USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=34 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 45 TYR OH : rot 48:sc= 0.313 USER MOD Set 1.2: B 68 ASN : amide:sc= 0.225 K(o=0.54,f=-0.72) USER MOD Single : A 1 GLY N :NH3+ 136:sc= 0.00469 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0273 USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) 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 -40:sc= 0.564 USER MOD Single : A 17 GLN : amide:sc= -3.68! C(o=-3.7!,f=-1.3!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0.00431 USER MOD Single : A 22 SER OG : rot 180:sc= -1.32 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : B 31 MET CE :methyl 161:sc= -0.0866 (180deg=-0.535) USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 35 ASN : amide:sc=-0.00946 X(o=-0.0095,f=0) USER MOD Single : B 38 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 40 SER OG : rot 180:sc= 0 USER MOD Single : B 41 HIS : no HD1:sc=-0.000171 X(o=-0.00017,f=0) USER MOD Single : B 43 SER OG : rot 180:sc= 0 USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 ASN : amide:sc=-0.00174 X(o=-0.0017,f=0) USER MOD Single : B 54 SER OG : rot 180:sc= 0 USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 66 HIS : no HD1:sc= 0 X(o=0,f=-0.0022) USER MOD Single : B 69 SER OG : rot -71:sc= 0.00144 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+ -173:sc= 0 (180deg=-0.0736) USER MOD Single : B 76 LYS NZ :NH3+ 168:sc= -0.0268 (180deg=-0.187) USER MOD Single : B 81 TYR OH : rot 97:sc= 0.0378 USER MOD Single : B 84 GLN : amide:sc= -0.324 K(o=-0.32,f=-3.8!) USER MOD Single : B 87 SER OG : rot -106:sc= 0.0418 USER MOD Single : B 89 GLN : amide:sc= 1.09 K(o=1.1,f=-0.17) USER MOD Single : B 90 GLN : amide:sc= -0.0814 K(o=-0.081,f=-2.4!) USER MOD Single : B 91 TYR OH : rot 180:sc= -1.41 USER MOD Single : B 93 HIS : no HE2:sc= 1.1 K(o=1.1,f=-4.2!) USER MOD Single : B 94 GLN : amide:sc= -0.0752 X(o=-0.075,f=0) USER MOD Single : B 97 THR OG1 : rot -156:sc= 1.28 USER MOD Single : B 102 THR OG1 : rot 180:sc= -0.089 USER MOD Single : B 103 THR OG1 : rot 180:sc= 0 USER MOD Single : B 104 THR OG1 : rot 180:sc= 0 USER MOD Single : B 105 SER OG : rot 180:sc= 0.0687 USER MOD Single : B 106 THR OG1 : rot 180:sc= 0.0261 USER MOD Single : B 107 SER OG : rot 180:sc= 0 USER MOD Single : B 108 THR OG1 : rot 180:sc= 0.0105 USER MOD Single : B 111 SER OG : rot 180:sc= 0 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=-0.0021) USER MOD Single : B 116 HIS : no HD1:sc= -0.25 X(o=-0.25,f=0) USER MOD Single : B 117 HIS : no HD1:sc=-0.00135 X(o=-0.0013,f=-0.0013) USER MOD Single : B 118 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.959 15.139 18.096 1.00 0.00 N ATOM 2 CA GLY A 1 7.219 13.929 18.515 1.00 0.00 C ATOM 3 C GLY A 1 6.117 13.573 17.543 1.00 0.00 C ATOM 4 O GLY A 1 5.400 14.459 17.071 1.00 0.00 O ATOM 0 H1 GLY A 1 8.109 15.757 18.919 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.879 14.863 17.698 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.410 15.650 17.376 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.912 13.092 18.600 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.791 14.090 19.505 1.00 0.00 H new ATOM 10 N SER A 2 5.995 12.278 17.243 1.00 0.00 N ATOM 11 CA SER A 2 4.970 11.759 16.339 1.00 0.00 C ATOM 12 C SER A 2 5.274 12.112 14.882 1.00 0.00 C ATOM 13 O SER A 2 5.550 13.265 14.546 1.00 0.00 O ATOM 14 CB SER A 2 3.579 12.275 16.734 1.00 0.00 C ATOM 15 OG SER A 2 2.572 11.757 15.877 1.00 0.00 O ATOM 0 H SER A 2 6.609 11.557 17.623 1.00 0.00 H new ATOM 0 HA SER A 2 4.977 10.673 16.430 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.363 11.992 17.764 1.00 0.00 H new ATOM 0 HB3 SER A 2 3.568 13.364 16.694 1.00 0.00 H new ATOM 0 HG SER A 2 1.697 12.102 16.154 1.00 0.00 H new ATOM 21 N GLN A 3 5.218 11.107 14.016 1.00 0.00 N ATOM 22 CA GLN A 3 5.430 11.315 12.590 1.00 0.00 C ATOM 23 C GLN A 3 4.098 11.514 11.884 1.00 0.00 C ATOM 24 O GLN A 3 4.043 11.697 10.669 1.00 0.00 O ATOM 25 CB GLN A 3 6.172 10.135 11.965 1.00 0.00 C ATOM 26 CG GLN A 3 7.567 9.922 12.524 1.00 0.00 C ATOM 27 CD GLN A 3 8.341 8.877 11.749 1.00 0.00 C ATOM 28 OE1 GLN A 3 9.045 9.196 10.791 1.00 0.00 O ATOM 29 NE2 GLN A 3 8.210 7.624 12.148 1.00 0.00 N ATOM 0 H GLN A 3 5.027 10.140 14.277 1.00 0.00 H new ATOM 0 HA GLN A 3 6.041 12.210 12.470 1.00 0.00 H new ATOM 0 HB2 GLN A 3 5.587 9.228 12.118 1.00 0.00 H new ATOM 0 HB3 GLN A 3 6.242 10.291 10.889 1.00 0.00 H new ATOM 0 HG2 GLN A 3 8.113 10.865 12.503 1.00 0.00 H new ATOM 0 HG3 GLN A 3 7.495 9.618 13.568 1.00 0.00 H new ATOM 0 HE21 GLN A 3 7.616 7.403 12.947 1.00 0.00 H new ATOM 0 HE22 GLN A 3 8.703 6.878 11.657 1.00 0.00 H new ATOM 38 N THR A 4 3.024 11.485 12.654 1.00 0.00 N ATOM 39 CA THR A 4 1.690 11.668 12.111 1.00 0.00 C ATOM 40 C THR A 4 1.336 13.156 12.073 1.00 0.00 C ATOM 41 O THR A 4 0.179 13.537 11.896 1.00 0.00 O ATOM 42 CB THR A 4 0.656 10.891 12.950 1.00 0.00 C ATOM 43 OG1 THR A 4 1.208 9.622 13.336 1.00 0.00 O ATOM 44 CG2 THR A 4 -0.629 10.655 12.168 1.00 0.00 C ATOM 0 H THR A 4 3.051 11.336 13.663 1.00 0.00 H new ATOM 0 HA THR A 4 1.671 11.278 11.093 1.00 0.00 H new ATOM 0 HB THR A 4 0.420 11.488 13.831 1.00 0.00 H new ATOM 0 HG1 THR A 4 0.551 9.129 13.871 1.00 0.00 H new ATOM 0 HG21 THR A 4 -1.337 10.105 12.788 1.00 0.00 H new ATOM 0 HG22 THR A 4 -1.064 11.614 11.885 1.00 0.00 H new ATOM 0 HG23 THR A 4 -0.408 10.077 11.270 1.00 0.00 H new ATOM 52 N THR A 5 2.351 13.998 12.242 1.00 0.00 N ATOM 53 CA THR A 5 2.172 15.441 12.196 1.00 0.00 C ATOM 54 C THR A 5 1.735 15.887 10.800 1.00 0.00 C ATOM 55 O THR A 5 0.947 16.821 10.651 1.00 0.00 O ATOM 56 CB THR A 5 3.464 16.183 12.619 1.00 0.00 C ATOM 57 OG1 THR A 5 3.315 17.598 12.441 1.00 0.00 O ATOM 58 CG2 THR A 5 4.670 15.694 11.827 1.00 0.00 C ATOM 0 H THR A 5 3.312 13.701 12.413 1.00 0.00 H new ATOM 0 HA THR A 5 1.387 15.700 12.907 1.00 0.00 H new ATOM 0 HB THR A 5 3.633 15.968 13.674 1.00 0.00 H new ATOM 0 HG1 THR A 5 4.140 18.051 12.715 1.00 0.00 H new ATOM 0 HG21 THR A 5 5.560 16.235 12.148 1.00 0.00 H new ATOM 0 HG22 THR A 5 4.811 14.627 12.001 1.00 0.00 H new ATOM 0 HG23 THR A 5 4.503 15.869 10.764 1.00 0.00 H new ATOM 66 N ALA A 6 2.233 15.199 9.781 1.00 0.00 N ATOM 67 CA ALA A 6 1.845 15.474 8.409 1.00 0.00 C ATOM 68 C ALA A 6 1.589 14.169 7.666 1.00 0.00 C ATOM 69 O ALA A 6 2.470 13.652 6.978 1.00 0.00 O ATOM 70 CB ALA A 6 2.913 16.294 7.704 1.00 0.00 C ATOM 0 H ALA A 6 2.910 14.443 9.883 1.00 0.00 H new ATOM 0 HA ALA A 6 0.923 16.056 8.417 1.00 0.00 H new ATOM 0 HB1 ALA A 6 2.603 16.489 6.677 1.00 0.00 H new ATOM 0 HB2 ALA A 6 3.050 17.240 8.228 1.00 0.00 H new ATOM 0 HB3 ALA A 6 3.853 15.742 7.701 1.00 0.00 H new ATOM 76 N PRO A 7 0.377 13.612 7.812 1.00 0.00 N ATOM 77 CA PRO A 7 -0.001 12.350 7.175 1.00 0.00 C ATOM 78 C PRO A 7 -0.142 12.494 5.663 1.00 0.00 C ATOM 79 O PRO A 7 -1.214 12.824 5.153 1.00 0.00 O ATOM 80 CB PRO A 7 -1.358 12.004 7.810 1.00 0.00 C ATOM 81 CG PRO A 7 -1.512 12.940 8.963 1.00 0.00 C ATOM 82 CD PRO A 7 -0.724 14.164 8.609 1.00 0.00 C ATOM 0 HA PRO A 7 0.754 11.579 7.326 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -2.169 12.129 7.093 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -1.382 10.966 8.142 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -2.561 13.186 9.129 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -1.141 12.490 9.884 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -1.318 14.879 8.040 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -0.362 14.684 9.496 1.00 0.00 H new ATOM 90 N ASP A 8 0.954 12.275 4.956 1.00 0.00 N ATOM 91 CA ASP A 8 0.956 12.347 3.500 1.00 0.00 C ATOM 92 C ASP A 8 0.663 10.966 2.927 1.00 0.00 C ATOM 93 O ASP A 8 0.305 10.817 1.758 1.00 0.00 O ATOM 94 CB ASP A 8 2.311 12.863 3.001 1.00 0.00 C ATOM 95 CG ASP A 8 2.293 13.277 1.542 1.00 0.00 C ATOM 96 OD1 ASP A 8 1.486 14.160 1.182 1.00 0.00 O ATOM 97 OD2 ASP A 8 3.114 12.759 0.751 1.00 0.00 O ATOM 0 H ASP A 8 1.859 12.045 5.367 1.00 0.00 H new ATOM 0 HA ASP A 8 0.184 13.040 3.167 1.00 0.00 H new ATOM 0 HB2 ASP A 8 2.615 13.715 3.610 1.00 0.00 H new ATOM 0 HB3 ASP A 8 3.063 12.086 3.142 1.00 0.00 H new ATOM 102 N ALA A 9 0.803 9.963 3.787 1.00 0.00 N ATOM 103 CA ALA A 9 0.568 8.576 3.420 1.00 0.00 C ATOM 104 C ALA A 9 -0.824 8.126 3.846 1.00 0.00 C ATOM 105 O ALA A 9 -1.369 8.628 4.834 1.00 0.00 O ATOM 106 CB ALA A 9 1.615 7.687 4.069 1.00 0.00 C ATOM 0 H ALA A 9 1.083 10.092 4.759 1.00 0.00 H new ATOM 0 HA ALA A 9 0.639 8.493 2.335 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.434 6.649 3.791 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.607 7.986 3.730 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.556 7.787 5.153 1.00 0.00 H new ATOM 112 N PRO A 10 -1.420 7.183 3.101 1.00 0.00 N ATOM 113 CA PRO A 10 -2.708 6.582 3.462 1.00 0.00 C ATOM 114 C PRO A 10 -2.632 5.847 4.797 1.00 0.00 C ATOM 115 O PRO A 10 -1.641 5.171 5.088 1.00 0.00 O ATOM 116 CB PRO A 10 -2.976 5.582 2.329 1.00 0.00 C ATOM 117 CG PRO A 10 -2.116 6.032 1.204 1.00 0.00 C ATOM 118 CD PRO A 10 -0.900 6.636 1.837 1.00 0.00 C ATOM 0 HA PRO A 10 -3.490 7.333 3.576 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -2.727 4.565 2.633 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -4.028 5.581 2.045 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -1.847 5.196 0.559 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -2.636 6.760 0.581 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -0.123 5.891 2.009 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -0.463 7.414 1.210 1.00 0.00 H new ATOM 126 N PRO A 11 -3.664 5.999 5.642 1.00 0.00 N ATOM 127 CA PRO A 11 -3.772 5.274 6.913 1.00 0.00 C ATOM 128 C PRO A 11 -3.927 3.762 6.723 1.00 0.00 C ATOM 129 O PRO A 11 -3.704 3.237 5.632 1.00 0.00 O ATOM 130 CB PRO A 11 -5.035 5.852 7.565 1.00 0.00 C ATOM 131 CG PRO A 11 -5.327 7.112 6.827 1.00 0.00 C ATOM 132 CD PRO A 11 -4.789 6.920 5.441 1.00 0.00 C ATOM 0 HA PRO A 11 -2.870 5.397 7.512 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -5.868 5.153 7.492 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -4.874 6.047 8.625 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -6.399 7.310 6.804 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -4.855 7.966 7.313 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -5.540 6.499 4.773 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -4.464 7.863 5.001 1.00 0.00 H new ATOM 140 N ASP A 12 -4.327 3.082 7.792 1.00 0.00 N ATOM 141 CA ASP A 12 -4.445 1.621 7.810 1.00 0.00 C ATOM 142 C ASP A 12 -5.253 1.073 6.633 1.00 0.00 C ATOM 143 O ASP A 12 -6.431 1.403 6.461 1.00 0.00 O ATOM 144 CB ASP A 12 -5.088 1.169 9.125 1.00 0.00 C ATOM 145 CG ASP A 12 -5.467 -0.302 9.123 1.00 0.00 C ATOM 146 OD1 ASP A 12 -6.650 -0.616 8.857 1.00 0.00 O ATOM 147 OD2 ASP A 12 -4.589 -1.148 9.398 1.00 0.00 O ATOM 0 H ASP A 12 -4.580 3.526 8.675 1.00 0.00 H new ATOM 0 HA ASP A 12 -3.435 1.221 7.721 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -4.397 1.360 9.946 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.979 1.768 9.313 1.00 0.00 H new ATOM 152 N PRO A 13 -4.614 0.253 5.785 