USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=36 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 102 THR OG1 : rot 30:sc= 2.23 USER MOD Set 1.2: B 105 SER OG : rot 127:sc= 1.06 USER MOD Set 2.1: B 53 ASN : amide:sc= -0.886! C(o=0.05!,f=-8.1!) USER MOD Set 2.2: B 54 SER OG : rot 180:sc= 0 USER MOD Set 2.3: B 76 LYS NZ :NH3+ -162:sc= 0.936 (180deg=0) USER MOD Set 3.1: B 34 SER OG : rot 180:sc= 0 USER MOD Set 3.2: B 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0297 USER MOD Single : A 3 GLN : amide:sc= -1.05 K(o=-1.1,f=-0.0016) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 85:sc= 0.863 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : B 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 38 GLN : amide:sc= -0.167 X(o=-0.17,f=-0.1) USER MOD Single : B 40 SER OG : rot 180:sc= -0.0655 USER MOD Single : B 41 HIS : no HD1:sc= -0.0332 X(o=-0.033,f=-0.033) USER MOD Single : B 43 SER OG : rot 180:sc= 0 USER MOD Single : B 44 LYS NZ :NH3+ -171:sc=-0.00443 (180deg=-0.0951) USER MOD Single : B 45 TYR OH : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ -171:sc=-0.00317 (180deg=-0.0829) USER MOD Single : B 59 LYS NZ :NH3+ -169:sc= -0.0151 (180deg=-0.2) USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 66 HIS : no HD1:sc= -0.143 X(o=-0.14,f=-0.00074) USER MOD Single : B 68 ASN : amide:sc= -0.235 K(o=-0.24,f=-5.9!) 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+ 169:sc= 0.917 (180deg=0.695) USER MOD Single : B 81 TYR OH : rot 180:sc= 0.244 USER MOD Single : B 84 GLN : amide:sc= -0.0871 X(o=-0.087,f=0.24!) USER MOD Single : B 87 SER OG : rot -57:sc= -1.19! USER MOD Single : B 89 GLN : amide:sc= -0.175 X(o=-0.17,f=-0.42) USER MOD Single : B 90 GLN : amide:sc= -0.832 K(o=-0.83,f=0) USER MOD Single : B 91 TYR OH : rot 180:sc= 0 USER MOD Single : B 93 HIS : no HE2:sc= 1.26 K(o=1.3,f=-5!) USER MOD Single : B 94 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : B 97 THR OG1 : rot -172:sc= 1.21 USER MOD Single : B 103 THR OG1 : rot 97:sc= 1.31 USER MOD Single : B 104 THR OG1 : rot -9:sc= -1.53! USER MOD Single : B 106 THR OG1 : rot 180:sc= 0.0212 USER MOD Single : B 107 SER OG : rot 180:sc= 0 USER MOD Single : B 108 THR OG1 : rot 180:sc= 0.0327 USER MOD Single : B 111 SER OG : rot -54:sc= 0.368 USER MOD Single : B 113 SER OG : rot 180:sc= 0 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) USER MOD Single : B 116 HIS : no HD1:sc= -0.105 X(o=-0.1,f=-0.013) USER MOD Single : B 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 118 HIS : no HE2:sc= 1.11 K(o=1.1,f=-4.3!) USER MOD Single : B 119 HIS : no HD1:sc= 0 X(o=0,f=-0.00054) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.938 7.143 9.302 1.00 0.00 N ATOM 2 CA GLY A 1 0.512 8.482 8.837 1.00 0.00 C ATOM 3 C GLY A 1 1.688 9.368 8.492 1.00 0.00 C ATOM 4 O GLY A 1 2.485 9.041 7.610 1.00 0.00 O ATOM 0 H1 GLY A 1 0.099 6.571 9.527 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.487 6.674 8.553 1.00 0.00 H new ATOM 0 H3 GLY A 1 1.528 7.242 10.153 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.128 8.374 7.962 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -0.086 8.961 9.612 1.00 0.00 H new ATOM 10 N SER A 2 1.811 10.482 9.195 1.00 0.00 N ATOM 11 CA SER A 2 2.875 11.435 8.936 1.00 0.00 C ATOM 12 C SER A 2 4.156 11.036 9.666 1.00 0.00 C ATOM 13 O SER A 2 4.476 11.578 10.722 1.00 0.00 O ATOM 14 CB SER A 2 2.430 12.835 9.363 1.00 0.00 C ATOM 15 OG SER A 2 1.243 13.212 8.684 1.00 0.00 O ATOM 0 H SER A 2 1.183 10.748 9.953 1.00 0.00 H new ATOM 0 HA SER A 2 3.087 11.438 7.867 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.261 12.856 10.440 1.00 0.00 H new ATOM 0 HB3 SER A 2 3.221 13.554 9.150 1.00 0.00 H new ATOM 0 HG SER A 2 0.973 14.109 8.971 1.00 0.00 H new ATOM 21 N GLN A 3 4.885 10.081 9.100 1.00 0.00 N ATOM 22 CA GLN A 3 6.124 9.614 9.709 1.00 0.00 C ATOM 23 C GLN A 3 7.273 10.578 9.427 1.00 0.00 C ATOM 24 O GLN A 3 8.203 10.693 10.223 1.00 0.00 O ATOM 25 CB GLN A 3 6.478 8.210 9.214 1.00 0.00 C ATOM 26 CG GLN A 3 5.522 7.134 9.706 1.00 0.00 C ATOM 27 CD GLN A 3 5.911 5.736 9.258 1.00 0.00 C ATOM 28 OE1 GLN A 3 5.052 4.871 9.076 1.00 0.00 O ATOM 29 NE2 GLN A 3 7.201 5.496 9.085 1.00 0.00 N ATOM 0 H GLN A 3 4.641 9.617 8.225 1.00 0.00 H new ATOM 0 HA GLN A 3 5.968 9.574 10.787 1.00 0.00 H new ATOM 0 HB2 GLN A 3 6.484 8.209 8.124 1.00 0.00 H new ATOM 0 HB3 GLN A 3 7.489 7.963 9.539 1.00 0.00 H new ATOM 0 HG2 GLN A 3 5.484 7.162 10.795 1.00 0.00 H new ATOM 0 HG3 GLN A 3 4.518 7.357 9.346 1.00 0.00 H new ATOM 0 HE21 GLN A 3 7.884 6.237 9.245 1.00 0.00 H new ATOM 0 HE22 GLN A 3 7.513 4.570 8.792 1.00 0.00 H new ATOM 38 N THR A 4 7.208 11.270 8.297 1.00 0.00 N ATOM 39 CA THR A 4 8.241 12.232 7.946 1.00 0.00 C ATOM 40 C THR A 4 7.952 13.599 8.577 1.00 0.00 C ATOM 41 O THR A 4 8.569 13.969 9.576 1.00 0.00 O ATOM 42 CB THR A 4 8.382 12.365 6.418 1.00 0.00 C ATOM 43 OG1 THR A 4 8.446 11.059 5.829 1.00 0.00 O ATOM 44 CG2 THR A 4 9.637 13.149 6.055 1.00 0.00 C ATOM 0 H THR A 4 6.456 11.183 7.613 1.00 0.00 H new ATOM 0 HA THR A 4 9.186 11.861 8.343 1.00 0.00 H new ATOM 0 HB THR A 4 7.515 12.903 6.035 1.00 0.00 H new ATOM 0 HG1 THR A 4 8.534 11.143 4.857 1.00 0.00 H new ATOM 0 HG21 THR A 4 9.715 13.230 4.971 1.00 0.00 H new ATOM 0 HG22 THR A 4 9.581 14.147 6.490 1.00 0.00 H new ATOM 0 HG23 THR A 4 10.514 12.632 6.444 1.00 0.00 H new ATOM 52 N THR A 5 7.012 14.342 8.003 1.00 0.00 N ATOM 53 CA THR A 5 6.619 15.631 8.558 1.00 0.00 C ATOM 54 C THR A 5 5.122 15.865 8.367 1.00 0.00 C ATOM 55 O THR A 5 4.347 15.790 9.321 1.00 0.00 O ATOM 56 CB THR A 5 7.415 16.786 7.918 1.00 0.00 C ATOM 57 OG1 THR A 5 8.822 16.574 8.109 1.00 0.00 O ATOM 58 CG2 THR A 5 7.013 18.126 8.519 1.00 0.00 C ATOM 0 H THR A 5 6.510 14.075 7.156 1.00 0.00 H new ATOM 0 HA THR A 5 6.844 15.610 9.624 1.00 0.00 H new ATOM 0 HB THR A 5 7.189 16.805 6.852 1.00 0.00 H new ATOM 0 HG1 THR A 5 9.322 17.310 7.699 1.00 0.00 H new ATOM 0 HG21 THR A 5 7.590 18.923 8.050 1.00 0.00 H new ATOM 0 HG22 THR A 5 5.950 18.298 8.347 1.00 0.00 H new ATOM 0 HG23 THR A 5 7.211 18.118 9.591 1.00 0.00 H new ATOM 66 N ALA A 6 4.717 16.126 7.132 1.00 0.00 N ATOM 67 CA ALA A 6 3.311 16.341 6.819 1.00 0.00 C ATOM 68 C ALA A 6 2.961 15.782 5.438 1.00 0.00 C ATOM 69 O ALA A 6 2.491 16.514 4.563 1.00 0.00 O ATOM 70 CB ALA A 6 2.978 17.823 6.894 1.00 0.00 C ATOM 0 H ALA A 6 5.343 16.194 6.329 1.00 0.00 H new ATOM 0 HA ALA A 6 2.712 15.807 7.557 1.00 0.00 H new ATOM 0 HB1 ALA A 6 1.924 17.972 6.658 1.00 0.00 H new ATOM 0 HB2 ALA A 6 3.180 18.191 7.900 1.00 0.00 H new ATOM 0 HB3 ALA A 6 3.591 18.370 6.178 1.00 0.00 H new ATOM 76 N PRO A 7 3.182 14.478 5.214 1.00 0.00 N ATOM 77 CA PRO A 7 2.872 13.843 3.950 1.00 0.00 C ATOM 78 C PRO A 7 1.452 13.289 3.926 1.00 0.00 C ATOM 79 O PRO A 7 0.933 12.820 4.944 1.00 0.00 O ATOM 80 CB PRO A 7 3.899 12.719 3.881 1.00 0.00 C ATOM 81 CG PRO A 7 4.168 12.344 5.305 1.00 0.00 C ATOM 82 CD PRO A 7 3.743 13.510 6.168 1.00 0.00 C ATOM 0 HA PRO A 7 2.917 14.531 3.106 1.00 0.00 H new ATOM 0 HB2 PRO A 7 3.515 11.869 3.316 1.00 0.00 H new ATOM 0 HB3 PRO A 7 4.810 13.048 3.382 1.00 0.00 H new ATOM 0 HG2 PRO A 7 3.615 11.445 5.576 1.00 0.00 H new ATOM 0 HG3 PRO A 7 5.226 12.124 5.451 1.00 0.00 H new ATOM 0 HD2 PRO A 7 3.004 13.208 6.910 1.00 0.00 H new ATOM 0 HD3 PRO A 7 4.588 13.931 6.713 1.00 0.00 H new ATOM 90 N ASP A 8 0.824 13.345 2.767 1.00 0.00 N ATOM 91 CA ASP A 8 -0.534 12.842 2.604 1.00 0.00 C ATOM 92 C ASP A 8 -0.516 11.337 2.366 1.00 0.00 C ATOM 93 O ASP A 8 -1.037 10.839 1.368 1.00 0.00 O ATOM 94 CB ASP A 8 -1.245 13.567 1.460 1.00 0.00 C ATOM 95 CG ASP A 8 -1.457 15.039 1.757 1.00 0.00 C ATOM 96 OD1 ASP A 8 -2.562 15.408 2.209 1.00 0.00 O ATOM 97 OD2 ASP A 8 -0.515 15.834 1.550 1.00 0.00 O ATOM 0 H ASP A 8 1.232 13.735 1.918 1.00 0.00 H new ATOM 0 HA ASP A 8 -1.089 13.037 3.522 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -0.659 13.463 0.547 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -2.209 13.093 1.276 1.00 0.00 H new ATOM 102 N ALA A 9 0.122 10.629 3.286 1.00 0.00 N ATOM 103 CA ALA A 9 0.241 9.184 3.212 1.00 0.00 C ATOM 104 C ALA A 9 -1.083 8.513 3.554 1.00 0.00 C ATOM 105 O ALA A 9 -1.744 8.894 4.523 1.00 0.00 O ATOM 106 CB ALA A 9 1.331 8.706 4.159 1.00 0.00 C ATOM 0 H ALA A 9 0.571 11.042 4.104 1.00 0.00 H new ATOM 0 HA ALA A 9 0.508 8.911 2.191 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.415 7.621 4.099 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.281 9.160 3.878 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.079 8.994 5.179 1.00 0.00 H new ATOM 112 N PRO A 10 -1.493 7.518 2.750 1.00 0.00 N ATOM 113 CA PRO A 10 -2.695 6.727 3.021 1.00 0.00 C ATOM 114 C PRO A 10 -2.612 6.030 4.375 1.00 0.00 C ATOM 115 O PRO A 10 -1.631 5.337 4.661 1.00 0.00 O ATOM 116 CB PRO A 10 -2.711 5.689 1.892 1.00 0.00 C ATOM 117 CG PRO A 10 -1.874 6.280 0.815 1.00 0.00 C ATOM 118 CD PRO A 10 -0.821 7.091 1.513 1.00 0.00 C ATOM 0 HA PRO A 10 -3.593 7.343 3.056 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -2.306 4.734 2.228 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -3.726 5.500 1.544 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -1.424 5.502 0.199 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -2.473 6.905 0.152 1.00 0.00 H new ATOM 0 HD2 PRO A 10 0.070 6.500 1.722 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -0.504 7.943 0.912 1.00 0.00 H new ATOM 126 N PRO A 11 -3.625 6.237 5.235 1.00 0.00 N ATOM 127 CA PRO A 11 -3.691 5.610 6.558 1.00 0.00 C ATOM 128 C PRO A 11 -3.688 4.086 6.492 1.00 0.00 C ATOM 129 O PRO A 11 -3.776 3.502 5.409 1.00 0.00 O ATOM 130 CB PRO A 11 -5.016 6.115 7.139 1.00 0.00 C ATOM 131 CG PRO A 11 -5.325 7.351 6.370 1.00 0.00 C ATOM 132 CD PRO A 11 -4.772 7.123 4.993 1.00 0.00 C ATOM 0 HA PRO A 11 -2.821 5.867 7.161 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -5.805 5.372 7.026 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -4.926 6.325 8.205 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -6.399 7.532 6.335 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -4.869 8.225 6.835 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -5.507 6.659 4.335 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -4.467 8.057 4.522 1.00 0.00 H new ATOM 140 N ASP A 12 -3.616 3.462 7.667 1.00 0.00 N ATOM 141 CA ASP A 12 -3.497 2.008 7.799 1.00 0.00 C ATOM 142 C ASP A 12 -4.482 1.270 6.899 1.00 0.00 C ATOM 143 O ASP A 12 -5.701 1.382 7.074 1.00 0.00 O ATOM 144 CB ASP A 12 -3.730 1.596 9.255 1.00 0.00 C ATOM 145 CG ASP A 12 -3.603 0.099 9.468 1.00 0.00 C ATOM 146 OD1 ASP A 12 -2.459 -0.400 9.548 1.00 0.00 O ATOM 147 OD2 ASP A 12 -4.643 -0.586 9.584 1.00 0.00 O ATOM 0 H ASP A 12 -3.639 3.953 8.561 1.00 0.00 H new ATOM 0 HA ASP A 12 -2.489 1.733 7.489 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -3.013 2.112 9.893 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -4.723 1.920 9.565 1.00 0.00 H new ATOM 152 N PRO A 13 -3.962 0.519 5.917 1.00 0.00 N ATOM 153 CA PRO A 13 -4.780 -0.294 5.023 1.00 0.00 C ATOM 154 C PRO A 13 -5.434 -1.442 5.773 1.00 0.00 C ATOM 155 O PRO A 13 -4.753 -2.270 6.384 1.00 0.00 O ATOM 156 CB PRO A 13 -3.788 -0.827 3.980 1.00 0.00 C ATOM 157 CG PRO A 13 -2.562 0.002 4.144 1.00 0.00 C ATOM 158 CD PRO A 13 -2.535 0.411 5.587 1.00 0.00 C ATOM 0 HA PRO A 13 -5.593 0.278 4.576 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -3.574 -1.883 4.145 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -4.192 -0.737 2.971 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -1.669 -0.565 3.881 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -2.589 0.874 3.491 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -2.030 -0.329 6.208 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -2.013 1.357 5.730 1.00 0.00 H new ATOM 166 N THR A 14 -6.749 -1.475 5.741 1.00 0.00 N ATOM 167 CA THR A 14 -7.498 -2.494 6.439 1.00 0.00 C ATOM 168 C THR A 14 -8.031 -3.520 5.453 1.00 0.00 C ATOM 169 O THR A 14 -8.587 -3.164 4.413 1.00 0.00 O ATOM 170 CB THR A 14 -8.670 -1.875 7.208 1.00 0.00 C ATOM 171 OG1 THR A 14 -8.216 -0.711 7.919 1.00 0.00 O ATOM 172 CG2 THR A 14 -9.268 -2.871 8.191 1.00 0.00 C ATOM 0 H THR A 14 -7.324 -0.802 5.234 1.00 0.00 H new ATOM 0 HA THR A 14 -6.828 -2.982 7.147 1.00 0.00 H new ATOM 0 HB THR A 14 -9.442 -1.596 6.491 1.00 0.00 H new ATOM 0 HG1 THR A 14 -8.966 -0.314 8.409 1.00 0.00 H new ATOM 0 HG21 THR A 14 -10.097 -2.404 8.722 1.00 0.00 H new ATOM 0 HG22 THR A 14 -9.630 -3.745 7.649 1.00 0.00 H new ATOM 0 HG23 THR A 14 -8.506 -3.178 8.907 1.00 0.00 H new ATOM 180 N VAL A 15 -7.840 -4.786 5.765 1.00 0.00 N ATOM 181 CA VAL A 15 -8.329 -5.844 4.909 1.00 0.00 C ATOM 182 C VAL A 15 -9.688 -6.335 5.389 1.00 0.00 C ATOM 183 O VAL A 15 -9.810 -6.914 6.471 1.00 0.00 O ATOM 184 CB VAL A 15 -7.331 -7.019 4.840 1.00 0.00 C ATOM 185 CG1 VAL A 15 -7.900 -8.163 4.016 1.00 0.00 C ATOM 186 CG2 VAL A 15 -6.003 -6.554 4.261 1.00 0.00 C ATOM 0 H VAL A 15 -7.352 -5.105 6.602 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.436 -5.434 3.905 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.160 -7.382 5.853 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -7.179 -8.980 3.981 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.825 -8.515 4.472 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -8.104 -7.816 3.003 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.310 -7.394 4.219 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -6.161 -6.164 3.256 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.585 -5.770 4.893 1.00 0.00 H new ATOM 196 N ASP A 16 -10.705 -6.078 4.583 1.00 0.00 N ATOM 197 CA ASP A 16 -12.060 -6.513 4.883 1.00 0.00 C ATOM 198 C ASP A 16 -12.445 -7.663 3.971 1.00 0.00 C ATOM 