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 Set 1.1: B 54 LYS NZ :NH3+ 142:sc= 0.0504 (180deg=-2.62!) USER MOD Set 1.2: B 85 CYS SG : rot 83:sc= -1.34 USER MOD Set 2.1: B 3 THR OG1 : rot -150:sc= -0.0395 USER MOD Set 2.2: B 7 HIS : no HD1:sc= -0.225 X(o=-0.26,f=-0.04) USER MOD Set 3.1: A 54 LYS NZ :NH3+ 139:sc= 0.0265 (180deg=-2.65!) USER MOD Set 3.2: A 85 CYS SG : rot 81:sc= -1.34 USER MOD Set 4.1: A 3 THR OG1 : rot -150:sc= -0.0372 USER MOD Set 4.2: A 7 HIS : no HD1:sc= -0.176 X(o=-0.21,f=-0.037) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -161:sc= -0.0124 (180deg=-0.347) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 MET CE :methyl -146:sc= -3.65! (180deg=-8.01!) USER MOD Single : A 18 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.105) USER MOD Single : A 22 SER OG : rot 98:sc= 0.307 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00809) USER MOD Single : A 41 LYS NZ :NH3+ -123:sc= 0.118 (180deg=-1.52!) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.234 K(o=-0.23,f=-1.2) USER MOD Single : A 53 LYS NZ :NH3+ 164:sc=-0.00303 (180deg=-0.194) USER MOD Single : A 64 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.11) USER MOD Single : A 66 THR OG1 : rot 91:sc= 0.739 USER MOD Single : A 67 CYS SG : rot -65:sc= 0.892 USER MOD Single : A 70 ASN : amide:sc= -0.0177 K(o=-0.018,f=-2!) USER MOD Single : A 72 LYS NZ :NH3+ 134:sc= -0.235 (180deg=-1.29!) USER MOD Single : A 73 GLN : amide:sc= -0.406 K(o=-0.41,f=-5.8!) USER MOD Single : A 74 SER OG : rot 77:sc= 0.252 USER MOD Single : A 77 CYS SG : rot -36:sc= 0.501 USER MOD Single : A 80 CYS SG : rot -24:sc= -2.21! USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -161:sc=-0.00842 (180deg=-0.356) USER MOD Single : B 2 THR OG1 : rot 180:sc= 0 USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 GLN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 MET CE :methyl -147:sc= -3.51! (180deg=-8.06!) USER MOD Single : B 18 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.103) USER MOD Single : B 22 SER OG : rot 101:sc= 0.306 USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00787) USER MOD Single : B 41 LYS NZ :NH3+ -123:sc=-0.00801 (180deg=-1.48!) USER MOD Single : B 43 TYR OH : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -0.138 K(o=-0.14,f=-1.1) USER MOD Single : B 53 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.184) USER MOD Single : B 64 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.115) USER MOD Single : B 66 THR OG1 : rot 79:sc= 0.859 USER MOD Single : B 67 CYS SG : rot -34:sc= 0.936 USER MOD Single : B 70 ASN : amide:sc= -0.0483 K(o=-0.048,f=-2!) USER MOD Single : B 72 LYS NZ :NH3+ 147:sc= -0.263 (180deg=-1.22!) USER MOD Single : B 73 GLN : amide:sc= -0.32 K(o=-0.32,f=-5.7!) USER MOD Single : B 74 SER OG : rot 78:sc= 0.251 USER MOD Single : B 77 CYS SG : rot -37:sc= 0.511 USER MOD Single : B 80 CYS SG : rot -24:sc= -2.21! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 115.318 -7.938 15.163 1.00 0.00 N ATOM 2 CA MET A 1 115.353 -7.825 13.677 1.00 0.00 C ATOM 3 C MET A 1 116.768 -8.136 13.180 1.00 0.00 C ATOM 4 O MET A 1 117.636 -7.286 13.180 1.00 0.00 O ATOM 5 CB MET A 1 114.967 -6.401 13.272 1.00 0.00 C ATOM 6 CG MET A 1 113.479 -6.173 13.552 1.00 0.00 C ATOM 7 SD MET A 1 113.053 -4.455 13.173 1.00 0.00 S ATOM 8 CE MET A 1 111.272 -4.588 13.463 1.00 0.00 C ATOM 0 H1 MET A 1 114.334 -8.049 15.480 1.00 0.00 H new ATOM 0 H2 MET A 1 115.873 -8.765 15.461 1.00 0.00 H new ATOM 0 H3 MET A 1 115.723 -7.078 15.586 1.00 0.00 H new ATOM 0 HA MET A 1 114.651 -8.532 13.235 1.00 0.00 H new ATOM 0 HB2 MET A 1 115.567 -5.679 13.827 1.00 0.00 H new ATOM 0 HB3 MET A 1 115.177 -6.244 12.214 1.00 0.00 H new ATOM 0 HG2 MET A 1 112.876 -6.851 12.948 1.00 0.00 H new ATOM 0 HG3 MET A 1 113.256 -6.393 14.596 1.00 0.00 H new ATOM 0 HE1 MET A 1 110.801 -3.622 13.283 1.00 0.00 H new ATOM 0 HE2 MET A 1 110.848 -5.330 12.787 1.00 0.00 H new ATOM 0 HE3 MET A 1 111.093 -4.892 14.494 1.00 0.00 H new ATOM 20 N THR A 2 117.010 -9.352 12.766 1.00 0.00 N ATOM 21 CA THR A 2 118.374 -9.726 12.280 1.00 0.00 C ATOM 22 C THR A 2 118.533 -9.368 10.801 1.00 0.00 C ATOM 23 O THR A 2 117.570 -9.176 10.085 1.00 0.00 O ATOM 24 CB THR A 2 118.583 -11.230 12.455 1.00 0.00 C ATOM 25 OG1 THR A 2 117.588 -11.934 11.722 1.00 0.00 O ATOM 26 CG2 THR A 2 118.486 -11.596 13.936 1.00 0.00 C ATOM 0 H THR A 2 116.322 -10.104 12.743 1.00 0.00 H new ATOM 0 HA THR A 2 119.114 -9.175 12.861 1.00 0.00 H new ATOM 0 HB THR A 2 119.570 -11.504 12.083 1.00 0.00 H new ATOM 0 HG1 THR A 2 117.722 -12.899 11.832 1.00 0.00 H new ATOM 0 HG21 THR A 2 118.636 -12.669 14.056 1.00 0.00 H new ATOM 0 HG22 THR A 2 119.252 -11.058 14.495 1.00 0.00 H new ATOM 0 HG23 THR A 2 117.501 -11.322 14.315 1.00 0.00 H new ATOM 34 N THR A 3 119.753 -9.289 10.342 1.00 0.00 N ATOM 35 CA THR A 3 120.008 -8.958 8.910 1.00 0.00 C ATOM 36 C THR A 3 119.876 -10.227 8.061 1.00 0.00 C ATOM 37 O THR A 3 119.773 -11.322 8.578 1.00 0.00 O ATOM 38 CB THR A 3 121.421 -8.385 8.766 1.00 0.00 C ATOM 39 OG1 THR A 3 122.367 -9.347 9.211 1.00 0.00 O ATOM 40 CG2 THR A 3 121.547 -7.113 9.604 1.00 0.00 C ATOM 0 H THR A 3 120.591 -9.441 10.903 1.00 0.00 H new ATOM 0 HA THR A 3 119.281 -8.220 8.569 1.00 0.00 H new ATOM 0 HB THR A 3 121.612 -8.145 7.720 1.00 0.00 H new ATOM 0 HG1 THR A 3 123.155 -8.889 9.572 1.00 0.00 H new ATOM 0 HG21 THR A 3 122.553 -6.707 9.500 1.00 0.00 H new ATOM 0 HG22 THR A 3 120.821 -6.377 9.259 1.00 0.00 H new ATOM 0 HG23 THR A 3 121.357 -7.347 10.651 1.00 0.00 H new ATOM 48 N SER A 4 119.871 -10.088 6.763 1.00 0.00 N ATOM 49 CA SER A 4 119.734 -11.284 5.880 1.00 0.00 C ATOM 50 C SER A 4 121.006 -12.136 5.944 1.00 0.00 C ATOM 51 O SER A 4 122.031 -11.722 6.450 1.00 0.00 O ATOM 52 CB SER A 4 119.499 -10.831 4.439 1.00 0.00 C ATOM 53 OG SER A 4 120.622 -10.081 3.993 1.00 0.00 O ATOM 0 H SER A 4 119.956 -9.197 6.274 1.00 0.00 H new ATOM 0 HA SER A 4 118.888 -11.880 6.221 1.00 0.00 H new ATOM 0 HB2 SER A 4 119.346 -11.696 3.794 1.00 0.00 H new ATOM 0 HB3 SER A 4 118.595 -10.225 4.379 1.00 0.00 H new ATOM 0 HG SER A 4 120.475 -9.791 3.069 1.00 0.00 H new ATOM 59 N GLN A 5 120.923 -13.339 5.442 1.00 0.00 N ATOM 60 CA GLN A 5 122.086 -14.274 5.462 1.00 0.00 C ATOM 61 C GLN A 5 123.271 -13.686 4.688 1.00 0.00 C ATOM 62 O GLN A 5 124.399 -14.099 4.864 1.00 0.00 O ATOM 63 CB GLN A 5 121.670 -15.602 4.821 1.00 0.00 C ATOM 64 CG GLN A 5 120.685 -16.329 5.739 1.00 0.00 C ATOM 65 CD GLN A 5 120.266 -17.656 5.101 1.00 0.00 C ATOM 66 OE1 GLN A 5 120.513 -17.868 3.837 1.00 0.00 O flip ATOM 67 NE2 GLN A 5 119.707 -18.511 5.760 1.00 0.00 N flip ATOM 0 H GLN A 5 120.081 -13.721 5.010 1.00 0.00 H new ATOM 0 HA GLN A 5 122.392 -14.432 6.496 1.00 0.00 H new ATOM 0 HB2 GLN A 5 121.211 -15.420 3.849 1.00 0.00 H new ATOM 0 HB3 GLN A 5 122.548 -16.224 4.647 1.00 0.00 H new ATOM 0 HG2 GLN A 5 121.145 -16.511 6.710 1.00 0.00 H new ATOM 0 HG3 GLN A 5 119.808 -15.706 5.913 1.00 0.00 H new ATOM 0 HE21 GLN A 5 119.513 -18.348 6.748 1.00 0.00 H new ATOM 0 HE22 GLN A 5 119.432 -19.392 5.325 1.00 0.00 H new ATOM 76 N LYS A 6 123.029 -12.731 3.826 1.00 0.00 N ATOM 77 CA LYS A 6 124.140 -12.126 3.036 1.00 0.00 C ATOM 78 C LYS A 6 125.110 -11.405 3.978 1.00 0.00 C ATOM 79 O LYS A 6 126.307 -11.409 3.769 1.00 0.00 O ATOM 80 CB LYS A 6 123.554 -11.114 2.048 1.00 0.00 C ATOM 81 CG LYS A 6 122.734 -11.849 0.986 1.00 0.00 C ATOM 82 CD LYS A 6 122.148 -10.836 -0.002 1.00 0.00 C ATOM 83 CE LYS A 6 121.329 -11.573 -1.063 1.00 0.00 C ATOM 84 NZ LYS A 6 120.671 -10.581 -1.962 1.00 0.00 N ATOM 0 H LYS A 6 122.105 -12.344 3.636 1.00 0.00 H new ATOM 0 HA LYS A 6 124.674 -12.909 2.498 1.00 0.00 H new ATOM 0 HB2 LYS A 6 122.925 -10.397 2.576 1.00 0.00 H new ATOM 0 HB3 LYS A 6 124.355 -10.547 1.575 1.00 0.00 H new ATOM 0 HG2 LYS A 6 123.363 -12.566 0.458 1.00 0.00 H new ATOM 0 HG3 LYS A 6 121.933 -12.416 1.459 1.00 0.00 H new ATOM 0 HD2 LYS A 6 121.518 -10.120 0.526 1.00 0.00 H new ATOM 0 HD3 LYS A 6 122.949 -10.268 -0.475 1.00 0.00 H new ATOM 0 HE2 LYS A 6 121.975 -12.233 -1.643 1.00 0.00 H new ATOM 0 HE3 LYS A 6 120.577 -12.202 -0.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 120.114 -11.082 -2.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 120.043 -9.969 -1.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 121.397 -9.999 -2.427 1.00 0.00 H new ATOM 98 N HIS A 7 124.608 -10.771 4.999 1.00 0.00 N ATOM 99 CA HIS A 7 125.506 -10.032 5.932 1.00 0.00 C ATOM 100 C HIS A 7 126.522 -10.984 6.565 1.00 0.00 C ATOM 101 O HIS A 7 127.707 -10.715 6.583 1.00 0.00 O ATOM 102 CB HIS A 7 124.653 -9.383 7.027 1.00 0.00 C ATOM 103 CG HIS A 7 125.532 -8.745 8.072 1.00 0.00 C ATOM 104 ND1 HIS A 7 125.949 -7.422 7.992 1.00 0.00 N ATOM 105 CD2 HIS A 7 126.060 -9.233 9.244 1.00 0.00 C ATOM 106 CE1 HIS A 7 126.688 -7.163 9.089 1.00 0.00 C ATOM 107 NE2 HIS A 7 126.785 -8.232 9.880 1.00 0.00 N ATOM 0 H HIS A 7 123.615 -10.732 5.229 1.00 0.00 H new ATOM 0 HA HIS A 7 126.051 -9.267 5.378 1.00 0.00 H new ATOM 0 HB2 HIS A 7 123.997 -8.632 6.588 1.00 0.00 H new ATOM 0 HB3 HIS A 7 124.013 -10.134 7.491 1.00 0.00 H new ATOM 0 HD2 HIS A 7 125.931 -10.240 9.614 1.00 0.00 H new ATOM 0 HE1 HIS A 7 127.145 -6.208 9.301 1.00 0.00 H new ATOM 0 HE2 HIS A 7 127.286 -8.301 10.766 1.00 0.00 H new ATOM 115 N ARG A 8 126.073 -12.095 7.090 1.00 0.00 N ATOM 116 CA ARG A 8 127.016 -13.058 7.722 1.00 0.00 C ATOM 117 C ARG A 8 127.886 -13.726 6.657 1.00 0.00 C ATOM 118 O ARG A 8 129.023 -14.078 6.900 1.00 0.00 O ATOM 119 CB ARG A 8 126.223 -14.123 8.478 1.00 0.00 C ATOM 120 CG ARG A 8 125.576 -13.486 9.707 1.00 0.00 C ATOM 121 CD ARG A 8 124.782 -14.544 10.472 1.00 0.00 C ATOM 122 NE ARG A 8 124.152 -13.919 11.669 1.00 0.00 N ATOM 123 CZ ARG A 8 123.198 -14.543 12.300 1.00 0.00 C ATOM 124 NH1 ARG A 8 122.805 -15.717 11.889 1.00 0.00 N ATOM 125 NH2 ARG A 8 122.637 -13.993 13.342 1.00 0.00 N ATOM 0 H ARG A 8 125.092 -12.375 7.107 1.00 0.00 H new ATOM 0 HA ARG A 8 127.662 -12.519 8.415 1.00 0.00 H new ATOM 0 HB2 ARG A 8 125.458 -14.553 7.831 1.00 0.00 H new ATOM 0 HB3 ARG A 8 126.881 -14.938 8.779 1.00 0.00 H new ATOM 0 HG2 ARG A 8 126.342 -13.054 10.352 1.00 0.00 H new ATOM 0 HG3 ARG A 8 124.918 -12.671 9.404 1.00 0.00 H new ATOM 0 HD2 ARG A 8 124.016 -14.976 9.828 1.00 0.00 H new ATOM 0 HD3 ARG A 8 125.439 -15.358 10.777 1.00 0.00 H new ATOM 0 HE ARG A 8 124.467 -13.005 11.994 1.00 0.00 H new ATOM 0 HH11 ARG A 8 123.244 -16.146 11.074 1.00 0.00 H new ATOM 0 HH12 ARG A 8 122.058 -16.206 12.382 1.00 0.00 H new ATOM 0 HH21 ARG A 8 122.945 -13.075 13.662 1.00 0.00 H new ATOM 0 HH22 ARG A 8 121.890 -14.481 13.836 1.00 0.00 H new ATOM 139 N ASP A 9 127.363 -13.899 5.477 1.00 0.00 N ATOM 140 CA ASP A 9 128.156 -14.539 4.391 1.00 0.00 C ATOM 141 C ASP A 9 129.267 -13.597 3.924 1.00 0.00 C ATOM 142 O ASP A 9 130.367 -14.016 3.624 1.00 0.00 O ATOM 143 CB ASP A 9 127.239 -14.860 3.211 1.00 0.00 C ATOM 144 CG ASP A 9 126.293 -16.000 3.593 1.00 0.00 C ATOM 145 OD1 ASP A 9 126.693 -16.834 4.388 1.00 0.00 O ATOM 146 OD2 ASP A 9 125.182 -16.016 3.088 1.00 0.00 O ATOM 0 H ASP A 9 126.416 -13.624 5.216 1.00 0.00 H new ATOM 0 HA ASP A 9 128.602 -15.457 4.773 1.00 0.00 H new ATOM 0 HB2 ASP A 9 126.666 -13.976 2.932 1.00 0.00 H new ATOM 0 HB3 ASP A 9 127.833 -15.142 2.342 1.00 0.00 H new ATOM 151 N PHE A 10 128.972 -12.331 3.825 1.00 0.00 N ATOM 152 CA PHE A 10 129.996 -11.365 3.337 1.00 0.00 C ATOM 153 C PHE A 10 131.141 -11.240 4.349 1.00 0.00 C ATOM 154 O PHE A 10 132.298 -11.197 3.984 1.00 0.00 O ATOM 155 CB PHE A 10 129.332 -10.001 3.134 1.00 0.00 C ATOM 156 CG PHE A 10 130.282 -9.077 2.413 1.00 0.00 C ATOM 157 CD1 PHE A 10 130.270 -9.029 1.014 1.00 0.00 C ATOM 158 CD2 PHE A 10 131.166 -8.267 3.135 1.00 0.00 C ATOM 159 CE1 PHE A 10 131.144 -8.172 0.335 1.00 0.00 C ATOM 160 CE2 PHE A 10 132.041 -7.410 2.455 1.00 0.00 C ATOM 161 CZ PHE A 10 132.030 -7.363 1.056 1.00 0.00 C ATOM 0 H PHE A 10 128.067 -11.923 4.061 1.00 0.00 H new ATOM 0 HA PHE A 10 130.409 -11.723 2.394 1.00 0.00 H new ATOM 0 HB2 PHE A 10 128.413 -10.115 2.559 1.00 0.00 H new ATOM 0 HB3 PHE A 10 129.054 -9.574 4.097 1.00 0.00 H new ATOM 0 HD1 PHE A 10 129.586 -9.653 0.458 1.00 0.00 H new ATOM 0 HD2 PHE A 10 131.174 -8.303 4.214 1.00 0.00 H new ATOM 0 HE1 PHE A 10 131.135 -8.135 -0.744 1.00 0.00 H new ATOM 0 HE2 PHE A 10 132.725 -6.785 3.011 1.00 0.00 H new ATOM 0 HZ PHE A 10 132.705 -6.702 0.533 1.00 0.00 H new ATOM 171 N VAL A 11 130.831 -11.177 5.617 1.00 0.00 N ATOM 172 CA VAL A 11 131.908 -11.050 6.646 1.00 0.00 C ATOM 173 C VAL A 11 132.439 -12.437 7.024 1.00 0.00 C ATOM 174 O VAL A 11 133.111 -12.598 8.023 1.00 0.00 O ATOM 175 CB VAL A 11 131.332 -10.375 7.891 1.00 0.00 C ATOM 176 CG1 VAL A 11 130.712 -9.031 7.505 1.00 0.00 C ATOM 177 CG2 VAL A 11 130.256 -11.276 8.497 1.00 0.00 C ATOM 0 H VAL A 11 129.880 -11.208 5.986 1.00 0.00 H new ATOM 0 HA VAL A 11 132.725 -10.453 6.240 1.00 0.00 H new ATOM 0 HB VAL A 11 132.127 -10.210 8.618 1.00 0.00 H new ATOM 0 HG11 VAL A 11 130.302 -8.551 8.393 1.00 0.00 H new ATOM 0 HG12 VAL A 11 131.477 -8.390 7.067 1.00 0.00 H new ATOM 0 HG13 VAL A 11 129.915 -9.193 6.779 1.00 0.00 H new ATOM 0 HG21 VAL A 11 129.841 -10.800 9.386 1.00 0.00 H new ATOM 0 HG22 VAL A 11 129.462 -11.436 7.767 1.00 0.00 H new ATOM 0 HG23 VAL A 11 130.696 -12.235 8.771 1.00 0.00 H new ATOM 187 N ALA A 12 132.133 -13.440 6.237 1.00 0.00 N ATOM 188 CA ALA A 12 132.608 -14.831 6.543 1.00 0.00 C ATOM 189 C ALA A 12 133.621 -15.296 5.493 1.00 0.00 C ATOM 190 O ALA A 12 134.251 -16.324 5.647 1.00 0.00 O ATOM 191 CB ALA A 12 131.408 -15.780 6.531 1.00 0.00 C ATOM 0 H ALA A 12 131.571 -13.357 5.390 1.00 0.00 H new ATOM 0 HA ALA A 12 133.087 -14.834 7.522 1.00 0.00 H new ATOM 0 HB1 ALA A 12 131.743 -16.793 6.752 1.00 0.00 H new ATOM 0 HB2 ALA A 12 130.687 -15.464 7.284 1.00 0.00 H new ATOM 0 HB3 ALA A 12 130.938 -15.760 5.548 1.00 0.00 H new ATOM 197 N GLU A 13 133.783 -14.565 4.422 1.00 0.00 N ATOM 198 CA GLU A 13 134.758 -14.997 3.372 1.00 0.00 C ATOM 199 C GLU A 13 135.269 -13.773 2.595 1.00 0.00 C ATOM 200 O GLU A 13 134.568 -12.788 2.472 1.00 0.00 O ATOM 201 CB GLU A 13 134.039 -15.944 2.407 1.00 0.00 C ATOM 202 CG GLU A 13 132.898 -15.192 1.710 1.00 0.00 C ATOM 203 CD GLU A 13 131.923 -16.196 1.091 1.00 0.00 C ATOM 204 OE1 GLU A 13 132.222 -17.377 1.119 1.00 0.00 O ATOM 205 OE2 GLU A 13 130.893 -15.764 0.598 1.00 0.00 O ATOM 0 H GLU A 13 133.288 -13.695 4.228 1.00 0.00 H new ATOM 0 HA GLU A 13 135.606 -15.499 3.839 1.00 0.00 H new ATOM 0 HB2 GLU A 13 134.741 -16.329 1.667 1.00 0.00 H new ATOM 0 HB3 GLU A 13 133.645 -16.803 2.950 1.00 0.00 H new ATOM 0 HG2 GLU A 13 132.376 -14.558 2.427 1.00 0.00 H new ATOM 0 HG3 GLU A 13 133.300 -14.536 0.937 1.00 0.00 H new ATOM 212 N PRO A 14 136.461 -13.833 2.037 1.00 0.00 N ATOM 213 CA PRO A 14 137.010 -12.704 1.233 1.00 0.00 C ATOM 214 C PRO A 14 135.944 -12.110 0.302 1.00 0.00 C ATOM 215 O PRO A 14 134.951 -12.744 0.004 1.00 0.00 O ATOM 216 CB PRO A 14 138.135 -13.359 0.425 1.00 0.00 C ATOM 217 CG PRO A 14 138.628 -14.476 1.291 1.00 0.00 C ATOM 218 CD PRO A 14 137.420 -14.958 2.111 1.00 0.00 C ATOM 0 HA PRO A 14 137.352 -11.874 1.852 1.00 0.00 H new ATOM 0 HB2 PRO A 14 137.769 -13.732 -0.532 1.00 0.00 H new ATOM 0 HB3 PRO A 14 138.931 -12.647 0.206 1.00 0.00 H new ATOM 0 HG2 PRO A 14 139.034 -15.286 0.685 1.00 0.00 H new ATOM 0 HG3 PRO A 14 139.430 -14.135 1.946 1.00 0.00 H new ATOM 0 HD2 PRO A 14 136.995 -15.872 1.695 1.00 0.00 H new ATOM 0 HD3 PRO A 14 137.699 -15.176 3.142 1.00 0.00 H new ATOM 226 N MET A 15 136.134 -10.903 -0.159 1.00 0.00 N ATOM 227 CA MET A 15 135.120 -10.287 -1.069 1.00 0.00 C ATOM 228 C MET A 15 135.452 -10.644 -2.520 1.00 0.00 C ATOM 229 O MET A 15 134.612 -10.585 -3.395 1.00 0.00 O ATOM 230 CB MET A 15 135.141 -8.767 -0.900 1.00 0.00 C ATOM 231 CG MET A 15 136.590 -8.271 -0.903 1.00 0.00 C ATOM 232 SD MET A 15 136.622 -6.489 -1.224 1.00 0.00 S ATOM 233 CE MET A 15 136.316 -5.929 0.470 1.00 0.00 C ATOM 0 H MET A 15 136.942 -10.318 0.053 1.00 0.00 H new ATOM 0 HA MET A 15 134.129 -10.667 -0.820 1.00 0.00 H new ATOM 0 HB2 MET A 15 134.582 -8.293 -1.707 1.00 0.00 H new ATOM 0 HB3 MET A 15 134.652 -8.488 0.033 1.00 0.00 H new ATOM 0 HG2 MET A 15 137.061 -8.486 0.056 1.00 0.00 H new ATOM 0 HG3 MET A 15 137.164 -8.798 -1.665 1.00 0.00 H new ATOM 0 HE1 MET A 15 135.724 -5.014 0.449 1.00 0.00 H new ATOM 0 HE2 MET A 15 135.773 -6.701 1.016 1.00 0.00 H new ATOM 0 HE3 MET A 15 137.267 -5.734 0.966 1.00 0.00 H new ATOM 243 N GLY A 16 136.675 -11.024 -2.774 1.00 0.00 N ATOM 244 CA GLY A 16 137.076 -11.402 -4.160 1.00 0.00 C ATOM 245 C GLY A 16 136.635 -10.324 -5.154 1.00 0.00 C ATOM 246 O GLY A 16 136.707 -9.142 -4.880 1.00 0.00 O ATOM 0 H GLY A 16 137.417 -11.089 -2.078 1.00 0.00 H new ATOM 0 HA2 GLY A 16 138.157 -11.532 -4.210 1.00 0.00 H new ATOM 0 HA3 GLY A 16 136.627 -12.358 -4.428 1.00 0.00 H new ATOM 250 N GLU A 17 136.211 -10.732 -6.323 1.00 0.00 N ATOM 251 CA GLU A 17 135.795 -9.754 -7.377 1.00 0.00 C ATOM 252 C GLU A 17 134.269 -9.676 -7.459 1.00 0.00 C ATOM 253 O GLU A 17 133.711 -9.395 -8.501 1.00 0.00 O ATOM 254 CB GLU A 17 136.355 -10.225 -8.722 1.00 0.00 C ATOM 255 CG GLU A 17 137.879 -10.081 -8.714 1.00 0.00 C ATOM 256 CD GLU A 17 138.445 -10.550 -10.055 1.00 0.00 C ATOM 257 OE1 GLU A 17 137.690 -11.112 -10.831 1.00 0.00 O ATOM 258 OE2 GLU A 17 139.627 -10.346 -10.280 1.00 0.00 O ATOM 0 H GLU A 17 136.134 -11.712 -6.596 1.00 0.00 H new ATOM 0 HA GLU A 17 136.179 -8.765 -7.129 1.00 0.00 H new ATOM 0 HB2 GLU A 17 136.077 -11.264 -8.901 1.00 0.00 H new ATOM 0 HB3 GLU A 17 135.927 -9.636 -9.533 1.00 0.00 H new ATOM 0 HG2 GLU A 17 138.155 -9.042 -8.534 1.00 0.00 H new ATOM 0 HG3 GLU A 17 138.306 -10.669 -7.902 1.00 0.00 H new ATOM 265 N LYS A 18 133.584 -9.921 -6.374 1.00 0.00 N ATOM 266 CA LYS A 18 132.096 -9.854 -6.410 1.00 0.00 C ATOM 267 C LYS A 18 131.682 -8.416 -6.768 1.00 0.00 C ATOM 268 O LYS A 18 132.381 -7.475 -6.447 1.00 0.00 O ATOM 269 CB LYS A 18 131.538 -10.226 -5.032 1.00 0.00 C ATOM 270 CG LYS A 18 131.785 -11.713 -4.768 1.00 0.00 C ATOM 271 CD LYS A 18 131.128 -12.115 -3.445 1.00 0.00 C ATOM 272 CE LYS A 18 131.586 -13.521 -3.052 1.00 0.00 C ATOM 273 NZ LYS A 18 131.028 -14.514 -4.012 1.00 0.00 N ATOM 0 H LYS A 18 133.988 -10.163 -5.470 1.00 0.00 H new ATOM 0 HA LYS A 18 131.703 -10.549 -7.152 1.00 0.00 H new ATOM 0 HB2 LYS A 18 132.016 -9.624 -4.259 1.00 0.00 H new ATOM 0 HB3 LYS A 18 130.470 -10.010 -4.989 1.00 0.00 H new ATOM 0 HG2 LYS A 18 131.378 -12.310 -5.584 1.00 0.00 H new ATOM 0 HG3 LYS A 18 132.856 -11.913 -4.730 1.00 0.00 H new ATOM 0 HD2 LYS A 18 131.394 -11.403 -2.664 1.00 0.00 H new ATOM 0 HD3 LYS A 18 130.043 -12.089 -3.543 1.00 0.00 H new ATOM 0 HE2 LYS A 18 132.675 -13.573 -3.051 1.00 0.00 H new ATOM 0 HE3 LYS A 18 131.255 -13.753 -2.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 131.225 -15.476 -3.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 130.000 -14.379 -4.