -3.919 1.00 0.00 C ATOM 2134 OE1 GLN B 48 143.446 7.882 -5.114 1.00 0.00 O flip ATOM 2135 NE2 GLN B 48 143.390 8.926 -3.197 1.00 0.00 N flip ATOM 0 H GLN B 48 143.953 5.201 -0.274 1.00 0.00 H new ATOM 0 HA GLN B 48 142.799 6.121 -2.721 1.00 0.00 H new ATOM 0 HB2 GLN B 48 144.536 7.311 -1.368 1.00 0.00 H new ATOM 0 HB3 GLN B 48 145.705 6.069 -1.773 1.00 0.00 H new ATOM 0 HG2 GLN B 48 145.984 8.005 -3.288 1.00 0.00 H new ATOM 0 HG3 GLN B 48 145.453 6.610 -4.205 1.00 0.00 H new ATOM 0 HE21 GLN B 48 143.762 9.099 -2.263 1.00 0.00 H new ATOM 0 HE22 GLN B 48 142.573 9.442 -3.525 1.00 0.00 H new ATOM 2144 N PHE B 49 144.919 3.604 -2.986 1.00 0.00 N ATOM 2145 CA PHE B 49 145.364 2.523 -3.915 1.00 0.00 C ATOM 2146 C PHE B 49 144.132 1.745 -4.388 1.00 0.00 C ATOM 2147 O PHE B 49 144.016 1.368 -5.537 1.00 0.00 O ATOM 2148 CB PHE B 49 146.316 1.594 -3.156 1.00 0.00 C ATOM 2149 CG PHE B 49 146.795 0.478 -4.056 1.00 0.00 C ATOM 2150 CD1 PHE B 49 147.664 0.759 -5.118 1.00 0.00 C ATOM 2151 CD2 PHE B 49 146.387 -0.841 -3.818 1.00 0.00 C ATOM 2152 CE1 PHE B 49 148.121 -0.277 -5.941 1.00 0.00 C ATOM 2153 CE2 PHE B 49 146.842 -1.876 -4.642 1.00 0.00 C ATOM 2154 CZ PHE B 49 147.710 -1.594 -5.704 1.00 0.00 C ATOM 0 H PHE B 49 145.309 3.547 -2.045 1.00 0.00 H new ATOM 0 HA PHE B 49 145.878 2.941 -4.781 1.00 0.00 H new ATOM 0 HB2 PHE B 49 147.169 2.162 -2.785 1.00 0.00 H new ATOM 0 HB3 PHE B 49 145.809 1.176 -2.286 1.00 0.00 H new ATOM 0 HD1 PHE B 49 147.981 1.775 -5.302 1.00 0.00 H new ATOM 0 HD2 PHE B 49 145.720 -1.059 -2.997 1.00 0.00 H new ATOM 0 HE1 PHE B 49 148.791 -0.060 -6.760 1.00 0.00 H new ATOM 0 HE2 PHE B 49 146.524 -2.892 -4.459 1.00 0.00 H new ATOM 0 HZ PHE B 49 148.062 -2.392 -6.340 1.00 0.00 H new ATOM 2164 N LEU B 50 143.219 1.513 -3.499 1.00 0.00 N ATOM 2165 CA LEU B 50 141.991 0.763 -3.885 1.00 0.00 C ATOM 2166 C LEU B 50 141.165 1.637 -4.834 1.00 0.00 C ATOM 2167 O LEU B 50 140.564 1.158 -5.775 1.00 0.00 O ATOM 2168 CB LEU B 50 141.177 0.424 -2.631 1.00 0.00 C ATOM 2169 CG LEU B 50 141.926 -0.622 -1.787 1.00 0.00 C ATOM 2170 CD1 LEU B 50 141.199 -0.806 -0.450 1.00 0.00 C ATOM 2171 CD2 LEU B 50 141.994 -1.971 -2.534 1.00 0.00 C ATOM 0 H LEU B 50 143.264 1.807 -2.523 1.00 0.00 H new ATOM 0 HA LEU B 50 142.259 -0.168 -4.385 1.00 0.00 H new ATOM 0 HB2 LEU B 50 141.008 1.325 -2.042 1.00 0.00 H new ATOM 0 HB3 LEU B 50 140.197 0.040 -2.916 1.00 0.00 H new ATOM 0 HG LEU B 50 142.943 -0.273 -1.609 1.00 0.00 H new ATOM 0 HD11 LEU B 50 141.726 -1.546 0.152 1.00 0.00 H new ATOM 0 HD12 LEU B 50 141.173 0.144 0.084 1.00 0.00 H new ATOM 0 HD13 LEU B 50 140.180 -1.147 -0.634 1.00 0.00 H new ATOM 0 HD21 LEU B 50 142.527 -2.699 -1.923 1.00 0.00 H new ATOM 0 HD22 LEU B 50 140.984 -2.331 -2.728 1.00 0.00 H new ATOM 0 HD23 LEU B 50 142.519 -1.837 -3.480 1.00 0.00 H new ATOM 2183 N VAL B 51 141.128 2.916 -4.586 1.00 0.00 N ATOM 2184 CA VAL B 51 140.342 3.838 -5.460 1.00 0.00 C ATOM 2185 C VAL B 51 140.939 3.864 -6.877 1.00 0.00 C ATOM 2186 O VAL B 51 140.244 4.095 -7.846 1.00 0.00 O ATOM 2187 CB VAL B 51 140.374 5.250 -4.858 1.00 0.00 C ATOM 2188 CG1 VAL B 51 139.788 6.260 -5.851 1.00 0.00 C ATOM 2189 CG2 VAL B 51 139.549 5.273 -3.567 1.00 0.00 C ATOM 0 H VAL B 51 141.611 3.368 -3.810 1.00 0.00 H new ATOM 0 HA VAL B 51 139.312 3.486 -5.521 1.00 0.00 H new ATOM 0 HB VAL B 51 141.408 5.520 -4.641 1.00 0.00 H new ATOM 0 HG11 VAL B 51 139.816 7.258 -5.414 1.00 0.00 H new ATOM 0 HG12 VAL B 51 140.375 6.250 -6.769 1.00 0.00 H new ATOM 0 HG13 VAL B 51 138.756 5.991 -6.077 1.00 0.00 H new ATOM 0 HG21 VAL B 51 139.571 6.275 -3.139 1.00 0.00 H new ATOM 0 HG22 VAL B 51 138.518 4.996 -3.789 1.00 0.00 H new ATOM 0 HG23 VAL B 51 139.970 4.564 -2.854 1.00 0.00 H new ATOM 2199 N LEU B 52 142.222 3.647 -7.004 1.00 0.00 N ATOM 2200 CA LEU B 52 142.858 3.681 -8.363 1.00 0.00 C ATOM 2201 C LEU B 52 142.802 2.300 -9.014 1.00 0.00 C ATOM 2202 O LEU B 52 143.468 2.053 -10.000 1.00 0.00 O ATOM 2203 CB LEU B 52 144.325 4.109 -8.246 1.00 0.00 C ATOM 2204 CG LEU B 52 144.432 5.527 -7.666 1.00 0.00 C ATOM 2205 CD1 LEU B 52 145.914 5.905 -7.546 1.00 0.00 C ATOM 2206 CD2 LEU B 52 143.718 6.536 -8.588 1.00 0.00 C ATOM 0 H LEU B 52 142.858 3.448 -6.232 1.00 0.00 H new ATOM 0 HA LEU B 52 142.310 4.396 -8.977 1.00 0.00 H new ATOM 0 HB2 LEU B 52 144.864 3.408 -7.608 1.00 0.00 H new ATOM 0 HB3 LEU B 52 144.798 4.075 -9.227 1.00 0.00 H new ATOM 0 HG LEU B 52 143.958 5.552 -6.685 1.00 0.00 H new ATOM 0 HD11 LEU B 52 146.001 6.911 -7.135 1.00 0.00 H new ATOM 0 HD12 LEU B 52 146.417 5.199 -6.886 1.00 0.00 H new ATOM 0 HD13 LEU B 52 146.378 5.875 -8.532 1.00 0.00 H new ATOM 0 HD21 LEU B 52 143.801 7.537 -8.165 1.00 0.00 H new ATOM 0 HD22 LEU B 52 144.182 6.519 -9.574 1.00 0.00 H new ATOM 0 HD23 LEU B 52 142.666 6.266 -8.677 1.00 0.00 H new ATOM 2218 N LYS B 53 142.010 1.400 -8.506 1.00 0.00 