199 O ASP A 16 -11.893 -7.802 2.879 1.00 0.00 O ATOM 200 CB ASP A 16 -13.070 -5.374 4.696 1.00 0.00 C ATOM 201 CG ASP A 16 -12.985 -4.310 5.773 1.00 0.00 C ATOM 202 OD1 ASP A 16 -13.333 -4.607 6.936 1.00 0.00 O ATOM 203 OD2 ASP A 16 -12.603 -3.164 5.456 1.00 0.00 O ATOM 0 H ASP A 16 -10.616 -5.564 3.706 1.00 0.00 H new ATOM 0 HA ASP A 16 -12.082 -6.831 5.925 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -12.907 -4.910 3.723 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -14.077 -5.790 4.685 1.00 0.00 H new ATOM 208 N GLN A 17 -13.389 -8.480 4.430 1.00 0.00 N ATOM 209 CA GLN A 17 -13.946 -9.562 3.625 1.00 0.00 C ATOM 210 C GLN A 17 -12.849 -10.501 3.128 1.00 0.00 C ATOM 211 O GLN A 17 -12.498 -10.505 1.946 1.00 0.00 O ATOM 212 CB GLN A 17 -14.730 -8.979 2.445 1.00 0.00 C ATOM 213 CG GLN A 17 -15.881 -8.084 2.867 1.00 0.00 C ATOM 214 CD GLN A 17 -16.449 -7.286 1.713 1.00 0.00 C ATOM 215 OE1 GLN A 17 -17.360 -7.736 1.018 1.00 0.00 O ATOM 216 NE2 GLN A 17 -15.919 -6.091 1.506 1.00 0.00 N ATOM 0 H GLN A 17 -13.788 -8.411 5.366 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.622 -10.145 4.250 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -14.049 -8.409 1.813 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -15.119 -9.796 1.838 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -16.670 -8.695 3.305 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -15.539 -7.400 3.644 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -15.165 -5.757 2.106 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -16.265 -5.504 0.746 1.00 0.00 H new ATOM 225 N VAL A 18 -12.304 -11.289 4.042 1.00 0.00 N ATOM 226 CA VAL A 18 -11.249 -12.231 3.704 1.00 0.00 C ATOM 227 C VAL A 18 -11.846 -13.553 3.225 1.00 0.00 C ATOM 228 O VAL A 18 -12.563 -14.226 3.968 1.00 0.00 O ATOM 229 CB VAL A 18 -10.325 -12.492 4.912 1.00 0.00 C ATOM 230 CG1 VAL A 18 -9.199 -13.446 4.542 1.00 0.00 C ATOM 231 CG2 VAL A 18 -9.765 -11.183 5.450 1.00 0.00 C ATOM 0 H VAL A 18 -12.576 -11.295 5.025 1.00 0.00 H new ATOM 0 HA VAL A 18 -10.658 -11.789 2.902 1.00 0.00 H new ATOM 0 HB VAL A 18 -10.919 -12.961 5.696 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -8.563 -13.613 5.411 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -9.620 -14.396 4.213 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -8.606 -13.014 3.736 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -9.116 -11.388 6.301 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -9.192 -10.684 4.669 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -10.586 -10.539 5.766 1.00 0.00 H new ATOM 241 N ASP A 19 -11.561 -13.911 1.982 1.00 0.00 N ATOM 242 CA ASP A 19 -12.021 -15.174 1.415 1.00 0.00 C ATOM 243 C ASP A 19 -10.951 -16.241 1.607 1.00 0.00 C ATOM 244 O ASP A 19 -10.074 -16.103 2.464 1.00 0.00 O ATOM 245 CB ASP A 19 -12.315 -15.035 -0.084 1.00 0.00 C ATOM 246 CG ASP A 19 -13.346 -13.975 -0.414 1.00 0.00 C ATOM 247 OD1 ASP A 19 -14.546 -14.199 -0.150 1.00 0.00 O ATOM 248 OD2 ASP A 19 -12.966 -12.928 -0.975 1.00 0.00 O ATOM 0 H ASP A 19 -11.009 -13.341 1.341 1.00 0.00 H new ATOM 0 HA ASP A 19 -12.939 -15.458 1.929 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -11.387 -14.800 -0.605 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -12.661 -15.995 -0.467 1.00 0.00 H new ATOM 253 N ASP A 20 -11.018 -17.299 0.811 1.00 0.00 N ATOM 254 CA ASP A 20 -10.000 -18.339 0.854 1.00 0.00 C ATOM 255 C ASP A 20 -8.758 -17.880 0.105 1.00 0.00 C ATOM 256 O ASP A 20 -7.646 -17.949 0.626 1.00 0.00 O ATOM 257 CB ASP A 20 -10.511 -19.652 0.245 1.00 0.00 C ATOM 258 CG ASP A 20 -11.688 -20.242 0.994 1.00 0.00 C ATOM 259 OD1 ASP A 20 -12.814 -20.212 0.451 1.00 0.00 O ATOM 260 OD2 ASP A 20 -11.500 -20.734 2.127 1.00 0.00 O ATOM 0 H ASP A 20 -11.762 -17.459 0.132 1.00 0.00 H new ATOM 0 HA ASP A 20 -9.754 -18.522 1.900 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -10.800 -19.476 -0.791 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -9.698 -20.378 0.230 1.00 0.00 H new ATOM 265 N THR A 21 -8.957 -17.388 -1.111 1.00 0.00 N ATOM 266 CA THR A 21 -7.843 -17.004 -1.964 1.00 0.00 C ATOM 267 C THR A 21 -7.927 -15.541 -2.403 1.00 0.00 C ATOM 268 O THR A 21 -7.178 -15.107 -3.281 1.00 0.00 O ATOM 269 CB THR A 21 -7.781 -17.905 -3.212 1.00 0.00 C ATOM 270 OG1 THR A 21 -9.060 -17.934 -3.863 1.00 0.00 O ATOM 271 CG2 THR A 21 -7.363 -19.319 -2.838 1.00 0.00 C ATOM 0 H THR A 21 -9.878 -17.246 -1.527 1.00 0.00 H new ATOM 0 HA THR A 21 -6.937 -17.129 -1.371 1.00 0.00 H new ATOM 0 HB THR A 21 -7.038 -17.492 -3.894 1.00 0.00 H new ATOM 0 HG1 THR A 21 -9.011 -18.508 -4.656 1.00 0.00 H new ATOM 0 HG21 THR A 21 -7.326 -19.937 -3.735 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.378 -19.296 -2.373 1.00 0.00 H new ATOM 0 HG23 THR A 21 -8.085 -19.739 -2.138 1.00 0.00 H new ATOM 279 N SER A 22 -8.823 -14.781 -1.793 1.00 0.00 N ATOM 280 CA SER A 22 -8.993 -13.382 -2.159 1.00 0.00 C ATOM 281 C SER A 22 -9.332 -12.530 -0.941 1.00 0.00 C ATOM 282 O SER A 22 -9.910 -13.017 0.027 1.00 0.00 O ATOM 283 CB SER A 22 -10.083 -13.247 -3.227 1.00 0.00 C ATOM 284 OG SER A 22 -11.274 -13.911 -2.837 1.00 0.00 O ATOM 0 H SER A 22 -9.440 -15.105 -1.048 1.00 0.00 H new ATOM 0 HA SER A 22 -8.049 -13.020 -2.567 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.294 -12.192 -3.403 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.725 -13.662 -4.169 1.00 0.00 H new ATOM 0 HG SER A 22 -11.812 -13.315 -2.275 1.00 0.00 H new ATOM 290 N ILE A 23 -8.945 -11.263 -0.988 1.00 0.00 N ATOM 291 CA ILE A 23 -9.261 -10.316 0.076 1.00 0.00 C ATOM 292 C ILE A 23 -9.645 -8.974 -0.522 1.00 0.00 C ATOM 293 O ILE A 23 -9.358 -8.706 -1.689 1.00 0.00 O ATOM 294 CB ILE A 23 -8.066 -10.061 1.023 1.00 0.00 C ATOM 295 CG1 ILE A 23 -6.921 -9.394 0.253 1.00 0.00 C ATOM 296 CG2 ILE A 23 -7.600 -11.351 1.676 1.00 0.00 C ATOM 297 CD1 ILE A 23 -5.930 -8.668 1.135 1.00 0.00 C ATOM 0 H ILE A 23 -8.407 -10.863 -1.757 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.079 -10.760 0.643 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.392 -9.390 1.818 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.392 -10.154 -0.322 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.341 -8.687 -0.463 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.759 -11.141 2.337 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -8.417 -11.782 2.255 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -7.289 -12.057 0.906 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.150 -8.223 0.517 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.444 -7.884 1.691 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.480 -9.373 1.834 1.00 0.00 H new ATOM 309 N VAL A 24 -10.279 -8.131 0.274 1.00 0.00 N ATOM 310 CA VAL A 24 -10.482 -6.750 -0.115 1.00 0.00 C ATOM 311 C VAL A 24 -9.595 -5.861 0.744 1.00 0.00 C ATOM 312 O VAL A 24 -9.891 -5.613 1.914 1.00 0.00 O ATOM 313 CB VAL A 24 -11.957 -6.313 0.034 1.00 0.00 C ATOM 314 CG1 VAL A 24 -12.150 -4.889 -0.469 1.00 0.00 C ATOM 315 CG2 VAL A 24 -12.880 -7.269 -0.706 1.00 0.00 C ATOM 0 H VAL A 24 -10.659 -8.378 1.188 1.00 0.00 H new ATOM 0 HA VAL A 24 -10.220 -6.653 -1.169 1.00 0.00 H new ATOM 0 HB VAL A 24 -12.213 -6.341 1.093 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -13.195 -4.601 -0.355 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -11.522 -4.211 0.109 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -11.871 -4.834 -1.521 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -13.913 -6.942 -0.588 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -12.621 -7.278 -1.765 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.768 -8.273 -0.297 1.00 0.00 H new ATOM 325 N VAL A 25 -8.509 -5.386 0.160 1.00 0.00 N ATOM 326 CA VAL A 25 -7.572 -4.535 0.870 1.00 0.00 C ATOM 327 C VAL A 25 -7.921 -3.073 0.619 1.00 0.00 C ATOM 328 O VAL A 25 -7.893 -2.594 -0.517 1.00 0.00 O ATOM 329 CB VAL A 25 -6.101 -4.850 0.479 1.00 0.00 C ATOM 330 CG1 VAL A 25 -5.927 -4.926 -1.027 1.00 0.00 C ATOM 331 CG2 VAL A 25 -5.137 -3.837 1.074 1.00 0.00 C ATOM 0 H VAL A 25 -8.254 -5.577 -0.809 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.657 -4.736 1.938 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.865 -5.829 0.896 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.886 -5.148 -1.262 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.565 -5.713 -1.428 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.205 -3.971 -1.474 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.118 -4.088 0.780 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.385 -2.841 0.708 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.216 -3.855 2.161 1.00 0.00 H new ATOM 341 N ARG A 26 -8.302 -2.387 1.683 1.00 0.00 N ATOM 342 CA ARG A 26 -8.802 -1.029 1.582 1.00 0.00 C ATOM 343 C ARG A 26 -7.826 -0.041 2.199 1.00 0.00 C ATOM 344 O ARG A 26 -7.213 -0.323 3.226 1.00 0.00 O ATOM 345 CB ARG A 26 -10.152 -0.925 2.293 1.00 0.00 C ATOM 346 CG ARG A 26 -11.190 -1.906 1.777 1.00 0.00 C ATOM 347 CD ARG A 26 -12.442 -1.890 2.635 1.00 0.00 C ATOM 348 NE ARG A 26 -13.035 -0.559 2.717 1.00 0.00 N ATOM 349 CZ ARG A 26 -13.786 -0.139 3.732 1.00 0.00 C ATOM 350 NH1 ARG A 26 -13.999 -0.930 4.780 1.00 0.00 N ATOM 351 NH2 ARG A 26 -14.303 1.084 3.711 1.00 0.00 N ATOM 0 H ARG A 26 -8.273 -2.754 2.634 1.00 0.00 H new ATOM 0 HA ARG A 26 -8.919 -0.784 0.526 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.005 -1.093 3.360 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.535 0.089 2.180 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.449 -1.656 0.748 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -10.768 -2.911 1.765 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -13.172 -2.587 2.223 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -12.198 -2.240 3.638 1.00 0.00 H new ATOM 0 HE ARG A 26 -12.863 0.089 1.949 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -13.586 -1.862 4.808 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -14.575 -0.604 5.556 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -14.124 1.700 2.918 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -14.879 1.408 4.488 1.00 0.00 H new ATOM 365 N TRP A 27 -7.687 1.111 1.569 1.00 0.00 N ATOM 366 CA TRP A 27 -6.855 2.173 2.100 1.00 0.00 C ATOM 367 C TRP A 27 -7.686 3.432 2.306 1.00 0.00 C ATOM 368 O TRP A 27 -8.461 3.838 1.434 1.00 0.00 O ATOM 369 CB TRP A 27 -5.654 2.446 1.185 1.00 0.00 C ATOM 370 CG TRP A 27 -6.002 2.547 -0.268 1.00 0.00 C ATOM 371 CD1 TRP A 27 -6.444 3.652 -0.935 1.00 0.00 C ATOM 372 CD2 TRP A 27 -5.924 1.496 -1.239 1.00 0.00 C ATOM 373 NE1 TRP A 27 -6.657 3.349 -2.256 1.00 0.00 N ATOM 374 CE2 TRP A 27 -6.340 2.034 -2.468 1.00 0.00 C ATOM 375 CE3 TRP A 27 -5.543 0.152 -1.185 1.00 0.00 C ATOM 376 CZ2 TRP A 27 -6.388 1.277 -3.633 1.00 0.00 C ATOM 377 CZ3 TRP A 27 -5.590 -0.599 -2.342 1.00 0.00 C ATOM 378 CH2 TRP A 27 -6.007 -0.034 -3.552 1.00 0.00 C ATOM 0 H TRP A 27 -8.143 1.335 0.684 1.00 0.00 H new ATOM 0 HA TRP A 27 -6.462 1.855 3.066 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -5.176 3.374 1.498 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -4.922 1.650 1.318 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.603 4.623 -0.489 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -6.997 3.998 -2.965 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -5.218 -0.290 -0.255 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -6.714 1.708 -4.568 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.300 -1.639 -2.313 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -6.029 -0.646 -4.441 1.00 0.00 H new ATOM 389 N SER A 28 -7.538 4.027 3.477 1.00 0.00 N ATOM 390 CA SER A 28 -8.315 5.193 3.854 1.00 0.00 C ATOM 391 C SER A 28 -7.812 6.436 3.127 1.00 0.00 C ATOM 392 O SER A 28 -6.684 6.465 2.635 1.00 0.00 O ATOM 393 CB SER A 28 -8.218 5.390 5.365 1.00 0.00 C ATOM 394 OG SER A 28 -8.486 4.178 6.052 1.00 0.00 O ATOM 0 H SER A 28 -6.878 3.716 4.190 1.00 0.00 H new ATOM 0 HA SER A 28 -9.356 5.036 3.570 1.00 0.00 H new ATOM 0 HB2 SER A 28 -7.222 5.748 5.626 1.00 0.00 H new ATOM 0 HB3 SER A 28 -8.925 6.156 5.682 1.00 0.00 H new ATOM 0 HG SER A 28 -8.417 4.327 7.018 1.00 0.00 H new ATOM 400 N ARG A 29 -8.659 7.452 3.049 1.00 0.00 N ATOM 401 CA ARG A 29 -8.272 8.719 2.448 1.00 0.00 C ATOM 402 C ARG A 29 -7.401 9.514 3.411 1.00 0.00 C ATOM 403 O ARG A 29 -7.784 9.734 4.559 1.00 0.00 O ATOM 404 CB ARG A 29 -9.507 9.530 2.046 1.00 0.00 C ATOM 405 CG ARG A 29 -10.157 9.039 0.765 1.00 0.00 C ATOM 406 CD ARG A 29 -9.293 9.361 -0.443 1.00 0.00 C ATOM 407 NE ARG A 29 -9.668 8.578 -1.616 1.00 0.00 N ATOM 408 CZ ARG A 29 -8.876 8.402 -2.675 1.00 0.00 C ATOM 409 NH1 ARG A 29 -7.712 9.037 -2.754 1.00 0.00 N ATOM 410 NH2 ARG A 29 -9.257 7.605 -3.662 1.00 0.00 N ATOM 0 H ARG A 29 -9.618 7.423 3.394 1.00 0.00 H new ATOM 0 HA ARG A 29 -7.696 8.511 1.546 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -10.238 9.491 2.854 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -9.223 10.575 1.924 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -10.318 7.963 0.824 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -11.137 9.502 0.650 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -9.378 10.423 -0.675 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -8.248 9.170 -0.201 1.00 0.00 H new ATOM 0 HE ARG A 29 -10.589 8.140 -1.627 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -7.420 9.662 -2.003 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -7.110 8.899 -3.566 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -10.156 7.126 -3.612 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -8.651 7.471 -4.472 1.00 0.00 H new ATOM 424 N PRO A 30 -6.207 9.927 2.958 1.00 