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 131.469 -14.381 -4.944 1.00 0.00 H new ATOM 287 N PRO A 19 130.570 -8.239 -7.444 1.00 0.00 N ATOM 288 CA PRO A 19 130.094 -6.883 -7.865 1.00 0.00 C ATOM 289 C PRO A 19 129.701 -5.995 -6.674 1.00 0.00 C ATOM 290 O PRO A 19 129.442 -6.466 -5.585 1.00 0.00 O ATOM 291 CB PRO A 19 128.877 -7.182 -8.759 1.00 0.00 C ATOM 292 CG PRO A 19 128.393 -8.523 -8.309 1.00 0.00 C ATOM 293 CD PRO A 19 129.641 -9.297 -7.887 1.00 0.00 C ATOM 0 HA PRO A 19 130.877 -6.322 -8.376 1.00 0.00 H new ATOM 0 HB2 PRO A 19 128.104 -6.423 -8.642 1.00 0.00 H new ATOM 0 HB3 PRO A 19 129.154 -7.195 -9.813 1.00 0.00 H new ATOM 0 HG2 PRO A 19 127.693 -8.428 -7.479 1.00 0.00 H new ATOM 0 HG3 PRO A 19 127.866 -9.038 -9.112 1.00 0.00 H new ATOM 0 HD2 PRO A 19 129.424 -10.002 -7.085 1.00 0.00 H new ATOM 0 HD3 PRO A 19 130.055 -9.873 -8.714 1.00 0.00 H new ATOM 301 N VAL A 20 129.676 -4.707 -6.888 1.00 0.00 N ATOM 302 CA VAL A 20 129.325 -3.753 -5.796 1.00 0.00 C ATOM 303 C VAL A 20 127.958 -4.091 -5.186 1.00 0.00 C ATOM 304 O VAL A 20 127.786 -4.097 -3.983 1.00 0.00 O ATOM 305 CB VAL A 20 129.295 -2.329 -6.368 1.00 0.00 C ATOM 306 CG1 VAL A 20 128.349 -2.267 -7.574 1.00 0.00 C ATOM 307 CG2 VAL A 20 128.805 -1.354 -5.294 1.00 0.00 C ATOM 0 H VAL A 20 129.887 -4.270 -7.785 1.00 0.00 H new ATOM 0 HA VAL A 20 130.076 -3.829 -5.009 1.00 0.00 H new ATOM 0 HB VAL A 20 130.301 -2.054 -6.684 1.00 0.00 H new ATOM 0 HG11 VAL A 20 128.334 -1.253 -7.973 1.00 0.00 H new ATOM 0 HG12 VAL A 20 128.696 -2.955 -8.345 1.00 0.00 H new ATOM 0 HG13 VAL A 20 127.343 -2.549 -7.262 1.00 0.00 H new ATOM 0 HG21 VAL A 20 128.784 -0.343 -5.702 1.00 0.00 H new ATOM 0 HG22 VAL A 20 127.802 -1.637 -4.976 1.00 0.00 H new ATOM 0 HG23 VAL A 20 129.480 -1.386 -4.438 1.00 0.00 H new ATOM 317 N GLY A 21 126.977 -4.343 -6.015 1.00 0.00 N ATOM 318 CA GLY A 21 125.608 -4.646 -5.504 1.00 0.00 C ATOM 319 C GLY A 21 125.636 -5.823 -4.526 1.00 0.00 C ATOM 320 O GLY A 21 124.623 -6.192 -3.965 1.00 0.00 O ATOM 0 H GLY A 21 127.068 -4.352 -7.031 1.00 0.00 H new ATOM 0 HA2 GLY A 21 125.198 -3.766 -5.008 1.00 0.00 H new ATOM 0 HA3 GLY A 21 124.947 -4.878 -6.339 1.00 0.00 H new ATOM 324 N SER A 22 126.774 -6.426 -4.313 1.00 0.00 N ATOM 325 CA SER A 22 126.830 -7.578 -3.368 1.00 0.00 C ATOM 326 C SER A 22 126.901 -7.058 -1.929 1.00 0.00 C ATOM 327 O SER A 22 126.633 -7.777 -0.986 1.00 0.00 O ATOM 328 CB SER A 22 128.067 -8.427 -3.664 1.00 0.00 C ATOM 329 OG SER A 22 128.000 -8.902 -5.001 1.00 0.00 O ATOM 0 H SER A 22 127.661 -6.174 -4.749 1.00 0.00 H new ATOM 0 HA SER A 22 125.935 -8.188 -3.491 1.00 0.00 H new ATOM 0 HB2 SER A 22 128.971 -7.835 -3.521 1.00 0.00 H new ATOM 0 HB3 SER A 22 128.121 -9.266 -2.970 1.00 0.00 H new ATOM 0 HG SER A 22 128.536 -8.322 -5.581 1.00 0.00 H new ATOM 335 N LEU A 23 127.264 -5.816 -1.750 1.00 0.00 N ATOM 336 CA LEU A 23 127.353 -5.261 -0.369 1.00 0.00 C ATOM 337 C LEU A 23 125.963 -5.233 0.270 1.00 0.00 C ATOM 338 O LEU A 23 124.985 -4.857 -0.346 1.00 0.00 O ATOM 339 CB LEU A 23 127.920 -3.839 -0.422 1.00 0.00 C ATOM 340 CG LEU A 23 129.401 -3.876 -0.829 1.00 0.00 C ATOM 341 CD1 LEU A 23 129.894 -2.442 -1.048 1.00 0.00 C ATOM 342 CD2 LEU A 23 130.247 -4.560 0.270 1.00 0.00 C ATOM 0 H LEU A 23 127.502 -5.164 -2.498 1.00 0.00 H new ATOM 0 HA LEU A 23 128.011 -5.893 0.228 1.00 0.00 H new ATOM 0 HB2 LEU A 23 127.354 -3.240 -1.135 1.00 0.00 H new ATOM 0 HB3 LEU A 23 127.814 -3.360 0.552 1.00 0.00 H new ATOM 0 HG LEU A 23 129.506 -4.449 -1.750 1.00 0.00 H new ATOM 0 HD11 LEU A 23 130.945 -2.459 -1.337 1.00 0.00 H new ATOM 0 HD12 LEU A 23 129.308 -1.972 -1.838 1.00 0.00 H new ATOM 0 HD13 LEU A 23 129.781 -1.873 -0.125 1.00 0.00 H new ATOM 0 HD21 LEU A 23 131.293 -4.578 -0.035 1.00 0.00 H new ATOM 0 HD22 LEU A 23 130.150 -4.004 1.203 1.00 0.00 H new ATOM 0 HD23 LEU A 23 129.895 -5.581 0.418 1.00 0.00 H new ATOM 354 N ALA A 24 125.879 -5.632 1.505 1.00 0.00 N ATOM 355 CA ALA A 24 124.559 -5.636 2.198 1.00 0.00 C ATOM 356 C ALA A 24 124.054 -4.199 2.376 1.00 0.00 C ATOM 357 O ALA A 24 124.803 -3.292 2.682 1.00 0.00 O ATOM 358 CB ALA A 24 124.700 -6.305 3.569 1.00 0.00 C ATOM 0 H ALA A 24 126.666 -5.956 2.067 1.00 0.00 H new ATOM 0 HA ALA A 24 123.842 -6.192 1.594 1.00 0.00 H new ATOM 0 HB1 ALA A 24 123.734 -6.307 4.074 1.00 0.00 H new ATOM 0 HB2 ALA A 24 125.044 -7.331 3.439 1.00 0.00 H new ATOM 0 HB3 ALA A 24 125.423 -5.753 4.170 1.00 0.00 H new ATOM 364 N GLY A 25 122.778 -3.998 2.179 1.00 0.00 N ATOM 365 CA GLY A 25 122.188 -2.630 2.325 1.00 0.00 C ATOM 366 C GLY A 25 122.054 -1.985 0.946 1.00 0.00 C ATOM 367 O GLY A 25 121.334 -1.022 0.768 1.00 0.00 O ATOM 0 H GLY A 25 122.112 -4.727 1.921 1.00 0.00 H new ATOM 0 HA2 GLY A 25 121.212 -2.692 2.806 1.00 0.00 H new ATOM 0 HA3 GLY A 25 122.820 -2.016 2.966 1.00 0.00 H new ATOM 371 N ILE A 26 122.730 -2.516 -0.038 1.00 0.00 N ATOM 372 CA ILE A 26 122.631 -1.948 -1.416 1.00 0.00 C ATOM 373 C ILE A 26 121.615 -2.781 -2.193 1.00 0.00 C ATOM 374 O ILE A 26 121.802 -3.963 -2.396 1.00 0.00 O ATOM 375 CB ILE A 26 123.996 -2.036 -2.107 1.00 0.00 C ATOM 376 CG1 ILE A 26 125.071 -1.381 -1.227 1.00 0.00 C ATOM 377 CG2 ILE A 26 123.938 -1.322 -3.459 1.00 0.00 C ATOM 378 CD1 ILE A 26 124.645 0.036 -0.825 1.00 0.00 C ATOM 0 H ILE A 26 123.349 -3.322 0.053 1.00 0.00 H new ATOM 0 HA ILE A 26 122.322 -0.904 -1.376 1.00 0.00 H new ATOM 0 HB ILE A 26 124.248 -3.085 -2.262 1.00 0.00 H new ATOM 0 HG12 ILE A 26 125.236 -1.985 -0.334 1.00 0.00 H new ATOM 0 HG13 ILE A 26 126.018 -1.343 -1.766 1.00 0.00 H new ATOM 0 HG21 ILE A 26 124.911 -1.387 -3.947 1.00 0.00 H new ATOM 0 HG22 ILE A 26 123.184 -1.795 -4.088 1.00 0.00 H new ATOM 0 HG23 ILE A 26 123.678 -0.275 -3.306 1.00 0.00 H new ATOM 0 HD11 ILE A 26 125.418 0.485 -0.202 1.00 0.00 H new ATOM 0 HD12 ILE A 26 124.503 0.641 -1.720 1.00 0.00 H new ATOM 0 HD13 ILE A 26 123.710 -0.010 -0.267 1.00 0.00 H new ATOM 390 N GLY A 27 120.535 -2.187 -2.635 1.00 0.00 N ATOM 391 CA GLY A 27 119.518 -2.960 -3.399 1.00 0.00 C ATOM 392 C GLY A 27 119.897 -2.970 -4.879 1.00 0.00 C ATOM 393 O GLY A 27 120.793 -2.270 -5.306 1.00 0.00 O ATOM 0 H GLY A 27 120.317 -1.200 -2.498 1.00 0.00 H new ATOM 0 HA2 GLY A 27 119.460 -3.980 -3.020 1.00 0.00 H new ATOM 0 HA3 GLY A 27 118.532 -2.515 -3.267 1.00 0.00 H new ATOM 397 N GLU A 28 119.236 -3.776 -5.659 1.00 0.00 N ATOM 398 CA GLU A 28 119.574 -3.850 -7.107 1.00 0.00 C ATOM 399 C GLU A 28 119.459 -2.463 -7.746 1.00 0.00 C ATOM 400 O GLU A 28 120.267 -2.084 -8.571 1.00 0.00 O ATOM 401 CB GLU A 28 118.604 -4.808 -7.799 1.00 0.00 C ATOM 402 CG GLU A 28 118.894 -6.243 -7.353 1.00 0.00 C ATOM 403 CD GLU A 28 117.877 -7.190 -7.993 1.00 0.00 C ATOM 404 OE1 GLU A 28 116.893 -6.701 -8.520 1.00 0.00 O ATOM 405 OE2 GLU A 28 118.105 -8.388 -7.950 1.00 0.00 O ATOM 0 H GLU A 28 118.477 -4.387 -5.358 1.00 0.00 H new ATOM 0 HA GLU A 28 120.597 -4.209 -7.219 1.00 0.00 H new ATOM 0 HB2 GLU A 28 117.576 -4.541 -7.554 1.00 0.00 H new ATOM 0 HB3 GLU A 28 118.705 -4.725 -8.881 1.00 0.00 H new ATOM 0 HG2 GLU A 28 119.905 -6.528 -7.643 1.00 0.00 H new ATOM 0 HG3 GLU A 28 118.841 -6.315 -6.267 1.00 0.00 H new ATOM 412 N VAL A 29 118.465 -1.701 -7.382 1.00 0.00 N ATOM 413 CA VAL A 29 118.315 -0.346 -7.986 1.00 0.00 C ATOM 414 C VAL A 29 119.442 0.562 -7.486 1.00 0.00 C ATOM 415 O VAL A 29 120.024 1.321 -8.238 1.00 0.00 O ATOM 416 CB VAL A 29 116.959 0.240 -7.588 1.00 0.00 C ATOM 417 CG1 VAL A 29 116.842 1.670 -8.119 1.00 0.00 C ATOM 418 CG2 VAL A 29 115.838 -0.620 -8.178 1.00 0.00 C ATOM 0 H VAL A 29 117.754 -1.955 -6.697 1.00 0.00 H new ATOM 0 HA VAL A 29 118.369 -0.420 -9.072 1.00 0.00 H new ATOM 0 HB VAL A 29 116.874 0.251 -6.501 1.00 0.00 H new ATOM 0 HG11 VAL A 29 115.875 2.086 -7.835 1.00 0.00 H new ATOM 0 HG12 VAL A 29 117.639 2.282 -7.696 1.00 0.00 H new ATOM 0 HG13 VAL A 29 116.928 1.663 -9.206 1.00 0.00 H new ATOM 0 HG21 VAL A 29 114.872 -0.203 -7.895 1.00 0.00 H new ATOM 0 HG22 VAL A 29 115.923 -0.633 -9.265 1.00 0.00 H new ATOM 0 HG23 VAL A 29 115.920 -1.637 -7.795 1.00 0.00 H new ATOM 428 N LEU A 30 119.749 0.494 -6.219 1.00 0.00 N ATOM 429 CA LEU A 30 120.831 1.351 -5.654 1.00 0.00 C ATOM 430 C LEU A 30 122.178 0.930 -6.236 1.00 0.00 C ATOM 431 O LEU A 30 123.028 1.750 -6.521 1.00 0.00 O ATOM 432 CB LEU A 30 120.876 1.192 -4.132 1.00 0.00 C ATOM 433 CG LEU A 30 119.546 1.629 -3.507 1.00 0.00 C ATOM 434 CD1 LEU A 30 119.604 1.388 -1.995 1.00 0.00 C ATOM 435 CD2 LEU A 30 119.296 3.124 -3.783 1.00 0.00 C ATOM 0 H LEU A 30 119.294 -0.123 -5.546 1.00 0.00 H new ATOM 0 HA LEU A 30 120.628 2.391 -5.909 1.00 0.00 H new ATOM 0 HB2 LEU A 30 121.081 0.153 -3.875 1.00 0.00 H new ATOM 0 HB3 LEU A 30 121.691 1.789 -3.722 1.00 0.00 H new ATOM 0 HG LEU A 30 118.732 1.051 -3.945 1.00 0.00 H new ATOM 0 HD11 LEU A 30 118.662 1.696 -1.541 1.00 0.00 H new ATOM 0 HD12 LEU A 30 119.771 0.328 -1.802 1.00 0.00 H new ATOM 0 HD13 LEU A 30 120.421 1.968 -1.565 1.00 0.00 H new ATOM 0 HD21 LEU A 30 118.349 3.423 -3.335 1.00 0.00 H new ATOM 0 HD22 LEU A 30 120.104 3.714 -3.351 1.00 0.00 H new ATOM 0 HD23 LEU A 30 119.258 3.294 -4.859 1.00 0.00 H new ATOM 447 N GLY A 31 122.381 -0.343 -6.405 1.00 0.00 N ATOM 448 CA GLY A 31 123.676 -0.819 -6.958 1.00 0.00 C ATOM 449 C GLY A 31 123.888 -0.224 -8.349 1.00 0.00 C ATOM 450 O GLY A 31 124.981 0.158 -8.710 1.00 0.00 O ATOM 0 H GLY A 31 121.706 -1.075 -6.184 1.00 0.00 H new ATOM 0 HA2 GLY A 31 124.494 -0.528 -6.298 1.00 0.00 H new ATOM 0 HA3 GLY A 31 123.682 -1.908 -7.012 1.00 0.00 H new ATOM 454 N LYS A 32 122.852 -0.148 -9.135 1.00 0.00 N ATOM 455 CA LYS A 32 122.994 0.410 -10.510 1.00 0.00 C ATOM 456 C LYS A 32 123.445 1.876 -10.454 1.00 0.00 C ATOM 457 O LYS A 32 124.230 2.314 -11.271 1.00 0.00 O ATOM 458 CB LYS A 32 121.652 0.312 -11.236 1.00 0.00 C ATOM 459 CG LYS A 32 121.350 -1.159 -11.539 1.00 0.00 C ATOM 460 CD LYS A 32 119.935 -1.297 -12.113 1.00 0.00 C ATOM 461 CE LYS A 32 119.875 -0.703 -13.525 1.00 0.00 C ATOM 462 NZ LYS A 32 118.638 -1.176 -14.207 1.00 0.00 N ATOM 0 H LYS A 32 121.910 -0.449 -8.885 1.00 0.00 H new ATOM 0 HA LYS A 32 123.749 -0.164 -11.048 1.00 0.00 H new ATOM 0 HB2 LYS A 32 120.860 0.739 -10.621 1.00 0.00 H new ATOM 0 HB3 LYS A 32 121.682 0.888 -12.161 1.00 0.00 H new ATOM 0 HG2 LYS A 32 122.079 -1.550 -12.249 1.00 0.00 H new ATOM 0 HG3 LYS A 32 121.442 -1.752 -10.629 1.00 0.00 H new ATOM 0 HD2 LYS A 32 119.647 -2.348 -12.140 1.00 0.00 H new ATOM 0 HD3 LYS A 32 119.221 -0.788 -11.466 1.00 0.00 H new ATOM 0 HE2 LYS A 32 119.882 0.386 -13.474 1.00 0.00 H new ATOM 0 HE3 LYS A 32 120.755 -1.001 -14.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 118.595 -0.774 -15.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 118.650 -2.214 -14.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 117.804 -0.870 -13.666 1.00 0.00 H new ATOM 476 N LYS A 33 122.949 2.649 -9.525 1.00 0.00 N ATOM 477 CA LYS A 33 123.360 4.085 -9.476 1.00 0.00 C ATOM 478 C LYS A 33 124.852 4.192 -9.132 1.00 0.00 C ATOM 479 O LYS A 33 125.575 4.974 -9.716 1.00 0.00 O ATOM 480 CB LYS A 33 122.548 4.810 -8.399 1.00 0.00 C ATOM 481 CG LYS A 33 121.076 4.868 -8.811 1.00 0.00 C ATOM 482 CD LYS A 33 120.274 5.593 -7.727 1.00 0.00 C ATOM 483 CE LYS A 33 118.797 5.657 -8.127 1.00 0.00 C ATOM 484 NZ LYS A 33 118.597 6.728 -9.145 1.00 0.00 N ATOM 0 H LYS A 33 122.287 2.356 -8.807 1.00 0.00 H new ATOM 0 HA LYS A 33 123.178 4.540 -10.450 1.00 0.00 H new ATOM 0 HB2 LYS A 33 122.648 4.292 -7.445 1.00 0.00 H new ATOM 0 HB3 LYS A 33 122.935 5.819 -8.256 1.00 0.00 H new ATOM 0 HG2 LYS A 33 120.974 5.388 -9.764 1.00 0.00 H new ATOM 0 HG3 LYS A 33 120.687 3.860 -8.954 1.00 0.00 H new ATOM 0 HD2 LYS A 33 120.380 5.073 -6.775 1.00 0.00 H new ATOM 0 HD3 LYS A 33 120.665 6.600 -7.585 1.00 0.00 H new ATOM 0 HE2 LYS A 33 118.477 4.696 -8.529 1.00 0.00 H new ATOM 0 HE3 LYS A 33 118.181 5.856 -7.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 117.586 6.803 -9.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 118.933 7.636 -8.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 119.133 6.494 -10.005 1.00 0.00 H new ATOM 498 N LEU A 34 125.322 3.408 -8.199 1.00 0.00 N ATOM 499 CA LEU A 34 126.771 3.464 -7.834 1.00 0.00 C ATOM 500 C LEU A 34 127.621 3.073 -9.051 1.00 0.00 C ATOM 501 O LEU A 34 128.674 3.628 -9.296 1.00 0.00 O ATOM 502 CB LEU A 34 127.051 2.500 -6.675 1.00 0.00 C ATOM 503 CG LEU A 34 126.380 2.998 -5.385 1.00 0.00 C ATOM 504 CD1 LEU A 34 126.430 1.883 -4.336 1.00 0.00 C ATOM 505 CD2 LEU A 34 127.112 4.239 -4.838 1.00 0.00 C ATOM 0 H LEU A 34 124.768 2.732 -7.674 1.00 0.00 H new ATOM 0 HA LEU A 34 127.027 4.477 -7.525 1.00 0.00 H new ATOM 0 HB2 LEU A 34 126.680 1.506 -6.924 1.00 0.00 H new ATOM 0 HB3 LEU A 34 128.126 2.410 -6.521 1.00 0.00 H new ATOM 0 HG LEU A 34 125.347 3.268 -5.604 1.00 0.00 H new ATOM 0 HD11 LEU A 34 125.956 2.227 -3.417 1.00 0.00 H new ATOM 0 HD12 LEU A 34 125.901 1.007 -4.711 1.00 0.00 H new ATOM 0 HD13 LEU A 34 127.468 1.621 -4.133 1.00 0.00 H new ATOM 0 HD21 LEU A 34 126.622 4.577 -3.925 1.00 0.00 H new ATOM 0 HD22 LEU A 34 128.149 3.983 -4.621 1.00 0.00 H new ATOM 0 HD23 LEU A 34 127.083 5.036 -5.581 1.00 0.00 H new ATOM 517 N GLU A 35 127.171 2.106 -9.796 1.00 0.00 N ATOM 518 CA GLU A 35 127.967 1.665 -10.983 1.00 0.00 C ATOM 519 C GLU A 35 128.132 2.844 -11.944 1.00 0.00 C ATOM 520 O GLU A 35 129.183 3.052 -12.517 1.00 0.00 O ATOM 521 CB GLU A 35 127.244 0.522 -11.701 1.00 0.00 C ATOM 522 CG GLU A 35 127.261 -0.736 -10.830 1.00 0.00 C ATOM 523 CD GLU A 35 126.357 -1.800 -11.454 1.00 0.00 C ATOM 524 OE1 GLU A 35 125.840 -1.553 -12.530 1.00 0.00 O ATOM 525 OE2 GLU A 35 126.202 -2.848 -10.848 1.00 0.00 O ATOM 0 H GLU A 35 126.297 1.603 -9.641 1.00 0.00 H new ATOM 0 HA GLU A 35 128.945 1.317 -10.652 1.00 0.00 H new ATOM 0 HB2 GLU A 35 126.215 0.810 -11.918 1.00 0.00 H new ATOM 0 HB3 GLU A 35 127.726 0.319 -12.657 1.00 0.00 H new ATOM 0 HG2 GLU A 35 128.279 -1.115 -10.740 1.00 0.00 H new ATOM 0 HG3 GLU A 35 126.919 -0.498 -9.823 1.00 0.00 H new ATOM 532 N GLU A 36 127.101 3.622 -12.115 1.00 0.00 N ATOM 533 CA GLU A 36 127.185 4.799 -13.027 1.00 0.00 C ATOM 534 C GLU A 36 128.105 5.853 -12.405 1.00 0.00 C ATOM 535 O GLU A 36 128.586 6.748 -13.072 1.00 0.00 O ATOM 536 CB GLU A 36 125.788 5.388 -13.230 1.00 0.00 C ATOM 537 CG GLU A 36 124.946 4.425 -14.069 1.00 0.00 C ATOM 538 CD GLU A 36 123.548 5.011 -14.275 1.00 0.00 C ATOM 539 OE1 GLU A 36 122.728 4.863 -13.383 1.00 0.00 O ATOM 540 OE2 GLU A 36 123.320 5.596 -15.320 1.00 0.00 O ATOM 0 H GLU A 36 126.197 3.493 -11.660 1.00 0.00 H new ATOM 0 HA GLU A 36 127.587 4.489 -13.992 1.00 0.00 H new ATOM 0 HB2 GLU A 36 125.310 5.560 -12.265 1.00 0.00 H new ATOM 0 HB3 GLU A 36 125.858 6.355 -13.728 1.00 0.00 H new ATOM 0 HG2 GLU A 36 125.425 4.253 -15.033 1.00 0.00 H new ATOM 0 HG3 GLU A 36 124.876 3.458 -13.571 1.00 0.00 H new ATOM 547 N ARG A 37 128.323 5.766 -11.123 1.00 0.00 N ATOM 548 CA ARG A 37 129.182 6.780 -10.438 1.00 0.00 C ATOM 549 C ARG A 37 130.654 6.345 -10.486 1.00 0.00 C ATOM 550 O ARG A 37 131.529 7.066 -10.050 1.00 0.00 O ATOM 551 CB ARG A 37 128.736 6.905 -8.977 1.00 0.00 C ATOM 552 CG ARG A 37 127.330 7.520 -8.890 1.00 0.00 C ATOM 553 CD ARG A 37 127.391 9.045 -9.046 1.00 0.00 C ATOM 554 NE ARG A 37 126.049 9.616 -8.736 1.00 0.00 N ATOM 555 CZ ARG A 37 125.914 10.894 -8.507 1.00 0.00 C ATOM 556 NH1 ARG A 37 126.954 11.680 -8.545 1.00 0.00 N ATOM 557 NH2 ARG A 37 124.734 11.385 -8.240 1.00 0.00 N ATOM 0 H ARG A 37 127.945 5.038 -10.517 1.00 0.00 H new ATOM 0 HA ARG A 37 129.081 7.740 -10.944 1.00 0.00 H new ATOM 0 HB2 ARG A 37 128.739 5.922 -8.505 1.00 0.00 H new ATOM 0 HB3 ARG A 37 129.444 7.525 -8.427 1.00 0.00 H new ATOM 0 HG2 ARG A 37 126.694 7.096 -9.667 1.00 0.00 H new ATOM 0 HG3 ARG A 37 126.876 7.266 -7.932 1.00 0.00 H new ATOM 0 HD2 ARG A 37 128.142 9.463 -8.376 1.00 0.00 H new ATOM 0 HD3 ARG A 37 127.687 9.309 -10.061 1.00 0.00 H new ATOM 0 HE ARG A 37 125.233 9.005 -8.703 1.00 0.00 H new ATOM 0 HH11 ARG A 37 127.876 11.296 -8.754 1.00 0.00 H new ATOM 0 HH12 ARG A 37 126.846 12.678 -8.366 1.00 0.00 H new ATOM 0 HH21 ARG A 37 123.921 10.770 -8.211 1.00 0.00 H new ATOM 0 HH22 ARG A 37 124.626 12.383 -8.061 1.00 0.00 H new ATOM 571 N GLY A 38 130.940 5.192 -11.048 1.00 0.00 N ATOM 572 CA GLY A 38 132.371 4.740 -11.164 1.00 0.00 C ATOM 573 C GLY A 38 132.685 3.610 -10.180 1.00 0.00 C ATOM 574 O GLY A 38 133.801 3.133 -10.124 1.00 0.00 O ATOM 0 H GLY A 38 130.250 4.546 -11.430 1.00 0.00 H new ATOM 0 HA2 GLY A 38 132.565 4.402 -12.182 1.00 0.00 H new ATOM 0 HA3 GLY A 38 133.036 5.583 -10.976 1.00 0.00 H new ATOM 578 N PHE A 39 131.723 3.157 -9.420 1.00 0.00 N ATOM 579 CA PHE A 39 131.987 2.035 -8.462 1.00 0.00 C ATOM 580 C PHE A 39 131.431 0.749 -9.069 1.00 0.00 C ATOM 581 O PHE A 39 130.382 0.268 -8.689 1.00 0.00 O ATOM 582 CB PHE A 39 131.281 2.314 -7.135 1.00 0.00 C ATOM 583 CG PHE A 39 131.862 3.556 -6.502 1.00 0.00 C ATOM 584 CD1 PHE A 39 132.981 3.463 -5.670 1.00 0.00 C ATOM 585 CD2 PHE A 39 131.284 4.799 -6.760 1.00 0.00 C ATOM 586 CE1 PHE A 39 133.521 4.618 -5.092 1.00 0.00 C ATOM 587 CE2 PHE A 39 131.823 5.955 -6.188 1.00 0.00 C ATOM 588 CZ PHE A 39 132.943 5.865 -5.352 1.00 0.00 C ATOM 0 H PHE A 39 130.767 3.512 -9.419 1.00 0.00 H new ATOM 0 HA PHE A 39 133.058 1.940 -8.282 1.00 0.00 H new ATOM 0 HB2 PHE A 39 130.212 2.445 -7.301 1.00 0.00 H new ATOM 0 HB3 PHE A 39 131.398 1.463 -6.464 1.00 0.00 H new ATOM 0 HD1 PHE A 39 133.429 2.500 -5.473 1.00 0.00 H new ATOM 0 HD2 PHE A 39 130.419 4.868 -7.403 1.00 0.00 H new ATOM 0 HE1 PHE A 39 134.383 4.546 -4.446 1.00 0.00 H new ATOM 0 HE2 PHE A 39 131.376 6.917 -6.391 1.00 0.00 H new ATOM 0 HZ PHE A 39 133.360 6.757 -4.909 1.00 0.00 H new ATOM 598 N ASP A 40 132.120 0.207 -10.039 1.00 0.00 N ATOM 599 CA ASP A 40 131.625 -1.026 -10.709 1.00 0.00 C ATOM 600 C ASP A 40 131.917 -2.263 -9.854 1.00 0.00 C ATOM 601 O ASP A 40 131.405 -3.332 -10.120 1.00 0.00 O ATOM 602 CB ASP A 40 132.331 -1.175 -12.058 1.00 0.00 C ATOM 603 CG ASP A 40 133.825 -1.411 -11.828 1.00 0.00 C ATOM 604 OD1 ASP A 40 134.293 -1.103 -10.745 1.00 0.00 O ATOM 605 OD2 ASP A 40 134.475 -1.895 -12.739 1.00 0.00 O ATOM 0 H ASP A 40 133.005 0.568 -10.395 1.00 0.00 H new ATOM 0 HA ASP A 40 130.547 -0.942 -10.848 1.00 0.00 H new ATOM 0 HB2 ASP A 40 131.902 -2.008 -12.615 1.00 0.00 H new ATOM 0 HB3 ASP A 40 132.182 -0.278 -12.660 1.00 0.00 H new ATOM 610 N LYS A 41 132.738 -2.141 -8.835 1.00 0.00 N ATOM 611 CA LYS A 41 133.055 -3.332 -7.979 1.00 0.00 C ATOM 612 C LYS A 41 133.081 -2.927 -6.499 1.00 0.00 C ATOM 613 O LYS A 41 133.183 -1.765 -6.159 1.00 0.00 O ATOM 614 CB LYS A 41 134.393 -3.934 -8.415 1.00 0.00 C ATOM 615 CG LYS A 41 134.207 -4.560 -9.805 1.00 0.00 C ATOM 616 CD LYS A 41 135.511 -5.203 -10.296 1.00 0.00 C ATOM 617 CE LYS A 41 135.676 -6.606 -9.696 1.00 0.00 C ATOM 618 NZ LYS A 41 134.502 -7.451 -10.064 1.00 0.00 N ATOM 0 H LYS A 41 133.200 -1.274 -8.560 1.00 0.00 H new ATOM 0 HA LYS A 41 132.280 -4.089 -8.103 1.00 0.00 H new ATOM 0 HB2 LYS A 41 135.164 -3.164 -8.445 1.00 0.00 H new ATOM 0 HB3 LYS A 41 134.722 -4.688 -7.700 1.00 0.00 H new ATOM 0 HG2 LYS A 41 133.418 -5.311 -9.767 1.00 0.00 H new ATOM 0 HG3 LYS A 41 133.885 -3.796 -10.512 1.00 0.00 H new ATOM 0 HD2 LYS A 41 135.506 -5.264 -11.384 1.00 0.00 H new ATOM 0 HD3 LYS A 41 136.360 -4.579 -10.016 1.00 0.00 H new ATOM 0 HE2 LYS A 41 136.595 -7.063 -10.063 1.00 0.00 H new ATOM 0 HE3 LYS A 41 135.764 -6.540 -8.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 134.050 -7.812 -9.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 133.818 -6.880 -10.