1.00 0.00 N ATOM 153 CA PRO A 13 -5.308 -0.548 4.788 1.00 0.00 C ATOM 154 C PRO A 13 -5.954 -1.761 5.443 1.00 0.00 C ATOM 155 O PRO A 13 -5.267 -2.605 6.019 1.00 0.00 O ATOM 156 CB PRO A 13 -4.201 -0.986 3.813 1.00 0.00 C ATOM 157 CG PRO A 13 -2.964 -0.269 4.251 1.00 0.00 C ATOM 158 CD PRO A 13 -3.163 0.064 5.701 1.00 0.00 C ATOM 0 HA PRO A 13 -6.107 0.001 4.290 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -4.058 -2.066 3.844 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -4.460 -0.728 2.786 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -2.082 -0.895 4.113 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -2.809 0.635 3.662 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -2.820 -0.739 6.353 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -2.619 0.963 5.990 1.00 0.00 H new ATOM 166 N THR A 14 -7.264 -1.849 5.354 1.00 0.00 N ATOM 167 CA THR A 14 -7.995 -2.893 6.041 1.00 0.00 C ATOM 168 C THR A 14 -8.300 -4.037 5.090 1.00 0.00 C ATOM 169 O THR A 14 -8.729 -3.822 3.952 1.00 0.00 O ATOM 170 CB THR A 14 -9.310 -2.348 6.615 1.00 0.00 C ATOM 171 OG1 THR A 14 -9.065 -1.089 7.261 1.00 0.00 O ATOM 172 CG2 THR A 14 -9.922 -3.321 7.614 1.00 0.00 C ATOM 0 H THR A 14 -7.845 -1.210 4.812 1.00 0.00 H new ATOM 0 HA THR A 14 -7.373 -3.256 6.859 1.00 0.00 H new ATOM 0 HB THR A 14 -10.013 -2.216 5.793 1.00 0.00 H new ATOM 0 HG1 THR A 14 -8.221 -1.134 7.756 1.00 0.00 H new ATOM 0 HG21 THR A 14 -10.852 -2.906 8.003 1.00 0.00 H new ATOM 0 HG22 THR A 14 -10.127 -4.270 7.119 1.00 0.00 H new ATOM 0 HG23 THR A 14 -9.226 -3.484 8.437 1.00 0.00 H new ATOM 180 N VAL A 15 -8.058 -5.247 5.558 1.00 0.00 N ATOM 181 CA VAL A 15 -8.261 -6.430 4.749 1.00 0.00 C ATOM 182 C VAL A 15 -9.594 -7.091 5.080 1.00 0.00 C ATOM 183 O VAL A 15 -9.777 -7.640 6.168 1.00 0.00 O ATOM 184 CB VAL A 15 -7.102 -7.436 4.953 1.00 0.00 C ATOM 185 CG1 VAL A 15 -7.421 -8.795 4.350 1.00 0.00 C ATOM 186 CG2 VAL A 15 -5.814 -6.884 4.360 1.00 0.00 C ATOM 0 H VAL A 15 -7.718 -5.435 6.501 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.278 -6.123 3.703 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.971 -7.575 6.026 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.583 -9.472 4.515 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.315 -9.202 4.823 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.595 -8.686 3.279 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.007 -7.601 4.511 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -5.950 -6.710 3.293 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.560 -5.945 4.851 1.00 0.00 H new ATOM 196 N ASP A 16 -10.526 -7.019 4.141 1.00 0.00 N ATOM 197 CA ASP A 16 -11.819 -7.669 4.298 1.00 0.00 C ATOM 198 C ASP A 16 -11.863 -8.906 3.414 1.00 0.00 C ATOM 199 O ASP A 16 -11.671 -8.819 2.201 1.00 0.00 O ATOM 200 CB ASP A 16 -12.955 -6.708 3.924 1.00 0.00 C ATOM 201 CG ASP A 16 -14.314 -7.171 4.423 1.00 0.00 C ATOM 202 OD1 ASP A 16 -14.854 -6.536 5.356 1.00 0.00 O ATOM 203 OD2 ASP A 16 -14.853 -8.164 3.891 1.00 0.00 O ATOM 0 H ASP A 16 -10.411 -6.516 3.261 1.00 0.00 H new ATOM 0 HA ASP A 16 -11.952 -7.959 5.340 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -12.740 -5.722 4.336 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -12.990 -6.600 2.840 1.00 0.00 H new ATOM 208 N GLN A 17 -12.087 -10.059 4.019 1.00 0.00 N ATOM 209 CA GLN A 17 -12.082 -11.313 3.282 1.00 0.00 C ATOM 210 C GLN A 17 -13.463 -11.615 2.704 1.00 0.00 C ATOM 211 O GLN A 17 -14.396 -11.966 3.423 1.00 0.00 O ATOM 212 CB GLN A 17 -11.574 -12.475 4.155 1.00 0.00 C ATOM 213 CG GLN A 17 -12.361 -12.748 5.438 1.00 0.00 C ATOM 214 CD GLN A 17 -12.190 -11.677 6.500 1.00 0.00 C ATOM 215 OE1 GLN A 17 -11.248 -11.713 7.289 1.00 0.00 O ATOM 216 NE2 GLN A 17 -13.128 -10.743 6.560 1.00 0.00 N ATOM 0 H GLN A 17 -12.274 -10.154 5.017 1.00 0.00 H new ATOM 0 HA GLN A 17 -11.389 -11.205 2.448 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -11.576 -13.383 3.552 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -10.537 -12.273 4.425 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -13.419 -12.837 5.192 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -12.047 -13.708 5.849 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -13.895 -10.746 5.887 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -13.083 -10.021 7.279 1.00 0.00 H new ATOM 225 N VAL A 18 -13.587 -11.457 1.395 1.00 0.00 N ATOM 226 CA VAL A 18 -14.855 -11.688 0.710 1.00 0.00 C ATOM 227 C VAL A 18 -14.958 -13.128 0.219 1.00 0.00 C ATOM 228 O VAL A 18 -16.031 -13.592 -0.173 1.00 0.00 O ATOM 229 CB VAL A 18 -15.035 -10.725 -0.482 1.00 0.00 C ATOM 230 CG1 VAL A 18 -15.162 -9.290 0.008 1.00 0.00 C ATOM 231 CG2 VAL A 18 -13.877 -10.856 -1.462 1.00 0.00 C ATOM 0 H VAL A 18 -12.824 -11.169 0.782 1.00 0.00 H new ATOM 0 HA VAL A 18 -15.648 -11.500 1.434 1.00 0.00 H new ATOM 0 HB VAL A 18 -15.953 -10.994 -1.004 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -15.288 -8.624 -0.846 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -16.027 -9.205 0.666 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -14.262 -9.011 0.555 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -14.025 -10.168 -2.294 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -12.942 -10.616 -0.955 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -13.833 -11.878 -1.839 1.00 0.00 H new ATOM 241 N ASP A 19 -13.836 -13.829 0.242 1.00 0.00 N ATOM 242 CA ASP A 19 -13.795 -15.223 -0.166 1.00 0.00 C ATOM 243 C ASP A 19 -12.709 -15.945 0.619 1.00 0.00 C ATOM 244 O ASP A 19 -12.172 -15.396 1.581 1.00 0.00 O ATOM 245 CB ASP A 19 -13.530 -15.334 -1.674 1.00 0.00 C ATOM 246 CG ASP A 19 -13.831 -16.711 -2.234 1.00 0.00 C ATOM 247 OD1 ASP A 19 -15.014 -17.010 -2.485 1.00 0.00 O ATOM 248 OD2 ASP A 19 -12.884 -17.501 -2.429 1.00 0.00 O ATOM 0 H ASP A 19 -12.937 -13.452 0.541 1.00 0.00 H new ATOM 0 HA ASP A 19 -14.759 -15.687 0.043 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -14.136 -14.595 -2.198 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -12.487 -15.088 -1.872 1.00 0.00 H new ATOM 253 N ASP A 20 -12.376 -17.151 0.207 1.00 0.00 N ATOM 254 CA ASP A 20 -11.366 -17.941 0.888 1.00 0.00 C ATOM 255 C ASP A 20 -9.983 -17.479 0.475 1.00 0.00 C ATOM 256 O ASP A 20 -9.147 -17.142 1.314 1.00 0.00 O ATOM 257 CB ASP A 20 -11.520 -19.426 0.551 1.00 0.00 C ATOM 258 CG ASP A 20 -12.858 -19.994 0.972 1.00 0.00 C ATOM 259 OD1 ASP A 20 -13.845 -19.823 0.224 1.00 0.00 O ATOM 260 OD2 ASP A 20 -12.925 -20.634 2.040 1.00 0.00 O ATOM 0 H ASP A 20 -12.793 -17.610 -0.603 1.00 0.00 H new ATOM 0 HA ASP A 20 -11.496 -17.806 1.962 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -11.395 -19.564 -0.523 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -10.724 -19.988 1.039 1.00 0.00 H new ATOM 265 N THR A 21 -9.762 -17.437 -0.829 1.00 0.00 N ATOM 266 CA THR A 21 -8.447 -17.152 -1.371 1.00 0.00 C ATOM 267 C THR A 21 -8.358 -15.752 -1.973 1.00 0.00 C ATOM 268 O THR A 21 -7.436 -15.455 -2.732 1.00 0.00 O ATOM 269 CB THR A 21 -8.070 -18.197 -2.436 1.00 0.00 C ATOM 270 OG1 THR A 21 -9.199 -18.461 -3.283 1.00 0.00 O ATOM 271 CG2 THR A 21 -7.600 -19.489 -1.786 1.00 0.00 C ATOM 0 H THR A 21 -10.482 -17.598 -1.534 1.00 0.00 H new ATOM 0 HA THR A 21 -7.744 -17.201 -0.540 1.00 0.00 H new ATOM 0 HB THR A 21 -7.253 -17.796 -3.035 1.00 0.00 H new ATOM 0 HG1 THR A 21 -8.952 -19.126 -3.960 1.00 0.00 H new ATOM 0 HG21 THR A 21 -7.339 -20.212 -2.559 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.725 -19.288 -1.168 1.00 0.00 H new ATOM 0 HG23 THR A 21 -8.398 -19.895 -1.164 1.00 0.00 H new ATOM 279 N SER A 22 -9.301 -14.890 -1.634 1.00 0.00 N ATOM 280 CA SER A 22 -9.286 -13.530 -2.146 1.00 0.00 C ATOM 281 C SER A 22 -9.861 -12.542 -1.139 1.00 0.00 C ATOM 282 O SER A 22 -10.847 -12.828 -0.452 1.00 0.00 O ATOM 283 CB SER A 22 -10.038 -13.451 -3.475 1.00 0.00 C ATOM 284 OG SER A 22 -11.287 -14.114 -3.406 1.00 0.00 O ATOM 0 H SER A 22 -10.080 -15.104 -1.012 1.00 0.00 H new ATOM 0 HA SER A 22 -8.246 -13.251 -2.316 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.194 -12.406 -3.744 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.432 -13.896 -4.264 1.00 0.00 H new ATOM 0 HG SER A 22 -11.743 -14.044 -4.271 1.00 0.00 H new ATOM 290 N ILE A 23 -9.227 -11.382 -1.056 1.00 0.00 N ATOM 291 CA ILE A 23 -9.637 -10.337 -0.132 1.00 0.00 C ATOM 292 C ILE A 23 -9.944 -9.052 -0.884 1.00 0.00 C ATOM 293 O ILE A 23 -9.598 -8.909 -2.057 1.00 0.00 O ATOM 294 CB ILE A 23 -8.526 -10.009 0.891 1.00 0.00 C ATOM 295 CG1 ILE A 23 -7.336 -9.364 0.167 1.00 0.00 C ATOM 296 CG2 ILE A 23 -8.091 -11.266 1.632 1.00 0.00 C ATOM 297 CD1 ILE A 23 -6.384 -8.612 1.071 1.00 0.00 C ATOM 0 H ILE A 23 -8.416 -11.140 -1.626 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.520 -10.711 0.386 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.915 -9.306 1.627 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.781 -10.142 -0.357 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.716 -8.678 -0.590 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -7.308 -11.014 2.348 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -8.944 -11.690 2.162 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -7.709 -11.995 0.918 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.574 -8.190 0.476 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.920 -7.809 1.576 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.971 -9.295 1.813 1.00 0.00 H new ATOM 309 N VAL A 24 -10.588 -8.124 -0.203 1.00 0.00 N ATOM 310 CA VAL A 24 -10.698 -6.767 -0.690 1.00 0.00 C ATOM 311 C VAL A 24 -9.965 -5.847 0.274 1.00 0.00 C ATOM 312 O VAL A 24 -10.431 -5.589 1.385 1.00 0.00 O ATOM 313 CB VAL A 24 -12.167 -6.311 -0.845 1.00 0.00 C ATOM 314 CG1 VAL A 24 -12.235 -4.866 -1.317 1.00 0.00 C ATOM 315 CG2 VAL A 24 -12.907 -7.218 -1.816 1.00 0.00 C ATOM 0 H VAL A 24 -11.045 -8.289 0.694 1.00 0.00 H new ATOM 0 HA VAL A 24 -10.251 -6.723 -1.683 1.00 0.00 H new ATOM 0 HB VAL A 24 -12.649 -6.378 0.130 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -13.278 -4.565 -1.420 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -11.742 -4.222 -0.589 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -11.735 -4.774 -2.281 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -13.939 -6.882 -1.913 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -12.421 -7.181 -2.791 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.892 -8.241 -1.441 1.00 0.00 H new ATOM 325 N VAL A 25 -8.802 -5.385 -0.146 1.00 0.00 N ATOM 326 CA VAL A 25 -7.979 -4.524 0.682 1.00 0.00 C ATOM 327 C VAL A 25 -8.327 -3.063 0.413 1.00 0.00 C ATOM 328 O VAL A 25 -8.190 -2.569 -0.709 1.00 0.00 O ATOM 329 CB VAL A 25 -6.466 -4.799 0.458 1.00 0.00 C ATOM 330 CG1 VAL A 25 -6.126 -4.847 -1.019 1.00 0.00 C ATOM 331 CG2 VAL A 25 -5.596 -3.778 1.172 1.00 0.00 C ATOM 0 H VAL A 25 -8.404 -5.593 -1.062 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.188 -4.744 1.729 1.00 0.00 H new ATOM 0 HB VAL A 25 -6.254 -5.777 0.889 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.060 -5.041 -1.141 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.697 -5.642 -1.498 