0.00 N ATOM 425 CA PRO A 30 -5.257 10.678 3.784 1.00 0.00 C ATOM 426 C PRO A 30 -5.835 12.004 4.260 1.00 0.00 C ATOM 427 O PRO A 30 -6.054 12.153 5.481 1.00 0.00 O ATOM 428 CB PRO A 30 -4.059 10.913 2.855 1.00 0.00 C ATOM 429 CG PRO A 30 -4.579 10.699 1.476 1.00 0.00 C ATOM 430 CD PRO A 30 -5.690 9.698 1.599 1.00 0.00 C ATOM 431 OXT PRO A 30 -6.092 12.882 3.410 1.00 0.00 O ATOM 0 HA PRO A 30 -4.995 10.135 4.692 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -3.662 11.921 2.973 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -3.246 10.222 3.080 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -4.942 11.633 1.047 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -3.794 10.330 0.817 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -6.460 9.858 0.844 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.327 8.678 1.474 1.00 0.00 H new TER 439 PRO A 30 ATOM 440 N MET B 31 -18.182 14.977 -2.762 1.00 0.00 N ATOM 441 CA MET B 31 -18.812 14.919 -1.422 1.00 0.00 C ATOM 442 C MET B 31 -18.801 16.297 -0.771 1.00 0.00 C ATOM 443 O MET B 31 -19.830 16.972 -0.715 1.00 0.00 O ATOM 444 CB MET B 31 -18.095 13.907 -0.521 1.00 0.00 C ATOM 445 CG MET B 31 -18.217 12.465 -0.991 1.00 0.00 C ATOM 446 SD MET B 31 -19.930 11.905 -1.084 1.00 0.00 S ATOM 447 CE MET B 31 -19.697 10.207 -1.610 1.00 0.00 C ATOM 0 HA MET B 31 -19.845 14.594 -1.549 1.00 0.00 H new ATOM 0 HB2 MET B 31 -17.039 14.171 -0.463 1.00 0.00 H new ATOM 0 HB3 MET B 31 -18.499 13.985 0.488 1.00 0.00 H new ATOM 0 HG2 MET B 31 -17.753 12.367 -1.972 1.00 0.00 H new ATOM 0 HG3 MET B 31 -17.664 11.817 -0.311 1.00 0.00 H new ATOM 0 HE1 MET B 31 -20.668 9.722 -1.714 1.00 0.00 H new ATOM 0 HE2 MET B 31 -19.179 10.191 -2.569 1.00 0.00 H new ATOM 0 HE3 MET B 31 -19.103 9.674 -0.868 1.00 0.00 H new ATOM 459 N ARG B 32 -17.637 16.722 -0.289 1.00 0.00 N ATOM 460 CA ARG B 32 -17.493 18.054 0.285 1.00 0.00 C ATOM 461 C ARG B 32 -17.234 19.065 -0.824 1.00 0.00 C ATOM 462 O ARG B 32 -16.160 19.663 -0.903 1.00 0.00 O ATOM 463 CB ARG B 32 -16.357 18.090 1.312 1.00 0.00 C ATOM 464 CG ARG B 32 -16.658 17.325 2.590 1.00 0.00 C ATOM 465 CD ARG B 32 -15.521 17.446 3.592 1.00 0.00 C ATOM 466 NE ARG B 32 -15.818 16.749 4.843 1.00 0.00 N ATOM 467 CZ ARG B 32 -14.964 16.641 5.861 1.00 0.00 C ATOM 468 NH1 ARG B 32 -13.753 17.182 5.782 1.00 0.00 N ATOM 469 NH2 ARG B 32 -15.324 15.987 6.959 1.00 0.00 N ATOM 0 H ARG B 32 -16.783 16.165 -0.285 1.00 0.00 H new ATOM 0 HA ARG B 32 -18.419 18.312 0.799 1.00 0.00 H new ATOM 0 HB2 ARG B 32 -15.456 17.678 0.857 1.00 0.00 H new ATOM 0 HB3 ARG B 32 -16.141 19.128 1.564 1.00 0.00 H new ATOM 0 HG2 ARG B 32 -17.578 17.704 3.034 1.00 0.00 H new ATOM 0 HG3 ARG B 32 -16.827 16.274 2.355 1.00 0.00 H new ATOM 0 HD2 ARG B 32 -14.609 17.037 3.157 1.00 0.00 H new ATOM 0 HD3 ARG B 32 -15.331 18.499 3.800 1.00 0.00 H new ATOM 0 HE ARG B 32 -16.737 16.318 4.943 1.00 0.00 H new ATOM 0 HH11 ARG B 32 -13.472 17.683 4.939 1.00 0.00 H new ATOM 0 HH12 ARG B 32 -13.104 17.096 6.564 1.00 0.00 H new ATOM 0 HH21 ARG B 32 -16.252 15.569 7.022 1.00 0.00 H new ATOM 0 HH22 ARG B 32 -14.672 15.903 7.739 1.00 0.00 H new ATOM 483 N GLY B 33 -18.231 19.252 -1.671 1.00 0.00 N ATOM 484 CA GLY B 33 -18.066 20.081 -2.841 1.00 0.00 C ATOM 485 C GLY B 33 -17.871 19.240 -4.083 1.00 0.00 C ATOM 486 O GLY B 33 -17.455 18.082 -3.995 1.00 0.00 O ATOM 0 H GLY B 33 -19.158 18.840 -1.567 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -18.941 20.719 -2.964 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -17.208 20.739 -2.706 1.00 0.00 H new ATOM 490 N SER B 34 -18.185 19.806 -5.235 1.00 0.00 N ATOM 491 CA SER B 34 -18.041 19.094 -6.489 1.00 0.00 C ATOM 492 C SER B 34 -16.580 19.080 -6.917 1.00 0.00 C ATOM 493 O SER B 34 -15.994 20.134 -7.182 1.00 0.00 O ATOM 494 CB SER B 34 -18.910 19.742 -7.571 1.00 0.00 C ATOM 495 OG SER B 34 -18.876 18.993 -8.772 1.00 0.00 O ATOM 0 H SER B 34 -18.541 20.757 -5.326 1.00 0.00 H new ATOM 0 HA SER B 34 -18.374 18.065 -6.350 1.00 0.00 H new ATOM 0 HB2 SER B 34 -19.938 19.820 -7.217 1.00 0.00 H new ATOM 0 HB3 SER B 34 -18.561 20.757 -7.762 1.00 0.00 H new ATOM 0 HG SER B 34 -19.440 19.428 -9.445 1.00 0.00 H new ATOM 501 N ASN B 35 -15.998 17.883 -6.960 1.00 0.00 N ATOM 502 CA ASN B 35 -14.605 17.705 -7.360 1.00 0.00 C ATOM 503 C ASN B 35 -13.678 18.536 -6.485 1.00 0.00 C ATOM 504 O ASN B 35 -13.097 19.524 -6.937 1.00 0.00 O ATOM 505 CB ASN B 35 -14.404 18.067 -8.837 1.00 0.00 C ATOM 506 CG ASN B 35 -14.977 17.024 -9.775 1.00 0.00 C ATOM 507 OD1 ASN B 35 -16.142 17.090 -10.163 1.00 0.00 O ATOM 508 ND2 ASN B 35 -14.156 16.057 -10.153 1.00 0.00 N ATOM 0 H ASN B 35 -16.476 17.014 -6.720 1.00 0.00 H new ATOM 0 HA ASN B 35 -14.356 16.652 -7.227 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -14.874 19.029 -9.039 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -13.339 18.184 -9.037 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -14.483 15.330 -10.789 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -13.196 16.039 -9.808 1.00 0.00 H new ATOM 515 N ALA B 36 -13.560 18.137 -5.227 1.00 0.00 N ATOM 516 CA ALA B 36 -12.685 18.819 -4.285 1.00 0.00 C ATOM 517 C ALA B 36 -11.227 18.645 -4.693 1.00 0.00 C ATOM 518 O ALA B 36 -10.704 17.528 -4.680 1.00 0.00 O ATOM 519 CB ALA B 36 -12.912 18.292 -2.877 1.00 0.00 C ATOM 0 H ALA B 36 -14.062 17.341 -4.834 1.00 0.00 H new ATOM 0 HA ALA B 36 -12.921 19.883 -4.298 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -12.251 18.811 -2.183 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -13.949 18.463 -2.587 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -12.699 17.223 -2.850 1.00 0.00 H new ATOM 525 N PRO B 37 -10.561 19.749 -5.076 1.00 0.00 N ATOM 526 CA PRO B 37 -9.173 19.726 -5.553 1.00 0.00 C ATOM 527 C PRO B 37 -8.237 18.962 -4.624 1.00 0.00 C ATOM 528 O PRO B 37 -8.117 19.287 -3.441 1.00 0.00 O ATOM 529 CB PRO B 37 -8.789 21.205 -5.593 1.00 0.00 C ATOM 530 CG PRO B 37 -10.076 21.920 -5.806 1.00 0.00 C ATOM 531 CD PRO B 37 -11.115 21.118 -5.073 1.00 0.00 C ATOM 0 HA PRO B 37 -9.088 19.217 -6.513 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -8.312 21.516 -4.664 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -8.083 21.410 -6.398 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -10.026 22.939 -5.422 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -10.313 21.991 -6.868 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -11.265 21.488 -4.059 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -12.082 21.161 -5.574 1.00 0.00 H new ATOM 539 N GLN B 38 -7.590 17.939 -5.162 1.00 0.00 N ATOM 540 CA GLN B 38 -6.645 17.140 -4.400 1.00 0.00 C ATOM 541 C GLN B 38 -5.218 17.591 -4.691 1.00 0.00 C ATOM 542 O GLN B 38 -4.682 17.310 -5.761 1.00 0.00 O ATOM 543 CB GLN B 38 -6.794 15.657 -4.747 1.00 0.00 C ATOM 544 CG GLN B 38 -8.128 15.055 -4.336 1.00 0.00 C ATOM 545 CD GLN B 38 -8.356 15.117 -2.839 1.00 0.00 C ATOM 546 OE1 GLN B 38 -7.963 14.212 -2.101 1.00 0.00 O ATOM 547 NE2 GLN B 38 -9.002 16.177 -2.383 1.00 0.00 N ATOM 0 H GLN B 38 -7.704 17.642 -6.131 1.00 0.00 H new ATOM 0 HA GLN B 38 -6.857 17.279 -3.340 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -6.667 15.532 -5.822 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -5.992 15.099 -4.264 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -8.934 15.584 -4.845 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -8.171 14.016 -4.664 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -9.310 16.904 -3.029 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -9.192 16.268 -1.385 1.00 0.00 H new ATOM 556 N PRO B 39 -4.591 18.306 -3.742 1.00 0.00 N ATOM 557 CA PRO B 39 -3.210 18.778 -3.888 1.00 0.00 C ATOM 558 C PRO B 39 -2.233 17.616 -4.019 1.00 0.00 C ATOM 559 O PRO B 39 -1.343 17.633 -4.869 1.00 0.00 O ATOM 560 CB PRO B 39 -2.946 19.558 -2.594 1.00 0.00 C ATOM 561 CG PRO B 39 -4.294 19.856 -2.036 1.00 0.00 C ATOM 562 CD PRO B 39 -5.176 18.719 -2.458 1.00 0.00 C ATOM 0 HA PRO B 39 -3.076 19.381 -4.786 1.00 0.00 H new ATOM 0 HB2 PRO B 39 -2.351 18.971 -1.894 1.00 0.00 H new ATOM 0 HB3 PRO B 39 -2.391 20.475 -2.793 1.00 0.00 H new ATOM 0 HG2 PRO B 39 -4.257 19.939 -0.950 1.00 0.00 H new ATOM 0 HG3 PRO B 39 -4.672 20.805 -2.416 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -5.165 17.908 -1.730 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -6.214 19.033 -2.570 1.00 0.00 H new ATOM 570 N SER B 40 -2.412 16.608 -3.174 1.00 0.00 N ATOM 571 CA SER B 40 -1.608 15.401 -3.241 1.00 0.00 C ATOM 572 C SER B 40 -1.856 14.688 -4.565 1.00 0.00 C ATOM 573 O SER B 40 -0.917 14.385 -5.303 1.00 0.00 O ATOM 574 CB SER B 40 -1.953 14.481 -2.069 1.00 0.00 C ATOM 575 OG SER B 40 -3.352 14.240 -2.012 1.00 0.00 O ATOM 0 H SER B 40 -3.112 16.606 -2.432 1.00 0.00 H new ATOM 0 HA SER B 40 -0.553 15.668 -3.178 1.00 0.00 H new ATOM 0 HB2 SER B 40 -1.421 13.536 -2.174 1.00 0.00 H new ATOM 0 HB3 SER B 40 -1.619 14.933 -1.135 1.00 0.00 H new ATOM 0 HG SER B 40 -3.551 13.648 -1.257 1.00 0.00 H new ATOM 581 N HIS B 41 -3.137 14.441 -4.847 1.00 0.00 N ATOM 582 CA HIS B 41 -3.577 13.830 -6.098 1.00 0.00 C ATOM 583 C HIS B 41 -2.814 12.540 -6.379 1.00 0.00 C ATOM 584 O HIS B 41 -1.871 12.516 -7.172 1.00 0.00 O ATOM 585 CB HIS B 41 -3.434 14.825 -7.261 1.00 0.00 C ATOM 586 CG HIS B 41 -3.833 14.270 -8.597 1.00 0.00 C ATOM 587 ND1 HIS B 41 -5.138 14.003 -8.946 1.00 0.00 N ATOM 588 CD2 HIS B 41 -3.083 13.922 -9.668 1.00 0.00 C ATOM 589 CE1 HIS B 41 -5.173 13.511 -10.169 1.00 0.00 C ATOM 590 NE2 HIS B 41 -3.941 13.454 -10.630 1.00 0.00 N ATOM 0 H HIS B 41 -3.901 14.662 -4.208 1.00 0.00 H new ATOM 0 HA HIS B 41 -4.631 13.571 -5.999 1.00 0.00 H new ATOM 0 HB2 HIS B 41 -4.042 15.704 -7.049 1.00 0.00 H new ATOM 0 HB3 HIS B 41 -2.398 15.159 -7.313 1.00 0.00 H new ATOM 0 HD2 HIS B 41 -2.009 13.999 -9.750 1.00 0.00 H new ATOM 0 HE1 HIS B 41 -6.062 13.206 -10.702 1.00 0.00 H new ATOM 0 HE2 HIS B 41 -3.669 13.116 -11.553 1.00 0.00 H new ATOM 599 N ILE B 42 -3.225 11.469 -5.720 1.00 0.00 N ATOM 600 CA ILE B 42 -2.613 10.172 -5.940 1.00 0.00 C ATOM 601 C ILE B 42 -2.926 9.699 -7.352 1.00 0.00 C ATOM 602 O ILE B 42 -4.083 9.454 -7.697 1.00 0.00 O ATOM 603 CB ILE B 42 -3.086 9.102 -4.923 1.00 0.00 C ATOM 604 CG1 ILE B 42 -2.638 9.440 -3.491 1.00 0.00 C ATOM 605 CG2 ILE B 42 -2.549 7.734 -5.319 1.00 0.00 C ATOM 606 CD1 ILE B 42 -3.399 10.579 -2.841 1.00 0.00 C ATOM 0 H ILE B 42 -3.977 11.473 -5.031 1.00 0.00 H new ATOM 0 HA ILE B 42 -1.539 10.295 -5.802 1.00 0.00 H new ATOM 0 HB ILE B 42 -4.176 9.089 -4.940 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -2.745 8.549 -2.872 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -1.578 9.692 -3.507 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -2.886 6.988 -4.599 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -2.916 7.472 -6.311 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -1.459 7.760 -5.331 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -3.015 10.746 -1.835 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -3.272 11.486 -3.433 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -4.458 10.326 -2.788 1.00 0.00 H new ATOM 618 N SER B 43 -1.889 9.603 -8.166 1.00 0.00 N ATOM 619 CA SER B 43 -2.026 9.192 -9.550 1.00 0.00 C ATOM 620 C SER B 43 -2.386 7.712 -9.640 1.00 0.00 C ATOM 621 O SER B 43 -3.205 7.310 -10.467 1.00 0.00 O ATOM 622 CB SER B 43 -0.718 9.472 -10.293 1.00 0.00 C ATOM 623 OG SER B 43 -0.401 10.856 -10.257 1.00 0.00 O ATOM 0 H SER B 43 -0.930 9.808 -7.885 1.00 0.00 H new ATOM 0 HA SER B 43 -2.832 9.761 -10.013 1.00 0.00 H new ATOM 0 HB2 SER B 43 0.091 8.898 -9.842 1.00 0.00 H new ATOM 0 HB3 SER B 43 -0.805 9.142 -11.328 1.00 0.00 H new ATOM 0 HG SER B 43 0.439 11.012 -10.736 1.00 0.00 H new ATOM 629 N LYS B 44 -1.781 6.912 -8.771 1.00 0.00 N ATOM 630 CA LYS B 44 -2.026 5.479 -8.751 1.00 0.00 C ATOM 631 C LYS B 44 -1.511 4.862 -7.457 1.00 0.00 C ATOM 632 O LYS B 44 -0.575 5.378 -6.838 1.00 0.00 O ATOM 633 CB LYS B 44 -1.361 4.800 -9.956 1.00 0.00 C ATOM 634 CG LYS B 44 0.140 5.040 -10.053 1.00 0.00 C ATOM 635 CD LYS B 44 0.738 4.307 -11.241 1.00 0.00 C ATOM 636 CE LYS B 44 2.231 4.566 -11.374 1.00 0.00 C ATOM 637 NZ LYS B 44 2.526 5.980 -11.723 1.00 0.00 N ATOM 0 H LYS B 44 -1.115 7.235 -8.069 1.00 0.00 H new ATOM 0 HA LYS B 44 -3.103 5.321 -8.809 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -1.544 3.727 -9.902 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -1.836 5.159 -10.869 1.00 0.00 H new ATOM 0 HG2 LYS B 44 0.335 6.108 -10.146 1.00 0.00 H new ATOM 0 HG3 LYS B 44 0.624 4.706 -9.135 1.00 0.00 H new ATOM 0 HD2 LYS B 44 0.563 3.237 -11.133 1.00 0.00 H new ATOM 0 HD3 LYS B 44 0.232 4.622 -12.154 1.00 0.00 H new ATOM 0 HE2 LYS B 44 2.727 4.314 -10.437 1.00 0.00 H new ATOM 0 HE3 LYS B 44 2.645 3.910 -12.140 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 3.536 6.078 -11.952 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 1.955 6.261 -12.546 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 2.294 6.593 -10.915 1.00 0.00 H new ATOM 651 N TYR B 45 -2.143 3.773 -7.052 1.00 0.00 N ATOM 652 CA TYR B 45 -1.715 3.012 -5.893 1.00 0.00 C ATOM 653 C TYR B 45 -1.089 1.704 -6.350 1.00 0.00 C ATOM 654 O TYR B 45 -1.665 0.986 -7.165 1.00 0.00 O ATOM 655 CB TYR B 45 -2.896 2.713 -4.965 1.00 0.00 C ATOM 656 CG TYR B 45 -3.500 3.931 -4.303 1.00 0.00 C ATOM 657 CD1 TYR B 45 -4.699 4.468 -4.749 1.00 0.00 C ATOM 658 CD2 TYR B 45 -2.877 4.531 -3.218 1.00 0.00 C ATOM 659 CE1 TYR B 45 -5.260 5.570 -4.130 1.00 0.00 C ATOM 660 CE2 TYR B 45 -3.429 5.633 -2.596 1.00 0.00 C ATOM 661 CZ TYR B 45 -4.622 6.148 -3.055 1.00 0.00 C ATOM 662 OH TYR B 45 -5.177 7.246 -2.435 1.00 0.00 O ATOM 0 H TYR B 45 -2.967 3.393 -7.518 1.00 0.00 H new