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 134.819 -8.250 -10.649 1.00 0.00 H new ATOM 632 N ALA A 42 132.931 -3.886 -5.625 1.00 0.00 N ATOM 633 CA ALA A 42 132.882 -3.596 -4.156 1.00 0.00 C ATOM 634 C ALA A 42 134.206 -3.044 -3.594 1.00 0.00 C ATOM 635 O ALA A 42 134.195 -2.146 -2.777 1.00 0.00 O ATOM 636 CB ALA A 42 132.527 -4.886 -3.415 1.00 0.00 C ATOM 0 H ALA A 42 132.839 -4.873 -5.867 1.00 0.00 H new ATOM 0 HA ALA A 42 132.129 -2.822 -4.006 1.00 0.00 H new ATOM 0 HB1 ALA A 42 132.487 -4.691 -2.343 1.00 0.00 H new ATOM 0 HB2 ALA A 42 131.555 -5.245 -3.755 1.00 0.00 H new ATOM 0 HB3 ALA A 42 133.285 -5.643 -3.618 1.00 0.00 H new ATOM 642 N TYR A 43 135.337 -3.585 -3.962 1.00 0.00 N ATOM 643 CA TYR A 43 136.613 -3.080 -3.357 1.00 0.00 C ATOM 644 C TYR A 43 136.788 -1.577 -3.592 1.00 0.00 C ATOM 645 O TYR A 43 137.544 -0.928 -2.896 1.00 0.00 O ATOM 646 CB TYR A 43 137.837 -3.852 -3.877 1.00 0.00 C ATOM 647 CG TYR A 43 138.052 -3.649 -5.362 1.00 0.00 C ATOM 648 CD1 TYR A 43 138.592 -2.446 -5.843 1.00 0.00 C ATOM 649 CD2 TYR A 43 137.748 -4.682 -6.254 1.00 0.00 C ATOM 650 CE1 TYR A 43 138.822 -2.282 -7.215 1.00 0.00 C ATOM 651 CE2 TYR A 43 137.974 -4.517 -7.623 1.00 0.00 C ATOM 652 CZ TYR A 43 138.513 -3.318 -8.104 1.00 0.00 C ATOM 653 OH TYR A 43 138.740 -3.157 -9.456 1.00 0.00 O ATOM 0 H TYR A 43 135.437 -4.340 -4.641 1.00 0.00 H new ATOM 0 HA TYR A 43 136.542 -3.251 -2.283 1.00 0.00 H new ATOM 0 HB2 TYR A 43 138.726 -3.528 -3.335 1.00 0.00 H new ATOM 0 HB3 TYR A 43 137.708 -4.915 -3.672 1.00 0.00 H new ATOM 0 HD1 TYR A 43 138.830 -1.647 -5.156 1.00 0.00 H new ATOM 0 HD2 TYR A 43 137.337 -5.610 -5.884 1.00 0.00 H new ATOM 0 HE1 TYR A 43 139.237 -1.357 -7.587 1.00 0.00 H new ATOM 0 HE2 TYR A 43 137.733 -5.315 -8.310 1.00 0.00 H new ATOM 0 HH TYR A 43 138.472 -3.971 -9.932 1.00 0.00 H new ATOM 663 N VAL A 44 136.092 -0.998 -4.533 1.00 0.00 N ATOM 664 CA VAL A 44 136.233 0.474 -4.747 1.00 0.00 C ATOM 665 C VAL A 44 135.385 1.201 -3.696 1.00 0.00 C ATOM 666 O VAL A 44 135.719 2.274 -3.228 1.00 0.00 O ATOM 667 CB VAL A 44 135.750 0.850 -6.152 1.00 0.00 C ATOM 668 CG1 VAL A 44 136.050 2.329 -6.430 1.00 0.00 C ATOM 669 CG2 VAL A 44 136.474 -0.013 -7.187 1.00 0.00 C ATOM 0 H VAL A 44 135.439 -1.472 -5.157 1.00 0.00 H new ATOM 0 HA VAL A 44 137.280 0.763 -4.651 1.00 0.00 H new ATOM 0 HB VAL A 44 134.675 0.681 -6.216 1.00 0.00 H new ATOM 0 HG11 VAL A 44 135.704 2.589 -7.430 1.00 0.00 H new ATOM 0 HG12 VAL A 44 135.536 2.949 -5.696 1.00 0.00 H new ATOM 0 HG13 VAL A 44 137.124 2.501 -6.362 1.00 0.00 H new ATOM 0 HG21 VAL A 44 136.131 0.254 -8.187 1.00 0.00 H new ATOM 0 HG22 VAL A 44 137.548 0.156 -7.115 1.00 0.00 H new ATOM 0 HG23 VAL A 44 136.259 -1.065 -6.998 1.00 0.00 H new ATOM 679 N VAL A 45 134.282 0.601 -3.329 1.00 0.00 N ATOM 680 CA VAL A 45 133.381 1.221 -2.316 1.00 0.00 C ATOM 681 C VAL A 45 134.000 1.032 -0.931 1.00 0.00 C ATOM 682 O VAL A 45 133.996 1.929 -0.113 1.00 0.00 O ATOM 683 CB VAL A 45 132.011 0.541 -2.364 1.00 0.00 C ATOM 684 CG1 VAL A 45 131.075 1.195 -1.345 1.00 0.00 C ATOM 685 CG2 VAL A 45 131.421 0.686 -3.769 1.00 0.00 C ATOM 0 H VAL A 45 133.966 -0.299 -3.691 1.00 0.00 H new ATOM 0 HA VAL A 45 133.258 2.283 -2.527 1.00 0.00 H new ATOM 0 HB VAL A 45 132.122 -0.516 -2.123 1.00 0.00 H new ATOM 0 HG11 VAL A 45 130.100 0.709 -1.382 1.00 0.00 H new ATOM 0 HG12 VAL A 45 131.496 1.090 -0.345 1.00 0.00 H new ATOM 0 HG13 VAL A 45 130.962 2.253 -1.582 1.00 0.00 H new ATOM 0 HG21 VAL A 45 130.445 0.202 -3.805 1.00 0.00 H new ATOM 0 HG22 VAL A 45 131.311 1.743 -4.010 1.00 0.00 H new ATOM 0 HG23 VAL A 45 132.086 0.216 -4.493 1.00 0.00 H new ATOM 695 N LEU A 46 134.571 -0.113 -0.675 1.00 0.00 N ATOM 696 CA LEU A 46 135.227 -0.329 0.643 1.00 0.00 C ATOM 697 C LEU A 46 136.333 0.714 0.790 1.00 0.00 C ATOM 698 O LEU A 46 136.571 1.248 1.856 1.00 0.00 O ATOM 699 CB LEU A 46 135.831 -1.740 0.714 1.00 0.00 C ATOM 700 CG LEU A 46 136.540 -1.947 2.070 1.00 0.00 C ATOM 701 CD1 LEU A 46 135.525 -1.859 3.222 1.00 0.00 C ATOM 702 CD2 LEU A 46 137.240 -3.316 2.094 1.00 0.00 C ATOM 0 H LEU A 46 134.611 -0.904 -1.318 1.00 0.00 H new ATOM 0 HA LEU A 46 134.496 -0.231 1.446 1.00 0.00 H new ATOM 0 HB2 LEU A 46 135.047 -2.486 0.587 1.00 0.00 H new ATOM 0 HB3 LEU A 46 136.540 -1.882 -0.101 1.00 0.00 H new ATOM 0 HG LEU A 46 137.286 -1.162 2.197 1.00 0.00 H new ATOM 0 HD11 LEU A 46 136.039 -2.007 4.172 1.00 0.00 H new ATOM 0 HD12 LEU A 46 135.051 -0.878 3.215 1.00 0.00 H new ATOM 0 HD13 LEU A 46 134.765 -2.630 3.097 1.00 0.00 H new ATOM 0 HD21 LEU A 46 137.737 -3.454 3.054 1.00 0.00 H new ATOM 0 HD22 LEU A 46 136.501 -4.105 1.952 1.00 0.00 H new ATOM 0 HD23 LEU A 46 137.978 -3.361 1.293 1.00 0.00 H new ATOM 714 N GLY A 47 137.018 0.996 -0.285 1.00 0.00 N ATOM 715 CA GLY A 47 138.120 1.993 -0.232 1.00 0.00 C ATOM 716 C GLY A 47 137.574 3.322 0.290 1.00 0.00 C ATOM 717 O GLY A 47 138.199 3.986 1.091 1.00 0.00 O ATOM 0 H GLY A 47 136.859 0.576 -1.201 1.00 0.00 H new ATOM 0 HA2 GLY A 47 138.919 1.635 0.417 1.00 0.00 H new ATOM 0 HA3 GLY A 47 138.552 2.128 -1.224 1.00 0.00 H new ATOM 721 N GLN A 48 136.409 3.714 -0.151 1.00 0.00 N ATOM 722 CA GLN A 48 135.829 4.997 0.335 1.00 0.00 C ATOM 723 C GLN A 48 135.654 4.921 1.856 1.00 0.00 C ATOM 724 O GLN A 48 135.955 5.851 2.574 1.00 0.00 O ATOM 725 CB GLN A 48 134.466 5.218 -0.334 1.00 0.00 C ATOM 726 CG GLN A 48 133.888 6.578 0.077 1.00 0.00 C ATOM 727 CD GLN A 48 134.769 7.699 -0.477 1.00 0.00 C ATOM 728 OE1 GLN A 48 135.288 7.595 -1.571 1.00 0.00 O ATOM 729 NE2 GLN A 48 134.954 8.779 0.233 1.00 0.00 N ATOM 0 H GLN A 48 135.837 3.203 -0.824 1.00 0.00 H new ATOM 0 HA GLN A 48 136.492 5.826 0.086 1.00 0.00 H new ATOM 0 HB2 GLN A 48 134.573 5.173 -1.418 1.00 0.00 H new ATOM 0 HB3 GLN A 48 133.779 4.421 -0.048 1.00 0.00 H new ATOM 0 HG2 GLN A 48 132.871 6.681 -0.301 1.00 0.00 H new ATOM 0 HG3 GLN A 48 133.833 6.648 1.163 1.00 0.00 H new ATOM 0 HE21 GLN A 48 134.518 8.867 1.151 1.00 0.00 H new ATOM 0 HE22 GLN A 48 135.534 9.535 -0.131 1.00 0.00 H new ATOM 738 N PHE A 49 135.177 3.812 2.351 1.00 0.00 N ATOM 739 CA PHE A 49 134.983 3.659 3.824 1.00 0.00 C ATOM 740 C PHE A 49 136.336 3.824 4.526 1.00 0.00 C ATOM 741 O PHE A 49 136.441 4.431 5.574 1.00 0.00 O ATOM 742 CB PHE A 49 134.412 2.261 4.095 1.00 0.00 C ATOM 743 CG PHE A 49 134.117 2.083 5.567 1.00 0.00 C ATOM 744 CD1 PHE A 49 133.154 2.888 6.188 1.00 0.00 C ATOM 745 CD2 PHE A 49 134.788 1.097 6.309 1.00 0.00 C ATOM 746 CE1 PHE A 49 132.864 2.714 7.545 1.00 0.00 C ATOM 747 CE2 PHE A 49 134.496 0.926 7.667 1.00 0.00 C ATOM 748 CZ PHE A 49 133.534 1.733 8.284 1.00 0.00 C ATOM 0 H PHE A 49 134.911 2.999 1.796 1.00 0.00 H new ATOM 0 HA PHE A 49 134.294 4.414 4.203 1.00 0.00 H new ATOM 0 HB2 PHE A 49 133.500 2.116 3.516 1.00 0.00 H new ATOM 0 HB3 PHE A 49 135.122 1.502 3.767 1.00 0.00 H new ATOM 0 HD1 PHE A 49 132.635 3.644 5.618 1.00 0.00 H new ATOM 0 HD2 PHE A 49 135.528 0.472 5.832 1.00 0.00 H new ATOM 0 HE1 PHE A 49 132.122 3.337 8.023 1.00 0.00 H new ATOM 0 HE2 PHE A 49 135.014 0.170 8.239 1.00 0.00 H new ATOM 0 HZ PHE A 49 133.308 1.599 9.332 1.00 0.00 H new ATOM 758 N LEU A 50 137.363 3.281 3.950 1.00 0.00 N ATOM 759 CA LEU A 50 138.713 3.397 4.579 1.00 0.00 C ATOM 760 C LEU A 50 139.182 4.856 4.484 1.00 0.00 C ATOM 761 O LEU A 50 139.795 5.382 5.391 1.00 0.00 O ATOM 762 CB LEU A 50 139.699 2.478 3.848 1.00 0.00 C ATOM 763 CG LEU A 50 139.221 1.017 3.938 1.00 0.00 C ATOM 764 CD1 LEU A 50 140.187 0.107 3.159 1.00 0.00 C ATOM 765 CD2 LEU A 50 139.160 0.569 5.412 1.00 0.00 C ATOM 0 H LEU A 50 137.334 2.761 3.073 1.00 0.00 H new ATOM 0 HA LEU A 50 138.664 3.099 5.626 1.00 0.00 H new ATOM 0 HB2 LEU A 50 139.783 2.778 2.804 1.00 0.00 H new ATOM 0 HB3 LEU A 50 140.692 2.572 4.288 1.00 0.00 H new ATOM 0 HG LEU A 50 138.224 0.943 3.504 1.00 0.00 H new ATOM 0 HD11 LEU A 50 139.846 -0.926 3.225 1.00 0.00 H new ATOM 0 HD12 LEU A 50 140.214 0.415 2.114 1.00 0.00 H new ATOM 0 HD13 LEU A 50 141.187 0.187 3.586 1.00 0.00 H new ATOM 0 HD21 LEU A 50 138.821 -0.466 5.464 1.00 0.00 H new ATOM 0 HD22 LEU A 50 140.151 0.649 5.858 1.00 0.00 H new ATOM 0 HD23 LEU A 50 138.465 1.207 5.958 1.00 0.00 H new ATOM 777 N VAL A 51 138.907 5.502 3.387 1.00 0.00 N ATOM 778 CA VAL A 51 139.342 6.921 3.209 1.00 0.00 C ATOM 779 C VAL A 51 138.590 7.845 4.183 1.00 0.00 C ATOM 780 O VAL A 51 139.034 8.936 4.481 1.00 0.00 O ATOM 781 CB VAL A 51 139.060 7.352 1.764 1.00 0.00 C ATOM 782 CG1 VAL A 51 139.274 8.861 1.613 1.00 0.00 C ATOM 783 CG2 VAL A 51 140.012 6.611 0.824 1.00 0.00 C ATOM 0 H VAL A 51 138.395 5.108 2.598 1.00 0.00 H new ATOM 0 HA VAL A 51 140.409 6.996 3.419 1.00 0.00 H new ATOM 0 HB VAL A 51 138.027 7.112 1.514 1.00 0.00 H new ATOM 0 HG11 VAL A 51 139.071 9.156 0.583 1.00 0.00 H new ATOM 0 HG12 VAL A 51 138.598 9.393 2.283 1.00 0.00 H new ATOM 0 HG13 VAL A 51 140.305 9.109 1.865 1.00 0.00 H new ATOM 0 HG21 VAL A 51 139.816 6.913 -0.205 1.00 0.00 H new ATOM 0 HG22 VAL A 51 141.042 6.854 1.084 1.00 0.00 H new ATOM 0 HG23 VAL A 51 139.857 5.537 0.922 1.00 0.00 H new ATOM 793 N LEU A 52 137.445 7.430 4.658 1.00 0.00 N ATOM 794 CA LEU A 52 136.652 8.303 5.584 1.00 0.00 C ATOM 795 C LEU A 52 137.032 8.038 7.046 1.00 0.00 C ATOM 796 O LEU A 52 136.347 8.469 7.952 1.00 0.00 O ATOM 797 CB LEU A 52 135.165 8.016 5.385 1.00 0.00 C ATOM 798 CG LEU A 52 134.736 8.445 3.973 1.00 0.00 C ATOM 799 CD1 LEU A 52 133.323 7.926 3.705 1.00 0.00 C ATOM 800 CD2 LEU A 52 134.759 9.983 3.843 1.00 0.00 C ATOM 0 H LEU A 52 137.022 6.526 4.447 1.00 0.00 H new ATOM 0 HA LEU A 52 136.870 9.347 5.357 1.00 0.00 H new ATOM 0 HB2 LEU A 52 134.968 6.953 5.528 1.00 0.00 H new ATOM 0 HB3 LEU A 52 134.579 8.552 6.132 1.00 0.00 H new ATOM 0 HG LEU A 52 135.432 8.028 3.245 1.00 0.00 H new ATOM 0 HD11 LEU A 52 133.009 8.225 2.705 1.00 0.00 H new ATOM 0 HD12 LEU A 52 133.315 6.838 3.778 1.00 0.00 H new ATOM 0 HD13 LEU A 52 132.636 8.344 4.441 1.00 0.00 H new ATOM 0 HD21 LEU A 52 134.452 10.268 2.837 1.00 0.00 H new ATOM 0 HD22 LEU A 52 134.073 10.420 4.569 1.00 0.00 H new ATOM 0 HD23 LEU A 52 135.768 10.349 4.032 1.00 0.00 H new ATOM 812 N LYS A 53 138.111 7.352 7.299 1.00 0.00 N ATOM 813 CA LYS A 53 138.514 7.094 8.712 1.00 0.00 C ATOM 814 C LYS A 53 137.312 6.577 9.514 1.00 0.00 C ATOM 815 O LYS A 53 137.127 6.930 10.661 1.00 0.00 O ATOM 816 CB LYS A 53 139.009 8.396 9.347 1.00 0.00 C ATOM 817 CG LYS A 53 140.213 8.927 8.566 1.00 0.00 C ATOM 818 CD LYS A 53 140.700 10.228 9.210 1.00 0.00 C ATOM 819 CE LYS A 53 141.898 10.767 8.429 1.00 0.00 C ATOM 820 NZ LYS A 53 141.431 11.300 7.117 1.00 0.00 N ATOM 0 H LYS A 53 138.731 6.959 6.591 1.00 0.00 H new ATOM 0 HA LYS A 53 139.308 6.347 8.723 1.00 0.00 H new ATOM 0 HB2 LYS A 53 138.210 9.137 9.350 1.00 0.00 H new ATOM 0 HB3 LYS A 53 139.286 8.222 10.387 1.00 0.00 H new ATOM 0 HG2 LYS A 53 141.014 8.187 8.563 1.00 0.00 H new ATOM 0 HG3 LYS A 53 139.938 9.103 7.526 1.00 0.00 H new ATOM 0 HD2 LYS A 53 139.897 10.965 9.218 1.00 0.00 H new ATOM 0 HD3 LYS A 53 140.980 10.050 10.248 1.00 0.00 H new ATOM 0 HE2 LYS A 53 142.394 11.553 8.998 1.00 0.00 H new ATOM 0 HE3 LYS A 53 142.631 9.976 8.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 142.172 11.902 6.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 141.228 10.509 6.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 140.567 11.862 7.258 1.00 0.00 H new ATOM 834 N LYS A 54 136.502 5.732 8.924 1.00 0.00 N ATOM 835 CA LYS A 54 135.315 5.165 9.640 1.00 0.00 C ATOM 836 C LYS A 54 134.360 6.284 10.083 1.00 0.00 C ATOM 837 O LYS A 54 133.535 6.079 10.950 1.00 0.00 O ATOM 838 CB LYS A 54 135.787 4.394 10.880 1.00 0.00 C ATOM 839 CG LYS A 54 136.980 3.492 10.531 1.00 0.00 C ATOM 840 CD LYS A 54 136.576 2.446 9.488 1.00 0.00 C ATOM 841 CE LYS A 54 137.712 1.436 9.322 1.00 0.00 C ATOM 842 NZ LYS A 54 137.388 0.506 8.204 1.00 0.00 N ATOM 0 H LYS A 54 136.614 5.407 7.964 1.00 0.00 H new ATOM 0 HA LYS A 54 134.787 4.498 8.958 1.00 0.00 H new ATOM 0 HB2 LYS A 54 136.071 5.095 11.665 1.00 0.00 H new ATOM 0 HB3 LYS A 54 134.969 3.790 11.273 1.00 0.00 H new ATOM 0 HG2 LYS A 54 137.801 4.098 10.148 1.00 0.00 H new ATOM 0 HG3 LYS A 54 137.343 2.995 11.431 1.00 0.00 H new ATOM 0 HD2 LYS A 54 135.664 1.937 9.800 1.00 0.00 H new ATOM 0 HD3 LYS A 54 136.361 2.929 8.535 1.00 0.00 H new ATOM 0 HE2 LYS A 54 138.648 1.955 9.118 1.00 0.00 H new ATOM 0 HE3 LYS A 54 137.853 0.876 10.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 138.244 0.330 7.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 137.038 -0.393 8.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 136.656 0.931 7.600 1.00 0.00 H new ATOM 856 N ASP A 55 134.428 7.450 9.498 1.00 0.00 N ATOM 857 CA ASP A 55 133.472 8.523 9.916 1.00 0.00 C ATOM 858 C ASP A 55 132.058 8.092 9.499 1.00 0.00 C ATOM 859 O ASP A 55 131.720 8.079 8.332 1.00 0.00 O ATOM 860 CB ASP A 55 133.843 9.843 9.231 1.00 0.00 C ATOM 861 CG ASP A 55 135.032 10.480 9.955 1.00 0.00 C ATOM 862 OD1 ASP A 55 135.052 10.432 11.175 1.00 0.00 O ATOM 863 OD2 ASP A 55 135.902 11.003 9.278 1.00 0.00 O ATOM 0 H ASP A 55 135.088 7.706 8.764 1.00 0.00 H new ATOM 0 HA ASP A 55 133.515 8.670 10.995 1.00 0.00 H new ATOM 0 HB2 ASP A 55 134.094 9.664 8.186 1.00 0.00 H new ATOM 0 HB3 ASP A 55 132.991 10.522 9.242 1.00 0.00 H new ATOM 868 N GLU A 56 131.245 7.707 10.448 1.00 0.00 N ATOM 869 CA GLU A 56 129.860 7.233 10.134 1.00 0.00 C ATOM 870 C GLU A 56 128.995 8.331 9.500 1.00 0.00 C ATOM 871 O GLU A 56 128.227 8.075 8.598 1.00 0.00 O ATOM 872 CB GLU A 56 129.193 6.770 11.434 1.00 0.00 C ATOM 873 CG GLU A 56 127.778 6.259 11.142 1.00 0.00 C ATOM 874 CD GLU A 56 127.180 5.660 12.416 1.00 0.00 C ATOM 875 OE1 GLU A 56 127.867 5.654 13.424 1.00 0.00 O ATOM 876 OE2 GLU A 56 126.043 5.219 12.363 1.00 0.00 O ATOM 0 H GLU A 56 131.483 7.700 11.440 1.00 0.00 H new ATOM 0 HA GLU A 56 129.942 6.418 9.414 1.00 0.00 H new ATOM 0 HB2 GLU A 56 129.786 5.980 11.896 1.00 0.00 H new ATOM 0 HB3 GLU A 56 129.151 7.595 12.145 1.00 0.00 H new ATOM 0 HG2 GLU A 56 127.152 7.076 10.782 1.00 0.00 H new ATOM 0 HG3 GLU A 56 127.807 5.508 10.353 1.00 0.00 H new ATOM 883 N ASP A 57 129.088 9.540 9.972 1.00 0.00 N ATOM 884 CA ASP A 57 128.238 10.631 9.404 1.00 0.00 C ATOM 885 C ASP A 57 128.694 10.963 7.985 1.00 0.00 C ATOM 886 O ASP A 57 127.892 11.207 7.105 1.00 0.00 O ATOM 887 CB ASP A 57 128.365 11.874 10.286 1.00 0.00 C ATOM 888 CG ASP A 57 127.672 11.619 11.624 1.00 0.00 C ATOM 889 OD1 ASP A 57 126.863 10.710 11.686 1.00 0.00 O ATOM 890 OD2 ASP A 57 127.964 12.337 12.567 1.00 0.00 O ATOM 0 H ASP A 57 129.714 9.824 10.726 1.00 0.00 H new ATOM 0 HA ASP A 57 127.199 10.303 9.374 1.00 0.00 H new ATOM 0 HB2 ASP A 57 129.416 12.113 10.448 1.00 0.00 H new ATOM 0 HB3 ASP A 57 127.916 12.734 9.789 1.00 0.00 H new ATOM 895 N LEU A 58 129.964 10.969 7.758 1.00 0.00 N ATOM 896 CA LEU A 58 130.450 11.281 6.388 1.00 0.00 C ATOM 897 C LEU A 58 130.096 10.121 5.457 1.00 0.00 C ATOM 898 O LEU A 58 129.704 10.320 4.325 1.00 0.00 O ATOM 899 CB LEU A 58 131.967 11.499 6.396 1.00 0.00 C ATOM 900 CG LEU A 58 132.308 12.812 7.119 1.00 0.00 C ATOM 901 CD1 LEU A 58 133.830 12.922 7.268 1.00 0.00 C ATOM 902 CD2 LEU A 58 131.776 14.024 6.320 1.00 0.00 C ATOM 0 H LEU A 58 130.688 10.774 8.450 1.00 0.00 H new ATOM 0 HA LEU A 58 129.973 12.196 6.036 1.00 0.00 H new ATOM 0 HB2 LEU A 58 132.460 10.663 6.892 1.00 0.00 H new ATOM 0 HB3 LEU A 58 132.343 11.529 5.373 1.00 0.00 H new ATOM 0 HG LEU A 58 131.837 12.810 8.102 1.00 0.00 H new ATOM 0 HD11 LEU A 58 134.079 13.851 7.780 1.00 0.00 H new ATOM 0 HD12 LEU A 58 134.201 12.077 7.848 1.00 0.00 H new ATOM 0 HD13 LEU A 58 134.294 12.916 6.281 1.00 0.00 H new ATOM 0 HD21 LEU A 58 132.026 14.945 6.846 1.00 0.00 H new ATOM 0 HD22 LEU A 58 132.233 14.036 5.330 1.00 0.00 H new ATOM 0 HD23 LEU A 58 130.693 13.946 6.219 1.00 0.00 H new ATOM 914 N PHE A 59 130.207 8.912 5.930 1.00 0.00 N ATOM 915 CA PHE A 59 129.849 7.747 5.076 1.00 0.00 C ATOM 916 C PHE A 59 128.359 7.792 4.728 1.00 0.00 C ATOM 917 O PHE A 59 127.972 7.644 3.586 1.00 0.00 O ATOM 918 CB PHE A 59 130.165 6.448 5.824 1.00 0.00 C ATOM 919 CG PHE A 59 129.691 5.264 5.009 1.00 0.00 C ATOM 920 CD1 PHE A 59 130.411 4.861 3.878 1.00 0.00 C ATOM 921 CD2 PHE A 59 128.535 4.567 5.388 1.00 0.00 C ATOM 922 CE1 PHE A 59 129.977 3.763 3.125 1.00 0.00 C ATOM 923 CE2 PHE A 59 128.100 3.470 4.635 1.00 0.00 C ATOM 924 CZ PHE A 59 128.821 3.067 3.503 1.00 0.00 C ATOM 0 H PHE A 59 130.530 8.680 6.870 1.00 0.00 H new ATOM 0 HA PHE A 59 130.430 7.786 4.155 1.00 0.00 H new ATOM 0 HB2 PHE A 59 131.237 6.372 6.004 1.00 0.00 H new ATOM 0 HB3 PHE A 59 129.677 6.450 6.799 1.00 0.00 H new ATOM 0 HD1 PHE A 59 131.302 5.397 3.586 1.00 0.00 H new ATOM 0 HD2 PHE A 59 127.980 4.877 6.261 1.00 0.00 H new ATOM 0 HE1 PHE A 59 130.533 3.453 2.253 1.00 0.00 H new ATOM 0 HE2 PHE A 59 127.209 2.934 4.927 1.00 0.00 H new ATOM 0 HZ PHE A 59 128.486 2.220 2.922 1.00 0.00 H new ATOM 934 N ARG A 60 127.519 7.961 5.716 1.00 0.00 N ATOM 935 CA ARG A 60 126.053 7.979 5.453 1.00 0.00 C ATOM 936 C ARG A 60 125.681 9.130 4.517 1.00 0.00 C ATOM 937 O ARG A 60 124.928 8.954 3.579 1.00 0.00 O ATOM 938 CB ARG A 60 125.299 8.143 6.774 1.00 0.00 C ATOM 939 CG ARG A 60 125.453 6.874 7.616 1.00 0.00 C ATOM 940 CD ARG A 60 124.633 7.015 8.898 1.00 0.00 C ATOM 941 NE ARG A 60 125.075 8.225 9.644 1.00 0.00 N ATOM 942 CZ ARG A 60 124.312 8.727 10.575 1.00 0.00 C ATOM 943 NH1 ARG A 60 123.172 8.160 10.861 1.00 0.00 N ATOM 944 NH2 ARG A 60 124.687 9.797 11.219 1.00 0.00 N ATOM 0 H ARG A 60 127.786 8.087 6.692 1.00 0.00 H new ATOM 0 HA ARG A 60 125.777 7.038 4.978 1.00 0.00 H new ATOM 0 HB2 ARG A 60 125.686 9.003 7.321 1.00 0.00 H new ATOM 0 HB3 ARG A 60 124.244 8.337 6.580 1.00 0.00 H new ATOM 0 HG2 ARG A 60 125.117 6.005 7.050 1.00 0.00 H new ATOM 0 HG3 ARG A 60 126.503 6.710 7.859 1.00 0.00 H new ATOM 0 HD2 ARG A 60 123.573 7.091 8.657 1.00 0.00 H new ATOM 0 HD3 ARG A 60 124.755 6.128 9.519 1.00 0.00 H new ATOM 0 HE ARG A 60 125.972 8.660 9.428 1.00 0.00 H new ATOM 0 HH11 ARG A 60 122.877 7.324 10.356 1.00 0.00 H new ATOM 0 HH12 ARG A 60 122.576 8.553 11.589 1.00 0.00 H new ATOM 0 HH21 ARG A 60 125.577 10.242 10.995 1.00 0.00 H new ATOM 0 HH22 ARG A 60 124.090 10.189 11.947 1.00 0.00 H new ATOM 958 N GLU A 61 126.194 10.307 4.754 1.00 0.00 N ATOM 959 CA GLU A 61 125.858 11.455 3.867 1.00 0.00 C ATOM 960 C GLU A 61 126.362 11.153 2.456 1.00 0.00 C ATOM 961 O GLU A 61 125.733 11.495 1.473 1.00 0.00 O ATOM 962 CB GLU A 61 126.534 12.723 4.405 1.00 0.00 C ATOM 963 CG GLU A 61 126.201 13.919 3.507 1.00 0.00 C ATOM 964 CD GLU A 61 126.883 15.173 4.058 1.00 0.00 C ATOM 965 OE1 GLU A 61 127.398 15.107 5.161 1.00 0.00 O ATOM 966 OE2 GLU A 61 126.874 16.180 3.367 1.00 0.00 O ATOM 0 H GLU A 61 126.830 10.522 5.522 1.00 0.00 H new ATOM 0 HA GLU A 61 124.779 11.609 3.842 1.00 0.00 H new ATOM 0 HB2 GLU A 61 126.199 12.919 5.424 1.00 0.00 H new ATOM 0 HB3 GLU A 61 127.614 12.579 4.447 1.00 0.00 H new ATOM 0 HG2 GLU A 61 126.536 13.727 2.488 1.00 0.00 H new ATOM 0 HG3 GLU A 61 125.122 14.067 3.465 1.00 0.00 H new ATOM 973 N TRP A 62 127.488 10.513 2.349 1.00 0.00 N ATOM 974 CA TRP A 62 128.036 10.182 1.004 1.00 0.00 C ATOM 975 C TRP A 62 127.106 9.223 0.255 1.00 0.00 C ATOM 976 O TRP A 62 126.820 9.403 -0.910 1.00 0.00 O ATOM 977 CB TRP A 62 129.408 9.516 1.176 1.00 0.00 C ATOM 978 CG TRP A 62 129.868 8.934 -0.129 1.00 0.00 C ATOM 979 CD1 TRP A 62 130.498 9.616 -1.112 1.00 0.00 C ATOM 980 CD2 TRP A 62 129.725 7.563 -0.608 1.00 0.00 C ATOM 981 NE1 TRP A 62 130.763 8.749 -2.159 1.00 0.00 N ATOM 982 CE2 TRP A 62 130.304 7.472 -1.894 1.00 0.00 C ATOM 983 CE3 TRP A 62 129.158 6.399 -0.050 1.00 0.00 C ATOM 984 CZ2 TRP A 62 130.321 6.269 -2.606 1.00 0.00 C ATOM 985 CZ3 TRP A 62 129.175 5.189 -0.764 1.00 0.00 C ATOM 986 CH2 TRP A 62 129.755 5.125 -2.038 1.00 0.00 C ATOM 0 H TRP A 62 128.057 10.202 3.137 1.00 0.00 H new ATOM 0 HA TRP A 62 128.125 11.102 0.426 1.00 0.00 H new ATOM 0 HB2 TRP A 62 130.133 10.247 1.532 1.00 0.00 H new ATOM 0 HB3 TRP A 62 129.348 8.732 1.931 1.00 0.00 H new ATOM 0 HD1 TRP A 62 130.753 10.665 -1.085 1.00 0.00 H new ATOM 0 HE1 TRP A 62 131.238 9.019 -3.020 1.00 0.00 H new ATOM 0 HE3 TRP A 62 128.708 6.438 0.931 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 130.768 6.224 -3.588 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 128.738 4.303 -0.328 1.00 0.00 H new ATOM 0 HH2 TRP A 62 129.764 4.191 -2.581 1.00 0.00 H new ATOM 997 N LEU A 63 126.653 8.195 0.908 1.00 0.00 N ATOM 998 CA LEU A 63 125.769 7.207 0.229 1.00 0.00 C ATOM 999 C LEU A 63 124.399 7.819 -0.090 1.00 0.00 C ATOM 1000 O LEU A 63 123.896 7.691 -1.188 1.00 0.00 O ATOM 1001 CB LEU A 63 125.598 5.996 1.155 1.00 0.00 C ATOM 1002 CG LEU A 63 124.693 4.939 0.510 1.00 0.00 C ATOM 1003 CD1 LEU A 63 125.309 4.439 -0.806 1.00 0.00 C ATOM 1004 CD2 LEU A 63 124.532 3.766 1.483 1.00 0.00 C ATOM 0 H LEU A 63 126.856 7.993 1.887 1.00 0.00 H new ATOM 0 HA LEU A 63 126.224 6.905 -0.714 1.00 0.00 H new ATOM 0 HB2 LEU A 63 126.573 5.561 1.375 1.00 0.00 H new ATOM 0 HB3 LEU A 63 125.170 6.317 2.105 1.00 0.00 H new ATOM 0 HG LEU A 63 123.720 5.380 0.291 1.00 0.00 H new ATOM 0 HD11 LEU A 63 124.655 3.689 -1.252 1.00 0.00 H new ATOM 0 HD12 LEU A 63 125.424 5.276 -1.495 1.00 0.00 H new ATOM 0 HD13 LEU A 63 126.285 3.997 -0.606 1.00 0.00 H new ATOM 0 HD21 LEU A 63 123.890 3.007 1.035 1.00 0.00 H new ATOM 0 HD22 LEU A 63 125.510 3.334 1.697 1.00 0.00 H new ATOM 0 HD23 LEU A 63 124.082 4.121 2.410 1.00 0.00 H new ATOM 1016 N LYS A 64 123.784 8.463 0.860 1.00 0.00 N ATOM 1017 CA LYS A 64 122.439 9.062 0.611 1.00 0.00 C ATOM 1018 C LYS A 64 122.516 10.115 -0.496 1.00 0.00 C ATOM 1019 O LYS A 64 121.726 10.117 -1.419 1.00 0.00 O ATOM 1020 CB LYS A 64 121.909 9.698 1.899 1.00 0.00 C ATOM 1021 CG LYS A 64 120.488 10.221 1.666 1.00 0.00 C ATOM 1022 CD LYS A 64 119.958 10.844 2.956 1.00 0.00 C ATOM 1023 CE LYS A 64 118.551 11.398 2.717 1.00 0.00 C ATOM 1024 NZ LYS A 64 118.644 12.659 1.927 1.00 0.00 N ATOM 0 H LYS A 64 124.153 8.602 1.801 1.00 0.00 H new ATOM 0 HA LYS A 64 121.759 8.272 0.291 1.00 0.00 H new ATOM 0 HB2 LYS A 64 121.910 8.965 2.706 1.00 0.00 H new ATOM 0 HB3 LYS A 64 122.562 10.514 2.209 1.00 0.00 H new ATOM 0 HG2 LYS A 64 120.488 10.961 0.865 1.00 0.00 H new ATOM 0 HG3 LYS A 64 119.837 9.407 1.348 1.00 0.00 H new ATOM 0 HD2 LYS A 64 119.936 10.098 3.750 1.00 0.00 H new ATOM 0 HD3 LYS A 64 120.623 11.642 3.287 1.00 0.00 H new ATOM 0 HE2 LYS A 64 117.945 10.665 2.184 1.00 0.00 H new ATOM 0 HE3 LYS A 64 118.056 11.588 3.