USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 920 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 111 SER OG : rot -81:sc= 0.00279 USER MOD Set 1.2: B 113 SER OG : rot 130:sc= 0.00803 USER MOD Set 2.1: B 45 TYR OH : rot 46:sc= 0.98 USER MOD Set 2.2: B 68 ASN : amide:sc= -0.0699 K(o=0.91,f=-1.7!) USER MOD Set 3.1: B 53 ASN : amide:sc= -1.53 K(o=-1.5,f=-6.3!) USER MOD Set 3.2: B 54 SER OG : rot 180:sc= 0 USER MOD Set 4.1: B 41 HIS : no HE2:sc= -0.0165 K(o=0.69,f=-0.35) USER MOD Set 4.2: B 90 GLN : amide:sc= 0.704 X(o=0.69,f=0.23) USER MOD Set 5.1: A 4 THR OG1 : rot 170:sc= 0.00963 USER MOD Set 5.2: A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -127:sc= 0.0552 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= -0.14 K(o=-0.14,f=-1.8) USER MOD Single : A 14 THR OG1 : rot 106:sc= 0.926 USER MOD Single : A 17 GLN : amide:sc= -1.65! K(o=-1.7!,f=-0.091) USER MOD Single : A 21 THR OG1 : rot -82:sc= 1.24 USER MOD Single : A 22 SER OG : rot 85:sc= -0.0415 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : B 31 MET CE :methyl -159:sc= -0.253 (180deg=-0.887) USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 35 ASN : amide:sc= -0.323 K(o=-0.32,f=-2.9!) USER MOD Single : B 38 GLN : amide:sc= -1.12 K(o=-1.1,f=-0.0085) USER MOD Single : B 40 SER OG : rot 180:sc= 0 USER MOD Single : B 43 SER OG : rot 180:sc= 0 USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 LYS NZ :NH3+ 168:sc= 1.18 (180deg=0.906) USER MOD Single : B 59 LYS NZ :NH3+ -123:sc= 0.249 (180deg=-2.44!) USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 66 HIS : no HD1:sc=-0.00161 X(o=-0.0016,f=-0.092) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 70 TYR OH : rot 180:sc= 0 USER MOD Single : B 71 THR OG1 : rot 180:sc= 0 USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 76 LYS NZ :NH3+ 168:sc= -0.014 (180deg=-0.187) USER MOD Single : B 81 TYR OH : rot 100:sc= 0.995 USER MOD Single : B 84 GLN : amide:sc= -1.5 K(o=-1.5,f=-3.2!) USER MOD Single : B 87 SER OG : rot -160:sc= 0 USER MOD Single : B 89 GLN : amide:sc= -1.06! X(o=-1.1!,f=-1.4) USER MOD Single : B 91 TYR OH : rot 180:sc= -0.304 USER MOD Single : B 93 HIS : no HD1:sc= 1.09 K(o=1.1,f=-5.4!) USER MOD Single : B 94 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : B 97 THR OG1 : rot -157:sc= 0.0661 USER MOD Single : B 102 THR OG1 : rot 180:sc=-0.00714 USER MOD Single : B 103 THR OG1 : rot 180:sc= 0 USER MOD Single : B 104 THR OG1 : rot 180:sc= -1.09 USER MOD Single : B 105 SER OG : rot 180:sc= 0.0694 USER MOD Single : B 106 THR OG1 : rot -27:sc= 1.26 USER MOD Single : B 107 SER OG : rot 180:sc= 0 USER MOD Single : B 108 THR OG1 : rot 180:sc= -3.96! USER MOD Single : B 114 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 115 HIS : no HD1:sc= 0 X(o=0,f=-0.0012) USER MOD Single : B 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 117 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : B 118 HIS : no HD1:sc= 0 X(o=0,f=-0.038) USER MOD Single : B 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.633 8.703 16.563 1.00 0.00 N ATOM 2 CA GLY A 1 6.775 7.257 16.272 1.00 0.00 C ATOM 3 C GLY A 1 7.555 7.008 15.002 1.00 0.00 C ATOM 4 O GLY A 1 8.258 7.896 14.514 1.00 0.00 O ATOM 0 H1 GLY A 1 6.960 8.896 17.531 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.205 9.251 15.889 1.00 0.00 H new ATOM 0 H3 GLY A 1 5.634 8.979 16.473 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.276 6.767 17.107 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.786 6.806 16.184 1.00 0.00 H new ATOM 10 N SER A 2 7.432 5.806 14.461 1.00 0.00 N ATOM 11 CA SER A 2 8.119 5.442 13.235 1.00 0.00 C ATOM 12 C SER A 2 7.107 5.031 12.172 1.00 0.00 C ATOM 13 O SER A 2 6.336 4.087 12.373 1.00 0.00 O ATOM 14 CB SER A 2 9.099 4.301 13.502 1.00 0.00 C ATOM 15 OG SER A 2 9.992 4.638 14.550 1.00 0.00 O ATOM 0 H SER A 2 6.858 5.062 14.857 1.00 0.00 H new ATOM 0 HA SER A 2 8.678 6.305 12.872 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.549 3.397 13.764 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.662 4.080 12.595 1.00 0.00 H new ATOM 0 HG SER A 2 10.610 3.893 14.706 1.00 0.00 H new ATOM 21 N GLN A 3 7.110 5.754 11.052 1.00 0.00 N ATOM 22 CA GLN A 3 6.160 5.527 9.963 1.00 0.00 C ATOM 23 C GLN A 3 4.723 5.688 10.454 1.00 0.00 C ATOM 24 O GLN A 3 3.796 5.067 9.929 1.00 0.00 O ATOM 25 CB GLN A 3 6.355 4.146 9.318 1.00 0.00 C ATOM 26 CG GLN A 3 7.599 4.039 8.444 1.00 0.00 C ATOM 27 CD GLN A 3 8.884 3.891 9.236 1.00 0.00 C ATOM 28 OE1 GLN A 3 8.905 3.297 10.315 1.00 0.00 O ATOM 29 NE2 GLN A 3 9.966 4.436 8.707 1.00 0.00 N ATOM 0 H GLN A 3 7.769 6.512 10.874 1.00 0.00 H new ATOM 0 HA GLN A 3 6.354 6.281 9.200 1.00 0.00 H new ATOM 0 HB2 GLN A 3 6.411 3.394 10.105 1.00 0.00 H new ATOM 0 HB3 GLN A 3 5.478 3.911 8.714 1.00 0.00 H new ATOM 0 HG2 GLN A 3 7.492 3.184 7.777 1.00 0.00 H new ATOM 0 HG3 GLN A 3 7.669 4.927 7.815 1.00 0.00 H new ATOM 0 HE21 GLN A 3 9.907 4.920 7.811 1.00 0.00 H new ATOM 0 HE22 GLN A 3 10.859 4.373 9.195 1.00 0.00 H new ATOM 38 N THR A 4 4.548 6.526 11.464 1.00 0.00 N ATOM 39 CA THR A 4 3.237 6.796 12.019 1.00 0.00 C ATOM 40 C THR A 4 2.664 8.070 11.417 1.00 0.00 C ATOM 41 O THR A 4 1.542 8.087 10.911 1.00 0.00 O ATOM 42 CB THR A 4 3.302 6.930 13.554 1.00 0.00 C ATOM 43 OG1 THR A 4 4.397 7.782 13.929 1.00 0.00 O ATOM 44 CG2 THR A 4 3.466 5.568 14.208 1.00 0.00 C ATOM 0 H THR A 4 5.308 7.034 11.918 1.00 0.00 H new ATOM 0 HA THR A 4 2.588 5.956 11.772 1.00 0.00 H new ATOM 0 HB THR A 4 2.366 7.371 13.898 1.00 0.00 H new ATOM 0 HG1 THR A 4 4.336 7.992 14.884 1.00 0.00 H new ATOM 0 HG21 THR A 4 3.510 5.687 15.291 1.00 0.00 H new ATOM 0 HG22 THR A 4 2.619 4.934 13.946 1.00 0.00 H new ATOM 0 HG23 THR A 4 4.388 5.104 13.857 1.00 0.00 H new ATOM 52 N THR A 5 3.458 9.128 11.451 1.00 0.00 N ATOM 53 CA THR A 5 3.039 10.411 10.923 1.00 0.00 C ATOM 54 C THR A 5 3.448 10.550 9.463 1.00 0.00 C ATOM 55 O THR A 5 4.632 10.677 9.140 1.00 0.00 O ATOM 56 CB THR A 5 3.626 11.564 11.758 1.00 0.00 C ATOM 57 OG1 THR A 5 3.233 11.401 13.129 1.00 0.00 O ATOM 58 CG2 THR A 5 3.145 12.918 11.250 1.00 0.00 C ATOM 0 H THR A 5 4.400 9.120 11.841 1.00 0.00 H new ATOM 0 HA THR A 5 1.952 10.463 10.984 1.00 0.00 H new ATOM 0 HB THR A 5 4.712 11.535 11.669 1.00 0.00 H new ATOM 0 HG1 THR A 5 3.606 12.132 13.665 1.00 0.00 H new ATOM 0 HG21 THR A 5 3.577 13.710 11.861 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.455 13.049 10.213 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.058 12.965 11.312 1.00 0.00 H new ATOM 66 N ALA A 6 2.458 10.489 8.591 1.00 0.00 N ATOM 67 CA ALA A 6 2.671 10.623 7.160 1.00 0.00 C ATOM 68 C ALA A 6 1.421 11.195 6.507 1.00 0.00 C ATOM 69 O ALA A 6 0.526 10.454 6.106 1.00 0.00 O ATOM 70 CB ALA A 6 3.027 9.276 6.551 1.00 0.00 C ATOM 0 H ALA A 6 1.483 10.345 8.854 1.00 0.00 H new ATOM 0 HA ALA A 6 3.503 11.305 6.984 1.00 0.00 H new ATOM 0 HB1 ALA A 6 3.184 9.392 5.479 1.00 0.00 H new ATOM 0 HB2 ALA A 6 3.939 8.898 7.012 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.214 8.572 6.725 1.00 0.00 H new ATOM 76 N PRO A 7 1.335 12.530 6.410 1.00 0.00 N ATOM 77 CA PRO A 7 0.141 13.217 5.900 1.00 0.00 C ATOM 78 C PRO A 7 -0.172 12.888 4.441 1.00 0.00 C ATOM 79 O PRO A 7 -1.273 13.162 3.960 1.00 0.00 O ATOM 80 CB PRO A 7 0.484 14.704 6.044 1.00 0.00 C ATOM 81 CG PRO A 7 1.622 14.756 7.006 1.00 0.00 C ATOM 82 CD PRO A 7 2.386 13.482 6.802 1.00 0.00 C ATOM 0 HA PRO A 7 -0.749 12.910 6.450 1.00 0.00 H new ATOM 0 HB2 PRO A 7 0.761 15.138 5.083 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -0.370 15.270 6.415 1.00 0.00 H new ATOM 0 HG2 PRO A 7 2.253 15.625 6.819 1.00 0.00 H new ATOM 0 HG3 PRO A 7 1.264 14.837 8.032 1.00 0.00 H new ATOM 0 HD2 PRO A 7 3.146 13.586 6.028 1.00 0.00 H new ATOM 0 HD3 PRO A 7 2.898 13.167 7.711 1.00 0.00 H new ATOM 90 N ASP A 8 0.791 12.304 3.739 1.00 0.00 N ATOM 91 CA ASP A 8 0.604 11.958 2.335 1.00 0.00 C ATOM 92 C ASP A 8 0.252 10.482 2.180 1.00 0.00 C ATOM 93 O ASP A 8 -0.067 10.022 1.084 1.00 0.00 O ATOM 94 CB ASP A 8 1.871 12.263 1.527 1.00 0.00 C ATOM 95 CG ASP A 8 2.269 13.722 1.569 1.00 0.00 C ATOM 96 OD1 ASP A 8 3.121 14.085 2.409 1.00 0.00 O ATOM 97 OD2 ASP A 8 1.752 14.511 0.753 1.00 0.00 O ATOM 0 H ASP A 8 1.707 12.061 4.117 1.00 0.00 H new ATOM 0 HA ASP A 8 -0.219 12.563 1.955 1.00 0.00 H new ATOM 0 HB2 ASP A 8 2.693 11.658 1.910 1.00 0.00 H new ATOM 0 HB3 ASP A 8 1.713 11.966 0.490 1.00 0.00 H new ATOM 102 N ALA A 9 0.312 9.746 3.282 1.00 0.00 N ATOM 103 CA ALA A 9 0.102 8.307 3.256 1.00 0.00 C ATOM 104 C ALA A 9 -1.211 7.926 3.922 1.00 0.00 C ATOM 105 O ALA A 9 -1.589 8.508 4.939 1.00 0.00 O ATOM 106 CB ALA A 9 1.251 7.614 3.957 1.00 0.00 C ATOM 0 H ALA A 9 0.505 10.126 4.209 1.00 0.00 H new ATOM 0 HA ALA A 9 0.057 7.988 2.215 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.092 6.536 3.937 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.185 7.853 3.448 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.304 7.954 4.991 1.00 0.00 H new ATOM 112 N PRO A 10 -1.936 6.953 3.348 1.00 0.00 N ATOM 113 CA PRO A 10 -3.155 6.417 3.956 1.00 0.00 C ATOM 114 C PRO A 10 -2.883 5.816 5.333 1.00 0.00 C ATOM 115 O PRO A 10 -2.066 4.896 5.456 1.00 0.00 O ATOM 116 CB PRO A 10 -3.603 5.324 2.978 1.00 0.00 C ATOM 117 CG PRO A 10 -2.948 5.670 1.686 1.00 0.00 C ATOM 118 CD PRO A 10 -1.642 6.315 2.053 1.00 0.00 C ATOM 0 HA PRO A 10 -3.906 7.191 4.114 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -3.297 4.336 3.323 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -4.688 5.305 2.878 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -2.788 4.780 1.077 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -3.569 6.348 1.101 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -0.840 5.582 2.138 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -1.329 7.045 1.306 1.00 0.00 H new ATOM 126 N PRO A 11 -3.544 6.347 6.381 1.00 0.00 N ATOM 127 CA PRO A 11 -3.275 5.985 7.780 1.00 0.00 C ATOM 128 C PRO A 11 -3.137 4.484 8.010 1.00 0.00 C ATOM 129 O PRO A 11 -2.046 3.994 8.312 1.00 0.00 O ATOM 130 CB PRO A 11 -4.494 6.528 8.519 1.00 0.00 C ATOM 131 CG PRO A 11 -4.921 7.705 7.715 1.00 0.00 C ATOM 132 CD PRO A 11 -4.608 7.365 6.282 1.00 0.00 C ATOM 0 HA PRO A 11 -2.323 6.393 8.118 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -5.286 5.781 8.582 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -4.244 6.814 9.541 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -5.985 7.901 7.846 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -4.390 8.604 8.027 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -5.485 6.977 5.763 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -4.272 8.241 5.728 1.00 0.00 H new ATOM 140 N ASP A 12 -4.236 3.761 7.851 1.00 0.00 N ATOM 141 CA ASP A 12 -4.245 2.325 8.088 1.00 0.00 C ATOM 142 C ASP A 12 -5.085 1.607 7.036 1.00 0.00 C ATOM 143 O ASP A 12 -6.292 1.840 6.931 1.00 0.00 O ATOM 144 CB ASP A 12 -4.789 2.027 9.489 1.00 0.00 C ATOM 145 CG ASP A 12 -4.915 0.541 9.767 1.00 0.00 C ATOM 146 OD1 ASP A 12 -3.882 -0.109 10.036 1.00 0.00 O ATOM 147 OD2 ASP A 12 -6.048 0.021 9.737 1.00 0.00 O ATOM 0 H ASP A 12 -5.134 4.146 7.558 1.00 0.00 H new ATOM 0 HA ASP A 12 -3.221 1.959 8.017 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -4.131 2.477 10.233 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.766 2.497 9.602 1.00 0.00 H new ATOM 152 N PRO A 13 -4.448 0.758 6.217 1.00 0.00 N ATOM 153 CA PRO A 13 -5.143 -0.080 5.246 1.00 0.00 C ATOM 154 C PRO A 13 -5.763 -1.304 5.909 1.00 0.00 C ATOM 155 O PRO A 13 -5.111 -1.994 6.697 1.00 0.00 O ATOM 156 CB PRO A 13 -4.043 -0.505 4.260 1.00 0.00 C ATOM 157 CG PRO A 13 -2.797 0.200 4.701 1.00 0.00 C ATOM 158 CD PRO A 13 -2.999 0.556 6.146 1.00 0.00 C ATOM 0 HA PRO A 13 -5.966 0.449 4.765 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -3.905 -1.586 4.272 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -4.307 -0.229 3.239 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -1.924 -0.441 4.577 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -2.624 1.094 4.102 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -2.666 -0.240 6.812 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -2.449 1.455 6.424 1.00 0.00 H new ATOM 166 N THR A 14 -7.014 -1.569 5.588 1.00 0.00 N ATOM 167 CA THR A 14 -7.734 -2.674 6.183 1.00 0.00 C ATOM 168 C THR A 14 -7.960 -3.785 5.172 1.00 0.00 C ATOM 169 O THR A 14 -8.189 -3.529 3.986 1.00 0.00 O ATOM 170 CB THR A 14 -9.094 -2.214 6.736 1.00 0.00 C ATOM 171 OG1 THR A 14 -9.847 -1.559 5.705 1.00 0.00 O ATOM 172 CG2 THR A 14 -8.908 -1.275 7.913 1.00 0.00 C ATOM 0 H THR A 14 -7.555 -1.029 4.913 1.00 0.00 H new ATOM 0 HA THR A 14 -7.123 -3.052 7.002 1.00 0.00 H new ATOM 0 HB THR A 14 -9.640 -3.093 7.078 1.00 0.00 H new ATOM 0 HG1 THR A 14 -10.563 -2.152 5.396 1.00 0.00 H new ATOM 0 HG21 THR A 14 -9.883 -0.963 8.287 1.00 0.00 H new ATOM 0 HG22 THR A 14 -8.363 -1.788 8.705 1.00 0.00 H new ATOM 0 HG23 THR A 14 -8.345 -0.398 7.594 1.00 0.00 H new ATOM 180 N VAL A 15 -7.878 -5.015 5.643 1.00 0.00 N ATOM 181 CA VAL A 15 -8.188 -6.164 4.815 1.00 0.00 C ATOM 182 C VAL A 15 -9.564 -6.694 5.177 1.00 0.00 C ATOM 183 O VAL A 15 -9.772 -7.230 6.269 1.00 0.00 O ATOM 184 CB VAL A 15 -7.130 -7.276 4.961 1.00 0.00 C ATOM 185 CG1 VAL A 15 -7.582 -8.554 4.271 1.00 0.00 C ATOM 186 CG2 VAL A 15 -5.800 -6.805 4.394 1.00 0.00 C ATOM 0 H VAL A 15 -7.599 -5.244 6.597 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.181 -5.844 3.773 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.005 -7.496 6.021 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.817 -9.322 4.390 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.514 -8.899 4.718 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.739 -8.359 3.210 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.058 -7.596 4.501 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -5.920 -6.561 3.339 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.467 -5.920 4.935 1.00 0.00 H new ATOM 196 N ASP A 16 -10.501 -6.522 4.261 1.00 0.00 N ATOM 197 CA ASP A 16 -11.886 -6.886 4.500 1.00 0.00 C ATOM 198 C ASP A 16 -12.358 -7.883 3.449 1.00 0.00 C ATOM 199 O ASP A 16 -11.733 -8.014 2.397 1.00 0.00 O ATOM 200 CB ASP A 16 -12.774 -5.635 4.474 1.00 0.00 C ATOM 201 CG ASP A 16 -12.397 -4.614 5.535 1.00 0.00 C ATOM 202 OD1 ASP A 16 -11.700 -3.628 5.207 1.00 0.00 O ATOM 203 OD2 ASP A 16 -12.807 -4.786 6.705 1.00 0.00 O ATOM 0 H ASP A 16 -10.325 -6.129 3.337 1.00 0.00 H new ATOM 0 HA ASP A 16 -11.960 -7.351 5.483 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -12.707 -5.170 3.491 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -13.813 -5.931 4.616 1.00 0.00 H new ATOM 208 N GLN A 17 -13.457 -8.578 3.743 1.00 0.00 N ATOM 209 CA GLN A 17 -14.039 -9.568 2.827 1.00 0.00 C ATOM 210 C GLN A 17 -13.003 -10.585 2.351 1.00 0.00 C ATOM 211 O GLN A 17 -12.569 -10.553 1.195 1.00 0.00 O ATOM 212 CB GLN A 17 -14.696 -8.899 1.610 1.00 0.00 C ATOM 213 CG GLN A 17 -16.020 -8.209 1.906 1.00 0.00 C ATOM 214 CD GLN A 17 -15.865 -6.844 2.545 1.00 0.00 C ATOM 215 OE1 GLN A 17 -16.691 -6.433 3.361 1.00 0.00 O ATOM 216 NE2 GLN A 17 -14.835 -6.113 2.153 1.00 0.00 N ATOM 0 H GLN A 17 -13.970 -8.474 4.619 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.806 -10.094 3.396 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -14.003 -8.166 1.197 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -14.858 -9.654 0.840 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -16.581 -8.104 0.977 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -16.611 -8.844 2.565 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -14.172 -6.488 1.475 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -14.704 -5.174 2.529 1.00 0.00 H new ATOM 225 N VAL A 18 -12.610 -11.481 3.240 1.00 0.00 N ATOM 226 CA VAL A 18 -11.683 -12.545 2.886 1.00 0.00 C ATOM 227 C VAL A 18 -12.450 -13.749 2.346 1.00 0.00 C ATOM 228 O VAL A 18 -13.328 -14.289 3.020 1.00 0.00 O ATOM 229 CB VAL A 18 -10.827 -12.973 4.097 1.00 0.00 C ATOM 230 CG1 VAL A 18 -9.833 -14.054 3.702 1.00 0.00 C ATOM 231 CG2 VAL A 18 -10.106 -11.774 4.694 1.00 0.00 C ATOM 0 H VAL A 18 -12.918 -11.494 4.212 1.00 0.00 H new ATOM 0 HA VAL A 18 -11.014 -12.162 2.115 1.00 0.00 H new ATOM 0 HB VAL A 18 -11.493 -13.385 4.855 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -9.241 -14.339 4.572 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -10.372 -14.925 3.328 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -9.173 -13.674 2.923 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -9.508 -12.096 5.546 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -9.455 -11.329 3.941 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -10.838 -11.036 5.023 1.00 0.00 H new ATOM 241 N ASP A 19 -12.136 -14.143 1.121 1.00 0.00 N ATOM 242 CA ASP A 19 -12.798 -15.270 0.477 1.00 0.00 C ATOM 243 C ASP A 19 -11.909 -16.504 0.524 1.00 0.00 C ATOM 244 O ASP A 19 -10.999 -16.595 1.347 1.00 0.00 O ATOM 245 CB ASP A 19 -13.116 -14.954 -0.989 1.00 0.00 C ATOM 246 CG ASP A 19 -13.925 -13.692 -1.174 1.00 0.00 C ATOM 247 OD1 ASP A 19 -13.422 -12.759 -1.834 1.00 0.00 O ATOM 248 OD2 ASP A 19 -15.069 -13.630 -0.677 1.00 0.00 O ATOM 0 H ASP A 19 -11.421 -13.695 0.548 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.726 -15.458 1.017 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -12.182 -14.861 -1.543 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -13.662 -15.792 -1.423 1.00 0.00 H new ATOM 253 N ASP A 20 -12.185 -17.445 -0.372 1.00 0.00 N ATOM 254 CA ASP A 20 -11.388 -18.661 -0.513 1.00 0.00 C ATOM 255 C ASP A 20 -9.915 -18.338 -0.748 1.00 0.00 C ATOM 256 O ASP A 20 -9.041 -18.845 -0.046 1.00 0.00 O ATOM 257 CB ASP A 20 -11.927 -19.501 -1.676 1.00 0.00 C ATOM 258 CG ASP A 20 -11.015 -20.653 -2.047 1.00 0.00 C ATOM 259 OD1 ASP A 20 -10.245 -20.517 -3.019 1.00 0.00 O ATOM 260 OD2 ASP A 20 -11.063 -21.705 -1.372 1.00 0.00 O ATOM 0 H ASP A 20 -12.968 -17.387 -1.023 1.00 0.00 H new ATOM 0 HA ASP A 20 -11.465 -19.226 0.416 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -12.908 -19.893 -1.409 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.066 -18.860 -2.546 1.00 0.00 H new ATOM 265 N THR A 21 -9.648 -17.498 -1.738 1.00 0.00 N ATOM 266 CA THR A 21 -8.285 -17.123 -2.084 1.00 0.00 C ATOM 267 C THR A 21 -8.204 -15.664 -2.539 1.00 0.00 C ATOM 268 O THR A 21 -7.374 -15.310 -3.381 1.00 0.00 O ATOM 269 CB THR A 21 -7.729 -18.039 -3.194 1.00 0.00 C ATOM 270 OG1 THR A 21 -8.785 -18.431 -4.084 1.00 0.00 O ATOM 271 CG2 THR A 21 -7.068 -19.278 -2.610 1.00 0.00 C ATOM 0 H THR A 21 -10.363 -17.061 -2.319 1.00 0.00 H new ATOM 0 HA THR A 21 -7.681 -17.241 -1.184 1.00 0.00 H new ATOM 0 HB THR A 21 -6.975 -17.476 -3.745 1.00 0.00 H new ATOM 0 HG1 THR A 21 -9.279 -19.183 -3.695 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.687 -19.902 -3.418 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.244 -18.980 -1.962 1.00 0.00 H new ATOM 0 HG23 THR A 21 -7.799 -19.841 -2.030 1.00 0.00 H new ATOM 279 N SER A 22 -9.061 -14.818 -1.982 1.00 0.00 N ATOM 280 CA SER A 22 -9.078 -13.407 -2.345 1.00 0.00 C ATOM 281 C SER A 22 -9.466 -12.535 -1.157 1.00 0.00 C ATOM 282 O SER A 22 -10.211 -12.966 -0.279 1.00 0.00 O ATOM 283 CB SER A 22 -10.040 -13.170 -3.513 1.00 0.00 C ATOM 284 OG SER A 22 -11.302 -13.778 -3.277 1.00 0.00 O ATOM 0 H SER A 22 -9.751 -15.083 -1.279 1.00 0.00 H new ATOM 0 HA SER A 22 -8.070 -13.128 -2.653 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.173 -12.099 -3.665 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.607 -13.571 -4.430 1.00 0.00 H new ATOM 0 HG SER A 22 -11.861 -13.175 -2.743 1.00 0.00 H new ATOM 290 N ILE A 23 -8.944 -11.316 -1.130 1.00 0.00 N ATOM 291 CA ILE A 23 -9.289 -10.348 -0.095 1.00 0.00 C ATOM 292 C ILE A 23 -9.629 -9.012 -0.734 1.00 0.00 C ATOM 293 O ILE A 23 -9.318 -8.781 -1.901 1.00 0.00 O ATOM 294 CB ILE A 23 -8.128 -10.093 0.892 1.00 0.00 C ATOM 295 CG1 ILE A 23 -6.976 -9.385 0.168 1.00 0.00 C ATOM 296 CG2 ILE A 23 -7.654 -11.395 1.520 1.00 0.00 C ATOM 297 CD1 ILE A 23 -6.006 -8.672 1.084 1.00 0.00 C ATOM 0 H ILE A 23 -8.275 -10.971 -1.818 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.135 -10.769 0.449 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.486 -9.449 1.695 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.427 -10.120 -0.421 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.393 -8.662 -0.533 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.836 -11.189 2.211 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -8.478 -11.859 2.061 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -7.307 -12.071 0.738 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.224 -8.200 0.489 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.537 -7.911 1.655 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.556 -9.391 1.769 1.00 0.00 H new ATOM 309 N VAL A 24 -10.257 -8.137 0.030 1.00 0.00 N ATOM 310 CA VAL A 24 -10.425 -6.761 -0.389 1.00 0.00 C ATOM 311 C VAL A 24 -9.600 -5.860 0.513 1.00 0.00 C ATOM 312 O VAL A 24 -9.957 -5.621 1.668 1.00 0.00 O ATOM 313 CB VAL A 24 -11.895 -6.304 -0.337 1.00 0.00 C ATOM 314 CG1 VAL A 24 -12.034 -4.902 -0.900 1.00 0.00 C ATOM 315 CG2 VAL A 24 -12.789 -7.267 -1.090 1.00 0.00 C ATOM 0 H VAL A 24 -10.658 -8.356 0.942 1.00 0.00 H new ATOM 0 HA VAL A 24 -10.092 -6.693 -1.425 1.00 0.00 H new ATOM 0 HB VAL A 24 -12.210 -6.294 0.706 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -13.079 -4.594 -0.856 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -11.427 -4.212 -0.313 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -11.696 -4.891 -1.936 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -13.821 -6.921 -1.038 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -12.475 -7.316 -2.133 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.715 -8.258 -0.642 1.00 0.00 H new ATOM 325 N VAL A 25 -8.494 -5.373 -0.007 1.00 0.00 N ATOM 326 CA VAL A 25 -7.639 -4.477 0.745 1.00 0.00 C ATOM 327 C VAL A 25 -8.022 -3.032 0.441 1.00 0.00 C ATOM 328 O VAL A 25 -7.979 -2.591 -0.709 1.00 0.00 O ATOM 329 CB VAL A 25 -6.140 -4.747 0.454 1.00 0.00 C ATOM 330 CG1 VAL A 25 -5.875 -4.857 -1.037 1.00 0.00 C ATOM 331 CG2 VAL A 25 -5.251 -3.684 1.078 1.00 0.00 C ATOM 0 H VAL A 25 -8.164 -5.582 -0.949 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.786 -4.659 1.810 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.892 -5.704 0.913 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.815 -5.046 -1.205 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.460 -5.678 -1.451 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.159 -3.926 -1.527 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.207 -3.905 0.854 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.511 -2.707 0.670 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.396 -3.676 2.158 1.00 0.00 H new ATOM 341 N ARG A 26 -8.457 -2.322 1.470 1.00 0.00 N ATOM 342 CA ARG A 26 -8.925 -0.954 1.315 1.00 0.00 C ATOM 343 C ARG A 26 -8.131 -0.019 2.207 1.00 0.00 C ATOM 344 O ARG A 26 -7.764 -0.376 3.322 1.00 0.00 O ATOM 345 CB ARG A 26 -10.415 -0.848 1.649 1.00 0.00 C ATOM 346 CG ARG A 26 -11.301 -1.686 0.748 1.00 0.00 C ATOM 347 CD ARG A 26 -12.772 -1.386 0.975 1.00 0.00 C ATOM 348 NE ARG A 26 -13.631 -2.086 0.018 1.00 0.00 N ATOM 349 CZ ARG A 26 -14.861 -1.692 -0.311 1.00 0.00 C ATOM 350 NH1 ARG A 26 -15.392 -0.611 0.249 1.00 0.00 N ATOM 351 NH2 ARG A 26 -15.563 -2.384 -1.200 1.00 0.00 N ATOM 0 H ARG A 26 -8.496 -2.673 2.427 1.00 0.00 H new ATOM 0 HA ARG A 26 -8.779 -0.663 0.275 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.569 -1.155 2.683 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.721 0.196 1.577 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.046 -1.494 -0.294 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.112 -2.744 0.932 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -13.048 -1.676 1.989 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -12.939 -0.312 0.894 1.00 0.00 H new ATOM 0 HE ARG A 26 -13.265 -2.929 -0.425 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -14.858 -0.077 0.935 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -16.334 -0.314 -0.007 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -15.161 -3.217 -1.631 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -16.504 -2.083 -1.452 1.00 0.00 H new ATOM 365 N TRP A 27 -7.875 1.177 1.720 1.00 0.00 N ATOM 366 CA TRP A 27 -7.092 2.147 2.463 1.00 0.00 C ATOM 367 C TRP A 27 -7.849 3.458 2.610 1.00 0.00 C ATOM 368 O TRP A 27 -8.495 3.927 1.670 1.00 0.00 O ATOM 369 CB TRP A 27 -5.739 2.369 1.779 1.00 0.00 C ATOM 370 CG TRP A 27 -5.832 2.459 0.287 1.00 0.00 C ATOM 371 CD1 TRP A 27 -6.043 3.580 -0.457 1.00 0.00 C ATOM 372 CD2 TRP A 27 -5.721 1.373 -0.642 1.00 0.00 C ATOM 373 NE1 TRP A 27 -6.076 3.259 -1.791 1.00 0.00 N ATOM 374 CE2 TRP A 27 -5.876 1.911 -1.930 1.00 0.00 C ATOM 375 CE3 TRP A 27 -5.505 -0.001 -0.507 1.00 0.00 C ATOM 376 CZ2 TRP A 27 -5.822 1.123 -3.078 1.00 0.00 C ATOM 377 CZ3 TRP A 27 -5.452 -0.782 -1.645 1.00 0.00 C ATOM 378 CH2 TRP A 27 -5.609 -0.218 -2.916 1.00 0.00 C ATOM 0 H TRP A 27 -8.198 1.503 0.809 1.00 0.00 H new ATOM 0 HA TRP A 27 -6.913 1.754 3.464 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -5.293 3.286 2.163 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -5.068 1.552 2.045 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.166 4.575 -0.056 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -6.225 3.918 -2.555 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -5.382 -0.444 0.470 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -5.944 1.556 -4.060 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.287 -1.845 -1.552 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -5.561 -0.855 -3.787 1.00 0.00 H new ATOM 389 N SER A 28 -7.790 4.026 3.804 1.00 0.00 N ATOM 390 CA SER A 28 -8.449 5.289 4.087 1.00 0.00 C ATOM 391 C SER A 28 -7.546 6.453 3.703 1.00 0.00 C ATOM 392 O SER A 28 -6.345 6.422 3.956 1.00 0.00 O ATOM 393 CB SER A 28 -8.799 5.366 5.571 1.00 0.00 C ATOM 394 OG SER A 28 -9.495 4.203 5.984 1.00 0.00 O ATOM 0 H SER A 28 -7.288 3.628 4.598 1.00 0.00 H new ATOM 0 HA SER A 28 -9.365 5.350 3.499 1.00 0.00 H new ATOM 0 HB2 SER A 28 -7.888 5.478 6.159 1.00 0.00 H new ATOM 0 HB3 SER A 28 -9.411 6.248 5.760 1.00 0.00 H new ATOM 0 HG SER A 28 -9.709 4.271 6.938 1.00 0.00 H new ATOM 400 N ARG A 29 -8.122 7.465 3.077 1.00 0.00 N ATOM 401 CA ARG A 29 -7.369 8.642 2.670 1.00 0.00 C ATOM 402 C ARG A 29 -7.054 9.533 3.866 1.00 0.00 C ATOM 403 O ARG A 29 -7.911 9.755 4.721 1.00 0.00 O ATOM 404 CB ARG A 29 -8.154 9.422 1.620 1.00 0.00 C ATOM 405 CG ARG A 29 -8.175 8.749 0.261 1.00 0.00 C ATOM 406 CD ARG A 29 -6.817 8.827 -0.420 1.00 0.00 C ATOM 407 NE ARG A 29 -6.441 10.209 -0.712 1.00 0.00 N ATOM 408 CZ ARG A 29 -6.304 10.699 -1.944 1.00 0.00 C ATOM 409 NH1 ARG A 29 -6.417 9.902 -2.999 1.00 0.00 N ATOM 410 NH2 ARG A 29 -6.026 11.985 -2.120 1.00 0.00 N ATOM 0 H ARG A 29 -9.113 7.496 2.838 1.00 0.00 H new ATOM 0 HA ARG A 29 -6.423 8.313 2.239 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -9.179 9.555 1.967 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -7.721 10.417 1.518 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -8.467 7.705 0.375 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -8.927 9.223 -0.369 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -6.062 8.371 0.220 