ATOM 0 HA TYR B 45 -0.985 3.605 -5.342 1.00 0.00 H new ATOM 0 HB2 TYR B 45 -3.672 2.205 -5.538 1.00 0.00 H new ATOM 0 HB3 TYR B 45 -2.566 2.021 -4.190 1.00 0.00 H new ATOM 0 HD1 TYR B 45 -5.202 4.019 -5.592 1.00 0.00 H new ATOM 0 HD2 TYR B 45 -1.943 4.129 -2.853 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -6.195 5.976 -4.488 1.00 0.00 H new ATOM 0 HE2 TYR B 45 -2.929 6.089 -1.754 1.00 0.00 H new ATOM 0 HH TYR B 45 -4.601 7.529 -1.694 1.00 0.00 H new ATOM 672 N ILE B 46 0.095 1.409 -5.849 1.00 0.00 N ATOM 673 CA ILE B 46 0.770 0.171 -6.193 1.00 0.00 C ATOM 674 C ILE B 46 0.703 -0.801 -5.024 1.00 0.00 C ATOM 675 O ILE B 46 1.217 -0.525 -3.937 1.00 0.00 O ATOM 676 CB ILE B 46 2.250 0.395 -6.613 1.00 0.00 C ATOM 677 CG1 ILE B 46 2.339 1.059 -7.996 1.00 0.00 C ATOM 678 CG2 ILE B 46 3.021 -0.917 -6.616 1.00 0.00 C ATOM 679 CD1 ILE B 46 1.953 2.522 -8.009 1.00 0.00 C ATOM 0 H ILE B 46 0.609 2.008 -5.203 1.00 0.00 H new ATOM 0 HA ILE B 46 0.251 -0.249 -7.055 1.00 0.00 H new ATOM 0 HB ILE B 46 2.700 1.063 -5.878 1.00 0.00 H new ATOM 0 HG12 ILE B 46 3.359 0.961 -8.369 1.00 0.00 H new ATOM 0 HG13 ILE B 46 1.693 0.519 -8.688 1.00 0.00 H new ATOM 0 HG21 ILE B 46 4.053 -0.732 -6.913 1.00 0.00 H new ATOM 0 HG22 ILE B 46 3.004 -1.351 -5.616 1.00 0.00 H new ATOM 0 HG23 ILE B 46 2.559 -1.609 -7.320 1.00 0.00 H new ATOM 0 HD11 ILE B 46 2.044 2.913 -9.022 1.00 0.00 H new ATOM 0 HD12 ILE B 46 0.923 2.630 -7.669 1.00 0.00 H new ATOM 0 HD13 ILE B 46 2.614 3.079 -7.345 1.00 0.00 H new ATOM 691 N LEU B 47 0.045 -1.924 -5.249 1.00 0.00 N ATOM 692 CA LEU B 47 -0.080 -2.959 -4.238 1.00 0.00 C ATOM 693 C LEU B 47 0.944 -4.048 -4.526 1.00 0.00 C ATOM 694 O LEU B 47 0.876 -4.711 -5.561 1.00 0.00 O ATOM 695 CB LEU B 47 -1.507 -3.546 -4.260 1.00 0.00 C ATOM 696 CG LEU B 47 -2.044 -4.148 -2.944 1.00 0.00 C ATOM 697 CD1 LEU B 47 -1.130 -5.230 -2.399 1.00 0.00 C ATOM 698 CD2 LEU B 47 -2.263 -3.060 -1.905 1.00 0.00 C ATOM 0 H LEU B 47 -0.415 -2.144 -6.132 1.00 0.00 H new ATOM 0 HA LEU B 47 0.102 -2.538 -3.249 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -2.191 -2.758 -4.575 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.541 -4.322 -5.025 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.003 -4.615 -3.170 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -1.546 -5.626 -1.473 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.042 -6.034 -3.130 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.144 -4.809 -2.203 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -2.642 -3.506 -0.985 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.318 -2.556 -1.702 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -2.986 -2.337 -2.282 1.00 0.00 H new ATOM 710 N ARG B 48 1.913 -4.204 -3.637 1.00 0.00 N ATOM 711 CA ARG B 48 2.894 -5.267 -3.771 1.00 0.00 C ATOM 712 C ARG B 48 2.839 -6.177 -2.558 1.00 0.00 C ATOM 713 O ARG B 48 2.927 -5.709 -1.420 1.00 0.00 O ATOM 714 CB ARG B 48 4.308 -4.709 -3.945 1.00 0.00 C ATOM 715 CG ARG B 48 4.470 -3.841 -5.181 1.00 0.00 C ATOM 716 CD ARG B 48 5.933 -3.567 -5.488 1.00 0.00 C ATOM 717 NE ARG B 48 6.652 -3.062 -4.322 1.00 0.00 N ATOM 718 CZ ARG B 48 7.976 -3.149 -4.163 1.00 0.00 C ATOM 719 NH1 ARG B 48 8.728 -3.726 -5.091 1.00 0.00 N ATOM 720 NH2 ARG B 48 8.551 -2.654 -3.075 1.00 0.00 N ATOM 0 H ARG B 48 2.040 -3.610 -2.818 1.00 0.00 H new ATOM 0 HA ARG B 48 2.649 -5.839 -4.666 1.00 0.00 H new ATOM 0 HB2 ARG B 48 4.570 -4.124 -3.063 1.00 0.00 H new ATOM 0 HB3 ARG B 48 5.013 -5.538 -3.998 1.00 0.00 H new ATOM 0 HG2 ARG B 48 4.005 -4.334 -6.035 1.00 0.00 H new ATOM 0 HG3 ARG B 48 3.946 -2.897 -5.034 1.00 0.00 H new ATOM 0 HD2 ARG B 48 6.408 -4.484 -5.837 1.00 0.00 H new ATOM 0 HD3 ARG B 48 6.004 -2.842 -6.299 1.00 0.00 H new ATOM 0 HE ARG B 48 6.110 -2.615 -3.583 1.00 0.00 H new ATOM 0 HH11 ARG B 48 8.296 -4.107 -5.933 1.00 0.00 H new ATOM 0 HH12 ARG B 48 9.738 -3.789 -4.963 1.00 0.00 H new ATOM 0 HH21 ARG B 48 7.982 -2.205 -2.357 1.00 0.00 H new ATOM 0 HH22 ARG B 48 9.562 -2.722 -2.957 1.00 0.00 H new ATOM 734 N TRP B 49 2.685 -7.467 -2.804 1.00 0.00 N ATOM 735 CA TRP B 49 2.557 -8.435 -1.728 1.00 0.00 C ATOM 736 C TRP B 49 3.323 -9.711 -2.053 1.00 0.00 C ATOM 737 O TRP B 49 3.633 -9.985 -3.213 1.00 0.00 O ATOM 738 CB TRP B 49 1.078 -8.762 -1.473 1.00 0.00 C ATOM 739 CG TRP B 49 0.427 -9.560 -2.569 1.00 0.00 C ATOM 740 CD1 TRP B 49 0.181 -10.902 -2.564 1.00 0.00 C ATOM 741 CD2 TRP B 49 -0.063 -9.068 -3.822 1.00 0.00 C ATOM 742 NE1 TRP B 49 -0.428 -11.275 -3.736 1.00 0.00 N ATOM 743 CE2 TRP B 49 -0.589 -10.166 -4.525 1.00 0.00 C ATOM 744 CE3 TRP B 49 -0.107 -7.807 -4.419 1.00 0.00 C ATOM 745 CZ2 TRP B 49 -1.152 -10.040 -5.791 1.00 0.00 C ATOM 746 CZ3 TRP B 49 -0.668 -7.680 -5.675 1.00 0.00 C ATOM 747 CH2 TRP B 49 -1.185 -8.793 -6.350 1.00 0.00 C ATOM 0 H TRP B 49 2.646 -7.869 -3.741 1.00 0.00 H new ATOM 0 HA TRP B 49 2.983 -7.995 -0.826 1.00 0.00 H new ATOM 0 HB2 TRP B 49 0.996 -9.315 -0.537 1.00 0.00 H new ATOM 0 HB3 TRP B 49 0.528 -7.830 -1.342 1.00 0.00 H new ATOM 0 HD1 TRP B 49 0.429 -11.573 -1.755 1.00 0.00 H new ATOM 0 HE1 TRP B 49 -0.714 -12.223 -3.980 1.00 0.00 H new ATOM 0 HE3 TRP B 49 0.291 -6.944 -3.907 1.00 0.00 H new ATOM 0 HZ2 TRP B 49 -1.549 -10.897 -6.314 1.00 0.00 H new ATOM 0 HZ3 TRP B 49 -0.709 -6.708 -6.144 1.00 0.00 H new ATOM 0 HH2 TRP B 49 -1.618 -8.664 -7.331 1.00 0.00 H new ATOM 758 N ARG B 50 3.634 -10.477 -1.021 1.00 0.00 N ATOM 759 CA ARG B 50 4.278 -11.772 -1.183 1.00 0.00 C ATOM 760 C ARG B 50 4.010 -12.631 0.045 1.00 0.00 C ATOM 761 O ARG B 50 3.904 -12.116 1.160 1.00 0.00 O ATOM 762 CB ARG B 50 5.791 -11.618 -1.393 1.00 0.00 C ATOM 763 CG ARG B 50 6.519 -11.016 -0.219 1.00 0.00 C ATOM 764 CD ARG B 50 8.019 -11.069 -0.428 1.00 0.00 C ATOM 765 NE ARG B 50 8.717 -10.915 0.833 1.00 0.00 N ATOM 766 CZ ARG B 50 9.987 -10.543 0.959 1.00 0.00 C ATOM 767 NH1 ARG B 50 10.730 -10.305 -0.119 1.00 0.00 N ATOM 768 NH2 ARG B 50 10.512 -10.415 2.168 1.00 0.00 N ATOM 0 H ARG B 50 3.449 -10.221 -0.051 1.00 0.00 H new ATOM 0 HA ARG B 50 3.862 -12.254 -2.068 1.00 0.00 H new ATOM 0 HB2 ARG B 50 6.218 -12.597 -1.608 1.00 0.00 H new ATOM 0 HB3 ARG B 50 5.963 -10.996 -2.271 1.00 0.00 H new ATOM 0 HG2 ARG B 50 6.203 -9.982 -0.082 1.00 0.00 H new ATOM 0 HG3 ARG B 50 6.255 -11.553 0.692 1.00 0.00 H new ATOM 0 HD2 ARG B 50 8.294 -12.018 -0.888 1.00 0.00 H new ATOM 0 HD3 ARG B 50 8.323 -10.281 -1.117 1.00 0.00 H new ATOM 0 HE ARG B 50 8.194 -11.106 1.688 1.00 0.00 H new ATOM 0 HH11 ARG B 50 10.326 -10.408 -1.050 1.00 0.00 H new ATOM 0 HH12 ARG B 50 11.704 -10.020 -0.014 1.00 0.00 H new ATOM 0 HH21 ARG B 50 9.943 -10.601 2.994 1.00 0.00 H new ATOM 0 HH22 ARG B 50 11.486 -10.130 2.274 1.00 0.00 H new ATOM 782 N PRO B 51 3.868 -13.949 -0.147 1.00 0.00 N ATOM 783 CA PRO B 51 3.655 -14.882 0.959 1.00 0.00 C ATOM 784 C PRO B 51 4.895 -15.000 1.835 1.00 0.00 C ATOM 785 O PRO B 51 6.019 -14.977 1.342 1.00 0.00 O ATOM 786 CB PRO B 51 3.362 -16.211 0.256 1.00 0.00 C ATOM 787 CG PRO B 51 3.997 -16.085 -1.084 1.00 0.00 C ATOM 788 CD PRO B 51 3.905 -14.632 -1.453 1.00 0.00 C ATOM 0 HA PRO B 51 2.854 -14.562 1.626 1.00 0.00 H new ATOM 0 HB2 PRO B 51 3.777 -17.052 0.812 1.00 0.00 H new ATOM 0 HB3 PRO B 51 2.289 -16.384 0.170 1.00 0.00 H new ATOM 0 HG2 PRO B 51 5.035 -16.415 -1.056 1.00 0.00 H new ATOM 0 HG3 PRO B 51 3.485 -16.707 -1.818 1.00 0.00 H new ATOM 0 HD2 PRO B 51 4.761 -14.314 -2.049 1.00 0.00 H new ATOM 0 HD3 PRO B 51 3.012 -14.423 -2.041 1.00 0.00 H new ATOM 796 N LYS B 52 4.674 -15.130 3.138 1.00 0.00 N ATOM 797 CA LYS B 52 5.758 -15.212 4.114 1.00 0.00 C ATOM 798 C LYS B 52 6.657 -16.416 3.874 1.00 0.00 C ATOM 799 O LYS B 52 7.785 -16.462 4.363 1.00 0.00 O ATOM 800 CB LYS B 52 5.187 -15.278 5.529 1.00 0.00 C ATOM 801 CG LYS B 52 4.814 -13.921 6.110 1.00 0.00 C ATOM 802 CD LYS B 52 6.031 -13.022 6.273 1.00 0.00 C ATOM 803 CE LYS B 52 7.018 -13.566 7.298 1.00 0.00 C ATOM 804 NZ LYS B 52 6.456 -13.564 8.677 1.00 0.00 N ATOM 0 H LYS B 52 3.742 -15.182 3.548 1.00 0.00 H new ATOM 0 HA LYS B 52 6.364 -14.314 3.998 1.00 0.00 H new ATOM 0 HB2 LYS B 52 4.303 -15.915 5.524 1.00 0.00 H new ATOM 0 HB3 LYS B 52 5.918 -15.753 6.183 1.00 0.00 H new ATOM 0 HG2 LYS B 52 4.087 -13.434 5.459 1.00 0.00 H new ATOM 0 HG3 LYS B 52 4.333 -14.060 7.078 1.00 0.00 H new ATOM 0 HD2 LYS B 52 6.532 -12.914 5.311 1.00 0.00 H new ATOM 0 HD3 LYS B 52 5.707 -12.027 6.577 1.00 0.00 H new ATOM 0 HE2 LYS B 52 7.300 -14.583 7.024 1.00 0.00 H new ATOM 0 HE3 LYS B 52 7.928 -12.966 7.278 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 7.207 -13.796 9.358 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 6.071 -12.623 8.894 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 5.697 -14.272 8.744 1.00 0.00 H new ATOM 818 N ASN B 53 6.155 -17.388 3.131 1.00 0.00 N ATOM 819 CA ASN B 53 6.928 -18.580 2.824 1.00 0.00 C ATOM 820 C ASN B 53 7.833 -18.343 1.614 1.00 0.00 C ATOM 821 O ASN B 53 8.620 -19.212 1.240 1.00 0.00 O ATOM 822 CB ASN B 53 6.001 -19.775 2.569 1.00 0.00 C ATOM 823 CG ASN B 53 5.195 -19.636 1.292 1.00 0.00 C ATOM 824 OD1 ASN B 53 4.068 -19.142 1.295 1.00 0.00 O ATOM 825 ND2 ASN B 53 5.779 -20.058 0.189 1.00 0.00 N ATOM 0 H ASN B 53 5.217 -17.376 2.730 1.00 0.00 H new ATOM 0 HA ASN B 53 7.557 -18.806 3.685 1.00 0.00 H new ATOM 0 HB2 ASN B 53 6.597 -20.686 2.519 1.00 0.00 H new ATOM 0 HB3 ASN B 53 5.319 -19.886 3.412 1.00 0.00 H new ATOM 0 HD21 ASN B 53 5.295 -19.981 -0.706 1.00 0.00 H new ATOM 0 HD22 ASN B 53 6.715 -20.462 0.230 1.00 0.00 H new ATOM 832 N SER B 54 7.711 -17.173 0.999 1.00 0.00 N ATOM 833 CA SER B 54 8.548 -16.815 -0.136 1.00 0.00 C ATOM 834 C SER B 54 9.183 -15.444 0.073 1.00 0.00 C ATOM 835 O SER B 54 8.488 -14.439 0.217 1.00 0.00 O ATOM 836 CB SER B 54 7.732 -16.803 -1.426 1.00 0.00 C ATOM 837 OG SER B 54 7.032 -18.024 -1.606 1.00 0.00 O ATOM 0 H SER B 54 7.038 -16.455 1.269 1.00 0.00 H new ATOM 0 HA SER B 54 9.335 -17.565 -0.218 1.00 0.00 H new ATOM 0 HB2 SER B 54 7.023 -15.975 -1.402 1.00 0.00 H new ATOM 0 HB3 SER B 54 8.393 -16.632 -2.275 1.00 0.00 H new ATOM 0 HG SER B 54 6.517 -17.986 -2.439 1.00 0.00 H new ATOM 843 N VAL B 55 10.502 -15.405 0.080 1.00 0.00 N ATOM 844 CA VAL B 55 11.231 -14.167 0.256 1.00 0.00 C ATOM 845 C VAL B 55 11.679 -13.627 -1.108 1.00 0.00 C ATOM 846 O VAL B 55 12.585 -12.797 -1.217 1.00 0.00 O ATOM 847 CB VAL B 55 12.445 -14.395 1.187 1.00 0.00 C ATOM 848 CG1 VAL B 55 13.536 -15.202 0.494 1.00 0.00 C ATOM 849 CG2 VAL B 55 12.982 -13.076 1.706 1.00 0.00 C ATOM 0 H VAL B 55 11.094 -16.227 -0.036 1.00 0.00 H new ATOM 0 HA VAL B 55 10.579 -13.427 0.721 1.00 0.00 H new ATOM 0 HB VAL B 55 12.103 -14.979 2.042 1.00 0.00 H new ATOM 0 HG11 VAL B 55 14.374 -15.343 1.177 1.00 0.00 H new ATOM 0 HG12 VAL B 55 13.139 -16.174 0.201 1.00 0.00 H new ATOM 0 HG13 VAL B 55 13.877 -14.667 -0.392 1.00 0.00 H new ATOM 0 HG21 VAL B 55 13.835 -13.262 2.358 1.00 0.00 H new ATOM 0 HG22 VAL B 55 13.295 -12.455 0.867 1.00 0.00 H new ATOM 0 HG23 VAL B 55 12.202 -12.561 2.267 1.00 0.00 H new ATOM 859 N GLY B 56 11.013 -14.100 -2.153 1.00 0.00 N ATOM 860 CA GLY B 56 11.388 -13.738 -3.502 1.00 0.00 C ATOM 861 C GLY B 56 10.705 -12.478 -3.997 1.00 0.00 C ATOM 862 O GLY B 56 10.741 -11.438 -3.333 1.00 0.00 O ATOM 0 H GLY B 56 10.215 -14.732 -2.087 1.00 0.00 H new ATOM 0 HA2 GLY B 56 12.468 -13.599 -3.546 1.00 0.00 H new ATOM 0 HA3 GLY B 56 11.145 -14.562 -4.173 1.00 0.00 H new ATOM 866 N ARG B 57 10.079 -12.581 -5.160 1.00 0.00 N ATOM 867 CA ARG B 57 9.501 -11.425 -5.835 1.00 0.00 C ATOM 868 C ARG B 57 8.219 -10.954 -5.169 1.00 0.00 C ATOM 869 O ARG B 57 7.474 -11.742 -4.581 1.00 0.00 O ATOM 870 CB ARG B 57 9.204 -11.755 -7.297 1.00 0.00 C ATOM 871 CG ARG B 57 10.442 -12.002 -8.136 1.00 0.00 C ATOM 872 CD ARG B 57 10.074 -12.302 -9.577 1.00 0.00 C ATOM 873 NE ARG B 57 11.253 -12.517 -10.411 1.00 0.00 N ATOM 874 CZ ARG B 57 11.203 -12.839 -11.702 1.00 0.00 C ATOM 875 NH1 ARG B 57 10.032 -13.005 -12.306 1.00 0.00 N ATOM 876 NH2 ARG B 57 12.328 -13.004 -12.384 1.00 0.00 N ATOM 0 H ARG B 57 9.957 -13.461 -5.661 1.00 0.00 H new ATOM 0 HA ARG B 57 10.237 -10.623 -5.771 1.00 0.00 H new ATOM 0 HB2 ARG B 57 8.568 -12.639 -7.337 1.00 0.00 H new ATOM 0 HB3 ARG B 57 8.637 -10.934 -7.736 1.00 0.00 H new ATOM 0 HG2 ARG B 57 11.091 -11.127 -8.098 1.00 0.00 H new ATOM 0 HG3 ARG B 57 11.006 -12.837 -7.720 1.00 0.00 H new ATOM 0 HD2 ARG B 57 9.439 -13.187 -9.612 1.00 0.00 H new ATOM 0 HD3 ARG B 57 9.490 -11.475 -9.981 1.00 0.00 H new ATOM 0 HE ARG B 57 12.171 -12.414 -9.978 1.00 0.00 H new ATOM 0 HH11 ARG B 57 9.166 -12.886 -11.781 1.00 0.00 H new ATOM 0 HH12 ARG B 57 9.999 -13.252 -13.295 1.00 0.00 H new ATOM 0 HH21 ARG B 57 13.228 -12.884 -11.920 1.00 0.00 H new ATOM 0 HH22 ARG B 57 12.293 -13.251 -13.373 1.00 0.00 H new ATOM 890 N TRP B 58 7.979 -9.657 -5.269 1.00 0.00 N ATOM 891 CA TRP B 58 6.732 -9.065 -4.823 1.00 0.00 C ATOM 892 C TRP B 58 5.753 -9.020 -5.983 1.00 0.00 C ATOM 893 O TRP B 58 6.107 -8.590 -7.080 1.00 0.00 O ATOM 894 CB TRP B 58 6.962 -7.647 -4.298 1.00 0.00 C ATOM 895 CG TRP B 58 7.821 -7.581 -3.073 1.00 0.00 C ATOM 896 CD1 TRP B 58 9.184 -7.537 -3.026 1.00 0.00 C ATOM 897 CD2 TRP B 58 7.369 -7.542 -1.717 1.00 0.00 C ATOM 898 NE1 TRP B 58 9.608 -7.478 -1.721 1.00 0.00 N ATOM 899 CE2 TRP B 58 8.511 -7.479 -0.899 1.00 0.00 C ATOM 900 CE3 TRP B 58 6.108 -7.555 -1.115 1.00 0.00 C ATOM 901 CZ2 TRP B 58 8.429 -7.430 0.490 1.00 0.00 C ATOM 902 CZ3 TRP B 58 6.029 -7.507 0.262 1.00 0.00 C ATOM 903 CH2 TRP B 58 7.185 -7.445 1.051 1.00 0.00 C ATOM 0 H TRP B 58 8.642 -8.988 -5.661 1.00 0.00 H new ATOM 0 HA TRP B 58 6.327 -9.674 -4.015 1.00 0.00 H new ATOM 0 HB2 TRP B 58 7.423 -7.050 -5.085 1.00 0.00 H new ATOM 0 HB3 TRP B 58 5.997 -7.192 -4.077 1.00 0.00 H new ATOM 0 HD1 TRP