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 117.728 13.151 1.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 119.377 13.272 2.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 118.892 12.434 0.942 1.00 0.00 H new ATOM 1038 N ASP A 65 123.452 11.015 -0.405 1.00 0.00 N ATOM 1039 CA ASP A 65 123.569 12.076 -1.443 1.00 0.00 C ATOM 1040 C ASP A 65 124.054 11.469 -2.759 1.00 0.00 C ATOM 1041 O ASP A 65 123.808 11.999 -3.824 1.00 0.00 O ATOM 1042 CB ASP A 65 124.559 13.145 -0.975 1.00 0.00 C ATOM 1043 CG ASP A 65 123.947 13.933 0.183 1.00 0.00 C ATOM 1044 OD1 ASP A 65 122.759 14.207 0.124 1.00 0.00 O ATOM 1045 OD2 ASP A 65 124.676 14.251 1.110 1.00 0.00 O ATOM 0 H ASP A 65 124.143 11.063 0.344 1.00 0.00 H new ATOM 0 HA ASP A 65 122.591 12.530 -1.600 1.00 0.00 H new ATOM 0 HB2 ASP A 65 125.492 12.679 -0.659 1.00 0.00 H new ATOM 0 HB3 ASP A 65 124.802 13.817 -1.798 1.00 0.00 H new ATOM 1050 N THR A 66 124.763 10.372 -2.698 1.00 0.00 N ATOM 1051 CA THR A 66 125.286 9.754 -3.948 1.00 0.00 C ATOM 1052 C THR A 66 124.200 8.933 -4.647 1.00 0.00 C ATOM 1053 O THR A 66 124.186 8.853 -5.859 1.00 0.00 O ATOM 1054 CB THR A 66 126.478 8.851 -3.607 1.00 0.00 C ATOM 1055 OG1 THR A 66 127.543 9.652 -3.117 1.00 0.00 O ATOM 1056 CG2 THR A 66 126.945 8.104 -4.858 1.00 0.00 C ATOM 0 H THR A 66 125.001 9.879 -1.837 1.00 0.00 H new ATOM 0 HA THR A 66 125.603 10.548 -4.624 1.00 0.00 H new ATOM 0 HB THR A 66 126.175 8.127 -2.850 1.00 0.00 H new ATOM 0 HG1 THR A 66 127.478 9.722 -2.142 1.00 0.00 H new ATOM 0 HG21 THR A 66 127.792 7.466 -4.606 1.00 0.00 H new ATOM 0 HG22 THR A 66 126.129 7.491 -5.241 1.00 0.00 H new ATOM 0 HG23 THR A 66 127.247 8.823 -5.620 1.00 0.00 H new ATOM 1064 N CYS A 67 123.307 8.291 -3.921 1.00 0.00 N ATOM 1065 CA CYS A 67 122.259 7.446 -4.586 1.00 0.00 C ATOM 1066 C CYS A 67 120.858 7.765 -4.059 1.00 0.00 C ATOM 1067 O CYS A 67 119.881 7.655 -4.773 1.00 0.00 O ATOM 1068 CB CYS A 67 122.564 5.975 -4.304 1.00 0.00 C ATOM 1069 SG CYS A 67 122.402 5.658 -2.529 1.00 0.00 S ATOM 0 H CYS A 67 123.260 8.316 -2.902 1.00 0.00 H new ATOM 0 HA CYS A 67 122.279 7.656 -5.655 1.00 0.00 H new ATOM 0 HB2 CYS A 67 121.880 5.337 -4.863 1.00 0.00 H new ATOM 0 HB3 CYS A 67 123.572 5.731 -4.638 1.00 0.00 H new ATOM 0 HG CYS A 67 123.314 6.323 -1.884 1.00 0.00 H new ATOM 1075 N GLY A 68 120.748 8.146 -2.807 1.00 0.00 N ATOM 1076 CA GLY A 68 119.406 8.459 -2.216 1.00 0.00 C ATOM 1077 C GLY A 68 119.016 7.347 -1.237 1.00 0.00 C ATOM 1078 O GLY A 68 117.869 7.222 -0.854 1.00 0.00 O ATOM 0 H GLY A 68 121.534 8.254 -2.166 1.00 0.00 H new ATOM 0 HA2 GLY A 68 119.437 9.419 -1.701 1.00 0.00 H new ATOM 0 HA3 GLY A 68 118.659 8.544 -3.005 1.00 0.00 H new ATOM 1082 N ALA A 69 119.957 6.536 -0.829 1.00 0.00 N ATOM 1083 CA ALA A 69 119.634 5.434 0.125 1.00 0.00 C ATOM 1084 C ALA A 69 118.884 6.002 1.331 1.00 0.00 C ATOM 1085 O ALA A 69 119.035 7.155 1.680 1.00 0.00 O ATOM 1086 CB ALA A 69 120.930 4.770 0.598 1.00 0.00 C ATOM 0 H ALA A 69 120.935 6.589 -1.115 1.00 0.00 H new ATOM 0 HA ALA A 69 119.008 4.695 -0.376 1.00 0.00 H new ATOM 0 HB1 ALA A 69 120.694 3.966 1.294 1.00 0.00 H new ATOM 0 HB2 ALA A 69 121.464 4.362 -0.260 1.00 0.00 H new ATOM 0 HB3 ALA A 69 121.557 5.509 1.097 1.00 0.00 H new ATOM 1092 N ASN A 70 118.069 5.201 1.969 1.00 0.00 N ATOM 1093 CA ASN A 70 117.297 5.696 3.148 1.00 0.00 C ATOM 1094 C ASN A 70 118.066 5.412 4.440 1.00 0.00 C ATOM 1095 O ASN A 70 119.086 4.751 4.443 1.00 0.00 O ATOM 1096 CB ASN A 70 115.940 4.989 3.193 1.00 0.00 C ATOM 1097 CG ASN A 70 115.071 5.494 2.040 1.00 0.00 C ATOM 1098 OD1 ASN A 70 115.304 6.565 1.513 1.00 0.00 O ATOM 1099 ND2 ASN A 70 114.072 4.767 1.622 1.00 0.00 N ATOM 0 H ASN A 70 117.905 4.225 1.724 1.00 0.00 H new ATOM 0 HA ASN A 70 117.151 6.772 3.055 1.00 0.00 H new ATOM 0 HB2 ASN A 70 116.076 3.910 3.116 1.00 0.00 H new ATOM 0 HB3 ASN A 70 115.448 5.181 4.146 1.00 0.00 H new ATOM 0 HD21 ASN A 70 113.487 5.097 0.854 1.00 0.00 H new ATOM 0 HD22 ASN A 70 113.875 3.869 2.063 1.00 0.00 H new ATOM 1106 N ALA A 71 117.587 5.930 5.538 1.00 0.00 N ATOM 1107 CA ALA A 71 118.280 5.727 6.841 1.00 0.00 C ATOM 1108 C ALA A 71 118.372 4.236 7.184 1.00 0.00 C ATOM 1109 O ALA A 71 119.339 3.795 7.767 1.00 0.00 O ATOM 1110 CB ALA A 71 117.507 6.449 7.945 1.00 0.00 C ATOM 0 H ALA A 71 116.736 6.491 5.588 1.00 0.00 H new ATOM 0 HA ALA A 71 119.289 6.131 6.762 1.00 0.00 H new ATOM 0 HB1 ALA A 71 118.013 6.302 8.899 1.00 0.00 H new ATOM 0 HB2 ALA A 71 117.461 7.514 7.720 1.00 0.00 H new ATOM 0 HB3 ALA A 71 116.496 6.046 8.004 1.00 0.00 H new ATOM 1116 N LYS A 72 117.382 3.455 6.851 1.00 0.00 N ATOM 1117 CA LYS A 72 117.454 2.004 7.200 1.00 0.00 C ATOM 1118 C LYS A 72 118.510 1.309 6.339 1.00 0.00 C ATOM 1119 O LYS A 72 119.257 0.472 6.809 1.00 0.00 O ATOM 1120 CB LYS A 72 116.089 1.354 6.962 1.00 0.00 C ATOM 1121 CG LYS A 72 115.092 1.861 8.010 1.00 0.00 C ATOM 1122 CD LYS A 72 113.682 1.323 7.711 1.00 0.00 C ATOM 1123 CE LYS A 72 113.531 -0.102 8.256 1.00 0.00 C ATOM 1124 NZ LYS A 72 113.742 -0.094 9.732 1.00 0.00 N ATOM 0 H LYS A 72 116.538 3.750 6.360 1.00 0.00 H new ATOM 0 HA LYS A 72 117.729 1.902 8.250 1.00 0.00 H new ATOM 0 HB2 LYS A 72 115.731 1.591 5.960 1.00 0.00 H new ATOM 0 HB3 LYS A 72 116.176 0.269 7.022 1.00 0.00 H new ATOM 0 HG2 LYS A 72 115.406 1.543 9.004 1.00 0.00 H new ATOM 0 HG3 LYS A 72 115.080 2.951 8.013 1.00 0.00 H new ATOM 0 HD2 LYS A 72 112.933 1.974 8.163 1.00 0.00 H new ATOM 0 HD3 LYS A 72 113.503 1.330 6.636 1.00 0.00 H new ATOM 0 HE2 LYS A 72 112.539 -0.489 8.022 1.00 0.00 H new ATOM 0 HE3 LYS A 72 114.253 -0.764 7.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 112.996 -0.654 10.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 114.671 -0.507 9.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 113.706 0.884 10.083 1.00 0.00 H new ATOM 1138 N GLN A 73 118.568 1.638 5.080 1.00 0.00 N ATOM 1139 CA GLN A 73 119.558 0.989 4.179 1.00 0.00 C ATOM 1140 C GLN A 73 120.976 1.384 4.578 1.00 0.00 C ATOM 1141 O GLN A 73 121.887 0.580 4.551 1.00 0.00 O ATOM 1142 CB GLN A 73 119.293 1.422 2.735 1.00 0.00 C ATOM 1143 CG GLN A 73 117.989 0.791 2.243 1.00 0.00 C ATOM 1144 CD GLN A 73 117.609 1.393 0.888 1.00 0.00 C ATOM 1145 OE1 GLN A 73 117.900 2.542 0.617 1.00 0.00 O ATOM 1146 NE2 GLN A 73 116.964 0.661 0.020 1.00 0.00 N ATOM 0 H GLN A 73 117.969 2.333 4.634 1.00 0.00 H new ATOM 0 HA GLN A 73 119.457 -0.093 4.263 1.00 0.00 H new ATOM 0 HB2 GLN A 73 119.228 2.508 2.676 1.00 0.00 H new ATOM 0 HB3 GLN A 73 120.121 1.117 2.095 1.00 0.00 H new ATOM 0 HG2 GLN A 73 118.107 -0.289 2.153 1.00 0.00 H new ATOM 0 HG3 GLN A 73 117.193 0.966 2.966 1.00 0.00 H new ATOM 0 HE21 GLN A 73 116.720 -0.303 0.247 1.00 0.00 H new ATOM 0 HE22 GLN A 73 116.704 1.053 -0.885 1.00 0.00 H new ATOM 1155 N SER A 74 121.175 2.621 4.934 1.00 0.00 N ATOM 1156 CA SER A 74 122.533 3.077 5.322 1.00 0.00 C ATOM 1157 C SER A 74 123.005 2.353 6.588 1.00 0.00 C ATOM 1158 O SER A 74 124.161 2.000 6.707 1.00 0.00 O ATOM 1159 CB SER A 74 122.506 4.582 5.566 1.00 0.00 C ATOM 1160 OG SER A 74 122.132 5.245 4.366 1.00 0.00 O ATOM 0 H SER A 74 120.450 3.338 4.972 1.00 0.00 H new ATOM 0 HA SER A 74 123.229 2.846 4.515 1.00 0.00 H new ATOM 0 HB2 SER A 74 121.801 4.820 6.362 1.00 0.00 H new ATOM 0 HB3 SER A 74 123.486 4.926 5.895 1.00 0.00 H new ATOM 0 HG SER A 74 121.165 5.161 4.234 1.00 0.00 H new ATOM 1166 N ARG A 75 122.135 2.132 7.545 1.00 0.00 N ATOM 1167 CA ARG A 75 122.569 1.437 8.794 1.00 0.00 C ATOM 1168 C ARG A 75 123.101 0.050 8.449 1.00 0.00 C ATOM 1169 O ARG A 75 124.050 -0.418 9.049 1.00 0.00 O ATOM 1170 CB ARG A 75 121.383 1.291 9.753 1.00 0.00 C ATOM 1171 CG ARG A 75 120.990 2.652 10.329 1.00 0.00 C ATOM 1172 CD ARG A 75 119.735 2.484 11.190 1.00 0.00 C ATOM 1173 NE ARG A 75 120.031 1.528 12.298 1.00 0.00 N ATOM 1174 CZ ARG A 75 119.183 1.375 13.280 1.00 0.00 C ATOM 1175 NH1 ARG A 75 118.045 2.013 13.266 1.00 0.00 N ATOM 1176 NH2 ARG A 75 119.466 0.569 14.266 1.00 0.00 N ATOM 0 H ARG A 75 121.152 2.401 7.514 1.00 0.00 H new ATOM 0 HA ARG A 75 123.352 2.027 9.271 1.00 0.00 H new ATOM 0 HB2 ARG A 75 120.534 0.853 9.227 1.00 0.00 H new ATOM 0 HB3 ARG A 75 121.644 0.609 10.562 1.00 0.00 H new ATOM 0 HG2 ARG A 75 121.806 3.058 10.927 1.00 0.00 H new ATOM 0 HG3 ARG A 75 120.802 3.362 9.524 1.00 0.00 H new ATOM 0 HD2 ARG A 75 119.425 3.447 11.596 1.00 0.00 H new ATOM 0 HD3 ARG A 75 118.909 2.113 10.583 1.00 0.00 H new ATOM 0 HE ARG A 75 120.899 0.992 12.288 1.00 0.00 H new ATOM 0 HH11 ARG A 75 117.817 2.632 12.488 1.00 0.00 H new ATOM 0 HH12 ARG A 75 117.384 1.893 14.033 1.00 0.00 H new ATOM 0 HH21 ARG A 75 120.349 0.059 14.270 1.00 0.00 H new ATOM 0 HH22 ARG A 75 118.804 0.449 15.033 1.00 0.00 H new ATOM 1190 N ASP A 76 122.501 -0.631 7.514 1.00 0.00 N ATOM 1191 CA ASP A 76 122.966 -2.000 7.164 1.00 0.00 C ATOM 1192 C ASP A 76 124.348 -1.950 6.512 1.00 0.00 C ATOM 1193 O ASP A 76 125.184 -2.796 6.760 1.00 0.00 O ATOM 1194 CB ASP A 76 121.968 -2.636 6.198 1.00 0.00 C ATOM 1195 CG ASP A 76 120.666 -2.942 6.940 1.00 0.00 C ATOM 1196 OD1 ASP A 76 120.740 -3.275 8.111 1.00 0.00 O ATOM 1197 OD2 ASP A 76 119.617 -2.831 6.327 1.00 0.00 O ATOM 0 H ASP A 76 121.703 -0.295 6.974 1.00 0.00 H new ATOM 0 HA ASP A 76 123.035 -2.594 8.075 1.00 0.00 H new ATOM 0 HB2 ASP A 76 121.774 -1.963 5.363 1.00 0.00 H new ATOM 0 HB3 ASP A 76 122.384 -3.552 5.779 1.00 0.00 H new ATOM 1202 N CYS A 77 124.605 -0.978 5.683 1.00 0.00 N ATOM 1203 CA CYS A 77 125.940 -0.901 5.029 1.00 0.00 C ATOM 1204 C CYS A 77 127.029 -0.600 6.065 1.00 0.00 C ATOM 1205 O CYS A 77 128.119 -1.131 5.989 1.00 0.00 O ATOM 1206 CB CYS A 77 125.928 0.205 3.973 1.00 0.00 C ATOM 1207 SG CYS A 77 124.907 -0.311 2.570 1.00 0.00 S ATOM 0 H CYS A 77 123.952 -0.237 5.431 1.00 0.00 H new ATOM 0 HA CYS A 77 126.155 -1.861 4.559 1.00 0.00 H new ATOM 0 HB2 CYS A 77 125.536 1.127 4.402 1.00 0.00 H new ATOM 0 HB3 CYS A 77 126.944 0.415 3.639 1.00 0.00 H new ATOM 0 HG CYS A 77 125.054 -1.587 2.372 1.00 0.00 H new ATOM 1213 N PHE A 78 126.775 0.260 7.016 1.00 0.00 N ATOM 1214 CA PHE A 78 127.848 0.576 8.001 1.00 0.00 C ATOM 1215 C PHE A 78 128.292 -0.698 8.717 1.00 0.00 C ATOM 1216 O PHE A 78 129.443 -1.083 8.660 1.00 0.00 O ATOM 1217 CB PHE A 78 127.335 1.589 9.028 1.00 0.00 C ATOM 1218 CG PHE A 78 128.440 1.900 10.008 1.00 0.00 C ATOM 1219 CD1 PHE A 78 129.328 2.950 9.746 1.00 0.00 C ATOM 1220 CD2 PHE A 78 128.579 1.142 11.178 1.00 0.00 C ATOM 1221 CE1 PHE A 78 130.356 3.243 10.651 1.00 0.00 C ATOM 1222 CE2 PHE A 78 129.606 1.436 12.084 1.00 0.00 C ATOM 1223 CZ PHE A 78 130.495 2.485 11.820 1.00 0.00 C ATOM 0 H PHE A 78 125.890 0.748 7.152 1.00 0.00 H new ATOM 0 HA PHE A 78 128.698 1.003 7.469 1.00 0.00 H new ATOM 0 HB2 PHE A 78 127.009 2.500 8.527 1.00 0.00 H new ATOM 0 HB3 PHE A 78 126.469 1.187 9.553 1.00 0.00 H new ATOM 0 HD1 PHE A 78 129.220 3.535 8.845 1.00 0.00 H new ATOM 0 HD2 PHE A 78 127.895 0.332 11.381 1.00 0.00 H new ATOM 0 HE1 PHE A 78 131.041 4.053 10.447 1.00 0.00 H new ATOM 0 HE2 PHE A 78 129.712 0.853 12.987 1.00 0.00 H new ATOM 0 HZ PHE A 78 131.288 2.709 12.518 1.00 0.00 H new ATOM 1233 N GLY A 79 127.394 -1.353 9.398 1.00 0.00 N ATOM 1234 CA GLY A 79 127.771 -2.599 10.127 1.00 0.00 C ATOM 1235 C GLY A 79 128.306 -3.642 9.141 1.00 0.00 C ATOM 1236 O GLY A 79 129.155 -4.444 9.470 1.00 0.00 O ATOM 0 H GLY A 79 126.415 -1.081 9.482 1.00 0.00 H new ATOM 0 HA2 GLY A 79 128.528 -2.375 10.879 1.00 0.00 H new ATOM 0 HA3 GLY A 79 126.905 -2.997 10.656 1.00 0.00 H new ATOM 1240 N CYS A 80 127.816 -3.637 7.938 1.00 0.00 N ATOM 1241 CA CYS A 80 128.301 -4.630 6.941 1.00 0.00 C ATOM 1242 C CYS A 80 129.742 -4.304 6.539 1.00 0.00 C ATOM 1243 O CYS A 80 130.609 -5.155 6.573 1.00 0.00 O ATOM 1244 CB CYS A 80 127.404 -4.580 5.705 1.00 0.00 C ATOM 1245 SG CYS A 80 127.866 -5.909 4.564 1.00 0.00 S ATOM 0 H CYS A 80 127.102 -2.991 7.600 1.00 0.00 H new ATOM 0 HA CYS A 80 128.270 -5.627 7.380 1.00 0.00 H new ATOM 0 HB2 CYS A 80 126.359 -4.685 5.997 1.00 0.00 H new ATOM 0 HB3 CYS A 80 127.502 -3.613 5.211 1.00 0.00 H new ATOM 0 HG CYS A 80 129.103 -6.251 4.774 1.00 0.00 H new ATOM 1251 N LEU A 81 130.015 -3.080 6.178 1.00 0.00 N ATOM 1252 CA LEU A 81 131.416 -2.731 5.803 1.00 0.00 C ATOM 1253 C LEU A 81 132.293 -2.713 7.061 1.00 0.00 C ATOM 1254 O LEU A 81 133.422 -3.163 7.050 1.00 0.00 O ATOM 1255 CB LEU A 81 131.443 -1.338 5.168 1.00 0.00 C ATOM 1256 CG LEU A 81 130.582 -1.310 3.901 1.00 0.00 C ATOM 1257 CD1 LEU A 81 130.542 0.121 3.359 1.00 0.00 C ATOM 1258 CD2 LEU A 81 131.174 -2.250 2.836 1.00 0.00 C ATOM 0 H LEU A 81 129.341 -2.316 6.126 1.00 0.00 H new ATOM 0 HA LEU A 81 131.792 -3.471 5.096 1.00 0.00 H new ATOM 0 HB2 LEU A 81 131.076 -0.600 5.881 1.00 0.00 H new ATOM 0 HB3 LEU A 81 132.469 -1.063 4.924 1.00 0.00 H new ATOM 0 HG LEU A 81 129.573 -1.645 4.141 1.00 0.00 H new ATOM 0 HD11 LEU A 81 129.931 0.151 2.457 1.00 0.00 H new ATOM 0 HD12 LEU A 81 130.112 0.783 4.111 1.00 0.00 H new ATOM 0 HD13 LEU A 81 131.554 0.449 3.123 1.00 0.00 H new ATOM 0 HD21 LEU A 81 130.554 -2.222 1.940 1.00 0.00 H new ATOM 0 HD22 LEU A 81 132.185 -1.927 2.587 1.00 0.00 H new ATOM 0 HD23 LEU A 81 131.203 -3.268 3.225 1.00 0.00 H new ATOM 1270 N ARG A 82 131.785 -2.177 8.139 1.00 0.00 N ATOM 1271 CA ARG A 82 132.586 -2.104 9.395 1.00 0.00 C ATOM 1272 C ARG A 82 132.952 -3.506 9.886 1.00 0.00 C ATOM 1273 O ARG A 82 134.054 -3.747 10.336 1.00 0.00 O ATOM 1274 CB ARG A 82 131.768 -1.368 10.465 1.00 0.00 C ATOM 1275 CG ARG A 82 132.502 -1.372 11.817 1.00 0.00 C ATOM 1276 CD ARG A 82 133.896 -0.756 11.669 1.00 0.00 C ATOM 1277 NE ARG A 82 134.428 -0.406 13.015 1.00 0.00 N ATOM 1278 CZ ARG A 82 135.696 -0.140 13.163 1.00 0.00 C ATOM 1279 NH1 ARG A 82 136.492 -0.166 12.130 1.00 0.00 N ATOM 1280 NH2 ARG A 82 136.169 0.155 14.343 1.00 0.00 N ATOM 0 H ARG A 82 130.846 -1.785 8.203 1.00 0.00 H new ATOM 0 HA ARG A 82 133.512 -1.563 9.199 1.00 0.00 H new ATOM 0 HB2 ARG A 82 131.588 -0.341 10.148 1.00 0.00 H new ATOM 0 HB3 ARG A 82 130.793 -1.844 10.574 1.00 0.00 H new ATOM 0 HG2 ARG A 82 131.926 -0.811 12.553 1.00 0.00 H new ATOM 0 HG3 ARG A 82 132.586 -2.393 12.189 1.00 0.00 H new ATOM 0 HD2 ARG A 82 134.565 -1.459 11.173 1.00 0.00 H new ATOM 0 HD3 ARG A 82 133.847 0.134 11.042 1.00 0.00 H new ATOM 0 HE ARG A 82 133.802 -0.374 13.820 1.00 0.00 H new ATOM 0 HH11 ARG A 82 136.123 -0.394 11.207 1.00 0.00 H new ATOM 0 HH12 ARG A 82 137.484 0.042 12.245 1.00 0.00 H new ATOM 0 HH21 ARG A 82 135.547 0.178 15.151 1.00 0.00 H new ATOM 0 HH22 ARG A 82 137.161 0.363 14.457 1.00 0.00 H new ATOM 1294 N GLU A 83 132.041 -4.431 9.804 1.00 0.00 N ATOM 1295 CA GLU A 83 132.341 -5.813 10.270 1.00 0.00 C ATOM 1296 C GLU A 83 133.336 -6.494 9.326 1.00 0.00 C ATOM 1297 O GLU A 83 134.207 -7.217 9.767 1.00 0.00 O ATOM 1298 CB GLU A 83 131.046 -6.626 10.350 1.00 0.00 C ATOM 1299 CG GLU A 83 130.204 -6.131 11.531 1.00 0.00 C ATOM 1300 CD GLU A 83 130.878 -6.536 12.845 1.00 0.00 C ATOM 1301 OE1 GLU A 83 131.790 -7.345 12.796 1.00 0.00 O ATOM 1302 OE2 GLU A 83 130.468 -6.032 13.878 1.00 0.00 O ATOM 0 H GLU A 83 131.101 -4.291 9.434 1.00 0.00 H new ATOM 0 HA GLU A 83 132.790 -5.759 11.262 1.00 0.00 H new ATOM 0 HB2 GLU A 83 130.484 -6.526 9.422 1.00 0.00 H new ATOM 0 HB3 GLU A 83 131.276 -7.685 10.472 1.00 0.00 H new ATOM 0 HG2 GLU A 83 130.095 -5.047 11.485 1.00 0.00 H new ATOM 0 HG3 GLU A 83 129.201 -6.555 11.479 1.00 0.00 H new ATOM 1309 N TRP A 84 133.252 -6.262 8.039 1.00 0.00 N ATOM 1310 CA TRP A 84 134.232 -6.895 7.111 1.00 0.00 C ATOM 1311 C TRP A 84 135.638 -6.422 7.492 1.00 0.00 C ATOM 1312 O TRP A 84 136.572 -7.194 7.570 1.00 0.00 O ATOM 1313 CB TRP A 84 133.927 -6.485 5.665 1.00 0.00 C ATOM 1314 CG TRP A 84 134.755 -7.315 4.734 1.00 0.00 C ATOM 1315 CD1 TRP A 84 134.382 -8.517 4.230 1.00 0.00 C ATOM 1316 CD2 TRP A 84 136.084 -7.040 4.194 1.00 0.00 C ATOM 1317 NE1 TRP A 84 135.399 -8.996 3.423 1.00 0.00 N ATOM 1318 CE2 TRP A 84 136.466 -8.124 3.370 1.00 0.00 C ATOM 1319 CE3 TRP A 84 136.987 -5.969 4.338 1.00 0.00 C ATOM 1320 CZ2 TRP A 84 137.698 -8.150 2.715 1.00 0.00 C ATOM 1321 CZ3 TRP A 84 138.229 -5.992 3.677 1.00 0.00 C ATOM 1322 CH2 TRP A 84 138.583 -7.083 2.870 1.00 0.00 C ATOM 0 H TRP A 84 132.552 -5.666 7.596 1.00 0.00 H new ATOM 0 HA TRP A 84 134.165 -7.980 7.189 1.00 0.00 H new ATOM 0 HB2 TRP A 84 132.867 -6.624 5.451 1.00 0.00 H new ATOM 0 HB3 TRP A 84 134.146 -5.427 5.520 1.00 0.00 H new ATOM 0 HD1 TRP A 84 133.446 -9.018 4.426 1.00 0.00 H new ATOM 0 HE1 TRP A 84 135.364 -9.887 2.927 1.00 0.00 H new ATOM 0 HE3 TRP A 84 136.725 -5.125 4.959 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 137.965 -8.991 2.092 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 138.914 -5.165 3.792 1.00 0.00 H new ATOM 0 HH2 TRP A 84 139.540 -7.097 2.369 1.00 0.00 H new ATOM 1333 N CYS A 85 135.788 -5.145 7.713 1.00 0.00 N ATOM 1334 CA CYS A 85 137.124 -4.591 8.073 1.00 0.00 C ATOM 1335 C CYS A 85 137.630 -5.232 9.367 1.00 0.00 C ATOM 1336 O CYS A 85 138.795 -5.541 9.505 1.00 0.00 O ATOM 1337 CB CYS A 85 136.995 -3.079 8.270 1.00 0.00 C ATOM 1338 SG CYS A 85 136.704 -2.288 6.667 1.00 0.00 S ATOM 0 H CYS A 85 135.037 -4.457 7.659 1.00 0.00 H new ATOM 0 HA CYS A 85 137.833 -4.806 7.274 1.00 0.00 H new ATOM 0 HB2 CYS A 85 136.173 -2.858 8.952 1.00 0.00 H new ATOM 0 HB3 CYS A 85 137.902 -2.681 8.725 1.00 0.00 H new ATOM 0 HG CYS A 85 135.449 -2.403 6.348 1.00 0.00 H new ATOM 1344 N ASP A 86 136.765 -5.434 10.317 1.00 0.00 N ATOM 1345 CA ASP A 86 137.199 -6.051 11.600 1.00 0.00 C ATOM 1346 C ASP A 86 137.785 -7.442 11.340 1.00 0.00 C ATOM 1347 O ASP A 86 138.659 -7.900 12.050 1.00 0.00 O ATOM 1348 CB ASP A 86 135.996 -6.165 12.540 1.00 0.00 C ATOM 1349 CG ASP A 86 135.584 -4.768 13.006 1.00 0.00 C ATOM 1350 OD1 ASP A 86 136.419 -3.879 12.962 1.00 0.00 O ATOM 1351 OD2 ASP A 86 134.439 -4.608 13.395 1.00 0.00 O ATOM 0 H ASP A 86 135.774 -5.199 10.262 1.00 0.00 H new ATOM 0 HA ASP A 86 137.964 -5.425 12.060 1.00 0.00 H new ATOM 0 HB2 ASP A 86 135.165 -6.650 12.028 1.00 0.00 H new ATOM 0 HB3 ASP A 86 136.248 -6.787 13.398 1.00 0.00 H new ATOM 1356 N ALA A 87 137.304 -8.127 10.336 1.00 0.00 N ATOM 1357 CA ALA A 87 137.828 -9.498 10.044 1.00 0.00 C ATOM 1358 C ALA A 87 138.993 -9.434 9.051 1.00 0.00 C ATOM 1359 O ALA A 87 139.888 -10.255 9.086 1.00 0.00 O ATOM 1360 CB ALA A 87 136.710 -10.347 9.434 1.00 0.00 C ATOM 0 H ALA A 87 136.572 -7.799 9.706 1.00 0.00 H new ATOM 0 HA ALA A 87 138.179 -9.940 10.977 1.00 0.00 H new ATOM 0 HB1 ALA A 87 137.088 -11.347 9.220 1.00 0.00 H new ATOM 0 HB2 ALA A 87 135.880 -10.416 10.137 1.00 0.00 H new ATOM 0 HB3 ALA A 87 136.365 -9.884 8.510 1.00 0.00 H new ATOM 1366 N PHE A 88 138.965 -8.496 8.135 1.00 0.00 N ATOM 1367 CA PHE A 88 140.045 -8.405 7.094 1.00 0.00 C ATOM 1368 C PHE A 88 140.929 -7.162 7.286 1.00 0.00 C ATOM 1369 O PHE A 88 141.813 -6.905 6.493 1.00 0.00 O ATOM 1370 CB PHE A 88 139.387 -8.337 5.719 1.00 0.00 C ATOM 1371 CG PHE A 88 138.663 -9.634 5.432 1.00 0.00 C ATOM 1372 CD1 PHE A 88 139.380 -10.753 4.989 1.00 0.00 C ATOM 1373 CD2 PHE A 88 137.274 -9.718 5.602 1.00 0.00 C ATOM 1374 CE1 PHE A 88 138.710 -11.951 4.716 1.00 0.00 C ATOM 1375 CE2 PHE A 88 136.605 -10.915 5.325 1.00 0.00 C ATOM 1376 CZ PHE A 88 137.322 -12.031 4.882 1.00 0.00 C ATOM 0 H PHE A 88 138.238 -7.785 8.061 1.00 0.00 H new ATOM 0 HA PHE A 88 140.683 -9.284 7.187 1.00 0.00 H new ATOM 0 HB2 PHE A 88 138.686 -7.503 5.682 1.00 0.00 H new ATOM 0 HB3 PHE A 88 140.141 -8.154 4.954 1.00 0.00 H new ATOM 0 HD1 PHE A 88 140.450 -10.691 4.858 1.00 0.00 H new ATOM 0 HD2 PHE A 88 136.720 -8.858 5.947 1.00 0.00 H new ATOM 0 HE1 PHE A 88 139.264 -12.814 4.377 1.00 0.00 H new ATOM 0 HE2 PHE A 88 135.534 -10.977 5.453 1.00 0.00 H new ATOM 