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -6.840 8.252 -1.346 1.00 0.00 H new ATOM 0 HE ARG A 29 -6.273 10.836 0.075 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -6.610 8.909 -2.870 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -6.311 10.283 -3.939 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -5.917 12.598 -1.312 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -5.921 12.360 -3.063 1.00 0.00 H new ATOM 424 N PRO A 30 -5.813 10.039 3.938 1.00 0.00 N ATOM 425 CA PRO A 30 -5.368 10.911 5.029 1.00 0.00 C ATOM 426 C PRO A 30 -5.966 12.315 4.937 1.00 0.00 C ATOM 427 O PRO A 30 -5.546 13.092 4.053 1.00 0.00 O ATOM 428 CB PRO A 30 -3.848 10.954 4.849 1.00 0.00 C ATOM 429 CG PRO A 30 -3.628 10.706 3.398 1.00 0.00 C ATOM 430 CD PRO A 30 -4.739 9.793 2.955 1.00 0.00 C ATOM 431 OXT PRO A 30 -6.851 12.642 5.757 1.00 0.00 O ATOM 0 HA PRO A 30 -5.683 10.539 6.004 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -3.441 11.919 5.151 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -3.356 10.196 5.459 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -3.645 11.640 2.837 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -2.655 10.247 3.225 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -5.065 10.023 1.941 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -4.424 8.749 2.959 1.00 0.00 H new TER 439 PRO A 30 ATOM 440 N MET B 31 -21.378 35.000 -7.211 1.00 0.00 N ATOM 441 CA MET B 31 -19.928 34.860 -7.480 1.00 0.00 C ATOM 442 C MET B 31 -19.537 33.397 -7.610 1.00 0.00 C ATOM 443 O MET B 31 -19.998 32.550 -6.843 1.00 0.00 O ATOM 444 CB MET B 31 -19.109 35.504 -6.359 1.00 0.00 C ATOM 445 CG MET B 31 -19.057 37.020 -6.424 1.00 0.00 C ATOM 446 SD MET B 31 -18.232 37.621 -7.915 1.00 0.00 S ATOM 447 CE MET B 31 -16.641 36.806 -7.781 1.00 0.00 C ATOM 0 HA MET B 31 -19.716 35.368 -8.421 1.00 0.00 H new ATOM 0 HB2 MET B 31 -19.530 35.206 -5.399 1.00 0.00 H new ATOM 0 HB3 MET B 31 -18.092 35.114 -6.396 1.00 0.00 H new ATOM 0 HG2 MET B 31 -20.072 37.417 -6.389 1.00 0.00 H new ATOM 0 HG3 MET B 31 -18.535 37.400 -5.546 1.00 0.00 H new ATOM 0 HE1 MET B 31 -15.907 37.339 -8.386 1.00 0.00 H new ATOM 0 HE2 MET B 31 -16.320 36.804 -6.739 1.00 0.00 H new ATOM 0 HE3 MET B 31 -16.727 35.779 -8.136 1.00 0.00 H new ATOM 459 N ARG B 32 -18.693 33.107 -8.590 1.00 0.00 N ATOM 460 CA ARG B 32 -18.159 31.768 -8.780 1.00 0.00 C ATOM 461 C ARG B 32 -16.968 31.824 -9.732 1.00 0.00 C ATOM 462 O ARG B 32 -17.037 31.362 -10.873 1.00 0.00 O ATOM 463 CB ARG B 32 -19.235 30.819 -9.315 1.00 0.00 C ATOM 464 CG ARG B 32 -18.786 29.368 -9.374 1.00 0.00 C ATOM 465 CD ARG B 32 -19.892 28.459 -9.874 1.00 0.00 C ATOM 466 NE ARG B 32 -20.364 28.846 -11.203 1.00 0.00 N ATOM 467 CZ ARG B 32 -20.855 27.991 -12.094 1.00 0.00 C ATOM 468 NH1 ARG B 32 -20.898 26.692 -11.823 1.00 0.00 N ATOM 469 NH2 ARG B 32 -21.291 28.434 -13.263 1.00 0.00 N ATOM 0 H ARG B 32 -18.361 33.790 -9.272 1.00 0.00 H new ATOM 0 HA ARG B 32 -17.828 31.382 -7.816 1.00 0.00 H new ATOM 0 HB2 ARG B 32 -20.120 30.892 -8.683 1.00 0.00 H new ATOM 0 HB3 ARG B 32 -19.529 31.141 -10.314 1.00 0.00 H new ATOM 0 HG2 ARG B 32 -17.919 29.281 -10.030 1.00 0.00 H new ATOM 0 HG3 ARG B 32 -18.469 29.044 -8.383 1.00 0.00 H new ATOM 0 HD2 ARG B 32 -19.530 27.431 -9.903 1.00 0.00 H new ATOM 0 HD3 ARG B 32 -20.726 28.484 -9.172 1.00 0.00 H new ATOM 0 HE ARG B 32 -20.313 29.831 -11.462 1.00 0.00 H new ATOM 0 HH11 ARG B 32 -20.553 26.346 -10.927 1.00 0.00 H new ATOM 0 HH12 ARG B 32 -21.276 26.040 -12.510 1.00 0.00 H new ATOM 0 HH21 ARG B 32 -21.250 29.430 -13.479 1.00 0.00 H new ATOM 0 HH22 ARG B 32 -21.668 27.779 -13.948 1.00 0.00 H new ATOM 483 N GLY B 33 -15.883 32.419 -9.260 1.00 0.00 N ATOM 484 CA GLY B 33 -14.697 32.563 -10.079 1.00 0.00 C ATOM 485 C GLY B 33 -13.485 31.905 -9.459 1.00 0.00 C ATOM 486 O GLY B 33 -12.374 32.022 -9.977 1.00 0.00 O ATOM 0 H GLY B 33 -15.802 32.806 -8.320 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -14.882 32.127 -11.061 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -14.492 33.622 -10.234 1.00 0.00 H new ATOM 490 N SER B 34 -13.696 31.217 -8.349 1.00 0.00 N ATOM 491 CA SER B 34 -12.616 30.533 -7.661 1.00 0.00 C ATOM 492 C SER B 34 -12.620 29.056 -8.033 1.00 0.00 C ATOM 493 O SER B 34 -13.385 28.266 -7.479 1.00 0.00 O ATOM 494 CB SER B 34 -12.760 30.703 -6.145 1.00 0.00 C ATOM 495 OG SER B 34 -11.602 30.246 -5.457 1.00 0.00 O ATOM 0 H SER B 34 -14.609 31.118 -7.905 1.00 0.00 H new ATOM 0 HA SER B 34 -11.666 30.971 -7.968 1.00 0.00 H new ATOM 0 HB2 SER B 34 -12.933 31.753 -5.910 1.00 0.00 H new ATOM 0 HB3 SER B 34 -13.633 30.151 -5.797 1.00 0.00 H new ATOM 0 HG SER B 34 -11.725 30.369 -4.493 1.00 0.00 H new ATOM 501 N ASN B 35 -11.786 28.694 -8.995 1.00 0.00 N ATOM 502 CA ASN B 35 -11.684 27.311 -9.441 1.00 0.00 C ATOM 503 C ASN B 35 -10.217 26.915 -9.556 1.00 0.00 C ATOM 504 O ASN B 35 -9.611 27.037 -10.623 1.00 0.00 O ATOM 505 CB ASN B 35 -12.389 27.129 -10.790 1.00 0.00 C ATOM 506 CG ASN B 35 -12.564 25.670 -11.183 1.00 0.00 C ATOM 507 OD1 ASN B 35 -11.786 24.801 -10.785 1.00 0.00 O ATOM 508 ND2 ASN B 35 -13.581 25.391 -11.984 1.00 0.00 N ATOM 0 H ASN B 35 -11.167 29.341 -9.484 1.00 0.00 H new ATOM 0 HA ASN B 35 -12.172 26.667 -8.709 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -13.368 27.607 -10.749 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -11.817 27.641 -11.564 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -13.740 24.431 -12.291 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -14.205 26.136 -12.294 1.00 0.00 H new ATOM 515 N ALA B 36 -9.649 26.456 -8.453 1.00 0.00 N ATOM 516 CA ALA B 36 -8.248 26.066 -8.421 1.00 0.00 C ATOM 517 C ALA B 36 -8.103 24.608 -8.000 1.00 0.00 C ATOM 518 O ALA B 36 -8.215 24.283 -6.816 1.00 0.00 O ATOM 519 CB ALA B 36 -7.467 26.975 -7.483 1.00 0.00 C ATOM 0 H ALA B 36 -10.138 26.344 -7.565 1.00 0.00 H new ATOM 0 HA ALA B 36 -7.838 26.171 -9.426 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -6.420 26.671 -7.469 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -7.541 28.006 -7.830 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -7.880 26.900 -6.477 1.00 0.00 H new ATOM 525 N PRO B 37 -7.856 23.708 -8.967 1.00 0.00 N ATOM 526 CA PRO B 37 -7.728 22.274 -8.697 1.00 0.00 C ATOM 527 C PRO B 37 -6.522 21.961 -7.816 1.00 0.00 C ATOM 528 O PRO B 37 -5.449 22.551 -7.980 1.00 0.00 O ATOM 529 CB PRO B 37 -7.558 21.653 -10.087 1.00 0.00 C ATOM 530 CG PRO B 37 -7.068 22.763 -10.950 1.00 0.00 C ATOM 531 CD PRO B 37 -7.674 24.019 -10.395 1.00 0.00 C ATOM 0 HA PRO B 37 -8.589 21.884 -8.153 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -6.847 20.827 -10.066 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -8.501 21.252 -10.458 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -5.979 22.816 -10.936 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -7.367 22.611 -11.987 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -7.019 24.879 -10.539 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -8.622 24.256 -10.879 1.00 0.00 H new ATOM 539 N GLN B 38 -6.703 21.042 -6.879 1.00 0.00 N ATOM 540 CA GLN B 38 -5.643 20.680 -5.952 1.00 0.00 C ATOM 541 C GLN B 38 -4.670 19.694 -6.591 1.00 0.00 C ATOM 542 O GLN B 38 -5.054 18.591 -6.989 1.00 0.00 O ATOM 543 CB GLN B 38 -6.227 20.084 -4.668 1.00 0.00 C ATOM 544 CG GLN B 38 -7.068 21.069 -3.870 1.00 0.00 C ATOM 545 CD GLN B 38 -7.589 20.487 -2.569 1.00 0.00 C ATOM 546 OE1 GLN B 38 -8.659 20.866 -2.094 1.00 0.00 O ATOM 547 NE2 GLN B 38 -6.834 19.574 -1.975 1.00 0.00 N ATOM 0 H GLN B 38 -7.576 20.533 -6.741 1.00 0.00 H new ATOM 0 HA GLN B 38 -5.097 21.589 -5.700 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -6.839 19.219 -4.924 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -5.412 19.723 -4.041 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -6.471 21.955 -3.652 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -7.911 21.395 -4.479 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -5.953 19.286 -2.400 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -7.134 19.160 -1.093 1.00 0.00 H new ATOM 556 N PRO B 39 -3.391 20.089 -6.694 1.00 0.00 N ATOM 557 CA PRO B 39 -2.341 19.248 -7.275 1.00 0.00 C ATOM 558 C PRO B 39 -2.033 18.039 -6.401 1.00 0.00 C ATOM 559 O PRO B 39 -1.514 17.023 -6.872 1.00 0.00 O ATOM 560 CB PRO B 39 -1.129 20.180 -7.351 1.00 0.00 C ATOM 561 CG PRO B 39 -1.379 21.229 -6.324 1.00 0.00 C ATOM 562 CD PRO B 39 -2.870 21.396 -6.248 1.00 0.00 C ATOM 0 HA PRO B 39 -2.633 18.839 -8.242 1.00 0.00 H new ATOM 0 HB2 PRO B 39 -0.204 19.641 -7.146 1.00 0.00 H new ATOM 0 HB3 PRO B 39 -1.030 20.617 -8.345 1.00 0.00 H new ATOM 0 HG2 PRO B 39 -0.971 20.932 -5.358 1.00 0.00 H new ATOM 0 HG3 PRO B 39 -0.896 22.166 -6.600 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -3.195 21.632 -5.235 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -3.216 22.206 -6.891 1.00 0.00 H new ATOM 570 N SER B 40 -2.375 18.153 -5.127 1.00 0.00 N ATOM 571 CA SER B 40 -2.143 17.090 -4.169 1.00 0.00 C ATOM 572 C SER B 40 -3.229 16.027 -4.274 1.00 0.00 C ATOM 573 O SER B 40 -4.135 15.957 -3.445 1.00 0.00 O ATOM 574 CB SER B 40 -2.100 17.662 -2.753 1.00 0.00 C ATOM 575 OG SER B 40 -1.725 16.678 -1.804 1.00 0.00 O ATOM 0 H SER B 40 -2.819 18.982 -4.732 1.00 0.00 H new ATOM 0 HA SER B 40 -1.183 16.624 -4.393 1.00 0.00 H new ATOM 0 HB2 SER B 40 -1.394 18.491 -2.716 1.00 0.00 H new ATOM 0 HB3 SER B 40 -3.079 18.065 -2.493 1.00 0.00 H new ATOM 0 HG SER B 40 -1.706 17.077 -0.909 1.00 0.00 H new ATOM 581 N HIS B 41 -3.153 15.220 -5.316 1.00 0.00 N ATOM 582 CA HIS B 41 -4.049 14.090 -5.461 1.00 0.00 C ATOM 583 C HIS B 41 -3.270 12.897 -5.990 1.00 0.00 C ATOM 584 O HIS B 41 -2.367 13.050 -6.818 1.00 0.00 O ATOM 585 CB HIS B 41 -5.261 14.438 -6.353 1.00 0.00 C ATOM 586 CG HIS B 41 -4.970 14.651 -7.810 1.00 0.00 C ATOM 587 ND1 HIS B 41 -5.029 15.889 -8.414 1.00 0.00 N ATOM 588 CD2 HIS B 41 -4.685 13.768 -8.798 1.00 0.00 C ATOM 589 CE1 HIS B 41 -4.796 15.755 -9.707 1.00 0.00 C ATOM 590 NE2 HIS B 41 -4.583 14.479 -9.963 1.00 0.00 N ATOM 0 H HIS B 41 -2.479 15.327 -6.074 1.00 0.00 H new ATOM 0 HA HIS B 41 -4.458 13.830 -4.485 1.00 0.00 H new ATOM 0 HB2 HIS B 41 -5.994 13.636 -6.263 1.00 0.00 H new ATOM 0 HB3 HIS B 41 -5.727 15.342 -5.961 1.00 0.00 H new ATOM 0 HD1 HIS B 41 -5.222 16.770 -7.937 1.00 0.00 H new ATOM 0 HD2 HIS B 41 -4.561 12.701 -8.687 1.00 0.00 H new ATOM 0 HE1 HIS B 41 -4.782 16.555 -10.432 1.00 0.00 H new ATOM 599 N ILE B 42 -3.603 11.719 -5.489 1.00 0.00 N ATOM 600 CA ILE B 42 -2.861 10.508 -5.806 1.00 0.00 C ATOM 601 C ILE B 42 -3.257 9.986 -7.180 1.00 0.00 C ATOM 602 O ILE B 42 -4.434 9.754 -7.461 1.00 0.00 O ATOM 603 CB ILE B 42 -3.073 9.406 -4.732 1.00 0.00 C ATOM 604 CG1 ILE B 42 -2.282 9.717 -3.449 1.00 0.00 C ATOM 605 CG2 ILE B 42 -2.668 8.039 -5.267 1.00 0.00 C ATOM 606 CD1 ILE B 42 -2.767 10.932 -2.684 1.00 0.00 C ATOM 0 H ILE B 42 -4.389 11.574 -4.856 1.00 0.00 H new ATOM 0 HA ILE B 42 -1.802 10.765 -5.814 1.00 0.00 H new ATOM 0 HB ILE B 42 -4.136 9.390 -4.490 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -2.327 8.849 -2.791 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -1.234 9.864 -3.711 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -2.826 7.285 -4.496 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -3.273 7.797 -6.141 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -1.615 8.056 -5.548 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -2.151 11.073 -1.796 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -2.695 11.815 -3.319 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -3.805 10.784 -2.385 1.00 0.00 H new ATOM 618 N SER B 43 -2.255 9.819 -8.030 1.00 0.00 N ATOM 619 CA SER B 43 -2.457 9.371 -9.395 1.00 0.00 C ATOM 620 C SER B 43 -2.787 7.883 -9.431 1.00 0.00 C ATOM 621 O SER B 43 -3.659 7.447 -10.187 1.00 0.00 O ATOM 622 CB SER B 43 -1.193 9.649 -10.209 1.00 0.00 C ATOM 623 OG SER B 43 -0.778 11.000 -10.061 1.00 0.00 O ATOM 0 H SER B 43 -1.279 9.991 -7.790 1.00 0.00 H new ATOM 0 HA SER B 43 -3.297 9.915 -9.826 1.00 0.00 H new ATOM 0 HB2 SER B 43 -0.394 8.982 -9.885 1.00 0.00 H new ATOM 0 HB3 SER B 43 -1.380 9.436 -11.261 1.00 0.00 H new ATOM 0 HG SER B 43 0.033 11.153 -10.589 1.00 0.00 H new ATOM 629 N LYS B 44 -2.094 7.110 -8.601 1.00 0.00 N ATOM 630 CA LYS B 44 -2.298 5.670 -8.546 1.00 0.00 C ATOM 631 C LYS B 44 -1.714 5.088 -7.264 1.00 0.00 C ATOM 632 O LYS B 44 -0.727 5.600 -6.729 1.00 0.00 O ATOM 633 CB LYS B 44 -1.670 4.989 -9.772 1.00 0.00 C ATOM 634 CG LYS B 44 -0.177 5.248 -9.931 1.00 0.00 C ATOM 635 CD LYS B 44 0.348 4.678 -11.238 1.00 0.00 C ATOM 636 CE LYS B 44 1.828 4.978 -11.431 1.00 0.00 C ATOM 637 NZ LYS B 44 2.322 4.496 -12.748 1.00 0.00 N ATOM 0 H LYS B 44 -1.385 7.460 -7.956 1.00 0.00 H new ATOM 0 HA LYS B 44 -3.371 5.481 -8.552 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -1.836 3.914 -9.702 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -2.185 5.333 -10.669 1.00 0.00 H new ATOM 0 HG2 LYS B 44 0.013 6.321 -9.898 1.00 0.00 H new ATOM 0 HG3 LYS B 44 0.362 4.802 -9.095 1.00 0.00 H new ATOM 0 HD2 LYS B 44 0.191 3.600 -11.254 1.00 0.00 H new ATOM 0 HD3 LYS B 44 -0.219 5.095 -12.070 1.00 0.00 H new ATOM 0 HE2 LYS B 44 1.994 6.052 -11.351 1.00 0.00 H new ATOM 0 HE3 LYS B 44 2.402 4.507 -10.633 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 3.334 4.719 -12.842 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 2.186 3.467 -12.814 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 1.792 4.965 -13.510 1.00 0.00 H new ATOM 651 N TYR B 45 -2.349 4.042 -6.762 1.00 0.00 N ATOM 652 CA TYR B 45 -1.846 3.310 -5.612 1.00 0.00 C ATOM 653 C TYR B 45 -1.221 2.010 -6.101 1.00 0.00 C ATOM 