N ATOM 2219 CA LYS B 53 141.925 0.056 -9.141 1.00 0.00 C ATOM 2220 C LYS B 53 143.334 -0.491 -9.405 1.00 0.00 C ATOM 2221 O LYS B 53 143.576 -1.145 -10.400 1.00 0.00 O ATOM 2222 CB LYS B 53 141.169 0.185 -10.463 1.00 0.00 C ATOM 2223 CG LYS B 53 139.722 0.598 -10.182 1.00 0.00 C ATOM 2224 CD LYS B 53 138.961 0.730 -11.502 1.00 0.00 C ATOM 2225 CE LYS B 53 137.515 1.142 -11.218 1.00 0.00 C ATOM 2226 NZ LYS B 53 136.753 1.186 -12.498 1.00 0.00 N ATOM 0 H LYS B 53 141.421 1.534 -7.684 1.00 0.00 H new ATOM 0 HA LYS B 53 141.401 -0.631 -8.476 1.00 0.00 H new ATOM 0 HB2 LYS B 53 141.653 0.925 -11.101 1.00 0.00 H new ATOM 0 HB3 LYS B 53 141.191 -0.763 -11.001 1.00 0.00 H new ATOM 0 HG2 LYS B 53 139.239 -0.143 -9.545 1.00 0.00 H new ATOM 0 HG3 LYS B 53 139.702 1.545 -9.642 1.00 0.00 H new ATOM 0 HD2 LYS B 53 139.443 1.471 -12.139 1.00 0.00 H new ATOM 0 HD3 LYS B 53 138.981 -0.217 -12.042 1.00 0.00 H new ATOM 0 HE2 LYS B 53 137.052 0.434 -10.530 1.00 0.00 H new ATOM 0 HE3 LYS B 53 137.492 2.118 -10.734 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 135.949 1.839 -12.401 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 137.377 1.516 -13.262 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 136.401 0.234 -12.725 1.00 0.00 H new ATOM 2240 N LYS B 54 144.259 -0.229 -8.514 1.00 0.00 N ATOM 2241 CA LYS B 54 145.662 -0.727 -8.676 1.00 0.00 C ATOM 2242 C LYS B 54 146.286 -0.178 -9.968 1.00 0.00 C ATOM 2243 O LYS B 54 147.257 -0.715 -10.462 1.00 0.00 O ATOM 2244 CB LYS B 54 145.654 -2.259 -8.725 1.00 0.00 C ATOM 2245 CG LYS B 54 144.843 -2.797 -7.546 1.00 0.00 C ATOM 2246 CD LYS B 54 145.003 -4.317 -7.462 1.00 0.00 C ATOM 2247 CE LYS B 54 144.001 -4.877 -6.450 1.00 0.00 C ATOM 2248 NZ LYS B 54 144.096 -4.113 -5.175 1.00 0.00 N ATOM 0 H LYS B 54 144.099 0.318 -7.668 1.00 0.00 H new ATOM 0 HA LYS B 54 146.256 -0.384 -7.829 1.00 0.00 H new ATOM 0 HB2 LYS B 54 145.222 -2.602 -9.665 1.00 0.00 H new ATOM 0 HB3 LYS B 54 146.674 -2.641 -8.684 1.00 0.00 H new ATOM 0 HG2 LYS B 54 145.180 -2.334 -6.619 1.00 0.00 H new ATOM 0 HG3 LYS B 54 143.791 -2.538 -7.667 1.00 0.00 H new ATOM 0 HD2 LYS B 54 144.837 -4.766 -8.441 1.00 0.00 H new ATOM 0 HD3 LYS B 54 146.020 -4.571 -7.163 1.00 0.00 H new ATOM 0 HE2 LYS B 54 142.989 -4.811 -6.850 1.00 0.00 H new ATOM 0 HE3 LYS B 54 144.204 -5.933 -6.269 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 143.644 -4.655 -4.411 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 145.096 -3.953 -4.940 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 143.614 -3.197 -5.282 1.00 0.00 H new ATOM 2262 N ASP B 55 145.766 0.889 -10.512 1.00 0.00 N ATOM 2263 CA ASP B 55 146.380 1.447 -11.756 1.00 0.00 C ATOM 2264 C ASP B 55 147.771 1.998 -11.404 1.00 0.00 C ATOM 2265 O ASP B 55 147.907 2.947 -10.657 1.00 0.00 O ATOM 2266 CB ASP B 55 145.489 2.564 -12.298 1.00 0.00 C ATOM 2267 CG ASP B 55 146.162 3.222 -13.506 1.00 0.00 C ATOM 2268 OD1 ASP B 55 147.285 3.677 -13.359 1.00 0.00 O ATOM 2269 OD2 ASP B 55 145.543 3.258 -14.556 1.00 0.00 O ATOM 0 H ASP B 55 144.954 1.394 -10.157 1.00 0.00 H new ATOM 0 HA ASP B 55 146.476 0.674 -12.518 1.00 0.00 H new ATOM 0 HB2 ASP B 55 144.518 2.160 -12.586 1.00 0.00 H new ATOM 0 HB3 ASP B 55 145.308 3.307 -11.521 1.00 0.00 H new ATOM 2274 N GLU B 56 148.805 1.376 -11.912 1.00 0.00 N ATOM 2275 CA GLU B 56 150.205 1.806 -11.595 1.00 0.00 C ATOM 2276 C GLU B 56 150.530 3.223 -12.102 1.00 0.00 C ATOM 2277 O GLU B 56 151.178 3.988 -11.421 1.00 0.00 O ATOM 2278 CB GLU B 56 151.169 0.806 -12.244 1.00 0.00 C ATOM 2279 CG GLU B 56 152.618 1.169 -11.906 1.00 0.00 C ATOM 2280 CD GLU B 56 153.551 0.089 -12.460 1.00 0.00 C ATOM 2281 OE1 GLU B 56 153.057 -0.806 -13.126 1.00 0.00 O ATOM 2282 OE2 GLU B 56 154.741 0.169 -12.200 1.00 0.00 O ATOM 0 H GLU B 56 148.739 0.577 -12.542 1.00 0.00 H new ATOM 0 HA GLU B 56 150.311 1.827 -10.510 1.00 0.00 H new ATOM 0 HB2 GLU B 56 150.948 -0.202 -11.894 1.00 0.00 H new ATOM 0 HB3 GLU B 56 151.030 0.805 -13.325 1.00 0.00 H new ATOM 0 HG2 GLU B 56 152.871 2.139 -12.333 1.00 0.00 H new ATOM 0 HG3 GLU B 56 152.742 1.254 -10.826 1.00 0.00 H new ATOM 2289 N ASP B 57 150.118 3.575 -13.289 1.00 0.00 N ATOM 2290 CA ASP B 57 150.454 4.936 -13.818 1.00 0.00 C ATOM 2291 C ASP B 57 149.706 6.014 -13.032 1.00 0.00 C ATOM 2292 O ASP B 57 150.246 7.058 -12.721 1.00 0.00 O ATOM 2293 CB ASP B 57 150.045 5.018 -15.292 1.00 0.00 C ATOM 2294 CG ASP B 57 150.970 4.136 -16.132 1.00 0.00 C ATOM 2295 OD1 ASP B 57 152.036 3.799 -15.649 1.00 0.00 O ATOM 2296 OD2 ASP B 57 150.594 3.814 -17.247 1.00 0.00 O ATOM 0 H ASP B 57 149.567 2.987 -13.915 1.00 0.00 H new ATOM 0 HA ASP B 57 151.527 5.100 -13.714 1.00 0.00 H new ATOM 0 HB2 ASP B 57 149.011 4.695 -15.411 1.00 0.00 H new ATOM 0 HB3 ASP B 57 150.098 6.050 -15.637 1.00 0.00 H new ATOM 2301 N LEU B 58 148.483 5.768 -12.700 1.00 0.00 N