0 HZ PHE A 88 136.805 -12.955 4.668 1.00 0.00 H new ATOM 1386 N LEU A 89 140.700 -6.384 8.313 1.00 0.00 N ATOM 1387 CA LEU A 89 141.531 -5.151 8.530 1.00 0.00 C ATOM 1388 C LEU A 89 141.824 -5.001 10.027 1.00 0.00 C ATOM 1389 O LEU A 89 141.068 -5.546 10.815 1.00 0.00 O ATOM 1390 CB LEU A 89 140.749 -3.916 8.046 1.00 0.00 C ATOM 1391 CG LEU A 89 141.699 -2.715 7.831 1.00 0.00 C ATOM 1392 CD1 LEU A 89 142.360 -2.788 6.439 1.00 0.00 C ATOM 1393 CD2 LEU A 89 140.913 -1.399 7.962 1.00 0.00 C ATOM 1394 OXT LEU A 89 142.795 -4.341 10.359 1.00 0.00 O ATOM 0 H LEU A 89 139.975 -6.545 9.012 1.00 0.00 H new ATOM 0 HA LEU A 89 142.465 -5.236 7.974 1.00 0.00 H new ATOM 0 HB2 LEU A 89 140.233 -4.149 7.115 1.00 0.00 H new ATOM 0 HB3 LEU A 89 139.984 -3.654 8.777 1.00 0.00 H new ATOM 0 HG LEU A 89 142.480 -2.750 8.591 1.00 0.00 H new ATOM 0 HD11 LEU A 89 143.025 -1.934 6.307 1.00 0.00 H new ATOM 0 HD12 LEU A 89 142.934 -3.711 6.357 1.00 0.00 H new ATOM 0 HD13 LEU A 89 141.589 -2.770 5.669 1.00 0.00 H new ATOM 0 HD21 LEU A 89 141.587 -0.556 7.810 1.00 0.00 H new ATOM 0 HD22 LEU A 89 140.122 -1.371 7.212 1.00 0.00 H new ATOM 0 HD23 LEU A 89 140.472 -1.336 8.957 1.00 0.00 H new TER 1406 LEU A 89 ATOM 1407 N MET B 1 169.037 -6.838 -6.476 1.00 0.00 N ATOM 1408 CA MET B 1 168.777 -5.751 -5.490 1.00 0.00 C ATOM 1409 C MET B 1 167.476 -6.051 -4.739 1.00 0.00 C ATOM 1410 O MET B 1 166.396 -5.764 -5.212 1.00 0.00 O ATOM 1411 CB MET B 1 168.646 -4.419 -6.232 1.00 0.00 C ATOM 1412 CG MET B 1 170.013 -4.002 -6.781 1.00 0.00 C ATOM 1413 SD MET B 1 169.832 -2.483 -7.750 1.00 0.00 S ATOM 1414 CE MET B 1 171.589 -2.218 -8.095 1.00 0.00 C ATOM 0 H1 MET B 1 170.040 -6.824 -6.752 1.00 0.00 H new ATOM 0 H2 MET B 1 168.809 -7.758 -6.047 1.00 0.00 H new ATOM 0 H3 MET B 1 168.444 -6.692 -7.318 1.00 0.00 H new ATOM 0 HA MET B 1 169.601 -5.692 -4.779 1.00 0.00 H new ATOM 0 HB2 MET B 1 167.929 -4.514 -7.047 1.00 0.00 H new ATOM 0 HB3 MET B 1 168.264 -3.652 -5.559 1.00 0.00 H new ATOM 0 HG2 MET B 1 170.713 -3.843 -5.961 1.00 0.00 H new ATOM 0 HG3 MET B 1 170.426 -4.796 -7.403 1.00 0.00 H new ATOM 0 HE1 MET B 1 171.710 -1.315 -8.693 1.00 0.00 H new ATOM 0 HE2 MET B 1 172.131 -2.107 -7.156 1.00 0.00 H new ATOM 0 HE3 MET B 1 171.985 -3.073 -8.643 1.00 0.00 H new ATOM 1426 N THR B 2 167.573 -6.638 -3.575 1.00 0.00 N ATOM 1427 CA THR B 2 166.342 -6.971 -2.795 1.00 0.00 C ATOM 1428 C THR B 2 165.890 -5.766 -1.965 1.00 0.00 C ATOM 1429 O THR B 2 166.646 -4.848 -1.712 1.00 0.00 O ATOM 1430 CB THR B 2 166.635 -8.143 -1.855 1.00 0.00 C ATOM 1431 OG1 THR B 2 167.696 -7.789 -0.978 1.00 0.00 O ATOM 1432 CG2 THR B 2 167.030 -9.373 -2.673 1.00 0.00 C ATOM 0 H THR B 2 168.452 -6.902 -3.130 1.00 0.00 H new ATOM 0 HA THR B 2 165.549 -7.240 -3.493 1.00 0.00 H new ATOM 0 HB THR B 2 165.743 -8.374 -1.272 1.00 0.00 H new ATOM 0 HG1 THR B 2 167.884 -8.537 -0.374 1.00 0.00 H new ATOM 0 HG21 THR B 2 167.238 -10.206 -2.001 1.00 0.00 H new ATOM 0 HG22 THR B 2 166.213 -9.642 -3.342 1.00 0.00 H new ATOM 0 HG23 THR B 2 167.921 -9.149 -3.260 1.00 0.00 H new ATOM 1440 N THR B 3 164.658 -5.777 -1.534 1.00 0.00 N ATOM 1441 CA THR B 3 164.130 -4.653 -0.707 1.00 0.00 C ATOM 1442 C THR B 3 164.540 -4.859 0.755 1.00 0.00 C ATOM 1443 O THR B 3 165.044 -5.900 1.127 1.00 0.00 O ATOM 1444 CB THR B 3 162.604 -4.616 -0.815 1.00 0.00 C ATOM 1445 OG1 THR B 3 162.067 -5.846 -0.349 1.00 0.00 O ATOM 1446 CG2 THR B 3 162.198 -4.398 -2.274 1.00 0.00 C ATOM 0 H THR B 3 163.988 -6.523 -1.721 1.00 0.00 H new ATOM 0 HA THR B 3 164.541 -3.710 -1.067 1.00 0.00 H new ATOM 0 HB THR B 3 162.217 -3.798 -0.208 1.00 0.00 H new ATOM 0 HG1 THR B 3 161.229 -6.037 -0.820 1.00 0.00 H new ATOM 0 HG21 THR B 3 161.111 -4.372 -2.349 1.00 0.00 H new ATOM 0 HG22 THR B 3 162.609 -3.453 -2.629 1.00 0.00 H new ATOM 0 HG23 THR B 3 162.584 -5.214 -2.885 1.00 0.00 H new ATOM 1454 N SER B 4 164.335 -3.872 1.585 1.00 0.00 N ATOM 1455 CA SER B 4 164.721 -4.005 3.021 1.00 0.00 C ATOM 1456 C SER B 4 163.794 -5.002 3.727 1.00 0.00 C ATOM 1457 O SER B 4 162.766 -5.397 3.214 1.00 0.00 O ATOM 1458 CB SER B 4 164.616 -2.642 3.705 1.00 0.00 C ATOM 1459 OG SER B 4 163.270 -2.191 3.654 1.00 0.00 O ATOM 0 H SER B 4 163.916 -2.977 1.331 1.00 0.00 H new ATOM 0 HA SER B 4 165.747 -4.369 3.080 1.00 0.00 H new ATOM 0 HB2 SER B 4 164.947 -2.716 4.741 1.00 0.00 H new ATOM 0 HB3 SER B 4 165.271 -1.924 3.212 1.00 0.00 H new ATOM 0 HG SER B 4 163.201 -1.318 4.094 1.00 0.00 H new ATOM 1465 N GLN B 5 164.183 -5.418 4.904 1.00 0.00 N ATOM 1466 CA GLN B 5 163.379 -6.406 5.683 1.00 0.00 C ATOM 1467 C GLN B 5 161.983 -5.854 5.985 1.00 0.00 C ATOM 1468 O GLN B 5 161.070 -6.597 6.290 1.00 0.00 O ATOM 1469 CB GLN B 5 164.102 -6.705 7.002 1.00 0.00 C ATOM 1470 CG GLN B 5 165.374 -7.511 6.718 1.00 0.00 C ATOM 1471 CD GLN B 5 166.099 -7.811 8.035 1.00 0.00 C ATOM 1472 OE1 GLN B 5 165.769 -7.155 9.114 1.00 0.00 O flip ATOM 1473 NE2 GLN B 5 166.974 -8.652 8.080 1.00 0.00 N flip ATOM 0 H GLN B 5 165.038 -5.109 5.366 1.00 0.00 H new ATOM 0 HA GLN B 5 163.271 -7.316 5.094 1.00 0.00 H new ATOM 0 HB2 GLN B 5 164.355 -5.774 7.509 1.00 0.00 H new ATOM 0 HB3 GLN B 5 163.446 -7.264 7.670 1.00 0.00 H new ATOM 0 HG2 GLN B 5 165.121 -8.442 6.211 1.00 0.00 H new ATOM 0 HG3 GLN B 5 166.029 -6.952 6.050 1.00 0.00 H new ATOM 0 HE21 GLN B 5 167.232 -9.165 7.237 1.00 0.00 H new ATOM 0 HE22 GLN B 5 167.451 -8.845 8.961 1.00 0.00 H new ATOM 1482 N LYS B 6 161.802 -4.561 5.909 1.00 0.00 N ATOM 1483 CA LYS B 6 160.466 -3.965 6.200 1.00 0.00 C ATOM 1484 C LYS B 6 159.450 -4.441 5.157 1.00 0.00 C ATOM 1485 O LYS B 6 158.296 -4.669 5.463 1.00 0.00 O ATOM 1486 CB LYS B 6 160.576 -2.439 6.132 1.00 0.00 C ATOM 1487 CG LYS B 6 161.440 -1.935 7.290 1.00 0.00 C ATOM 1488 CD LYS B 6 161.551 -0.411 7.222 1.00 0.00 C ATOM 1489 CE LYS B 6 162.416 0.093 8.380 1.00 0.00 C ATOM 1490 NZ LYS B 6 162.612 1.565 8.253 1.00 0.00 N ATOM 0 H LYS B 6 162.527 -3.889 5.656 1.00 0.00 H new ATOM 0 HA LYS B 6 160.138 -4.274 7.193 1.00 0.00 H new ATOM 0 HB2 LYS B 6 161.014 -2.138 5.180 1.00 0.00 H new ATOM 0 HB3 LYS B 6 159.584 -1.990 6.183 1.00 0.00 H new ATOM 0 HG2 LYS B 6 161.002 -2.236 8.242 1.00 0.00 H new ATOM 0 HG3 LYS B 6 162.432 -2.385 7.240 1.00 0.00 H new ATOM 0 HD2 LYS B 6 161.989 -0.110 6.270 1.00 0.00 H new ATOM 0 HD3 LYS B 6 160.559 0.039 7.273 1.00 0.00 H new ATOM 0 HE2 LYS B 6 161.939 -0.140 9.332 1.00 0.00 H new ATOM 0 HE3 LYS B 6 163.381 -0.414 8.374 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 163.200 1.906 9.040 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 163.085 1.776 7.351 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 161.688 2.042 8.279 1.00 0.00 H new ATOM 1504 N HIS B 7 159.857 -4.574 3.928 1.00 0.00 N ATOM 1505 CA HIS B 7 158.902 -5.010 2.869 1.00 0.00 C ATOM 1506 C HIS B 7 158.323 -6.385 3.205 1.00 0.00 C ATOM 1507 O HIS B 7 157.126 -6.588 3.161 1.00 0.00 O ATOM 1508 CB HIS B 7 159.645 -5.075 1.530 1.00 0.00 C ATOM 1509 CG HIS B 7 158.753 -5.649 0.459 1.00 0.00 C ATOM 1510 ND1 HIS B 7 157.942 -4.856 -0.340 1.00 0.00 N ATOM 1511 CD2 HIS B 7 158.560 -6.939 0.027 1.00 0.00 C ATOM 1512 CE1 HIS B 7 157.307 -5.670 -1.207 1.00 0.00 C ATOM 1513 NE2 HIS B 7 157.648 -6.946 -1.022 1.00 0.00 N ATOM 0 H HIS B 7 160.810 -4.400 3.608 1.00 0.00 H new ATOM 0 HA HIS B 7 158.081 -4.296 2.807 1.00 0.00 H new ATOM 0 HB2 HIS B 7 159.974 -4.077 1.241 1.00 0.00 H new ATOM 0 HB3 HIS B 7 160.540 -5.688 1.633 1.00 0.00 H new ATOM 0 HD2 HIS B 7 159.043 -7.813 0.439 1.00 0.00 H new ATOM 0 HE1 HIS B 7 156.609 -5.331 -1.958 1.00 0.00 H new ATOM 0 HE2 HIS B 7 157.311 -7.757 -1.541 1.00 0.00 H new ATOM 1521 N ARG B 8 159.157 -7.334 3.538 1.00 0.00 N ATOM 1522 CA ARG B 8 158.649 -8.693 3.871 1.00 0.00 C ATOM 1523 C ARG B 8 157.900 -8.667 5.204 1.00 0.00 C ATOM 1524 O ARG B 8 156.970 -9.417 5.421 1.00 0.00 O ATOM 1525 CB ARG B 8 159.824 -9.666 3.962 1.00 0.00 C ATOM 1526 CG ARG B 8 160.393 -9.895 2.562 1.00 0.00 C ATOM 1527 CD ARG B 8 161.568 -10.870 2.642 1.00 0.00 C ATOM 1528 NE ARG B 8 162.122 -11.087 1.279 1.00 0.00 N ATOM 1529 CZ ARG B 8 163.295 -11.636 1.133 1.00 0.00 C ATOM 1530 NH1 ARG B 8 163.977 -12.003 2.185 1.00 0.00 N ATOM 1531 NH2 ARG B 8 163.787 -11.820 -0.061 1.00 0.00 N ATOM 0 H ARG B 8 160.170 -7.225 3.593 1.00 0.00 H new ATOM 0 HA ARG B 8 157.963 -9.017 3.089 1.00 0.00 H new ATOM 0 HB2 ARG B 8 160.595 -9.265 4.620 1.00 0.00 H new ATOM 0 HB3 ARG B 8 159.497 -10.612 4.394 1.00 0.00 H new ATOM 0 HG2 ARG B 8 159.620 -10.293 1.905 1.00 0.00 H new ATOM 0 HG3 ARG B 8 160.721 -8.949 2.132 1.00 0.00 H new ATOM 0 HD2 ARG B 8 162.340 -10.473 3.302 1.00 0.00 H new ATOM 0 HD3 ARG B 8 161.240 -11.818 3.069 1.00 0.00 H new ATOM 0 HE ARG B 8 161.584 -10.806 0.459 1.00 0.00 H new ATOM 0 HH11 ARG B 8 163.591 -11.860 3.118 1.00 0.00 H new ATOM 0 HH12 ARG B 8 164.895 -12.433 2.073 1.00 0.00 H new ATOM 0 HH21 ARG B 8 163.254 -11.534 -0.882 1.00 0.00 H new ATOM 0 HH22 ARG B 8 164.705 -12.250 -0.174 1.00 0.00 H new ATOM 1545 N ASP B 9 158.295 -7.805 6.097 1.00 0.00 N ATOM 1546 CA ASP B 9 157.608 -7.722 7.415 1.00 0.00 C ATOM 1547 C ASP B 9 156.209 -7.129 7.245 1.00 0.00 C ATOM 1548 O ASP B 9 155.264 -7.539 7.888 1.00 0.00 O ATOM 1549 CB ASP B 9 158.420 -6.836 8.361 1.00 0.00 C ATOM 1550 CG ASP B 9 159.714 -7.552 8.749 1.00 0.00 C ATOM 1551 OD1 ASP B 9 159.699 -8.770 8.809 1.00 0.00 O ATOM 1552 OD2 ASP B 9 160.699 -6.869 8.978 1.00 0.00 O ATOM 0 H ASP B 9 159.068 -7.151 5.970 1.00 0.00 H new ATOM 0 HA ASP B 9 157.523 -8.726 7.831 1.00 0.00 H new ATOM 0 HB2 ASP B 9 158.649 -5.886 7.879 1.00 0.00 H new ATOM 0 HB3 ASP B 9 157.837 -6.609 9.253 1.00 0.00 H new ATOM 1557 N PHE B 10 156.081 -6.138 6.405 1.00 0.00 N ATOM 1558 CA PHE B 10 154.753 -5.487 6.221 1.00 0.00 C ATOM 1559 C PHE B 10 153.766 -6.458 5.560 1.00 0.00 C ATOM 1560 O PHE B 10 152.616 -6.537 5.941 1.00 0.00 O ATOM 1561 CB PHE B 10 154.928 -4.248 5.339 1.00 0.00 C ATOM 1562 CG PHE B 10 153.654 -3.439 5.341 1.00 0.00 C ATOM 1563 CD1 PHE B 10 153.470 -2.440 6.304 1.00 0.00 C ATOM 1564 CD2 PHE B 10 152.662 -3.680 4.382 1.00 0.00 C ATOM 1565 CE1 PHE B 10 152.295 -1.681 6.310 1.00 0.00 C ATOM 1566 CE2 PHE B 10 151.486 -2.921 4.390 1.00 0.00 C ATOM 1567 CZ PHE B 10 151.301 -1.921 5.354 1.00 0.00 C ATOM 0 H PHE B 10 156.837 -5.752 5.839 1.00 0.00 H new ATOM 0 HA PHE B 10 154.354 -5.200 7.194 1.00 0.00 H new ATOM 0 HB2 PHE B 10 155.756 -3.642 5.707 1.00 0.00 H new ATOM 0 HB3 PHE B 10 155.179 -4.547 4.321 1.00 0.00 H new ATOM 0 HD1 PHE B 10 154.236 -2.255 7.043 1.00 0.00 H new ATOM 0 HD2 PHE B 10 152.804 -4.450 3.638 1.00 0.00 H new ATOM 0 HE1 PHE B 10 152.155 -0.909 7.053 1.00 0.00 H new ATOM 0 HE2 PHE B 10 150.720 -3.106 3.652 1.00 0.00 H new ATOM 0 HZ PHE B 10 150.393 -1.336 5.359 1.00 0.00 H new ATOM 1577 N VAL B 11 154.201 -7.193 4.572 1.00 0.00 N ATOM 1578 CA VAL B 11 153.280 -8.153 3.889 1.00 0.00 C ATOM 1579 C VAL B 11 153.260 -9.487 4.643 1.00 0.00 C ATOM 1580 O VAL B 11 152.806 -10.489 4.127 1.00 0.00 O ATOM 1581 CB VAL B 11 153.773 -8.390 2.460 1.00 0.00 C ATOM 1582 CG1 VAL B 11 153.890 -7.050 1.731 1.00 0.00 C ATOM 1583 CG2 VAL B 11 155.143 -9.064 2.510 1.00 0.00 C ATOM 0 H VAL B 11 155.153 -7.172 4.207 1.00 0.00 H new ATOM 0 HA VAL B 11 152.273 -7.736 3.873 1.00 0.00 H new ATOM 0 HB VAL B 11 153.067 -9.029 1.929 1.00 0.00 H new ATOM 0 HG11 VAL B 11 154.241 -7.219 0.713 1.00 0.00 H new ATOM 0 HG12 VAL B 11 152.914 -6.565 1.702 1.00 0.00 H new ATOM 0 HG13 VAL B 11 154.598 -6.410 2.257 1.00 0.00 H new ATOM 0 HG21 VAL B 11 155.501 -9.236 1.495 1.00 0.00 H new ATOM 0 HG22 VAL B 11 155.846 -8.420 3.038 1.00 0.00 H new ATOM 0 HG23 VAL B 11 155.061 -10.017 3.032 1.00 0.00 H new ATOM 1593 N ALA B 12 153.756 -9.507 5.857 1.00 0.00 N ATOM 1594 CA ALA B 12 153.780 -10.777 6.657 1.00 0.00 C ATOM 1595 C ALA B 12 152.836 -10.672 7.859 1.00 0.00 C ATOM 1596 O ALA B 12 152.580 -11.648 8.537 1.00 0.00 O ATOM 1597 CB ALA B 12 155.204 -11.019 7.163 1.00 0.00 C ATOM 0 H ALA B 12 154.148 -8.694 6.332 1.00 0.00 H new ATOM 0 HA ALA B 12 153.455 -11.601 6.022 1.00 0.00 H new ATOM 0 HB1 ALA B 12 155.232 -11.940 7.746 1.00 0.00 H new ATOM 0 HB2 ALA B 12 155.882 -11.106 6.314 1.00 0.00 H new ATOM 0 HB3 ALA B 12 155.514 -10.183 7.790 1.00 0.00 H new ATOM 1603 N GLU B 13 152.319 -9.506 8.141 1.00 0.00 N ATOM 1604 CA GLU B 13 151.401 -9.368 9.314 1.00 0.00 C ATOM 1605 C GLU B 13 150.439 -8.190 9.090 1.00 0.00 C ATOM 1606 O GLU B 13 150.778 -7.243 8.408 1.00 0.00 O ATOM 1607 CB GLU B 13 152.247 -9.100 10.561 1.00 0.00 C ATOM 1608 CG GLU B 13 152.999 -7.774 10.393 1.00 0.00 C ATOM 1609 CD GLU B 13 154.150 -7.703 11.399 1.00 0.00 C ATOM 1610 OE1 GLU B 13 154.239 -8.591 12.230 1.00 0.00 O ATOM 1611 OE2 GLU B 13 154.922 -6.762 11.319 1.00 0.00 O ATOM 0 H GLU B 13 152.489 -8.648 7.616 1.00 0.00 H new ATOM 0 HA GLU B 13 150.819 -10.281 9.438 1.00 0.00 H new ATOM 0 HB2 GLU B 13 151.610 -9.060 11.444 1.00 0.00 H new ATOM 0 HB3 GLU B 13 152.955 -9.915 10.716 1.00 0.00 H new ATOM 0 HG2 GLU B 13 153.385 -7.690 9.377 1.00 0.00 H new ATOM 0 HG3 GLU B 13 152.318 -6.937 10.545 1.00 0.00 H new ATOM 1618 N PRO B 14 149.263 -8.214 9.682 1.00 0.00 N ATOM 1619 CA PRO B 14 148.293 -7.090 9.548 1.00 0.00 C ATOM 1620 C PRO B 14 148.993 -5.729 9.665 1.00 0.00 C ATOM 1621 O PRO B 14 150.089 -5.633 10.181 1.00 0.00 O ATOM 1622 CB PRO B 14 147.332 -7.309 10.722 1.00 0.00 C ATOM 1623 CG PRO B 14 147.323 -8.790 10.939 1.00 0.00 C ATOM 1624 CD PRO B 14 148.717 -9.299 10.529 1.00 0.00 C ATOM 0 HA PRO B 14 147.794 -7.079 8.579 1.00 0.00 H new ATOM 0 HB2 PRO B 14 147.670 -6.781 11.614 1.00 0.00 H new ATOM 0 HB3 PRO B 14 146.334 -6.937 10.491 1.00 0.00 H new ATOM 0 HG2 PRO B 14 147.114 -9.028 11.982 1.00 0.00 H new ATOM 0 HG3 PRO B 14 146.545 -9.265 10.341 1.00 0.00 H new ATOM 0 HD2 PRO B 14 149.347 -9.480 11.400 1.00 0.00 H new ATOM 0 HD3 PRO B 14 148.653 -10.239 9.981 1.00 0.00 H new ATOM 1632 N MET B 15 148.378 -4.679 9.192 1.00 0.00 N ATOM 1633 CA MET B 15 149.025 -3.334 9.284 1.00 0.00 C ATOM 1634 C MET B 15 148.637 -2.673 10.608 1.00 0.00 C ATOM 1635 O MET B 15 149.297 -1.770 11.083 1.00 0.00 O ATOM 1636 CB MET B 15 148.555 -2.461 8.120 1.00 0.00 C ATOM 1637 CG MET B 15 147.037 -2.582 7.969 1.00 0.00 C ATOM 1638 SD MET B 15 146.412 -1.204 6.973 1.00 0.00 S ATOM 1639 CE MET B 15 146.747 -1.908 5.339 1.00 0.00 C ATOM 0 H MET B 15 147.460 -4.691 8.748 1.00 0.00 H new ATOM 0 HA MET B 15 150.108 -3.447 9.238 1.00 0.00 H new ATOM 0 HB2 MET B 15 148.831 -1.422 8.297 1.00 0.00 H new ATOM 0 HB3 MET B 15 149.048 -2.770 7.198 1.00 0.00 H new ATOM 0 HG2 MET B 15 146.783 -3.530 7.495 1.00 0.00 H new ATOM 0 HG3 MET B 15 146.563 -2.579 8.950 1.00 0.00 H new ATOM 0 HE1 MET B 15 147.001 -1.108 4.643 1.00 0.00 H new ATOM 0 HE2 MET B 15 147.580 -2.607 5.408 1.00 0.00 H new ATOM 0 HE3 MET B 15 145.862 -2.433 4.981 1.00 0.00 H new ATOM 1649 N GLY B 16 147.570 -3.126 11.210 1.00 0.00 N ATOM 1650 CA GLY B 16 147.132 -2.542 12.511 1.00 0.00 C ATOM 1651 C GLY B 16 147.084 -1.015 12.420 1.00 0.00 C ATOM 1652 O GLY B 16 146.685 -0.450 11.420 1.00 0.00 O ATOM 0 H GLY B 16 146.980 -3.879 10.855 1.00 0.00 H new ATOM 0 HA2 GLY B 16 146.148 -2.928 12.778 1.00 0.00 H new ATOM 0 HA3 GLY B 16 147.818 -2.844 13.302 1.00 0.00 H new ATOM 1656 N GLU B 17 147.461 -0.345 13.480 1.00 0.00 N ATOM 1657 CA GLU B 17 147.413 1.151 13.504 1.00 0.00 C ATOM 1658 C GLU B 17 148.817 1.731 13.313 1.00 0.00 C ATOM 1659 O GLU B 17 149.119 2.808 13.789 1.00 0.00 O ATOM 1660 CB GLU B 17 146.859 1.595 14.861 1.00 0.00 C ATOM 1661 CG GLU B 17 145.380 1.212 14.954 1.00 0.00 C ATOM 1662 CD GLU B 17 144.819 1.653 16.307 1.00 0.00 C ATOM 1663 OE1 GLU B 17 145.606 2.053 17.150 1.00 0.00 O ATOM 1664 OE2 GLU B 17 143.614 1.575 16.481 1.00 0.00 O ATOM 0 H GLU B 17 147.804 -0.775 14.339 1.00 0.00 H new ATOM 0 HA GLU B 17 146.776 1.510 12.696 1.00 0.00 H new ATOM 0 HB2 GLU B 17 147.420 1.123 15.668 1.00 0.00 H new ATOM 0 HB3 GLU B 17 146.976 2.672 14.979 1.00 0.00 H new ATOM 0 HG2 GLU B 17 144.821 1.683 14.146 1.00 0.00 H new ATOM 0 HG3 GLU B 17 145.265 0.135 14.835 1.00 0.00 H new ATOM 1671 N LYS B 18 149.677 1.037 12.619 1.00 0.00 N ATOM 1672 CA LYS B 18 151.053 1.566 12.405 1.00 0.00 C ATOM 1673 C LYS B 18 150.951 2.884 11.617 1.00 0.00 C ATOM 1674 O LYS B 18 150.042 3.063 10.831 1.00 0.00 O ATOM 1675 CB LYS B 18 151.871 0.546 11.606 1.00 0.00 C ATOM 1676 CG LYS B 18 152.134 -0.689 12.473 1.00 0.00 C ATOM 1677 CD LYS B 18 153.048 -1.659 11.721 1.00 0.00 C ATOM 1678 CE LYS B 18 153.103 -2.993 12.468 1.00 0.00 C ATOM 1679 NZ LYS B 18 153.814 -2.809 13.765 1.00 0.00 N ATOM 0 H LYS B 18 149.487 0.130 12.193 1.00 0.00 H new ATOM 0 HA LYS B 18 151.544 1.743 13.362 1.00 0.00 H new ATOM 0 HB2 LYS B 18 151.333 0.261 10.702 1.00 0.00 H new ATOM 0 HB3 LYS B 18 152.815 0.989 11.289 1.00 0.00 H new ATOM 0 HG2 LYS B 18 152.597 -0.393 13.414 1.00 0.00 H new ATOM 0 HG3 LYS B 18 151.192 -1.179 12.721 1.00 0.00 H new ATOM 0 HD2 LYS B 18 152.677 -1.813 10.708 1.00 0.00 H new ATOM 0 HD3 LYS B 18 154.049 -1.238 11.634 1.00 0.00 H new ATOM 0 HE2 LYS B 18 152.094 -3.365 12.644 1.00 0.00 H new ATOM 0 HE3 LYS B 18 153.617 -3.740 11.863 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 153.986 -3.737 14.201 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 154.723 -2.331 13.598 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 153.230 -2.230 14.402 1.00 0.00 H new ATOM 1693 N PRO B 19 151.857 3.811 11.834 1.00 0.00 N ATOM 1694 CA PRO B 19 151.830 5.136 11.138 1.00 0.00 C ATOM 1695 C PRO B 19 152.078 5.019 9.626 1.00 0.00 C ATOM 1696 O PRO B 19 152.609 4.041 9.139 1.00 0.00 O ATOM 1697 CB PRO B 19 152.954 5.934 11.825 1.00 0.00 C ATOM 1698 CG PRO B 19 153.883 4.896 12.364 1.00 0.00 C ATOM 1699 CD PRO B 19 153.003 3.710 12.757 1.00 0.00 C ATOM 0 HA PRO B 19 150.853 5.612 11.216 1.00 0.00 H new ATOM 0 HB2 PRO B 19 153.462 6.591 11.119 1.00 0.00 H new ATOM 0 HB3 PRO B 19 152.561 6.565 12.622 1.00 0.00 H new ATOM 0 HG2 PRO B 19 154.620 4.605 11.615 1.00 0.00 H new ATOM 0 HG3 PRO B 19 154.435 5.275 13.224 1.00 0.00 H new ATOM 0 HD2 PRO B 19 153.530 2.763 12.640 1.00 0.00 H new ATOM 0 HD3 PRO B 19 152.687 3.773 13.798 1.00 0.00 H new ATOM 1707 N VAL B 20 151.674 6.019 8.889 1.00 0.00 N ATOM 1708 CA VAL B 20 151.848 6.000 7.407 1.00 0.00 C ATOM 1709 C VAL B 20 153.320 5.782 7.028 1.00 0.00 C ATOM 1710 O VAL B 20 153.638 5.004 6.151 1.00 0.00 O ATOM 1711 CB VAL B 20 151.363 7.337 6.830 1.00 0.00 C ATOM 1712 CG1 VAL B 20 152.079 8.501 7.525 1.00 0.00 C ATOM 1713 CG2 VAL B 20 151.659 7.387 5.329 1.00 0.00 C ATOM 0 H VAL B 20 151.225 6.859 9.255 1.00 0.00 H new ATOM 0 HA VAL B 20 151.264 5.176 6.996 1.00 0.00 H new ATOM 0 HB VAL B 20 150.289 7.424 6.996 1.00 0.00 H new ATOM 0 HG11 VAL B 20 151.728 9.445 7.108 1.00 0.00 H new ATOM 0 HG12 VAL B 20 151.865 8.474 8.593 1.00 0.00 H new ATOM 0 HG13 VAL B 20 153.154 8.413 7.368 1.00 0.00 H new ATOM 0 HG21 VAL B 20 151.314 8.337 4.922 1.00 0.00 H new ATOM 0 HG22 VAL B 20 152.733 7.291 5.166 1.00 0.00 H new ATOM 0 HG23 VAL B 20 151.142 6.568 4.829 1.00 0.00 H new ATOM 1723 N GLY B 21 154.215 6.493 7.666 1.00 0.00 N ATOM 1724 CA GLY B 21 155.665 6.367 7.333 1.00 0.00 C ATOM 1725 C GLY B 21 156.129 4.912 7.448 1.00 0.00 C ATOM 1726 O GLY B 21 157.269 4.598 7.170 1.00 0.00 O ATOM 0 H GLY B 21 154.001 7.159 8.408 1.00 0.00 H new ATOM 0 HA2 GLY B 21 155.842 6.730 6.321 1.00 0.00 H new ATOM 0 HA3 GLY B 21 156.252 6.994 8.004 1.00 0.00 H new ATOM 1730 N SER B 22 155.272 4.017 7.859 1.00 0.00 N ATOM 1731 CA SER B 22 155.699 2.594 7.984 1.00 0.00 C ATOM 1732 C SER B 22 155.655 1.922 6.610 1.00 0.00 C ATOM 1733 O SER B 22 156.254 0.886 6.397 1.00 0.00 O ATOM 1734 CB SER B 22 154.758 1.859 8.939 1.00 0.00 C ATOM 1735 OG SER B 22 154.797 2.488 10.213 1.00 0.00 O ATOM 0 H SER B 22 154.302 4.207 8.112 1.00 0.00 H new ATOM 0 HA SER B 22 156.716 2.556 8.374 1.00 0.00 H new ATOM 0 HB2 SER B 22 153.741 1.870 8.546 1.00 0.00 H new ATOM 0 HB3 SER B 22 155.054 0.814 9.027 1.00 0.00 H new ATOM 0 HG SER B 22 154.012 3.065 10.317 1.00 0.00 H new ATOM 1741 N LEU B 23 154.951 2.500 5.674 1.00 0.00 N ATOM 1742 CA LEU B 23 154.872 1.886 4.318 1.00 0.00 C ATOM 1743 C LEU B 23 156.256 1.894 3.664 1.00 0.00 C ATOM 1744 O LEU B 23 156.980 2.869 3.717 1.00 0.00 O ATOM 