654 O TYR B 45 -1.782 1.342 -6.969 1.00 0.00 O ATOM 655 CB TYR B 45 -2.972 2.965 -4.629 1.00 0.00 C ATOM 656 CG TYR B 45 -3.914 4.102 -4.292 1.00 0.00 C ATOM 657 CD1 TYR B 45 -5.131 4.230 -4.949 1.00 0.00 C ATOM 658 CD2 TYR B 45 -3.604 5.022 -3.299 1.00 0.00 C ATOM 659 CE1 TYR B 45 -6.012 5.242 -4.628 1.00 0.00 C ATOM 660 CE2 TYR B 45 -4.481 6.043 -2.976 1.00 0.00 C ATOM 661 CZ TYR B 45 -5.685 6.146 -3.643 1.00 0.00 C ATOM 662 OH TYR B 45 -6.570 7.149 -3.318 1.00 0.00 O ATOM 0 H TYR B 45 -3.224 3.678 -7.138 1.00 0.00 H new ATOM 0 HA TYR B 45 -1.116 3.936 -5.098 1.00 0.00 H new ATOM 0 HB2 TYR B 45 -3.556 2.144 -5.046 1.00 0.00 H new ATOM 0 HB3 TYR B 45 -2.525 2.601 -3.704 1.00 0.00 H new ATOM 0 HD1 TYR B 45 -5.392 3.525 -5.725 1.00 0.00 H new ATOM 0 HD2 TYR B 45 -2.665 4.940 -2.771 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -6.955 5.325 -5.148 1.00 0.00 H new ATOM 0 HE2 TYR B 45 -4.224 6.755 -2.206 1.00 0.00 H new ATOM 0 HH TYR B 45 -7.470 6.773 -3.224 1.00 0.00 H new ATOM 672 N ILE B 46 -0.070 1.658 -5.569 1.00 0.00 N ATOM 673 CA ILE B 46 0.577 0.408 -5.929 1.00 0.00 C ATOM 674 C ILE B 46 0.540 -0.554 -4.751 1.00 0.00 C ATOM 675 O ILE B 46 1.060 -0.257 -3.675 1.00 0.00 O ATOM 676 CB ILE B 46 2.043 0.615 -6.403 1.00 0.00 C ATOM 677 CG1 ILE B 46 2.089 1.188 -7.830 1.00 0.00 C ATOM 678 CG2 ILE B 46 2.828 -0.691 -6.341 1.00 0.00 C ATOM 679 CD1 ILE B 46 1.636 2.629 -7.942 1.00 0.00 C ATOM 0 H ILE B 46 0.439 2.218 -4.885 1.00 0.00 H new ATOM 0 HA ILE B 46 0.023 -0.014 -6.768 1.00 0.00 H new ATOM 0 HB ILE B 46 2.506 1.333 -5.726 1.00 0.00 H new ATOM 0 HG12 ILE B 46 3.109 1.110 -8.207 1.00 0.00 H new ATOM 0 HG13 ILE B 46 1.463 0.572 -8.476 1.00 0.00 H new ATOM 0 HG21 ILE B 46 3.850 -0.518 -6.678 1.00 0.00 H new ATOM 0 HG22 ILE B 46 2.842 -1.059 -5.315 1.00 0.00 H new ATOM 0 HG23 ILE B 46 2.354 -1.431 -6.986 1.00 0.00 H new ATOM 0 HD11 ILE B 46 1.701 2.951 -8.981 1.00 0.00 H new ATOM 0 HD12 ILE B 46 0.605 2.714 -7.599 1.00 0.00 H new ATOM 0 HD13 ILE B 46 2.276 3.261 -7.326 1.00 0.00 H new ATOM 691 N LEU B 47 -0.104 -1.689 -4.954 1.00 0.00 N ATOM 692 CA LEU B 47 -0.184 -2.718 -3.932 1.00 0.00 C ATOM 693 C LEU B 47 0.812 -3.817 -4.267 1.00 0.00 C ATOM 694 O LEU B 47 0.719 -4.443 -5.323 1.00 0.00 O ATOM 695 CB LEU B 47 -1.616 -3.291 -3.872 1.00 0.00 C ATOM 696 CG LEU B 47 -2.072 -3.907 -2.532 1.00 0.00 C ATOM 697 CD1 LEU B 47 -1.160 -5.034 -2.078 1.00 0.00 C ATOM 698 CD2 LEU B 47 -2.176 -2.842 -1.454 1.00 0.00 C ATOM 0 H LEU B 47 -0.583 -1.923 -5.824 1.00 0.00 H new ATOM 0 HA LEU B 47 0.056 -2.293 -2.957 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -2.311 -2.492 -4.131 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.707 -4.055 -4.644 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.060 -4.335 -2.700 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -1.521 -5.435 -1.131 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.156 -5.824 -2.829 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.147 -4.652 -1.947 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -2.499 -3.301 -0.519 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.203 -2.373 -1.311 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -2.901 -2.087 -1.757 1.00 0.00 H new ATOM 710 N ARG B 48 1.785 -4.022 -3.395 1.00 0.00 N ATOM 711 CA ARG B 48 2.752 -5.093 -3.583 1.00 0.00 C ATOM 712 C ARG B 48 2.660 -6.092 -2.447 1.00 0.00 C ATOM 713 O ARG B 48 2.715 -5.711 -1.279 1.00 0.00 O ATOM 714 CB ARG B 48 4.177 -4.545 -3.669 1.00 0.00 C ATOM 715 CG ARG B 48 4.398 -3.591 -4.829 1.00 0.00 C ATOM 716 CD ARG B 48 5.873 -3.275 -5.017 1.00 0.00 C ATOM 717 NE ARG B 48 6.473 -2.719 -3.808 1.00 0.00 N ATOM 718 CZ ARG B 48 7.777 -2.790 -3.521 1.00 0.00 C ATOM 719 NH1 ARG B 48 8.618 -3.388 -4.355 1.00 0.00 N ATOM 720 NH2 ARG B 48 8.242 -2.253 -2.400 1.00 0.00 N ATOM 0 H ARG B 48 1.927 -3.464 -2.553 1.00 0.00 H new ATOM 0 HA ARG B 48 2.516 -5.591 -4.524 1.00 0.00 H new ATOM 0 HB2 ARG B 48 4.415 -4.031 -2.738 1.00 0.00 H new ATOM 0 HB3 ARG B 48 4.872 -5.380 -3.760 1.00 0.00 H new ATOM 0 HG2 ARG B 48 3.999 -4.030 -5.744 1.00 0.00 H new ATOM 0 HG3 ARG B 48 3.847 -2.668 -4.652 1.00 0.00 H new ATOM 0 HD2 ARG B 48 6.405 -4.183 -5.301 1.00 0.00 H new ATOM 0 HD3 ARG B 48 5.990 -2.568 -5.838 1.00 0.00 H new ATOM 0 HE ARG B 48 5.861 -2.248 -3.142 1.00 0.00 H new ATOM 0 HH11 ARG B 48 8.271 -3.798 -5.222 1.00 0.00 H new ATOM 0 HH12 ARG B 48 9.611 -3.438 -4.129 1.00 0.00 H new ATOM 0 HH21 ARG B 48 7.604 -1.785 -1.756 1.00 0.00 H new ATOM 0 HH22 ARG B 48 9.237 -2.308 -2.183 1.00 0.00 H new ATOM 734 N TRP B 49 2.510 -7.364 -2.786 1.00 0.00 N ATOM 735 CA TRP B 49 2.437 -8.404 -1.775 1.00 0.00 C ATOM 736 C TRP B 49 3.437 -9.517 -2.055 1.00 0.00 C ATOM 737 O TRP B 49 3.657 -9.908 -3.204 1.00 0.00 O ATOM 738 CB TRP B 49 1.013 -8.964 -1.638 1.00 0.00 C ATOM 739 CG TRP B 49 0.458 -9.612 -2.874 1.00 0.00 C ATOM 740 CD1 TRP B 49 0.364 -10.951 -3.126 1.00 0.00 C ATOM 741 CD2 TRP B 49 -0.102 -8.950 -4.012 1.00 0.00 C ATOM 742 NE1 TRP B 49 -0.225 -11.162 -4.350 1.00 0.00 N ATOM 743 CE2 TRP B 49 -0.518 -9.947 -4.913 1.00 0.00 C ATOM 744 CE3 TRP B 49 -0.293 -7.612 -4.355 1.00 0.00 C ATOM 745 CZ2 TRP B 49 -1.114 -9.644 -6.133 1.00 0.00 C ATOM 746 CZ3 TRP B 49 -0.884 -7.313 -5.565 1.00 0.00 C ATOM 747 CH2 TRP B 49 -1.290 -8.324 -6.441 1.00 0.00 C ATOM 0 H TRP B 49 2.437 -7.698 -3.747 1.00 0.00 H new ATOM 0 HA TRP B 49 2.702 -7.947 -0.822 1.00 0.00 H new ATOM 0 HB2 TRP B 49 1.004 -9.694 -0.829 1.00 0.00 H new ATOM 0 HB3 TRP B 49 0.348 -8.153 -1.343 1.00 0.00 H new ATOM 0 HD1 TRP B 49 0.703 -11.731 -2.460 1.00 0.00 H new ATOM 0 HE1 TRP B 49 -0.413 -12.072 -4.770 1.00 0.00 H new ATOM 0 HE3 TRP B 49 0.016 -6.824 -3.685 1.00 0.00 H new ATOM 0 HZ2 TRP B 49 -1.426 -10.424 -6.812 1.00 0.00 H new ATOM 0 HZ3 TRP B 49 -1.036 -6.280 -5.840 1.00 0.00 H new ATOM 0 HH2 TRP B 49 -1.752 -8.057 -7.380 1.00 0.00 H new ATOM 758 N ARG B 50 4.052 -9.998 -0.989 1.00 0.00 N ATOM 759 CA ARG B 50 5.053 -11.048 -1.070 1.00 0.00 C ATOM 760 C ARG B 50 4.826 -12.045 0.061 1.00 0.00 C ATOM 761 O ARG B 50 4.651 -11.641 1.212 1.00 0.00 O ATOM 762 CB ARG B 50 6.453 -10.419 -0.977 1.00 0.00 C ATOM 763 CG ARG B 50 7.613 -11.365 -1.270 1.00 0.00 C ATOM 764 CD ARG B 50 8.034 -12.161 -0.045 1.00 0.00 C ATOM 765 NE ARG B 50 8.496 -11.299 1.046 1.00 0.00 N ATOM 766 CZ ARG B 50 9.100 -11.752 2.146 1.00 0.00 C ATOM 767 NH1 ARG B 50 9.300 -13.055 2.311 1.00 0.00 N ATOM 768 NH2 ARG B 50 9.495 -10.905 3.091 1.00 0.00 N ATOM 0 H ARG B 50 3.871 -9.671 -0.040 1.00 0.00 H new ATOM 0 HA ARG B 50 4.973 -11.577 -2.020 1.00 0.00 H new ATOM 0 HB2 ARG B 50 6.504 -9.582 -1.673 1.00 0.00 H new ATOM 0 HB3 ARG B 50 6.584 -10.010 0.025 1.00 0.00 H new ATOM 0 HG2 ARG B 50 7.326 -12.052 -2.066 1.00 0.00 H new ATOM 0 HG3 ARG B 50 8.464 -10.790 -1.637 1.00 0.00 H new ATOM 0 HD2 ARG B 50 7.194 -12.763 0.301 1.00 0.00 H new ATOM 0 HD3 ARG B 50 8.830 -12.853 -0.320 1.00 0.00 H new ATOM 0 HE ARG B 50 8.347 -10.294 0.959 1.00 0.00 H new ATOM 0 HH11 ARG B 50 8.991 -13.713 1.595 1.00 0.00 H new ATOM 0 HH12 ARG B 50 9.762 -13.397 3.153 1.00 0.00 H new ATOM 0 HH21 ARG B 50 9.337 -9.904 2.977 1.00 0.00 H new ATOM 0 HH22 ARG B 50 9.956 -11.256 3.930 1.00 0.00 H new ATOM 782 N PRO B 51 4.793 -13.352 -0.248 1.00 0.00 N ATOM 783 CA PRO B 51 4.617 -14.394 0.769 1.00 0.00 C ATOM 784 C PRO B 51 5.753 -14.377 1.786 1.00 0.00 C ATOM 785 O PRO B 51 6.911 -14.619 1.448 1.00 0.00 O ATOM 786 CB PRO B 51 4.625 -15.701 -0.026 1.00 0.00 C ATOM 787 CG PRO B 51 4.391 -15.314 -1.446 1.00 0.00 C ATOM 788 CD PRO B 51 4.918 -13.916 -1.602 1.00 0.00 C ATOM 0 HA PRO B 51 3.701 -14.254 1.344 1.00 0.00 H new ATOM 0 HB2 PRO B 51 5.576 -16.221 0.086 1.00 0.00 H new ATOM 0 HB3 PRO B 51 3.848 -16.379 0.328 1.00 0.00 H new ATOM 0 HG2 PRO B 51 4.902 -15.998 -2.123 1.00 0.00 H new ATOM 0 HG3 PRO B 51 3.329 -15.357 -1.690 1.00 0.00 H new ATOM 0 HD2 PRO B 51 5.953 -13.912 -1.945 1.00 0.00 H new ATOM 0 HD3 PRO B 51 4.339 -13.347 -2.329 1.00 0.00 H new ATOM 796 N LYS B 52 5.394 -14.104 3.033 1.00 0.00 N ATOM 797 CA LYS B 52 6.353 -13.859 4.106 1.00 0.00 C ATOM 798 C LYS B 52 7.291 -15.042 4.318 1.00 0.00 C ATOM 799 O LYS B 52 8.488 -14.865 4.534 1.00 0.00 O ATOM 800 CB LYS B 52 5.583 -13.581 5.393 1.00 0.00 C ATOM 801 CG LYS B 52 6.080 -12.392 6.190 1.00 0.00 C ATOM 802 CD LYS B 52 7.376 -12.685 6.921 1.00 0.00 C ATOM 803 CE LYS B 52 7.927 -11.432 7.580 1.00 0.00 C ATOM 804 NZ LYS B 52 6.894 -10.717 8.377 1.00 0.00 N ATOM 0 H LYS B 52 4.421 -14.045 3.333 1.00 0.00 H new ATOM 0 HA LYS B 52 6.967 -13.003 3.827 1.00 0.00 H new ATOM 0 HB2 LYS B 52 4.534 -13.420 5.144 1.00 0.00 H new ATOM 0 HB3 LYS B 52 5.628 -14.468 6.025 1.00 0.00 H new ATOM 0 HG2 LYS B 52 6.228 -11.545 5.520 1.00 0.00 H new ATOM 0 HG3 LYS B 52 5.318 -12.098 6.912 1.00 0.00 H new ATOM 0 HD2 LYS B 52 7.206 -13.452 7.676 1.00 0.00 H new ATOM 0 HD3 LYS B 52 8.110 -13.084 6.221 1.00 0.00 H new ATOM 0 HE2 LYS B 52 8.762 -11.701 8.227 1.00 0.00 H new ATOM 0 HE3 LYS B 52 8.320 -10.763 6.814 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 7.351 -9.993 8.967 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 6.214 -10.262 7.735 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 6.394 -11.396 8.986 1.00 0.00 H new ATOM 818 N ASN B 53 6.739 -16.243 4.251 1.00 0.00 N ATOM 819 CA ASN B 53 7.499 -17.455 4.534 1.00 0.00 C ATOM 820 C ASN B 53 8.206 -17.981 3.288 1.00 0.00 C ATOM 821 O ASN B 53 8.986 -18.930 3.363 1.00 0.00 O ATOM 822 CB ASN B 53 6.573 -18.534 5.103 1.00 0.00 C ATOM 823 CG ASN B 53 5.426 -18.866 4.168 1.00 0.00 C ATOM 824 OD1 ASN B 53 4.379 -18.223 4.207 1.00 0.00 O ATOM 825 ND2 ASN B 53 5.613 -19.872 3.328 1.00 0.00 N ATOM 0 H ASN B 53 5.764 -16.407 4.002 1.00 0.00 H new ATOM 0 HA ASN B 53 8.262 -17.204 5.270 1.00 0.00 H new ATOM 0 HB2 ASN B 53 7.151 -19.437 5.300 1.00 0.00 H new ATOM 0 HB3 ASN B 53 6.172 -18.197 6.059 1.00 0.00 H new ATOM 0 HD21 ASN B 53 4.872 -20.140 2.680 1.00 0.00 H new ATOM 0 HD22 ASN B 53 6.498 -20.379 3.329 1.00 0.00 H new ATOM 832 N SER B 54 7.934 -17.370 2.146 1.00 0.00 N ATOM 833 CA SER B 54 8.517 -17.821 0.892 1.00 0.00 C ATOM 834 C SER B 54 9.545 -16.818 0.380 1.00 0.00 C ATOM 835 O SER B 54 9.524 -15.640 0.745 1.00 0.00 O ATOM 836 CB SER B 54 7.421 -18.020 -0.154 1.00 0.00 C ATOM 837 OG SER B 54 6.321 -18.725 0.393 1.00 0.00 O ATOM 0 H SER B 54 7.316 -16.563 2.061 1.00 0.00 H new ATOM 0 HA SER B 54 9.020 -18.771 1.071 1.00 0.00 H new ATOM 0 HB2 SER B 54 7.088 -17.051 -0.526 1.00 0.00 H new ATOM 0 HB3 SER B 54 7.822 -18.568 -1.006 1.00 0.00 H new ATOM 0 HG SER B 54 5.631 -18.839 -0.294 1.00 0.00 H new ATOM 843 N VAL B 55 10.445 -17.295 -0.467 1.00 0.00 N ATOM 844 CA VAL B 55 11.470 -16.458 -1.060 1.00 0.00 C ATOM 845 C VAL B 55 10.979 -15.894 -2.405 1.00 0.00 C ATOM 846 O VAL B 55 11.751 -15.650 -3.335 1.00 0.00 O ATOM 847 CB VAL B 55 12.776 -17.274 -1.233 1.00 0.00 C ATOM 848 CG1 VAL B 55 12.614 -18.366 -2.281 1.00 0.00 C ATOM 849 CG2 VAL B 55 13.950 -16.368 -1.554 1.00 0.00 C ATOM 0 H VAL B 55 10.483 -18.271 -0.760 1.00 0.00 H new ATOM 0 HA VAL B 55 11.679 -15.615 -0.401 1.00 0.00 H new ATOM 0 HB VAL B 55 12.988 -17.764 -0.283 1.00 0.00 H new ATOM 0 HG11 VAL B 55 13.548 -18.919 -2.377 1.00 0.00 H new ATOM 0 HG12 VAL B 55 11.819 -19.047 -1.977 1.00 0.00 H new ATOM 0 HG13 VAL B 55 12.359 -17.915 -3.240 1.00 0.00 H new ATOM 0 HG21 VAL B 55 14.852 -16.969 -1.670 1.00 0.00 H new ATOM 0 HG22 VAL B 55 13.751 -15.829 -2.481 1.00 0.00 H new ATOM 0 HG23 VAL B 55 14.091 -15.654 -0.743 1.00 0.00 H new ATOM 859 N GLY B 56 9.671 -15.688 -2.493 1.00 0.00 N ATOM 860 CA GLY B 56 9.074 -15.162 -3.704 1.00 0.00 C ATOM 861 C GLY B 56 9.292 -13.669 -3.855 1.00 0.00 C ATOM 862 O GLY B 56 9.878 -13.027 -2.981 1.00 0.00 O ATOM 0 H GLY B 56 9.009 -15.878 -1.741 1.00 0.00 H new ATOM 0 HA2 GLY B 56 9.496 -15.677 -4.567 1.00 0.00 H new ATOM 0 HA3 GLY B 56 8.004 -15.372 -3.699 1.00 0.00 H new ATOM 866 N ARG B 57 8.816 -13.116 -4.959 1.00 0.00 N ATOM 867 CA ARG B 57 8.991 -11.698 -5.244 1.00 0.00 C ATOM 868 C ARG B 57 7.735 -10.917 -4.891 1.00 0.00 C ATOM 869 O ARG B 57 6.681 -11.499 -4.620 1.00 0.00 O ATOM 870 CB ARG B 57 9.340 -11.481 -6.721 1.00 0.00 C ATOM 871 CG ARG B 57 10.797 -11.761 -7.064 1.00 0.00 C ATOM 872 CD ARG B 57 11.125 -13.240 -6.965 1.00 0.00 C ATOM 873 NE ARG B 57 12.546 -13.507 -7.167 1.00 0.00 N ATOM 874 CZ ARG B 57 13.038 -14.708 -7.464 1.00 0.00 C ATOM 875 NH1 ARG B 57 12.219 -15.742 -7.624 1.00 0.00 N ATOM 876 NH2 ARG B 57 14.346 -14.873 -7.609 1.00 0.00 N ATOM 0 H ARG B 57 8.303 -13.629 -5.676 1.00 0.00 H new ATOM 0 HA ARG B 57 9.815 -11.333 -4.630 1.00 0.00 H new ATOM 0 HB2 ARG B 57 8.705 -12.123 -7.331 1.00 0.00 H new ATOM 0 HB3 ARG B 57 9.106 -10.451 -6.991 1.00 0.00 H new ATOM 0 HG2 ARG B 57 11.007 -11.409 -8.074 1.00 0.00 H new ATOM 0 HG3 ARG B 57 11.444 -11.199 -6.390 1.00 0.00 H new ATOM 0 HD2 ARG B 57 10.823 -13.612 -5.986 1.00 0.00 H new ATOM 0 HD3 ARG B 57 10.545 -13.789 -7.707 1.00 0.00 H new ATOM 0 HE ARG B 57 13.199 -12.729 -7.075 1.00 0.00 H new ATOM 0 HH11 ARG B 57 11.212 -15.616 -7.519 1.00 0.00 H new ATOM 0 HH12 ARG B 57 12.597 -16.662 -7.852 1.00 0.00 H new ATOM 0 HH21 ARG B 57 14.976 -14.079 -7.493 1.00 0.00 H new ATOM 0 HH22 ARG B 57 14.722 -15.794 -7.837 1.00 0.00 H new ATOM 890 N TRP B 58 7.853 -9.598 -4.889 1.00 0.00 N ATOM 891 CA TRP B 58 6.728 -8.728 -4.587 1.00 0.00 C ATOM 892 C TRP B 58 5.863 -8.553 -5.826 1.00 0.00 C ATOM 893 O TRP B 58 6.307 -7.985 -6.827 1.00 0.00 O ATOM 894 CB TRP B 58 7.216 -7.358 -4.103 1.00 0.00 C ATOM 895 CG TRP B 58 8.036 -7.411 -2.852 1.00 0.00 C ATOM 896 CD1 TRP B 58 9.378 -7.646 -2.760 1.00 0.00 C ATOM 897 CD2 TRP B 58 7.569 -7.217 -1.511 1.00 0.00 C ATOM 898 NE1 TRP B 58 9.771 -7.621 -1.445 1.00 0.00 N ATOM 899 CE2 TRP B 58 8.681 -7.357 -0.660 1.00 0.00 C ATOM 900 CE3 TRP B 58 6.320 -6.941 -0.948 1.00 0.00 C ATOM 901 CZ2 TRP B 58 8.580 -7.231 0.723 1.00 0.00 C ATOM 902 CZ3 TRP B 58 6.223 -6.817 0.425 1.00 0.00 C ATOM 903 CH2 TRP B 58 7.347 -6.961 1.246 1.00 0.00 C ATOM 0 H TRP B 58 8.722 -9.105 -5.094 1.00 0.00 H new ATOM 0 HA TRP B 58 6.140 -9.189 -3.793 1.00 0.00 H new ATOM 0 HB2 TRP B 58 7.807 -6.894 -4.893 1.00 0.00 H new ATOM 0 HB3 TRP B 58 6.352 -6.716 -3.932 1.00 0.00 H new ATOM 0 HD1 TRP B 58 10.034 -7.825 -3.599 1.00 0.00 H new ATOM 0 HE1 TRP B 58 10.721 -7.774 -1.107 1.00 0.00 H new ATOM 0 HE3 TRP B 58 5.447 -6.827 -1.574 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 9.445 -7.343 1.360 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 5.263 -6.605 0.872 1.00 0.00 H new ATOM 0 HH2 TRP B 58 7.238 -6.857 2.315 1.00 0.00 H new ATOM 914 N LYS B 59 4.638 -9.043 -5.758 1.00 0.00 N ATOM 915 CA LYS B 59 3.710 -8.912 -6.868 1.00 0.00 C ATOM 916 C LYS B 59 3.105 -7.517 -6.853 1.00 0.00 C ATOM 917 O LYS B 59 2.778 -6.997 -5.790 1.00 0.00 O ATOM 918 CB LYS B 59 2.618 -9.980 -6.779 1.00 0.00 C ATOM 919 CG LYS B 59 3.169 -11.397 -6.725 1.00 0.00 C ATOM 920 CD LYS B 59 2.069 -12.452 -6.670 1.00 0.00 C ATOM 921 CE LYS B 59 1.385 -12.652 -8.018 1.00 0.00 C ATOM 922 NZ LYS B 59 0.304 -11.661 -8.271 1.00 0.00 N ATOM 0 H LYS B 59 4.263 -9.535 -4.947 1.00 0.00 H new ATOM 0 HA LYS B 59 4.244 -9.058 -7.807 1.00 0.00 H new ATOM 0 HB2 LYS B 59 2.013 -9.798 -5.891 1.00 0.00 H new ATOM 0 HB3 LYS B 59 1.956 -9.887 -7.640 1.00 0.00 H new ATOM 0 HG2 LYS B 59 3.793 -11.574 -7.601 1.00 0.00 H new ATOM 0 HG3 LYS B 59 3.811 -11.500 -5.850 1.00 0.00 H new ATOM 0 HD2 LYS B 59 2.494 -13.399 -6.338 1.00 0.00 H new ATOM 0 HD3 LYS B 59 1.326 -12.159 -5.929 1.00 0.00 H new ATOM 0 HE2 LYS B 59 2.129 -12.581 -8.811 1.00 0.00 H new ATOM 0 HE3 LYS B 59 0.967 -13.658 -8.062 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -0.590 -12.161 -8.452 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 0.194 -11.047 -7.439 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 0.551 -11.082 -9.099 1.00 0.00 H new ATOM 936 N GLU B 60 2.959 -6.909 -8.022 1.00 0.00 N ATOM 937 CA GLU B 60 2.545 -5.513 -8.098 1.00 0.00 C ATOM 938 C GLU B 60 1.166 -5.367 -8.725 1.00 0.00 C ATOM 939 O GLU B 60 0.838 -6.036 -9.706 1.00 0.00 O ATOM 940 CB GLU B 60 3.548 -4.700 -8.916 1.00 0.00 C ATOM 941 CG GLU B 60 4.978 -4.788 -8.415 1.00 0.00 C ATOM 942 CD GLU B 60 5.912 -3.894 -9.199 1.00 0.00 C ATOM 943 OE1 GLU B 60 6.391 -4.318 -10.268 1.00 0.00 O ATOM 944 OE2 GLU B 60 6.177 -2.759 -8.745 1.00 0.00 O ATOM 0 H GLU B 60 3.119 -7.355 -8.925 1.00 0.00 H new ATOM 0 HA GLU B 60 2.506 -5.137 -7.076 1.00 0.00 H new ATOM 0 HB2 GLU B 60 3.516 -5.041 -9.951 1.00 0.00 H new ATOM 0 HB3 GLU B 60 3.238 -3.655 -8.915 1.00 0.00 H new ATOM 0 HG2 GLU B 60 5.010 -4.510 -7.362 1.00 0.00 H new ATOM 0 HG3 GLU B 60 5.323 -5.820 -8.483 1.00 0.00 H new ATOM 951 N ALA B 61 0.364 -4.486 -8.146 1.00 0.00 N ATOM 952 CA ALA B 61 -0.938 -4.144 -8.695 1.00 0.00 C ATOM 953 C ALA B 61 -1.116 -2.632 -8.718 1.00 0.00 C ATOM 954 O ALA B 61 -0.829 -1.955 -7.730 1.00 0.00 O ATOM 955 CB ALA B 61 -2.044 -4.792 -7.881 1.00 0.00 C ATOM 0 H ALA B 61 0.597 -3.990 -7.286 1.00 0.00 H new ATOM 0 HA ALA B 61 -0.995 -4.520 -9.716 1.00 0.00 H new ATOM 0 HB1 ALA B 61 -3.012 -4.526 -8.306 1.00 0.00 H new ATOM 0 HB2 ALA B 61 -1.924 -5.875 -7.902 1.00 0.00 H new ATOM 0 HB3 ALA B 61 -1.991 -4.441 -6.850 1.00 0.00 H new ATOM 961 N THR B 62 -1.572 -2.105 -9.844 1.00 0.00 N ATOM 962 CA THR B 62 -1.812 -0.678 -9.974 1.00 0.00 C ATOM 963 C THR B 62 -3.292 -0.361 -9.783 1.00 0.00 C ATOM 964 O THR B 62 -4.143 -0.831 -10.541 1.00 0.00 O ATOM 965 CB THR B 62 -1.355 -0.155 -11.350 1.00 0.00 C ATOM 966 OG1 THR B 62 0.036 -0.448 -11.548 1.00 0.00 O ATOM 967 CG2 THR B 62 -1.581 1.346 -11.465 1.00 0.00 C ATOM 0 H THR B 62 -1.783 -2.646 -10.682 1.00 0.00 H new ATOM 0 HA THR B 62 -1.230 -0.180 -9.198 1.00 0.00 H new ATOM 0 HB THR B 62 -1.947 -0.655 -12.117 1.00 0.00 H new ATOM 0 HG1 THR B 62 0.319 -0.114 -12.425 1.00 0.00 H new ATOM 0 HG21 THR B 62 -1.250 1.690 -12.445 1.00 0.00 H new ATOM 0 HG22 THR B 62 -2.642 1.565 -11.343 1.00 0.00 H new ATOM 0 HG23 THR B 62 -1.013 1.860 -10.690 1.00 0.00 H new ATOM 975 N ILE B 63 -3.593 0.422 -8.762 1.00 0.00 N ATOM 976 CA ILE B 63 -4.959 0.839 -8.497 1.00 0.00 C ATOM 977 C ILE B 63 -5.110 2.329 -8.783 1.00 0.00 C ATOM 978 O ILE B 63 -4.470 3.152 -8.132 1.00 0.00 O ATOM 979 CB ILE B 63 -5.381 0.573 -7.027 1.00 0.00 C ATOM 980 CG1 ILE B 63 -5.241 -0.908 -6.660 1.00 0.00 C ATOM 981 CG2 ILE B 63 -6.816 1.031 -6.793 1.00 0.00 C ATOM 982 CD1 ILE B 63 -3.843 -1.317 -6.240 1.00 0.00 C ATOM 0 H ILE B 63 -2.906 0.783 -8.100 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.604 0.251 -9.150 1.00 0.00 H new ATOM 0 HB ILE B 63 -4.711 1.146 -6.386 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -5.933 -1.136 -5.849 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -5.542 -1.512 -7.516 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -7.096 0.837 -5.757 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -6.895 2.099 -6.996 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -7.485 0.485 -7.458 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -3.832 -2.380 -5.998 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -3.147 -1.124 -7.056 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -3.543 -0.742 -5.364 1.00 0.00 H new ATOM 994 N PRO B 64 -5.933 2.689 -9.782 1.00 0.00 N ATOM 995 CA PRO B 64 -6.247 4.088 -10.089 1.00 0.00 C ATOM 996 C PRO B 64 -6.613 4.881 -8.835 1.00 0.00 C ATOM 997 O PRO B 64 -7.328 4.380 -7.957 1.00 0.00 O ATOM 998 CB PRO B 64 -7.444 3.972 -11.031 1.00 0.00 C ATOM 999 CG PRO B 64 -7.242 2.669 -11.723 1.00 0.00 C ATOM 1000 CD PRO B 64 -6.603 1.757 -10.711 1.00 0.00 C ATOM 0 HA PRO B 64 -5.401 4.622 -10.521 1.00 0.00 H new ATOM 0 HB2 PRO B 64 -8.385 3.989 -10.482 1.00 0.00 H new ATOM 0 HB3 PRO B 64 -7.474 4.799 -11.740 1.00 0.00 H new ATOM 0 HG2 PRO B 64 -8.191 2.261 -12.072 1.00 0.00 H new ATOM 0 HG3 PRO B 64 -6.605 2.787 -12.599 1.00 0.00 H new ATOM 0 HD2 PRO B 64 -7.344 1.144 -10.199 1.00 0.00 H new ATOM 0 HD3 PRO B 64 -5.892 1.075 -11.178 1.00 0.00 H new ATOM 1008 N GLY B 65 -6.132 6.118 -8.766 1.00 0.00 N ATOM 1009 CA GLY B 65 -6.243 6.913 -7.553 1.00 0.00 C ATOM 1010 C GLY B 65 -7.637 7.463 -7.291 1.00 0.00 C ATOM 1011 O GLY B 65 -7.803 8.665 -7.085 1.00 0.00 O ATOM 0 H GLY B 65 -5.661 6.590 -9.538 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -5.941 6.302 -6.703 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -5.542 7.745 -7.613 1.00 0.00 H new ATOM 1015 N HIS B 66 -8.636 6.589 -7.296 1.00 0.00 N ATOM 1016 CA HIS B 66 -10.000 6.980 -6.952 1.00 0.00 C ATOM 1017 C HIS B 66 -10.849 5.752 -6.633 1.00 0.00 C ATOM 1018 O HIS B 66 -12.075 5.828 -6.590 1.00 0.00 O ATOM 1019 CB HIS B 66 -10.646 7.805 -8.083 1.00 0.00 C ATOM 1020 CG HIS B 66 -11.008 7.021 -9.314 1.00 0.00 C ATOM 1021 ND1 HIS B 66 -12.252 7.090 -9.904 1.00 0.00 N ATOM 1022 CD2 HIS B 66 -10.283 6.170 -10.079 1.00 0.00 C ATOM 1023 CE1 HIS B 66 -12.276 6.317 -10.971 1.00 0.00 C ATOM 1024 NE2 HIS B 66 -11.094 5.749 -11.100 1.00 0.00 N ATOM 0 H HIS B 66 -8.528 5.603 -7.535 1.00 0.00 H new ATOM 0 HA HIS B 66 -9.952 7.608 -6.063 1.00 0.00 H new ATOM 0 HB2 HIS B 66 -11.547 8.281 -7.696 1.00 0.00 H new ATOM 0 HB3 HIS B 66 -9.960 8.603 -8.367 1.00 0.00 H new ATOM 0 HD2 HIS B 66 -9.256 5.878 -9.915 1.00 0.00 H new ATOM 0 HE1 HIS B 66 -13.121 6.173 -11.628 1.00 0.00 H new ATOM 0 HE2 HIS B 66 -10.826 5.101 -11.840 1.00 0.00 H new ATOM 1033 N LEU B 67 -10.192 4.620 -6.407 1.00 0.00 N ATOM 1034 CA LEU B 67 -10.902 3.378 -6.129 1.00 0.00 C ATOM 1035 C LEU B 67 -10.780 3.010 -4.656 1.00 0.00 C ATOM 1036 O LEU B 67 -11.778 2.748 -3.981 1.00 0.00 O ATOM 1037 CB LEU B 67 -10.368 2.238 -7.000 1.00 0.00 C ATOM 1038 CG LEU B 67 -10.335 2.524 -8.504 1.00 0.00 C ATOM 1039 CD1 LEU B 67 -9.916 1.283 -9.272 1.00 0.00 C ATOM 1040 CD2 LEU B 67 -11.685 3.028 -8.988 1.00 0.00 C ATOM 0 H LEU B 67 -9.175 4.537 -6.411 1.00 0.00 H new ATOM 0 HA LEU B 67 -11.954 3.532 -6.367 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -9.358 1.994 -6.671 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -10.982 1.354 -6.828 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.598 3.306 -8.688 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -9.898 1.504 -10.339 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -8.922 0.973 -8.949 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -10.627 0.479 -9.080 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -11.637 3.224 -10.059 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -12.447 2.274 -8.791 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -11.940 3.948 -8.462 1.00 0.00 H new ATOM 1052 N ASN B 68 -9.532 2.991 -4.178 1.00 0.00 N ATOM 1053 CA ASN B 68 -9.217 2.804 -2.754 1.00 0.00 C ATOM 1054 C ASN B 68 -9.505 1.383 -2.287 1.00 0.00 C ATOM 1055 O ASN B 68 -9.538 1.113 -1.086 1.00 0.00 O ATOM 1056 CB ASN B 68 -9.981 3.810 -1.883 1.00 0.00 C ATOM 1057 CG ASN B 68 -9.531 5.246 -2.095 1.00 0.00 C ATOM 1058 OD1 ASN B 68 -9.004 5.603 -3.151 1.00 0.00 O ATOM 1059 ND2 ASN B 68 -9.746 6.086 -1.095 1.00 0.00 N ATOM 0 H ASN B 68 -8.708 3.105 -4.768 1.00 0.00 H new ATOM 0 HA ASN B 68 -8.147 2.982 -2.642 1.00 0.00 H new ATOM 0 HB2 ASN B 68 -11.046 3.734 -2.100 1.00 0.00 H new ATOM 0 HB3 ASN B 68 -9.850 3.546 -0.834 1.00 0.00 H new ATOM 0 HD21 ASN B 68 -9.473 7.065 -1.184 1.00 0.00 H new ATOM 0 HD22 ASN B 68 -10.185 5.755 -0.236 1.00 0.00 H new ATOM 1066 N SER B 69 -9.695 0.476 -3.236 1.00 0.00 N ATOM 1067 CA SER B 69 -9.960 -0.918 -2.926 1.00 0.00 C ATOM 1068 C SER B 69 -9.395 -1.822 -4.014 1.00 0.00 C ATOM 1069 O SER B 69 -9.444 -1.481 -5.200 1.00 0.00 O ATOM 1070 CB SER B 69 -11.466 -1.145 -2.776 1.00 0.00 C ATOM 1071 OG SER B 69 -12.171 -0.674 -3.913 1.00 0.00 O ATOM 0 H SER B 69 -9.670 0.686 -4.234 1.00 0.00 H new ATOM 0 HA SER B 69 -9.471 -1.166 -1.984 1.00 0.00 H new ATOM 0 HB2 SER B 69 -11.664 -2.208 -2.636 1.00 0.00 H new ATOM 0 HB3 SER B 69 -11.827 -0.634 -1.884 1.00 0.00 H new ATOM 0 HG SER B 69 -13.130 -0.833 -3.792 1.00 0.00 H new ATOM 1077 N TYR B 70 -8.844 -2.957 -3.611 1.00 0.00 N ATOM 1078 CA TYR B 70 -8.315 -3.927 -4.557 1.00 0.00 C ATOM 1079 C TYR B 70 -8.570 -5.346 -4.067 1.00 0.00 C ATOM 1080 O TYR B 70 -8.362 -5.655 -2.892 1.00 0.00 O ATOM 1081 CB TYR B 70 -6.813 -3.704 -4.767 1.00 0.00 C ATOM 1082 CG TYR B 70 -6.166 -4.701 -5.704 1.00 0.00 C ATOM 1083 CD1 TYR B 70 -6.479 -4.723 -7.056 1.00 0.00 C ATOM 1084 CD2 TYR B 70 -5.237 -5.620 -5.232 1.00 0.00 C ATOM 1085 CE1 TYR B 70 -5.889 -5.633 -7.911 1.00 0.00 C ATOM 1086 CE2 TYR B 70 -4.642 -6.534 -6.082 1.00 0.00 C ATOM 1087 CZ TYR B 70 -4.970 -6.536 -7.419 1.00 0.00 C ATOM 1088 OH TYR B 70 -4.375 -7.443 -8.268 1.00 0.00 O ATOM 0 H TYR B 70 -8.752 -3.229 -2.632 1.00 0.00 H new ATOM 0 HA TYR B 70 -8.827 -3.791 -5.510 1.00 0.00 H new ATOM 0 HB2 TYR B 70 -6.657 -2.699 -5.159 1.00 0.00 H new ATOM 0 HB3 TYR B 70 -6.311 -3.751 -3.801 1.00 0.00 H new ATOM 0 HD1 TYR B 70 -7.196 -4.016 -7.446 1.00 0.00 H new ATOM 0 HD2 TYR B 70 -4.975 -5.620 -4.184 1.00 0.00 H new ATOM 0 HE1 TYR B 70 -6.146 -5.637 -8.960 1.00 0.00 H new ATOM 0 HE2 TYR B 70 -3.923 -7.243 -5.699 1.00 0.00 H new ATOM 0 HH TYR B 70 -3.752 -8.005 -7.762 1.00 0.00 H new ATOM 1098 N THR B 71 -9.036 -6.199 -4.965 1.00 0.00 N ATOM 1099 CA THR B 71 -9.239 -7.598 -4.649 1.00 0.00 C ATOM 1100 C THR B 71 -7.996 -8.402 -5.010 1.00 0.00 C ATOM 1101 O THR B 71 -7.775 -8.728 -6.179 1.00 0.00 O ATOM 1102 CB THR B 71 -10.455 -8.180 -5.399 1.00 0.00 C ATOM 1103 OG1 THR B 71 -11.623 -7.393 -5.133 1.00 0.00 O ATOM 1104 CG2 THR B 71 -10.710 -9.621 -4.980 1.00 0.00 C ATOM 0 H THR B 71 -9.281 -5.943 -5.921 1.00 0.00 H new ATOM 0 HA THR B 71 -9.430 -7.667 -3.578 1.00 0.00 H new ATOM 0 HB THR B 71 -10.236 -8.157 -6.467 1.00 0.00 H new ATOM 0 HG1 THR B 71 -12.388 -7.770 -5.615 1.00 0.00 H new ATOM 0 HG21 THR B 71 -11.572 -10.010 -5.522 1.00 0.00 H new ATOM 0 HG22 THR B 71 -9.833 -10.227 -5.209 1.00 0.00 H new ATOM 0 HG23 THR B 71 -10.907 -9.659 -3.909 1.00 0.00 H new ATOM 1112 N ILE B 72 -7.173 -8.699 -4.015 1.00 0.00 N ATOM 1113 CA ILE B 72 -5.986 -9.510 -4.237 1.00 0.00 C ATOM 1114 C ILE B 72 -6.389 -10.968 -4.383 1.00 0.00 C ATOM 1115 O ILE B 72 -7.000 -11.540 -3.481 1.00 0.00 O ATOM 1116 CB ILE B 72 -4.966 -9.397 -3.087 1.00 0.00 C ATOM 1117 CG1 ILE B 72 -4.659 -7.934 -2.763 1.00 0.00 C ATOM 1118 CG2 ILE B 72 -3.688 -10.133 -3.454 1.00 0.00 C ATOM 1119 CD1 ILE B 72 -3.656 -7.763 -1.644 1.00 0.00 C ATOM 0 H ILE B 72 -7.304 -8.392 -3.051 1.00 0.00 H new ATOM 0 HA ILE B 72 -5.511 -9.138 -5.145 1.00 0.00 H new ATOM 0 HB ILE B 72 -5.401 -9.854 -2.198 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -4.279 -7.443 -3.659 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -5.585 -7.428 -2.491 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -2.972 -10.049 -2.636 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -3.912 -11.185 -3.633 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -3.262 -9.694 -4.356 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -3.485 -6.701 -1.467 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -4.042 -8.225 -0.735 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -2.716 -8.240 -1.922 1.00 0.00 H new ATOM 1131 N LYS B 73 -6.058 -11.559 -5.518 1.00 0.00 N ATOM 1132 CA LYS B 73 -6.438 -12.932 -5.795 1.00 0.00 C ATOM 1133 C LYS B 73 -5.211 -13.833 -5.836 1.00 0.00 C ATOM 1134 O LYS B 73 -4.132 -13.416 -6.264 1.00 0.00 O ATOM 1135 CB LYS B 73 -7.204 -13.007 -7.116 1.00 0.00 C ATOM 