ATOM 2302 CA LEU B 58 147.726 6.786 -11.919 1.00 0.00 C ATOM 2303 C LEU B 58 148.293 6.852 -10.502 1.00 0.00 C ATOM 2304 O LEU B 58 148.424 7.912 -9.922 1.00 0.00 O ATOM 2305 CB LEU B 58 146.241 6.427 -11.865 1.00 0.00 C ATOM 2306 CG LEU B 58 145.632 6.490 -13.274 1.00 0.00 C ATOM 2307 CD1 LEU B 58 144.192 5.968 -13.221 1.00 0.00 C ATOM 2308 CD2 LEU B 58 145.641 7.942 -13.797 1.00 0.00 C ATOM 0 H LEU B 58 147.970 4.916 -12.929 1.00 0.00 H new ATOM 0 HA LEU B 58 147.828 7.756 -12.405 1.00 0.00 H new ATOM 0 HB2 LEU B 58 146.115 5.427 -11.450 1.00 0.00 H new ATOM 0 HB3 LEU B 58 145.716 7.115 -11.202 1.00 0.00 H new ATOM 0 HG LEU B 58 146.225 5.873 -13.950 1.00 0.00 H new ATOM 0 HD11 LEU B 58 143.753 6.010 -14.218 1.00 0.00 H new ATOM 0 HD12 LEU B 58 144.191 4.937 -12.867 1.00 0.00 H new ATOM 0 HD13 LEU B 58 143.606 6.586 -12.540 1.00 0.00 H new ATOM 0 HD21 LEU B 58 145.207 7.971 -14.796 1.00 0.00 H new ATOM 0 HD22 LEU B 58 145.056 8.573 -13.128 1.00 0.00 H new ATOM 0 HD23 LEU B 58 146.667 8.308 -13.836 1.00 0.00 H new ATOM 2320 N PHE B 59 148.653 5.726 -9.950 1.00 0.00 N ATOM 2321 CA PHE B 59 149.236 5.719 -8.580 1.00 0.00 C ATOM 2322 C PHE B 59 150.565 6.483 -8.577 1.00 0.00 C ATOM 2323 O PHE B 59 150.810 7.318 -7.728 1.00 0.00 O ATOM 2324 CB PHE B 59 149.458 4.274 -8.126 1.00 0.00 C ATOM 2325 CG PHE B 59 150.102 4.264 -6.758 1.00 0.00 C ATOM 2326 CD1 PHE B 59 149.369 4.668 -5.634 1.00 0.00 C ATOM 2327 CD2 PHE B 59 151.432 3.845 -6.609 1.00 0.00 C ATOM 2328 CE1 PHE B 59 149.964 4.653 -4.366 1.00 0.00 C ATOM 2329 CE2 PHE B 59 152.026 3.830 -5.341 1.00 0.00 C ATOM 2330 CZ PHE B 59 151.293 4.235 -4.220 1.00 0.00 C ATOM 0 H PHE B 59 148.568 4.810 -10.390 1.00 0.00 H new ATOM 0 HA PHE B 59 148.548 6.208 -7.891 1.00 0.00 H new ATOM 0 HB2 PHE B 59 148.507 3.742 -8.095 1.00 0.00 H new ATOM 0 HB3 PHE B 59 150.093 3.751 -8.841 1.00 0.00 H new ATOM 0 HD1 PHE B 59 148.345 4.991 -5.746 1.00 0.00 H new ATOM 0 HD2 PHE B 59 151.999 3.533 -7.474 1.00 0.00 H new ATOM 0 HE1 PHE B 59 149.398 4.964 -3.500 1.00 0.00 H new ATOM 0 HE2 PHE B 59 153.050 3.506 -5.228 1.00 0.00 H new ATOM 0 HZ PHE B 59 151.752 4.225 -3.242 1.00 0.00 H new ATOM 2340 N ARG B 60 151.438 6.185 -9.508 1.00 0.00 N ATOM 2341 CA ARG B 60 152.761 6.879 -9.540 1.00 0.00 C ATOM 2342 C ARG B 60 152.584 8.387 -9.703 1.00 0.00 C ATOM 2343 O ARG B 60 153.194 9.166 -8.998 1.00 0.00 O ATOM 2344 CB ARG B 60 153.604 6.359 -10.710 1.00 0.00 C ATOM 2345 CG ARG B 60 154.062 4.925 -10.439 1.00 0.00 C ATOM 2346 CD ARG B 60 154.934 4.446 -11.603 1.00 0.00 C ATOM 2347 NE ARG B 60 154.191 4.621 -12.883 1.00 0.00 N ATOM 2348 CZ ARG B 60 154.827 4.551 -14.021 1.00 0.00 C ATOM 2349 NH1 ARG B 60 156.101 4.274 -14.042 1.00 0.00 N ATOM 2350 NH2 ARG B 60 154.186 4.751 -15.139 1.00 0.00 N ATOM 0 H ARG B 60 151.292 5.494 -10.244 1.00 0.00 H new ATOM 0 HA ARG B 60 153.264 6.674 -8.595 1.00 0.00 H new ATOM 0 HB2 ARG B 60 153.021 6.394 -11.631 1.00 0.00 H new ATOM 0 HB3 ARG B 60 154.471 7.003 -10.857 1.00 0.00 H new ATOM 0 HG2 ARG B 60 154.624 4.880 -9.506 1.00 0.00 H new ATOM 0 HG3 ARG B 60 153.198 4.271 -10.323 1.00 0.00 H new ATOM 0 HD2 ARG B 60 155.866 5.011 -11.630 1.00 0.00 H new ATOM 0 HD3 ARG B 60 155.201 3.398 -11.465 1.00 0.00 H new ATOM 0 HE ARG B 60 153.186 4.795 -12.870 1.00 0.00 H new ATOM 0 HH11 ARG B 60 156.602 4.112 -13.169 1.00 0.00 H new ATOM 0 HH12 ARG B 60 156.596 4.220 -14.932 1.00 0.00 H new ATOM 0 HH21 ARG B 60 153.188 4.962 -15.124 1.00 0.00 H new ATOM 0 HH22 ARG B 60 154.682 4.696 -16.028 1.00 0.00 H new ATOM 2364 N GLU B 61 151.765 8.815 -10.621 1.00 0.00 N ATOM 2365 CA GLU B 61 151.571 10.276 -10.811 1.00 0.00 C ATOM 2366 C GLU B 61 150.974 10.863 -9.529 1.00 0.00 C ATOM 2367 O GLU B 61 151.313 11.955 -9.119 1.00 0.00 O ATOM 2368 CB GLU B 61 150.620 10.504 -11.993 1.00 0.00 C ATOM 2369 CG GLU B 61 150.466 12.002 -12.271 1.00 0.00 C ATOM 2370 CD GLU B 61 151.795 12.573 -12.771 1.00 0.00 C ATOM 2371 OE1 GLU B 61 152.664 11.788 -13.112 1.00 0.00 O ATOM 2372 OE2 GLU B 61 151.920 13.786 -12.808 1.00 0.00 O ATOM 0 H GLU B 61 151.223 8.218 -11.246 1.00 0.00 H new ATOM 0 HA GLU B 61 152.522 10.764 -11.022 1.00 0.00 H new ATOM 0 HB2 GLU B 61 151.004 10.000 -12.880 1.00 0.00 H new ATOM 0 HB3 GLU B 61 149.646 10.066 -11.775 1.00 0.00 H new ATOM 0 HG2 GLU B 61 149.686 12.165 -13.015 1.00 0.00 H new ATOM 0 HG3 GLU B 61 150.155 12.520 -11.364 1.00 0.00 H new ATOM 2379 N TRP B 62 150.090 10.146 -8.895 1.00 0.00 N ATOM 2380 CA TRP B 62 149.470 10.662 -7.640 1.00 0.00 C ATOM 2381 C TRP B 62 150.516 10.852 -6.529 1.00 0.00 C ATOM 2382 O TRP B 62 150.552 11.873 -5.874 1.00 0.00 O ATOM 2383 CB TRP B 62 148.398 9.669 -7.155 1.00 0.00 C ATOM 2384 CG TRP B 62 147.956 10.037 -5.767 1.00 0.00 C ATOM 2385 CD1 TRP B 62 147.010 10.952 -5.460 1.00 0.00 C ATOM 2386 CD2 TRP B 62 148.457 9.524 -4.499 1.00 0.00 C ATOM 