1745 CB LEU B 23 153.890 2.678 3.450 1.00 0.00 C ATOM 1746 CG LEU B 23 152.455 2.474 3.958 1.00 0.00 C ATOM 1747 CD1 LEU B 23 151.516 3.413 3.190 1.00 0.00 C ATOM 1748 CD2 LEU B 23 152.011 1.008 3.754 1.00 0.00 C ATOM 0 H LEU B 23 154.429 3.368 5.790 1.00 0.00 H new ATOM 0 HA LEU B 23 154.524 0.857 4.411 1.00 0.00 H new ATOM 0 HB2 LEU B 23 154.145 3.737 3.473 1.00 0.00 H new ATOM 0 HB3 LEU B 23 153.966 2.354 2.412 1.00 0.00 H new ATOM 0 HG LEU B 23 152.416 2.699 5.024 1.00 0.00 H new ATOM 0 HD11 LEU B 23 150.494 3.275 3.544 1.00 0.00 H new ATOM 0 HD12 LEU B 23 151.821 4.447 3.354 1.00 0.00 H new ATOM 0 HD13 LEU B 23 151.565 3.185 2.125 1.00 0.00 H new ATOM 0 HD21 LEU B 23 150.992 0.882 4.120 1.00 0.00 H new ATOM 0 HD22 LEU B 23 152.049 0.761 2.693 1.00 0.00 H new ATOM 0 HD23 LEU B 23 152.679 0.346 4.305 1.00 0.00 H new ATOM 1760 N ALA B 24 156.617 0.808 3.047 1.00 0.00 N ATOM 1761 CA ALA B 24 157.951 0.738 2.384 1.00 0.00 C ATOM 1762 C ALA B 24 158.004 1.713 1.202 1.00 0.00 C ATOM 1763 O ALA B 24 157.056 1.863 0.456 1.00 0.00 O ATOM 1764 CB ALA B 24 158.202 -0.688 1.886 1.00 0.00 C ATOM 0 H ALA B 24 156.049 -0.036 2.971 1.00 0.00 H new ATOM 0 HA ALA B 24 158.721 1.013 3.105 1.00 0.00 H new ATOM 0 HB1 ALA B 24 159.177 -0.738 1.402 1.00 0.00 H new ATOM 0 HB2 ALA B 24 158.180 -1.377 2.730 1.00 0.00 H new ATOM 0 HB3 ALA B 24 157.427 -0.965 1.171 1.00 0.00 H new ATOM 1770 N GLY B 25 159.117 2.375 1.039 1.00 0.00 N ATOM 1771 CA GLY B 25 159.266 3.354 -0.084 1.00 0.00 C ATOM 1772 C GLY B 25 159.015 4.768 0.438 1.00 0.00 C ATOM 1773 O GLY B 25 159.372 5.744 -0.192 1.00 0.00 O ATOM 0 H GLY B 25 159.937 2.281 1.638 1.00 0.00 H new ATOM 0 HA2 GLY B 25 160.266 3.285 -0.511 1.00 0.00 H new ATOM 0 HA3 GLY B 25 158.562 3.119 -0.882 1.00 0.00 H new ATOM 1777 N ILE B 26 158.417 4.888 1.595 1.00 0.00 N ATOM 1778 CA ILE B 26 158.158 6.241 2.173 1.00 0.00 C ATOM 1779 C ILE B 26 159.274 6.545 3.168 1.00 0.00 C ATOM 1780 O ILE B 26 159.438 5.851 4.152 1.00 0.00 O ATOM 1781 CB ILE B 26 156.811 6.236 2.904 1.00 0.00 C ATOM 1782 CG1 ILE B 26 155.708 5.726 1.964 1.00 0.00 C ATOM 1783 CG2 ILE B 26 156.469 7.654 3.369 1.00 0.00 C ATOM 1784 CD1 ILE B 26 155.721 6.510 0.646 1.00 0.00 C ATOM 0 H ILE B 26 158.096 4.106 2.166 1.00 0.00 H new ATOM 0 HA ILE B 26 158.131 6.994 1.385 1.00 0.00 H new ATOM 0 HB ILE B 26 156.880 5.577 3.770 1.00 0.00 H new ATOM 0 HG12 ILE B 26 155.854 4.665 1.764 1.00 0.00 H new ATOM 0 HG13 ILE B 26 154.735 5.829 2.445 1.00 0.00 H new ATOM 0 HG21 ILE B 26 155.511 7.645 3.888 1.00 0.00 H new ATOM 0 HG22 ILE B 26 157.245 8.012 4.046 1.00 0.00 H new ATOM 0 HG23 ILE B 26 156.408 8.315 2.505 1.00 0.00 H new ATOM 0 HD11 ILE B 26 154.933 6.136 -0.008 1.00 0.00 H new ATOM 0 HD12 ILE B 26 155.551 7.567 0.850 1.00 0.00 H new ATOM 0 HD13 ILE B 26 156.688 6.385 0.158 1.00 0.00 H new ATOM 1796 N GLY B 27 160.049 7.574 2.935 1.00 0.00 N ATOM 1797 CA GLY B 27 161.148 7.909 3.881 1.00 0.00 C ATOM 1798 C GLY B 27 160.604 8.803 4.994 1.00 0.00 C ATOM 1799 O GLY B 27 159.488 9.277 4.933 1.00 0.00 O ATOM 0 H GLY B 27 159.966 8.195 2.130 1.00 0.00 H new ATOM 0 HA2 GLY B 27 161.569 6.997 4.305 1.00 0.00 H new ATOM 0 HA3 GLY B 27 161.955 8.417 3.353 1.00 0.00 H new ATOM 1803 N GLU B 28 161.377 9.017 6.020 1.00 0.00 N ATOM 1804 CA GLU B 28 160.895 9.863 7.147 1.00 0.00 C ATOM 1805 C GLU B 28 160.492 11.247 6.633 1.00 0.00 C ATOM 1806 O GLU B 28 159.507 11.812 7.065 1.00 0.00 O ATOM 1807 CB GLU B 28 162.018 10.011 8.175 1.00 0.00 C ATOM 1808 CG GLU B 28 162.247 8.674 8.881 1.00 0.00 C ATOM 1809 CD GLU B 28 163.415 8.808 9.859 1.00 0.00 C ATOM 1810 OE1 GLU B 28 164.124 9.797 9.772 1.00 0.00 O ATOM 1811 OE2 GLU B 28 163.578 7.923 10.683 1.00 0.00 O ATOM 0 H GLU B 28 162.320 8.644 6.128 1.00 0.00 H new ATOM 0 HA GLU B 28 160.027 9.390 7.606 1.00 0.00 H new ATOM 0 HB2 GLU B 28 162.935 10.335 7.683 1.00 0.00 H new ATOM 0 HB3 GLU B 28 161.759 10.779 8.904 1.00 0.00 H new ATOM 0 HG2 GLU B 28 161.345 8.373 9.414 1.00 0.00 H new ATOM 0 HG3 GLU B 28 162.459 7.895 8.148 1.00 0.00 H new ATOM 1818 N VAL B 29 161.238 11.803 5.720 1.00 0.00 N ATOM 1819 CA VAL B 29 160.881 13.154 5.198 1.00 0.00 C ATOM 1820 C VAL B 29 159.602 13.056 4.361 1.00 0.00 C ATOM 1821 O VAL B 29 158.721 13.890 4.450 1.00 0.00 O ATOM 1822 CB VAL B 29 162.027 13.684 4.335 1.00 0.00 C ATOM 1823 CG1 VAL B 29 161.627 15.023 3.714 1.00 0.00 C ATOM 1824 CG2 VAL B 29 163.274 13.874 5.203 1.00 0.00 C ATOM 0 H VAL B 29 162.075 11.385 5.314 1.00 0.00 H new ATOM 0 HA VAL B 29 160.713 13.836 6.031 1.00 0.00 H new ATOM 0 HB VAL B 29 162.242 12.969 3.541 1.00 0.00 H new ATOM 0 HG11 VAL B 29 162.446 15.398 3.100 1.00 0.00 H new ATOM 0 HG12 VAL B 29 160.741 14.886 3.094 1.00 0.00 H new ATOM 0 HG13 VAL B 29 161.409 15.740 4.505 1.00 0.00 H new ATOM 0 HG21 VAL B 29 164.091 14.252 4.588 1.00 0.00 H new ATOM 0 HG22 VAL B 29 163.058 14.587 5.998 1.00 0.00 H new ATOM 0 HG23 VAL B 29 163.561 12.918 5.641 1.00 0.00 H new ATOM 1834 N LEU B 30 159.497 12.043 3.544 1.00 0.00 N ATOM 1835 CA LEU B 30 158.285 11.881 2.690 1.00 0.00 C ATOM 1836 C LEU B 30 157.071 11.587 3.570 1.00 0.00 C ATOM 1837 O LEU B 30 155.979 12.056 3.319 1.00 0.00 O ATOM 1838 CB LEU B 30 158.487 10.713 1.721 1.00 0.00 C ATOM 1839 CG LEU B 30 159.685 10.982 0.802 1.00 0.00 C ATOM 1840 CD1 LEU B 30 159.899 9.764 -0.103 1.00 0.00 C ATOM 1841 CD2 LEU B 30 159.421 12.229 -0.063 1.00 0.00 C ATOM 0 H LEU B 30 160.203 11.316 3.431 1.00 0.00 H new ATOM 0 HA LEU B 30 158.122 12.801 2.129 1.00 0.00 H new ATOM 0 HB2 LEU B 30 158.649 9.792 2.281 1.00 0.00 H new ATOM 0 HB3 LEU B 30 157.587 10.568 1.123 1.00 0.00 H new ATOM 0 HG LEU B 30 160.574 11.158 1.407 1.00 0.00 H new ATOM 0 HD11 LEU B 30 160.749 9.945 -0.761 1.00 0.00 H new ATOM 0 HD12 LEU B 30 160.095 8.885 0.511 1.00 0.00 H new ATOM 0 HD13 LEU B 30 159.005 9.595 -0.703 1.00 0.00 H new ATOM 0 HD21 LEU B 30 160.278 12.410 -0.711 1.00 0.00 H new ATOM 0 HD22 LEU B 30 158.532 12.067 -0.673 1.00 0.00 H new ATOM 0 HD23 LEU B 30 159.265 13.093 0.583 1.00 0.00 H new ATOM 1853 N GLY B 31 157.254 10.806 4.594 1.00 0.00 N ATOM 1854 CA GLY B 31 156.110 10.474 5.484 1.00 0.00 C ATOM 1855 C GLY B 31 155.547 11.757 6.093 1.00 0.00 C ATOM 1856 O GLY B 31 154.352 11.917 6.228 1.00 0.00 O ATOM 0 H GLY B 31 158.145 10.383 4.854 1.00 0.00 H new ATOM 0 HA2 GLY B 31 155.335 9.957 4.919 1.00 0.00 H new ATOM 0 HA3 GLY B 31 156.435 9.796 6.274 1.00 0.00 H new ATOM 1860 N LYS B 32 156.398 12.669 6.468 1.00 0.00 N ATOM 1861 CA LYS B 32 155.914 13.938 7.083 1.00 0.00 C ATOM 1862 C LYS B 32 155.042 14.720 6.093 1.00 0.00 C ATOM 1863 O LYS B 32 154.061 15.326 6.476 1.00 0.00 O ATOM 1864 CB LYS B 32 157.115 14.790 7.495 1.00 0.00 C ATOM 1865 CG LYS B 32 157.816 14.128 8.685 1.00 0.00 C ATOM 1866 CD LYS B 32 159.118 14.871 9.005 1.00 0.00 C ATOM 1867 CE LYS B 32 158.810 16.250 9.598 1.00 0.00 C ATOM 1868 NZ LYS B 32 160.035 16.795 10.250 1.00 0.00 N ATOM 0 H LYS B 32 157.411 12.591 6.375 1.00 0.00 H new ATOM 0 HA LYS B 32 155.312 13.698 7.959 1.00 0.00 H new ATOM 0 HB2 LYS B 32 157.808 14.892 6.660 1.00 0.00 H new ATOM 0 HB3 LYS B 32 156.789 15.795 7.763 1.00 0.00 H new ATOM 0 HG2 LYS B 32 157.160 14.136 9.555 1.00 0.00 H new ATOM 0 HG3 LYS B 32 158.030 13.084 8.457 1.00 0.00 H new ATOM 0 HD2 LYS B 32 159.713 14.289 9.709 1.00 0.00 H new ATOM 0 HD3 LYS B 32 159.714 14.982 8.099 1.00 0.00 H new ATOM 0 HE2 LYS B 32 158.470 16.927 8.814 1.00 0.00 H new ATOM 0 HE3 LYS B 32 158.002 16.173 10.325 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 159.827 17.731 10.653 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 160.340 16.152 11.008 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 160.794 16.883 9.544 1.00 0.00 H new ATOM 1882 N LYS B 33 155.388 14.742 4.835 1.00 0.00 N ATOM 1883 CA LYS B 33 154.562 15.522 3.863 1.00 0.00 C ATOM 1884 C LYS B 33 153.168 14.892 3.738 1.00 0.00 C ATOM 1885 O LYS B 33 152.168 15.582 3.710 1.00 0.00 O ATOM 1886 CB LYS B 33 155.240 15.505 2.491 1.00 0.00 C ATOM 1887 CG LYS B 33 156.557 16.284 2.554 1.00 0.00 C ATOM 1888 CD LYS B 33 157.227 16.261 1.176 1.00 0.00 C ATOM 1889 CE LYS B 33 158.546 17.036 1.227 1.00 0.00 C ATOM 1890 NZ LYS B 33 158.271 18.500 1.190 1.00 0.00 N ATOM 0 H LYS B 33 156.196 14.261 4.439 1.00 0.00 H new ATOM 0 HA LYS B 33 154.467 16.548 4.219 1.00 0.00 H new ATOM 0 HB2 LYS B 33 155.429 14.477 2.181 1.00 0.00 H new ATOM 0 HB3 LYS B 33 154.581 15.947 1.744 1.00 0.00 H new ATOM 0 HG2 LYS B 33 156.370 17.312 2.863 1.00 0.00 H new ATOM 0 HG3 LYS B 33 157.218 15.843 3.300 1.00 0.00 H new ATOM 0 HD2 LYS B 33 157.411 15.232 0.868 1.00 0.00 H new ATOM 0 HD3 LYS B 33 156.564 16.702 0.432 1.00 0.00 H new ATOM 0 HE2 LYS B 33 159.093 16.782 2.135 1.00 0.00 H new ATOM 0 HE3 LYS B 33 159.178 16.754 0.385 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 159.170 19.022 1.173 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 157.722 18.729 0.337 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 157.728 18.773 2.034 1.00 0.00 H new ATOM 1904 N LEU B 34 153.089 13.590 3.671 1.00 0.00 N ATOM 1905 CA LEU B 34 151.755 12.926 3.560 1.00 0.00 C ATOM 1906 C LEU B 34 150.918 13.244 4.808 1.00 0.00 C ATOM 1907 O LEU B 34 149.723 13.452 4.737 1.00 0.00 O ATOM 1908 CB LEU B 34 151.938 11.409 3.433 1.00 0.00 C ATOM 1909 CG LEU B 34 152.582 11.054 2.083 1.00 0.00 C ATOM 1910 CD1 LEU B 34 153.014 9.585 2.110 1.00 0.00 C ATOM 1911 CD2 LEU B 34 151.576 11.264 0.933 1.00 0.00 C ATOM 0 H LEU B 34 153.889 12.957 3.688 1.00 0.00 H new ATOM 0 HA LEU B 34 151.240 13.298 2.674 1.00 0.00 H new ATOM 0 HB2 LEU B 34 152.563 11.043 4.248 1.00 0.00 H new ATOM 0 HB3 LEU B 34 150.972 10.912 3.524 1.00 0.00 H new ATOM 0 HG LEU B 34 153.444 11.701 1.919 1.00 0.00 H new ATOM 0 HD11 LEU B 34 153.472 9.323 1.156 1.00 0.00 H new ATOM 0 HD12 LEU B 34 153.735 9.432 2.913 1.00 0.00 H new ATOM 0 HD13 LEU B 34 152.143 8.953 2.280 1.00 0.00 H new ATOM 0 HD21 LEU B 34 152.049 11.008 -0.015 1.00 0.00 H new ATOM 0 HD22 LEU B 34 150.706 10.625 1.089 1.00 0.00 H new ATOM 0 HD23 LEU B 34 151.261 12.307 0.911 1.00 0.00 H new ATOM 1923 N GLU B 35 151.547 13.263 5.946 1.00 0.00 N ATOM 1924 CA GLU B 35 150.782 13.543 7.199 1.00 0.00 C ATOM 1925 C GLU B 35 150.137 14.928 7.096 1.00 0.00 C ATOM 1926 O GLU B 35 149.008 15.132 7.497 1.00 0.00 O ATOM 1927 CB GLU B 35 151.724 13.514 8.407 1.00 0.00 C ATOM 1928 CG GLU B 35 152.210 12.084 8.655 1.00 0.00 C ATOM 1929 CD GLU B 35 153.312 12.097 9.716 1.00 0.00 C ATOM 1930 OE1 GLU B 35 153.584 13.161 10.246 1.00 0.00 O ATOM 1931 OE2 GLU B 35 153.861 11.041 9.984 1.00 0.00 O ATOM 0 H GLU B 35 152.546 13.099 6.068 1.00 0.00 H new ATOM 0 HA GLU B 35 150.013 12.782 7.327 1.00 0.00 H new ATOM 0 HB2 GLU B 35 152.576 14.171 8.231 1.00 0.00 H new ATOM 0 HB3 GLU B 35 151.208 13.890 9.290 1.00 0.00 H new ATOM 0 HG2 GLU B 35 151.380 11.459 8.985 1.00 0.00 H new ATOM 0 HG3 GLU B 35 152.587 11.651 7.729 1.00 0.00 H new ATOM 1938 N GLU B 36 150.843 15.877 6.549 1.00 0.00 N ATOM 1939 CA GLU B 36 150.281 17.249 6.399 1.00 0.00 C ATOM 1940 C GLU B 36 149.167 17.226 5.348 1.00 0.00 C ATOM 1941 O GLU B 36 148.351 18.122 5.270 1.00 0.00 O ATOM 1942 CB GLU B 36 151.387 18.209 5.957 1.00 0.00 C ATOM 1943 CG GLU B 36 152.371 18.416 7.111 1.00 0.00 C ATOM 1944 CD GLU B 36 153.480 19.375 6.673 1.00 0.00 C ATOM 1945 OE1 GLU B 36 154.413 18.918 6.032 1.00 0.00 O ATOM 1946 OE2 GLU B 36 153.379 20.549 6.987 1.00 0.00 O ATOM 0 H GLU B 36 151.793 15.761 6.196 1.00 0.00 H new ATOM 0 HA GLU B 36 149.874 17.585 7.353 1.00 0.00 H new ATOM 0 HB2 GLU B 36 151.908 17.806 5.088 1.00 0.00 H new ATOM 0 HB3 GLU B 36 150.956 19.164 5.656 1.00 0.00 H new ATOM 0 HG2 GLU B 36 151.850 18.819 7.979 1.00 0.00 H new ATOM 0 HG3 GLU B 36 152.800 17.460 7.412 1.00 0.00 H new ATOM 1953 N ARG B 37 149.154 16.217 4.522 1.00 0.00 N ATOM 1954 CA ARG B 37 148.119 16.144 3.446 1.00 0.00 C ATOM 1955 C ARG B 37 146.862 15.437 3.971 1.00 0.00 C ATOM 1956 O ARG B 37 145.871 15.337 3.276 1.00 0.00 O ATOM 1957 CB ARG B 37 148.689 15.358 2.259 1.00 0.00 C ATOM 1958 CG ARG B 37 149.833 16.138 1.592 1.00 0.00 C ATOM 1959 CD ARG B 37 149.282 17.227 0.661 1.00 0.00 C ATOM 1960 NE ARG B 37 150.409 17.804 -0.127 1.00 0.00 N ATOM 1961 CZ ARG B 37 150.169 18.525 -1.188 1.00 0.00 C ATOM 1962 NH1 ARG B 37 148.941 18.743 -1.568 1.00 0.00 N ATOM 1963 NH2 ARG B 37 151.163 19.027 -1.870 1.00 0.00 N ATOM 0 H ARG B 37 149.813 15.439 4.543 1.00 0.00 H new ATOM 0 HA ARG B 37 147.851 17.153 3.132 1.00 0.00 H new ATOM 0 HB2 ARG B 37 149.053 14.388 2.599 1.00 0.00 H new ATOM 0 HB3 ARG B 37 147.901 15.165 1.531 1.00 0.00 H new ATOM 0 HG2 ARG B 37 150.463 16.592 2.357 1.00 0.00 H new ATOM 0 HG3 ARG B 37 150.463 15.453 1.025 1.00 0.00 H new ATOM 0 HD2 ARG B 37 148.531 16.807 -0.008 1.00 0.00 H new ATOM 0 HD3 ARG B 37 148.790 18.007 1.243 1.00 0.00 H new ATOM 0 HE ARG B 37 151.372 17.634 0.165 1.00 0.00 H new ATOM 0 HH11 ARG B 37 148.165 18.350 -1.036 1.00 0.00 H new ATOM 0 HH12 ARG B 37 148.756 19.307 -2.398 1.00 0.00 H new ATOM 0 HH21 ARG B 37 152.124 18.855 -1.573 1.00 0.00 H new ATOM 0 HH22 ARG B 37 150.979 19.591 -2.700 1.00 0.00 H new ATOM 1977 N GLY B 38 146.876 14.980 5.203 1.00 0.00 N ATOM 1978 CA GLY B 38 145.655 14.320 5.782 1.00 0.00 C ATOM 1979 C GLY B 38 145.836 12.803 5.900 1.00 0.00 C ATOM 1980 O GLY B 38 144.939 12.107 6.332 1.00 0.00 O ATOM 0 H GLY B 38 147.677 15.034 5.832 1.00 0.00 H new ATOM 0 HA2 GLY B 38 145.446 14.740 6.766 1.00 0.00 H new ATOM 0 HA3 GLY B 38 144.791 14.536 5.153 1.00 0.00 H new ATOM 1984 N PHE B 39 146.981 12.281 5.543 1.00 0.00 N ATOM 1985 CA PHE B 39 147.203 10.804 5.667 1.00 0.00 C ATOM 1986 C PHE B 39 148.047 10.552 6.915 1.00 0.00 C ATOM 1987 O PHE B 39 149.234 10.301 6.840 1.00 0.00 O ATOM 1988 CB PHE B 39 147.952 10.294 4.437 1.00 0.00 C ATOM 1989 CG PHE B 39 147.101 10.491 3.206 1.00 0.00 C ATOM 1990 CD1 PHE B 39 146.183 9.509 2.821 1.00 0.00 C ATOM 1991 CD2 PHE B 39 147.226 11.662 2.459 1.00 0.00 C ATOM 1992 CE1 PHE B 39 145.390 9.701 1.684 1.00 0.00 C ATOM 1993 CE2 PHE B 39 146.434 11.858 1.324 1.00 0.00 C ATOM 1994 CZ PHE B 39 145.514 10.876 0.934 1.00 0.00 C ATOM 0 H PHE B 39 147.771 12.809 5.172 1.00 0.00 H new ATOM 0 HA PHE B 39 146.248 10.284 5.743 1.00 0.00 H new ATOM 0 HB2 PHE B 39 148.896 10.827 4.327 1.00 0.00 H new ATOM 0 HB3 PHE B 39 148.194 9.238 4.558 1.00 0.00 H new ATOM 0 HD1 PHE B 39 146.086 8.603 3.401 1.00 0.00 H new ATOM 0 HD2 PHE B 39 147.936 12.419 2.758 1.00 0.00 H new ATOM 0 HE1 PHE B 39 144.682 8.942 1.385 1.00 0.00 H new ATOM 0 HE2 PHE B 39 146.531 12.766 0.748 1.00 0.00 H new ATOM 0 HZ PHE B 39 144.902 11.025 0.057 1.00 0.00 H new ATOM 2004 N ASP B 40 147.441 10.652 8.068 1.00 0.00 N ATOM 2005 CA ASP B 40 148.204 10.459 9.332 1.00 0.00 C ATOM 2006 C ASP B 40 148.422 8.969 9.612 1.00 0.00 C ATOM 2007 O ASP B 40 149.202 8.611 10.470 1.00 0.00 O ATOM 2008 CB ASP B 40 147.412 11.073 10.488 1.00 0.00 C ATOM 2009 CG ASP B 40 146.107 10.298 10.681 1.00 0.00 C ATOM 2010 OD1 ASP B 40 145.707 9.609 9.756 1.00 0.00 O ATOM 2011 OD2 ASP B 40 145.527 10.407 11.749 1.00 0.00 O ATOM 0 H ASP B 40 146.449 10.859 8.188 1.00 0.00 H new ATOM 0 HA ASP B 40 149.176 10.943 9.234 1.00 0.00 H new ATOM 0 HB2 ASP B 40 148.003 11.044 11.403 1.00 0.00 H new ATOM 0 HB3 ASP B 40 147.197 12.121 10.280 1.00 0.00 H new ATOM 2016 N LYS B 41 147.741 8.092 8.908 1.00 0.00 N ATOM 2017 CA LYS B 41 147.924 6.624 9.158 1.00 0.00 C ATOM 2018 C LYS B 41 147.963 5.862 7.826 1.00 0.00 C ATOM 2019 O LYS B 41 147.552 6.358 6.796 1.00 0.00 O ATOM 2020 CB LYS B 41 146.795 6.114 10.055 1.00 0.00 C ATOM 2021 CG LYS B 41 146.986 6.719 11.455 1.00 0.00 C ATOM 2022 CD LYS B 41 145.894 6.231 12.416 1.00 0.00 C ATOM 2023 CE LYS B 41 146.251 4.847 12.976 1.00 0.00 C ATOM 2024 NZ LYS B 41 147.572 4.913 13.668 1.00 0.00 N ATOM 0 H LYS B 41 147.071 8.327 8.176 1.00 0.00 H new ATOM 0 HA LYS B 41 148.873 6.455 9.667 1.00 0.00 H new ATOM 0 HB2 LYS B 41 145.826 6.400 9.646 1.00 0.00 H new ATOM 0 HB3 LYS B 41 146.811 5.025 10.105 1.00 0.00 H new ATOM 0 HG2 LYS B 41 147.967 6.445 11.843 1.00 0.00 H new ATOM 0 HG3 LYS B 41 146.961 7.807 11.392 1.00 0.00 H new ATOM 0 HD2 LYS B 41 145.777 6.942 13.234 1.00 0.00 H new ATOM 0 HD3 LYS B 41 144.938 6.184 11.895 1.00 0.00 H new ATOM 0 HE2 LYS B 41 145.481 4.515 13.672 1.00 0.00 H new ATOM 0 HE3 LYS B 41 146.288 4.115 12.169 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 148.222 4.221 13.242 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 147.969 5.869 13.567 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 147.447 4.695 14.677 1.00 0.00 H new ATOM 2038 N ALA B 42 148.516 4.677 7.843 1.00 0.00 N ATOM 2039 CA ALA B 42 148.661 3.871 6.590 1.00 0.00 C ATOM 2040 C ALA B 42 147.315 3.434 5.979 1.00 0.00 C ATOM 2041 O ALA B 42 147.152 3.464 4.776 1.00 0.00 O ATOM 2042 CB ALA B 42 149.490 2.624 6.903 1.00 0.00 C ATOM 0 H ALA B 42 148.879 4.226 8.683 1.00 0.00 H new ATOM 0 HA ALA B 42 149.149 4.510 5.854 1.00 0.00 H new ATOM 0 HB1 ALA B 42 149.604 2.026 5.999 1.00 0.00 H new ATOM 0 HB2 ALA B 42 150.473 2.923 7.267 1.00 0.00 H new ATOM 0 HB3 ALA B 42 148.984 2.033 7.667 1.00 0.00 H new ATOM 2048 N TYR B 43 146.370 2.983 6.761 1.00 0.00 N ATOM 2049 CA TYR B 43 145.090 2.501 6.147 1.00 0.00 C ATOM 2050 C TYR B 43 144.428 3.595 5.302 1.00 0.00 C ATOM 2051 O TYR B 43 143.605 3.306 4.456 1.00 0.00 O ATOM 2052 CB TYR B 43 144.109 1.974 7.208 1.00 0.00 C ATOM 2053 CG TYR B 43 143.654 3.064 8.156 1.00 0.00 C ATOM 2054 CD1 TYR B 43 142.711 4.015 7.741 1.00 0.00 C ATOM 2055 CD2 TYR B 43 144.146 3.095 9.466 1.00 0.00 C ATOM 2056 CE1 TYR B 43 142.267 4.997 8.636 1.00 0.00 C ATOM 2057 CE2 TYR B 43 143.705 4.077 10.356 1.00 0.00 C ATOM 2058 CZ TYR B 43 142.765 5.028 9.944 1.00 0.00 C ATOM 2059 OH TYR B 43 142.328 5.994 10.826 1.00 0.00 O ATOM 0 H TYR B 43 146.422 2.926 7.778 1.00 0.00 H new ATOM 0 HA TYR B 43 145.349 1.671 5.490 1.00 0.00 H new ATOM 0 HB2 TYR B 43 143.241 1.539 6.714 1.00 0.00 H new ATOM 0 HB3 TYR B 43 144.586 1.175 7.777 1.00 0.00 H new ATOM 0 HD1 TYR B 43 142.327 3.990 6.732 1.00 0.00 H new ATOM 0 HD2 TYR B 43 144.867 2.359 9.789 1.00 0.00 H new ATOM 0 HE1 TYR B 43 141.541 5.730 8.317 1.00 0.00 H new ATOM 0 HE2 TYR B 43 144.090 4.102 11.365 1.00 0.00 H new ATOM 0 HH TYR B 43 142.772 5.872 11.691 1.00 0.00 H new ATOM 2069 N VAL B 44 144.783 4.837 5.485 1.00 0.00 N ATOM 2070 CA VAL B 44 144.165 5.906 4.641 1.00 0.00 C ATOM 2071 C VAL B 44 144.875 5.921 3.281 1.00 0.00 C ATOM 2072 O VAL B 44 144.288 6.198 2.252 1.00 0.00 O ATOM 2073 CB VAL B 44 144.323 7.271 5.322 1.00 0.00 C ATOM 2074 CG1 VAL B 44 143.547 8.337 4.540 1.00 0.00 C ATOM 2075 CG2 VAL B 44 143.776 7.195 6.747 1.00 0.00 C ATOM 0 H VAL B 44 145.465 5.158 6.172 1.00 0.00 H new ATOM 0 HA VAL B 44 143.102 5.705 4.509 1.00 0.00 H new ATOM 0 HB VAL B 44 145.380 7.538 5.346 1.00 0.00 H new ATOM 0 HG11 VAL B 44 143.664 9.304 5.029 1.00 0.00 H new ATOM 0 HG12 VAL B 44 143.934 8.396 3.523 1.00 0.00 H new ATOM 0 HG13 VAL B 44 142.491 8.070 4.511 1.00 0.00 H new ATOM 0 HG21 VAL B 44 143.888 8.165 7.232 1.00 0.00 H new ATOM 0 HG22 VAL B 44 142.721 6.924 6.718 1.00 0.00 H new ATOM 0 HG23 VAL B 44 144.329 6.442 7.309 1.00 0.00 H new ATOM 2085 N VAL B 45 146.147 5.618 3.289 1.00 0.00 N ATOM 2086 CA VAL B 45 146.935 5.606 2.023 1.00 0.00 C ATOM 2087 C VAL B 45 146.587 4.337 1.247 1.00 0.00 C ATOM 2088 O VAL B 45 146.418 4.362 0.044 1.00 0.00 O ATOM 2089 CB VAL B 45 148.429 5.618 2.349 1.00 0.00 C ATOM 2090 CG1 VAL B 45 149.238 5.636 1.049 1.00 0.00 C ATOM 2091 CG2 VAL B 45 148.758 6.863 3.175 1.00 0.00 C ATOM 0 H VAL B 45 146.677 5.376 4.126 1.00 0.00 H new ATOM 0 HA VAL B 45 146.697 6.486 1.425 1.00 0.00 H new ATOM 0 HB VAL B 45 148.684 4.725 2.919 1.00 0.00 H new ATOM 0 HG11 VAL B 45 150.303 5.645 1.283 1.00 0.00 H new ATOM 0 HG12 VAL B 45 149.003 4.748 0.462 1.00 0.00 H new ATOM 0 HG13 VAL B 45 148.985 6.528 0.476 1.00 0.00 H new ATOM 0 HG21 VAL B 45 149.823 6.874 3.409 1.00 0.00 H new ATOM 0 HG22 VAL B 45 148.503 7.756 2.605 1.00 0.00 H new ATOM 0 HG23 VAL B 45 148.183 6.847 4.101 1.00 0.00 H new ATOM 2101 N LEU B 46 146.437 3.232 1.926 1.00 0.00 N ATOM 2102 CA LEU B 46 146.055 1.981 1.218 1.00 0.00 C ATOM 2103 C LEU B 46 144.709 2.220 0.540 1.00 