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.376 -3.892 -1.481 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -4.545 -4.005 0.991 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.822 -2.780 0.795 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.796 -3.815 2.243 1.00 0.00 H new ATOM 341 N ARG A 26 -8.825 -2.392 1.440 1.00 0.00 N ATOM 342 CA ARG A 26 -9.273 -1.015 1.309 1.00 0.00 C ATOM 343 C ARG A 26 -8.469 -0.094 2.211 1.00 0.00 C ATOM 344 O ARG A 26 -8.386 -0.306 3.422 1.00 0.00 O ATOM 345 CB ARG A 26 -10.757 -0.903 1.653 1.00 0.00 C ATOM 346 CG ARG A 26 -11.661 -1.702 0.734 1.00 0.00 C ATOM 347 CD ARG A 26 -13.125 -1.487 1.075 1.00 0.00 C ATOM 348 NE ARG A 26 -13.497 -0.073 1.012 1.00 0.00 N ATOM 349 CZ ARG A 26 -14.720 0.388 1.265 1.00 0.00 C ATOM 350 NH1 ARG A 26 -15.698 -0.450 1.584 1.00 0.00 N ATOM 351 NH2 ARG A 26 -14.961 1.691 1.196 1.00 0.00 N ATOM 0 H ARG A 26 -8.929 -2.781 2.377 1.00 0.00 H new ATOM 0 HA ARG A 26 -9.120 -0.710 0.274 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.909 -1.239 2.679 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -11.051 0.146 1.614 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.480 -1.411 -0.301 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.419 -2.762 0.814 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -13.746 -2.057 0.384 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -13.325 -1.871 2.075 1.00 0.00 H new ATOM 0 HE ARG A 26 -12.775 0.601 0.759 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -15.514 -1.452 1.636 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -16.633 -0.092 1.777 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -14.210 2.336 0.950 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -15.897 2.047 1.389 1.00 0.00 H new ATOM 365 N TRP A 27 -7.889 0.929 1.620 1.00 0.00 N ATOM 366 CA TRP A 27 -7.097 1.892 2.363 1.00 0.00 C ATOM 367 C TRP A 27 -7.803 3.239 2.407 1.00 0.00 C ATOM 368 O TRP A 27 -8.470 3.639 1.450 1.00 0.00 O ATOM 369 CB TRP A 27 -5.701 2.029 1.741 1.00 0.00 C ATOM 370 CG TRP A 27 -5.719 2.226 0.256 1.00 0.00 C ATOM 371 CD1 TRP A 27 -5.784 3.412 -0.414 1.00 0.00 C ATOM 372 CD2 TRP A 27 -5.670 1.202 -0.746 1.00 0.00 C ATOM 373 NE1 TRP A 27 -5.787 3.190 -1.768 1.00 0.00 N ATOM 374 CE2 TRP A 27 -5.713 1.840 -1.997 1.00 0.00 C ATOM 375 CE3 TRP A 27 -5.595 -0.193 -0.703 1.00 0.00 C ATOM 376 CZ2 TRP A 27 -5.685 1.132 -3.196 1.00 0.00 C ATOM 377 CZ3 TRP A 27 -5.566 -0.895 -1.893 1.00 0.00 C ATOM 378 CH2 TRP A 27 -5.609 -0.232 -3.126 1.00 0.00 C ATOM 0 H TRP A 27 -7.951 1.118 0.620 1.00 0.00 H new ATOM 0 HA TRP A 27 -6.982 1.534 3.386 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -5.188 2.872 2.204 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -5.121 1.136 1.973 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -5.827 4.385 0.053 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -5.836 3.912 -2.487 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -5.560 -0.713 0.243 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -5.722 1.642 -4.147 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.509 -1.973 -1.872 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -5.582 -0.809 -4.039 1.00 0.00 H new ATOM 389 N SER A 28 -7.678 3.915 3.535 1.00 0.00 N ATOM 390 CA SER A 28 -8.255 5.234 3.698 1.00 0.00 C ATOM 391 C SER A 28 -7.418 6.254 2.936 1.00 0.00 C ATOM 392 O SER A 28 -6.199 6.115 2.847 1.00 0.00 O ATOM 393 CB SER A 28 -8.302 5.593 5.182 1.00 0.00 C ATOM 394 OG SER A 28 -8.923 4.568 5.941 1.00 0.00 O ATOM 0 H SER A 28 -7.179 3.569 4.355 1.00 0.00 H new ATOM 0 HA SER A 28 -9.270 5.241 3.301 1.00 0.00 H new ATOM 0 HB2 SER A 28 -7.290 5.759 5.550 1.00 0.00 H new ATOM 0 HB3 SER A 28 -8.847 6.528 5.315 1.00 0.00 H new ATOM 0 HG SER A 28 -8.937 4.824 6.887 1.00 0.00 H new ATOM 400 N ARG A 29 -8.069 7.260 2.374 1.00 0.00 N ATOM 401 CA ARG A 29 -7.358 8.304 1.656 1.00 0.00 C ATOM 402 C ARG A 29 -6.566 9.171 2.623 1.00 0.00 C ATOM 403 O ARG A 29 -7.076 9.582 3.667 1.00 0.00 O ATOM 404 CB ARG A 29 -8.323 9.156 0.829 1.00 0.00 C ATOM 405 CG ARG A 29 -7.743 10.469 0.321 1.00 0.00 C ATOM 406 CD ARG A 29 -7.252 10.348 -1.115 1.00 0.00 C ATOM 407 NE ARG A 29 -8.355 10.123 -2.049 1.00 0.00 N ATOM 408 CZ ARG A 29 -8.203 9.962 -3.364 1.00 0.00 C ATOM 409 NH1 ARG A 29 -6.994 9.970 -3.908 1.00 0.00 N ATOM 410 NH2 ARG A 29 -9.267 9.787 -4.136 1.00 0.00 N ATOM 0 H ARG A 29 -9.082 7.375 2.401 1.00 0.00 H new ATOM 0 HA ARG A 29 -6.659 7.828 0.969 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -8.661 8.570 -0.026 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -9.203 9.374 1.434 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -8.501 11.250 0.382 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -6.918 10.775 0.964 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -6.719 11.257 -1.395 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -6.541 9.525 -1.188 1.00 0.00 H new ATOM 0 HE ARG A 29 -9.301 10.087 -1.670 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -6.171 10.100 -3.320 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -6.887 9.846 -4.915 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -10.200 9.776 -3.724 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -9.152 9.664 -5.142 1.00 0.00 H new ATOM 424 N PRO A 30 -5.300 9.424 2.279 1.00 0.00 N ATOM 425 CA PRO A 30 -4.390 10.258 3.068 1.00 0.00 C ATOM 426 C PRO A 30 -4.964 11.646 3.328 1.00 0.00 C ATOM 427 O PRO A 30 -5.361 11.920 4.480 1.00 0.00 O ATOM 428 CB PRO A 30 -3.125 10.352 2.201 1.00 0.00 C ATOM 429 CG PRO A 30 -3.531 9.869 0.846 1.00 0.00 C ATOM 430 CD PRO A 30 -4.660 8.909 1.067 1.00 0.00 C ATOM 431 OXT PRO A 30 -5.031 12.453 2.377 1.00 0.00 O ATOM 0 HA PRO A 30 -4.205 9.832 4.054 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -2.755 11.376 2.158 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -2.322 9.740 2.611 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -3.844 10.700 0.214 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -2.698 9.381 0.341 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -5.349 8.895 0.222 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -4.301 7.889 1.203 1.00 0.00 H new TER 439 PRO A 30 ATOM 440 N MET B 31 -13.588 23.527 -25.758 1.00 0.00 N ATOM 441 CA MET B 31 -14.727 24.163 -25.056 1.00 0.00 C ATOM 442 C MET B 31 -14.337 24.545 -23.633 1.00 0.00 C ATOM 443 O MET B 31 -14.188 25.726 -23.321 1.00 0.00 O ATOM 444 CB MET B 31 -15.941 23.229 -25.029 1.00 0.00 C ATOM 445 CG MET B 31 -16.452 22.851 -26.409 1.00 0.00 C ATOM 446 SD MET B 31 -17.917 21.798 -26.351 1.00 0.00 S ATOM 447 CE MET B 31 -19.111 22.922 -25.629 1.00 0.00 C ATOM 0 HA MET B 31 -14.993 25.067 -25.603 1.00 0.00 H new ATOM 0 HB2 MET B 31 -15.677 22.320 -24.488 1.00 0.00 H new ATOM 0 HB3 MET B 31 -16.746 23.710 -24.472 1.00 0.00 H new ATOM 0 HG2 MET B 31 -16.685 23.759 -26.966 1.00 0.00 H new ATOM 0 HG3 MET B 31 -15.662 22.336 -26.955 1.00 0.00 H new ATOM 0 HE1 MET B 31 -20.119 22.561 -25.831 1.00 0.00 H new ATOM 0 HE2 MET B 31 -18.954 22.976 -24.552 1.00 0.00 H new ATOM 0 HE3 MET B 31 -18.987 23.914 -26.064 1.00 0.00 H new ATOM 459 N ARG B 32 -14.162 23.549 -22.769 1.00 0.00 N ATOM 460 CA ARG B 32 -13.813 23.805 -21.376 1.00 0.00 C ATOM 461 C ARG B 32 -12.650 22.922 -20.941 1.00 0.00 C ATOM 462 O ARG B 32 -12.846 21.819 -20.429 1.00 0.00 O ATOM 463 CB ARG B 32 -15.026 23.577 -20.465 1.00 0.00 C ATOM 464 CG ARG B 32 -16.231 24.422 -20.844 1.00 0.00 C ATOM 465 CD ARG B 32 -17.395 24.226 -19.888 1.00 0.00 C ATOM 466 NE ARG B 32 -18.578 24.962 -20.334 1.00 0.00 N ATOM 467 CZ ARG B 32 -19.723 25.028 -19.659 1.00 0.00 C ATOM 468 NH1 ARG B 32 -19.843 24.427 -18.482 1.00 0.00 N ATOM 469 NH2 ARG B 32 -20.748 25.704 -20.162 1.00 0.00 N ATOM 0 H ARG B 32 -14.256 22.562 -23.008 1.00 0.00 H new ATOM 0 HA ARG B 32 -13.505 24.847 -21.289 1.00 0.00 H new ATOM 0 HB2 ARG B 32 -15.304 22.524 -20.500 1.00 0.00 H new ATOM 0 HB3 ARG B 32 -14.745 23.799 -19.435 1.00 0.00 H new ATOM 0 HG2 ARG B 32 -15.946 25.474 -20.855 1.00 0.00 H new ATOM 0 HG3 ARG B 32 -16.547 24.167 -21.855 1.00 0.00 H new ATOM 0 HD2 ARG B 32 -17.631 23.165 -19.812 1.00 0.00 H new ATOM 0 HD3 ARG B 32 -17.110 24.561 -18.891 1.00 0.00 H new ATOM 0 HE ARG B 32 -18.521 25.459 -21.223 1.00 0.00 H new ATOM 0 HH11 ARG B 32 -19.055 23.911 -18.090 1.00 0.00 H new ATOM 0 HH12 ARG B 32 -20.723 24.481 -17.969 1.00 0.00 H new ATOM 0 HH21 ARG B 32 -20.657 26.171 -21.064 1.00 0.00 H new ATOM 0 HH22 ARG B 32 -21.627 25.756 -19.647 1.00 0.00 H new ATOM 483 N GLY B 33 -11.439 23.413 -21.153 1.00 0.00 N ATOM 484 CA GLY B 33 -10.259 22.668 -20.772 1.00 0.00 C ATOM 485 C GLY B 33 -9.659 23.190 -19.486 1.00 0.00 C ATOM 486 O GLY B 33 -8.801 24.073 -19.505 1.00 0.00 O ATOM 0 H GLY B 33 -11.252 24.318 -21.584 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -10.516 21.615 -20.653 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -9.518 22.727 -21.569 1.00 0.00 H new ATOM 490 N SER B 34 -10.117 22.659 -18.366 1.00 0.00 N ATOM 491 CA SER B 34 -9.677 23.128 -17.064 1.00 0.00 C ATOM 492 C SER B 34 -9.056 21.992 -16.256 1.00 0.00 C ATOM 493 O SER B 34 -9.721 21.365 -15.429 1.00 0.00 O ATOM 494 CB SER B 34 -10.863 23.731 -16.309 1.00 0.00 C ATOM 495 OG SER B 34 -11.488 24.745 -17.083 1.00 0.00 O ATOM 0 H SER B 34 -10.797 21.899 -18.332 1.00 0.00 H new ATOM 0 HA SER B 34 -8.914 23.893 -17.208 1.00 0.00 H new ATOM 0 HB2 SER B 34 -11.585 22.950 -16.073 1.00 0.00 H new ATOM 0 HB3 SER B 34 -10.523 24.148 -15.361 1.00 0.00 H new ATOM 0 HG SER B 34 -12.245 25.117 -16.584 1.00 0.00 H new ATOM 501 N ASN B 35 -7.783 21.721 -16.511 1.00 0.00 N ATOM 502 CA ASN B 35 -7.059 20.702 -15.765 1.00 0.00 C ATOM 503 C ASN B 35 -6.669 21.237 -14.398 1.00 0.00 C ATOM 504 O ASN B 35 -5.955 22.238 -14.295 1.00 0.00 O ATOM 505 CB ASN B 35 -5.812 20.244 -16.531 1.00 0.00 C ATOM 506 CG ASN B 35 -4.933 19.307 -15.718 1.00 0.00 C ATOM 507 OD1 ASN B 35 -5.162 18.098 -15.675 1.00 0.00 O ATOM 508 ND2 ASN B 35 -3.910 19.855 -15.078 1.00 0.00 N ATOM 0 H ASN B 35 -7.231 22.192 -17.228 1.00 0.00 H new ATOM 0 HA ASN B 35 -7.714 19.840 -15.637 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -6.119 19.742 -17.449 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -5.230 21.118 -16.824 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -3.281 19.271 -14.527 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -3.751 20.861 -15.137 1.00 0.00 H new ATOM 515 N ALA B 36 -7.151 20.580 -13.357 1.00 0.00 N ATOM 516 CA ALA B 36 -6.871 20.999 -11.996 1.00 0.00 C ATOM 517 C ALA B 36 -5.829 20.090 -11.355 1.00 0.00 C ATOM 518 O ALA B 36 -6.127 18.949 -10.990 1.00 0.00 O ATOM 519 CB ALA B 36 -8.151 21.006 -11.172 1.00 0.00 C ATOM 0 H ALA B 36 -7.741 19.751 -13.430 1.00 0.00 H new ATOM 0 HA ALA B 36 -6.468 22.012 -12.024 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -7.926 21.322 -10.153 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -8.866 21.697 -11.617 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -8.578 20.003 -11.155 1.00 0.00 H new ATOM 525 N PRO B 37 -4.588 20.575 -11.224 1.00 0.00 N ATOM 526 CA PRO B 37 -3.515 19.835 -10.570 1.00 0.00 C ATOM 527 C PRO B 37 -3.565 20.018 -9.058 1.00 0.00 C ATOM 528 O PRO B 37 -2.581 20.411 -8.431 1.00 0.00 O ATOM 529 CB PRO B 37 -2.259 20.472 -11.160 1.00 0.00 C ATOM 530 CG PRO B 37 -2.643 21.889 -11.425 1.00 0.00 C ATOM 531 CD PRO B 37 -4.128 21.894 -11.701 1.00 0.00 C ATOM 0 HA PRO B 37 -3.571 18.759 -10.732 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -1.421 20.412 -10.466 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -1.951 19.967 -12.076 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -2.407 22.520 -10.568 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -2.090 22.287 -12.276 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -4.629 22.706 -11.173 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -4.336 22.028 -12.763 1.00 0.00 H new ATOM 539 N GLN B 38 -4.733 19.728 -8.493 1.00 0.00 N ATOM 540 CA GLN B 38 -5.002 19.946 -7.074 1.00 0.00 C ATOM 541 C GLN B 38 -3.960 19.264 -6.188 1.00 0.00 C ATOM 542 O GLN B 38 -3.463 18.183 -6.507 1.00 0.00 O ATOM 543 CB GLN B 38 -6.405 19.446 -6.724 1.00 0.00 C ATOM 544 CG GLN B 38 -6.659 17.996 -7.096 1.00 0.00 C ATOM 545 CD GLN B 38 -8.049 17.540 -6.708 1.00 0.00 C ATOM 546 OE1 GLN B 38 -8.997 17.666 -7.483 1.00 0.00 O ATOM 547 NE2 GLN B 38 -8.181 17.010 -5.505 1.00 0.00 N ATOM 0 H GLN B 38 -5.522 19.334 -9.006 1.00 0.00 H new ATOM 0 HA GLN B 38 -4.943 21.018 -6.885 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -6.566 19.568 -5.653 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -7.139 20.073 -7.230 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -6.524 17.869 -8.170 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -5.921 17.362 -6.605 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -7.369 16.924 -4.894 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -9.095 16.687 -5.188 1.00 0.00 H new ATOM 556 N PRO B 39 -3.610 19.915 -5.067 1.00 0.00 N ATOM 557 CA PRO B 39 -2.603 19.413 -4.127 1.00 0.00 C ATOM 558 C PRO B 39 -3.022 18.113 -3.450 1.00 0.00 C ATOM 559 O PRO B 39 -4.215 17.799 -3.357 1.00 0.00 O ATOM 560 CB PRO B 39 -2.480 20.535 -3.092 1.00 0.00 C ATOM 561 CG PRO B 39 -3.758 21.290 -3.191 1.00 0.00 C ATOM 562 CD PRO B 39 -4.173 21.204 -4.629 1.00 0.00 C ATOM 0 HA PRO B 39 -1.668 19.177 -4.635 1.00 0.00 H new ATOM 0 HB2 PRO B 39 -2.335 20.133 -2.089 1.00 0.00 H new ATOM 0 HB3 PRO B 39 -1.625 21.176 -3.305 1.00 0.00 H new ATOM 0 HG2 PRO B 39 -4.518 20.860 -2.538 1.00 0.00 H new ATOM 0 HG3 PRO B 39 -3.624 22.327 -2.884 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -5.257 21.227 -4.737 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -3.777 22.035 -5.213 1.00 0.00 H new ATOM 570 N SER B 40 -2.024 17.368 -2.974 1.00 0.00 N ATOM 571 CA SER B 40 -2.242 16.079 -2.321 1.00 0.00 C ATOM 572 C SER B 40 -2.974 15.113 -3.250 1.00 0.00 C ATOM 573 O SER B 40 -3.801 14.313 -2.814 1.00 0.00 O ATOM 574 CB SER B 40 -3.020 16.269 -1.015 1.00 0.00 C ATOM 575 OG SER B 40 -2.361 17.189 -0.155 1.00 0.00 O ATOM 0 H SER B 40 -1.043 17.642 -3.031 1.00 0.00 H new ATOM 0 HA SER B 40 -1.270 15.646 -2.086 1.00 0.00 H new ATOM 0 HB2 SER B 40 -4.025 16.629 -1.236 1.00 0.00 H new ATOM 0 HB3 SER B 40 -3.129 15.309 -0.510 1.00 0.00 H new ATOM 0 HG SER B 40 -2.879 17.294 0.670 1.00 0.00 H new ATOM 581 N HIS B 41 -2.666 15.197 -4.537 1.00 0.00 N ATOM 582 CA HIS B 41 -3.292 14.338 -5.532 1.00 0.00 C ATOM 583 C HIS B 41 -2.498 13.051 -5.711 1.00 0.00 C ATOM 584 O HIS B 41 -1.358 13.075 -6.183 1.00 0.00 O ATOM 585 CB HIS B 41 -3.412 15.076 -6.872 1.00 0.00 C ATOM 586 CG HIS B 41 -3.938 14.229 -7.996 1.00 0.00 C ATOM 587 ND1 HIS B 41 -5.270 13.912 -8.141 1.00 0.00 N ATOM 588 CD2 HIS B 41 -3.300 13.637 -9.034 1.00 0.00 C ATOM 589 CE1 HIS B 41 -5.428 13.162 -9.214 1.00 0.00 C ATOM 590 NE2 HIS B 41 -4.249 12.980 -9.774 1.00 0.00 N ATOM 0 H HIS B 41 -1.984 15.854 -4.917 1.00 0.00 H new ATOM 0 HA HIS B 41 -4.291 14.080 -5.180 1.00 0.00 H new ATOM 0 HB2 HIS B 41 -4.068 15.937 -6.743 1.00 0.00 H new ATOM 0 HB3 HIS B 41 -2.431 15.462 -7.151 1.00 0.00 H new ATOM 0 HD2 HIS B 41 -2.241 13.675 -9.240 1.00 0.00 H new ATOM 0 HE1 HIS B 41 -6.365 12.764 -9.573 1.00 0.00 H new ATOM 0 HE2 HIS B 41 -4.071 12.439 -10.620 1.00 0.00 H new ATOM 599 N ILE B 42 -3.098 11.935 -5.328 1.00 0.00 N ATOM 600 CA ILE B 42 -2.506 10.632 -5.573 1.00 0.00 C ATOM 601 C ILE B 42 -2.858 10.181 -6.984 1.00 0.00 C ATOM 602 O ILE B 42 -4.031 10.120 -7.359 1.00 0.00 O ATOM 603 CB ILE B 42 -2.973 9.556 -4.556 1.00 0.00 C ATOM 604 CG1 ILE B 42 -2.343 9.777 -3.172 1.00 0.00 C ATOM 605 CG2 ILE B 42 -2.623 8.162 -5.062 1.00 0.00 C ATOM 606 CD1 ILE B 42 -2.828 11.012 -2.446 1.00 0.00 C ATOM 0 H ILE B 42 -3.996 11.907 -4.845 1.00 0.00 H new ATOM 0 HA ILE B 42 -1.428 10.737 -5.455 1.00 0.00 H new ATOM 0 HB ILE B 42 -4.055 9.646 -4.457 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -2.547 8.904 -2.552 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -1.261 9.841 -3.287 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -2.956 7.418 -4.339 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -3.118 7.987 -6.017 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -1.544 8.083 -5.193 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -2.329 11.085 -1.480 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -2.600 11.897 -3.040 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -3.905 10.945 -2.294 1.00 0.00 H new ATOM 618 N SER B 43 -1.834 9.895 -7.766 1.00 0.00 N ATOM 619 CA SER B 43 -2.019 9.487 -9.143 1.00 0.00 C ATOM 620 C SER B 43 -2.397 8.012 -9.215 1.00 0.00 C ATOM 621 O SER B 43 -3.341 7.637 -9.908 1.00 0.00 O ATOM 622 CB SER B 43 -0.738 9.757 -9.932 1.00 0.00 C ATOM 623 OG SER B 43 -0.323 11.105 -9.770 1.00 0.00 O ATOM 0 H SER B 43 -0.860 9.939 -7.467 1.00 0.00 H new ATOM 0 HA SER B 43 -2.833 10.064 -9.582 1.00 0.00 H new ATOM 0 HB2 SER B 43 0.051 9.085 -9.594 1.00 0.00 H new ATOM 0 HB3 SER B 43 -0.905 9.547 -10.989 1.00 0.00 H new ATOM 0 HG SER B 43 0.499 11.258 -10.281 1.00 0.00 H new ATOM 629 N LYS B 44 -1.675 7.180 -8.470 1.00 0.00 N ATOM 630 CA LYS B 44 -1.925 5.746 -8.474 1.00 0.00 C ATOM 631 C LYS B 44 -1.406 5.093 -7.198 1.00 0.00 C ATOM 632 O LYS B 44 -0.411 5.537 -6.616 1.00 0.00 O ATOM 633 CB LYS B 44 -1.267 5.097 -9.697 1.00 0.00 C ATOM 634 CG LYS B 44 0.240 5.295 -9.757 1.00 0.00 C ATOM 635 CD LYS B 44 0.833 4.696 -11.020 1.00 0.00 C ATOM 636 CE LYS B 44 2.336 4.898 -11.078 1.00 0.00 C ATOM 637 NZ LYS B 44 2.928 4.302 -12.303 1.00 0.00 N ATOM 0 H LYS B 44 -0.914 7.475 -7.858 1.00 0.00 H new ATOM 0 HA LYS B 44 -3.003 5.593 -8.522 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -1.484 4.029 -9.692 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -1.715 5.509 -10.601 1.00 0.00 H new ATOM 0 HG2 LYS B 44 0.469 6.360 -9.716 1.00 0.00 H new ATOM 0 HG3 LYS B 44 0.703 4.836 -8.884 1.00 0.00 H new ATOM 0 HD2 LYS B 44 0.606 3.631 -11.060 1.00 0.00 H new ATOM 0 HD3 LYS B 44 0.369 5.154 -11.894 1.00 0.00 H new ATOM 0 HE2 LYS B 44 2.560 5.964 -11.048 1.00 0.00 H new ATOM 0 HE3 LYS B 44 2.797 4.450 -10.197 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 3.956 4.461 -12.305 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 2.736 3.280 -12.319 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 2.507 4.747 -13.144 1.00 0.00 H new ATOM 651 N TYR B 45 -2.097 4.053 -6.764 1.00 0.00 N ATOM 652 CA TYR B 45 -1.666 3.252 -5.631 1.00 0.00 C ATOM 653 C TYR B 45 -1.115 1.927 -6.136 1.00 0.00 C ATOM 654 O TYR B 45 -1.750 1.264 -6.955 1.00 0.00 O ATOM 655 CB TYR B 45 -2.828 2.958 -4.683 1.00 0.00 C ATOM 656 CG TYR B 45 -3.562 4.171 -4.160 1.00 0.00 C ATOM 657 CD1 TYR B 45 -4.781 4.552 -4.705 1.00 0.00 C ATOM 658 CD2 TYR B 45 -3.054 4.916 -3.103 1.00 0.00 C ATOM 659 CE1 TYR B 45 -5.473 5.640 -4.211 1.00 0.00 C ATOM 660 CE2 TYR B 45 -3.739 6.010 -2.606 1.00 0.00 C ATOM 661 CZ TYR B 45 -4.949 6.365 -3.163 1.00 0.00 C ATOM 662 OH TYR B 45 -5.643 7.446 -2.667 1.00 0.00 O ATOM 0 H TYR B 45 -2.971 3.740 -7.186 1.00 0.00 H new ATOM 0 HA TYR B 45 -0.903 3.814 -5.092 1.00 0.00 H new ATOM 0 HB2 TYR B 45 -3.542 2.317 -5.199 1.00 0.00 H new ATOM 0 HB3 TYR B 45 -2.447 2.391 -3.834 1.00 0.00 H new ATOM 0 HD1 TYR B 45 -5.194 3.988 -5.528 1.00 0.00 H new ATOM 0 HD2 TYR B 45 -2.109 4.636 -2.662 1.00 0.00 H new ATOM 0 HE1 TYR B 45 -6.421 5.922 -4.644 1.00 0.00 H new ATOM 0 HE2 TYR B 45 -3.329 6.582 -1.787 1.00 0.00 H new ATOM 0 HH TYR B 45 -6.577 7.193 -2.515 1.00 0.00 H new ATOM 672 N ILE B 46 0.055 1.547 -5.664 1.00 0.00 N ATOM 673 CA ILE B 46 0.632 0.263 -6.019 1.00 0.00 C ATOM 674 C ILE B 46 0.522 -0.694 -4.841 1.00 0.00 C ATOM 675 O ILE B 46 1.069 -0.442 -3.766 1.00 0.00 O ATOM 676 CB ILE B 46 2.116 0.378 -6.462 1.00 0.00 C ATOM 677 CG1 ILE B 46 2.243 1.115 -7.802 1.00 0.00 C ATOM 678 CG2 ILE B 46 2.755 -1.002 -6.569 1.00 0.00 C ATOM 679 CD1 ILE B 46 1.993 2.605 -7.724 1.00 0.00 C ATOM 0 H ILE B 46 0.627 2.108 -5.033 1.00 0.00 H new ATOM 0 HA ILE B 46 0.068 -0.119 -6.870 1.00 0.00 H new ATOM 0 HB ILE B 46 2.641 0.955 -5.701 1.00 0.00 H new ATOM 0 HG12 ILE B 46 3.243 0.948 -8.201 1.00 0.00 H new ATOM 0 HG13 ILE B 46 1.540 0.678 -8.511 1.00 0.00 H new ATOM 0 HG21 ILE B 46 3.794 -0.899 -6.881 1.00 0.00 H new ATOM 0 HG22 ILE B 46 2.715 -1.498 -5.599 1.00 0.00 H new ATOM 0 HG23 ILE B 46 2.214 -1.598 -7.304 1.00 0.00 H new ATOM 0 HD11 ILE B 46 2.104 3.045 -8.715 1.00 0.00 H new ATOM 0 HD12 ILE B 46 0.982 2.786 -7.358 1.00 0.00 H new ATOM 0 HD13 ILE B 46 2.713 3.060 -7.043 1.00 0.00 H new ATOM 691 N LEU B 47 -0.208 -1.777 -5.043 1.00 0.00 N ATOM 692 CA LEU B 47 -0.372 -2.793 -4.019 1.00 0.00 C ATOM 693 C LEU B 47 0.642 -3.903 -4.268 1.00 0.00 C ATOM 694 O LEU B 47 0.587 -4.581 -5.293 1.00 0.00 O ATOM 695 CB LEU B 47 -1.806 -3.353 -4.062 1.00 0.00 C ATOM 696 CG LEU B 47 -2.352 -3.986 -2.767 1.00 0.00 C ATOM 697 CD1 LEU B 47 -1.493 -5.146 -2.295 1.00 0.00 C ATOM 698 CD2 LEU B 47 -2.486 -2.946 -1.666 1.00 0.00 C ATOM 0 H LEU B 47 -0.700 -1.976 -5.914 1.00 0.00 H new ATOM 0 HA LEU B 47 -0.204 -2.361 -3.032 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -2.476 -2.544 -4.352 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.852 -4.104 -4.851 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.342 -4.380 -2.999 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -1.914 -5.562 -1.380 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.467 -5.917 -3.066 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.480 -4.793 -2.100 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -2.873 -3.419 -0.764 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.509 -2.510 -1.457 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -3.172 -2.162 -1.987 1.00 0.00 H new ATOM 710 N ARG B 48 1.586 -4.053 -3.353 1.00 0.00 N ATOM 711 CA ARG B 48 2.583 -5.106 -3.455 1.00 0.00 C ATOM 712 C ARG B 48 2.372 -6.153 -2.374 1.00 0.00 C ATOM 713 O ARG B 48 2.236 -5.814 -1.199 1.00 0.00 O ATOM 714 CB ARG B 48 3.994 -4.529 -3.338 1.00 0.00 C ATOM 715 CG ARG B 48 4.545 -3.970 -4.628 1.00 0.00 C ATOM 716 CD ARG B 48 5.939 -3.402 -4.421 1.00 0.00 C ATOM 717 NE ARG B 48 6.497 -2.868 -5.656 1.00 0.00 N ATOM 718 CZ ARG B 48 7.737 -2.395 -5.774 1.00 0.00 C