2387 NE1 TRP B 62 146.892 11.028 -4.081 1.00 0.00 N ATOM 2388 CE2 TRP B 62 147.766 10.166 -3.445 1.00 0.00 C ATOM 2389 CE3 TRP B 62 149.434 8.569 -4.168 1.00 0.00 C ATOM 2390 CZ2 TRP B 62 148.038 9.869 -2.106 1.00 0.00 C ATOM 2391 CZ3 TRP B 62 149.709 8.267 -2.825 1.00 0.00 C ATOM 2392 CH2 TRP B 62 149.014 8.917 -1.796 1.00 0.00 C ATOM 0 H TRP B 62 149.769 9.224 -9.190 1.00 0.00 H new ATOM 0 HA TRP B 62 149.023 11.632 -7.859 1.00 0.00 H new ATOM 0 HB2 TRP B 62 147.545 9.680 -7.833 1.00 0.00 H new ATOM 0 HB3 TRP B 62 148.798 8.655 -7.163 1.00 0.00 H new ATOM 0 HD1 TRP B 62 146.439 11.529 -6.172 1.00 0.00 H new ATOM 0 HE1 TRP B 62 146.240 11.644 -3.595 1.00 0.00 H new ATOM 0 HE3 TRP B 62 149.977 8.064 -4.953 1.00 0.00 H new ATOM 0 HZ2 TRP B 62 147.498 10.371 -1.317 1.00 0.00 H new ATOM 0 HZ3 TRP B 62 150.460 7.530 -2.583 1.00 0.00 H new ATOM 0 HH2 TRP B 62 149.232 8.683 -0.765 1.00 0.00 H new ATOM 2403 N LEU B 63 151.344 9.873 -6.291 1.00 0.00 N ATOM 2404 CA LEU B 63 152.353 10.006 -5.198 1.00 0.00 C ATOM 2405 C LEU B 63 153.419 11.046 -5.558 1.00 0.00 C ATOM 2406 O LEU B 63 153.751 11.903 -4.763 1.00 0.00 O ATOM 2407 CB LEU B 63 153.014 8.642 -4.955 1.00 0.00 C ATOM 2408 CG LEU B 63 154.060 8.738 -3.835 1.00 0.00 C ATOM 2409 CD1 LEU B 63 153.407 9.214 -2.528 1.00 0.00 C ATOM 2410 CD2 LEU B 63 154.682 7.353 -3.620 1.00 0.00 C ATOM 0 H LEU B 63 151.368 8.990 -6.802 1.00 0.00 H new ATOM 0 HA LEU B 63 151.848 10.341 -4.292 1.00 0.00 H new ATOM 0 HB2 LEU B 63 152.255 7.907 -4.688 1.00 0.00 H new ATOM 0 HB3 LEU B 63 153.487 8.293 -5.873 1.00 0.00 H new ATOM 0 HG LEU B 63 154.828 9.457 -4.121 1.00 0.00 H new ATOM 0 HD11 LEU B 63 154.163 9.276 -1.745 1.00 0.00 H new ATOM 0 HD12 LEU B 63 152.961 10.197 -2.681 1.00 0.00 H new ATOM 0 HD13 LEU B 63 152.633 8.507 -2.229 1.00 0.00 H new ATOM 0 HD21 LEU B 63 155.427 7.408 -2.826 1.00 0.00 H new ATOM 0 HD22 LEU B 63 153.903 6.644 -3.338 1.00 0.00 H new ATOM 0 HD23 LEU B 63 155.158 7.021 -4.542 1.00 0.00 H new ATOM 2422 N LYS B 64 153.964 10.978 -6.738 1.00 0.00 N ATOM 2423 CA LYS B 64 155.013 11.965 -7.132 1.00 0.00 C ATOM 2424 C LYS B 64 154.430 13.377 -7.122 1.00 0.00 C ATOM 2425 O LYS B 64 155.012 14.301 -6.591 1.00 0.00 O ATOM 2426 CB LYS B 64 155.536 11.639 -8.533 1.00 0.00 C ATOM 2427 CG LYS B 64 156.696 12.580 -8.875 1.00 0.00 C ATOM 2428 CD LYS B 64 157.221 12.256 -10.273 1.00 0.00 C ATOM 2429 CE LYS B 64 158.393 13.183 -10.608 1.00 0.00 C ATOM 2430 NZ LYS B 64 157.920 14.597 -10.638 1.00 0.00 N ATOM 0 H LYS B 64 153.731 10.284 -7.448 1.00 0.00 H new ATOM 0 HA LYS B 64 155.835 11.909 -6.418 1.00 0.00 H new ATOM 0 HB2 LYS B 64 155.869 10.602 -8.577 1.00 0.00 H new ATOM 0 HB3 LYS B 64 154.737 11.748 -9.266 1.00 0.00 H new ATOM 0 HG2 LYS B 64 156.362 13.617 -8.832 1.00 0.00 H new ATOM 0 HG3 LYS B 64 157.495 12.472 -8.141 1.00 0.00 H new ATOM 0 HD2 LYS B 64 157.542 11.215 -10.320 1.00 0.00 H new ATOM 0 HD3 LYS B 64 156.426 12.378 -11.009 1.00 0.00 H new ATOM 0 HE2 LYS B 64 159.183 13.069 -9.866 1.00 0.00 H new ATOM 0 HE3 LYS B 64 158.820 12.911 -11.573 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 158.593 15.177 -11.179 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 156.984 14.641 -11.090 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 157.853 14.961 -9.666 1.00 0.00 H new ATOM 2444 N ASP B 65 153.285 13.544 -7.718 1.00 0.00 N ATOM 2445 CA ASP B 65 152.649 14.888 -7.764 1.00 0.00 C ATOM 2446 C ASP B 65 152.206 15.297 -6.359 1.00 0.00 C ATOM 2447 O ASP B 65 152.111 16.466 -6.043 1.00 0.00 O ATOM 2448 CB ASP B 65 151.436 14.841 -8.696 1.00 0.00 C ATOM 2449 CG ASP B 65 150.937 16.262 -8.961 1.00 0.00 C ATOM 2450 OD1 ASP B 65 150.937 17.053 -8.031 1.00 0.00 O ATOM 2451 OD2 ASP B 65 150.570 16.538 -10.090 1.00 0.00 O ATOM 0 H ASP B 65 152.758 12.802 -8.179 1.00 0.00 H new ATOM 0 HA ASP B 65 153.367 15.619 -8.138 1.00 0.00 H new ATOM 0 HB2 ASP B 65 151.705 14.358 -9.635 1.00 0.00 H new ATOM 0 HB3 ASP B 65 150.642 14.244 -8.247 1.00 0.00 H new ATOM 2456 N THR B 66 151.901 14.341 -5.523 1.00 0.00 N ATOM 2457 CA THR B 66 151.426 14.670 -4.150 1.00 0.00 C ATOM 2458 C THR B 66 152.596 15.034 -3.228 1.00 0.00 C ATOM 2459 O THR B 66 152.434 15.849 -2.342 1.00 0.00 O ATOM 2460 CB THR B 66 150.672 13.464 -3.576 1.00 0.00 C ATOM 2461 OG1 THR B 66 149.478 13.263 -4.320 1.00 0.00 O ATOM 2462 CG2 THR B 66 150.316 13.718 -2.108 1.00 0.00 C ATOM 0 H THR B 66 151.961 13.345 -5.733 1.00 0.00 H new ATOM 0 HA THR B 66 150.764 15.534 -4.210 1.00 0.00 H new ATOM 0 HB THR B 66 151.306 12.580 -3.642 1.00 0.00 H new ATOM 0 HG1 THR B 66 149.699 12.885 -5.197 1.00 0.00 H new ATOM 0 HG21 THR B 66 149.781 12.856 -1.709 1.00 0.00 H new ATOM 0 HG22 THR B 66 151.229 13.876 -1.534 1.00 0.00 H new ATOM 0 HG23 THR B 66 149.684 14.603 -2.035 1.00 0.00 H new ATOM 2470 N CYS B 67 153.758 14.427 -3.378 1.00 