B 58 9.834 -7.547 -3.888 1.00 0.00 H new ATOM 0 HE1 TRP B 58 10.580 -7.440 -1.414 1.00 0.00 H new ATOM 0 HE3 TRP B 58 5.212 -7.602 -1.716 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 9.318 -7.382 1.102 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 5.060 -7.517 0.739 1.00 0.00 H new ATOM 0 HH2 TRP B 58 7.090 -7.408 2.126 1.00 0.00 H new ATOM 914 N LYS B 59 4.533 -9.472 -5.752 1.00 0.00 N ATOM 915 CA LYS B 59 3.504 -9.416 -6.775 1.00 0.00 C ATOM 916 C LYS B 59 2.975 -7.994 -6.867 1.00 0.00 C ATOM 917 O LYS B 59 2.714 -7.365 -5.844 1.00 0.00 O ATOM 918 CB LYS B 59 2.371 -10.391 -6.457 1.00 0.00 C ATOM 919 CG LYS B 59 2.852 -11.804 -6.182 1.00 0.00 C ATOM 920 CD LYS B 59 1.689 -12.767 -6.044 1.00 0.00 C ATOM 921 CE LYS B 59 2.160 -14.163 -5.679 1.00 0.00 C ATOM 922 NZ LYS B 59 3.174 -14.685 -6.635 1.00 0.00 N ATOM 0 H LYS B 59 4.231 -9.881 -4.868 1.00 0.00 H new ATOM 0 HA LYS B 59 3.933 -9.707 -7.734 1.00 0.00 H new ATOM 0 HB2 LYS B 59 1.821 -10.027 -5.589 1.00 0.00 H new ATOM 0 HB3 LYS B 59 1.672 -10.409 -7.293 1.00 0.00 H new ATOM 0 HG2 LYS B 59 3.504 -12.132 -6.992 1.00 0.00 H new ATOM 0 HG3 LYS B 59 3.447 -11.816 -5.269 1.00 0.00 H new ATOM 0 HD2 LYS B 59 1.003 -12.402 -5.280 1.00 0.00 H new ATOM 0 HD3 LYS B 59 1.133 -12.803 -6.981 1.00 0.00 H new ATOM 0 HE2 LYS B 59 2.584 -14.150 -4.675 1.00 0.00 H new ATOM 0 HE3 LYS B 59 1.305 -14.838 -5.656 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 3.328 -15.698 -6.459 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 2.835 -14.550 -7.609 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 4.069 -14.172 -6.506 1.00 0.00 H new ATOM 936 N GLU B 60 2.826 -7.489 -8.080 1.00 0.00 N ATOM 937 CA GLU B 60 2.515 -6.083 -8.275 1.00 0.00 C ATOM 938 C GLU B 60 1.133 -5.886 -8.883 1.00 0.00 C ATOM 939 O GLU B 60 0.720 -6.625 -9.781 1.00 0.00 O ATOM 940 CB GLU B 60 3.571 -5.443 -9.176 1.00 0.00 C ATOM 941 CG GLU B 60 4.985 -5.599 -8.645 1.00 0.00 C ATOM 942 CD GLU B 60 6.027 -5.063 -9.596 1.00 0.00 C ATOM 943 OE1 GLU B 60 6.509 -5.828 -10.453 1.00 0.00 O ATOM 944 OE2 GLU B 60 6.383 -3.873 -9.490 1.00 0.00 O ATOM 0 H GLU B 60 2.915 -8.029 -8.941 1.00 0.00 H new ATOM 0 HA GLU B 60 2.518 -5.603 -7.297 1.00 0.00 H new ATOM 0 HB2 GLU B 60 3.511 -5.890 -10.169 1.00 0.00 H new ATOM 0 HB3 GLU B 60 3.348 -4.382 -9.290 1.00 0.00 H new ATOM 0 HG2 GLU B 60 5.069 -5.080 -7.690 1.00 0.00 H new ATOM 0 HG3 GLU B 60 5.182 -6.654 -8.453 1.00 0.00 H new ATOM 951 N ALA B 61 0.423 -4.890 -8.375 1.00 0.00 N ATOM 952 CA ALA B 61 -0.865 -4.494 -8.917 1.00 0.00 C ATOM 953 C ALA B 61 -0.984 -2.975 -8.926 1.00 0.00 C ATOM 954 O ALA B 61 -0.576 -2.314 -7.971 1.00 0.00 O ATOM 955 CB ALA B 61 -1.994 -5.109 -8.105 1.00 0.00 C ATOM 0 H ALA B 61 0.725 -4.334 -7.575 1.00 0.00 H new ATOM 0 HA ALA B 61 -0.940 -4.858 -9.942 1.00 0.00 H new ATOM 0 HB1 ALA B 61 -2.952 -4.803 -8.524 1.00 0.00 H new ATOM 0 HB2 ALA B 61 -1.915 -6.196 -8.137 1.00 0.00 H new ATOM 0 HB3 ALA B 61 -1.925 -4.770 -7.071 1.00 0.00 H new ATOM 961 N THR B 62 -1.530 -2.426 -10.001 1.00 0.00 N ATOM 962 CA THR B 62 -1.687 -0.984 -10.122 1.00 0.00 C ATOM 963 C THR B 62 -3.161 -0.592 -10.052 1.00 0.00 C ATOM 964 O THR B 62 -3.964 -0.987 -10.902 1.00 0.00 O ATOM 965 CB THR B 62 -1.078 -0.470 -11.438 1.00 0.00 C ATOM 966 OG1 THR B 62 0.285 -0.899 -11.535 1.00 0.00 O ATOM 967 CG2 THR B 62 -1.140 1.048 -11.513 1.00 0.00 C ATOM 0 H THR B 62 -1.872 -2.957 -10.802 1.00 0.00 H new ATOM 0 HA THR B 62 -1.157 -0.525 -9.288 1.00 0.00 H new ATOM 0 HB THR B 62 -1.656 -0.879 -12.267 1.00 0.00 H new ATOM 0 HG1 THR B 62 0.672 -0.573 -12.374 1.00 0.00 H new ATOM 0 HG21 THR B 62 -0.703 1.384 -12.453 1.00 0.00 H new ATOM 0 HG22 THR B 62 -2.179 1.373 -11.459 1.00 0.00 H new ATOM 0 HG23 THR B 62 -0.583 1.477 -10.680 1.00 0.00 H new ATOM 975 N ILE B 63 -3.508 0.173 -9.032 1.00 0.00 N ATOM 976 CA ILE B 63 -4.882 0.597 -8.820 1.00 0.00 C ATOM 977 C ILE B 63 -5.008 2.103 -9.036 1.00 0.00 C ATOM 978 O ILE B 63 -4.189 2.871 -8.532 1.00 0.00 O ATOM 979 CB ILE B 63 -5.370 0.255 -7.388 1.00 0.00 C ATOM 980 CG1 ILE B 63 -5.152 -1.226 -7.062 1.00 0.00 C ATOM 981 CG2 ILE B 63 -6.839 0.611 -7.226 1.00 0.00 C ATOM 982 CD1 ILE B 63 -3.790 -1.537 -6.474 1.00 0.00 C ATOM 0 H ILE B 63 -2.851 0.516 -8.331 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.502 0.061 -9.539 1.00 0.00 H new ATOM 0 HB ILE B 63 -4.780 0.848 -6.689 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -5.921 -1.549 -6.360 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -5.285 -1.811 -7.972 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -7.164 0.364 -6.215 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -6.976 1.678 -7.401 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -7.432 0.046 -7.946 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -3.716 -2.606 -6.272 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -3.013 -1.247 -7.182 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -3.659 -0.982 -5.545 1.00 0.00 H new ATOM 994 N PRO B 64 -6.014 2.542 -9.813 1.00 0.00 N ATOM 995 CA PRO B 64 -6.311 3.968 -9.993 1.00 0.00 C ATOM 996 C PRO B 64 -6.472 4.685 -8.655 1.00 0.00 C ATOM 997 O PRO B 64 -7.108 4.162 -7.736 1.00 0.00 O ATOM 998 CB PRO B 64 -7.642 3.963 -10.756 1.00 0.00 C ATOM 999 CG PRO B 64 -7.666 2.657 -11.469 1.00 0.00 C ATOM 1000 CD PRO B 64 -6.925 1.684 -10.593 1.00 0.00 C ATOM 0 HA PRO B 64 -5.510 4.493 -10.514 1.00 0.00 H new ATOM 0 HB2 PRO B 64 -8.488 4.058 -10.076 1.00 0.00 H new ATOM 0 HB3 PRO B 64 -7.700 4.797 -11.456 1.00 0.00 H new ATOM 0 HG2 PRO B 64 -8.690 2.325 -11.639 1.00 0.00 H new ATOM 0 HG3 PRO B 64 -7.192 2.739 -12.447 1.00 0.00 H new ATOM 0 HD2 PRO B 64 -7.605 1.129 -9.946 1.00 0.00 H new ATOM 0 HD3 PRO B 64 -6.377 0.950 -11.184 1.00 0.00 H new ATOM 1008 N GLY B 65 -5.908 5.888 -8.563 1.00 0.00 N ATOM 1009 CA GLY B 65 -5.930 6.650 -7.321 1.00 0.00 C ATOM 1010 C GLY B 65 -7.331 7.033 -6.881 1.00 0.00 C ATOM 1011 O GLY B 65 -7.537 7.489 -5.757 1.00 0.00 O ATOM 0 H GLY B 65 -5.431 6.354 -9.335 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -5.456 6.064 -6.534 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -5.335 7.555 -7.446 1.00 0.00 H new ATOM 1015 N HIS B 66 -8.287 6.858 -7.779 1.00 0.00 N ATOM 1016 CA HIS B 66 -9.689 7.104 -7.479 1.00 0.00 C ATOM 1017 C HIS B 66 -10.272 5.980 -6.615 1.00 0.00 C ATOM 1018 O HIS B 66 -11.236 6.191 -5.878 1.00 0.00 O ATOM 1019 CB HIS B 66 -10.470 7.257 -8.796 1.00 0.00 C ATOM 1020 CG HIS B 66 -11.953 7.052 -8.680 1.00 0.00 C ATOM 1021 ND1 HIS B 66 -12.819 7.987 -8.151 1.00 0.00 N ATOM 1022 CD2 HIS B 66 -12.716 5.994 -9.032 1.00 0.00 C ATOM 1023 CE1 HIS B 66 -14.050 7.507 -8.183 1.00 0.00 C ATOM 1024 NE2 HIS B 66 -14.015 6.298 -8.713 1.00 0.00 N ATOM 0 H HIS B 66 -8.114 6.542 -8.733 1.00 0.00 H new ATOM 0 HA HIS B 66 -9.776 8.027 -6.906 1.00 0.00 H new ATOM 0 HB2 HIS B 66 -10.286 8.254 -9.197 1.00 0.00 H new ATOM 0 HB3 HIS B 66 -10.075 6.545 -9.520 1.00 0.00 H new ATOM 0 HD2 HIS B 66 -12.367 5.077 -9.482 1.00 0.00 H new ATOM 0 HE1 HIS B 66 -14.936 8.018 -7.834 1.00 0.00 H new ATOM 0 HE2 HIS B 66 -14.821 5.690 -8.861 1.00 0.00 H new ATOM 1033 N LEU B 67 -9.679 4.796 -6.691 1.00 0.00 N ATOM 1034 CA LEU B 67 -10.183 3.652 -5.941 1.00 0.00 C ATOM 1035 C LEU B 67 -9.563 3.610 -4.552 1.00 0.00 C ATOM 1036 O LEU B 67 -8.476 4.147 -4.329 1.00 0.00 O ATOM 1037 CB LEU B 67 -9.901 2.338 -6.678 1.00 0.00 C ATOM 1038 CG LEU B 67 -10.451 2.245 -8.106 1.00 0.00 C ATOM 1039 CD1 LEU B 67 -10.232 0.852 -8.672 1.00 0.00 C ATOM 1040 CD2 LEU B 67 -11.926 2.608 -8.146 1.00 0.00 C ATOM 0 H LEU B 67 -8.855 4.603 -7.260 1.00 0.00 H new ATOM 0 HA LEU B 67 -11.263 3.767 -5.846 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -8.822 2.187 -6.713 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -10.319 1.518 -6.093 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.909 2.961 -8.724 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -10.629 0.805 -9.686 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -9.165 0.630 -8.689 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -10.745 0.121 -8.047 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -12.291 2.534 -9.170 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -12.487 1.923 -7.510 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -12.060 3.628 -7.786 1.00 0.00 H new ATOM 1052 N ASN B 68 -10.266 2.983 -3.620 1.00 0.00 N ATOM 1053 CA ASN B 68 -9.797 2.873 -2.244 1.00 0.00 C ATOM 1054 C ASN B 68 -9.816 1.429 -1.772 1.00 0.00 C ATOM 1055 O ASN B 68 -9.647 1.153 -0.583 1.00 0.00 O ATOM 1056 CB ASN B 68 -10.654 3.727 -1.307 1.00 0.00 C ATOM 1057 CG ASN B 68 -10.365 5.207 -1.435 1.00 0.00 C ATOM 1058 OD1 ASN B 68 -10.989 5.909 -2.234 1.00 0.00 O ATOM 1059 ND2 ASN B 68 -9.417 5.693 -0.647 1.00 0.00 N ATOM 0 H ASN B 68 -11.169 2.540 -3.792 1.00 0.00 H new ATOM 0 HA ASN B 68 -8.770 3.237 -2.220 1.00 0.00 H new ATOM 0 HB2 ASN B 68 -11.708 3.547 -1.521 1.00 0.00 H new ATOM 0 HB3 ASN B 68 -10.480 3.415 -0.277 1.00 0.00 H new ATOM 0 HD21 ASN B 68 -9.179 6.684 -0.687 1.00 0.00 H new ATOM 0 HD22 ASN B 68 -8.926 5.076 -0.000 1.00 0.00 H new ATOM 1066 N SER B 69 -10.013 0.505 -2.700 1.00 0.00 N ATOM 1067 CA SER B 69 -10.089 -0.903 -2.355 1.00 0.00 C ATOM 1068 C SER B 69 -9.670 -1.774 -3.528 1.00 0.00 C ATOM 1069 O SER B 69 -10.086 -1.541 -4.663 1.00 0.00 O ATOM 1070 CB SER B 69 -11.511 -1.255 -1.919 1.00 0.00 C ATOM 1071 OG SER B 69 -12.452 -0.912 -2.926 1.00 0.00 O ATOM 0 H SER B 69 -10.123 0.705 -3.694 1.00 0.00 H new ATOM 0 HA SER B 69 -9.403 -1.093 -1.530 1.00 0.00 H new ATOM 0 HB2 SER B 69 -11.576 -2.322 -1.704 1.00 0.00 H new ATOM 0 HB3 SER B 69 -11.753 -0.729 -0.996 1.00 0.00 H new ATOM 0 HG SER B 69 -13.354 -1.148 -2.625 1.00 0.00 H new ATOM 1077 N TYR B 70 -8.845 -2.768 -3.249 1.00 0.00 N ATOM 1078 CA TYR B 70 -8.421 -3.719 -4.260 1.00 0.00 C ATOM 1079 C TYR B 70 -8.734 -5.134 -3.799 1.00 0.00 C ATOM 1080 O TYR B 70 -8.575 -5.461 -2.624 1.00 0.00 O ATOM 1081 CB TYR B 70 -6.922 -3.566 -4.538 1.00 0.00 C ATOM 1082 CG TYR B 70 -6.387 -4.520 -5.583 1.00 0.00 C ATOM 1083 CD1 TYR B 70 -5.502 -5.533 -5.237 1.00 0.00 C ATOM 1084 CD2 TYR B 70 -6.767 -4.408 -6.914 1.00 0.00 C ATOM 1085 CE1 TYR B 70 -5.012 -6.410 -6.186 1.00 0.00 C ATOM 1086 CE2 TYR B 70 -6.281 -5.279 -7.869 1.00 0.00 C ATOM 1087 CZ TYR B 70 -5.405 -6.277 -7.500 1.00 0.00 C ATOM 1088 OH TYR B 70 -4.919 -7.150 -8.449 1.00 0.00 O ATOM 0 H TYR B 70 -8.453 -2.938 -2.323 1.00 0.00 H new ATOM 0 HA TYR B 70 -8.964 -3.521 -5.184 1.00 0.00 H new ATOM 0 HB2 TYR B 70 -6.726 -2.543 -4.861 1.00 0.00 H new ATOM 0 HB3 TYR B 70 -6.374 -3.718 -3.608 1.00 0.00 H new ATOM 0 HD1 TYR B 70 -5.191 -5.637 -4.208 1.00 0.00 H new ATOM 0 HD2 TYR B 70 -7.453 -3.627 -7.207 1.00 0.00 H new ATOM 0 HE1 TYR B 70 -4.326 -7.194 -5.900 1.00 0.00 H new ATOM 0 HE2 TYR B 70 -6.586 -5.179 -8.900 1.00 0.00 H new ATOM 0 HH TYR B 70 -5.293 -6.922 -9.325 1.00 0.00 H new ATOM 1098 N THR B 71 -9.201 -5.964 -4.712 1.00 0.00 N ATOM 1099 CA THR B 71 -9.476 -7.349 -4.393 1.00 0.00 C ATOM 1100 C THR B 71 -8.339 -8.232 -4.889 1.00 0.00 C ATOM 1101 O THR B 71 -8.281 -8.580 -6.073 1.00 0.00 O ATOM 1102 CB THR B 71 -10.808 -7.804 -5.018 1.00 0.00 C ATOM 1103 OG1 THR B 71 -11.829 -6.843 -4.716 1.00 0.00 O ATOM 1104 CG2 THR B 71 -11.224 -9.171 -4.493 1.00 0.00 C ATOM 0 H THR B 71 -9.397 -5.703 -5.678 1.00 0.00 H new ATOM 0 HA THR B 71 -9.558 -7.442 -3.310 1.00 0.00 H new ATOM 0 HB THR B 71 -10.673 -7.880 -6.097 1.00 0.00 H new ATOM 0 HG1 THR B 71 -12.677 -7.130 -5.115 1.00 0.00 H new ATOM 0 HG21 THR B 71 -12.168 -9.465 -4.952 1.00 0.00 H new ATOM 0 HG22 THR B 71 -10.456 -9.904 -4.739 1.00 0.00 H new ATOM 0 HG23 THR B 71 -11.346 -9.123 -3.411 1.00 0.00 H new ATOM 1112 N ILE B 72 -7.433 -8.578 -3.983 1.00 0.00 N ATOM 1113 CA ILE B 72 -6.290 -9.410 -4.325 1.00 0.00 C ATOM 1114 C ILE B 72 -6.754 -10.831 -4.601 1.00 0.00 C ATOM 1115 O ILE B 72 -7.492 -11.409 -3.804 1.00 0.00 O ATOM 1116 CB ILE B 72 -5.233 -9.435 -3.199 1.00 0.00 C ATOM 1117 CG1 ILE B 72 -4.808 -8.013 -2.819 1.00 0.00 C ATOM 1118 CG2 ILE B 72 -4.025 -10.251 -3.631 1.00 0.00 C ATOM 1119 CD1 ILE B 72 -3.786 -7.966 -1.703 1.00 0.00 C ATOM 0 H ILE B 72 -7.469 -8.294 -3.004 1.00 0.00 H new ATOM 0 HA ILE B 72 -5.828 -8.980 -5.214 1.00 0.00 H new ATOM 0 HB ILE B 72 -5.678 -9.903 -2.321 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -4.397 -7.518 -3.699 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -5.690 -7.447 -2.518 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -3.287 -10.261 -2.829 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -4.336 -11.272 -3.851 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -3.585 -9.805 -4.523 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -3.531 -6.929 -1.486 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -4.201 -8.432 -0.809 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -2.888 -8.504 -2.009 1.00 0.00 H new ATOM 1131 N LYS B 73 -6.337 -11.381 -5.728 1.00 0.00 N ATOM 1132 CA LYS B 73 -6.773 -12.707 -6.134 1.00 0.00 C ATOM 1133 C LYS B 73 -5.573 -13.620 -6.333 1.00 0.00 C ATOM 1134 O LYS B 73 -4.536 -13.192 -6.845 1.00 0.00 O ATOM 1135 CB LYS B 73 -7.589 -12.610 -7.426 1.00 0.00 C ATOM 1136 CG LYS B 73 -8.696 -11.569 -7.360 1.00 0.00 C ATOM 1137 CD LYS B 73 -9.434 -11.439 -8.682 1.00 0.00 C ATOM 1138 CE LYS B 73 -10.404 -10.267 -8.667 1.00 0.00 C ATOM 1139 NZ LYS B 73 -9.696 -8.962 -8.547 1.00 0.00 N ATOM 0 H LYS B 73 -5.696 -10.929 -6.380 1.00 0.00 H new ATOM 0 HA LYS B 73 -7.400 -13.130 -5.350 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -6.921 -12.368 -8.253 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -8.027 -13.584 -7.645 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -9.402 -11.840 -6.575 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -8.270 -10.604 -7.086 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -8.714 -11.307 -9.490 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -9.978 -12.361 -8.888 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -10.998 -10.275 -9.581 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -11.099 -10.381 -7.835 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -10.365 -8.186 -8.726 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -9.304 -8.867 -7.588 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -8.924 -8.921 -9.242 1.00 0.00 H new ATOM 1153 N GLY B 74 -5.706 -14.869 -5.916 1.00 0.00 N ATOM 1154 CA GLY B 74 -4.623 -15.819 -6.073 1.00 0.00 C ATOM 1155 C GLY B 74 -3.845 -16.029 -4.790 1.00 0.00 C ATOM 1156 O GLY B 74 -2.732 -16.561 -4.809 1.00 0.00 O ATOM 0 H GLY B 74 -6.544 -15.243 -5.471 1.00 0.00 H new ATOM 0 HA2 GLY B 74 -5.027 -16.774 -6.409 1.00 0.00 H new ATOM 0 HA3 GLY B 74 -3.946 -15.468 -6.851 1.00 0.00 H new ATOM 1160 N LEU B 75 -4.426 -15.609 -3.675 1.00 0.00 N ATOM 1161 CA LEU B 75 -3.803 -15.794 -2.371 1.00 0.00 C ATOM 1162 C LEU B 75 -3.961 -17.246 -1.922 1.00 0.00 C ATOM 1163 O LEU B 75 -4.699 -18.012 -2.535 1.00 0.00 O ATOM 1164 CB LEU B 75 -4.423 -14.841 -1.339 1.00 0.00 C ATOM 1165 CG LEU B 75 -4.157 -13.344 -1.564 1.00 0.00 C ATOM 1166 CD1 LEU B 75 -4.832 -12.518 -0.486 1.00 0.00 C ATOM 1167 CD2 LEU B 75 -2.666 -13.060 -1.587 1.00 0.00 C ATOM 0 H LEU B 75 -5.330 -15.137 -3.647 1.00 0.00 H new ATOM 0 HA LEU B 75 -2.741 -15.564 -2.452 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -5.501 -15.001 -1.327 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -4.049 -15.112 -0.352 1.00 0.00 H new ATOM 0 HG LEU B 75 -4.575 -13.066 -2.531 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -4.634 -11.460 -0.660 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -5.907 -12.695 -0.512 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -4.441 -12.804 0.490 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -2.501 -11.995 -1.747 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -2.224 -13.356 -0.636 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -2.200 -13.625 -2.395 1.00 0.00 H new ATOM 1179 N LYS B 76 -3.248 -17.627 -0.876 1.00 0.00 N ATOM 1180 CA LYS B 76 -3.291 -18.992 -0.372 1.00 0.00 C ATOM 1181 C LYS B 76 -3.848 -19.022 1.047 1.00 0.00 C ATOM 1182 O LYS B 76 -3.392 -18.272 1.914 1.00 0.00 O ATOM 1183 CB LYS B 76 -1.888 -19.609 -0.394 1.00 0.00 C ATOM 1184 CG LYS B 76 -1.257 -19.648 -1.778 1.00 0.00 C ATOM 1185 CD LYS B 76 0.117 -20.303 -1.757 1.00 0.00 C ATOM 1186 CE LYS B 76 1.113 -19.515 -0.919 1.00 0.00 C ATOM 1187 NZ LYS B 76 2.443 -20.174 -0.874 1.00 0.00 N ATOM 0 H LYS B 76 -2.628 -17.007 -0.355 1.00 0.00 H new ATOM 0 HA LYS B 76 -3.947 -19.576 -1.018 1.00 0.00 H new ATOM 0 HB2 LYS B 76 -1.241 -19.041 0.274 1.00 0.00 H new ATOM 0 HB3 LYS B 76 -1.941 -20.624 -0.000 1.00 0.00 H new ATOM 0 HG2 LYS B 76 -1.909 -20.194 -2.459 1.00 0.00 H new ATOM 0 HG3 LYS B 76 -1.170 -18.633 -2.166 1.00 0.00 H new ATOM 0 HD2 LYS B 76 0.030 -21.315 -1.360 1.00 0.00 H new ATOM 0 HD3 LYS B 76 0.492 -20.392 -2.777 1.00 0.00 H new ATOM 0 HE2 LYS B 76 1.219 -18.511 -1.330 1.00 0.00 H new ATOM 0 HE3 LYS B 76 0.728 -19.405 0.095 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 2.991 -19.796 -0.075 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 2.318 -21.200 -0.754 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 2.952 -19.989 -1.762 1.00 0.00 H new ATOM 1201 N PRO B 77 -4.851 -19.878 1.303 1.00 0.00 N ATOM 1202 CA PRO B 77 -5.447 -20.021 2.633 1.00 0.00 C ATOM 1203 C PRO B 77 -4.463 -20.608 3.639 1.00 0.00 C ATOM 1204 O PRO B 77 -3.795 -21.610 3.360 1.00 0.00 O ATOM 1205 CB PRO B 77 -6.621 -20.988 2.420 1.00 0.00 C ATOM 1206 CG PRO B 77 -6.826 -21.052 0.945 1.00 0.00 C ATOM 1207 CD PRO B 77 -5.493 -20.763 0.321 1.00 0.00 C ATOM 0 HA PRO B 77 -5.750 -19.056 3.040 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -6.396 -21.974 2.827 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -7.519 -20.632 2.925 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -7.190 -22.035 0.646 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -7.571 -20.324 0.624 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -4.916 -21.674 0.162 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -5.599 -20.279 -0.650 1.00 0.00 H new ATOM 1215 N GLY B 78 -4.365 -19.972 4.799 1.00 0.00 N ATOM 1216 CA GLY B 78 -3.500 -20.466 5.851 1.00 0.00 C ATOM 1217 C GLY B 78 -2.098 -19.904 5.762 1.00 0.00 C ATOM 1218 O GLY B 78 -1.220 -20.281 6.537 1.00 0.00 O ATOM 0 H GLY B 78 -4.873 -19.118 5.030 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -3.929 -20.210 6.820 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -3.456 -21.554 5.799 1.00 0.00 H new ATOM 1222 N VAL B 79 -1.888 -18.997 4.819 1.00 0.00 N ATOM 1223 CA VAL B 79 -0.573 -18.415 4.597 1.00 0.00 C ATOM 1224 C VAL B 79 -0.575 -16.926 4.928 1.00 0.00 C ATOM 1225 O VAL B 79 -1.510 -16.200 4.579 1.00 0.00 O ATOM 1226 CB VAL B 79 -0.115 -18.630 3.137 1.00 0.00 C ATOM 1227 CG1 VAL B 79 1.256 -18.030 2.887 1.00 0.00 C ATOM 1228 CG2 VAL B 79 -0.097 -20.108 2.802 1.00 0.00 C ATOM 0 H VAL B 79 -2.614 -18.648 4.194 1.00 0.00 H new ATOM 0 HA VAL B 79 0.129 -18.919 5.261 1.00 0.00 H new ATOM 0 HB VAL B 79 -0.830 -18.121 2.491 1.00 0.00 H new ATOM 0 HG11 VAL B 79 1.544 -18.201 1.850 1.00 0.00 H new ATOM 0 HG12 VAL B 79 1.225 -16.958 3.083 1.00 0.00 H new ATOM 0 HG13 VAL B 79 1.985 -18.499 3.548 1.00 0.00 H new ATOM 0 HG21 VAL B 79 0.228 -20.243 1.770 1.00 0.00 H new ATOM 0 HG22 VAL B 79 0.593 -20.624 3.470 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -1.098 -20.521 2.924 1.00 0.00 H new ATOM 1238 N VAL B 80 0.460 -16.484 5.629 1.00 0.00 N ATOM 1239 CA VAL B 80 0.613 -15.082 5.982 1.00 0.00 C ATOM 1240 C VAL B 80 1.321 -14.343 4.852 1.00 0.00 C ATOM 1241 O VAL B 80 2.176 -14.914 4.172 1.00 0.00 O ATOM 1242 CB VAL B 80 1.410 -14.919 7.296 1.00 0.00 C ATOM 1243 CG1 VAL B 80 1.488 -13.458 7.714 1.00 0.00 C ATOM 1244 CG2 VAL B 80 0.788 -15.759 8.402 1.00 0.00 C ATOM 0 H VAL B 80 1.212 -17.084 5.967 1.00 0.00 H new ATOM 0 HA VAL B 80 -0.379 -14.658 6.134 1.00 0.00 H new ATOM 0 HB VAL B 80 2.426 -15.271 7.120 1.00 0.00 H new ATOM 0 HG11 VAL B 80 2.054 -13.375 8.641 1.00 0.00 H new ATOM 0 HG12 VAL B 80 1.984 -12.882 6.933 1.00 0.00 H new ATOM 0 HG13 VAL B 80 0.481 -13.069 7.868 1.00 0.00 H new ATOM 0 HG21 VAL B 80 1.361 -15.633 9.321 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -0.240 -15.437 8.569 1.00 0.00 H new ATOM 0 HG23 VAL B 80 0.797 -16.809 8.110 1.00 0.00 H new ATOM 1254 N TYR B 81 0.963 -13.087 4.641 1.00 0.00 N ATOM 1255 CA TYR B 81 1.514 -12.320 3.538 1.00 0.00 C ATOM 1256 C TYR B 81 2.115 -11.003 4.004 1.00 0.00 C ATOM 1257 O TYR B 81 1.709 -10.438 5.021 1.00 0.00 O ATOM 1258 CB TYR B 81 0.430 -12.038 2.498 1.00 0.00 C ATOM 1259 CG TYR B 81 0.097 -13.218 1.621 1.00 0.00 C ATOM 1260 CD1 TYR B 81 -0.732 -14.238 2.067 1.00 0.00 C ATOM 1261 CD2 TYR B 81 0.616 -13.306 0.340 1.00 0.00 C ATOM 1262 CE1 TYR B 81 -1.031 -15.316 1.259 1.00 0.00 C ATOM 1263 CE2 TYR B 81 0.321 -14.378 -0.475 1.00 0.00 C ATOM 1264 CZ TYR B 81 -0.499 -15.379 -0.011 1.00 0.00 C ATOM 1265 OH TYR B 81 -0.792 -16.445 -0.821 1.00 0.00 O ATOM 0 H TYR B 81 0.294 -12.578 5.219 1.00 0.00 H new ATOM 0 HA TYR B 81 2.310 -12.919 3.096 1.00 0.00 H new ATOM 0 HB2 TYR B 81 -0.475 -11.713 3.011 1.00 0.00 H new ATOM 0 HB3 TYR B 81 0.753 -11.210 1.867 1.00 0.00 H new ATOM 0 HD1 TYR B 81 -1.149 -14.187 3.062 1.00 0.00 H new ATOM 0 HD2 TYR B 81 1.262 -12.522 -0.026 1.00 0.00 H new ATOM 0 HE1 TYR B 81 -1.676 -16.104 1.619 1.00 0.00 H new ATOM 0 HE2 TYR B 81 0.732 -14.431 -1.472 1.00 0.00 H new ATOM 0 HH TYR B 81 -0.339 -16.335 -1.683 1.00 0.00 H new ATOM 1275 N GLU B 82 3.089 -10.533 3.246 1.00 0.00 N ATOM 1276 CA GLU B 82 3.651 -9.208 3.430 1.00 0.00 C ATOM 1277 C GLU B 82 3.100 -8.304 2.342 1.00 0.00 C ATOM 1278 O GLU B 82 2.897 -8.755 1.216 1.00 0.00 O ATOM 1279 CB GLU B 82 5.177 -9.243 3.324 1.00 0.00 C ATOM 1280 CG GLU B 82 5.851 -10.187 4.300 1.00 0.00 C ATOM 1281 CD GLU B 82 7.346 -10.280 4.072 1.00 0.00 C ATOM 1282 OE1 GLU B 82 8.089 -9.431 4.611 1.00 0.00 O ATOM 1283 OE2 GLU B 82 7.786 -11.199 3.352 1.00 0.00 O ATOM 0 H GLU B 82 3.513 -11.061 2.484 1.00 0.00 H new ATOM 0 HA GLU B 82 3.383 -8.839 4.420 1.00 0.00 H new ATOM 0 HB2 GLU B 82 5.452 -9.532 2.310 1.00 0.00 H new ATOM 0 HB3 GLU B 82 5.563 -8.237 3.485 1.00 0.00 H new ATOM 0 HG2 GLU B 82 5.662 -9.849 5.319 1.00 0.00 H new ATOM 0 HG3 GLU B 82 5.409 -11.179 4.206 1.00 0.00 H new ATOM 1290 N GLY B 83 2.850 -7.046 2.668 1.00 0.00 N ATOM 1291 CA GLY B 83 2.295 -6.139 1.687 1.00 0.00 C ATOM 1292 C GLY B 83 2.561 -4.687 2.013 1.00 0.00 C ATOM 1293 O GLY B 83 2.537 -4.285 3.178 1.00 0.00 O ATOM 0 H GLY B 83 3.020 -6.639 3.588 1.00 0.00 H new ATOM 0 HA2 GLY B 83 2.715 -6.369 0.708 1.00 0.00 H new ATOM 0 HA3 GLY B 83 1.219 -6.300 1.618 1.00 0.00 H new ATOM 1297 N GLN B 84 2.835 -3.900 0.986 1.00 0.00 N ATOM 1298 CA GLN B 84 3.026 -2.468 1.151 1.00 0.00 C ATOM 1299 C GLN B 84 2.196 -1.704 0.131 1.00 0.00 C ATOM 1300 O GLN B 84 2.209 -2.023 -1.059 1.00 0.00 O ATOM 1301 CB GLN B 84 4.501 -2.072 1.013 1.00 0.00 C ATOM 1302 CG GLN B 84 5.405 -2.638 2.098 1.00 0.00 C ATOM 1303 CD GLN B 84 5.863 -4.050 1.806 1.00 0.00 C ATOM 1304 OE1 GLN B 84 6.047 -4.426 0.650 1.00 0.00 O ATOM 1305 NE2 GLN B 84 6.036 -4.844 2.849 1.00 0.00 N ATOM 0 H GLN B 84 2.931 -4.230 0.026 1.00 0.00 H new ATOM 0 HA GLN B 84 2.698 -2.210 2.158 1.00 0.00 H new ATOM 0 HB2 GLN B 84 4.866 -2.406 0.042 1.00 0.00 H new ATOM 0 HB3 GLN B 84 4.576 -0.985 1.025 1.00 0.00 H new ATOM 0 HG2 GLN B 84 6.278 -1.994 2.209 1.00 0.00 H new ATOM 0 HG3 GLN B 84 4.874 -2.623 3.050 1.00 0.00 H new ATOM 0 HE21 GLN B 84 5.872 -4.491 3.792 1.00 0.00 H new ATOM 0 HE22 GLN B 84 6.333 -5.810 2.711 1.00 0.00 H new ATOM 1314 N LEU B 85 1.463 -0.709 0.608 1.00 0.00 N ATOM 1315 CA LEU B 85 0.666 0.140 -0.262 1.00 0.00 C ATOM 1316 C LEU B 85 1.489 1.364 -0.650 1.00 0.00 C ATOM 1317 O LEU B 85 1.743 2.244 0.175 1.00 0.00 O ATOM 1318 CB LEU B 85 -0.642 0.540 0.445 1.00 0.00 C ATOM 1319 CG LEU B 85 -1.716 1.224 -0.422 1.00 0.00 C ATOM 1320 CD1 LEU B 85 -1.391 2.690 -0.657 1.00 0.00 C ATOM 1321 CD2 LEU B 85 -1.875 0.504 -1.754 1.00 0.00 C ATOM 0 H LEU B 85 1.404 -0.470 1.598 1.00 0.00 H new ATOM 0 HA LEU B 85 0.397 -0.400 -1.170 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -1.079 -0.357 0.884 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -0.393 1.209 1.269 1.00 0.00 H new ATOM 0 HG LEU B 85 -2.658 1.168 0.123 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -2.169 3.141 -1.272 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -1.338 3.209 0.300 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -0.432 2.773 -1.168 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -2.639 1.005 -2.349 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -0.927 0.520 -2.292 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -2.173 -0.529 -1.576 1.00 0.00 H new ATOM 1333 N ILE B 86 1.923 1.395 -1.898 1.00 0.00 N ATOM 1334 CA ILE B 86 2.764 2.473 -2.394 1.00 0.00 C ATOM 1335 C ILE B 86 1.925 3.491 -3.155 1.00 0.00 C ATOM 1336 O ILE B 86 1.389 3.193 -4.222 1.00 0.00 O ATOM 1337 CB ILE B 86 3.860 1.929 -3.329 1.00 0.00 C ATOM 1338 CG1 ILE B 86 4.549 0.722 -2.689 1.00 0.00 C ATOM 1339 CG2 ILE B 86 4.880 3.019 -3.642 1.00 0.00 C ATOM 1340 CD1 ILE B 86 5.290 -0.143 -3.681 1.00 0.00 C ATOM 0 H ILE B 86 1.705 0.680 -2.592 1.00 0.00 H new ATOM 0 HA ILE B 86 3.233 2.951 -1.534 1.00 0.00 H new ATOM 0 HB ILE B 86 3.396 1.611 -4.263 1.00 0.00 H new ATOM 0 HG12 ILE B 86 5.249 1.073 -1.931 1.00 0.00 H new ATOM 0 HG13 ILE B 86 3.802 0.116 -2.177 1.00 0.00 H new ATOM 0 HG21 ILE B 86 5.648 2.619 -4.304 1.00 0.00 H new ATOM 0 HG22 ILE B 86 4.380 3.856 -4.130 1.00 0.00 H new ATOM 0 HG23 ILE B 86 5.342 3.362 -2.716 1.00 0.00 H new ATOM 0 HD11 ILE B 86 5.754 -0.980 -3.159 1.00 0.00 H new ATOM 0 HD12 ILE B 86 4.591 -0.523 -4.426 1.00 0.00 H new ATOM 0 HD13 ILE B 86 6.061 0.449 -4.175 1.00 0.00 H new ATOM 1352 N SER B 87 1.799 4.682 -2.605 1.00 0.00 N ATOM 1353 CA SER B 87 1.024 5.725 -3.250 1.00 0.00 C ATOM 1354 C SER B 87 1.927 6.656 -4.054 1.00 0.00 C ATOM 1355 O SER B 87 2.912 7.180 -3.533 1.00 0.00 O ATOM 1356 CB SER B 87 0.228 6.513 -2.207 1.00 0.00 C ATOM 1357 OG SER B 87 1.064 6.973 -1.160 1.00 0.00 O ATOM 0 H SER B 87 2.221 4.952 -1.717 1.00 0.00 H new ATOM 0 HA SER B 87 0.324 5.256 -3.942 1.00 0.00 H new ATOM 0 HB2 SER B 87 -0.260 7.362 -2.685 1.00 0.00 H new ATOM 0 HB3 SER B 87 -0.560 5.882 -1.795 1.00 0.00 H new ATOM 0 HG SER B 87 1.523 6.211 -0.749 1.00 0.00 H new ATOM 1363 N ILE B 88 1.603 6.829 -5.329 1.00 0.00 N ATOM 1364 CA ILE B 88 2.332 7.752 -6.187 1.00 0.00 C ATOM 1365 C ILE B 88 1.512 9.019 -6.379 1.00 0.00 C ATOM 1366 O ILE B 88 0.456 8.990 -7.012 1.00 0.00 O ATOM 1367 CB ILE B 88 2.633 7.130 -7.570 1.00 0.00 C ATOM 1368 CG1 ILE B 88 3.335 5.776 -7.417 1.00 0.00 C ATOM 1369 CG2 ILE B 88 3.480 8.079 -8.407 1.00 0.00 C ATOM 1370 CD1 ILE B 88 4.661 5.844 -6.691 1.00 0.00 C ATOM 0 H ILE B 88 0.837 6.340 -5.792 1.00 0.00 H new ATOM 0 HA ILE B 88 3.281 7.981 -5.702 1.00 0.00 H new ATOM 0 HB ILE B 88 1.686 6.966 -8.084 1.00 0.00 H new ATOM 0 HG12 ILE B 88 2.674 5.095 -6.880 1.00 0.00 H new ATOM 0 HG13 ILE B 88 3.497 5.349 -8.407 1.00 0.00 H new ATOM 0 HG21 ILE B 88 3.683 7.626 -9.377 1.00 0.00 H new ATOM 0 HG22 ILE B 88 2.943 9.017 -8.550 1.00 0.00 H new ATOM 0 HG23 ILE B 88 4.422 8.275 -7.894 1.00 0.00 H new ATOM 0 HD11 ILE B 88 5.091 4.845 -6.625 1.00 0.00 H new ATOM 0 HD12 ILE B 