ATOM 719 NH1 ARG B 48 8.555 -2.387 -4.728 1.00 0.00 N ATOM 720 NH2 ARG B 48 8.157 -1.939 -6.947 1.00 0.00 N ATOM 0 H ARG B 48 1.683 -3.458 -2.530 1.00 0.00 H new ATOM 0 HA ARG B 48 2.471 -5.576 -4.432 1.00 0.00 H new ATOM 0 HB2 ARG B 48 3.990 -3.740 -2.586 1.00 0.00 H new ATOM 0 HB3 ARG B 48 4.664 -5.309 -2.978 1.00 0.00 H new ATOM 0 HG2 ARG B 48 4.576 -4.754 -5.385 1.00 0.00 H new ATOM 0 HG3 ARG B 48 3.882 -3.190 -5.004 1.00 0.00 H new ATOM 0 HD2 ARG B 48 5.902 -2.614 -3.669 1.00 0.00 H new ATOM 0 HD3 ARG B 48 6.595 -4.182 -4.034 1.00 0.00 H new ATOM 0 HE ARG B 48 5.900 -2.855 -6.483 1.00 0.00 H new ATOM 0 HH11 ARG B 48 8.235 -2.744 -3.828 1.00 0.00 H new ATOM 0 HH12 ARG B 48 9.503 -2.024 -4.825 1.00 0.00 H new ATOM 0 HH21 ARG B 48 7.532 -1.952 -7.753 1.00 0.00 H new ATOM 0 HH22 ARG B 48 9.105 -1.576 -7.043 1.00 0.00 H new ATOM 734 N TRP B 49 2.341 -7.415 -2.774 1.00 0.00 N ATOM 735 CA TRP B 49 2.227 -8.507 -1.822 1.00 0.00 C ATOM 736 C TRP B 49 3.071 -9.697 -2.266 1.00 0.00 C ATOM 737 O TRP B 49 3.337 -9.875 -3.459 1.00 0.00 O ATOM 738 CB TRP B 49 0.760 -8.924 -1.631 1.00 0.00 C ATOM 739 CG TRP B 49 0.151 -9.620 -2.813 1.00 0.00 C ATOM 740 CD1 TRP B 49 -0.028 -10.965 -2.962 1.00 0.00 C ATOM 741 CD2 TRP B 49 -0.366 -9.012 -4.001 1.00 0.00 C ATOM 742 NE1 TRP B 49 -0.624 -11.229 -4.169 1.00 0.00 N ATOM 743 CE2 TRP B 49 -0.841 -10.048 -4.826 1.00 0.00 C ATOM 744 CE3 TRP B 49 -0.473 -7.695 -4.446 1.00 0.00 C ATOM 745 CZ2 TRP B 49 -1.413 -9.803 -6.071 1.00 0.00 C ATOM 746 CZ3 TRP B 49 -1.040 -7.452 -5.679 1.00 0.00 C ATOM 747 CH2 TRP B 49 -1.505 -8.501 -6.480 1.00 0.00 C ATOM 0 H TRP B 49 2.393 -7.707 -3.750 1.00 0.00 H new ATOM 0 HA TRP B 49 2.604 -8.156 -0.861 1.00 0.00 H new ATOM 0 HB2 TRP B 49 0.692 -9.581 -0.764 1.00 0.00 H new ATOM 0 HB3 TRP B 49 0.170 -8.036 -1.405 1.00 0.00 H new ATOM 0 HD1 TRP B 49 0.258 -11.712 -2.236 1.00 0.00 H new ATOM 0 HE1 TRP B 49 -0.866 -12.156 -4.520 1.00 0.00 H new ATOM 0 HE3 TRP B 49 -0.118 -6.879 -3.835 1.00 0.00 H new ATOM 0 HZ2 TRP B 49 -1.771 -10.611 -6.691 1.00 0.00 H new ATOM 0 HZ3 TRP B 49 -1.127 -6.435 -6.033 1.00 0.00 H new ATOM 0 HH2 TRP B 49 -1.945 -8.278 -7.441 1.00 0.00 H new ATOM 758 N ARG B 50 3.510 -10.487 -1.297 1.00 0.00 N ATOM 759 CA ARG B 50 4.313 -11.673 -1.564 1.00 0.00 C ATOM 760 C ARG B 50 4.272 -12.597 -0.349 1.00 0.00 C ATOM 761 O ARG B 50 3.948 -12.153 0.752 1.00 0.00 O ATOM 762 CB ARG B 50 5.768 -11.280 -1.850 1.00 0.00 C ATOM 763 CG ARG B 50 6.554 -10.921 -0.601 1.00 0.00 C ATOM 764 CD ARG B 50 8.019 -10.695 -0.908 1.00 0.00 C ATOM 765 NE ARG B 50 8.857 -11.017 0.242 1.00 0.00 N ATOM 766 CZ ARG B 50 9.956 -10.349 0.582 1.00 0.00 C ATOM 767 NH1 ARG B 50 10.374 -9.326 -0.152 1.00 0.00 N ATOM 768 NH2 ARG B 50 10.649 -10.719 1.649 1.00 0.00 N ATOM 0 H ARG B 50 3.321 -10.326 -0.308 1.00 0.00 H new ATOM 0 HA ARG B 50 3.905 -12.185 -2.436 1.00 0.00 H new ATOM 0 HB2 ARG B 50 6.266 -12.106 -2.359 1.00 0.00 H new ATOM 0 HB3 ARG B 50 5.779 -10.431 -2.534 1.00 0.00 H new ATOM 0 HG2 ARG B 50 6.133 -10.021 -0.152 1.00 0.00 H new ATOM 0 HG3 ARG B 50 6.455 -11.720 0.134 1.00 0.00 H new ATOM 0 HD2 ARG B 50 8.314 -11.309 -1.759 1.00 0.00 H new ATOM 0 HD3 ARG B 50 8.176 -9.656 -1.196 1.00 0.00 H new ATOM 0 HE ARG B 50 8.582 -11.808 0.825 1.00 0.00 H new ATOM 0 HH11 ARG B 50 9.852 -9.047 -0.983 1.00 0.00 H new ATOM 0 HH12 ARG B 50 11.217 -8.818 0.114 1.00 0.00 H new ATOM 0 HH21 ARG B 50 10.339 -11.514 2.208 1.00 0.00 H new ATOM 0 HH22 ARG B 50 11.492 -10.208 1.912 1.00 0.00 H new ATOM 782 N PRO B 51 4.580 -13.893 -0.528 1.00 0.00 N ATOM 783 CA PRO B 51 4.722 -14.823 0.594 1.00 0.00 C ATOM 784 C PRO B 51 5.861 -14.396 1.517 1.00 0.00 C ATOM 785 O PRO B 51 6.966 -14.125 1.057 1.00 0.00 O ATOM 786 CB PRO B 51 5.045 -16.167 -0.075 1.00 0.00 C ATOM 787 CG PRO B 51 4.615 -16.009 -1.494 1.00 0.00 C ATOM 788 CD PRO B 51 4.801 -14.556 -1.824 1.00 0.00 C ATOM 0 HA PRO B 51 3.828 -14.864 1.216 1.00 0.00 H new ATOM 0 HB2 PRO B 51 6.109 -16.395 -0.009 1.00 0.00 H new ATOM 0 HB3 PRO B 51 4.513 -16.986 0.409 1.00 0.00 H new ATOM 0 HG2 PRO B 51 5.211 -16.638 -2.155 1.00 0.00 H new ATOM 0 HG3 PRO B 51 3.575 -16.308 -1.622 1.00 0.00 H new ATOM 0 HD2 PRO B 51 5.798 -14.355 -2.216 1.00 0.00 H new ATOM 0 HD3 PRO B 51 4.089 -14.218 -2.577 1.00 0.00 H new ATOM 796 N LYS B 52 5.587 -14.338 2.813 1.00 0.00 N ATOM 797 CA LYS B 52 6.550 -13.819 3.783 1.00 0.00 C ATOM 798 C LYS B 52 7.634 -14.852 4.099 1.00 0.00 C ATOM 799 O LYS B 52 8.689 -14.515 4.641 1.00 0.00 O ATOM 800 CB LYS B 52 5.799 -13.388 5.052 1.00 0.00 C ATOM 801 CG LYS B 52 6.635 -12.653 6.093 1.00 0.00 C ATOM 802 CD LYS B 52 7.265 -13.600 7.103 1.00 0.00 C ATOM 803 CE LYS B 52 8.080 -12.842 8.138 1.00 0.00 C ATOM 804 NZ LYS B 52 8.728 -13.755 9.116 1.00 0.00 N ATOM 0 H LYS B 52 4.704 -14.644 3.221 1.00 0.00 H new ATOM 0 HA LYS B 52 7.057 -12.953 3.357 1.00 0.00 H new ATOM 0 HB2 LYS B 52 4.968 -12.746 4.760 1.00 0.00 H new ATOM 0 HB3 LYS B 52 5.369 -14.275 5.517 1.00 0.00 H new ATOM 0 HG2 LYS B 52 7.420 -12.087 5.591 1.00 0.00 H new ATOM 0 HG3 LYS B 52 6.007 -11.932 6.617 1.00 0.00 H new ATOM 0 HD2 LYS B 52 6.485 -14.175 7.602 1.00 0.00 H new ATOM 0 HD3 LYS B 52 7.905 -14.314 6.585 1.00 0.00 H new ATOM 0 HE2 LYS B 52 8.844 -12.249 7.635 1.00 0.00 H new ATOM 0 HE3 LYS B 52 7.433 -12.144 8.668 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 9.273 -13.197 9.803 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 7.999 -14.303 9.616 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 9.366 -14.405 8.614 1.00 0.00 H new ATOM 818 N ASN B 53 7.387 -16.106 3.738 1.00 0.00 N ATOM 819 CA ASN B 53 8.338 -17.181 4.023 1.00 0.00 C ATOM 820 C ASN B 53 9.631 -16.983 3.238 1.00 0.00 C ATOM 821 O ASN B 53 10.701 -17.418 3.663 1.00 0.00 O ATOM 822 CB ASN B 53 7.741 -18.553 3.689 1.00 0.00 C ATOM 823 CG ASN B 53 6.424 -18.813 4.394 1.00 0.00 C ATOM 824 OD1 ASN B 53 6.397 -19.242 5.546 1.00 0.00 O ATOM 825 ND2 ASN B 53 5.323 -18.591 3.692 1.00 0.00 N ATOM 0 H ASN B 53 6.543 -16.405 3.250 1.00 0.00 H new ATOM 0 HA ASN B 53 8.559 -17.146 5.090 1.00 0.00 H new ATOM 0 HB2 ASN B 53 7.591 -18.625 2.612 1.00 0.00 H new ATOM 0 HB3 ASN B 53 8.454 -19.330 3.964 1.00 0.00 H new ATOM 0 HD21 ASN B 53 4.409 -18.777 4.105 1.00 0.00 H new ATOM 0 HD22 ASN B 53 5.389 -18.234 2.739 1.00 0.00 H new ATOM 832 N SER B 54 9.524 -16.327 2.092 1.00 0.00 N ATOM 833 CA SER B 54 10.686 -16.040 1.264 1.00 0.00 C ATOM 834 C SER B 54 10.561 -14.659 0.626 1.00 0.00 C ATOM 835 O SER B 54 9.701 -13.869 1.017 1.00 0.00 O ATOM 836 CB SER B 54 10.845 -17.118 0.189 1.00 0.00 C ATOM 837 OG SER B 54 10.990 -18.404 0.775 1.00 0.00 O ATOM 0 H SER B 54 8.642 -15.983 1.713 1.00 0.00 H new ATOM 0 HA SER B 54 11.575 -16.044 1.895 1.00 0.00 H new ATOM 0 HB2 SER B 54 9.977 -17.110 -0.470 1.00 0.00 H new ATOM 0 HB3 SER B 54 11.715 -16.895 -0.428 1.00 0.00 H new ATOM 0 HG SER B 54 11.088 -19.076 0.069 1.00 0.00 H new ATOM 843 N VAL B 55 11.425 -14.352 -0.330 1.00 0.00 N ATOM 844 CA VAL B 55 11.329 -13.098 -1.048 1.00 0.00 C ATOM 845 C VAL B 55 10.576 -13.281 -2.369 1.00 0.00 C ATOM 846 O VAL B 55 9.589 -12.591 -2.626 1.00 0.00 O ATOM 847 CB VAL B 55 12.727 -12.473 -1.292 1.00 0.00 C ATOM 848 CG1 VAL B 55 13.702 -13.483 -1.880 1.00 0.00 C ATOM 849 CG2 VAL B 55 12.616 -11.260 -2.192 1.00 0.00 C ATOM 0 H VAL B 55 12.195 -14.953 -0.623 1.00 0.00 H new ATOM 0 HA VAL B 55 10.763 -12.406 -0.425 1.00 0.00 H new ATOM 0 HB VAL B 55 13.120 -12.161 -0.324 1.00 0.00 H new ATOM 0 HG11 VAL B 55 14.670 -13.006 -2.036 1.00 0.00 H new ATOM 0 HG12 VAL B 55 13.817 -14.321 -1.192 1.00 0.00 H new ATOM 0 HG13 VAL B 55 13.319 -13.846 -2.833 1.00 0.00 H new ATOM 0 HG21 VAL B 55 13.606 -10.834 -2.352 1.00 0.00 H new ATOM 0 HG22 VAL B 55 12.189 -11.556 -3.150 1.00 0.00 H new ATOM 0 HG23 VAL B 55 11.973 -10.516 -1.722 1.00 0.00 H new ATOM 859 N GLY B 56 11.021 -14.236 -3.182 1.00 0.00 N ATOM 860 CA GLY B 56 10.401 -14.471 -4.472 1.00 0.00 C ATOM 861 C GLY B 56 10.349 -13.220 -5.325 1.00 0.00 C ATOM 862 O GLY B 56 11.384 -12.626 -5.640 1.00 0.00 O ATOM 0 H GLY B 56 11.804 -14.853 -2.967 1.00 0.00 H new ATOM 0 HA2 GLY B 56 10.955 -15.246 -5.002 1.00 0.00 H new ATOM 0 HA3 GLY B 56 9.389 -14.848 -4.322 1.00 0.00 H new ATOM 866 N ARG B 57 9.143 -12.818 -5.692 1.00 0.00 N ATOM 867 CA ARG B 57 8.930 -11.602 -6.464 1.00 0.00 C ATOM 868 C ARG B 57 7.736 -10.842 -5.906 1.00 0.00 C ATOM 869 O ARG B 57 6.786 -11.447 -5.407 1.00 0.00 O ATOM 870 CB ARG B 57 8.684 -11.924 -7.944 1.00 0.00 C ATOM 871 CG ARG B 57 9.863 -12.577 -8.650 1.00 0.00 C ATOM 872 CD ARG B 57 11.096 -11.690 -8.623 1.00 0.00 C ATOM 873 NE ARG B 57 12.197 -12.260 -9.397 1.00 0.00 N ATOM 874 CZ ARG B 57 13.285 -12.812 -8.861 1.00 0.00 C ATOM 875 NH1 ARG B 57 13.401 -12.929 -7.542 1.00 0.00 N ATOM 876 NH2 ARG B 57 14.253 -13.266 -9.650 1.00 0.00 N ATOM 0 H ARG B 57 8.286 -13.323 -5.465 1.00 0.00 H new ATOM 0 HA ARG B 57 9.828 -10.989 -6.388 1.00 0.00 H new ATOM 0 HB2 ARG B 57 7.820 -12.584 -8.021 1.00 0.00 H new ATOM 0 HB3 ARG B 57 8.429 -11.002 -8.466 1.00 0.00 H new ATOM 0 HG2 ARG B 57 10.090 -13.530 -8.173 1.00 0.00 H new ATOM 0 HG3 ARG B 57 9.593 -12.794 -9.684 1.00 0.00 H new ATOM 0 HD2 ARG B 57 10.844 -10.707 -9.021 1.00 0.00 H new ATOM 0 HD3 ARG B 57 11.415 -11.544 -7.591 1.00 0.00 H new ATOM 0 HE ARG B 57 12.128 -12.234 -10.414 1.00 0.00 H new ATOM 0 HH11 ARG B 57 12.654 -12.595 -6.933 1.00 0.00 H new ATOM 0 HH12 ARG B 57 14.237 -13.353 -7.139 1.00 0.00 H new ATOM 0 HH21 ARG B 57 14.162 -13.191 -10.663 1.00 0.00 H new ATOM 0 HH22 ARG B 57 15.087 -13.689 -9.242 1.00 0.00 H new ATOM 890 N TRP B 58 7.784 -9.523 -5.989 1.00 0.00 N ATOM 891 CA TRP B 58 6.687 -8.695 -5.515 1.00 0.00 C ATOM 892 C TRP B 58 5.603 -8.575 -6.574 1.00 0.00 C ATOM 893 O TRP B 58 5.846 -8.058 -7.667 1.00 0.00 O ATOM 894 CB TRP B 58 7.180 -7.298 -5.132 1.00 0.00 C ATOM 895 CG TRP B 58 7.854 -7.234 -3.797 1.00 0.00 C ATOM 896 CD1 TRP B 58 9.195 -7.183 -3.554 1.00 0.00 C ATOM 897 CD2 TRP B 58 7.211 -7.205 -2.520 1.00 0.00 C ATOM 898 NE1 TRP B 58 9.424 -7.113 -2.201 1.00 0.00 N ATOM 899 CE2 TRP B 58 8.222 -7.128 -1.545 1.00 0.00 C ATOM 900 CE3 TRP B 58 5.878 -7.235 -2.105 1.00 0.00 C ATOM 901 CZ2 TRP B 58 7.939 -7.080 -0.183 1.00 0.00 C ATOM 902 CZ3 TRP B 58 5.599 -7.187 -0.753 1.00 0.00 C ATOM 903 CH2 TRP B 58 6.626 -7.109 0.194 1.00 0.00 C ATOM 0 H TRP B 58 8.570 -9.003 -6.380 1.00 0.00 H new ATOM 0 HA TRP B 58 6.271 -9.178 -4.631 1.00 0.00 H new ATOM 0 HB2 TRP B 58 7.875 -6.947 -5.895 1.00 0.00 H new ATOM 0 HB3 TRP B 58 6.333 -6.612 -5.133 1.00 0.00 H new ATOM 0 HD1 TRP B 58 9.963 -7.196 -4.313 1.00 0.00 H new ATOM 0 HE1 TRP B 58 10.341 -7.059 -1.757 1.00 0.00 H new ATOM 0 HE3 TRP B 58 5.079 -7.295 -2.829 1.00 0.00 H new ATOM 0 HZ2 TRP B 58 8.730 -7.022 0.550 1.00 0.00 H new ATOM 0 HZ3 TRP B 58 4.571 -7.210 -0.422 1.00 0.00 H new ATOM 0 HH2 TRP B 58 6.376 -7.071 1.244 1.00 0.00 H new ATOM 914 N LYS B 59 4.415 -9.065 -6.255 1.00 0.00 N ATOM 915 CA LYS B 59 3.266 -8.893 -7.124 1.00 0.00 C ATOM 916 C LYS B 59 2.754 -7.469 -6.993 1.00 0.00 C ATOM 917 O LYS B 59 2.548 -6.982 -5.882 1.00 0.00 O ATOM 918 CB LYS B 59 2.162 -9.887 -6.773 1.00 0.00 C ATOM 919 CG