0.00 N ATOM 2471 CA CYS B 67 154.896 14.742 -2.447 1.00 0.00 C ATOM 2472 C CYS B 67 156.205 15.003 -3.199 1.00 0.00 C ATOM 2473 O CYS B 67 157.038 15.768 -2.753 1.00 0.00 O ATOM 2474 CB CYS B 67 155.103 13.553 -1.510 1.00 0.00 C ATOM 2475 SG CYS B 67 155.739 12.147 -2.455 1.00 0.00 S ATOM 0 H CYS B 67 153.965 13.734 -4.098 1.00 0.00 H new ATOM 0 HA CYS B 67 154.638 15.647 -1.897 1.00 0.00 H new ATOM 0 HB2 CYS B 67 155.802 13.818 -0.717 1.00 0.00 H new ATOM 0 HB3 CYS B 67 154.162 13.286 -1.029 1.00 0.00 H new ATOM 0 HG CYS B 67 154.904 11.851 -3.407 1.00 0.00 H new ATOM 2481 N GLY B 68 156.403 14.365 -4.329 1.00 0.00 N ATOM 2482 CA GLY B 68 157.669 14.561 -5.110 1.00 0.00 C ATOM 2483 C GLY B 68 158.511 13.282 -5.041 1.00 0.00 C ATOM 2484 O GLY B 68 159.686 13.287 -5.348 1.00 0.00 O ATOM 0 H GLY B 68 155.739 13.713 -4.747 1.00 0.00 H new ATOM 0 HA2 GLY B 68 157.436 14.801 -6.147 1.00 0.00 H new ATOM 0 HA3 GLY B 68 158.232 15.403 -4.707 1.00 0.00 H new ATOM 2488 N ALA B 69 157.922 12.185 -4.643 1.00 0.00 N ATOM 2489 CA ALA B 69 158.691 10.908 -4.556 1.00 0.00 C ATOM 2490 C ALA B 69 159.403 10.643 -5.886 1.00 0.00 C ATOM 2491 O ALA B 69 158.966 11.083 -6.931 1.00 0.00 O ATOM 2492 CB ALA B 69 157.729 9.755 -4.256 1.00 0.00 C ATOM 0 H ALA B 69 156.940 12.118 -4.374 1.00 0.00 H new ATOM 0 HA ALA B 69 159.431 10.985 -3.759 1.00 0.00 H new ATOM 0 HB1 ALA B 69 158.288 8.822 -4.192 1.00 0.00 H new ATOM 0 HB2 ALA B 69 157.223 9.940 -3.309 1.00 0.00 H new ATOM 0 HB3 ALA B 69 156.990 9.681 -5.054 1.00 0.00 H new ATOM 2498 N ASN B 70 160.501 9.931 -5.857 1.00 0.00 N ATOM 2499 CA ASN B 70 161.249 9.646 -7.121 1.00 0.00 C ATOM 2500 C ASN B 70 160.784 8.315 -7.720 1.00 0.00 C ATOM 2501 O ASN B 70 160.019 7.581 -7.125 1.00 0.00 O ATOM 2502 CB ASN B 70 162.746 9.568 -6.818 1.00 0.00 C ATOM 2503 CG ASN B 70 163.222 10.903 -6.242 1.00 0.00 C ATOM 2504 OD1 ASN B 70 163.762 10.949 -5.155 1.00 0.00 O ATOM 2505 ND2 ASN B 70 163.046 11.997 -6.931 1.00 0.00 N ATOM 0 H ASN B 70 160.913 9.534 -5.012 1.00 0.00 H new ATOM 0 HA ASN B 70 161.057 10.446 -7.836 1.00 0.00 H new ATOM 0 HB2 ASN B 70 162.943 8.764 -6.109 1.00 0.00 H new ATOM 0 HB3 ASN B 70 163.300 9.334 -7.727 1.00 0.00 H new ATOM 0 HD21 ASN B 70 163.362 12.892 -6.557 1.00 0.00 H new ATOM 0 HD22 ASN B 70 162.592 11.957 -7.844 1.00 0.00 H new ATOM 2512 N ALA B 71 161.235 8.014 -8.906 1.00 0.00 N ATOM 2513 CA ALA B 71 160.825 6.749 -9.584 1.00 0.00 C ATOM 2514 C ALA B 71 161.233 5.518 -8.766 1.00 0.00 C ATOM 2515 O ALA B 71 160.538 4.525 -8.756 1.00 0.00 O ATOM 2516 CB ALA B 71 161.489 6.674 -10.960 1.00 0.00 C ATOM 0 H ALA B 71 161.878 8.597 -9.442 1.00 0.00 H new ATOM 0 HA ALA B 71 159.739 6.754 -9.682 1.00 0.00 H new ATOM 0 HB1 ALA B 71 161.191 5.751 -11.458 1.00 0.00 H new ATOM 0 HB2 ALA B 71 161.177 7.528 -11.562 1.00 0.00 H new ATOM 0 HB3 ALA B 71 162.573 6.690 -10.842 1.00 0.00 H new ATOM 2522 N LYS B 72 162.353 5.550 -8.096 1.00 0.00 N ATOM 2523 CA LYS B 72 162.765 4.343 -7.318 1.00 0.00 C ATOM 2524 C LYS B 72 161.875 4.187 -6.085 1.00 0.00 C ATOM 2525 O LYS B 72 161.496 3.093 -5.710 1.00 0.00 O ATOM 2526 CB LYS B 72 164.226 4.478 -6.889 1.00 0.00 C ATOM 2527 CG LYS B 72 165.122 4.378 -8.125 1.00 0.00 C ATOM 2528 CD LYS B 72 166.589 4.512 -7.714 1.00 0.00 C ATOM 2529 CE LYS B 72 167.475 4.410 -8.959 1.00 0.00 C ATOM 2530 NZ LYS B 72 168.888 4.175 -8.547 1.00 0.00 N ATOM 0 H LYS B 72 162.992 6.344 -8.052 1.00 0.00 H new ATOM 0 HA LYS B 72 162.656 3.460 -7.948 1.00 0.00 H new ATOM 0 HB2 LYS B 72 164.384 5.432 -6.387 1.00 0.00 H new ATOM 0 HB3 LYS B 72 164.482 3.695 -6.175 1.00 0.00 H new ATOM 0 HG2 LYS B 72 164.961 3.423 -8.626 1.00 0.00 H new ATOM 0 HG3 LYS B 72 164.862 5.160 -8.838 1.00 0.00 H new ATOM 0 HD2 LYS B 72 166.753 5.467 -7.214 1.00 0.00 H new ATOM 0 HD3 LYS B 72 166.852 3.730 -7.002 1.00 0.00 H new ATOM 0 HE2 LYS B 72 167.131 3.596 -9.597 1.00 0.00 H new ATOM 0 HE3 LYS B 72 167.404 5.326 -9.545 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 169.489 4.106 -9.393 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 169.213 4.966 -7.955 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 168.949 3.289 -8.006 1.00 0.00 H new ATOM 2544 N GLN B 73 161.557 5.275 -5.441 1.00 0.00 N ATOM 2545 CA GLN B 73 160.711 5.211 -4.217 1.00 0.00 C ATOM 2546 C GLN B 73 159.303 4.747 -4.569 1.00 0.00 C ATOM 2547 O GLN B 73 158.677 4.012 -3.833 1.00 0.00 O ATOM 2548 CB GLN B 73 160.642 6.603 -3.580 1.00 0.00 C ATOM 2549 CG GLN B 73 162.009 6.979 -3.000 1.00 0.00 C ATOM 2550 CD GLN B 73 162.345 6.062 -1.823 1.00 0.00 C ATOM 2551 OE1 GLN B 73 163.411 5.482 -1.775 1.00 0.00 O ATOM 2552 NE2 GLN B 73 161.475 5.907 -0.864 1.00 0.00 N ATOM 0 H GLN B 73 161.850 6.214 -5.713 1.00 0.00 H new ATOM 0 HA GLN B 73 161.151 4.501 -3.517 1.00 0.00 H new ATOM 0 HB2 GLN B 73 160.338 7.339 -4.325 1.00 0.00 H new ATOM 