0.00 C ATOM 2104 O LEU B 46 144.457 1.762 -0.558 1.00 0.00 O ATOM 2105 CB LEU B 46 145.933 0.820 2.219 1.00 0.00 C ATOM 2106 CG LEU B 46 145.505 -0.470 1.486 1.00 0.00 C ATOM 2107 CD1 LEU B 46 146.582 -0.891 0.472 1.00 0.00 C ATOM 2108 CD2 LEU B 46 145.273 -1.602 2.502 1.00 0.00 C ATOM 0 H LEU B 46 146.562 3.143 2.934 1.00 0.00 H new ATOM 0 HA LEU B 46 146.815 1.719 0.482 1.00 0.00 H new ATOM 0 HB2 LEU B 46 146.887 0.662 2.723 1.00 0.00 H new ATOM 0 HB3 LEU B 46 145.203 1.069 2.989 1.00 0.00 H new ATOM 0 HG LEU B 46 144.576 -0.274 0.951 1.00 0.00 H new ATOM 0 HD11 LEU B 46 146.266 -1.802 -0.037 1.00 0.00 H new ATOM 0 HD12 LEU B 46 146.723 -0.096 -0.260 1.00 0.00 H new ATOM 0 HD13 LEU B 46 147.521 -1.074 0.994 1.00 0.00 H new ATOM 0 HD21 LEU B 46 144.972 -2.507 1.975 1.00 0.00 H new ATOM 0 HD22 LEU B 46 146.195 -1.792 3.052 1.00 0.00 H new ATOM 0 HD23 LEU B 46 144.488 -1.310 3.200 1.00 0.00 H new ATOM 2120 N GLY B 47 143.838 2.933 1.200 1.00 0.00 N ATOM 2121 CA GLY B 47 142.498 3.209 0.618 1.00 0.00 C ATOM 2122 C GLY B 47 142.667 3.889 -0.740 1.00 0.00 C ATOM 2123 O GLY B 47 141.976 3.579 -1.688 1.00 0.00 O ATOM 0 H GLY B 47 144.000 3.338 2.122 1.00 0.00 H new ATOM 0 HA2 GLY B 47 141.940 2.280 0.505 1.00 0.00 H new ATOM 0 HA3 GLY B 47 141.922 3.848 1.288 1.00 0.00 H new ATOM 2127 N GLN B 48 143.586 4.811 -0.847 1.00 0.00 N ATOM 2128 CA GLN B 48 143.797 5.497 -2.152 1.00 0.00 C ATOM 2129 C GLN B 48 144.181 4.452 -3.207 1.00 0.00 C ATOM 2130 O GLN B 48 143.701 4.474 -4.321 1.00 0.00 O ATOM 2131 CB GLN B 48 144.925 6.525 -2.003 1.00 0.00 C ATOM 2132 CG GLN B 48 145.101 7.311 -3.306 1.00 0.00 C ATOM 2133 CD GLN B 48 143.852 8.155 -3.570 1.00 0.00 C ATOM 2134 OE1 GLN B 48 143.255 8.680 -2.651 1.00 0.00 O ATOM 2135 NE2 GLN B 48 143.434 8.316 -4.796 1.00 0.00 N ATOM 0 H GLN B 48 144.197 5.117 -0.090 1.00 0.00 H new ATOM 0 HA GLN B 48 142.884 6.007 -2.461 1.00 0.00 H new ATOM 0 HB2 GLN B 48 144.698 7.209 -1.185 1.00 0.00 H new ATOM 0 HB3 GLN B 48 145.856 6.019 -1.746 1.00 0.00 H new ATOM 0 HG2 GLN B 48 145.979 7.954 -3.239 1.00 0.00 H new ATOM 0 HG3 GLN B 48 145.271 6.625 -4.136 1.00 0.00 H new ATOM 0 HE21 GLN B 48 143.935 7.875 -5.568 1.00 0.00 H new ATOM 0 HE22 GLN B 48 142.606 8.882 -4.982 1.00 0.00 H new ATOM 2144 N PHE B 49 145.038 3.532 -2.857 1.00 0.00 N ATOM 2145 CA PHE B 49 145.457 2.478 -3.828 1.00 0.00 C ATOM 2146 C PHE B 49 144.221 1.682 -4.268 1.00 0.00 C ATOM 2147 O PHE B 49 144.071 1.325 -5.419 1.00 0.00 O ATOM 2148 CB PHE B 49 146.462 1.552 -3.132 1.00 0.00 C ATOM 2149 CG PHE B 49 146.986 0.512 -4.098 1.00 0.00 C ATOM 2150 CD1 PHE B 49 147.723 0.912 -5.221 1.00 0.00 C ATOM 2151 CD2 PHE B 49 146.756 -0.852 -3.863 1.00 0.00 C ATOM 2152 CE1 PHE B 49 148.225 -0.047 -6.106 1.00 0.00 C ATOM 2153 CE2 PHE B 49 147.258 -1.809 -4.753 1.00 0.00 C ATOM 2154 CZ PHE B 49 147.993 -1.406 -5.873 1.00 0.00 C ATOM 0 H PHE B 49 145.469 3.464 -1.935 1.00 0.00 H new ATOM 0 HA PHE B 49 145.920 2.926 -4.707 1.00 0.00 H new ATOM 0 HB2 PHE B 49 147.291 2.138 -2.736 1.00 0.00 H new ATOM 0 HB3 PHE B 49 145.985 1.061 -2.284 1.00 0.00 H new ATOM 0 HD1 PHE B 49 147.903 1.961 -5.403 1.00 0.00 H new ATOM 0 HD2 PHE B 49 146.192 -1.163 -2.996 1.00 0.00 H new ATOM 0 HE1 PHE B 49 148.793 0.262 -6.971 1.00 0.00 H new ATOM 0 HE2 PHE B 49 147.078 -2.859 -4.575 1.00 0.00 H new ATOM 0 HZ PHE B 49 148.381 -2.145 -6.558 1.00 0.00 H new ATOM 2164 N LEU B 50 143.349 1.406 -3.351 1.00 0.00 N ATOM 2165 CA LEU B 50 142.123 0.630 -3.704 1.00 0.00 C ATOM 2166 C LEU B 50 141.216 1.505 -4.580 1.00 0.00 C ATOM 2167 O LEU B 50 140.592 1.035 -5.512 1.00 0.00 O ATOM 2168 CB LEU B 50 141.385 0.227 -2.422 1.00 0.00 C ATOM 2169 CG LEU B 50 142.300 -0.644 -1.542 1.00 0.00 C ATOM 2170 CD1 LEU B 50 141.573 -1.004 -0.234 1.00 0.00 C ATOM 2171 CD2 LEU B 50 142.687 -1.934 -2.293 1.00 0.00 C ATOM 0 H LEU B 50 143.425 1.680 -2.371 1.00 0.00 H new ATOM 0 HA LEU B 50 142.397 -0.272 -4.251 1.00 0.00 H new ATOM 0 HB2 LEU B 50 141.079 1.118 -1.873 1.00 0.00 H new ATOM 0 HB3 LEU B 50 140.477 -0.322 -2.672 1.00 0.00 H new ATOM 0 HG LEU B 50 143.206 -0.084 -1.310 1.00 0.00 H new ATOM 0 HD11 LEU B 50 142.224 -1.620 0.386 1.00 0.00 H new ATOM 0 HD12 LEU B 50 141.318 -0.091 0.304 1.00 0.00 H new ATOM 0 HD13 LEU B 50 140.662 -1.556 -0.464 1.00 0.00 H new ATOM 0 HD21 LEU B 50 143.334 -2.542 -1.661 1.00 0.00 H new ATOM 0 HD22 LEU B 50 141.786 -2.497 -2.538 1.00 0.00 H new ATOM 0 HD23 LEU B 50 143.215 -1.676 -3.211 1.00 0.00 H new ATOM 2183 N VAL B 51 141.132 2.769 -4.277 1.00 0.00 N ATOM 2184 CA VAL B 51 140.260 3.688 -5.071 1.00 0.00 C ATOM 2185 C VAL B 51 140.807 3.855 -6.500 1.00 0.00 C ATOM 2186 O VAL B 51 140.087 4.227 -7.406 1.00 0.00 O ATOM 2187 CB VAL B 51 140.207 5.053 -4.374 1.00 0.00 C ATOM 2188 CG1 VAL B 51 139.517 6.081 -5.277 1.00 0.00 C ATOM 2189 CG2 VAL B 51 139.419 4.922 -3.069 1.00 0.00 C ATOM 0 H VAL B 51 141.633 3.212 -3.507 1.00 0.00 H new ATOM 0 HA VAL B 51 139.258 3.263 -5.134 1.00 0.00 H new ATOM 0 HB VAL B 51 141.224 5.386 -4.166 1.00 0.00 H new ATOM 0 HG11 VAL B 51 139.485 7.046 -4.771 1.00 0.00 H new ATOM 0 HG12 VAL B 51 140.073 6.178 -6.209 1.00 0.00 H new ATOM 0 HG13 VAL B 51 138.501 5.751 -5.493 1.00 0.00 H new ATOM 0 HG21 VAL B 51 139.379 5.890 -2.570 1.00 0.00 H new ATOM 0 HG22 VAL B 51 138.406 4.584 -3.288 1.00 0.00 H new ATOM 0 HG23 VAL B 51 139.910 4.198 -2.418 1.00 0.00 H new ATOM 2199 N LEU B 52 142.074 3.612 -6.701 1.00 0.00 N ATOM 2200 CA LEU B 52 142.669 3.792 -8.067 1.00 0.00 C ATOM 2201 C LEU B 52 142.581 2.492 -8.877 1.00 0.00 C ATOM 2202 O LEU B 52 143.207 2.364 -9.911 1.00 0.00 O ATOM 2203 CB LEU B 52 144.133 4.202 -7.919 1.00 0.00 C ATOM 2204 CG LEU B 52 144.222 5.587 -7.263 1.00 0.00 C ATOM 2205 CD1 LEU B 52 145.681 5.869 -6.898 1.00 0.00 C ATOM 2206 CD2 LEU B 52 143.708 6.679 -8.227 1.00 0.00 C ATOM 0 H LEU B 52 142.726 3.297 -5.983 1.00 0.00 H new ATOM 0 HA LEU B 52 142.111 4.564 -8.597 1.00 0.00 H new ATOM 0 HB2 LEU B 52 144.666 3.468 -7.314 1.00 0.00 H new ATOM 0 HB3 LEU B 52 144.615 4.221 -8.896 1.00 0.00 H new ATOM 0 HG LEU B 52 143.602 5.599 -6.367 1.00 0.00 H new ATOM 0 HD11 LEU B 52 145.756 6.851 -6.431 1.00 0.00 H new ATOM 0 HD12 LEU B 52 146.036 5.108 -6.202 1.00 0.00 H new ATOM 0 HD13 LEU B 52 146.292 5.849 -7.800 1.00 0.00 H new ATOM 0 HD21 LEU B 52 143.779 7.654 -7.744 1.00 0.00 H new ATOM 0 HD22 LEU B 52 144.313 6.678 -9.134 1.00 0.00 H new ATOM 0 HD23 LEU B 52 142.668 6.477 -8.485 1.00 0.00 H new ATOM 2218 N LYS B 53 141.810 1.534 -8.445 1.00 0.00 N ATOM 2219 CA LYS B 53 141.693 0.267 -9.224 1.00 0.00 C ATOM 2220 C LYS B 53 143.090 -0.252 -9.596 1.00 0.00 C ATOM 2221 O LYS B 53 143.302 -0.753 -10.681 1.00 0.00 O ATOM 2222 CB LYS B 53 140.905 0.531 -10.510 1.00 0.00 C ATOM 2223 CG LYS B 53 139.506 1.042 -10.163 1.00 0.00 C ATOM 2224 CD LYS B 53 138.726 1.302 -11.454 1.00 0.00 C ATOM 2225 CE LYS B 53 137.330 1.823 -11.113 1.00 0.00 C ATOM 2226 NZ LYS B 53 137.438 3.220 -10.605 1.00 0.00 N ATOM 0 H LYS B 53 141.257 1.572 -7.589 1.00 0.00 H new ATOM 0 HA LYS B 53 141.178 -0.476 -8.615 1.00 0.00 H new ATOM 0 HB2 LYS B 53 141.428 1.264 -11.124 1.00 0.00 H new ATOM 0 HB3 LYS B 53 140.833 -0.384 -11.098 1.00 0.00 H new ATOM 0 HG2 LYS B 53 138.981 0.310 -9.549 1.00 0.00 H new ATOM 0 HG3 LYS B 53 139.576 1.958 -9.577 1.00 0.00 H new ATOM 0 HD2 LYS B 53 139.256 2.028 -12.071 1.00 0.00 H new ATOM 0 HD3 LYS B 53 138.650 0.384 -12.036 1.00 0.00 H new ATOM 0 HE2 LYS B 53 136.692 1.793 -11.996 1.00 0.00 H new ATOM 0 HE3 LYS B 53 136.864 1.185 -10.362 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 136.496 3.660 -10.596 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 137.824 3.209 -9.639 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 138.070 3.767 -11.224 1.00 0.00 H new ATOM 2240 N LYS B 54 144.038 -0.147 -8.698 1.00 0.00 N ATOM 2241 CA LYS B 54 145.425 -0.643 -8.972 1.00 0.00 C ATOM 2242 C LYS B 54 146.034 0.081 -10.182 1.00 0.00 C ATOM 2243 O LYS B 54 146.987 -0.395 -10.767 1.00 0.00 O ATOM 2244 CB LYS B 54 145.381 -2.150 -9.264 1.00 0.00 C ATOM 2245 CG LYS B 54 144.491 -2.871 -8.240 1.00 0.00 C ATOM 2246 CD LYS B 54 145.062 -2.712 -6.828 1.00 0.00 C ATOM 2247 CE LYS B 54 144.284 -3.612 -5.866 1.00 0.00 C ATOM 2248 NZ LYS B 54 144.733 -3.352 -4.470 1.00 0.00 N ATOM 0 H LYS B 54 143.909 0.266 -7.774 1.00 0.00 H new ATOM 0 HA LYS B 54 146.041 -0.446 -8.095 1.00 0.00 H new ATOM 0 HB2 LYS B 54 144.999 -2.320 -10.270 1.00 0.00 H new ATOM 0 HB3 LYS B 54 146.390 -2.562 -9.232 1.00 0.00 H new ATOM 0 HG2 LYS B 54 143.480 -2.465 -8.278 1.00 0.00 H new ATOM 0 HG3 LYS B 54 144.419 -3.929 -8.493 1.00 0.00 H new ATOM 0 HD2 LYS B 54 146.119 -2.977 -6.818 1.00 0.00 H new ATOM 0 HD3 LYS B 54 144.991 -1.672 -6.509 1.00 0.00 H new ATOM 0 HE2 LYS B 54 143.215 -3.421 -5.957 1.00 0.00 H new ATOM 0 HE3 LYS B 54 144.444 -4.660 -6.122 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 143.915 -3.395 -3.829 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 145.430 -4.071 -4.190 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 145.167 -2.409 -4.415 1.00 0.00 H new ATOM 2262 N ASP B 55 145.532 1.227 -10.560 1.00 0.00 N ATOM 2263 CA ASP B 55 146.154 1.938 -11.720 1.00 0.00 C ATOM 2264 C ASP B 55 147.567 2.381 -11.309 1.00 0.00 C ATOM 2265 O ASP B 55 147.740 3.282 -10.512 1.00 0.00 O ATOM 2266 CB ASP B 55 145.309 3.160 -12.092 1.00 0.00 C ATOM 2267 CG ASP B 55 144.084 2.710 -12.893 1.00 0.00 C ATOM 2268 OD1 ASP B 55 144.236 1.832 -13.727 1.00 0.00 O ATOM 2269 OD2 ASP B 55 143.015 3.250 -12.657 1.00 0.00 O ATOM 0 H ASP B 55 144.735 1.695 -10.128 1.00 0.00 H new ATOM 0 HA ASP B 55 146.206 1.277 -12.585 1.00 0.00 H new ATOM 0 HB2 ASP B 55 144.994 3.686 -11.191 1.00 0.00 H new ATOM 0 HB3 ASP B 55 145.903 3.861 -12.679 1.00 0.00 H new ATOM 2274 N GLU B 56 148.574 1.726 -11.825 1.00 0.00 N ATOM 2275 CA GLU B 56 149.986 2.062 -11.454 1.00 0.00 C ATOM 2276 C GLU B 56 150.378 3.486 -11.870 1.00 0.00 C ATOM 2277 O GLU B 56 151.064 4.178 -11.149 1.00 0.00 O ATOM 2278 CB GLU B 56 150.924 1.069 -12.148 1.00 0.00 C ATOM 2279 CG GLU B 56 152.379 1.375 -11.775 1.00 0.00 C ATOM 2280 CD GLU B 56 153.292 0.290 -12.346 1.00 0.00 C ATOM 2281 OE1 GLU B 56 152.777 -0.616 -12.981 1.00 0.00 O ATOM 2282 OE2 GLU B 56 154.490 0.383 -12.141 1.00 0.00 O ATOM 0 H GLU B 56 148.480 0.963 -12.496 1.00 0.00 H new ATOM 0 HA GLU B 56 150.070 2.000 -10.369 1.00 0.00 H new ATOM 0 HB2 GLU B 56 150.671 0.050 -11.854 1.00 0.00 H new ATOM 0 HB3 GLU B 56 150.796 1.130 -13.229 1.00 0.00 H new ATOM 0 HG2 GLU B 56 152.668 2.351 -12.166 1.00 0.00 H new ATOM 0 HG3 GLU B 56 152.486 1.421 -10.691 1.00 0.00 H new ATOM 2289 N ASP B 57 149.977 3.924 -13.028 1.00 0.00 N ATOM 2290 CA ASP B 57 150.364 5.294 -13.484 1.00 0.00 C ATOM 2291 C ASP B 57 149.650 6.348 -12.642 1.00 0.00 C ATOM 2292 O ASP B 57 150.215 7.363 -12.285 1.00 0.00 O ATOM 2293 CB ASP B 57 149.973 5.461 -14.952 1.00 0.00 C ATOM 2294 CG ASP B 57 150.877 4.588 -15.822 1.00 0.00 C ATOM 2295 OD1 ASP B 57 151.930 4.201 -15.343 1.00 0.00 O ATOM 2296 OD2 ASP B 57 150.503 4.319 -16.951 1.00 0.00 O ATOM 0 H ASP B 57 149.398 3.396 -13.681 1.00 0.00 H new ATOM 0 HA ASP B 57 151.440 5.422 -13.370 1.00 0.00 H new ATOM 0 HB2 ASP B 57 148.930 5.180 -15.096 1.00 0.00 H new ATOM 0 HB3 ASP B 57 150.065 6.506 -15.247 1.00 0.00 H new ATOM 2301 N LEU B 58 148.422 6.114 -12.320 1.00 0.00 N ATOM 2302 CA LEU B 58 147.691 7.112 -11.493 1.00 0.00 C ATOM 2303 C LEU B 58 148.265 7.103 -10.077 1.00 0.00 C ATOM 2304 O LEU B 58 148.426 8.136 -9.457 1.00 0.00 O ATOM 2305 CB LEU B 58 146.196 6.779 -11.454 1.00 0.00 C ATOM 2306 CG LEU B 58 145.560 7.038 -12.830 1.00 0.00 C ATOM 2307 CD1 LEU B 58 144.112 6.535 -12.815 1.00 0.00 C ATOM 2308 CD2 LEU B 58 145.582 8.547 -13.162 1.00 0.00 C ATOM 0 H LEU B 58 147.890 5.286 -12.587 1.00 0.00 H new ATOM 0 HA LEU B 58 147.812 8.102 -11.932 1.00 0.00 H new ATOM 0 HB2 LEU B 58 146.055 5.736 -11.170 1.00 0.00 H new ATOM 0 HB3 LEU B 58 145.700 7.385 -10.696 1.00 0.00 H new ATOM 0 HG LEU B 58 146.131 6.508 -13.592 1.00 0.00 H new ATOM 0 HD11 LEU B 58 143.654 6.715 -13.788 1.00 0.00 H new ATOM 0 HD12 LEU B 58 144.100 5.466 -12.601 1.00 0.00 H new ATOM 0 HD13 LEU B 58 143.551 7.065 -12.046 1.00 0.00 H new ATOM 0 HD21 LEU B 58 145.128 8.711 -14.139 1.00 0.00 H new ATOM 0 HD22 LEU B 58 145.021 9.094 -12.405 1.00 0.00 H new ATOM 0 HD23 LEU B 58 146.613 8.901 -13.177 1.00 0.00 H new ATOM 2320 N PHE B 59 148.597 5.950 -9.567 1.00 0.00 N ATOM 2321 CA PHE B 59 149.186 5.886 -8.200 1.00 0.00 C ATOM 2322 C PHE B 59 150.531 6.616 -8.176 1.00 0.00 C ATOM 2323 O PHE B 59 150.794 7.426 -7.311 1.00 0.00 O ATOM 2324 CB PHE B 59 149.388 4.421 -7.799 1.00 0.00 C ATOM 2325 CG PHE B 59 150.096 4.354 -6.464 1.00 0.00 C ATOM 2326 CD1 PHE B 59 149.397 4.645 -5.287 1.00 0.00 C ATOM 2327 CD2 PHE B 59 151.451 3.995 -6.404 1.00 0.00 C ATOM 2328 CE1 PHE B 59 150.051 4.579 -4.049 1.00 0.00 C ATOM 2329 CE2 PHE B 59 152.104 3.929 -5.166 1.00 0.00 C ATOM 2330 CZ PHE B 59 151.404 4.222 -3.989 1.00 0.00 C ATOM 0 H PHE B 59 148.486 5.051 -10.036 1.00 0.00 H new ATOM 0 HA PHE B 59 148.508 6.367 -7.495 1.00 0.00 H new ATOM 0 HB2 PHE B 59 148.425 3.914 -7.737 1.00 0.00 H new ATOM 0 HB3 PHE B 59 149.973 3.903 -8.559 1.00 0.00 H new ATOM 0 HD1 PHE B 59 148.354 4.920 -5.333 1.00 0.00 H new ATOM 0 HD2 PHE B 59 151.991 3.770 -7.312 1.00 0.00 H new ATOM 0 HE1 PHE B 59 149.511 4.804 -3.141 1.00 0.00 H new ATOM 0 HE2 PHE B 59 153.147 3.652 -5.120 1.00 0.00 H new ATOM 0 HZ PHE B 59 151.908 4.173 -3.035 1.00 0.00 H new ATOM 2340 N ARG B 60 151.397 6.307 -9.107 1.00 0.00 N ATOM 2341 CA ARG B 60 152.739 6.954 -9.121 1.00 0.00 C ATOM 2342 C ARG B 60 152.610 8.469 -9.294 1.00 0.00 C ATOM 2343 O ARG B 60 153.253 9.234 -8.602 1.00 0.00 O ATOM 2344 CB ARG B 60 153.567 6.386 -10.274 1.00 0.00 C ATOM 2345 CG ARG B 60 153.924 4.927 -9.981 1.00 0.00 C ATOM 2346 CD ARG B 60 154.817 4.391 -11.100 1.00 0.00 C ATOM 2347 NE ARG B 60 154.121 4.532 -12.408 1.00 0.00 N ATOM 2348 CZ ARG B 60 154.803 4.457 -13.517 1.00 0.00 C ATOM 2349 NH1 ARG B 60 156.089 4.243 -13.477 1.00 0.00 N ATOM 2350 NH2 ARG B 60 154.201 4.599 -14.664 1.00 0.00 N ATOM 0 H ARG B 60 151.231 5.635 -9.856 1.00 0.00 H new ATOM 0 HA ARG B 60 153.231 6.750 -8.170 1.00 0.00 H new ATOM 0 HB2 ARG B 60 153.005 6.453 -11.206 1.00 0.00 H new ATOM 0 HB3 ARG B 60 154.476 6.974 -10.406 1.00 0.00 H new ATOM 0 HG2 ARG B 60 154.438 4.852 -9.023 1.00 0.00 H new ATOM 0 HG3 ARG B 60 153.017 4.327 -9.905 1.00 0.00 H new ATOM 0 HD2 ARG B 60 155.760 4.937 -11.118 1.00 0.00 H new ATOM 0 HD3 ARG B 60 155.058 3.344 -10.916 1.00 0.00 H new ATOM 0 HE ARG B 60 153.113 4.687 -12.437 1.00 0.00 H new ATOM 0 HH11 ARG B 60 156.560 4.134 -12.579 1.00 0.00 H new ATOM 0 HH12 ARG B 60 156.623 4.184 -14.344 1.00 0.00 H new ATOM 0 HH21 ARG B 60 153.196 4.769 -14.695 1.00 0.00 H new ATOM 0 HH22 ARG B 60 154.735 4.540 -15.531 1.00 0.00 H new ATOM 2364 N GLU B 61 151.792 8.918 -10.208 1.00 0.00 N ATOM 2365 CA GLU B 61 151.638 10.385 -10.410 1.00 0.00 C ATOM 2366 C GLU B 61 151.077 11.003 -9.129 1.00 0.00 C ATOM 2367 O GLU B 61 151.437 12.098 -8.744 1.00 0.00 O ATOM 2368 CB GLU B 61 150.678 10.636 -11.578 1.00 0.00 C ATOM 2369 CG GLU B 61 150.505 12.142 -11.804 1.00 0.00 C ATOM 2370 CD GLU B 61 149.544 12.374 -12.973 1.00 0.00 C ATOM 2371 OE1 GLU B 61 149.219 11.410 -13.646 1.00 0.00 O ATOM 2372 OE2 GLU B 61 149.155 13.512 -13.176 1.00 0.00 O ATOM 0 H GLU B 61 151.225 8.332 -10.822 1.00 0.00 H new ATOM 0 HA GLU B 61 152.603 10.837 -10.639 1.00 0.00 H new ATOM 0 HB2 GLU B 61 151.064 10.167 -12.483 1.00 0.00 H new ATOM 0 HB3 GLU B 61 149.711 10.178 -11.369 1.00 0.00 H new ATOM 0 HG2 GLU B 61 150.118 12.614 -10.901 1.00 0.00 H new ATOM 0 HG3 GLU B 61 151.470 12.602 -12.015 1.00 0.00 H new ATOM 2379 N TRP B 62 150.201 10.308 -8.466 1.00 0.00 N ATOM 2380 CA TRP B 62 149.614 10.848 -7.209 1.00 0.00 C ATOM 2381 C TRP B 62 150.691 11.024 -6.133 1.00 0.00 C ATOM 2382 O TRP B 62 150.755 12.033 -5.463 1.00 0.00 O ATOM 2383 CB TRP B 62 148.551 9.868 -6.694 1.00 0.00 C ATOM 2384 CG TRP B 62 148.131 10.243 -5.302 1.00 0.00 C ATOM 2385 CD1 TRP B 62 147.199 11.172 -4.990 1.00 0.00 C ATOM 2386 CD2 TRP B 62 148.628 9.718 -4.036 1.00 0.00 C ATOM 2387 NE1 TRP B 62 147.084 11.243 -3.611 1.00 0.00 N ATOM 2388 CE2 TRP B 62 147.946 10.366 -2.980 1.00 0.00 C ATOM 2389 CE3 TRP B 62 149.595 8.748 -3.704 1.00 0.00 C ATOM 2390 CZ2 TRP B 62 148.211 10.063 -1.641 1.00 0.00 C ATOM 2391 CZ3 TRP B 62 149.864 8.442 -2.360 1.00 0.00 C ATOM 2392 CH2 TRP B 62 149.172 9.097 -1.332 1.00 0.00 C ATOM 0 H TRP B 62 149.864 9.385 -8.740 1.00 0.00 H new ATOM 0 HA TRP B 62 149.170 11.821 -7.421 1.00 0.00 H new ATOM 0 HB2 TRP B 62 147.686 9.877 -7.357 1.00 0.00 H new ATOM 0 HB3 TRP B 62 148.948 8.853 -6.701 1.00 0.00 H new ATOM 0 HD1 TRP B 62 146.637 11.762 -5.699 1.00 0.00 H new ATOM 0 HE1 TRP B 62 146.442 11.866 -3.121 1.00 0.00 H new ATOM 0 HE3 TRP B 62 150.133 8.236 -4.489 1.00 0.00 H new ATOM 0 HZ2 TRP B 62 147.677 10.572 -0.852 1.00 0.00 H new ATOM 0 HZ3 TRP B 62 150.608 7.698 -2.117 1.00 0.00 H new ATOM 0 HH2 TRP B 62 149.382 8.855 -0.301 1.00 0.00 H new ATOM 2403 N LEU B 63 151.521 10.042 -5.950 1.00 0.00 N ATOM 2404 CA LEU B 63 152.573 10.136 -4.900 1.00 0.00 C ATOM 2405 C LEU B 63 153.633 11.181 -5.271 1.00 0.00 C ATOM 2406 O LEU B 63 154.005 12.010 -4.466 1.00 0.00 O ATOM 2407 CB LEU B 63 153.229 8.758 -4.749 1.00 0.00 C ATOM 2408 CG LEU B 63 154.326 8.790 -3.678 1.00 0.00 C ATOM 2409 CD1 LEU B 63 153.730 9.176 -2.314 1.00 0.00 C ATOM 2410 CD2 LEU B 63 154.967 7.400 -3.585 1.00 0.00 C ATOM 0 H LEU B 63 151.519 9.173 -6.484 1.00 0.00 H new ATOM 0 HA LEU B 63 152.116 10.447 -3.960 1.00 0.00 H new ATOM 0 HB2 LEU B 63 152.474 8.019 -4.481 1.00 0.00 H new ATOM 0 HB3 LEU B 63 153.655 8.447 -5.703 1.00 0.00 H new ATOM 0 HG LEU B 63 155.077 9.531 -3.951 1.00 0.00 H new ATOM 0 HD11 LEU B 63 154.520 9.195 -1.564 1.00 0.00 H new ATOM 0 HD12 LEU B 63 153.272 10.163 -2.383 1.00 0.00 H new ATOM 0 HD13 LEU B 63 152.974 8.445 -2.027 1.00 0.00 H new ATOM 0 HD21 LEU B 63 155.749 7.410 -2.826 1.00 0.00 H new ATOM 0 HD22 LEU B 63 154.208 6.667 -3.314 1.00 0.00 H new ATOM 0 HD23 LEU B 63 155.400 7.134 -4.549 1.00 0.00 H new ATOM 2422 N LYS B 64 154.134 11.139 -6.472 1.00 0.00 N ATOM 2423 CA LYS B 64 155.183 12.119 -6.881 1.00 0.00 C ATOM 2424 C LYS B 64 154.642 13.547 -6.806 1.00 0.00 C ATOM 2425 O LYS B 64 155.265 14.430 -6.251 1.00 0.00 O ATOM 2426 CB LYS B 64 155.651 11.814 -8.307 1.00 0.00 C ATOM 2427 CG LYS B 64 156.797 12.757 -8.684 1.00 0.00 C ATOM 2428 CD LYS B 64 157.270 12.441 -10.103 1.00 0.00 C ATOM 2429 CE LYS B 64 158.392 13.406 -10.495 1.00 0.00 C ATOM 2430 NZ LYS B 64 157.811 14.747 -10.787 1.00 0.00 N ATOM 0 H LYS B 64 153.864 10.468 -7.191 1.00 0.00 H new ATOM 0 HA LYS B 64 156.027 12.031 -6.197 1.00 0.00 H new ATOM 0 HB2 LYS B 64 155.981 10.778 -8.378 1.00 0.00 H new ATOM 0 HB3 LYS B 64 154.823 11.934 -9.006 1.00 0.00 H new ATOM 0 HG2 LYS B 64 156.465 13.793 -8.622 1.00 0.00 H new ATOM 0 HG3 LYS B 64 157.622 12.644 -7.980 1.00 0.00 H new ATOM 0 HD2 LYS B 64 157.625 11.412 -10.158 1.00 0.00 H new ATOM 0 HD3 LYS B 64 156.439 12.529 -10.803 1.00 0.00 H new ATOM 0 HE2 LYS B 64 159.121 13.481 -9.688 1.00 0.00 H new ATOM 0 HE3 LYS B 64 158.922 13.029 -11.369 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 158.529 15.344 -11.245 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 156.994 14.641 -11.421 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 157.505 15.193 -9.899 1.00 0.00 H new ATOM 2444 N ASP B 65 153.493 13.785 -7.372 1.00 0.00 N ATOM 2445 CA ASP B 65 152.919 15.160 -7.345 1.00 0.00 C ATOM 2446 C ASP B 65 152.482 15.516 -5.925 1.00 0.00 C ATOM 2447 O ASP B 65 152.411 16.674 -5.562 1.00 0.00 O ATOM 2448 CB ASP B 65 151.714 15.230 -8.286 1.00 0.00 C ATOM 2449 CG ASP B 65 152.195 15.140 -9.735 1.00 0.00 C ATOM 2450 OD1 ASP B 65 153.227 15.716 -10.033 1.00 0.00 O ATOM 2451 OD2 ASP B 65 151.523 14.492 -10.522 1.00 0.00 O ATOM 0 H ASP B 65 152.925 13.087 -7.853 1.00 0.00 H new ATOM 0 HA ASP B 65 153.678 15.870 -7.672 1.00 0.00 H new ATOM 0 HB2 ASP B 65 151.022 14.416 -8.070 1.00 0.00 H new ATOM 0 HB3 ASP B 65 151.170 16.161 -8.129 1.00 0.00 H new ATOM 2456 N THR B 66 