1136 CG LYS B 73 -8.492 -12.199 -7.114 1.00 0.00 C ATOM 1137 CD LYS B 73 -9.232 -12.323 -8.433 1.00 0.00 C ATOM 1138 CE LYS B 73 -10.551 -11.569 -8.406 1.00 0.00 C ATOM 1139 NZ LYS B 73 -11.318 -11.737 -9.670 1.00 0.00 N ATOM 0 H LYS B 73 -5.526 -11.108 -6.263 1.00 0.00 H new ATOM 0 HA LYS B 73 -7.087 -13.282 -4.993 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -6.561 -12.650 -7.921 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -7.438 -14.049 -7.333 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -9.135 -12.540 -6.302 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -8.264 -11.151 -6.921 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -8.608 -11.937 -9.239 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -9.418 -13.375 -8.649 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -11.152 -11.921 -7.568 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -10.359 -10.509 -8.237 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -12.210 -11.206 -9.608 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -10.756 -11.377 -10.468 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -11.525 -12.745 -9.819 1.00 0.00 H new ATOM 1153 N GLY B 74 -5.379 -15.062 -5.370 1.00 0.00 N ATOM 1154 CA GLY B 74 -4.283 -16.007 -5.349 1.00 0.00 C ATOM 1155 C GLY B 74 -3.672 -16.136 -3.970 1.00 0.00 C ATOM 1156 O GLY B 74 -2.634 -16.775 -3.798 1.00 0.00 O ATOM 0 H GLY B 74 -6.260 -15.422 -5.004 1.00 0.00 H new ATOM 0 HA2 GLY B 74 -4.639 -16.982 -5.681 1.00 0.00 H new ATOM 0 HA3 GLY B 74 -3.517 -15.690 -6.057 1.00 0.00 H new ATOM 1160 N LEU B 75 -4.321 -15.530 -2.985 1.00 0.00 N ATOM 1161 CA LEU B 75 -3.832 -15.564 -1.614 1.00 0.00 C ATOM 1162 C LEU B 75 -4.188 -16.885 -0.949 1.00 0.00 C ATOM 1163 O LEU B 75 -5.354 -17.274 -0.903 1.00 0.00 O ATOM 1164 CB LEU B 75 -4.409 -14.401 -0.807 1.00 0.00 C ATOM 1165 CG LEU B 75 -4.000 -13.002 -1.278 1.00 0.00 C ATOM 1166 CD1 LEU B 75 -4.579 -11.953 -0.352 1.00 0.00 C ATOM 1167 CD2 LEU B 75 -2.485 -12.876 -1.352 1.00 0.00 C ATOM 0 H LEU B 75 -5.189 -15.008 -3.110 1.00 0.00 H new ATOM 0 HA LEU B 75 -2.747 -15.467 -1.641 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -5.497 -14.470 -0.831 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -4.105 -14.518 0.233 1.00 0.00 H new ATOM 0 HG LEU B 75 -4.398 -12.843 -2.280 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -4.283 -10.962 -0.695 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -5.666 -12.027 -0.353 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -4.205 -12.114 0.659 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -2.219 -11.874 -1.689 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -2.057 -13.053 -0.365 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -2.093 -13.611 -2.055 1.00 0.00 H new ATOM 1179 N LYS B 76 -3.177 -17.569 -0.439 1.00 0.00 N ATOM 1180 CA LYS B 76 -3.364 -18.872 0.179 1.00 0.00 C ATOM 1181 C LYS B 76 -3.608 -18.739 1.681 1.00 0.00 C ATOM 1182 O LYS B 76 -2.782 -18.180 2.402 1.00 0.00 O ATOM 1183 CB LYS B 76 -2.130 -19.740 -0.068 1.00 0.00 C ATOM 1184 CG LYS B 76 -1.824 -19.951 -1.542 1.00 0.00 C ATOM 1185 CD LYS B 76 -0.512 -20.693 -1.748 1.00 0.00 C ATOM 1186 CE LYS B 76 -0.544 -22.082 -1.132 1.00 0.00 C ATOM 1187 NZ LYS B 76 -1.624 -22.924 -1.709 1.00 0.00 N ATOM 0 H LYS B 76 -2.211 -17.241 -0.441 1.00 0.00 H new ATOM 0 HA LYS B 76 -4.240 -19.341 -0.269 1.00 0.00 H new ATOM 0 HB2 LYS B 76 -1.268 -19.277 0.412 1.00 0.00 H new ATOM 0 HB3 LYS B 76 -2.276 -20.710 0.407 1.00 0.00 H new ATOM 0 HG2 LYS B 76 -2.635 -20.513 -2.004 1.00 0.00 H new ATOM 0 HG3 LYS B 76 -1.778 -18.985 -2.045 1.00 0.00 H new ATOM 0 HD2 LYS B 76 -0.304 -20.774 -2.815 1.00 0.00 H new ATOM 0 HD3 LYS B 76 0.303 -20.119 -1.307 1.00 0.00 H new ATOM 0 HE2 LYS B 76 0.418 -22.570 -1.288 1.00 0.00 H new ATOM 0 HE3 LYS B 76 -0.687 -21.997 -0.055 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 -1.487 -23.913 -1.417 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 -2.547 -22.587 -1.368 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 -1.595 -22.863 -2.747 1.00 0.00 H new ATOM 1201 N PRO B 77 -4.748 -19.253 2.171 1.00 0.00 N ATOM 1202 CA PRO B 77 -5.061 -19.258 3.602 1.00 0.00 C ATOM 1203 C PRO B 77 -4.034 -20.050 4.403 1.00 0.00 C ATOM 1204 O PRO B 77 -3.776 -21.220 4.115 1.00 0.00 O ATOM 1205 CB PRO B 77 -6.431 -19.940 3.680 1.00 0.00 C ATOM 1206 CG PRO B 77 -6.998 -19.830 2.308 1.00 0.00 C ATOM 1207 CD PRO B 77 -5.826 -19.852 1.369 1.00 0.00 C ATOM 0 HA PRO B 77 -5.054 -18.252 4.021 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -6.336 -20.982 3.985 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -7.074 -19.451 4.412 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -7.679 -20.655 2.101 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -7.570 -18.909 2.196 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -5.579 -20.866 1.055 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -6.023 -19.277 0.464 1.00 0.00 H new ATOM 1215 N GLY B 78 -3.450 -19.411 5.404 1.00 0.00 N ATOM 1216 CA GLY B 78 -2.416 -20.053 6.191 1.00 0.00 C ATOM 1217 C GLY B 78 -1.049 -19.493 5.873 1.00 0.00 C ATOM 1218 O GLY B 78 -0.118 -19.595 6.673 1.00 0.00 O ATOM 0 H GLY B 78 -3.673 -18.457 5.687 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -2.628 -19.918 7.252 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -2.424 -21.126 5.999 1.00 0.00 H new ATOM 1222 N VAL B 79 -0.938 -18.902 4.696 1.00 0.00 N ATOM 1223 CA VAL B 79 0.291 -18.261 4.268 1.00 0.00 C ATOM 1224 C VAL B 79 0.187 -16.761 4.507 1.00 0.00 C ATOM 1225 O VAL B 79 -0.681 -16.101 3.945 1.00 0.00 O ATOM 1226 CB VAL B 79 0.564 -18.529 2.771 1.00 0.00 C ATOM 1227 CG1 VAL B 79 1.814 -17.809 2.298 1.00 0.00 C ATOM 1228 CG2 VAL B 79 0.697 -20.017 2.505 1.00 0.00 C ATOM 0 H VAL B 79 -1.694 -18.853 4.013 1.00 0.00 H new ATOM 0 HA VAL B 79 1.117 -18.675 4.846 1.00 0.00 H new ATOM 0 HB VAL B 79 -0.288 -18.143 2.212 1.00 0.00 H new ATOM 0 HG11 VAL B 79 1.977 -18.019 1.241 1.00 0.00 H new ATOM 0 HG12 VAL B 79 1.691 -16.735 2.440 1.00 0.00 H new ATOM 0 HG13 VAL B 79 2.673 -18.155 2.873 1.00 0.00 H new ATOM 0 HG21 VAL B 79 0.889 -20.181 1.445 1.00 0.00 H new ATOM 0 HG22 VAL B 79 1.524 -20.419 3.090 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -0.227 -20.521 2.789 1.00 0.00 H new ATOM 1238 N VAL B 80 1.049 -16.229 5.359 1.00 0.00 N ATOM 1239 CA VAL B 80 1.023 -14.806 5.655 1.00 0.00 C ATOM 1240 C VAL B 80 1.736 -14.021 4.557 1.00 0.00 C ATOM 1241 O VAL B 80 2.827 -14.392 4.109 1.00 0.00 O ATOM 1242 CB VAL B 80 1.632 -14.486 7.045 1.00 0.00 C ATOM 1243 CG1 VAL B 80 0.801 -15.122 8.148 1.00 0.00 C ATOM 1244 CG2 VAL B 80 3.077 -14.947 7.151 1.00 0.00 C ATOM 0 H VAL B 80 1.769 -16.756 5.854 1.00 0.00 H new ATOM 0 HA VAL B 80 -0.022 -14.498 5.687 1.00 0.00 H new ATOM 0 HB VAL B 80 1.619 -13.402 7.163 1.00 0.00 H new ATOM 0 HG11 VAL B 80 1.242 -14.888 9.117 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -0.216 -14.732 8.108 1.00 0.00 H new ATOM 0 HG13 VAL B 80 0.780 -16.203 8.011 1.00 0.00 H new ATOM 0 HG21 VAL B 80 3.465 -14.704 8.140 1.00 0.00 H new ATOM 0 HG22 VAL B 80 3.127 -16.025 6.997 1.00 0.00 H new ATOM 0 HG23 VAL B 80 3.676 -14.444 6.392 1.00 0.00 H new ATOM 1254 N TYR B 81 1.102 -12.956 4.098 1.00 0.00 N ATOM 1255 CA TYR B 81 1.652 -12.143 3.024 1.00 0.00 C ATOM 1256 C TYR B 81 2.002 -10.756 3.530 1.00 0.00 C ATOM 1257 O TYR B 81 1.346 -10.235 4.426 1.00 0.00 O ATOM 1258 CB TYR B 81 0.654 -12.014 1.871 1.00 0.00 C ATOM 1259 CG TYR B 81 0.349 -13.307 1.149 1.00 0.00 C ATOM 1260 CD1 TYR B 81 1.065 -13.677 0.018 1.00 0.00 C ATOM 1261 CD2 TYR B 81 -0.662 -14.150 1.590 1.00 0.00 C ATOM 1262 CE1 TYR B 81 0.779 -14.850 -0.653 1.00 0.00 C ATOM 1263 CE2 TYR B 81 -0.949 -15.326 0.926 1.00 0.00 C ATOM 1264 CZ TYR B 81 -0.226 -15.671 -0.195 1.00 0.00 C ATOM 1265 OH TYR B 81 -0.512 -16.839 -0.862 1.00 0.00 O ATOM 0 H TYR B 81 0.202 -12.632 4.453 1.00 0.00 H new ATOM 0 HA TYR B 81 2.554 -12.639 2.665 1.00 0.00 H new ATOM 0 HB2 TYR B 81 -0.278 -11.603 2.260 1.00 0.00 H new ATOM 0 HB3 TYR B 81 1.044 -11.295 1.150 1.00 0.00 H new ATOM 0 HD1 TYR B 81 1.857 -13.038 -0.342 1.00 0.00 H new ATOM 0 HD2 TYR B 81 -1.233 -13.882 2.466 1.00 0.00 H new ATOM 0 HE1 TYR B 81 1.342 -15.122 -1.534 1.00 0.00 H new ATOM 0 HE2 TYR B 81 -1.737 -15.973 1.284 1.00 0.00 H new ATOM 0 HH TYR B 81 -0.095 -17.593 -0.395 1.00 0.00 H new ATOM 1275 N GLU B 82 3.013 -10.154 2.923 1.00 0.00 N ATOM 1276 CA GLU B 82 3.432 -8.804 3.269 1.00 0.00 C ATOM 1277 C GLU B 82 2.896 -7.831 2.233 1.00 0.00 C ATOM 1278 O GLU B 82 3.153 -7.991 1.042 1.00 0.00 O ATOM 1279 CB GLU B 82 4.958 -8.721 3.294 1.00 0.00 C ATOM 1280 CG GLU B 82 5.610 -9.551 4.385 1.00 0.00 C ATOM 1281 CD GLU B 82 5.795 -8.781 5.676 1.00 0.00 C ATOM 1282 OE1 GLU B 82 5.342 -9.256 6.737 1.00 0.00 O ATOM 1283 OE2 GLU B 82 6.416 -7.698 5.633 1.00 0.00 O ATOM 0 H GLU B 82 3.564 -10.584 2.180 1.00 0.00 H new ATOM 0 HA GLU B 82 3.042 -8.550 4.255 1.00 0.00 H new ATOM 0 HB2 GLU B 82 5.344 -9.045 2.327 1.00 0.00 H new ATOM 0 HB3 GLU B 82 5.252 -7.679 3.422 1.00 0.00 H new ATOM 0 HG2 GLU B 82 5.000 -10.433 4.578 1.00 0.00 H new ATOM 0 HG3 GLU B 82 6.580 -9.904 4.036 1.00 0.00 H new ATOM 1290 N GLY B 83 2.151 -6.834 2.683 1.00 0.00 N ATOM 1291 CA GLY B 83 1.530 -5.902 1.769 1.00 0.00 C ATOM 1292 C GLY B 83 2.091 -4.505 1.899 1.00 0.00 C ATOM 1293 O GLY B 83 2.172 -3.959 2.999 1.00 0.00 O ATOM 0 H GLY B 83 1.965 -6.654 3.670 1.00 0.00 H new ATOM 0 HA2 GLY B 83 1.670 -6.253 0.746 1.00 0.00 H new ATOM 0 HA3 GLY B 83 0.456 -5.878 1.954 1.00 0.00 H new ATOM 1297 N GLN B 84 2.504 -3.936 0.782 1.00 0.00 N ATOM 1298 CA GLN B 84 3.010 -2.572 0.756 1.00 0.00 C ATOM 1299 C GLN B 84 2.092 -1.703 -0.094 1.00 0.00 C ATOM 1300 O GLN B 84 1.977 -1.921 -1.301 1.00 0.00 O ATOM 1301 CB GLN B 84 4.425 -2.532 0.167 1.00 0.00 C ATOM 1302 CG GLN B 84 5.392 -3.530 0.783 1.00 0.00 C ATOM 1303 CD GLN B 84 5.762 -3.213 2.221 1.00 0.00 C ATOM 1304 OE1 GLN B 84 6.720 -2.491 2.481 1.00 0.00 O ATOM 1305 NE2 GLN B 84 5.016 -3.761 3.164 1.00 0.00 N ATOM 0 H GLN B 84 2.500 -4.399 -0.127 1.00 0.00 H new ATOM 0 HA GLN B 84 3.040 -2.195 1.778 1.00 0.00 H new ATOM 0 HB2 GLN B 84 4.364 -2.718 -0.905 1.00 0.00 H new ATOM 0 HB3 GLN B 84 4.829 -1.528 0.293 1.00 0.00 H new ATOM 0 HG2 GLN B 84 4.949 -4.525 0.742 1.00 0.00 H new ATOM 0 HG3 GLN B 84 6.301 -3.561 0.182 1.00 0.00 H new ATOM 0 HE21 GLN B 84 4.227 -4.356 2.909 1.00 0.00 H new ATOM 0 HE22 GLN B 84 5.229 -3.589 4.147 1.00 0.00 H new ATOM 1314 N LEU B 85 1.425 -0.740 0.531 1.00 0.00 N ATOM 1315 CA LEU B 85 0.583 0.194 -0.205 1.00 0.00 C ATOM 1316 C LEU B 85 1.381 1.450 -0.515 1.00 0.00 C ATOM 1317 O LEU B 85 1.745 2.205 0.386 1.00 0.00 O ATOM 1318 CB LEU B 85 -0.691 0.529 0.590 1.00 0.00 C ATOM 1319 CG LEU B 85 -1.784 1.315 -0.163 1.00 0.00 C ATOM 1320 CD1 LEU B 85 -1.437 2.791 -0.278 1.00 0.00 C ATOM 1321 CD2 LEU B 85 -2.010 0.727 -1.547 1.00 0.00 C ATOM 0 H LEU B 85 1.450 -0.586 1.539 1.00 0.00 H new ATOM 0 HA LEU B 85 0.268 -0.267 -1.141 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -1.126 -0.405 0.947 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -0.403 1.103 1.471 1.00 0.00 H new ATOM 0 HG LEU B 85 -2.703 1.228 0.417 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -2.231 3.311 -0.814 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -1.332 3.219 0.719 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -0.499 2.903 -0.821 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -2.785 1.295 -2.062 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -1.083 0.776 -2.119 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -2.324 -0.313 -1.454 1.00 0.00 H new ATOM 1333 N ILE B 86 1.660 1.655 -1.790 1.00 0.00 N ATOM 1334 CA ILE B 86 2.464 2.781 -2.231 1.00 0.00 C ATOM 1335 C ILE B 86 1.603 3.784 -2.991 1.00 0.00 C ATOM 1336 O ILE B 86 1.093 3.482 -4.064 1.00 0.00 O ATOM 1337 CB ILE B 86 3.608 2.304 -3.146 1.00 0.00 C ATOM 1338 CG1 ILE B 86 4.280 1.067 -2.548 1.00 0.00 C ATOM 1339 CG2 ILE B 86 4.627 3.417 -3.347 1.00 0.00 C ATOM 1340 CD1 ILE B 86 5.078 0.267 -3.549 1.00 0.00 C ATOM 0 H ILE B 86 1.338 1.050 -2.545 1.00 0.00 H new ATOM 0 HA ILE B 86 2.885 3.260 -1.347 1.00 0.00 H new ATOM 0 HB ILE B 86 3.191 2.040 -4.118 1.00 0.00 H new ATOM 0 HG12 ILE B 86 4.938 1.378 -1.737 1.00 0.00 H new ATOM 0 HG13 ILE B 86 3.516 0.425 -2.110 1.00 0.00 H new ATOM 0 HG21 ILE B 86 5.429 3.064 -3.996 1.00 0.00 H new ATOM 0 HG22 ILE B 86 4.140 4.277 -3.807 1.00 0.00 H new ATOM 0 HG23 ILE B 86 5.043 3.708 -2.382 1.00 0.00 H new ATOM 0 HD11 ILE B 86 5.525 -0.594 -3.053 1.00 0.00 H new ATOM 0 HD12 ILE B 86 4.421 -0.075 -4.348 1.00 0.00 H new ATOM 0 HD13 ILE B 86 5.865 0.892 -3.970 1.00 0.00 H new ATOM 1352 N SER B 87 1.431 4.966 -2.431 1.00 0.00 N ATOM 1353 CA SER B 87 0.630 5.995 -3.075 1.00 0.00 C ATOM 1354 C SER B 87 1.517 6.947 -3.874 1.00 0.00 C ATOM 1355 O SER B 87 2.486 7.500 -3.344 1.00 0.00 O ATOM 1356 CB SER B 87 -0.169 6.763 -2.028 1.00 0.00 C ATOM 1357 OG SER B 87 -0.956 5.878 -1.250 1.00 0.00 O ATOM 0 H SER B 87 1.833 5.239 -1.534 1.00 0.00 H new ATOM 0 HA SER B 87 -0.063 5.516 -3.767 1.00 0.00 H new ATOM 0 HB2 SER B 87 0.510 7.319 -1.381 1.00 0.00 H new ATOM 0 HB3 SER B 87 -0.812 7.494 -2.518 1.00 0.00 H new ATOM 0 HG SER B 87 -1.679 6.378 -0.817 1.00 0.00 H new ATOM 1363 N ILE B 88 1.191 7.120 -5.149 1.00 0.00 N ATOM 1364 CA ILE B 88 1.970 7.974 -6.037 1.00 0.00 C ATOM 1365 C ILE B 88 1.236 9.283 -6.316 1.00 0.00 C ATOM 1366 O ILE B 88 0.110 9.276 -6.811 1.00 0.00 O ATOM 1367 CB ILE B 88 2.249 7.268 -7.386 1.00 0.00 C ATOM 1368 CG1 ILE B 88 2.866 5.882 -7.158 1.00 0.00 C ATOM 1369 CG2 ILE B 88 3.159 8.122 -8.261 1.00 0.00 C ATOM 1370 CD1 ILE B 88 4.195 