LYS B 59 2.533 -11.332 -7.052 1.00 0.00 C ATOM 920 CD LYS B 59 1.431 -12.284 -6.616 1.00 0.00 C ATOM 921 CE LYS B 59 1.718 -13.703 -7.066 1.00 0.00 C ATOM 922 NZ LYS B 59 0.687 -14.660 -6.589 1.00 0.00 N ATOM 0 H LYS B 59 4.223 -9.585 -5.399 1.00 0.00 H new ATOM 0 HA LYS B 59 3.568 -9.082 -8.154 1.00 0.00 H new ATOM 0 HB2 LYS B 59 1.913 -9.782 -5.717 1.00 0.00 H new ATOM 0 HB3 LYS B 59 1.265 -9.635 -7.339 1.00 0.00 H new ATOM 0 HG2 LYS B 59 2.726 -11.460 -8.117 1.00 0.00 H new ATOM 0 HG3 LYS B 59 3.457 -11.579 -6.529 1.00 0.00 H new ATOM 0 HD2 LYS B 59 1.333 -12.257 -5.531 1.00 0.00 H new ATOM 0 HD3 LYS B 59 0.478 -11.955 -7.030 1.00 0.00 H new ATOM 0 HE2 LYS B 59 1.766 -13.735 -8.154 1.00 0.00 H new ATOM 0 HE3 LYS B 59 2.696 -14.010 -6.695 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 0.923 -15.618 -6.919 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 0.658 -14.650 -5.549 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -0.243 -14.384 -6.964 1.00 0.00 H new ATOM 936 N GLU B 60 2.567 -6.803 -8.118 1.00 0.00 N ATOM 937 CA GLU B 60 2.209 -5.396 -8.109 1.00 0.00 C ATOM 938 C GLU B 60 0.862 -5.165 -8.775 1.00 0.00 C ATOM 939 O GLU B 60 0.590 -5.695 -9.852 1.00 0.00 O ATOM 940 CB GLU B 60 3.288 -4.573 -8.814 1.00 0.00 C ATOM 941 CG GLU B 60 4.663 -4.716 -8.185 1.00 0.00 C ATOM 942 CD GLU B 60 5.724 -3.916 -8.902 1.00 0.00 C ATOM 943 OE1 GLU B 60 5.979 -2.765 -8.498 1.00 0.00 O ATOM 944 OE2 GLU B 60 6.318 -4.438 -9.869 1.00 0.00 O ATOM 0 H GLU B 60 2.657 -7.213 -9.048 1.00 0.00 H new ATOM 0 HA GLU B 60 2.133 -5.076 -7.070 1.00 0.00 H new ATOM 0 HB2 GLU B 60 3.341 -4.877 -9.859 1.00 0.00 H new ATOM 0 HB3 GLU B 60 2.999 -3.522 -8.802 1.00 0.00 H new ATOM 0 HG2 GLU B 60 4.616 -4.396 -7.144 1.00 0.00 H new ATOM 0 HG3 GLU B 60 4.948 -5.768 -8.183 1.00 0.00 H new ATOM 951 N ALA B 61 0.019 -4.395 -8.113 1.00 0.00 N ATOM 952 CA ALA B 61 -1.260 -3.999 -8.669 1.00 0.00 C ATOM 953 C ALA B 61 -1.372 -2.484 -8.674 1.00 0.00 C ATOM 954 O ALA B 61 -1.117 -1.838 -7.659 1.00 0.00 O ATOM 955 CB ALA B 61 -2.398 -4.617 -7.874 1.00 0.00 C ATOM 0 H ALA B 61 0.201 -4.028 -7.179 1.00 0.00 H new ATOM 0 HA ALA B 61 -1.328 -4.360 -9.695 1.00 0.00 H new ATOM 0 HB1 ALA B 61 -3.351 -4.310 -8.304 1.00 0.00 H new ATOM 0 HB2 ALA B 61 -2.318 -5.703 -7.908 1.00 0.00 H new ATOM 0 HB3 ALA B 61 -2.343 -4.282 -6.838 1.00 0.00 H new ATOM 961 N THR B 62 -1.734 -1.923 -9.812 1.00 0.00 N ATOM 962 CA THR B 62 -1.833 -0.481 -9.949 1.00 0.00 C ATOM 963 C THR B 62 -3.291 -0.033 -9.901 1.00 0.00 C ATOM 964 O THR B 62 -4.079 -0.328 -10.804 1.00 0.00 O ATOM 965 CB THR B 62 -1.188 -0.013 -11.266 1.00 0.00 C ATOM 966 OG1 THR B 62 0.119 -0.591 -11.397 1.00 0.00 O ATOM 967 CG2 THR B 62 -1.080 1.504 -11.312 1.00 0.00 C ATOM 0 H THR B 62 -1.965 -2.445 -10.657 1.00 0.00 H new ATOM 0 HA THR B 62 -1.297 -0.029 -9.114 1.00 0.00 H new ATOM 0 HB THR B 62 -1.821 -0.339 -12.091 1.00 0.00 H new ATOM 0 HG1 THR B 62 0.526 -0.293 -12.237 1.00 0.00 H new ATOM 0 HG21 THR B 62 -0.621 1.808 -12.253 1.00 0.00 H new ATOM 0 HG22 THR B 62 -2.075 1.942 -11.236 1.00 0.00 H new ATOM 0 HG23 THR B 62 -0.466 1.850 -10.480 1.00 0.00 H new ATOM 975 N ILE B 63 -3.644 0.671 -8.838 1.00 0.00 N ATOM 976 CA ILE B 63 -5.002 1.157 -8.650 1.00 0.00 C ATOM 977 C ILE B 63 -5.038 2.673 -8.810 1.00 0.00 C ATOM 978 O ILE B 63 -4.303 3.385 -8.127 1.00 0.00 O ATOM 979 CB ILE B 63 -5.561 0.797 -7.246 1.00 0.00 C ATOM 980 CG1 ILE B 63 -5.557 -0.718 -7.010 1.00 0.00 C ATOM 981 CG2 ILE B 63 -6.972 1.345 -7.073 1.00 0.00 C ATOM 982 CD1 ILE B 63 -4.229 -1.266 -6.525 1.00 0.00 C ATOM 0 H ILE B 63 -3.002 0.921 -8.085 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.622 0.674 -9.405 1.00 0.00 H new ATOM 0 HB ILE B 63 -4.906 1.258 -6.507 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -6.328 -0.963 -6.279 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -5.828 -1.220 -7.939 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -7.346 1.082 -6.083 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -6.957 2.430 -7.179 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -7.625 0.916 -7.833 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -4.310 -2.344 -6.382 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -3.456 -1.055 -7.264 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -3.964 -0.794 -5.579 1.00 0.00 H new ATOM 994 N PRO B 64 -5.877 3.183 -9.731 1.00 0.00 N ATOM 995 CA PRO B 64 -6.076 4.625 -9.915 1.00 0.00 C ATOM 996 C PRO B 64 -6.335 5.338 -8.590 1.00 0.00 C ATOM 997 O PRO B 64 -7.032 4.806 -7.715 1.00 0.00 O ATOM 998 CB PRO B 64 -7.309 4.697 -10.814 1.00 0.00 C ATOM 999 CG PRO B 64 -7.284 3.428 -11.591 1.00 0.00 C ATOM 1000 CD PRO B 64 -6.680 2.390 -10.681 1.00 0.00 C ATOM 0 HA PRO B 64 -5.198 5.114 -10.337 1.00 0.00 H new ATOM 0 HB2 PRO B 64 -8.223 4.784 -10.226 1.00 0.00 H new ATOM 0 HB3 PRO B 64 -7.269 5.565 -11.472 1.00 0.00 H new ATOM 0 HG2 PRO B 64 -8.289 3.139 -11.898 1.00 0.00 H new ATOM 0 HG3 PRO B 64 -6.693 3.540 -12.500 1.00 0.00 H new ATOM 0 HD2 PRO B 64 -7.448 1.810 -10.169 1.00 0.00 H new ATOM 0 HD3 PRO B 64 -6.062 1.683 -11.235 1.00 0.00 H new ATOM 1008 N GLY B 65 -5.789 6.543 -8.454 1.00 0.00 N ATOM 1009 CA GLY B 65 -5.836 7.262 -7.189 1.00 0.00 C ATOM 1010 C GLY B 65 -7.203 7.839 -6.857 1.00 0.00 C ATOM 1011 O GLY B 65 -7.320 9.015 -6.515 1.00 0.00 O ATOM 0 H GLY B 65 -5.310 7.040 -9.205 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -5.533 6.588 -6.388 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -5.108 8.072 -7.216 1.00 0.00 H new ATOM 1015 N HIS B 66 -8.234 7.009 -6.944 1.00 0.00 N ATOM 1016 CA HIS B 66 -9.593 7.427 -6.616 1.00 0.00 C ATOM 1017 C HIS B 66 -10.516 6.219 -6.486 1.00 0.00 C ATOM 1018 O HIS B 66 -11.720 6.324 -6.708 1.00 0.00 O ATOM 1019 CB HIS B 66 -10.137 8.413 -7.663 1.00 0.00 C ATOM 1020 CG HIS B 66 -10.005 7.952 -9.085 1.00 0.00 C ATOM 1021 ND1 HIS B 66 -9.086 8.483 -9.962 1.00 0.00 N ATOM 1022 CD2 HIS B 66 -10.686 7.014 -9.782 1.00 0.00 C ATOM 1023 CE1 HIS B 66 -9.205 7.892 -11.135 1.00 0.00 C ATOM 1024 NE2 HIS B 66 -10.170 6.996 -11.054 1.00 0.00 N ATOM 0 H HIS B 66 -8.155 6.036 -7.241 1.00 0.00 H new ATOM 0 HA HIS B 66 -9.561 7.939 -5.654 1.00 0.00 H new ATOM 0 HB2 HIS B 66 -11.190 8.602 -7.452 1.00 0.00 H new ATOM 0 HB3 HIS B 66 -9.615 9.363 -7.553 1.00 0.00 H new ATOM 0 HD2 HIS B 66 -11.487 6.394 -9.407 1.00 0.00 H new ATOM 0 HE1 HIS B 66 -8.613 8.105 -12.013 1.00 0.00 H new ATOM 0 HE2 HIS B 66 -10.482 6.389 -11.812 1.00 0.00 H new ATOM 1033 N LEU B 67 -9.945 5.073 -6.137 1.00 0.00 N ATOM 1034 CA LEU B 67 -10.735 3.864 -5.928 1.00 0.00 C ATOM 1035 C LEU B 67 -10.560 3.363 -4.501 1.00 0.00 C ATOM 1036 O LEU B 67 -11.530 3.044 -3.815 1.00 0.00 O ATOM 1037 CB LEU B 67 -10.339 2.761 -6.915 1.00 0.00 C ATOM 1038 CG LEU B 67 -10.486 3.113 -8.397 1.00 0.00 C ATOM 1039 CD1 LEU B 67 -10.153 1.911 -9.262 1.00 0.00 C ATOM 1040 CD2 LEU B 67 -11.890 3.613 -8.698 1.00 0.00 C ATOM 0 H LEU B 67 -8.942 4.954 -5.993 1.00 0.00 H new ATOM 0 HA LEU B 67 -11.781 4.116 -6.099 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -9.301 2.486 -6.727 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -10.945 1.879 -6.708 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.784 3.914 -8.629 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -10.262 2.178 -10.313 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -9.126 1.599 -9.072 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -10.831 1.092 -9.023 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -11.970 3.857 -9.757 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -12.614 2.837 -8.448 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -12.094 4.504 -8.104 1.00 0.00 H new ATOM 1052 N ASN B 68 -9.294 3.295 -4.083 1.00 0.00 N ATOM 1053 CA ASN B 68 -8.920 3.013 -2.694 1.00 0.00 C ATOM 1054 C ASN B 68 -9.305 1.598 -2.270 1.00 0.00 C ATOM 1055 O ASN B 68 -9.497 1.330 -1.080 1.00 0.00 O ATOM 1056 CB ASN B 68 -9.550 4.036 -1.742 1.00 0.00 C ATOM 1057 CG ASN B 68 -9.161 5.467 -2.069 1.00 0.00 C ATOM 1058 OD1 ASN B 68 -8.074 5.732 -2.586 1.00 0.00 O ATOM 1059 ND2 ASN B 68 -10.050 6.402 -1.773 1.00 0.00 N ATOM 0 H ASN B 68 -8.495 3.435 -4.701 1.00 0.00 H new ATOM 0 HA ASN B 68 -7.834 3.092 -2.636 1.00 0.00 H new ATOM 0 HB2 ASN B 68 -10.635 3.942 -1.782 1.00 0.00 H new ATOM 0 HB3 ASN B 68 -9.248 3.807 -0.720 1.00 0.00 H new ATOM 0 HD21 ASN B 68 -9.846 7.381 -1.972 1.00 0.00 H new ATOM 0 HD22 ASN B 68 -10.939 6.143 -1.345 1.00 0.00 H new ATOM 1066 N SER B 69 -9.396 0.693 -3.239 1.00 0.00 N ATOM 1067 CA SER B 69 -9.765 -0.686 -2.964 1.00 0.00 C ATOM 1068 C SER B 69 -9.263 -1.614 -4.067 1.00 0.00 C ATOM 1069 O SER B 69 -9.336 -1.280 -5.252 1.00 0.00 O ATOM 1070 CB SER B 69 -11.287 -0.796 -2.836 1.00 0.00 C ATOM 1071 OG SER B 69 -11.933 -0.285 -3.990 1.00 0.00 O ATOM 0 H SER B 69 -9.218 0.893 -4.223 1.00 0.00 H new ATOM 0 HA SER B 69 -9.300 -0.990 -2.027 1.00 0.00 H new ATOM 0 HB2 SER B 69 -11.569 -1.839 -2.689 1.00 0.00 H new ATOM 0 HB3 SER B 69 -11.622 -0.248 -1.955 1.00 0.00 H new ATOM 0 HG SER B 69 -11.841 0.690 -4.011 1.00 0.00 H new ATOM 1077 N TYR B 70 -8.745 -2.771 -3.678 1.00 0.00 N ATOM 1078 CA TYR B 70 -8.304 -3.773 -4.639 1.00 0.00 C ATOM 1079 C TYR B 70 -8.659 -5.172 -4.147 1.00 0.00 C ATOM 1080 O TYR B 70 -8.609 -5.450 -2.949 1.00 0.00 O ATOM 1081 CB TYR B 70 -6.795 -3.663 -4.880 1.00 0.00 C ATOM 1082 CG TYR B 70 -6.266 -4.659 -5.894 1.00 0.00 C ATOM 1083 CD1 TYR B 70 -5.524 -5.761 -5.489 1.00 0.00 C ATOM 1084 CD2 TYR B 70 -6.517 -4.502 -7.251 1.00 0.00 C ATOM 1085 CE1 TYR B 70 -5.047 -6.678 -6.407 1.00 0.00 C ATOM 1086 CE2 TYR B 70 -6.043 -5.414 -8.176 1.00 0.00 C ATOM 1087 CZ TYR B 70 -5.310 -6.501 -7.750 1.00 0.00 C ATOM 1088 OH TYR B 70 -4.835 -7.411 -8.668 1.00 0.00 O ATOM 0 H TYR B 70 -8.620 -3.039 -2.702 1.00 0.00 H new ATOM 0 HA TYR B 70 -8.818 -3.592 -5.583 1.00 0.00 H new ATOM 0 HB2 TYR B 70 -6.563 -2.654 -5.220 1.00 0.00 H new ATOM 0 HB3 TYR B 70 -6.273 -3.809 -3.934 1.00 0.00 H new ATOM 0 HD1 TYR B 70 -5.316 -5.904 -4.439 1.00 0.00 H new ATOM 0 HD2 TYR B 70 -7.092 -3.653 -7.590 1.00 0.00 H new ATOM 0 HE1 TYR B 70 -4.471 -7.529 -6.075 1.00 0.00 H new ATOM 0 HE2 TYR B 70 -6.246 -5.275 -9.228 1.00 0.00 H new ATOM 0 HH TYR B 70 -5.109 -7.140 -9.569 1.00 0.00 H new ATOM 1098 N THR B 71 -9.034 -6.041 -5.070 1.00 0.00 N ATOM 1099 CA THR B 71 -9.348 -7.419 -4.740 1.00 0.00 C ATOM 1100 C THR B 71 -8.148 -8.321 -5.023 1.00 0.00 C ATOM 1101 O THR B 71 -7.874 -8.671 -6.174 1.00 0.00 O ATOM 1102 CB THR B 71 -10.570 -7.908 -5.539 1.00 0.00 C ATOM 1103 OG1 THR B 71 -11.653 -6.984 -5.367 1.00 0.00 O ATOM 1104 CG2 THR B 71 -11.007 -9.295 -5.084 1.00 0.00 C ATOM 0 H THR B 71 -9.129 -5.814 -6.060 1.00 0.00 H new ATOM 0 HA THR B 71 -9.586 -7.466 -3.677 1.00 0.00 H new ATOM 0 HB THR B 71 -10.291 -7.966 -6.591 1.00 0.00 H new ATOM 0 HG1 THR B 71 -12.431 -7.293 -5.877 1.00 0.00 H new ATOM 0 HG21 THR B 71 -11.872 -9.613 -5.666 1.00 0.00 H new ATOM 0 HG22 THR B 71 -10.190 -10.001 -5.232 1.00 0.00 H new ATOM 0 HG23 THR B 71 -11.273 -9.264 -4.027 1.00 0.00 H new ATOM 1112 N ILE B 72 -7.420 -8.678 -3.972 1.00 0.00 N ATOM 1113 CA ILE B 72 -6.258 -9.541 -4.109 1.00 0.00 C ATOM 1114 C ILE B 72 -6.694 -10.996 -4.158 1.00 0.00 C ATOM 1115 O ILE B 72 -7.262 -11.514 -3.197 1.00 0.00 O ATOM 1116 CB ILE B 72 -5.257 -9.367 -2.949 1.00 0.00 C ATOM 1117 CG1 ILE B 72 -4.852 -7.900 -2.795 1.00 0.00 C ATOM 1118 CG2 ILE B 72 -4.028 -10.236 -3.185 1.00 0.00 C ATOM 1119 CD1 ILE B 72 -3.853 -7.662 -1.685 1.00 0.00 C ATOM 0 H ILE B 72 -7.616 -8.382 -3.016 1.00 0.00 H new ATOM 0 HA ILE B 72 -5.761 -9.255 -5.036 1.00 0.00 H new ATOM 0 HB ILE B 72 -5.741 -9.683 -2.025 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -4.428 -7.548 -3.736 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -5.744 -7.303 -2.604 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -3.327 -10.106 -2.361 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -4.328 -11.282 -3.245 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -3.548 -9.942 -4.119 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -3.612 -6.600 -1.634 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -4.281 -7.983 -0.735 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -2.945 -8.231 -1.884 1.00 0.00 H new ATOM 1131 N LYS B 73 -6.441 -11.644 -5.280 1.00 0.00 N ATOM 1132 CA LYS B 73 -6.789 -13.042 -5.441 1.00 0.00 C ATOM 1133 C LYS B 73 -5.535 -13.902 -5.409 1.00 0.00 C ATOM 1134 O LYS B 73 -4.559 -13.620 -6.104 1.00 0.00 O ATOM 1135 CB LYS B 73 -7.553 -13.251 -6.748 1.00 0.00 C ATOM 1136 CG LYS B 73 -8.886 -12.521 -6.790 1.00 0.00 C ATOM 1137 CD LYS B 73 -9.558 -12.669 -8.142 1.00 0.00 C ATOM 1138 CE LYS B 73 -10.916 -11.983 -8.175 1.00 0.00 C ATOM 1139 NZ LYS B 73 -11.915 -12.680 -7.322 1.00 0.00 N ATOM 0 H LYS B 73 -5.995 -11.223 -6.095 1.00 0.00 H new ATOM 0 HA LYS B 73 -7.434 -13.341 -4.615 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -6.935 -12.913 -7.580 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -7.726 -14.317 -6.893 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -9.541 -12.913 -6.012 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -8.730 -11.464 -6.574 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -8.917 -12.245 -8.915 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -9.679 -13.727 -8.374 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -10.809 -10.952 -7.839 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -11.279 -11.947 -9.202 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -12.852 -12.252 -7.465 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -11.951 -13.687 -7.581 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -11.642 -12.589 -6.323 1.00 0.00 H new ATOM 1153 N GLY B 74 -5.561 -14.936 -4.586 1.00 0.00 N ATOM 1154 CA GLY B 74 -4.421 -15.820 -4.467 1.00 0.00 C ATOM 1155 C GLY B 74 -3.823 -15.806 -3.075 1.00 0.00 C ATOM 1156 O GLY B 74 -2.637 -16.093 -2.900 1.00 0.00 O ATOM 0 H GLY B 74 -6.355 -15.181 -3.995 1.00 0.00 H new ATOM 0 HA2 GLY B 74 -4.725 -16.836 -4.719 1.00 0.00 H new ATOM 0 HA3 GLY B 74 -3.660 -15.526 -5.190 1.00 0.00 H new ATOM 1160 N LEU B 75 -4.633 -15.462 -2.085 1.00 0.00 N ATOM 1161 CA LEU B 75 -4.182 -15.453 -0.701 1.00 0.00 C ATOM 1162 C LEU B 75 -4.719 -16.672 0.037 1.00 0.00 C ATOM 1163 O LEU B 75 -5.924 -16.895 0.087 1.00 0.00 O ATOM 1164 CB LEU B 75 -4.623 -14.171 0.012 1.00 0.00 C ATOM 1165 CG LEU B 75 -4.065 -12.866 -0.569 1.00 0.00 C ATOM 1166 CD1 LEU B 75 -4.457 -11.690 0.309 1.00 0.00 C ATOM 1167 CD2 LEU B 75 -2.551 -12.939 -0.714 1.00 0.00 C ATOM 0 H LEU B 75 -5.606 -15.185 -2.214 1.00 0.00 H new ATOM 0 HA LEU B 75 -3.093 -15.488 -0.700 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -5.712 -14.121 -0.008 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -4.327 -14.238 1.059 1.00 0.00 H new ATOM 0 HG LEU B 75 -4.494 -12.722 -1.561 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -4.055 -10.770 -0.114 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -5.544 -11.621 0.361 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -4.054 -11.834 1.312 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -2.180 -12.002 -1.128 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -2.100 -13.108 0.264 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -2.289 -13.760 -1.382 1.00 0.00 H new ATOM 1179 N LYS B 76 -3.820 -17.460 0.598 1.00 0.00 N ATOM 1180 CA LYS B 76 -4.201 -18.681 1.292 1.00 0.00 C ATOM 1181 C LYS B 76 -4.229 -18.458 2.801 1.00 0.00 C ATOM 1182 O LYS B 76 -3.221 -18.066 3.391 1.00 0.00 O ATOM 1183 CB LYS B 76 -3.215 -19.800 0.953 1.00 0.00 C ATOM 1184 CG LYS B 76 -3.125 -20.110 -0.534 1.00 0.00 C ATOM 1185 CD LYS B 76 -2.052 -21.149 -0.827 1.00 0.00 C ATOM 1186 CE LYS B 76 -2.369 -22.493 -0.187 1.00 0.00 C ATOM 1187 NZ LYS B 76 -3.638 -23.071 -0.700 1.00 0.00 N ATOM 0 H LYS B 76 -2.817 -17.277 0.587 1.00 0.00 H new ATOM 0 HA LYS B 76 -5.201 -18.966 0.965 1.00 0.00 H new ATOM 0 HB2 LYS B 76 -2.226 -19.523 1.317 1.00 0.00 H new ATOM 0 HB3 LYS B 76 -3.509 -20.704 1.486 1.00 0.00 H new ATOM 0 HG2 LYS B 76 -4.090 -20.472 -0.889 1.00 0.00 H new ATOM 0 HG3 LYS B 76 -2.906 -19.195 -1.084 1.00 0.00 H new ATOM 0 HD2 LYS B 76 -1.954 -21.275 -1.905 1.00 0.00 H new ATOM 0 HD3 LYS B 76 -1.090 -20.790 -0.460 1.00 0.00 H new ATOM 0 HE2 LYS B 76 -1.551 -23.187 -0.379 1.00 0.00 H new ATOM 0 HE3 LYS B 76 -2.437 -22.372 0.894 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 -3.714 -24.063 -0.398 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 -4.443 -22.531 -0.322 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 -3.646 -23.023 -1.739 1.00 0.00 H new ATOM 1201 N PRO B 77 -5.384 -18.697 3.444 1.00 0.00 N ATOM 1202 CA PRO B 77 -5.513 -18.609 4.903 1.00 0.00 C ATOM 1203 C PRO B 77 -4.562 -19.569 5.612 1.00 0.00 C ATOM 1204 O PRO B 77 -4.625 -20.787 5.415 1.00 0.00 O ATOM 1205 CB PRO B 77 -6.970 -19.001 5.166 1.00 0.00 C ATOM 1206 CG PRO B 77 -7.671 -18.753 3.876 1.00 0.00 C ATOM 1207 CD PRO B 77 -6.663 -19.044 2.801 1.00 0.00 C ATOM 0 HA PRO B 77 -5.261 -17.617 5.279 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -7.050 -20.046 5.465 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -7.401 -18.405 5.971 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -8.546 -19.396 3.776 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -8.023 -17.723 3.814 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -6.690 -20.090 2.495 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -6.841 -18.445 1.908 1.00 0.00 H new ATOM 1215 N GLY B 78 -3.672 -19.015 6.420 1.00 0.00 N ATOM 1216 CA GLY B 78 -2.683 -19.820 7.105 1.00 0.00 C ATOM 1217 C GLY B 78 -1.292 -19.547 6.578 1.00 0.00 C ATOM 1218 O GLY B 78 -0.289 -19.864 7.225 1.00 0.00 O ATOM 0 H GLY B 78 -3.617 -18.015 6.615 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -2.717 -19.610 8.174 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -2.921 -20.876 6.980 1.00 0.00 H new ATOM 1222 N VAL B 79 -1.235 -18.953 5.396 1.00 0.00 N ATOM 1223 CA VAL B 79 0.027 -18.596 4.777 1.00 0.00 C ATOM 1224 C VAL B 79 0.317 -17.121 5.019 1.00 0.00 C ATOM 1225 O VAL B 79 -0.519 -16.261 4.744 1.00 0.00 O ATOM 1226 CB VAL B 79 0.008 -18.888 3.261 1.00 0.00 C ATOM 1227 CG1 VAL B 79 1.334 -18.536 2.614 1.00 0.00 C ATOM 1228 CG2 VAL B 79 -0.319 -20.347 3.000 1.00 0.00 C ATOM 0 H VAL B 79 -2.057 -18.707 4.844 1.00 0.00 H new ATOM 0 HA VAL B 79 0.813 -19.202 5.227 1.00 0.00 H new ATOM 0 HB VAL B 79 -0.768 -18.264 2.818 1.00 0.00 H new ATOM 0 HG11 VAL B 79 1.287 -18.753 1.547 1.00 0.00 H new ATOM 0 HG12 VAL B 79 1.540 -17.476 2.760 1.00 0.00 H new ATOM 0 HG13 VAL B 79 2.129 -19.126 3.070 1.00 0.00 H new ATOM 0 HG21 VAL B 79 -0.327 -20.531 1.926 1.00 0.00 H new ATOM 0 HG22 VAL B 79 0.434 -20.979 3.471 1.00 0.00 H new ATOM 0 HG23 VAL B 79 -1.299 -20.580 3.416 1.00 0.00 H new ATOM 1238 N VAL B 80 1.488 -16.839 5.562 1.00 0.00 N ATOM 1239 CA VAL B 80 1.871 -15.474 5.878 1.00 0.00 C ATOM 1240 C VAL B 80 2.307 -14.713 4.620 1.00 0.00 C ATOM 1241 O VAL B 80 3.129 -15.193 3.833 1.00 0.00 O ATOM 1242 CB VAL B 80 2.988 -15.448 6.949 1.00 0.00 C ATOM 1243 CG1 VAL B 80 4.216 -16.219 6.486 1.00 0.00 C ATOM 1244 CG2 VAL B 80 3.350 -14.020 7.326 1.00 0.00 C ATOM 0 H VAL B 80 2.192 -17.539 5.794 1.00 0.00 H new ATOM 0 HA VAL B 80 0.995 -14.970 6.286 1.00 0.00 H new ATOM 0 HB VAL B 80 2.603 -15.943 7.840 1.00 0.00 H new ATOM 0 HG11 VAL B 80 4.982 -16.182 7.260 1.00 0.00 H new ATOM 0 HG12 VAL B 80 3.943 -17.257 6.295 1.00 0.00 H new ATOM 0 HG13 VAL B 80 4.603 -15.771 5.571 1.00 0.00 H new ATOM 0 HG21 VAL B 80 4.137 -14.031 8.080 1.00 0.00 H new ATOM 0 HG22 VAL B 80 3.702 -13.488 6.442 1.00 0.00 H new ATOM 0 HG23 VAL B 80 2.471 -13.515 7.727 1.00 0.00 H new ATOM 1254 N TYR B 81 1.731 -13.533 4.431 1.00 0.00 N ATOM 1255 CA TYR B 81 2.046 -12.686 3.289 1.00 0.00 C ATOM 1256 C TYR B 81 2.496 -11.303 3.740 1.00 0.00 C ATOM 1257 O TYR B 81 2.027 -10.783 4.757 1.00 0.00 O ATOM 1258 CB TYR B 81 0.829 -12.538 2.369 1.00 0.00 C ATOM 1259 CG TYR B 81 0.532 -13.754 1.522 1.00 0.00 C ATOM 1260 CD1 TYR B 81 -0.353 -14.731 1.956 1.00 0.00 C ATOM 1261 CD2 TYR B 81 1.131 -13.918 0.281 1.00 0.00 C ATOM 1262 CE1 TYR B 81 -0.633 -15.835 1.178 1.00 0.00 C ATOM 1263 CE2 TYR B 81 0.857 -15.020 -0.504 1.00 0.00 C ATOM 1264 CZ TYR B 81 -0.025 -15.974 -0.053 1.00 0.00 C ATOM 1265 OH TYR B 81 -0.299 -17.075 -0.834 1.00 0.00 O ATOM 0 H TYR B 81 1.035 -13.137 5.063 1.00 0.00 H new ATOM 0 HA TYR B 81 2.858 -13.167 2.744 1.00 0.00 H new ATOM 0 HB2 TYR B 81 -0.046 -12.313 2.979 1.00 0.00 H new ATOM 0 HB3 TYR B 81 0.988 -11.683 1.712 1.00 0.00 H new ATOM 0 HD1 TYR B 81 -0.830 -14.625 2.919 1.00 0.00 H new ATOM 0 HD2 TYR B 81 1.824 -13.171 -0.077 1.00 0.00 H new ATOM 0 HE1 TYR B 81 -1.324 -16.586 1.530 1.00 0.00 H new ATOM 0 HE2 TYR B 81 1.333 -15.132 -1.467 1.00 0.00 H new ATOM 0 HH TYR B 81 -0.988 -16.846 -1.492 1.00 0.00 H new ATOM 1275 N GLU B 82 3.390 -10.715 2.964 1.00 0.00 N ATOM 1276 CA GLU B 82 3.856 -9.354 3.189 1.00 0.00 C ATOM 1277 C GLU B 82 3.172 -8.425 2.205 1.00 0.00 C ATOM 1278 O GLU B 82 3.134 -8.711 1.009 1.00 0.00 O ATOM 1279 CB GLU B 82 5.373 -9.268 2.997 1.00 0.00 C ATOM 1280 CG GLU B 82 6.184 -9.729 4.194 1.00 0.00 C ATOM 1281 CD GLU B 82 6.198 -8.706 5.310 1.00 0.00 C ATOM 1282 OE1 GLU B 82 7.081 -7.822 5.299 1.00 0.00 O ATOM 1283 OE2 GLU B 82 5.331 -8.775 6.204 1.00 0.00 O ATOM 0 H GLU B 82 3.816 -11.169 2.156 1.00 0.00 H new ATOM 0 HA GLU B 82 3.615 -9.061 4.211 1.00 0.00 H new ATOM 0 HB2 GLU B 82 5.652 -9.869 2.131 1.00 0.00 H new ATOM 0 HB3 GLU B 82 5.640 -8.236 2.768 1.00 0.00 H new ATOM 0 HG2 GLU B 82 5.773 -10.666 4.569 1.00 0.00 H new ATOM 0 HG3 GLU B 82 7.207 -9.933 3.879 1.00 0.00 H new ATOM 1290 N GLY B 83 2.621 -7.331 2.702 1.00 0.00 N ATOM 1291 CA GLY B 83 1.919 -6.409 1.840 1.00 0.00 C ATOM 1292 C GLY B 83 2.298 -4.970 2.105 1.00 0.00 C ATOM 1293 O GLY B 83 2.599 -4.598 3.238 1.00 0.00 O ATOM 0 H GLY B 83 2.648 -7.065 3.686 1.00 0.00 H new ATOM 0 HA2 GLY B 83 2.134 -6.653 0.800 1.00 0.00 H new ATOM 0 HA3 GLY B 83 0.845 -6.531 1.980 1.00 0.00 H new ATOM 1297 N GLN B 84 2.298 -4.165 1.061 1.00 0.00 N ATOM 1298 CA GLN B 84 2.598 -2.751 1.190 1.00 0.00 C ATOM 1299 C GLN B 84 1.867 -1.941 0.127 1.00 0.00 C ATOM 1300 O GLN B 84 1.782 -2.346 -1.034 1.00 0.00 O