88 5.342 6.497 -7.237 1.00 0.00 H new ATOM 0 HD13 ILE B 88 4.506 6.239 -5.687 1.00 0.00 H new ATOM 1382 N GLN B 89 1.983 10.121 -5.821 1.00 0.00 N ATOM 1383 CA GLN B 89 1.224 11.363 -5.843 1.00 0.00 C ATOM 1384 C GLN B 89 1.684 12.302 -6.951 1.00 0.00 C ATOM 1385 O GLN B 89 2.623 11.995 -7.688 1.00 0.00 O ATOM 1386 CB GLN B 89 1.328 12.067 -4.495 1.00 0.00 C ATOM 1387 CG GLN B 89 0.820 11.234 -3.334 1.00 0.00 C ATOM 1388 CD GLN B 89 1.105 11.878 -1.996 1.00 0.00 C ATOM 1389 OE1 GLN B 89 1.142 13.102 -1.876 1.00 0.00 O ATOM 1390 NE2 GLN B 89 1.333 11.061 -0.988 1.00 0.00 N ATOM 0 H GLN B 89 2.885 10.183 -5.348 1.00 0.00 H new ATOM 0 HA GLN B 89 0.185 11.101 -6.044 1.00 0.00 H new ATOM 0 HB2 GLN B 89 2.369 12.332 -4.313 1.00 0.00 H new ATOM 0 HB3 GLN B 89 0.764 12.999 -4.537 1.00 0.00 H new ATOM 0 HG2 GLN B 89 -0.254 11.084 -3.441 1.00 0.00 H new ATOM 0 HG3 GLN B 89 1.285 10.248 -3.366 1.00 0.00 H new ATOM 0 HE21 GLN B 89 1.292 10.052 -1.130 1.00 0.00 H new ATOM 0 HE22 GLN B 89 1.550 11.438 -0.065 1.00 0.00 H new ATOM 1399 N GLN B 90 1.027 13.452 -7.049 1.00 0.00 N ATOM 1400 CA GLN B 90 1.304 14.419 -8.104 1.00 0.00 C ATOM 1401 C GLN B 90 2.722 14.968 -8.000 1.00 0.00 C ATOM 1402 O GLN B 90 3.441 15.028 -8.996 1.00 0.00 O ATOM 1403 CB GLN B 90 0.291 15.561 -8.034 1.00 0.00 C ATOM 1404 CG GLN B 90 0.485 16.627 -9.098 1.00 0.00 C ATOM 1405 CD GLN B 90 -0.558 17.725 -9.029 1.00 0.00 C ATOM 1406 OE1 GLN B 90 -0.920 18.314 -10.048 1.00 0.00 O ATOM 1407 NE2 GLN B 90 -1.053 18.012 -7.832 1.00 0.00 N ATOM 0 H GLN B 90 0.291 13.739 -6.403 1.00 0.00 H new ATOM 0 HA GLN B 90 1.215 13.910 -9.064 1.00 0.00 H new ATOM 0 HB2 GLN B 90 -0.713 15.148 -8.128 1.00 0.00 H new ATOM 0 HB3 GLN B 90 0.353 16.028 -7.051 1.00 0.00 H new ATOM 0 HG2 GLN B 90 1.476 17.067 -8.988 1.00 0.00 H new ATOM 0 HG3 GLN B 90 0.450 16.161 -10.083 1.00 0.00 H new ATOM 0 HE21 GLN B 90 -0.728 17.502 -7.010 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -1.758 18.742 -7.733 1.00 0.00 H new ATOM 1416 N TYR B 91 3.133 15.332 -6.789 1.00 0.00 N ATOM 1417 CA TYR B 91 4.453 15.929 -6.572 1.00 0.00 C ATOM 1418 C TYR B 91 5.542 14.860 -6.538 1.00 0.00 C ATOM 1419 O TYR B 91 6.653 15.107 -6.071 1.00 0.00 O ATOM 1420 CB TYR B 91 4.481 16.727 -5.266 1.00 0.00 C ATOM 1421 CG TYR B 91 3.588 17.950 -5.260 1.00 0.00 C ATOM 1422 CD1 TYR B 91 2.206 17.830 -5.186 1.00 0.00 C ATOM 1423 CD2 TYR B 91 4.132 19.227 -5.318 1.00 0.00 C ATOM 1424 CE1 TYR B 91 1.394 18.946 -5.171 1.00 0.00 C ATOM 1425 CE2 TYR B 91 3.325 20.348 -5.304 1.00 0.00 C ATOM 1426 CZ TYR B 91 1.957 20.201 -5.231 1.00 0.00 C ATOM 1427 OH TYR B 91 1.146 21.314 -5.210 1.00 0.00 O ATOM 0 H TYR B 91 2.574 15.226 -5.942 1.00 0.00 H new ATOM 0 HA TYR B 91 4.647 16.602 -7.407 1.00 0.00 H new ATOM 0 HB2 TYR B 91 4.184 16.071 -4.448 1.00 0.00 H new ATOM 0 HB3 TYR B 91 5.506 17.040 -5.068 1.00 0.00 H new ATOM 0 HD1 TYR B 91 1.760 16.848 -5.139 1.00 0.00 H new ATOM 0 HD2 TYR B 91 5.204 19.345 -5.375 1.00 0.00 H new ATOM 0 HE1 TYR B 91 0.321 18.835 -5.112 1.00 0.00 H new ATOM 0 HE2 TYR B 91 3.764 21.334 -5.350 1.00 0.00 H new ATOM 0 HH TYR B 91 1.698 22.122 -5.258 1.00 0.00 H new ATOM 1437 N GLY B 92 5.213 13.670 -7.024 1.00 0.00 N ATOM 1438 CA GLY B 92 6.172 12.587 -7.045 1.00 0.00 C ATOM 1439 C GLY B 92 6.379 11.976 -5.677 1.00 0.00 C ATOM 1440 O GLY B 92 7.349 11.255 -5.455 1.00 0.00 O ATOM 0 H GLY B 92 4.296 13.437 -7.405 1.00 0.00 H new ATOM 0 HA2 GLY B 92 5.831 11.817 -7.737 1.00 0.00 H new ATOM 0 HA3 GLY B 92 7.125 12.956 -7.423 1.00 0.00 H new ATOM 1444 N HIS B 93 5.471 12.271 -4.753 1.00 0.00 N ATOM 1445 CA HIS B 93 5.555 11.711 -3.413 1.00 0.00 C ATOM 1446 C HIS B 93 5.221 10.240 -3.427 1.00 0.00 C ATOM 1447 O HIS B 93 4.130 9.851 -3.844 1.00 0.00 O ATOM 1448 CB HIS B 93 4.607 12.411 -2.435 1.00 0.00 C ATOM 1449 CG HIS B 93 5.287 13.374 -1.521 1.00 0.00 C ATOM 1450 ND1 HIS B 93 5.621 13.068 -0.218 1.00 0.00 N ATOM 1451 CD2 HIS B 93 5.681 14.652 -1.719 1.00 0.00 C ATOM 1452 CE1 HIS B 93 6.188 14.118 0.343 1.00 0.00 C ATOM 1453 NE2 HIS B 93 6.237 15.090 -0.546 1.00 0.00 N ATOM 0 H HIS B 93 4.675 12.890 -4.907 1.00 0.00 H new ATOM 0 HA HIS B 93 6.582 11.863 -3.080 1.00 0.00 H new ATOM 0 HB2 HIS B 93 3.842 12.941 -3.002 1.00 0.00 H new ATOM 0 HB3 HIS B 93 4.095 11.657 -1.837 1.00 0.00 H new ATOM 0 HD1 HIS B 93 5.456 12.171 0.239 1.00 0.00 H new ATOM 0 HD2 HIS B 93 5.577 15.221 -2.631 1.00 0.00 H new ATOM 0 HE1 HIS B 93 6.551 14.172 1.359 1.00 0.00 H new ATOM 1462 N GLN B 94 6.164 9.430 -2.995 1.00 0.00 N ATOM 1463 CA GLN B 94 5.881 8.040 -2.734 1.00 0.00 C ATOM 1464 C GLN B 94 5.682 7.860 -1.244 1.00 0.00 C ATOM 1465 O GLN B 94 6.593 8.115 -0.452 1.00 0.00 O ATOM 1466 CB GLN B 94 7.024 7.139 -3.199 1.00 0.00 C ATOM 1467 CG GLN B 94 7.333 7.230 -4.680 1.00 0.00 C ATOM 1468 CD GLN B 94 8.354 6.198 -5.112 1.00 0.00 C ATOM 1469 OE1 GLN B 94 9.215 5.789 -4.333 1.00 0.00 O ATOM 1470 NE2 GLN B 94 8.262 5.764 -6.356 1.00 0.00 N ATOM 0 H GLN B 94 7.129 9.711 -2.819 1.00 0.00 H new ATOM 0 HA GLN B 94 4.984 7.758 -3.285 1.00 0.00 H new ATOM 0 HB2 GLN B 94 7.922 7.394 -2.637 1.00 0.00 H new ATOM 0 HB3 GLN B 94 6.778 6.106 -2.955 1.00 0.00 H new ATOM 0 HG2 GLN B 94 6.415 7.092 -5.251 1.00 0.00 H new ATOM 0 HG3 GLN B 94 7.706 8.228 -4.912 1.00 0.00 H new ATOM 0 HE21 GLN B 94 7.534 6.128 -6.971 1.00 0.00 H new ATOM 0 HE22 GLN B 94 8.919 5.065 -6.702 1.00 0.00 H new ATOM 1479 N GLU B 95 4.502 7.426 -0.863 1.00 0.00 N ATOM 1480 CA GLU B 95 4.229 7.116 0.522 1.00 0.00 C ATOM 1481 C GLU B 95 3.894 5.643 0.628 1.00 0.00 C ATOM 1482 O GLU B 95 2.889 5.185 0.074 1.00 0.00 O ATOM 1483 CB GLU B 95 3.078 7.967 1.069 1.00 0.00 C ATOM 1484 CG GLU B 95 3.302 9.470 0.962 1.00 0.00 C ATOM 1485 CD GLU B 95 4.540 9.950 1.695 1.00 0.00 C ATOM 1486 OE1 GLU B 95 4.749 9.544 2.862 1.00 0.00 O ATOM 1487 OE2 GLU B 95 5.299 10.760 1.115 1.00 0.00 O ATOM 0 H GLU B 95 3.714 7.279 -1.494 1.00 0.00 H new ATOM 0 HA GLU B 95 5.111 7.344 1.120 1.00 0.00 H new ATOM 0 HB2 GLU B 95 2.165 7.709 0.533 1.00 0.00 H new ATOM 0 HB3 GLU B 95 2.917 7.709 2.116 1.00 0.00 H new ATOM 0 HG2 GLU B 95 3.383 9.743 -0.090 1.00 0.00 H new ATOM 0 HG3 GLU B 95 2.430 9.989 1.360 1.00 0.00 H new ATOM 1494 N VAL B 96 4.750 4.901 1.304 1.00 0.00 N ATOM 1495 CA VAL B 96 4.596 3.462 1.397 1.00 0.00 C ATOM 1496 C VAL B 96 4.062 3.071 2.764 1.00 0.00 C ATOM 1497 O VAL B 96 4.771 3.147 3.769 1.00 0.00 O ATOM 1498 CB VAL B 96 5.932 2.737 1.136 1.00 0.00 C ATOM 1499 CG1 VAL B 96 5.741 1.229 1.159 1.00 0.00 C ATOM 1500 CG2 VAL B 96 6.532 3.179 -0.192 1.00 0.00 C ATOM 0 H VAL B 96 5.561 5.272 1.798 1.00 0.00 H new ATOM 0 HA VAL B 96 3.883 3.158 0.631 1.00 0.00 H new ATOM 0 HB VAL B 96 6.625 3.006 1.933 1.00 0.00 H new ATOM 0 HG11 VAL B 96 6.696 0.738 0.973 1.00 0.00 H new ATOM 0 HG12 VAL B 96 5.361 0.925 2.135 1.00 0.00 H new ATOM 0 HG13 VAL B 96 5.028 0.941 0.386 1.00 0.00 H new ATOM 0 HG21 VAL B 96 7.474 2.656 -0.358 1.00 0.00 H new ATOM 0 HG22 VAL B 96 5.840 2.944 -1.000 1.00 0.00 H new ATOM 0 HG23 VAL B 96 6.713 4.254 -0.170 1.00 0.00 H new ATOM 1510 N THR B 97 2.807 2.667 2.797 1.00 0.00 N ATOM 1511 CA THR B 97 2.184 2.237 4.031 1.00 0.00 C ATOM 1512 C THR B 97 2.190 0.714 4.113 1.00 0.00 C ATOM 1513 O THR B 97 1.485 0.034 3.364 1.00 0.00 O ATOM 1514 CB THR B 97 0.744 2.772 4.143 1.00 0.00 C ATOM 1515 OG1 THR B 97 0.720 4.169 3.816 1.00 0.00 O ATOM 1516 CG2 THR B 97 0.204 2.580 5.551 1.00 0.00 C ATOM 0 H THR B 97 2.198 2.628 1.980 1.00 0.00 H new ATOM 0 HA THR B 97 2.758 2.643 4.864 1.00 0.00 H new ATOM 0 HB THR B 97 0.117 2.215 3.446 1.00 0.00 H new ATOM 0 HG1 THR B 97 -0.169 4.534 4.007 1.00 0.00 H new ATOM 0 HG21 THR B 97 -0.814 2.965 5.606 1.00 0.00 H new ATOM 0 HG22 THR B 97 0.204 1.519 5.799 1.00 0.00 H new ATOM 0 HG23 THR B 97 0.834 3.118 6.259 1.00 0.00 H new ATOM 1524 N ARG B 98 3.011 0.188 5.009 1.00 0.00 N ATOM 1525 CA ARG B 98 3.179 -1.252 5.148 1.00 0.00 C ATOM 1526 C ARG B 98 2.025 -1.848 5.942 1.00 0.00 C ATOM 1527 O ARG B 98 1.650 -1.325 6.993 1.00 0.00 O ATOM 1528 CB ARG B 98 4.503 -1.562 5.850 1.00 0.00 C ATOM 1529 CG ARG B 98 5.699 -0.849 5.243 1.00 0.00 C ATOM 1530 CD ARG B 98 6.975 -1.157 6.008 1.00 0.00 C ATOM 1531 NE ARG B 98 8.101 -0.354 5.535 1.00 0.00 N ATOM 1532 CZ ARG B 98 9.274 -0.280 6.158 1.00 0.00 C ATOM 1533 NH1 ARG B 98 9.491 -0.990 7.259 1.00 0.00 N ATOM 1534 NH2 ARG B 98 10.234 0.499 5.677 1.00 0.00 N ATOM 0 H ARG B 98 3.575 0.740 5.655 1.00 0.00 H new ATOM 0 HA ARG B 98 3.188 -1.696 4.153 1.00 0.00 H new ATOM 0 HB2 ARG B 98 4.421 -1.284 6.901 1.00 0.00 H new ATOM 0 HB3 ARG B 98 4.678 -2.637 5.818 1.00 0.00 H new ATOM 0 HG2 ARG B 98 5.815 -1.151 4.202 1.00 0.00 H new ATOM 0 HG3 ARG B 98 5.523 0.227 5.245 1.00 0.00 H new ATOM 0 HD2 ARG B 98 6.816 -0.969 7.070 1.00 0.00 H new ATOM 0 HD3 ARG B 98 7.214 -2.215 5.904 1.00 0.00 H new ATOM 0 HE ARG B 98 7.980 0.182 4.676 1.00 0.00 H new ATOM 0 HH11 ARG B 98 8.757 -1.594 7.629 1.00 0.00 H new ATOM 0 HH12 ARG B 98 10.391 -0.931 7.735 1.00 0.00 H new ATOM 0 HH21 ARG B 98 10.073 1.042 4.829 1.00 0.00 H new ATOM 0 HH22 ARG B 98 11.133 0.555 6.156 1.00 0.00 H new ATOM 1548 N PHE B 99 1.468 -2.943 5.451 1.00 0.00 N ATOM 1549 CA PHE B 99 0.362 -3.597 6.131 1.00 0.00 C ATOM 1550 C PHE B 99 0.565 -5.106 6.165 1.00 0.00 C ATOM 1551 O PHE B 99 1.280 -5.670 5.338 1.00 0.00 O ATOM 1552 CB PHE B 99 -0.977 -3.243 5.467 1.00 0.00 C ATOM 1553 CG PHE B 99 -1.092 -3.657 4.026 1.00 0.00 C ATOM 1554 CD1 PHE B 99 -1.724 -4.841 3.681 1.00 0.00 C ATOM 1555 CD2 PHE B 99 -0.578 -2.858 3.017 1.00 0.00 C ATOM 1556 CE1 PHE B 99 -1.838 -5.220 2.358 1.00 0.00 C ATOM 1557 CE2 PHE B 99 -0.691 -3.234 1.694 1.00 0.00 C ATOM 1558 CZ PHE B 99 -1.321 -4.415 1.364 1.00 0.00 C ATOM 0 H PHE B 99 1.763 -3.397 4.586 1.00 0.00 H new ATOM 0 HA PHE B 99 0.336 -3.234 7.158 1.00 0.00 H new ATOM 0 HB2 PHE B 99 -1.782 -3.713 6.031 1.00 0.00 H new ATOM 0 HB3 PHE B 99 -1.127 -2.165 5.535 1.00 0.00 H new ATOM 0 HD1 PHE B 99 -2.132 -5.474 4.455 1.00 0.00 H new ATOM 0 HD2 PHE B 99 -0.084 -1.931 3.269 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -2.331 -6.146 2.102 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -0.286 -2.603 0.917 1.00 0.00 H new ATOM 0 HZ PHE B 99 -1.410 -4.710 0.329 1.00 0.00 H new ATOM 1568 N ASP B 100 -0.058 -5.744 7.136 1.00 0.00 N ATOM 1569 CA ASP B 100 0.064 -7.182 7.323 1.00 0.00 C ATOM 1570 C ASP B 100 -1.298 -7.838 7.145 1.00 0.00 C ATOM 1571 O ASP B 100 -2.314 -7.283 7.571 1.00 0.00 O ATOM 1572 CB ASP B 100 0.617 -7.471 8.723 1.00 0.00 C ATOM 1573 CG ASP B 100 0.749 -8.951 9.016 1.00 0.00 C ATOM 1574 OD1 ASP B 100 -0.245 -9.568 9.445 1.00 0.00 O ATOM 1575 OD2 ASP B 100 1.856 -9.497 8.841 1.00 0.00 O ATOM 0 H ASP B 100 -0.662 -5.285 7.817 1.00 0.00 H new ATOM 0 HA ASP B 100 0.750 -7.591 6.581 1.00 0.00 H new ATOM 0 HB2 ASP B 100 1.594 -6.998 8.826 1.00 0.00 H new ATOM 0 HB3 ASP B 100 -0.038 -7.016 9.467 1.00 0.00 H new ATOM 1580 N PHE B 101 -1.327 -9.003 6.507 1.00 0.00 N ATOM 1581 CA PHE B 101 -2.584 -9.700 6.274 1.00 0.00 C ATOM 1582 C PHE B 101 -2.348 -11.188 6.054 1.00 0.00 C ATOM 1583 O PHE B 101 -1.205 -11.638 5.934 1.00 0.00 O ATOM 1584 CB PHE B 101 -3.339 -9.092 5.080 1.00 0.00 C ATOM 1585 CG PHE B 101 -2.656 -9.249 3.745 1.00 0.00 C ATOM 1586 CD1 PHE B 101 -3.125 -10.169 2.820 1.00 0.00 C ATOM 1587 CD2 PHE B 101 -1.560 -8.468 3.409 1.00 0.00 C ATOM 1588 CE1 PHE B 101 -2.518 -10.305 1.586 1.00 0.00 C ATOM 1589 CE2 PHE B 101 -0.947 -8.603 2.178 1.00 0.00 C ATOM 1590 CZ PHE B 101 -1.427 -9.522 1.266 1.00 0.00 C ATOM 0 H PHE B 101 -0.501 -9.480 6.145 1.00 0.00 H new ATOM 0 HA PHE B 101 -3.201 -9.579 7.164 1.00 0.00 H new ATOM 0 HB2 PHE B 101 -4.326 -9.551 5.022 1.00 0.00 H new ATOM 0 HB3 PHE B 101 -3.492 -8.030 5.270 1.00 0.00 H new ATOM 0 HD1 PHE B 101 -3.975 -10.787 3.067 1.00 0.00 H new ATOM 0 HD2 PHE B 101 -1.181 -7.746 4.118 1.00 0.00 H new ATOM 0 HE1 PHE B 101 -2.896 -11.023 0.873 1.00 0.00 H new ATOM 0 HE2 PHE B 101 -0.093 -7.990 1.929 1.00 0.00 H new ATOM 0 HZ PHE B 101 -0.949 -9.628 0.303 1.00 0.00 H new ATOM 1600 N THR B 102 -3.433 -11.946 6.017 1.00 0.00 N ATOM 1601 CA THR B 102 -3.364 -13.378 5.812 1.00 0.00 C ATOM 1602 C THR B 102 -4.736 -13.913 5.405 1.00 0.00 C ATOM 1603 O THR B 102 -5.762 -13.483 5.935 1.00 0.00 O ATOM 1604 CB THR B 102 -2.858 -14.104 7.082 1.00 0.00 C ATOM 1605 OG1 THR B 102 -2.739 -15.509 6.834 1.00 0.00 O ATOM 1606 CG2 THR B 102 -3.790 -13.870 8.265 1.00 0.00 C ATOM 0 H THR B 102 -4.380 -11.585 6.128 1.00 0.00 H new ATOM 0 HA THR B 102 -2.651 -13.573 5.011 1.00 0.00 H new ATOM 0 HB THR B 102 -1.879 -13.693 7.331 1.00 0.00 H new ATOM 0 HG1 THR B 102 -2.531 -15.658 5.888 1.00 0.00 H new ATOM 0 HG21 THR B 102 -3.405 -14.394 9.140 1.00 0.00 H new ATOM 0 HG22 THR B 102 -3.848 -12.802 8.477 1.00 0.00 H new ATOM 0 HG23 THR B 102 -4.784 -14.246 8.025 1.00 0.00 H new ATOM 1614 N THR B 103 -4.751 -14.825 4.449 1.00 0.00 N ATOM 1615 CA THR B 103 -5.994 -15.375 3.938 1.00 0.00 C ATOM 1616 C THR B 103 -6.466 -16.571 4.759 1.00 0.00 C ATOM 1617 O THR B 103 -5.753 -17.568 4.881 1.00 0.00 O ATOM 1618 CB THR B 103 -5.828 -15.800 2.472 1.00 0.00 C ATOM 1619 OG1 THR B 103 -4.440 -15.737 2.108 1.00 0.00 O ATOM 1620 CG2 THR B 103 -6.649 -14.908 1.554 1.00 0.00 C ATOM 0 H THR B 103 -3.912 -15.202 4.009 1.00 0.00 H new ATOM 0 HA THR B 103 -6.747 -14.590 4.012 1.00 0.00 H new ATOM 0 HB THR B 103 -6.187 -16.823 2.362 1.00 0.00 H new ATOM 0 HG1 THR B 103 -4.041 -16.629 2.183 1.00 0.00 H new ATOM 0 HG21 THR B 103 -6.515 -15.228 0.521 1.00 0.00 H new ATOM 0 HG22 THR B 103 -7.703 -14.981 1.823 1.00 0.00 H new ATOM 0 HG23 THR B 103 -6.318 -13.875 1.659 1.00 0.00 H new ATOM 1628 N THR B 104 -7.658 -16.441 5.347 1.00 0.00 N ATOM 1629 CA THR B 104 -8.337 -17.551 6.019 1.00 0.00 C ATOM 