152.162 14.538 -5.122 1.00 0.00 N ATOM 2457 CA THR B 66 151.700 14.831 -3.736 1.00 0.00 C ATOM 2458 C THR B 66 152.888 15.112 -2.813 1.00 0.00 C ATOM 2459 O THR B 66 152.768 15.899 -1.894 1.00 0.00 O ATOM 2460 CB THR B 66 150.901 13.635 -3.203 1.00 0.00 C ATOM 2461 OG1 THR B 66 149.712 13.492 -3.965 1.00 0.00 O ATOM 2462 CG2 THR B 66 150.532 13.864 -1.735 1.00 0.00 C ATOM 0 H THR B 66 152.201 13.548 -5.366 1.00 0.00 H new ATOM 0 HA THR B 66 151.067 15.718 -3.759 1.00 0.00 H new ATOM 0 HB THR B 66 151.508 12.733 -3.284 1.00 0.00 H new ATOM 0 HG1 THR B 66 149.919 13.048 -4.814 1.00 0.00 H new ATOM 0 HG21 THR B 66 149.965 13.010 -1.365 1.00 0.00 H new ATOM 0 HG22 THR B 66 151.441 13.979 -1.145 1.00 0.00 H new ATOM 0 HG23 THR B 66 149.927 14.766 -1.648 1.00 0.00 H new ATOM 2470 N CYS B 67 154.021 14.466 -3.003 1.00 0.00 N ATOM 2471 CA CYS B 67 155.185 14.695 -2.083 1.00 0.00 C ATOM 2472 C CYS B 67 156.474 14.977 -2.860 1.00 0.00 C ATOM 2473 O CYS B 67 157.336 15.701 -2.401 1.00 0.00 O ATOM 2474 CB CYS B 67 155.392 13.443 -1.231 1.00 0.00 C ATOM 2475 SG CYS B 67 155.871 12.062 -2.300 1.00 0.00 S ATOM 0 H CYS B 67 154.187 13.794 -3.752 1.00 0.00 H new ATOM 0 HA CYS B 67 154.962 15.563 -1.463 1.00 0.00 H new ATOM 0 HB2 CYS B 67 156.164 13.623 -0.482 1.00 0.00 H new ATOM 0 HB3 CYS B 67 154.476 13.200 -0.693 1.00 0.00 H new ATOM 0 HG CYS B 67 155.271 12.174 -3.448 1.00 0.00 H new ATOM 2481 N GLY B 68 156.621 14.399 -4.029 1.00 0.00 N ATOM 2482 CA GLY B 68 157.863 14.612 -4.840 1.00 0.00 C ATOM 2483 C GLY B 68 158.702 13.331 -4.823 1.00 0.00 C ATOM 2484 O GLY B 68 159.870 13.341 -5.159 1.00 0.00 O ATOM 0 H GLY B 68 155.929 13.785 -4.459 1.00 0.00 H new ATOM 0 HA2 GLY B 68 157.602 14.876 -5.865 1.00 0.00 H new ATOM 0 HA3 GLY B 68 158.439 15.443 -4.434 1.00 0.00 H new ATOM 2488 N ALA B 69 158.120 12.226 -4.435 1.00 0.00 N ATOM 2489 CA ALA B 69 158.887 10.946 -4.398 1.00 0.00 C ATOM 2490 C ALA B 69 159.573 10.721 -5.747 1.00 0.00 C ATOM 2491 O ALA B 69 159.118 11.190 -6.771 1.00 0.00 O ATOM 2492 CB ALA B 69 157.933 9.784 -4.112 1.00 0.00 C ATOM 0 H ALA B 69 157.146 12.155 -4.142 1.00 0.00 H new ATOM 0 HA ALA B 69 159.640 10.999 -3.612 1.00 0.00 H new ATOM 0 HB1 ALA B 69 158.495 8.850 -4.085 1.00 0.00 H new ATOM 0 HB2 ALA B 69 157.446 9.942 -3.150 1.00 0.00 H new ATOM 0 HB3 ALA B 69 157.178 9.731 -4.897 1.00 0.00 H new ATOM 2498 N ASN B 70 160.671 10.009 -5.756 1.00 0.00 N ATOM 2499 CA ASN B 70 161.397 9.759 -7.038 1.00 0.00 C ATOM 2500 C ASN B 70 160.926 8.445 -7.665 1.00 0.00 C ATOM 2501 O ASN B 70 160.171 7.694 -7.079 1.00 0.00 O ATOM 2502 CB ASN B 70 162.900 9.687 -6.760 1.00 0.00 C ATOM 2503 CG ASN B 70 163.414 11.081 -6.397 1.00 0.00 C ATOM 2504 OD1 ASN B 70 162.796 12.073 -6.728 1.00 0.00 O ATOM 2505 ND2 ASN B 70 164.527 11.202 -5.727 1.00 0.00 N ATOM 0 H ASN B 70 161.097 9.589 -4.930 1.00 0.00 H new ATOM 0 HA ASN B 70 161.189 10.573 -7.732 1.00 0.00 H new ATOM 0 HB2 ASN B 70 163.098 8.990 -5.945 1.00 0.00 H new ATOM 0 HB3 ASN B 70 163.426 9.310 -7.637 1.00 0.00 H new ATOM 0 HD21 ASN B 70 164.877 12.128 -5.482 1.00 0.00 H new ATOM 0 HD22 ASN B 70 165.047 10.370 -5.448 1.00 0.00 H new ATOM 2512 N ALA B 71 161.359 8.177 -8.866 1.00 0.00 N ATOM 2513 CA ALA B 71 160.936 6.931 -9.566 1.00 0.00 C ATOM 2514 C ALA B 71 161.355 5.690 -8.774 1.00 0.00 C ATOM 2515 O ALA B 71 160.658 4.699 -8.760 1.00 0.00 O ATOM 2516 CB ALA B 71 161.582 6.884 -10.952 1.00 0.00 C ATOM 0 H ALA B 71 161.994 8.773 -9.397 1.00 0.00 H new ATOM 0 HA ALA B 71 159.850 6.937 -9.656 1.00 0.00 H new ATOM 0 HB1 ALA B 71 161.274 5.974 -11.466 1.00 0.00 H new ATOM 0 HB2 ALA B 71 161.266 7.752 -11.530 1.00 0.00 H new ATOM 0 HB3 ALA B 71 162.667 6.893 -10.848 1.00 0.00 H new ATOM 2522 N LYS B 72 162.489 5.714 -8.126 1.00 0.00 N ATOM 2523 CA LYS B 72 162.916 4.501 -7.367 1.00 0.00 C ATOM 2524 C LYS B 72 162.027 4.311 -6.137 1.00 0.00 C ATOM 2525 O LYS B 72 161.643 3.207 -5.797 1.00 0.00 O ATOM 2526 CB LYS B 72 164.372 4.662 -6.925 1.00 0.00 C ATOM 2527 CG LYS B 72 165.289 4.582 -8.152 1.00 0.00 C ATOM 2528 CD LYS B 72 166.745 4.872 -7.749 1.00 0.00 C ATOM 2529 CE LYS B 72 167.400 3.609 -7.176 1.00 0.00 C ATOM 2530 NZ LYS B 72 167.389 2.533 -8.208 1.00 0.00 N ATOM 0 H LYS B 72 163.130 6.507 -8.088 1.00 0.00 H new ATOM 0 HA LYS B 72 162.823 3.627 -8.011 1.00 0.00 H new ATOM 0 HB2 LYS B 72 164.506 5.618 -6.419 1.00 0.00 H new ATOM 0 HB3 LYS B 72 164.635 3.883 -6.210 1.00 0.00 H new ATOM 0 HG2 LYS B 72 165.219 3.592 -8.603 1.00 0.00 H new ATOM 0 HG3 LYS B 72 164.963 5.299 -8.906 1.00 0.00 H new ATOM 0 HD2 LYS B 72 167.307 5.220 -8.616 1.00 0.00 H new ATOM 0 HD3 LYS B 72 166.772 5.672 -7.009 1.00 0.00 H new ATOM 0 HE2 LYS B 72 168.424 3.824 -6.870 1.00 0.00 H new ATOM 0 HE3 LYS B 72 166.864 3.280 -6.286 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 168.236 1.940 -8.100 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 166.538 1.947 -8.089 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 167.385 2.961 -9.156 1.00 0.00 H new ATOM 2544 N GLN B 73 161.707 5.377 -5.458 1.00 0.00 N ATOM 2545 CA GLN B 73 160.860 5.265 -4.241 1.00 0.00 C ATOM 2546 C GLN B 73 159.453 4.809 -4.613 1.00 0.00 C ATOM 2547 O GLN B 73 158.841 4.019 -3.921 1.00 0.00 O ATOM 2548 CB GLN B 73 160.790 6.625 -3.542 1.00 0.00 C ATOM 2549 CG GLN B 73 162.151 6.955 -2.925 1.00 0.00 C ATOM 2550 CD GLN B 73 162.147 8.399 -2.422 1.00 0.00 C ATOM 2551 OE1 GLN B 73 161.483 9.249 -2.982 1.00 0.00 O ATOM 2552 NE2 GLN B 73 162.869 8.717 -1.383 1.00 0.00 N ATOM 0 H GLN B 73 161.998 6.325 -5.696 1.00 0.00 H new ATOM 0 HA GLN B 73 161.302 4.528 -3.570 1.00 0.00 H new ATOM 0 HB2 GLN B 73 160.506 7.398 -4.256 1.00 0.00 H new ATOM 0 HB3 GLN B 73 160.023 6.608 -2.768 1.00 0.00 H new ATOM 0 HG2 GLN B 73 162.364 6.273 -2.102 1.00 0.00 H new ATOM 0 HG3 GLN B 73 162.940 6.819 -3.665 1.00 0.00 H new ATOM 0 HE21 GLN B 73 163.427 8.005 -0.912 1.00 0.00 H new ATOM 0 HE22 GLN B 73 162.876 9.678 -1.042 1.00 0.00 H new ATOM 2561 N SER B 74 158.928 5.312 -5.693 1.00 0.00 N ATOM 2562 CA SER B 74 157.556 4.923 -6.108 1.00 0.00 C ATOM 2563 C SER B 74 157.499 3.430 -6.453 1.00 0.00 C ATOM 2564 O SER B 74 156.536 2.759 -6.143 1.00 0.00 O ATOM 2565 CB SER B 74 157.147 5.751 -7.323 1.00 0.00 C ATOM 2566 OG SER B 74 157.138 7.128 -6.970 1.00 0.00 O ATOM 0 H SER B 74 159.393 5.979 -6.308 1.00 0.00 H new ATOM 0 HA SER B 74 156.868 5.111 -5.283 1.00 0.00 H new ATOM 0 HB2 SER B 74 157.841 5.579 -8.145 1.00 0.00 H new ATOM 0 HB3 SER B 74 156.160 5.446 -7.670 1.00 0.00 H new ATOM 0 HG SER B 74 158.057 7.469 -6.958 1.00 0.00 H new ATOM 2572 N ARG B 75 158.511 2.896 -7.096 1.00 0.00 N ATOM 2573 CA ARG B 75 158.478 1.446 -7.452 1.00 0.00 C ATOM 2574 C ARG B 75 158.363 0.609 -6.182 1.00 0.00 C ATOM 2575 O ARG B 75 157.693 -0.405 -6.164 1.00 0.00 O ATOM 2576 CB ARG B 75 159.763 1.055 -8.188 1.00 0.00 C ATOM 2577 CG ARG B 75 159.786 1.674 -9.588 1.00 0.00 C ATOM 2578 CD ARG B 75 161.130 1.360 -10.248 1.00 0.00 C ATOM 2579 NE ARG B 75 161.291 -0.122 -10.343 1.00 0.00 N ATOM 2580 CZ ARG B 75 162.264 -0.635 -11.045 1.00 0.00 C ATOM 2581 NH1 ARG B 75 163.135 0.145 -11.624 1.00 0.00 N ATOM 2582 NH2 ARG B 75 162.375 -1.931 -11.157 1.00 0.00 N ATOM 0 H ARG B 75 159.350 3.398 -7.386 1.00 0.00 H new ATOM 0 HA ARG B 75 157.619 1.264 -8.098 1.00 0.00 H new ATOM 0 HB2 ARG B 75 160.631 1.391 -7.621 1.00 0.00 H new ATOM 0 HB3 ARG B 75 159.831 -0.030 -8.262 1.00 0.00 H new ATOM 0 HG2 ARG B 75 158.969 1.276 -10.189 1.00 0.00 H new ATOM 0 HG3 ARG B 75 159.640 2.752 -9.526 1.00 0.00 H new ATOM 0 HD2 ARG B 75 161.176 1.808 -11.241 1.00 0.00 H new ATOM 0 HD3 ARG B 75 161.945 1.791 -9.666 1.00 0.00 H new ATOM 0 HE ARG B 75 160.637 -0.736 -9.857 1.00 0.00 H new ATOM 0 HH11 ARG B 75 163.056 1.157 -11.528 1.00 0.00 H new ATOM 0 HH12 ARG B 75 163.895 -0.258 -12.172 1.00 0.00 H new ATOM 0 HH21 ARG B 75 161.701 -2.542 -10.696 1.00 0.00 H new ATOM 0 HH22 ARG B 75 163.135 -2.332 -11.706 1.00 0.00 H new ATOM 2596 N ASP B 76 159.019 0.993 -5.124 1.00 0.00 N ATOM 2597 CA ASP B 76 158.961 0.193 -3.872 1.00 0.00 C ATOM 2598 C ASP B 76 157.561 0.246 -3.260 1.00 0.00 C ATOM 2599 O ASP B 76 157.067 -0.738 -2.746 1.00 0.00 O ATOM 2600 CB ASP B 76 159.973 0.752 -2.872 1.00 0.00 C ATOM 2601 CG ASP B 76 161.391 0.444 -3.359 1.00 0.00 C ATOM 2602 OD1 ASP B 76 161.576 -0.605 -3.955 1.00 0.00 O ATOM 2603 OD2 ASP B 76 162.265 1.263 -3.134 1.00 0.00 O ATOM 0 H ASP B 76 159.596 1.832 -5.073 1.00 0.00 H new ATOM 0 HA ASP B 76 159.198 -0.845 -4.107 1.00 0.00 H new ATOM 0 HB2 ASP B 76 159.839 1.828 -2.765 1.00 0.00 H new ATOM 0 HB3 ASP B 76 159.811 0.311 -1.888 1.00 0.00 H new ATOM 2608 N CYS B 77 156.909 1.375 -3.304 1.00 0.00 N ATOM 2609 CA CYS B 77 155.545 1.462 -2.719 1.00 0.00 C ATOM 2610 C CYS B 77 154.560 0.607 -3.523 1.00 0.00 C ATOM 2611 O CYS B 77 153.687 -0.025 -2.961 1.00 0.00 O ATOM 2612 CB CYS B 77 155.076 2.918 -2.729 1.00 0.00 C ATOM 2613 SG CYS B 77 156.017 3.864 -1.506 1.00 0.00 S ATOM 0 H CYS B 77 157.262 2.238 -3.719 1.00 0.00 H new ATOM 0 HA CYS B 77 155.580 1.091 -1.695 1.00 0.00 H new ATOM 0 HB2 CYS B 77 155.213 3.348 -3.721 1.00 0.00 H new ATOM 0 HB3 CYS B 77 154.011 2.970 -2.503 1.00 0.00 H new ATOM 0 HG CYS B 77 156.231 3.126 -0.458 1.00 0.00 H new ATOM 2619 N PHE B 78 154.654 0.595 -4.828 1.00 0.00 N ATOM 2620 CA PHE B 78 153.671 -0.208 -5.610 1.00 0.00 C ATOM 2621 C PHE B 78 153.740 -1.675 -5.186 1.00 0.00 C ATOM 2622 O PHE B 78 152.768 -2.245 -4.731 1.00 0.00 O ATOM 2623 CB PHE B 78 153.974 -0.093 -7.105 1.00 0.00 C ATOM 2624 CG PHE B 78 152.962 -0.907 -7.876 1.00 0.00 C ATOM 2625 CD1 PHE B 78 151.766 -0.313 -8.298 1.00 0.00 C ATOM 2626 CD2 PHE B 78 153.217 -2.252 -8.170 1.00 0.00 C ATOM 2627 CE1 PHE B 78 150.824 -1.063 -9.010 1.00 0.00 C ATOM 2628 CE2 PHE B 78 152.273 -3.002 -8.885 1.00 0.00 C ATOM 2629 CZ PHE B 78 151.077 -2.408 -9.304 1.00 0.00 C ATOM 0 H PHE B 78 155.354 1.096 -5.375 1.00 0.00 H new ATOM 0 HA PHE B 78 152.670 0.176 -5.415 1.00 0.00 H new ATOM 0 HB2 PHE B 78 153.935 0.950 -7.418 1.00 0.00 H new ATOM 0 HB3 PHE B 78 154.982 -0.451 -7.313 1.00 0.00 H new ATOM 0 HD1 PHE B 78 151.571 0.725 -8.073 1.00 0.00 H new ATOM 0 HD2 PHE B 78 154.140 -2.711 -7.846 1.00 0.00 H new ATOM 0 HE1 PHE B 78 149.901 -0.604 -9.333 1.00 0.00 H new ATOM 0 HE2 PHE B 78 152.469 -4.039 -9.113 1.00 0.00 H new ATOM 0 HZ PHE B 78 150.350 -2.987 -9.854 1.00 0.00 H new ATOM 2639 N GLY B 79 154.876 -2.294 -5.337 1.00 0.00 N ATOM 2640 CA GLY B 79 155.002 -3.729 -4.950 1.00 0.00 C ATOM 2641 C GLY B 79 154.695 -3.901 -3.460 1.00 0.00 C ATOM 2642 O GLY B 79 154.185 -4.914 -3.032 1.00 0.00 O ATOM 0 H GLY B 79 155.724 -1.870 -5.712 1.00 0.00 H new ATOM 0 HA2 GLY B 79 154.317 -4.335 -5.543 1.00 0.00 H new ATOM 0 HA3 GLY B 79 156.010 -4.085 -5.165 1.00 0.00 H new ATOM 2646 N CYS B 80 155.001 -2.915 -2.669 1.00 0.00 N ATOM 2647 CA CYS B 80 154.724 -3.030 -1.209 1.00 0.00 C ATOM 2648 C CYS B 80 153.213 -2.986 -0.961 1.00 0.00 C ATOM 2649 O CYS B 80 152.665 -3.837 -0.288 1.00 0.00 O ATOM 2650 CB CYS B 80 155.394 -1.869 -0.477 1.00 0.00 C ATOM 2651 SG CYS B 80 155.225 -2.101 1.311 1.00 0.00 S ATOM 0 H CYS B 80 155.429 -2.038 -2.965 1.00 0.00 H new ATOM 0 HA CYS B 80 155.119 -3.976 -0.839 1.00 0.00 H new ATOM 0 HB2 CYS B 80 156.448 -1.814 -0.749 1.00 0.00 H new ATOM 0 HB3 CYS B 80 154.938 -0.925 -0.776 1.00 0.00 H new ATOM 0 HG CYS B 80 154.193 -2.853 1.555 1.00 0.00 H new ATOM 2657 N LEU B 81 152.529 -2.020 -1.511 1.00 0.00 N ATOM 2658 CA LEU B 81 151.053 -1.968 -1.303 1.00 0.00 C ATOM 2659 C LEU B 81 150.384 -3.094 -2.098 1.00 0.00 C ATOM 2660 O LEU B 81 149.459 -3.732 -1.634 1.00 0.00 O ATOM 2661 CB LEU B 81 150.512 -0.626 -1.805 1.00 0.00 C ATOM 2662 CG LEU B 81 151.154 0.531 -1.031 1.00 0.00 C ATOM 2663 CD1 LEU B 81 150.679 1.856 -1.635 1.00 0.00 C ATOM 2664 CD2 LEU B 81 150.750 0.466 0.453 1.00 0.00 C ATOM 0 H LEU B 81 152.920 -1.275 -2.087 1.00 0.00 H new ATOM 0 HA LEU B 81 150.838 -2.083 -0.241 1.00 0.00 H new ATOM 0 HB2 LEU B 81 150.718 -0.519 -2.870 1.00 0.00 H new ATOM 0 HB3 LEU B 81 149.429 -0.595 -1.686 1.00 0.00 H new ATOM 0 HG LEU B 81 152.239 0.456 -1.102 1.00 0.00 H new ATOM 0 HD11 LEU B 81 151.130 2.686 -1.091 1.00 0.00 H new ATOM 0 HD12 LEU B 81 150.975 1.905 -2.683 1.00 0.00 H new ATOM 0 HD13 LEU B 81 149.593 1.921 -1.561 1.00 0.00 H new ATOM 0 HD21 LEU B 81 151.212 1.293 0.992 1.00 0.00 H new ATOM 0 HD22 LEU B 81 149.666 0.538 0.538 1.00 0.00 H new ATOM 0 HD23 LEU B 81 151.086 -0.479 0.880 1.00 0.00 H new ATOM 2676 N ARG B 82 150.835 -3.328 -3.302 1.00 0.00 N ATOM 2677 CA ARG B 82 150.219 -4.393 -4.146 1.00 0.00 C ATOM 2678 C ARG B 82 150.372 -5.763 -3.482 1.00 0.00 C ATOM 2679 O ARG B 82 149.467 -6.573 -3.497 1.00 0.00 O ATOM 2680 CB ARG B 82 150.900 -4.396 -5.521 1.00 0.00 C ATOM 2681 CG ARG B 82 150.383 -5.556 -6.389 1.00 0.00 C ATOM 2682 CD ARG B 82 148.860 -5.484 -6.526 1.00 0.00 C ATOM 2683 NE ARG B 82 148.424 -6.346 -7.659 1.00 0.00 N ATOM 2684 CZ ARG B 82 147.165 -6.666 -7.783 1.00 0.00 C ATOM 2685 NH1 ARG B 82 146.292 -6.218 -6.925 1.00 0.00 N ATOM 2686 NH2 ARG B 82 146.781 -7.433 -8.767 1.00 0.00 N ATOM 0 H ARG B 82 151.607 -2.825 -3.739 1.00 0.00 H new ATOM 0 HA ARG B 82 149.155 -4.189 -4.261 1.00 0.00 H new ATOM 0 HB2 ARG B 82 150.713 -3.448 -6.026 1.00 0.00 H new ATOM 0 HB3 ARG B 82 151.979 -4.483 -5.396 1.00 0.00 H new ATOM 0 HG2 ARG B 82 150.845 -5.514 -7.375 1.00 0.00 H new ATOM 0 HG3 ARG B 82 150.670 -6.508 -5.942 1.00 0.00 H new ATOM 0 HD2 ARG B 82 148.385 -5.812 -5.601 1.00 0.00 H new ATOM 0 HD3 ARG B 82 148.548 -4.454 -6.697 1.00 0.00 H new ATOM 0 HE ARG B 82 149.107 -6.685 -8.336 1.00 0.00 H new ATOM 0 HH11 ARG B 82 146.593 -5.618 -6.157 1.00 0.00 H new ATOM 0 HH12 ARG B 82 145.308 -6.468 -7.021 1.00 0.00 H new ATOM 0 HH21 ARG B 82 147.465 -7.782 -9.438 1.00 0.00 H new ATOM 0 HH22 ARG B 82 145.797 -7.683 -8.864 1.00 0.00 H new ATOM 2700 N GLU B 83 151.507 -6.031 -2.905 1.00 0.00 N ATOM 2701 CA GLU B 83 151.714 -7.351 -2.245 1.00 0.00 C ATOM 2702 C GLU B 83 150.866 -7.456 -0.975 1.00 0.00 C ATOM 2703 O GLU B 83 150.327 -8.504 -0.680 1.00 0.00 O ATOM 2704 CB GLU B 83 153.196 -7.535 -1.911 1.00 0.00 C ATOM 2705 CG GLU B 83 153.986 -7.765 -3.204 1.00 0.00 C ATOM 2706 CD GLU B 83 153.647 -9.144 -3.775 1.00 0.00 C ATOM 2707 OE1 GLU B 83 153.032 -9.922 -3.065 1.00 0.00 O ATOM 2708 OE2 GLU B 83 154.011 -9.399 -4.912 1.00 0.00 O ATOM 0 H GLU B 83 152.302 -5.394 -2.861 1.00 0.00 H new ATOM 0 HA GLU B 83 151.402 -8.140 -2.930 1.00 0.00 H new ATOM 0 HB2 GLU B 83 153.575 -6.654 -1.392 1.00 0.00 H new ATOM 0 HB3 GLU B 83 153.326 -8.382 -1.237 1.00 0.00 H new ATOM 0 HG2 GLU B 83 153.745 -6.990 -3.932 1.00 0.00 H new ATOM 0 HG3 GLU B 83 155.056 -7.695 -3.006 1.00 0.00 H new ATOM 2715 N TRP B 84 150.708 -6.391 -0.227 1.00 0.00 N ATOM 2716 CA TRP B 84 149.861 -6.471 0.998 1.00 0.00 C ATOM 2717 C TRP B 84 148.440 -6.859 0.581 1.00 0.00 C ATOM 2718 O TRP B 84 147.809 -7.708 1.176 1.00 0.00 O ATOM 2719 CB TRP B 84 149.835 -5.111 1.706 1.00 0.00 C ATOM 2720 CG TRP B 84 149.193 -5.270 3.049 1.00 0.00 C ATOM 2721 CD1 TRP B 84 149.852 -5.595 4.188 1.00 0.00 C ATOM 2722 CD2 TRP B 84 147.788 -5.130 3.416 1.00 0.00 C ATOM 2723 NE1 TRP B 84 148.941 -5.668 5.226 1.00 0.00 N ATOM 2724 CE2 TRP B 84 147.659 -5.392 4.802 1.00 0.00 C ATOM 2725 CE3 TRP B 84 146.623 -4.809 2.694 1.00 0.00 C ATOM 2726 CZ2 TRP B 84 146.422 -5.341 5.446 1.00 0.00 C ATOM 2727 CZ3 TRP B 84 145.375 -4.754 3.342 1.00 0.00 C ATOM 2728 CH2 TRP B 84 145.277 -5.022 4.715 1.00 0.00 C ATOM 0 H TRP B 84 151.126 -5.479 -0.411 1.00 0.00 H new ATOM 0 HA TRP B 84 150.269 -7.215 1.682 1.00 0.00 H new ATOM 0 HB2 TRP B 84 150.848 -4.725 1.817 1.00 0.00 H new ATOM 0 HB3 TRP B 84 149.282 -4.386 1.108 1.00 0.00 H new ATOM 0 HD1 TRP B 84 150.915 -5.769 4.271 1.00 0.00 H new ATOM 0 HE1 TRP B 84 149.188 -5.898 6.189 1.00 0.00 H new ATOM 0 HE3 TRP B 84 146.687 -4.604 1.636 1.00 0.00 H new ATOM 0 HZ2 TRP B 84 146.351 -5.547 6.504 1.00 0.00 H new ATOM 0 HZ3 TRP B 84 144.488 -4.504 2.779 1.00 0.00 H new ATOM 0 HH2 TRP B 84 144.316 -4.982 5.206 1.00 0.00 H new ATOM 2739 N CYS B 85 147.931 -6.220 -0.436 1.00 0.00 N ATOM 2740 CA CYS B 85 146.547 -6.520 -0.902 1.00 0.00 C ATOM 2741 C CYS B 85 146.437 -7.988 -1.318 1.00 0.00 C ATOM 2742 O CYS B 85 145.452 -8.646 -1.055 1.00 0.00 O ATOM 2743 CB CYS B 85 146.225 -5.625 -2.100 1.00 0.00 C ATOM 2744 SG CYS B 85 146.041 -3.914 -1.540 1.00 0.00 S ATOM 0 H CYS B 85 148.417 -5.498 -0.968 1.00 0.00 H new ATOM 0 HA CYS B 85 145.842 -6.331 -0.092 1.00 0.00 H new ATOM 0 HB2 CYS B 85 147.020 -5.693 -2.843 1.00 0.00 H new ATOM 0 HB3 CYS B 85 145.308 -5.962 -2.583 1.00 0.00 H new ATOM 0 HG CYS B 85 147.214 -3.363 -1.435 1.00 0.00 H new ATOM 2750 N ASP B 86 147.434 -8.506 -1.968 1.00 0.00 N ATOM 2751 CA ASP B 86 147.383 -9.929 -2.402 1.00 0.00 C ATOM 2752 C ASP B 86 147.229 -10.843 -1.182 1.00 0.00 C ATOM 2753 O ASP B 86 146.639 -11.903 -1.262 1.00 0.00 O ATOM 2754 CB ASP B 86 148.672 -10.278 -3.150 1.00 0.00 C ATOM 2755 CG ASP B 86 148.687 -9.555 -4.498 1.00 0.00 C ATOM 2756 OD1 ASP B 86 147.618 -9.202 -4.971 1.00 0.00 O ATOM 2757 OD2 ASP B 86 149.766 -9.363 -5.034 1.00 0.00 O ATOM 0 H ASP B 86 148.287 -8.006 -2.220 1.00 0.00 H new ATOM 0 HA ASP B 86 146.528 -10.074 -3.062 1.00 0.00 H new ATOM 0 HB2 ASP B 86 149.540 -9.986 -2.558 1.00 0.00 H new ATOM 0 HB3 ASP B 86 148.738 -11.355 -3.302 1.00 0.00 H new ATOM 2762 N ALA B 87 147.766 -10.451 -0.056 1.00 0.00 N ATOM 2763 CA ALA B 87 147.659 -11.311 1.163 1.00 0.00 C ATOM 2764 C ALA B 87 146.415 -10.946 1.977 1.00 0.00 C ATOM 2765 O ALA B 87 145.832 -11.786 2.634 1.00 0.00 O ATOM 2766 CB ALA B 87 148.897 -11.101 2.038 1.00 0.00 C ATOM 0 H ALA B 87 148.273 -9.575 0.073 1.00 0.00 H new ATOM 0 HA ALA B 87 147.585 -12.352 0.847 1.00 0.00 H new ATOM 0 HB1 ALA B 87 148.824 -11.726 2.928 1.00 0.00 H new ATOM 0 HB2 ALA B 87 149.790 -11.373 1.476 1.00 0.00 H new ATOM 0 HB3 ALA B 87 148.960 -10.054 2.334 1.00 0.00 H new ATOM 2772 N PHE B 88 146.032 -9.692 1.981 1.00 0.00 N ATOM 2773 CA PHE B 88 144.852 -9.251 2.801 1.00 0.00 C ATOM 2774 C PHE B 88 143.660 -8.845 1.922 1.00 0.00 C ATOM 2775 O PHE B 88 142.644 -8.403 2.423 1.00 0.00 O ATOM 2776 CB PHE B 88 145.274 -8.055 3.650 1.00 0.00 C ATOM 2777 CG PHE B 88 146.322 -8.483 4.655 1.00 0.00 C ATOM 2778 CD1 PHE B 88 145.936 -9.131 5.834 1.00 0.00 C ATOM 2779 CD2 PHE B 88 147.678 -8.224 4.411 1.00 0.00 C ATOM 2780 CE1 PHE B 88 146.904 -9.521 6.767 1.00 0.00 C ATOM 2781 CE2 PHE B 88 148.645 -8.611 5.346 1.00 0.00 C ATOM 2782 CZ PHE B 88 148.259 -9.259 6.524 1.00 0.00 C ATOM 0 H PHE B 88 146.486 -8.949 1.450 1.00 0.00 H new ATOM 0 HA PHE B 88 144.536 -10.088 3.424 1.00 0.00 H new ATOM 0 HB2 PHE B 88 145.671 -7.266 3.011 1.00 0.00 H new ATOM 0 HB3 PHE B 88 144.408 -7.641 4.167 1.00 0.00 H new ATOM 0 HD1 PHE B 88 144.892 -9.330 6.024 1.00 0.00 H new ATOM 0 HD2 PHE B 88 147.977 -7.725 3.501 1.00 0.00 H new ATOM 0 HE1 PHE B 88 146.606 -10.024 7.675 1.00 0.00 H new ATOM 0 HE2 PHE B 88 149.689 -8.409 5.158 1.00 0.00 H new ATOM 0 HZ PHE B 88 149.005 -9.557 7.246 1.00 0.00 H new ATOM 2792 N LEU B 89 143.766 -8.972 0.623 1.00 0.00 N ATOM 2793 CA LEU B 89 142.630 -8.572 -0.275 1.00 0.00 C ATOM 2794 C LEU B 89 142.506 -9.588 -1.414 1.00 0.00 C ATOM 2795 O LEU B 89 143.487 -10.253 -1.699 1.00 0.00 O ATOM 2796 CB LEU B 89 142.917 -7.179 -0.866 1.00 0.00 C ATOM 2797 CG LEU B 89 141.620 -6.547 -1.423 1.00 0.00 C ATOM 2798 CD1 LEU B 89 140.848 -5.827 -0.298 1.00 0.00 C ATOM 2799 CD2 LEU B 89 141.970 -5.534 -2.530 1.00 0.00 C ATOM 2800 OXT LEU B 89 141.429 -9.684 -1.981 1.00 0.00 O ATOM 0 H LEU B 89 144.589 -9.335 0.142 1.00 0.00 H new ATOM 0 HA LEU B 89 141.702 -8.545 0.296 1.00 0.00 H new ATOM 0 HB2 LEU B 89 143.342 -6.533 -0.098 1.00 0.00 H new ATOM 0 HB3 LEU B 89 143.659 -7.261 -1.661 1.00 0.00 H new ATOM 0 HG LEU B 89 140.994 -7.339 -1.834 1.00 0.00 H new ATOM 0 HD11 LEU B 89 139.938 -5.387 -0.705 1.00 0.00 H new ATOM 0 HD12 LEU B 89 140.588 -6.544 0.481 1.00 0.00 H new ATOM 0 HD13 LEU B 89 141.472 -5.041 0.126 1.00 0.00 H new ATOM 0 HD21 LEU B 89 141.054 -5.091 -2.920 1.00 0.00 H new ATOM 0 HD22 LEU B 89 142.606 -4.750 -2.118 1.00 0.00 H new ATOM 0 HD23 LEU B 89 142.498 -6.044 -3.336 1.00 0.00 H new TER 2812 LEU B 89