5.909 -6.437 1.00 0.00 C ATOM 0 H ILE B 88 0.387 6.677 -5.593 1.00 0.00 H new ATOM 0 HA ILE B 88 2.914 8.183 -5.534 1.00 0.00 H new ATOM 0 HB ILE B 88 1.299 7.137 -7.904 1.00 0.00 H new ATOM 0 HG12 ILE B 88 2.166 5.274 -6.585 1.00 0.00 H new ATOM 0 HG13 ILE B 88 2.998 5.392 -8.123 1.00 0.00 H new ATOM 0 HG21 ILE B 88 3.343 7.608 -9.205 1.00 0.00 H new ATOM 0 HG22 ILE B 88 2.680 9.081 -8.457 1.00 0.00 H new ATOM 0 HG23 ILE B 88 4.106 8.288 -7.748 1.00 0.00 H new ATOM 0 HD11 ILE B 88 4.564 4.890 -6.315 1.00 0.00 H new ATOM 0 HD12 ILE B 88 4.913 6.488 -7.019 1.00 0.00 H new ATOM 0 HD13 ILE B 88 4.068 6.368 -5.457 1.00 0.00 H new ATOM 1382 N GLN B 89 1.871 10.402 -5.992 1.00 0.00 N ATOM 1383 CA GLN B 89 1.307 11.714 -6.295 1.00 0.00 C ATOM 1384 C GLN B 89 1.880 12.256 -7.596 1.00 0.00 C ATOM 1385 O GLN B 89 2.839 11.702 -8.132 1.00 0.00 O ATOM 1386 CB GLN B 89 1.606 12.708 -5.175 1.00 0.00 C ATOM 1387 CG GLN B 89 0.938 12.384 -3.854 1.00 0.00 C ATOM 1388 CD GLN B 89 1.315 13.377 -2.773 1.00 0.00 C ATOM 1389 OE1 GLN B 89 1.594 14.546 -3.053 1.00 0.00 O ATOM 1390 NE2 GLN B 89 1.333 12.923 -1.536 1.00 0.00 N ATOM 0 H GLN B 89 2.775 10.429 -5.520 1.00 0.00 H new ATOM 0 HA GLN B 89 0.228 11.592 -6.392 1.00 0.00 H new ATOM 0 HB2 GLN B 89 2.684 12.750 -5.022 1.00 0.00 H new ATOM 0 HB3 GLN B 89 1.290 13.701 -5.494 1.00 0.00 H new ATOM 0 HG2 GLN B 89 -0.144 12.383 -3.985 1.00 0.00 H new ATOM 0 HG3 GLN B 89 1.222 11.380 -3.540 1.00 0.00 H new ATOM 0 HE21 GLN B 89 1.096 11.949 -1.347 1.00 0.00 H new ATOM 0 HE22 GLN B 89 1.584 13.545 -0.768 1.00 0.00 H new ATOM 1399 N GLN B 90 1.315 13.357 -8.085 1.00 0.00 N ATOM 1400 CA GLN B 90 1.841 14.023 -9.277 1.00 0.00 C ATOM 1401 C GLN B 90 3.230 14.586 -8.999 1.00 0.00 C ATOM 1402 O GLN B 90 4.014 14.829 -9.916 1.00 0.00 O ATOM 1403 CB GLN B 90 0.924 15.163 -9.722 1.00 0.00 C ATOM 1404 CG GLN B 90 -0.524 14.762 -9.922 1.00 0.00 C ATOM 1405 CD GLN B 90 -1.351 15.885 -10.515 1.00 0.00 C ATOM 1406 OE1 GLN B 90 -1.510 15.981 -11.732 1.00 0.00 O ATOM 1407 NE2 GLN B 90 -1.859 16.762 -9.665 1.00 0.00 N ATOM 0 H GLN B 90 0.496 13.807 -7.677 1.00 0.00 H new ATOM 0 HA GLN B 90 1.895 13.280 -10.072 1.00 0.00 H new ATOM 0 HB2 GLN B 90 0.968 15.959 -8.979 1.00 0.00 H new ATOM 0 HB3 GLN B 90 1.306 15.576 -10.655 1.00 0.00 H new ATOM 0 HG2 GLN B 90 -0.571 13.893 -10.578 1.00 0.00 H new ATOM 0 HG3 GLN B 90 -0.952 14.463 -8.965 1.00 0.00 H new ATOM 0 HE21 GLN B 90 -1.706 16.649 -8.663 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -2.404 17.551 -10.012 1.00 0.00 H new ATOM 1416 N TYR B 91 3.521 14.794 -7.720 1.00 0.00 N ATOM 1417 CA TYR B 91 4.806 15.334 -7.291 1.00 0.00 C ATOM 1418 C TYR B 91 5.911 14.294 -7.423 1.00 0.00 C ATOM 1419 O TYR B 91 7.092 14.612 -7.297 1.00 0.00 O ATOM 1420 CB TYR B 91 4.730 15.789 -5.830 1.00 0.00 C ATOM 1421 CG TYR B 91 3.787 16.944 -5.580 1.00 0.00 C ATOM 1422 CD1 TYR B 91 2.414 16.746 -5.513 1.00 0.00 C ATOM 1423 CD2 TYR B 91 4.273 18.230 -5.394 1.00 0.00 C ATOM 1424 CE1 TYR B 91 1.554 17.798 -5.266 1.00 0.00 C ATOM 1425 CE2 TYR B 91 3.420 19.287 -5.150 1.00 0.00 C ATOM 1426 CZ TYR B 91 2.062 19.065 -5.086 1.00 0.00 C ATOM 1427 OH TYR B 91 1.210 20.114 -4.830 1.00 0.00 O ATOM 0 H TYR B 91 2.877 14.594 -6.955 1.00 0.00 H new ATOM 0 HA TYR B 91 5.037 16.183 -7.934 1.00 0.00 H new ATOM 0 HB2 TYR B 91 4.420 14.944 -5.215 1.00 0.00 H new ATOM 0 HB3 TYR B 91 5.729 16.074 -5.499 1.00 0.00 H new ATOM 0 HD1 TYR B 91 2.012 15.754 -5.656 1.00 0.00 H new ATOM 0 HD2 TYR B 91 5.337 18.407 -5.441 1.00 0.00 H new ATOM 0 HE1 TYR B 91 0.489 17.628 -5.214 1.00 0.00 H new ATOM 0 HE2 TYR B 91 3.815 20.282 -5.010 1.00 0.00 H new ATOM 0 HH TYR B 91 1.729 20.939 -4.727 1.00 0.00 H new ATOM 1437 N GLY B 92 5.520 13.047 -7.661 1.00 0.00 N ATOM 1438 CA GLY B 92 6.482 11.966 -7.695 1.00 0.00 C ATOM 1439 C GLY B 92 6.821 11.479 -6.303 1.00 0.00 C ATOM 1440 O GLY B 92 7.723 10.659 -6.121 1.00 0.00 O ATOM 0 H GLY B 92 4.554 12.767 -7.831 1.00 0.00 H new ATOM 0 HA2 GLY B 92 6.082 11.140 -8.283 1.00 0.00 H new ATOM 0 HA3 GLY B 92 7.390 12.302 -8.195 1.00 0.00 H new ATOM 1444 N HIS B 93 6.096 11.996 -5.319 1.00 0.00 N ATOM 1445 CA HIS B 93 6.299 11.612 -3.929 1.00 0.00 C ATOM 1446 C HIS B 93 5.622 10.277 -3.661 1.00 0.00 C ATOM 1447 O HIS B 93 4.430 10.115 -3.928 1.00 0.00 O ATOM 1448 CB HIS B 93 5.745 12.694 -2.990 1.00 0.00 C ATOM 1449 CG HIS B 93 5.988 12.424 -1.533 1.00 0.00 C ATOM 1450 ND1 HIS B 93 7.162 12.749 -0.891 1.00 0.00 N ATOM 1451 CD2 HIS B 93 5.191 11.867 -0.593 1.00 0.00 C ATOM 1452 CE1 HIS B 93 7.077 12.402 0.379 1.00 0.00 C ATOM 1453 NE2 HIS B 93 5.891 11.864 0.587 1.00 0.00 N ATOM 0 H HIS B 93 5.358 12.686 -5.460 1.00 0.00 H new ATOM 0 HA HIS B 93 7.368 11.510 -3.740 1.00 0.00 H new ATOM 0 HB2 HIS B 93 6.195 13.652 -3.251 1.00 0.00 H new ATOM 0 HB3 HIS B 93 4.672 12.790 -3.157 1.00 0.00 H new ATOM 0 HD2 HIS B 93 4.189 11.494 -0.743 1.00 0.00 H new ATOM 0 HE1 HIS B 93 7.848 12.536 1.123 1.00 0.00 H new ATOM 0 HE2 HIS B 93 5.550 11.505 1.479 1.00 0.00 H new ATOM 1462 N GLN B 94 6.387 9.333 -3.143 1.00 0.00 N ATOM 1463 CA GLN B 94 5.887 7.996 -2.880 1.00 0.00 C ATOM 1464 C GLN B 94 5.722 7.771 -1.383 1.00 0.00 C ATOM 1465 O GLN B 94 6.637 8.028 -0.602 1.00 0.00 O ATOM 1466 CB GLN B 94 6.847 6.953 -3.452 1.00 0.00 C ATOM 1467 CG GLN B 94 7.129 7.123 -4.936 1.00 0.00 C ATOM 1468 CD GLN B 94 8.048 6.048 -5.481 1.00 0.00 C ATOM 1469 OE1 GLN B 94 8.905 5.526 -4.769 1.00 0.00 O ATOM 1470 NE2 GLN B 94 7.878 5.709 -6.748 1.00 0.00 N ATOM 0 H GLN B 94 7.367 9.470 -2.894 1.00 0.00 H new ATOM 0 HA GLN B 94 4.914 7.894 -3.361 1.00 0.00 H new ATOM 0 HB2 GLN B 94 7.789 7.002 -2.905 1.00 0.00 H new ATOM 0 HB3 GLN B 94 6.431 5.960 -3.283 1.00 0.00 H new ATOM 0 HG2 GLN B 94 6.188 7.104 -5.485 1.00 0.00 H new ATOM 0 HG3 GLN B 94 7.578 8.101 -5.107 1.00 0.00 H new ATOM 0 HE21 GLN B 94 7.156 6.165 -7.306 1.00 0.00 H new ATOM 0 HE22 GLN B 94 8.469 4.991 -7.168 1.00 0.00 H new ATOM 1479 N GLU B 95 4.546 7.313 -0.990 1.00 0.00 N ATOM 1480 CA GLU B 95 4.291 6.943 0.396 1.00 0.00 C ATOM 1481 C GLU B 95 4.017 5.454 0.490 1.00 0.00 C ATOM 1482 O GLU B 95 3.183 4.928 -0.245 1.00 0.00 O ATOM 1483 CB GLU B 95 3.108 7.723 0.958 1.00 0.00 C ATOM 1484 CG GLU B 95 3.433 9.162 1.316 1.00 0.00 C ATOM 1485 CD GLU B 95 4.442 9.282 2.445 1.00 0.00 C ATOM 1486 OE1 GLU B 95 5.125 10.325 2.521 1.00 0.00 O ATOM 1487 OE2 GLU B 95 4.555 8.346 3.261 1.00 0.00 O ATOM 0 H GLU B 95 3.748 7.187 -1.613 1.00 0.00 H new ATOM 0 HA GLU B 95 5.175 7.187 0.985 1.00 0.00 H new ATOM 0 HB2 GLU B 95 2.300 7.715 0.227 1.00 0.00 H new ATOM 0 HB3 GLU B 95 2.738 7.212 1.847 1.00 0.00 H new ATOM 0 HG2 GLU B 95 3.822 9.671 0.434 1.00 0.00 H new ATOM 0 HG3 GLU B 95 2.515 9.675 1.601 1.00 0.00 H new ATOM 1494 N VAL B 96 4.718 4.781 1.390 1.00 0.00 N ATOM 1495 CA VAL B 96 4.605 3.338 1.511 1.00 0.00 C ATOM 1496 C VAL B 96 4.121 2.943 2.898 1.00 0.00 C ATOM 1497 O VAL B 96 4.860 3.044 3.881 1.00 0.00 O ATOM 1498 CB VAL B 96 5.955 2.643 1.235 1.00 0.00 C ATOM 1499 CG1 VAL B 96 5.790 1.129 1.229 1.00 0.00 C ATOM 1500 CG2 VAL B 96 6.554 3.133 -0.076 1.00 0.00 C ATOM 0 H VAL B 96 5.370 5.212 2.046 1.00 0.00 H new ATOM 0 HA VAL B 96 3.878 3.013 0.767 1.00 0.00 H new ATOM 0 HB VAL B 96 6.645 2.903 2.038 1.00 0.00 H new ATOM 0 HG11 VAL B 96 6.754 0.659 1.033 1.00 0.00 H new ATOM 0 HG12 VAL B 96 5.416 0.800 2.199 1.00 0.00 H new ATOM 0 HG13 VAL B 96 5.082 0.843 0.451 1.00 0.00 H new ATOM 0 HG21 VAL B 96 7.505 2.631 -0.252 1.00 0.00 H new ATOM 0 HG22 VAL B 96 5.869 2.910 -0.894 1.00 0.00 H new ATOM 0 HG23 VAL B 96 6.717 4.209 -0.022 1.00 0.00 H new ATOM 1510 N THR B 97 2.880 2.498 2.978 1.00 0.00 N ATOM 1511 CA THR B 97 2.329 2.012 4.227 1.00 0.00 C ATOM 1512 C THR B 97 2.528 0.502 4.324 1.00 0.00 C ATOM 1513 O THR B 97 1.935 -0.263 3.558 1.00 0.00 O ATOM 1514 CB THR B 97 0.833 2.360 4.350 1.00 0.00 C ATOM 1515 OG1 THR B 97 0.632 3.754 4.078 1.00 0.00 O ATOM 1516 CG2 THR B 97 0.315 2.043 5.744 1.00 0.00 C ATOM 0 H THR B 97 2.234 2.464 2.189 1.00 0.00 H new ATOM 0 HA THR B 97 2.854 2.501 5.047 1.00 0.00 H new ATOM 0 HB THR B 97 0.284 1.758 3.625 1.00 0.00 H new ATOM 0 HG1 THR B 97 -0.202 4.052 4.498 1.00 0.00 H new ATOM 0 HG21 THR B 97 -0.743 2.297 5.806 1.00 0.00 H new ATOM 0 HG22 THR B 97 0.445 0.980 5.948 1.00 0.00 H new ATOM 0 HG23 THR B 97 0.871 2.624 6.480 1.00 0.00 H new ATOM 1524 N ARG B 98 3.386 0.081 5.246 1.00 0.00 N ATOM 1525 CA ARG B 98 3.723 -1.327 5.391 1.00 0.00 C ATOM 1526 C ARG B 98 2.735 -2.038 6.309 1.00 0.00 C ATOM 1527 O ARG B 98 2.412 -1.550 7.392 1.00 0.00 O ATOM 1528 CB ARG B 98 5.143 -1.490 5.939 1.00 0.00 C ATOM 1529 CG ARG B 98 6.207 -0.780 5.115 1.00 0.00 C ATOM 1530 CD ARG B 98 7.610 -1.156 5.566 1.00 0.00 C ATOM 1531 NE ARG B 98 7.812 -0.932 6.998 1.00 0.00 N ATOM 1532 CZ ARG B 98 8.830 -1.439 7.695 1.00 0.00 C ATOM 1533 NH1 ARG B 98 9.748 -2.187 7.091 1.00 0.00 N ATOM 1534 NH2 ARG B 98 8.934 -1.195 8.996 1.00 0.00 N ATOM 0 H ARG B 98 3.861 0.698 5.905 1.00 0.00 H new ATOM 0 HA ARG B 98 3.668 -1.781 4.402 1.00 0.00 H new ATOM 0 HB2 ARG B 98 5.174 -1.109 6.960 1.00 0.00 H new ATOM 0 HB3 ARG B 98 5.384 -2.552 5.987 1.00 0.00 H new ATOM 0 HG2 ARG B 98 6.082 -1.035 4.062 1.00 0.00 H new ATOM 0 HG3 ARG B 98 6.074 0.298 5.200 1.00 0.00 H new ATOM 0 HD2 ARG B 98 7.794 -2.205 5.335 1.00 0.00 H new ATOM 0 HD3 ARG B 98 8.339 -0.573 5.003 1.00 0.00 H new ATOM 0 HE ARG B 98 7.133 -0.353 7.493 1.00 0.00 H new ATOM 0 HH11 ARG B 98 9.675 -2.375 6.091 1.00 0.00 H new ATOM 0 HH12 ARG B 98 10.525 -2.573 7.627 1.00 0.00 H new ATOM 0 HH21 ARG B 98 8.235 -0.619 9.464 1.00 0.00 H new ATOM 0 HH22 ARG B 98 9.713 -1.584 9.527 1.00 0.00 H new ATOM 1548 N PHE B 99 2.254 -3.184 5.854 1.00 0.00 N ATOM 1549 CA PHE B 99 1.360 -4.024 6.637 1.00 0.00 C ATOM 1550 C PHE B 99 1.435 -5.455 6.116 1.00 0.00 C ATOM 1551 O PHE B 99 2.211 -5.740 5.203 1.00 0.00 O ATOM 1552 CB PHE B 99 -0.084 -3.499 6.568 1.00 0.00 C ATOM 1553 CG PHE B 99 -0.686 -3.510 5.188 1.00 0.00 C ATOM 1554 CD1 PHE B 99 -0.366 -2.525 4.269 1.00 0.00 C ATOM 1555 CD2 PHE B 99 -1.579 -4.504 4.814 1.00 0.00 C ATOM 1556 CE1 PHE B 99 -0.920 -2.530 3.005 1.00 0.00 C ATOM 1557 CE2 PHE B 99 -2.134 -4.514 3.548 1.00 0.00 C ATOM 1558 CZ PHE B 99 -1.804 -3.526 2.644 1.00 0.00 C ATOM 0 H PHE B 99 2.472 -3.559 4.931 1.00 0.00 H new ATOM 0 HA PHE B 99 1.671 -4.001 7.681 1.00 0.00 H new ATOM 0 HB2 PHE B 99 -0.708 -4.101 7.228 1.00 0.00 H new ATOM 0 HB3 PHE B 99 -0.105 -2.479 6.952 1.00 0.00 H new ATOM 0 HD1 PHE B 99 0.326 -1.743 4.545 1.00 0.00 H new ATOM 0 HD2 PHE B 99 -1.843 -5.278 5.519 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -0.662 -1.755 2.299 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -2.825 -5.295 3.267 1.00 0.00 H new ATOM 0 HZ PHE B 99 -2.237 -3.532 1.655 1.00 0.00 H new ATOM 1568 N ASP B 100 0.661 -6.350 6.702 1.00 0.00 N ATOM 1569 CA ASP B 100 0.594 -7.727 6.228 1.00 0.00 C ATOM 1570 C ASP B 100 -0.800 -8.283 6.473 1.00 0.00 C ATOM 1571 O ASP B 100 -1.590 -7.682 7.206 1.00 0.00 O ATOM 1572 CB ASP B 100 1.666 -8.602 6.891 1.00 0.00 C ATOM 1573 CG ASP B 100 1.478 -8.762 8.380 1.00 0.00 C ATOM 1574 OD1 ASP B 100 0.966 -9.813 8.809 1.00 0.00 O ATOM 1575 OD2 ASP B 100 1.865 -7.844 9.130 1.00 0.00 O ATOM 0 H ASP B 100 0.068 -6.151 7.508 1.00 0.00 H new ATOM 0 HA ASP B 100 0.795 -7.737 5.157 1.00 0.00 H new ATOM 0 HB2 ASP B 100 1.659 -9.587 6.424 1.00 0.00 H new ATOM 0 HB3 ASP B 100 2.647 -8.166 6.702 1.00 0.00 H new ATOM 1580 N PHE B 101 -1.113 -9.413 5.859 1.00 0.00 N ATOM 1581 CA PHE B 101 -2.469 -9.940 5.904 1.00 0.00 C ATOM 1582 C PHE B 101 -2.503 -11.456 5.745 1.00 0.00 C ATOM 1583 O PHE B 101 -1.469 -12.089 5.519 1.00 0.00 O ATOM 1584 CB PHE B 101 -3.332 -9.267 4.835 1.00 0.00 C ATOM 1585 CG PHE B 101 -2.708 -9.232 3.466 1.00 0.00 C ATOM 1586 CD1 PHE B 101 -2.043 -8.099 3.026 1.00 0.00 C ATOM 1587 CD2 PHE B 101 -2.788 -10.325 2.621 1.00 0.00 C ATOM 1588 CE1 PHE B 101 -1.471 -8.058 1.769 1.00 0.00 C ATOM 1589 CE2 PHE B 101 -2.217 -10.289 1.366 1.00 0.00 C ATOM 1590 CZ PHE B 101 -1.559 -9.155 0.939 1.00 0.00 C ATOM 0 H PHE B 101 -0.453 -9.980 5.327 1.00 0.00 H new ATOM 0 HA PHE B 101 -2.877 -9.713 6.889 1.00 0.00 H new ATOM 0 HB2 PHE B 101 -4.286 -9.790 4.773 1.00 0.00 H new ATOM 0 HB3 PHE B 101 -3.548 -8.246 5.149 1.00 0.00 H new ATOM 0 HD1 PHE B 101 -1.971 -7.238 3.673 1.00 0.00 H new ATOM 0 HD2 PHE B 101 -3.303 -11.216 2.948 1.00 0.00 H new ATOM 0 HE1 PHE B 101 -0.956 -7.168 1.437 1.00 0.00 H new ATOM 0 HE2 PHE B 101 -2.285 -11.150 0.717 1.00 0.00 H new ATOM 0 HZ PHE B 101 -1.113 -9.126 -0.044 1.00 0.00 H new ATOM 1600 N THR B 102 -3.713 -12.013 5.840 1.00 0.00 N ATOM 1601 CA THR B 102 -3.917 -13.456 5.877 1.00 0.00 C ATOM 1602 C THR B 102 -3.254 -14.028 7.124 1.00 0.00 C ATOM 1603 O THR B 102 -2.160 -14.583 7.064 1.00 0.00 O ATOM 1604 CB THR B 102 -3.378 -14.153 4.609 1.00 0.00 C ATOM 1605 OG1 THR B 102 -3.858 -13.473 3.441 1.00 0.00 O ATOM 1606 CG2 THR B 102 -3.822 -15.610 4.560 1.00 0.00 C ATOM 0 H THR B 102 -4.577 -11.473 5.893 1.00 0.00 H new ATOM 0 HA THR B 102 -4.990 -13.645 5.910 1.00 0.00 H new ATOM 0 HB THR B 102 -2.289 -14.119 4.637 1.00 0.00 H new ATOM 0 HG1 THR B 102 -3.512 -13.917 2.639 1.00 0.00 H new ATOM 0 HG21 THR B 102 -3.430 -16.080 3.658 1.00 0.00 H new ATOM 0 HG22 THR B 102 -3.443 -16.135 5.437 1.00 0.00 H new ATOM 0 HG23 THR B 102 -4.911 -15.658 4.550 1.00 0.00 H new ATOM 1614 N THR B 103 -3.944 -13.885 8.256 1.00 0.00 N ATOM 1615 CA THR B 103 -3.379 -14.192 9.566 1.00 0.00 C ATOM 1616 C THR B 103 -2.325 -13.137 9.916 1.00 0.00 C ATOM 1617 O THR B 103 -1.168 -13.455 10.200 1.00 0.00 O ATOM 1618 CB THR B 103 -2.768 -15.613 9.615 1.00 0.00 C ATOM 1619 OG1 THR B 103 -3.642 -16.535 8.951 1.00 0.00 O ATOM 1620 CG2 THR B 103 -2.557 -16.075 11.049 1.00 0.00 C ATOM 0 H THR B 103 -4.908 -13.554 8.288 1.00 0.00 H new ATOM 0 HA THR B 103 -4.182 -14.170 10.302 1.00 0.00 H new ATOM 0 HB THR B 103 -1.800 -15.581 9.115 1.00 0.00 H new ATOM 0 HG1 THR B 103 -3.253 -17.434 8.981 1.00 0.00 H new ATOM 0 HG21 THR B 103 -2.127 -17.076 11.049 1.00 0.00 H new ATOM 0 HG22 THR B 103 -1.879 -15.389 11.556 1.00 0.00 H new ATOM 0 HG23 THR B 103 -3.514 -16.091 11.571 1.00 0.00 H new ATOM 1628 N THR B 104 -2.761 -11.877 9.885 1.00 0.00 N ATOM 1629 CA THR B 104 -1.894 -10.720 10.090 1.00 0.00 C ATOM 1630 C THR B 104 -1.018 -10.858 11.333 1.00 0.00 C ATOM 1631 O THR B 104 -1.494 -11.179 12.426 1.00 0.00 O ATOM 1632 CB THR B 104 -2.733 -9.430 10.190 1.00 0.00 C ATOM 1633 OG1 THR B 104 -3.465 -9.235 8.972 1.00 0.00 O ATOM 1634 CG2 THR B 104 -1.857 -8.215 10.456 1.00 0.00 C ATOM 0 H THR B 104 -3.736 -11.630 9.715 1.00 0.00 H new ATOM 0 HA THR B 104 -1.233 -10.666 9.225 1.00 0.00 H new ATOM 0 HB THR B 104 -3.423 -9.541 11.027 1.00 0.00 H new ATOM 0 HG1 THR B 104 -3.998 -8.416 9.039 1.00 0.00 H new ATOM 0 HG21 THR B 104 -2.481 -7.324 10.521 1.00 0.00 H new ATOM 0 HG22 THR B 104 -1.321 -8.351 11.395 1.00 0.00 H new ATOM 0 HG23 THR B 104 -1.140 -8.098 9.643 1.00 0.00 H new ATOM 1642 N SER B 105 0.263 -10.611 11.143 1.00 0.00 N ATOM 1643 CA SER B 105 1.250 -10.752 12.189 1.00 0.00 C ATOM 1644 C SER B 105 1.785 -9.384 12.614 1.00 0.00 C ATOM 1645 O SER B 105 1.548 -8.947 13.740 1.00 0.00 O ATOM 1646 CB SER B 105 2.381 -11.655 11.693 1.00 0.00 C ATOM 1647 OG SER B 105 2.792 -11.289 10.382 1.00 0.00 O ATOM 0 H SER B 105 0.649 -10.304 10.250 1.00 0.00 H new ATOM 0 HA SER B 105 0.788 -11.209 13.064 1.00 0.00 H new ATOM 0 HB2 SER B 105 3.229 -11.589 12.375 1.00 0.00 H new ATOM 0 HB3 SER B 105 2.049 -12.693 11.697 1.00 0.00 H new ATOM 0 HG SER B 105 3.517 -11.880 10.089 1.00 0.00 H new ATOM 1653 N THR B 106 2.480 -8.714 11.694 1.00 0.00 N ATOM 1654 CA THR B 106 3.038 -7.383 11.929 1.00 0.00 C ATOM 1655 C THR B 106 4.057 -7.389 13.071 1.00 0.00 C ATOM 1656 O THR B 106 3.704 -7.474 14.249 1.00 0.00 O ATOM 1657 CB THR B 106 1.922 -6.354 12.201 1.00 0.00 C ATOM 1658 OG1 THR B 106 0.951 -6.425 11.147 1.00 0.00 O ATOM 1659 CG2 THR B 106 2.483 -4.942 12.273 1.00 0.00 C ATOM 0 H THR B 106 2.672 -9.081 10.762 1.00 0.00 H new ATOM 0 HA THR B 106 3.562 -7.088 11.020 1.00 0.00 H new ATOM 0 HB THR B 106 1.460 -6.589 13.160 1.00 0.00 H new ATOM 0 HG1 THR B 106 1.382 -6.740 10.325 1.00 0.00 H new ATOM 0 HG21 THR B 106 1.673 -4.238 12.466 1.00 0.00 H new ATOM 0 HG22 THR B 106 3.215 -4.882 13.078 1.00 0.00 H new ATOM 0 HG23 THR B 106 2.963 -4.693 11.327 1.00 0.00 H new ATOM 1667 N SER B 107 5.328 -7.296 12.707 1.00 0.00 N ATOM 1668 CA SER B 107 6.416 -7.388 13.669 1.00 0.00 C ATOM 1669 C SER B 107 6.609 -6.080 14.446 1.00 0.00 C ATOM 1670 O SER B 107 7.620 -5.394 14.287 1.00 0.00 O ATOM 1671 CB SER B 107 7.707 -7.767 12.941 1.00 0.00 C ATOM 1672 OG SER B 107 7.517 -8.924 12.140 1.00 0.00 O ATOM 0 H SER B 107 5.632 -7.156 11.744 1.00 0.00 H new ATOM 0 HA SER B 107 6.160 -8.159 14.396 1.00 0.00 H new ATOM 0 HB2 SER B 107 8.033 -6.936 12.315 1.00 0.00 H new ATOM 0 HB3 SER B 107 8.499 -7.949 13.668 1.00 0.00 H new ATOM 0 HG SER B 107 8.355 -9.147 11.683 1.00 0.00 H new ATOM 1678 N THR B 108 5.634 -5.737 15.277 1.00 0.00 N ATOM 1679 CA THR B 108 5.742 -4.576 16.149 1.00 0.00 C ATOM 1680 C THR B 108 5.407 -4.909 17.613 1.00 0.00 C ATOM 1681 O THR B 108 6.187 -4.569 18.500 1.00 0.00 O ATOM 1682 CB THR B 108 4.886 -3.387 15.653 1.00 0.00 C ATOM 1683 OG1 THR B 108 3.682 -3.853 15.032 1.00 0.00 O ATOM 1684 CG2 THR B 108 5.670 -2.532 14.668 1.00 0.00 C ATOM 0 H THR B 108 4.756 -6.249 15.365 1.00 0.00 H new ATOM 0 HA THR B 108 6.788 -4.273 16.109 1.00 0.00 H new ATOM 0 HB THR B 108 4.626 -2.780 16.520 1.00 0.00 H new ATOM 0 HG1 THR B 108 3.154 -3.086 14.727 1.00 0.00 H new ATOM 0 HG21 THR B 108 5.049 -1.702 14.332 1.00 0.00 H new ATOM 0 HG22 THR B 108 6.564 -2.143 15.155 1.00 0.00 H new ATOM 0 HG23 THR B 108 5.960 -3.139 13.810 1.00 0.00 H new ATOM 1692 N PRO B 109 4.263 -5.576 17.911 1.00 0.00 N ATOM 1693 CA PRO B 109 3.928 -5.963 19.287 1.00 0.00 C ATOM 1694 C PRO B 109 5.003 -6.849 19.905 1.00 0.00 C ATOM 1695 O PRO B 109 5.366 -7.886 19.343 1.00 0.00 O ATOM 1696 CB PRO B 109 2.616 -6.742 19.145 1.00 0.00 C ATOM 1697 CG PRO B 109 2.038 -6.284 17.855 1.00 0.00 C ATOM 1698 CD PRO B 109 3.209 -5.993 16.965 1.00 0.00 C ATOM 0 HA PRO B 109 3.847 -5.096 19.942 1.00 0.00 H new ATOM 0 HB2 PRO B 109 2.794 -7.817 19.139 1.00 0.00 H new ATOM 0 HB3 PRO B 109 1.942 -6.535 19.976 1.00 0.00 H new ATOM 0 HG2 PRO B 109 1.397 -7.050 17.420 1.00 0.00 H new ATOM 0 HG3 PRO B 109 1.423 -5.395 17.995 1.00 0.00 H new ATOM 0 HD2 PRO B 109 3.507 -6.872 16.393 1.00 0.00 H new ATOM 0 HD3 PRO B 109 2.981 -5.207 16.245 1.00 0.00 H new ATOM 1706 N GLY B 110 5.527 -6.429 21.044 1.00 0.00 N ATOM 1707 CA GLY B 110 6.554 -7.197 21.713 1.00 0.00 C ATOM 1708 C GLY B 110 7.685 -6.324 22.204 1.00 0.00 C ATOM 1709 O GLY B 110 7.470 -5.165 22.557 1.00 0.00 O ATOM 0 H GLY B 110 5.259 -5.567 21.519 1.00 0.00 H new ATOM 0 HA2 GLY B 110 6.116 -7.731 22.556 1.00 0.00 H new ATOM 0 HA3 GLY B 110 6.947 -7.949 21.029 1.00 0.00 H new ATOM 1713 N SER B 111 8.889 -6.875 22.220 1.00 0.00 N ATOM 1714 CA SER B 111 10.051 -6.146 22.694 1.00 0.00 C ATOM 1715 C SER B 111 10.542 -5.175 21.622 1.00 0.00 C ATOM 1716 O SER B 111 10.463 -3.961 21.803 1.00 0.00 O ATOM 1717 CB SER B 111 11.159 -7.130 23.085 1.00 0.00 C ATOM 1718 OG SER B 111 12.223 -6.478 23.760 1.00 0.00 O ATOM 0 H SER B 111 9.085 -7.826 21.909 1.00 0.00 H new ATOM 0 HA SER B 111 9.773 -5.567 23.575 1.00 0.00 H new ATOM 0 HB2 SER B 111 10.745 -7.909 23.725 1.00 0.00 H new ATOM 0 HB3 SER B 111 11.542 -7.622 22.191 1.00 0.00 H new ATOM 0 HG SER B 111 12.814 -6.053 23.104 1.00 0.00 H new ATOM 1724 N ARG B 112 11.036 -5.719 20.507 1.00 0.00 N ATOM 1725 CA ARG B 112 11.535 -4.910 19.393 1.00 0.00 C ATOM 1726 C ARG B 112 12.626 -3.948 19.858 1.00 0.00 C ATOM 1727 O ARG B 112 12.486 -2.727 19.749 1.00 0.00 O ATOM 1728 CB ARG B 112 10.395 -4.121 18.737 1.00 0.00 C ATOM 1729 CG ARG B 112 9.302 -4.979 18.113 1.00 0.00 C ATOM 1730 CD ARG B 112 9.798 -5.755 16.902 1.00 0.00 C ATOM 1731 NE ARG B 112 10.600 -6.920 17.274 1.00 0.00 N ATOM 1732 CZ ARG B 112 11.228 -7.703 16.397 1.00 0.00 C ATOM 1733 NH1 ARG B 112 11.177 -7.426 15.098 1.00 0.00 N ATOM 1734 NH2 ARG B 112 11.913 -8.759 16.820 1.00 0.00 N ATOM 0 H ARG B 112 11.101 -6.725 20.352 1.00 0.00 H new ATOM 0 HA ARG B 112 11.961 -5.593 18.658 1.00 0.00 H new ATOM 0 HB2 ARG B 112 9.944 -3.471 19.486 1.00 0.00 H new ATOM 0 HB3 ARG B 112 10.815 -3.475 17.966 1.00 0.00 H new ATOM 0 HG2 ARG B 112 8.921 -5.677 18.858 1.00 0.00 H new ATOM 0 HG3 ARG B 112 8.468 -4.343 17.817 1.00 0.00 H new ATOM 0 HD2 ARG B 112 8.944 -6.080 16.308 1.00 0.00 H new ATOM 0 HD3 ARG B 112 10.393 -5.095 16.270 1.00 0.00 H new ATOM 0 HE ARG B 112 10.684 -7.147 18.265 1.00 0.00 H new ATOM 0 HH11 ARG B 112 10.656 -6.612 14.770 1.00 0.00 H new ATOM 0 HH12 ARG B 112 11.659 -8.027 14.429 1.00 0.00 H new ATOM 0 HH21 ARG B 112 11.959 -8.971 17.817 1.00 0.00 H new ATOM 0 HH22 ARG B 112 12.393 -9.358 16.148 1.00 0.00 H new ATOM 1748 N SER B 113 13.704 -4.498 20.392 1.00 0.00 N ATOM 1749 CA SER B 113 14.813 -3.691 20.873 1.00 0.00 C ATOM 1750 C SER B 113 15.718 -3.267 19.724 1.00 0.00 C ATOM 1751 O SER B 113 16.323 -4.103 19.053 1.00 0.00 O ATOM 1752 CB SER B 113 15.618 -4.465 21.911 1.00 0.00 C ATOM 1753 OG SER B 113 14.818 -4.783 23.037 1.00 0.00 O ATOM 0 H SER B 113 13.835 -5.503 20.504 1.00 0.00 H new ATOM 0 HA SER B 113 14.402 -2.794 21.336 1.00 0.00 H new ATOM 0 HB2 SER B 113 16.007 -5.381 21.466 1.00 0.00 H new ATOM 0 HB3 SER B 113 16.477 -3.873 22.226 1.00 0.00 H new ATOM 0 HG SER B 113 14.906 -5.737 23.242 1.00 0.00 H new ATOM 1759 N HIS B 114 15.806 -1.966 19.502 1.00 0.00 N ATOM 1760 CA HIS B 114 16.646 -1.431 18.445 1.00 0.00 C ATOM 1761 C HIS B 114 17.983 -0.977 19.012 1.00 0.00 C ATOM 1762 O HIS B 114 18.088 0.106 19.589 1.00 0.00 O ATOM 1763 CB HIS B 114 15.953 -0.266 17.730 1.00 0.00 C ATOM 1764 CG HIS B 114 14.739 -0.670 16.949 1.00 0.00 C ATOM 1765 ND1 HIS B 114 14.749 -0.862 15.584 1.00 0.00 N ATOM 1766 CD2 HIS B 114 13.468 -0.912 17.349 1.00 0.00 C ATOM 1767 CE1 HIS B 114 13.540 -1.203 15.181 1.00 0.00 C ATOM 1768 NE2 HIS B 114 12.744 -1.239 16.231 1.00 0.00 N ATOM 0 H HIS B 114 15.305 -1.260 20.041 1.00 0.00 H new ATOM 0 HA HIS B 114 16.820 -2.223 17.717 1.00 0.00 H new ATOM 0 HB2 HIS B 114 15.666 0.482 18.469 1.00 0.00 H new ATOM 0 HB3 HIS B 114 16.665 0.209 17.056 1.00 0.00 H new ATOM 0 HD2 HIS B 114 13.094 -0.858 18.361 1.00 0.00 H new ATOM 0 HE1 HIS B 114 13.251 -1.417 14.163 1.00 0.00 H new ATOM 0 HE2 HIS B 114 11.751 -1.472 16.215 1.00 0.00 H new ATOM 1777 N HIS B 115 18.991 -1.834 18.854 1.00 0.00 N ATOM 1778 CA HIS B 115 20.357 -1.539 19.288 1.00 0.00 C ATOM 1779 C HIS B 115 20.435 -1.369 20.800 1.00 0.00 C ATOM 1780 O HIS B 115 20.811 -0.305 21.293 1.00 0.00 O ATOM 1781 CB HIS B 115 20.899 -0.287 18.588 1.00 0.00 C ATOM 1782 CG HIS B 115 20.998 -0.424 17.102 1.00 0.00 C ATOM 1783 ND1 HIS B 115 20.131 0.198 16.229 1.00 0.00 N ATOM 1784 CD2 HIS B 115 21.865 -1.121 16.335 1.00 0.00 C ATOM 1785 CE1 HIS B 115 20.462 -0.115 14.990 1.00 0.00 C ATOM 1786 NE2 HIS B 115 21.511 -0.912 15.028 1.00 0.00 N ATOM 0 H HIS B 115 18.884 -2.752 18.422 1.00 0.00 H new ATOM 0 HA HIS B 115 20.977 -2.391 19.007 1.00 0.00 H new ATOM 0 HB2 HIS B 115 20.253 0.559 18.824 1.00 0.00 H new ATOM 0 HB3 HIS B 115 21.886 -0.056 18.989 1.00 0.00 H new ATOM 0 HD2 HIS B 115 22.685 -1.730 16.687 1.00 0.00 H new ATOM 0 HE1 HIS B 115 19.959 0.224 14.097 1.00 0.00 H new ATOM 0 HE2 HIS B 115 21.983 -1.309 14.216 1.00 0.00 H new ATOM 1795 N HIS B 116 20.075 -2.432 21.519 1.00 0.00 N ATOM 1796 CA HIS B 116 20.141 -2.468 22.983 1.00 0.00 C ATOM 1797 C HIS B 116 19.077 -1.577 23.617 1.00 0.00 C ATOM 1798 O HIS B 116 19.176 -0.350 23.604 1.00 0.00 O ATOM 1799 CB HIS B 116 21.534 -2.079 23.495 1.00 0.00 C ATOM 1800 CG HIS B 116 22.567 -3.149 23.318 1.00 0.00 C ATOM 1801 ND1 HIS B 116 23.458 -3.501 24.307 1.00 0.00 N ATOM 1802 CD2 HIS B 116 22.860 -3.934 22.256 1.00 0.00 C ATOM 1803 CE1 HIS B 116 24.253 -4.454 23.862 1.00 0.00 C ATOM 1804 NE2 HIS B 116 23.911 -4.739 22.619 1.00 0.00 N ATOM 0 H HIS B 116 19.728 -3.296 21.103 1.00 0.00 H new ATOM 0 HA HIS B 116 19.943 -3.498 23.281 1.00 0.00 H new ATOM 0 HB2 HIS B 116 21.864 -1.180 22.974 1.00 0.00 H new ATOM 0 HB3 HIS B 116 21.464 -1.827 24.553 1.00 0.00 H new ATOM 0 HD2 HIS B 116 22.359 -3.928 21.299 1.00 0.00 H new ATOM 0 HE1 HIS B 116 25.050 -4.923 24.420 1.00 0.00 H new ATOM 0 HE2 HIS B 116 24.354 -5.441 22.027 1.00 0.00 H new ATOM 1813 N HIS B 117 18.056 -2.212 24.169 1.00 0.00 N ATOM 1814 CA HIS B 117 16.975 -1.503 24.834 1.00 0.00 C ATOM 1815 C HIS B 117 16.432 -2.339 25.987 1.00 0.00 C ATOM 1816 O HIS B 117 16.311 -1.858 27.114 1.00 0.00 O ATOM 1817 CB HIS B 117 15.855 -1.185 23.838 1.00 0.00 C ATOM 1818 CG HIS B 117 14.699 -0.439 24.437 1.00 0.00 C ATOM 1819 ND1 HIS B 117 13.551 -1.060 24.878 1.00 0.00 N ATOM 1820 CD2 HIS B 117 14.514 0.884 24.656 1.00 0.00 C ATOM 1821 CE1 HIS B 117 12.713 -0.154 25.342 1.00 0.00 C ATOM 1822 NE2 HIS B 117 13.271 1.032 25.220 1.00 0.00 N ATOM 0 H HIS B 117 17.953 -3.227 24.169 1.00 0.00 H new ATOM 0 HA HIS B 117 17.364 -0.565 25.231 1.00 0.00 H new ATOM 0 HB2 HIS B 117 16.268 -0.597 23.018 1.00 0.00 H new ATOM 0 HB3 HIS B 117 15.489 -2.118 23.409 1.00 0.00 H new ATOM 0 HD2 HIS B 117 15.213 1.675 24.429 1.00 0.00 H new ATOM 0 HE1 HIS B 117 11.734 -0.352 25.753 1.00 0.00 H new ATOM 0 HE2 HIS B 117 12.848 1.917 25.499 1.00 0.00 H new ATOM 1831 N HIS B 118 16.112 -3.594 25.699 1.00 0.00 N ATOM 1832 CA HIS B 118 15.575 -4.495 26.711 1.00 0.00 C ATOM 1833 C HIS B 118 16.712 -5.167 27.469 1.00 0.00 C ATOM 1834 O HIS B 118 17.356 -6.086 26.960 1.00 0.00 O ATOM 1835 CB HIS B 118 14.675 -5.554 26.067 1.00 0.00 C ATOM 1836 CG HIS B 118 13.964 -6.435 27.053 1.00 0.00 C ATOM 1837 ND1 HIS B 118 14.483 -7.625 27.513 1.00 0.00 N ATOM 1838 CD2 HIS B 118 12.758 -6.299 27.654 1.00 0.00 C ATOM 1839 CE1 HIS B 118 13.630 -8.182 28.351 1.00 0.00 C ATOM 1840 NE2 HIS B 118 12.574 -7.398 28.456 1.00 0.00 N ATOM 0 H HIS B 118 16.215 -4.011 24.774 1.00 0.00 H new ATOM 0 HA HIS B 118 14.977 -3.912 27.411 1.00 0.00 H new ATOM 0 HB2 HIS B 118 13.935 -5.055 25.442 1.00 0.00 H new ATOM 0 HB3 HIS B 118 15.280 -6.178 25.409 1.00 0.00 H new ATOM 0 HD2 HIS B 118 12.068 -5.478 27.526 1.00 0.00 H new ATOM 0 HE1 HIS B 118 13.772 -9.121 28.865 1.00 0.00 H new ATOM 0 HE2 HIS B 118 11.756 -7.579 29.037 1.00 0.00 H new ATOM 1849 N HIS B 119 16.955 -4.692 28.677 1.00 0.00 N ATOM 1850 CA HIS B 119 17.990 -5.260 29.529 1.00 0.00 C ATOM 1851 C HIS B 119 17.552 -6.623 30.041 1.00 0.00 C ATOM 1852 O HIS B 119 18.096 -7.643 29.570 1.00 0.00 O ATOM 1853 CB HIS B 119 18.291 -4.331 30.707 1.00 0.00 C ATOM 1854 CG HIS B 119 18.915 -3.032 30.308 1.00 0.00 C ATOM 1855 ND1 HIS B 119 18.184 -1.907 29.991 1.00 0.00 N ATOM 1856 CD2 HIS B 119 20.215 -2.679 30.178 1.00 0.00 C ATOM 1857 CE1 HIS B 119 19.008 -0.923 29.686 1.00 0.00 C ATOM 1858 NE2 HIS B 119 20.245 -1.365 29.793 1.00 0.00 N ATOM 1859 OXT HIS B 119 16.642 -6.669 30.893 1.00 0.00 O ATOM 0 H HIS B 119 16.449 -3.911 29.094 1.00 0.00 H new ATOM 0 HA HIS B 119 18.899 -5.374 28.938 1.00 0.00 H new ATOM 0 HB2 HIS B 119 17.364 -4.128 31.244 1.00 0.00 H new ATOM 0 HB3 HIS B 119 18.956 -4.844 31.402 1.00 0.00 H new ATOM 0 HD2 HIS B 119 21.071 -3.316 30.347 1.00 0.00 H new ATOM 0 HE1 HIS B 119 18.718 0.076 29.397 1.00 0.00 H new ATOM 0 HE2 HIS B 119 21.088 -0.818 29.618 1.00 0.00 H new TER 1868 HIS B 119