1630 C THR B 104 -7.735 -17.868 7.398 1.00 0.00 C ATOM 1631 O THR B 104 -8.379 -18.510 8.230 1.00 0.00 O ATOM 1632 CB THR B 104 -8.330 -18.814 5.124 1.00 0.00 C ATOM 1633 OG1 THR B 104 -8.894 -18.496 3.844 1.00 0.00 O ATOM 1634 CG2 THR B 104 -9.123 -19.952 5.748 1.00 0.00 C ATOM 0 H THR B 104 -8.179 -15.564 5.370 1.00 0.00 H new ATOM 0 HA THR B 104 -9.366 -17.235 6.187 1.00 0.00 H new ATOM 0 HB THR B 104 -7.295 -19.140 5.016 1.00 0.00 H new ATOM 0 HG1 THR B 104 -9.293 -17.601 3.875 1.00 0.00 H new ATOM 0 HG21 THR B 104 -9.094 -20.820 5.089 1.00 0.00 H new ATOM 0 HG22 THR B 104 -8.687 -20.213 6.712 1.00 0.00 H new ATOM 0 HG23 THR B 104 -10.157 -19.639 5.890 1.00 0.00 H new ATOM 1642 N SER B 105 -6.530 -17.375 7.666 1.00 0.00 N ATOM 1643 CA SER B 105 -5.839 -17.672 8.920 1.00 0.00 C ATOM 1644 C SER B 105 -6.384 -16.833 10.082 1.00 0.00 C ATOM 1645 O SER B 105 -5.637 -16.428 10.973 1.00 0.00 O ATOM 1646 CB SER B 105 -4.344 -17.412 8.759 1.00 0.00 C ATOM 1647 OG SER B 105 -3.882 -17.875 7.503 1.00 0.00 O ATOM 0 H SER B 105 -6.010 -16.768 7.033 1.00 0.00 H new ATOM 0 HA SER B 105 -6.012 -18.722 9.154 1.00 0.00 H new ATOM 0 HB2 SER B 105 -4.144 -16.345 8.853 1.00 0.00 H new ATOM 0 HB3 SER B 105 -3.796 -17.911 9.559 1.00 0.00 H new ATOM 0 HG SER B 105 -3.408 -17.152 7.042 1.00 0.00 H new ATOM 1653 N THR B 106 -7.686 -16.587 10.075 1.00 0.00 N ATOM 1654 CA THR B 106 -8.328 -15.820 11.128 1.00 0.00 C ATOM 1655 C THR B 106 -8.779 -16.739 12.254 1.00 0.00 C ATOM 1656 O THR B 106 -9.178 -16.284 13.327 1.00 0.00 O ATOM 1657 CB THR B 106 -9.539 -15.045 10.582 1.00 0.00 C ATOM 1658 OG1 THR B 106 -10.321 -15.904 9.741 1.00 0.00 O ATOM 1659 CG2 THR B 106 -9.092 -13.821 9.796 1.00 0.00 C ATOM 0 H THR B 106 -8.321 -16.911 9.345 1.00 0.00 H new ATOM 0 HA THR B 106 -7.600 -15.107 11.514 1.00 0.00 H new ATOM 0 HB THR B 106 -10.143 -14.709 11.425 1.00 0.00 H new ATOM 0 HG1 THR B 106 -11.093 -15.409 9.395 1.00 0.00 H new ATOM 0 HG21 THR B 106 -9.967 -13.290 9.421 1.00 0.00 H new ATOM 0 HG22 THR B 106 -8.518 -13.161 10.446 1.00 0.00 H new ATOM 0 HG23 THR B 106 -8.470 -14.134 8.957 1.00 0.00 H new ATOM 1667 N SER B 107 -8.694 -18.039 12.000 1.00 0.00 N ATOM 1668 CA SER B 107 -9.110 -19.046 12.960 1.00 0.00 C ATOM 1669 C SER B 107 -8.014 -19.287 14.002 1.00 0.00 C ATOM 1670 O SER B 107 -7.555 -20.414 14.196 1.00 0.00 O ATOM 1671 CB SER B 107 -9.444 -20.343 12.221 1.00 0.00 C ATOM 1672 OG SER B 107 -10.348 -20.095 11.154 1.00 0.00 O ATOM 0 H SER B 107 -8.336 -18.421 11.125 1.00 0.00 H new ATOM 0 HA SER B 107 -9.998 -18.693 13.485 1.00 0.00 H new ATOM 0 HB2 SER B 107 -8.530 -20.792 11.833 1.00 0.00 H new ATOM 0 HB3 SER B 107 -9.881 -21.061 12.915 1.00 0.00 H new ATOM 0 HG SER B 107 -10.548 -20.936 10.693 1.00 0.00 H new ATOM 1678 N THR B 108 -7.601 -18.219 14.665 1.00 0.00 N ATOM 1679 CA THR B 108 -6.579 -18.301 15.689 1.00 0.00 C ATOM 1680 C THR B 108 -7.181 -18.776 17.010 1.00 0.00 C ATOM 1681 O THR B 108 -8.350 -18.503 17.297 1.00 0.00 O ATOM 1682 CB THR B 108 -5.898 -16.933 15.885 1.00 0.00 C ATOM 1683 OG1 THR B 108 -6.887 -15.898 15.941 1.00 0.00 O ATOM 1684 CG2 THR B 108 -4.927 -16.642 14.753 1.00 0.00 C ATOM 0 H THR B 108 -7.963 -17.278 14.508 1.00 0.00 H new ATOM 0 HA THR B 108 -5.830 -19.023 15.364 1.00 0.00 H new ATOM 0 HB THR B 108 -5.343 -16.962 16.823 1.00 0.00 H new ATOM 0 HG1 THR B 108 -6.447 -15.032 16.067 1.00 0.00 H new ATOM 0 HG21 THR B 108 -4.460 -15.671 14.915 1.00 0.00 H new ATOM 0 HG22 THR B 108 -4.158 -17.414 14.725 1.00 0.00 H new ATOM 0 HG23 THR B 108 -5.465 -16.632 13.805 1.00 0.00 H new ATOM 1692 N PRO B 109 -6.408 -19.526 17.814 1.00 0.00 N ATOM 1693 CA PRO B 109 -6.866 -20.021 19.117 1.00 0.00 C ATOM 1694 C PRO B 109 -7.103 -18.892 20.117 1.00 0.00 C ATOM 1695 O PRO B 109 -6.197 -18.500 20.857 1.00 0.00 O ATOM 1696 CB PRO B 109 -5.719 -20.922 19.596 1.00 0.00 C ATOM 1697 CG PRO B 109 -4.890 -21.183 18.387 1.00 0.00 C ATOM 1698 CD PRO B 109 -5.041 -19.973 17.515 1.00 0.00 C ATOM 0 HA PRO B 109 -7.821 -20.539 19.034 1.00 0.00 H new ATOM 0 HB2 PRO B 109 -5.134 -20.433 20.375 1.00 0.00 H new ATOM 0 HB3 PRO B 109 -6.100 -21.851 20.019 1.00 0.00 H new ATOM 0 HG2 PRO B 109 -3.846 -21.342 18.656 1.00 0.00 H new ATOM 0 HG3 PRO B 109 -5.226 -22.082 17.870 1.00 0.00 H new ATOM 0 HD2 PRO B 109 -4.303 -19.207 17.754 1.00 0.00 H new ATOM 0 HD3 PRO B 109 -4.917 -20.217 16.460 1.00 0.00 H new ATOM 1706 N GLY B 110 -8.318 -18.365 20.121 1.00 0.00 N ATOM 1707 CA GLY B 110 -8.673 -17.321 21.054 1.00 0.00 C ATOM 1708 C GLY B 110 -9.730 -17.779 22.032 1.00 0.00 C ATOM 1709 O GLY B 110 -9.484 -18.678 22.841 1.00 0.00 O ATOM 0 H GLY B 110 -9.068 -18.646 19.489 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -7.785 -17.004 21.601 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -9.037 -16.452 20.506 1.00 0.00 H new ATOM 1713 N SER B 111 -10.909 -17.169 21.950 1.00 0.00 N ATOM 1714 CA SER B 111 -12.027 -17.503 22.827 1.00 0.00 C ATOM 1715 C SER B 111 -11.618 -17.353 24.294 1.00 0.00 C ATOM 1716 O SER B 111 -11.955 -18.181 25.139 1.00 0.00 O ATOM 1717 CB SER B 111 -12.524 -18.927 22.541 1.00 0.00 C ATOM 1718 OG SER B 111 -13.715 -19.217 23.257 1.00 0.00 O ATOM 0 H SER B 111 -11.116 -16.432 21.276 1.00 0.00 H new ATOM 0 HA SER B 111 -12.845 -16.810 22.629 1.00 0.00 H new ATOM 0 HB2 SER B 111 -12.704 -19.043 21.472 1.00 0.00 H new ATOM 0 HB3 SER B 111 -11.751 -19.645 22.814 1.00 0.00 H new ATOM 0 HG SER B 111 -13.575 -19.040 24.211 1.00 0.00 H new ATOM 1724 N ARG B 112 -10.882 -16.290 24.583 1.00 0.00 N ATOM 1725 CA ARG B 112 -10.396 -16.034 25.932 1.00 0.00 C ATOM 1726 C ARG B 112 -11.189 -14.904 26.573 1.00 0.00 C ATOM 1727 O ARG B 112 -10.843 -14.431 27.657 1.00 0.00 O ATOM 1728 CB ARG B 112 -8.918 -15.646 25.901 1.00 0.00 C ATOM 1729 CG ARG B 112 -8.026 -16.625 25.161 1.00 0.00 C ATOM 1730 CD ARG B 112 -6.598 -16.115 25.111 1.00 0.00 C ATOM 1731 NE ARG B 112 -5.721 -16.973 24.320 1.00 0.00 N ATOM 1732 CZ ARG B 112 -4.761 -16.507 23.520 1.00 0.00 C ATOM 1733 NH1 ARG B 112 -4.595 -15.200 23.368 1.00 0.00 N ATOM 1734 NH2 ARG B 112 -3.971 -17.345 22.865 1.00 0.00 N ATOM 0 H ARG B 112 -10.607 -15.587 23.897 1.00 0.00 H new ATOM 0 HA ARG B 112 -10.521 -16.946 26.516 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -8.823 -14.665 25.436 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -8.559 -15.550 26.926 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -8.054 -17.596 25.656 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -8.401 -16.772 24.148 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -6.590 -15.109 24.691 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -6.207 -16.040 26.126 1.00 0.00 H new ATOM 0 HE ARG B 112 -5.849 -17.983 24.382 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -5.203 -14.548 23.864 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -3.860 -14.847 22.755 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -4.096 -18.352 22.971 1.00 0.00 H new ATOM 0 HH22 ARG B 112 -3.238 -16.983 22.254 1.00 0.00 H new ATOM 1748 N SER B 113 -12.237 -14.465 25.876 1.00 0.00 N ATOM 1749 CA SER B 113 -13.058 -13.340 26.318 1.00 0.00 C ATOM 1750 C SER B 113 -12.223 -12.061 26.380 1.00 0.00 C ATOM 1751 O SER B 113 -12.542 -11.129 27.115 1.00 0.00 O ATOM 1752 CB SER B 113 -13.685 -13.637 27.685 1.00 0.00 C ATOM 1753 OG SER B 113 -14.363 -14.884 27.672 1.00 0.00 O ATOM 0 H SER B 113 -12.539 -14.878 24.993 1.00 0.00 H new ATOM 0 HA SER B 113 -13.861 -13.194 25.595 1.00 0.00 H new ATOM 0 HB2 SER B 113 -12.909 -13.649 28.450 1.00 0.00 H new ATOM 0 HB3 SER B 113 -14.382 -12.842 27.950 1.00 0.00 H new ATOM 0 HG SER B 113 -14.753 -15.053 28.555 1.00 0.00 H new ATOM 1759 N HIS B 114 -11.156 -12.026 25.592 1.00 0.00 N ATOM 1760 CA HIS B 114 -10.235 -10.896 25.587 1.00 0.00 C ATOM 1761 C HIS B 114 -9.843 -10.517 24.163 1.00 0.00 C ATOM 1762 O HIS B 114 -8.663 -10.360 23.858 1.00 0.00 O ATOM 1763 CB HIS B 114 -8.969 -11.216 26.396 1.00 0.00 C ATOM 1764 CG HIS B 114 -9.055 -10.857 27.851 1.00 0.00 C ATOM 1765 ND1 HIS B 114 -8.226 -9.927 28.444 1.00 0.00 N ATOM 1766 CD2 HIS B 114 -9.863 -11.314 28.835 1.00 0.00 C ATOM 1767 CE1 HIS B 114 -8.522 -9.828 29.725 1.00 0.00 C ATOM 1768 NE2 HIS B 114 -9.511 -10.657 29.987 1.00 0.00 N ATOM 0 H HIS B 114 -10.906 -12.773 24.944 1.00 0.00 H new ATOM 0 HA HIS B 114 -10.750 -10.054 26.050 1.00 0.00 H new ATOM 0 HB2 HIS B 114 -8.757 -12.282 26.309 1.00 0.00 H new ATOM 0 HB3 HIS B 114 -8.126 -10.686 25.953 1.00 0.00 H new ATOM 0 HD2 HIS B 114 -10.640 -12.057 28.733 1.00 0.00 H new ATOM 0 HE1 HIS B 114 -8.036 -9.178 30.438 1.00 0.00 H new ATOM 0 HE2 HIS B 114 -9.946 -10.790 30.900 1.00 0.00 H new ATOM 1777 N HIS B 115 -10.830 -10.372 23.287 1.00 0.00 N ATOM 1778 CA HIS B 115 -10.545 -9.981 21.910 1.00 0.00 C ATOM 1779 C HIS B 115 -11.098 -8.591 21.610 1.00 0.00 C ATOM 1780 O HIS B 115 -11.302 -8.225 20.454 1.00 0.00 O ATOM 1781 CB HIS B 115 -11.060 -11.019 20.897 1.00 0.00 C ATOM 1782 CG HIS B 115 -12.549 -11.213 20.866 1.00 0.00 C ATOM 1783 ND1 HIS B 115 -13.351 -10.693 19.874 1.00 0.00 N ATOM 1784 CD2 HIS B 115 -13.371 -11.912 21.682 1.00 0.00 C ATOM 1785 CE1 HIS B 115 -14.600 -11.063 20.082 1.00 0.00 C ATOM 1786 NE2 HIS B 115 -14.640 -11.803 21.171 1.00 0.00 N ATOM 0 H HIS B 115 -11.817 -10.516 23.498 1.00 0.00 H new ATOM 0 HA HIS B 115 -9.461 -9.943 21.802 1.00 0.00 H new ATOM 0 HB2 HIS B 115 -10.729 -10.723 19.901 1.00 0.00 H new ATOM 0 HB3 HIS B 115 -10.591 -11.978 21.117 1.00 0.00 H new ATOM 0 HD2 HIS B 115 -13.082 -12.455 22.570 1.00 0.00 H new ATOM 0 HE1 HIS B 115 -15.447 -10.803 19.464 1.00 0.00 H new ATOM 0 HE2 HIS B 115 -15.478 -12.226 21.570 1.00 0.00 H new ATOM 1795 N HIS B 116 -11.331 -7.819 22.666 1.00 0.00 N ATOM 1796 CA HIS B 116 -11.686 -6.410 22.519 1.00 0.00 C ATOM 1797 C HIS B 116 -10.548 -5.551 23.051 1.00 0.00 C ATOM 1798 O HIS B 116 -10.757 -4.516 23.684 1.00 0.00 O ATOM 1799 CB HIS B 116 -13.021 -6.072 23.216 1.00 0.00 C ATOM 1800 CG HIS B 116 -13.110 -6.426 24.675 1.00 0.00 C ATOM 1801 ND1 HIS B 116 -13.972 -7.384 25.162 1.00 0.00 N ATOM 1802 CD2 HIS B 116 -12.473 -5.919 25.756 1.00 0.00 C ATOM 1803 CE1 HIS B 116 -13.863 -7.449 26.476 1.00 0.00 C ATOM 1804 NE2 HIS B 116 -12.959 -6.570 26.863 1.00 0.00 N ATOM 0 H HIS B 116 -11.281 -8.143 23.632 1.00 0.00 H new ATOM 0 HA HIS B 116 -11.834 -6.197 21.460 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -13.203 -5.003 23.110 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -13.824 -6.586 22.688 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -11.720 -5.144 25.749 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -14.420 -8.110 27.124 1.00 0.00 H new ATOM 0 HE2 HIS B 116 -12.669 -6.402 27.826 1.00 0.00 H new ATOM 1813 N HIS B 117 -9.335 -6.006 22.778 1.00 0.00 N ATOM 1814 CA HIS B 117 -8.130 -5.355 23.260 1.00 0.00 C ATOM 1815 C HIS B 117 -7.937 -4.010 22.569 1.00 0.00 C ATOM 1816 O HIS B 117 -7.843 -3.933 21.342 1.00 0.00 O ATOM 1817 CB HIS B 117 -6.921 -6.269 23.016 1.00 0.00 C ATOM 1818 CG HIS B 117 -5.627 -5.759 23.577 1.00 0.00 C ATOM 1819 ND1 HIS B 117 -5.187 -6.063 24.845 1.00 0.00 N ATOM 1820 CD2 HIS B 117 -4.665 -4.982 23.024 1.00 0.00 C ATOM 1821 CE1 HIS B 117 -4.010 -5.499 25.048 1.00 0.00 C ATOM 1822 NE2 HIS B 117 -3.670 -4.836 23.958 1.00 0.00 N ATOM 0 H HIS B 117 -9.160 -6.838 22.215 1.00 0.00 H new ATOM 0 HA HIS B 117 -8.225 -5.172 24.330 1.00 0.00 H new ATOM 0 HB2 HIS B 117 -7.129 -7.247 23.449 1.00 0.00 H new ATOM 0 HB3 HIS B 117 -6.804 -6.415 21.942 1.00 0.00 H new ATOM 0 HD2 HIS B 117 -4.678 -4.556 22.032 1.00 0.00 H new ATOM 0 HE1 HIS B 117 -3.425 -5.568 25.953 1.00 0.00 H new ATOM 0 HE2 HIS B 117 -2.810 -4.303 23.831 1.00 0.00 H new ATOM 1831 N HIS B 118 -7.892 -2.954 23.363 1.00 0.00 N ATOM 1832 CA HIS B 118 -7.673 -1.611 22.846 1.00 0.00 C ATOM 1833 C HIS B 118 -6.215 -1.219 23.025 1.00 0.00 C ATOM 1834 O HIS B 118 -5.440 -1.945 23.652 1.00 0.00 O ATOM 1835 CB HIS B 118 -8.574 -0.586 23.554 1.00 0.00 C ATOM 1836 CG HIS B 118 -8.376 -0.506 25.043 1.00 0.00 C ATOM 1837 ND1 HIS B 118 -7.304 0.134 25.636 1.00 0.00 N ATOM 1838 CD2 HIS B 118 -9.124 -0.993 26.059 1.00 0.00 C ATOM 1839 CE1 HIS B 118 -7.407 0.035 26.947 1.00 0.00 C ATOM 1840 NE2 HIS B 118 -8.500 -0.644 27.229 1.00 0.00 N ATOM 0 H HIS B 118 -8.005 -3.000 24.376 1.00 0.00 H new ATOM 0 HA HIS B 118 -7.926 -1.613 21.786 1.00 0.00 H new ATOM 0 HB2 HIS B 118 -8.392 0.398 23.122 1.00 0.00 H new ATOM 0 HB3 HIS B 118 -9.616 -0.835 23.351 1.00 0.00 H new ATOM 0 HD1 HIS B 118 -6.551 0.609 25.138 1.00 0.00 H new ATOM 0 HD2 HIS B 118 -10.043 -1.553 25.966 1.00 0.00 H new ATOM 0 HE1 HIS B 118 -6.713 0.442 27.667 1.00 0.00 H new ATOM 1849 N HIS B 119 -5.843 -0.076 22.480 1.00 0.00 N ATOM 1850 CA HIS B 119 -4.509 0.450 22.680 1.00 0.00 C ATOM 1851 C HIS B 119 -4.547 1.490 23.793 1.00 0.00 C ATOM 1852 O HIS B 119 -4.343 2.687 23.513 1.00 0.00 O ATOM 1853 CB HIS B 119 -3.973 1.057 21.379 1.00 0.00 C ATOM 1854 CG HIS B 119 -2.506 1.361 21.412 1.00 0.00 C ATOM 1855 ND1 HIS B 119 -2.001 2.639 21.486 1.00 0.00 N ATOM 1856 CD2 HIS B 119 -1.433 0.538 21.365 1.00 0.00 C ATOM 1857 CE1 HIS B 119 -0.682 2.589 21.484 1.00 0.00 C ATOM 1858 NE2 HIS B 119 -0.311 1.327 21.411 1.00 0.00 N ATOM 1859 OXT HIS B 119 -4.840 1.106 24.943 1.00 0.00 O ATOM 0 H HIS B 119 -6.446 0.504 21.897 1.00 0.00 H new ATOM 0 HA HIS B 119 -3.836 -0.357 22.970 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -4.173 0.368 20.558 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -4.520 1.975 21.165 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -1.455 -0.540 21.303 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -0.018 3.440 21.534 1.00 0.00 H new ATOM 0 HE2 HIS B 119 0.652 0.991 21.392 1.00 0.00 H new TER 1868 HIS B 119