0 HB3 GLN B 73 159.888 6.616 -2.793 1.00 0.00 H new ATOM 0 HG2 GLN B 73 162.776 6.893 -3.769 1.00 0.00 H new ATOM 0 HG3 GLN B 73 162.001 8.018 -2.672 1.00 0.00 H new ATOM 0 HE21 GLN B 73 160.580 6.394 -0.904 1.00 0.00 H new ATOM 0 HE22 GLN B 73 161.690 5.299 -0.074 1.00 0.00 H new ATOM 2561 N SER B 74 158.794 5.180 -5.687 1.00 0.00 N ATOM 2562 CA SER B 74 157.421 4.773 -6.078 1.00 0.00 C ATOM 2563 C SER B 74 157.387 3.271 -6.377 1.00 0.00 C ATOM 2564 O SER B 74 156.423 2.596 -6.075 1.00 0.00 O ATOM 2565 CB SER B 74 156.993 5.554 -7.320 1.00 0.00 C ATOM 2566 OG SER B 74 155.585 5.447 -7.471 1.00 0.00 O ATOM 0 H SER B 74 159.270 5.797 -6.345 1.00 0.00 H new ATOM 0 HA SER B 74 156.735 4.988 -5.258 1.00 0.00 H new ATOM 0 HB2 SER B 74 157.283 6.600 -7.225 1.00 0.00 H new ATOM 0 HB3 SER B 74 157.497 5.162 -8.203 1.00 0.00 H new ATOM 0 HG SER B 74 155.220 6.311 -7.755 1.00 0.00 H new ATOM 2572 N ARG B 75 158.424 2.736 -6.971 1.00 0.00 N ATOM 2573 CA ARG B 75 158.440 1.280 -7.291 1.00 0.00 C ATOM 2574 C ARG B 75 158.305 0.471 -6.002 1.00 0.00 C ATOM 2575 O ARG B 75 157.654 -0.554 -5.978 1.00 0.00 O ATOM 2576 CB ARG B 75 159.767 0.917 -7.973 1.00 0.00 C ATOM 2577 CG ARG B 75 159.859 1.565 -9.364 1.00 0.00 C ATOM 2578 CD ARG B 75 159.092 0.742 -10.407 1.00 0.00 C ATOM 2579 NE ARG B 75 159.168 1.443 -11.720 1.00 0.00 N ATOM 2580 CZ ARG B 75 158.836 0.820 -12.816 1.00 0.00 C ATOM 2581 NH1 ARG B 75 158.415 -0.413 -12.765 1.00 0.00 N ATOM 2582 NH2 ARG B 75 158.918 1.435 -13.965 1.00 0.00 N ATOM 0 H ARG B 75 159.261 3.248 -7.248 1.00 0.00 H new ATOM 0 HA ARG B 75 157.609 1.051 -7.958 1.00 0.00 H new ATOM 0 HB2 ARG B 75 160.602 1.249 -7.356 1.00 0.00 H new ATOM 0 HB3 ARG B 75 159.850 -0.166 -8.065 1.00 0.00 H new ATOM 0 HG2 ARG B 75 159.455 2.577 -9.325 1.00 0.00 H new ATOM 0 HG3 ARG B 75 160.904 1.651 -9.661 1.00 0.00 H new ATOM 0 HD2 ARG B 75 159.519 -0.258 -10.487 1.00 0.00 H new ATOM 0 HD3 ARG B 75 158.052 0.621 -10.103 1.00 0.00 H new ATOM 0 HE ARG B 75 159.481 2.413 -11.761 1.00 0.00 H new ATOM 0 HH11 ARG B 75 158.345 -0.891 -11.867 1.00 0.00 H new ATOM 0 HH12 ARG B 75 158.156 -0.899 -13.623 1.00 0.00 H new ATOM 0 HH21 ARG B 75 159.241 2.402 -14.004 1.00 0.00 H new ATOM 0 HH22 ARG B 75 158.659 0.949 -14.823 1.00 0.00 H new ATOM 2596 N ASP B 76 158.935 0.889 -4.936 1.00 0.00 N ATOM 2597 CA ASP B 76 158.866 0.110 -3.668 1.00 0.00 C ATOM 2598 C ASP B 76 157.453 0.139 -3.090 1.00 0.00 C ATOM 2599 O ASP B 76 156.963 -0.854 -2.588 1.00 0.00 O ATOM 2600 CB ASP B 76 159.838 0.718 -2.654 1.00 0.00 C ATOM 2601 CG ASP B 76 161.275 0.441 -3.096 1.00 0.00 C ATOM 2602 OD1 ASP B 76 161.461 -0.432 -3.928 1.00 0.00 O ATOM 2603 OD2 ASP B 76 162.167 1.106 -2.595 1.00 0.00 O ATOM 0 H ASP B 76 159.496 1.740 -4.890 1.00 0.00 H new ATOM 0 HA ASP B 76 159.135 -0.925 -3.877 1.00 0.00 H new ATOM 0 HB2 ASP B 76 159.672 1.792 -2.574 1.00 0.00 H new ATOM 0 HB3 ASP B 76 159.662 0.293 -1.666 1.00 0.00 H new ATOM 2608 N CYS B 77 156.785 1.255 -3.148 1.00 0.00 N ATOM 2609 CA CYS B 77 155.406 1.316 -2.593 1.00 0.00 C ATOM 2610 C CYS B 77 154.463 0.458 -3.440 1.00 0.00 C ATOM 2611 O CYS B 77 153.587 -0.203 -2.918 1.00 0.00 O ATOM 2612 CB CYS B 77 154.919 2.767 -2.602 1.00 0.00 C ATOM 2613 SG CYS B 77 155.837 3.717 -1.366 1.00 0.00 S ATOM 0 H CYS B 77 157.132 2.124 -3.554 1.00 0.00 H new ATOM 0 HA CYS B 77 155.414 0.936 -1.571 1.00 0.00 H new ATOM 0 HB2 CYS B 77 155.060 3.203 -3.591 1.00 0.00 H new ATOM 0 HB3 CYS B 77 153.851 2.805 -2.386 1.00 0.00 H new ATOM 0 HG CYS B 77 156.362 2.905 -0.497 1.00 0.00 H new ATOM 2619 N PHE B 78 154.604 0.473 -4.739 1.00 0.00 N ATOM 2620 CA PHE B 78 153.677 -0.332 -5.581 1.00 0.00 C ATOM 2621 C PHE B 78 153.762 -1.809 -5.201 1.00 0.00 C ATOM 2622 O PHE B 78 152.788 -2.414 -4.800 1.00 0.00 O ATOM 2623 CB PHE B 78 154.067 -0.173 -7.050 1.00 0.00 C ATOM 2624 CG PHE B 78 153.141 -0.998 -7.907 1.00 0.00 C ATOM 2625 CD1 PHE B 78 153.465 -2.328 -8.204 1.00 0.00 C ATOM 2626 CD2 PHE B 78 151.958 -0.439 -8.403 1.00 0.00 C ATOM 2627 CE1 PHE B 78 152.607 -3.099 -8.998 1.00 0.00 C ATOM 2628 CE2 PHE B 78 151.099 -1.209 -9.197 1.00 0.00 C ATOM 2629 CZ PHE B 78 151.424 -2.538 -9.494 1.00 0.00 C ATOM 0 H PHE B 78 155.313 1.002 -5.247 1.00 0.00 H new ATOM 0 HA PHE B 78 152.658 0.020 -5.421 1.00 0.00 H new ATOM 0 HB2 PHE B 78 154.011 0.876 -7.341 1.00 0.00 H new ATOM 0 HB3 PHE B 78 155.099 -0.491 -7.200 1.00 0.00 H new ATOM 0 HD1 PHE B 78 154.378 -2.759 -7.820 1.00 0.00 H new ATOM 0 HD2 PHE B 78 151.707 0.586 -8.174 1.00 0.00 H new ATOM 0 HE1 PHE B 78 152.857 -4.124 -9.227 1.00 0.00 H new ATOM 0 HE2 PHE B 78 150.186 -0.778 -9.580 1.00 0.00 H new ATOM 0 HZ PHE B 78 150.761 -3.131 -10.107 1.00 0.00 H new ATOM 2639 N GLY B 79 154.916 -2.399 -5.339 1.00 0.00 N ATOM 2640 CA GLY B 79 155.065 -3.842 -5.005 1.00 0.00 C ATOM 2641 C GLY B 79 154.772 -4.081 -3.524 1.00 0.00 C ATOM 2642 O GLY B 79 154.265 -5.114 -3.141 1.00 0.00 O ATOM 0 H GLY B 79 155.766 -1.942 -5.670 1.00 0.00 H new ATOM 0 HA2 GLY B 79 154.385 -4.435 -5.617 1.00 0.00 H new ATOM 0 HA3 GLY B 79 156.077 -4.173 -5.240 1.00 0.00 H new ATOM 2646 N CYS B 80 155.086 -3.138 -2.685 1.00 0.00 N ATOM 2647 CA CYS B 80 154.819 -3.331 -1.233 1.00 0.00 C ATOM 2648 C CYS B 80 153.309 -3.326 -0.979 1.00 0.00 C ATOM 2649 O CYS B 80 152.778 -4.204 -0.330 1.00 0.00 O ATOM 2650 CB CYS B 80 155.477 -2.199 -0.439 1.00 0.00 C ATOM 2651 SG CYS B 80 155.214 -2.475 1.331 1.00 0.00 S ATOM 0 H CYS B 80 155.513 -2.247 -2.938 1.00 0.00 H new ATOM 0 HA CYS B 80 155.233 -4.288 -0.914 1.00 0.00 H new ATOM 0 HB2 CYS B 80 156.544 -2.159 -0.658 1.00 0.00 H new ATOM 0 HB3 CYS B 80 155.055 -1.239 -0.735 1.00 0.00 H new ATOM 0 HG CYS B 80 154.938 -1.344 1.910 1.00 0.00 H new ATOM 2657 N LEU B 81 152.613 -2.355 -1.501 1.00 0.00 N ATOM 2658 CA LEU B 81 151.137 -2.327 -1.293 1.00 0.00 C ATOM 2659 C LEU B 81 150.491 -3.467 -2.091 1.00 0.00 C ATOM 2660 O LEU B 81 149.574 -4.116 -1.629 1.00 0.00 O ATOM 2661 CB LEU B 81 150.578 -0.986 -1.776 1.00 0.00 C ATOM 2662 CG LEU B 81 151.176 0.160 -0.947 1.00 0.00 C ATOM 2663 CD1 LEU B 81 150.788 1.497 -1.587 1.00 0.00 C ATOM 2664 CD2 LEU B 81 150.649 0.109 0.500 1.00 0.00 C ATOM 0 H LEU B 81 152.995 -1.589 -2.056 1.00 0.00 H new ATOM 0 HA LEU B 81 150.915 -2.451 -0.233 1.00 0.00 H new ATOM 0 HB2 LEU B 81 150.812 -0.844 -2.831 1.00 0.00 H new ATOM 0 HB3 LEU B 81 149.492 -0.982 -1.687 1.00 0.00 H new ATOM 0 HG LEU B 81 152.261 0.057 -0.927 1.00 0.00 H new ATOM 0 HD11 LEU B 81 151.209 2.316 -1.003 1.00 0.00 H new ATOM 0 HD12 LEU B 81 151.176 1.539 -2.605 1.00 0.00 H new ATOM 0 HD13 LEU B 81 149.702 1.588 -1.609 1.00 0.00 H new ATOM 0 HD21 LEU B 81 151.082 0.928 1.074 1.00 0.00 H new ATOM 0 HD22 LEU B 81 149.563 0.204 0.495 1.00 0.00 H new ATOM 0 HD23 LEU B 81 150.928 -0.841 0.956 1.00 0.00 H new ATOM 2676 N ARG B 82 150.962 -3.717 -3.285 1.00 0.00 N ATOM 2677 CA ARG B 82 150.368 -4.816 -4.103 1.00 0.00 C ATOM 2678 C ARG B 82 150.548 -6.150 -3.375 1.00 0.00 C ATOM 2679 O ARG B 82 149.670 -6.991 -3.374 1.00 0.00 O ATOM 2680 CB ARG B 82 151.053 -4.872 -5.475 1.00 0.00 C ATOM 2681 CG ARG B 82 150.443 -6.001 -6.316 1.00 0.00 C ATOM 2682 CD ARG B 82 151.104 -6.032 -7.696 1.00 0.00 C ATOM 2683 NE ARG B 82 150.507 -7.131 -8.507 1.00 0.00 N ATOM 2684 CZ ARG B 82 150.702 -7.176 -9.798 1.00 0.00 C ATOM 2685 NH1 ARG B 82 151.413 -6.253 -10.384 1.00 0.00 N ATOM 2686 NH2 ARG B 82 150.185 -8.146 -10.502 1.00 0.00 N ATOM 0 H ARG B 82 151.729 -3.210 -3.728 1.00 0.00 H new ATOM 0 HA ARG B 82 149.304 -4.626 -4.246 1.00 0.00 H new ATOM 0 HB2 ARG B 82 150.935 -3.918 -5.990 1.00 0.00 H new ATOM 0 HB3 ARG B 82 152.123 -5.037 -5.351 1.00 0.00 H new ATOM 0 HG2 ARG B 82 150.583 -6.958 -5.814 1.00 0.00 H new ATOM 0 HG3 ARG B 82 149.369 -5.850 -6.420 1.00 0.00 H new ATOM 0 HD2 ARG B 82 150.964 -5.076 -8.200 1.00 0.00 H new ATOM 0 HD3 ARG B 82 152.179 -6.183 -7.593 1.00 0.00 H new ATOM 0 HE ARG B 82 149.944 -7.850 -8.053 1.00 0.00 H new ATOM 0 HH11 ARG B 82 151.818 -5.495 -9.834 1.00 0.00 H new ATOM 0 HH12 ARG B 82 151.565 -6.289 -11.392 1.00 0.00 H new ATOM 0 HH21 ARG B 82 149.629 -8.868 -10.044 1.00 0.00 H new ATOM 0 HH22 ARG B 82 150.337 -8.182 -11.510 1.00 0.00 H new ATOM 2700 N GLU B 83 151.682 -6.357 -2.764 1.00 0.00 N ATOM 2701 CA GLU B 83 151.929 -7.641 -2.045 1.00 0.00 C ATOM 2702 C GLU B 83 151.064 -7.734 -0.784 1.00 0.00 C ATOM 2703 O GLU B 83 150.534 -8.782 -0.475 1.00 0.00 O ATOM 2704 CB GLU B 83 153.409 -7.733 -1.665 1.00 0.00 C ATOM 2705 CG GLU B 83 154.245 -8.000 -2.918 1.00 0.00 C ATOM 2706 CD GLU B 83 154.049 -9.451 -3.363 1.00 0.00 C ATOM 2707 OE1 GLU B 83 153.895 -10.299 -2.498 1.00 0.00 O ATOM 2708 OE2 GLU B 83 154.055 -9.691 -4.559 1.00 0.00 O ATOM 0 H GLU B 83 152.452 -5.689 -2.731 1.00 0.00 H new ATOM 0 HA GLU B 83 151.664 -8.468 -2.704 1.00 0.00 H new ATOM 0 HB2 GLU B 83 153.731 -6.806 -1.191 1.00 0.00 H new ATOM 0 HB3 GLU B 83 153.559 -8.531 -0.938 1.00 0.00 H new ATOM 0 HG2 GLU B 83 153.949 -7.320 -3.717 1.00 0.00 H new ATOM 0 HG3 GLU B 83 155.299 -7.811 -2.712 1.00 0.00 H new ATOM 2715 N TRP B 84 150.888 -6.659 -0.055 1.00 0.00 N ATOM 2716 CA TRP B 84 150.034 -6.724 1.165 1.00 0.00 C ATOM 2717 C TRP B 84 148.614 -7.123 0.749 1.00 0.00 C ATOM 2718 O TRP B 84 147.969 -7.933 1.385 1.00 0.00 O ATOM 2719 CB TRP B 84 150.012 -5.353 1.847 1.00 0.00 C ATOM 2720 CG TRP B 84 149.331 -5.461 3.174 1.00 0.00 C ATOM 2721 CD1 TRP B 84 149.962 -5.689 4.352 1.00 0.00 C ATOM 2722 CD2 TRP B 84 147.912 -5.354 3.485 1.00 0.00 C ATOM 2723 NE1 TRP B 84 149.019 -5.725 5.363 1.00 0.00 N ATOM 2724 CE2 TRP B 84 147.742 -5.525 4.880 1.00 0.00 C ATOM 2725 CE3 TRP B 84 146.766 -5.126 2.702 1.00 0.00 C ATOM 2726 CZ2 TRP B 84 146.482 -5.473 5.476 1.00 0.00 C ATOM 2727 CZ3 TRP B 84 145.495 -5.073 3.300 1.00 0.00 C ATOM 2728 CH2 TRP B 84 145.354 -5.246 4.684 1.00 0.00 C ATOM 0 H TRP B 84 151.297 -5.746 -0.253 1.00 0.00 H new ATOM 0 HA TRP B 84 150.433 -7.459 1.864 1.00 0.00 H new ATOM 0 HB2 TRP B 84 151.030 -4.985 1.979 1.00 0.00 H new ATOM 0 HB3 TRP B 84 149.491 -4.631 1.218 1.00 0.00 H new ATOM 0 HD1 TRP B 84 151.026 -5.821 4.480 1.00 0.00 H new ATOM 0 HE1 TRP B 84 149.241 -5.881 6.346 1.00 0.00 H new ATOM 0 HE3 TRP B 84 146.863 -4.991 1.635 1.00 0.00 H new ATOM 0 HZ2 TRP B 84 146.379 -5.607 6.543 1.00 0.00 H new ATOM 0 HZ3 TRP B 84 144.622 -4.898 2.689 1.00 0.00 H new ATOM 0 HH2 TRP B 84 144.375 -5.204 5.137 1.00 0.00 H new ATOM 2739 N CYS B 85 148.125 -6.550 -0.316 1.00 0.00 N ATOM 2740 CA CYS B 85 146.747 -6.881 -0.784 1.00 0.00 C ATOM 2741 C CYS B 85 146.666 -8.373 -1.120 1.00 0.00 C ATOM 2742 O CYS B 85 145.686 -9.033 -0.840 1.00 0.00 O ATOM 2743 CB CYS B 85 146.423 -6.059 -2.033 1.00 0.00 C ATOM 2744 SG CYS B 85 146.228 -4.318 -1.576 1.00 0.00 S ATOM 0 H CYS B 85 148.621 -5.864 -0.885 1.00 0.00 H new ATOM 0 HA CYS B 85 146.030 -6.647 0.003 1.00 0.00 H new ATOM 0 HB2 CYS B 85 147.220 -6.166 -2.769 1.00 0.00 H new ATOM 0 HB3 CYS B 85 145.509 -6.429 -2.498 1.00 0.00 H new ATOM 0 HG CYS B 85 147.399 -3.770 -1.446 1.00 0.00 H new ATOM 2750 N ASP B 86 147.692 -8.901 -1.726 1.00 0.00 N ATOM 2751 CA ASP B 86 147.695 -10.344 -2.098 1.00 0.00 C ATOM 2752 C ASP B 86 147.527 -11.213 -0.850 1.00 0.00 C ATOM 2753 O ASP B 86 146.964 -12.289 -0.904 1.00 0.00 O ATOM 2754 CB ASP B 86 149.024 -10.687 -2.772 1.00 0.00 C ATOM 2755 CG ASP B 86 149.088 -10.027 -4.150 1.00 0.00 C ATOM 2756 OD1 ASP B 86 148.038 -9.717 -4.687 1.00 0.00 O ATOM 2757 OD2 ASP B 86 150.188 -9.839 -4.644 1.00 0.00 O ATOM 0 H ASP B 86 148.537 -8.390 -1.982 1.00 0.00 H new ATOM 0 HA ASP B 86 146.867 -10.536 -2.781 1.00 0.00 H new ATOM 0 HB2 ASP B 86 149.855 -10.345 -2.155 1.00 0.00 H new ATOM 0 HB3 ASP B 86 149.125 -11.768 -2.871 1.00 0.00 H new ATOM 2762 N ALA B 87 148.029 -10.769 0.271 1.00 0.00 N ATOM 2763 CA ALA B 87 147.918 -11.590 1.516 1.00 0.00 C ATOM 2764 C ALA B 87 146.594 -11.306 2.224 1.00 0.00 C ATOM 2765 O ALA B 87 146.024 -12.177 2.853 1.00 0.00 O ATOM 2766 CB ALA B 87 149.070 -11.236 2.459 1.00 0.00 C ATOM 0 H ALA B 87 148.510 -9.876 0.381 1.00 0.00 H new ATOM 0 HA ALA B 87 147.961 -12.645 1.246 1.00 0.00 H new ATOM 0 HB1 ALA B 87 148.993 -11.833 3.368 1.00 0.00 H new ATOM 0 HB2 ALA B 87 150.020 -11.445 1.967 1.00 0.00 H new ATOM 0 HB3 ALA B 87 149.019 -10.178 2.714 1.00 0.00 H new ATOM 2772 N PHE B 88 146.119 -10.086 2.166 1.00 0.00 N ATOM 2773 CA PHE B 88 144.850 -9.733 2.875 1.00 0.00 C ATOM 2774 C PHE B 88 143.708 -9.533 1.879 1.00 0.00 C ATOM 2775 O PHE B 88 142.963 -10.444 1.583 1.00 0.00 O ATOM 2776 CB PHE B 88 145.060 -8.433 3.654 1.00 0.00 C ATOM 2777 CG PHE B 88 146.013 -8.672 4.802 1.00 0.00 C ATOM 2778 CD1 PHE B 88 145.531 -9.182 6.015 1.00 0.00 C ATOM 2779 CD2 PHE B 88 147.378 -8.384 4.656 1.00 0.00 C ATOM 2780 CE1 PHE B 88 146.411 -9.400 7.082 1.00 0.00 C ATOM 2781 CE2 PHE B 88 148.258 -8.602 5.725 1.00 0.00 C ATOM 2782 CZ PHE B 88 147.773 -9.110 6.936 1.00 0.00 C ATOM 0 H PHE B 88 146.556 -9.318 1.657 1.00 0.00 H new ATOM 0 HA PHE B 88 144.589 -10.548 3.550 1.00 0.00 H new ATOM 0 HB2 PHE B 88 145.458 -7.663 2.993 1.00 0.00 H new ATOM 0 HB3 PHE B 88 144.106 -8.067 4.032 1.00 0.00 H new ATOM 0 HD1 PHE B 88 144.481 -9.407 6.127 1.00 0.00 H new ATOM 0 HD2 PHE B 88 147.751 -7.994 3.720 1.00 0.00 H new ATOM 0 HE1 PHE B 88 146.039 -9.792 8.017 1.00 0.00 H new ATOM 0 HE2 PHE B 88 149.309 -8.378 5.615 1.00 0.00 H new ATOM 0 HZ PHE B 88 148.451 -9.279 7.760 1.00 0.00 H new ATOM 2792 N LEU B 89 143.555 -8.340 1.368 1.00 0.00 N ATOM 2793 CA LEU B 89 142.455 -8.059 0.398 1.00 0.00 C ATOM 2794 C LEU B 89 142.924 -8.390 -1.021 1.00 0.00 C ATOM 2795 O LEU B 89 142.538 -9.435 -1.520 1.00 0.00 O ATOM 2796 CB LEU B 89 142.084 -6.571 0.497 1.00 0.00 C ATOM 2797 CG LEU B 89 141.150 -6.164 -0.653 1.00 0.00 C ATOM 2798 CD1 LEU B 89 139.968 -7.135 -0.734 1.00 0.00 C ATOM 2799 CD2 LEU B 89 140.627 -4.742 -0.399 1.00 0.00 C ATOM 2800 OXT LEU B 89 143.656 -7.594 -1.584 1.00 0.00 O ATOM 0 H LEU B 89 144.151 -7.540 1.583 1.00 0.00 H new ATOM 0 HA LEU B 89 141.584 -8.672 0.630 1.00 0.00 H new ATOM 0 HB2 LEU B 89 141.598 -6.376 1.453 1.00 0.00 H new ATOM 0 HB3 LEU B 89 142.989 -5.963 0.469 1.00 0.00 H new ATOM 0 HG LEU B 89 141.701 -6.193 -1.593 1.00 0.00 H new ATOM 0 HD11 LEU B 89 139.310 -6.840 -1.552 1.00 0.00 H new ATOM 0 HD12 LEU B 89 140.338 -8.145 -0.912 1.00 0.00 H new ATOM 0 HD13 LEU B 89 139.413 -7.112 0.204 1.00 0.00 H new ATOM 0 HD21 LEU B 89 139.963 -4.448 -1.212 1.00 0.00 H new ATOM 0 HD22 LEU B 89 140.079 -4.719 0.543 1.00 0.00 H new ATOM 0 HD23 LEU B 89 141.467 -4.049 -0.347 1.00 0.00 H new TER 2812 LEU B 89