ATOM 1301 CB GLN B 84 4.106 -2.507 1.110 1.00 0.00 C ATOM 1302 CG GLN B 84 4.785 -3.220 -0.044 1.00 0.00 C ATOM 1303 CD GLN B 84 6.255 -2.879 -0.153 1.00 0.00 C ATOM 1304 OE1 GLN B 84 6.633 -1.944 -0.854 1.00 0.00 O ATOM 1305 NE2 GLN B 84 7.092 -3.623 0.550 1.00 0.00 N ATOM 0 H GLN B 84 2.093 -4.467 0.109 1.00 0.00 H new ATOM 0 HA GLN B 84 2.249 -2.421 2.168 1.00 0.00 H new ATOM 0 HB2 GLN B 84 4.286 -1.436 1.019 1.00 0.00 H new ATOM 0 HB3 GLN B 84 4.566 -2.829 2.044 1.00 0.00 H new ATOM 0 HG2 GLN B 84 4.674 -4.297 0.083 1.00 0.00 H new ATOM 0 HG3 GLN B 84 4.284 -2.955 -0.975 1.00 0.00 H new ATOM 0 HE21 GLN B 84 6.737 -4.391 1.120 1.00 0.00 H new ATOM 0 HE22 GLN B 84 8.093 -3.429 0.522 1.00 0.00 H new ATOM 1314 N LEU B 85 1.325 -0.812 0.547 1.00 0.00 N ATOM 1315 CA LEU B 85 0.597 0.078 -0.340 1.00 0.00 C ATOM 1316 C LEU B 85 1.457 1.304 -0.646 1.00 0.00 C ATOM 1317 O LEU B 85 1.670 2.155 0.218 1.00 0.00 O ATOM 1318 CB LEU B 85 -0.734 0.473 0.329 1.00 0.00 C ATOM 1319 CG LEU B 85 -1.767 1.206 -0.544 1.00 0.00 C ATOM 1320 CD1 LEU B 85 -1.424 2.679 -0.687 1.00 0.00 C ATOM 1321 CD2 LEU B 85 -1.876 0.554 -1.915 1.00 0.00 C ATOM 0 H LEU B 85 1.377 -0.486 1.512 1.00 0.00 H new ATOM 0 HA LEU B 85 0.373 -0.420 -1.284 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -1.200 -0.433 0.716 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -0.507 1.106 1.187 1.00 0.00 H new ATOM 0 HG LEU B 85 -2.733 1.130 -0.044 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -2.173 3.168 -1.309 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -1.409 3.146 0.298 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -0.443 2.781 -1.152 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -2.612 1.089 -2.515 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -0.907 0.590 -2.413 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -2.187 -0.484 -1.800 1.00 0.00 H new ATOM 1333 N ILE B 86 1.967 1.376 -1.868 1.00 0.00 N ATOM 1334 CA ILE B 86 2.820 2.484 -2.278 1.00 0.00 C ATOM 1335 C ILE B 86 2.012 3.502 -3.073 1.00 0.00 C ATOM 1336 O ILE B 86 1.498 3.197 -4.145 1.00 0.00 O ATOM 1337 CB ILE B 86 4.025 2.027 -3.144 1.00 0.00 C ATOM 1338 CG1 ILE B 86 4.805 0.881 -2.483 1.00 0.00 C ATOM 1339 CG2 ILE B 86 4.957 3.201 -3.408 1.00 0.00 C ATOM 1340 CD1 ILE B 86 4.207 -0.490 -2.718 1.00 0.00 C ATOM 0 H ILE B 86 1.805 0.679 -2.594 1.00 0.00 H new ATOM 0 HA ILE B 86 3.210 2.928 -1.362 1.00 0.00 H new ATOM 0 HB ILE B 86 3.626 1.657 -4.088 1.00 0.00 H new ATOM 0 HG12 ILE B 86 5.828 0.888 -2.858 1.00 0.00 H new ATOM 0 HG13 ILE B 86 4.858 1.063 -1.410 1.00 0.00 H new ATOM 0 HG21 ILE B 86 5.798 2.868 -4.016 1.00 0.00 H new ATOM 0 HG22 ILE B 86 4.414 3.985 -3.937 1.00 0.00 H new ATOM 0 HG23 ILE B 86 5.327 3.592 -2.460 1.00 0.00 H new ATOM 0 HD11 ILE B 86 4.816 -1.243 -2.219 1.00 0.00 H new ATOM 0 HD12 ILE B 86 3.194 -0.519 -2.317 1.00 0.00 H new ATOM 0 HD13 ILE B 86 4.180 -0.696 -3.788 1.00 0.00 H new ATOM 1352 N SER B 87 1.893 4.705 -2.545 1.00 0.00 N ATOM 1353 CA SER B 87 1.137 5.751 -3.210 1.00 0.00 C ATOM 1354 C SER B 87 2.056 6.663 -4.013 1.00 0.00 C ATOM 1355 O SER B 87 2.976 7.276 -3.465 1.00 0.00 O ATOM 1356 CB SER B 87 0.364 6.565 -2.178 1.00 0.00 C ATOM 1357 OG SER B 87 -0.420 5.716 -1.364 1.00 0.00 O ATOM 0 H SER B 87 2.310 4.983 -1.657 1.00 0.00 H new ATOM 0 HA SER B 87 0.436 5.283 -3.901 1.00 0.00 H new ATOM 0 HB2 SER B 87 1.059 7.132 -1.559 1.00 0.00 H new ATOM 0 HB3 SER B 87 -0.277 7.288 -2.682 1.00 0.00 H new ATOM 0 HG SER B 87 -1.363 5.802 -1.615 1.00 0.00 H new ATOM 1363 N ILE B 88 1.814 6.732 -5.313 1.00 0.00 N ATOM 1364 CA ILE B 88 2.548 7.639 -6.179 1.00 0.00 C ATOM 1365 C ILE B 88 1.715 8.889 -6.414 1.00 0.00 C ATOM 1366 O ILE B 88 0.656 8.832 -7.040 1.00 0.00 O ATOM 1367 CB ILE B 88 2.891 6.990 -7.538 1.00 0.00 C ATOM 1368 CG1 ILE B 88 3.656 5.679 -7.334 1.00 0.00 C ATOM 1369 CG2 ILE B 88 3.702 7.949 -8.404 1.00 0.00 C ATOM 1370 CD1 ILE B 88 4.979 5.842 -6.617 1.00 0.00 C ATOM 0 H ILE B 88 1.112 6.168 -5.792 1.00 0.00 H new ATOM 0 HA ILE B 88 3.486 7.890 -5.684 1.00 0.00 H new ATOM 0 HB ILE B 88 1.956 6.767 -8.053 1.00 0.00 H new ATOM 0 HG12 ILE B 88 3.030 4.990 -6.767 1.00 0.00 H new ATOM 0 HG13 ILE B 88 3.836 5.220 -8.306 1.00 0.00 H new ATOM 0 HG21 ILE B 88 3.933 7.472 -9.357 1.00 0.00 H new ATOM 0 HG22 ILE B 88 3.124 8.855 -8.583 1.00 0.00 H new ATOM 0 HG23 ILE B 88 4.630 8.205 -7.892 1.00 0.00 H new ATOM 0 HD11 ILE B 88 5.458 4.869 -6.512 1.00 0.00 H new ATOM 0 HD12 ILE B 88 5.625 6.505 -7.192 1.00 0.00 H new ATOM 0 HD13 ILE B 88 4.807 6.270 -5.629 1.00 0.00 H new ATOM 1382 N GLN B 89 2.181 10.010 -5.891 1.00 0.00 N ATOM 1383 CA GLN B 89 1.433 11.251 -5.980 1.00 0.00 C ATOM 1384 C GLN B 89 1.866 12.092 -7.170 1.00 0.00 C ATOM 1385 O GLN B 89 2.870 11.789 -7.816 1.00 0.00 O ATOM 1386 CB GLN B 89 1.586 12.055 -4.693 1.00 0.00 C ATOM 1387 CG GLN B 89 0.847 11.450 -3.517 1.00 0.00 C ATOM 1388 CD GLN B 89 1.131 12.173 -2.223 1.00 0.00 C ATOM 1389 OE1 GLN B 89 0.460 13.148 -1.885 1.00 0.00 O ATOM 1390 NE2 GLN B 89 2.121 11.696 -1.489 1.00 0.00 N ATOM 0 H GLN B 89 3.072 10.086 -5.401 1.00 0.00 H new ATOM 0 HA GLN B 89 0.385 10.988 -6.122 1.00 0.00 H new ATOM 0 HB2 GLN B 89 2.645 12.134 -4.446 1.00 0.00 H new ATOM 0 HB3 GLN B 89 1.221 13.068 -4.860 1.00 0.00 H new ATOM 0 HG2 GLN B 89 -0.225 11.473 -3.715 1.00 0.00 H new ATOM 0 HG3 GLN B 89 1.130 10.402 -3.414 1.00 0.00 H new ATOM 0 HE21 GLN B 89 2.649 10.885 -1.811 1.00 0.00 H new ATOM 0 HE22 GLN B 89 2.357 12.139 -0.601 1.00 0.00 H new ATOM 1399 N GLN B 90 1.109 13.146 -7.443 1.00 0.00 N ATOM 1400 CA GLN B 90 1.410 14.067 -8.535 1.00 0.00 C ATOM 1401 C GLN B 90 2.841 14.592 -8.422 1.00 0.00 C ATOM 1402 O GLN B 90 3.557 14.702 -9.417 1.00 0.00 O ATOM 1403 CB GLN B 90 0.416 15.231 -8.506 1.00 0.00 C ATOM 1404 CG GLN B 90 0.516 16.171 -9.696 1.00 0.00 C ATOM 1405 CD GLN B 90 -0.498 17.297 -9.626 1.00 0.00 C ATOM 1406 OE1 GLN B 90 -1.626 17.159 -10.098 1.00 0.00 O ATOM 1407 NE2 GLN B 90 -0.103 18.419 -9.047 1.00 0.00 N ATOM 0 H GLN B 90 0.270 13.388 -6.916 1.00 0.00 H new ATOM 0 HA GLN B 90 1.319 13.535 -9.482 1.00 0.00 H new ATOM 0 HB2 GLN B 90 -0.596 14.828 -8.461 1.00 0.00 H new ATOM 0 HB3 GLN B 90 0.572 15.804 -7.592 1.00 0.00 H new ATOM 0 HG2 GLN B 90 1.521 16.592 -9.741 1.00 0.00 H new ATOM 0 HG3 GLN B 90 0.366 15.606 -10.616 1.00 0.00 H new ATOM 0 HE21 GLN B 90 0.841 18.492 -8.668 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -0.743 19.211 -8.979 1.00 0.00 H new ATOM 1416 N TYR B 91 3.257 14.874 -7.194 1.00 0.00 N ATOM 1417 CA TYR B 91 4.582 15.426 -6.931 1.00 0.00 C ATOM 1418 C TYR B 91 5.667 14.372 -7.133 1.00 0.00 C ATOM 1419 O TYR B 91 6.839 14.698 -7.293 1.00 0.00 O ATOM 1420 CB TYR B 91 4.652 15.954 -5.499 1.00 0.00 C ATOM 1421 CG TYR B 91 3.525 16.895 -5.141 1.00 0.00 C ATOM 1422 CD1 TYR B 91 2.349 16.416 -4.579 1.00 0.00 C ATOM 1423 CD2 TYR B 91 3.638 18.260 -5.367 1.00 0.00 C ATOM 1424 CE1 TYR B 91 1.316 17.270 -4.255 1.00 0.00 C ATOM 1425 CE2 TYR B 91 2.609 19.121 -5.043 1.00 0.00 C ATOM 1426 CZ TYR B 91 1.452 18.620 -4.489 1.00 0.00 C ATOM 1427 OH TYR B 91 0.425 19.474 -4.171 1.00 0.00 O ATOM 0 H TYR B 91 2.692 14.728 -6.358 1.00 0.00 H new ATOM 0 HA TYR B 91 4.752 16.241 -7.635 1.00 0.00 H new ATOM 0 HB2 TYR B 91 4.641 15.110 -4.809 1.00 0.00 H new ATOM 0 HB3 TYR B 91 5.602 16.469 -5.357 1.00 0.00 H new ATOM 0 HD1 TYR B 91 2.242 15.358 -4.393 1.00 0.00 H new ATOM 0 HD2 TYR B 91 4.544 18.654 -5.803 1.00 0.00 H new ATOM 0 HE1 TYR B 91 0.406 16.883 -3.821 1.00 0.00 H new ATOM 0 HE2 TYR B 91 2.711 20.181 -5.223 1.00 0.00 H new ATOM 0 HH TYR B 91 0.681 20.392 -4.398 1.00 0.00 H new ATOM 1437 N GLY B 92 5.267 13.108 -7.119 1.00 0.00 N ATOM 1438 CA GLY B 92 6.225 12.028 -7.238 1.00 0.00 C ATOM 1439 C GLY B 92 6.651 11.490 -5.888 1.00 0.00 C ATOM 1440 O GLY B 92 7.434 10.544 -5.808 1.00 0.00 O ATOM 0 H GLY B 92 4.295 12.811 -7.027 1.00 0.00 H new ATOM 0 HA2 GLY B 92 5.789 11.221 -7.828 1.00 0.00 H new ATOM 0 HA3 GLY B 92 7.102 12.381 -7.780 1.00 0.00 H new ATOM 1444 N HIS B 93 6.135 12.097 -4.825 1.00 0.00 N ATOM 1445 CA HIS B 93 6.454 11.665 -3.470 1.00 0.00 C ATOM 1446 C HIS B 93 5.816 10.312 -3.193 1.00 0.00 C ATOM 1447 O HIS B 93 4.596 10.163 -3.282 1.00 0.00 O ATOM 1448 CB HIS B 93 5.975 12.697 -2.441 1.00 0.00 C ATOM 1449 CG HIS B 93 6.495 12.452 -1.054 1.00 0.00 C ATOM 1450 ND1 HIS B 93 5.688 12.376 0.064 1.00 0.00 N ATOM 1451 CD2 HIS B 93 7.762 12.281 -0.605 1.00 0.00 C ATOM 1452 CE1 HIS B 93 6.436 12.174 1.131 1.00 0.00 C ATOM 1453 NE2 HIS B 93 7.697 12.111 0.753 1.00 0.00 N ATOM 0 H HIS B 93 5.494 12.889 -4.876 1.00 0.00 H new ATOM 0 HA HIS B 93 7.537 11.574 -3.383 1.00 0.00 H new ATOM 0 HB2 HIS B 93 6.284 13.691 -2.765 1.00 0.00 H new ATOM 0 HB3 HIS B 93 4.885 12.694 -2.417 1.00 0.00 H new ATOM 0 HD1 HIS B 93 4.672 12.463 0.064 1.00 0.00 H new ATOM 0 HD2 HIS B 93 8.659 12.279 -1.207 1.00 0.00 H new ATOM 0 HE1 HIS B 93 6.076 12.077 2.144 1.00 0.00 H new ATOM 1462 N GLN B 94 6.645 9.332 -2.877 1.00 0.00 N ATOM 1463 CA GLN B 94 6.175 7.979 -2.646 1.00 0.00 C ATOM 1464 C GLN B 94 5.878 7.758 -1.171 1.00 0.00 C ATOM 1465 O GLN B 94 6.759 7.904 -0.321 1.00 0.00 O ATOM 1466 CB GLN B 94 7.224 6.971 -3.114 1.00 0.00 C ATOM 1467 CG GLN B 94 7.641 7.158 -4.561 1.00 0.00 C ATOM 1468 CD GLN B 94 8.719 6.185 -4.985 1.00 0.00 C ATOM 1469 OE1 GLN B 94 9.911 6.464 -4.853 1.00 0.00 O ATOM 1470 NE2 GLN B 94 8.313 5.038 -5.506 1.00 0.00 N ATOM 0 H GLN B 94 7.653 9.450 -2.774 1.00 0.00 H new ATOM 0 HA GLN B 94 5.256 7.835 -3.215 1.00 0.00 H new ATOM 0 HB2 GLN B 94 8.105 7.053 -2.477 1.00 0.00 H new ATOM 0 HB3 GLN B 94 6.830 5.963 -2.985 1.00 0.00 H new ATOM 0 HG2 GLN B 94 6.771 7.034 -5.205 1.00 0.00 H new ATOM 0 HG3 GLN B 94 8.000 8.177 -4.703 1.00 0.00 H new ATOM 0 HE21 GLN B 94 7.316 4.844 -5.598 1.00 0.00 H new ATOM 0 HE22 GLN B 94 8.997 4.348 -5.815 1.00 0.00 H new ATOM 1479 N GLU B 95 4.641 7.405 -0.877 1.00 0.00 N ATOM 1480 CA GLU B 95 4.233 7.098 0.483 1.00 0.00 C ATOM 1481 C GLU B 95 3.825 5.637 0.584 1.00 0.00 C ATOM 1482 O GLU B 95 2.928 5.187 -0.127 1.00 0.00 O ATOM 1483 CB GLU B 95 3.084 8.010 0.914 1.00 0.00 C ATOM 1484 CG GLU B 95 3.520 9.435 1.221 1.00 0.00 C ATOM 1485 CD GLU B 95 4.450 9.512 2.416 1.00 0.00 C ATOM 1486 OE1 GLU B 95 5.646 9.199 2.266 1.00 0.00 O ATOM 1487 OE2 GLU B 95 3.995 9.887 3.517 1.00 0.00 O ATOM 0 H GLU B 95 3.895 7.323 -1.568 1.00 0.00 H new ATOM 0 HA GLU B 95 5.075 7.273 1.153 1.00 0.00 H new ATOM 0 HB2 GLU B 95 2.332 8.031 0.125 1.00 0.00 H new ATOM 0 HB3 GLU B 95 2.607 7.586 1.798 1.00 0.00 H new ATOM 0 HG2 GLU B 95 4.020 9.855 0.348 1.00 0.00 H new ATOM 0 HG3 GLU B 95 2.639 10.049 1.410 1.00 0.00 H new ATOM 1494 N VAL B 96 4.493 4.898 1.455 1.00 0.00 N ATOM 1495 CA VAL B 96 4.277 3.465 1.560 1.00 0.00 C ATOM 1496 C VAL B 96 3.659 3.097 2.902 1.00 0.00 C ATOM 1497 O VAL B 96 4.205 3.418 3.959 1.00 0.00 O ATOM 1498 CB VAL B 96 5.596 2.683 1.381 1.00 0.00 C ATOM 1499 CG1 VAL B 96 5.344 1.183 1.396 1.00 0.00 C ATOM 1500 CG2 VAL B 96 6.302 3.101 0.097 1.00 0.00 C ATOM 0 H VAL B 96 5.191 5.268 2.101 1.00 0.00 H new ATOM 0 HA VAL B 96 3.588 3.191 0.761 1.00 0.00 H new ATOM 0 HB VAL B 96 6.248 2.923 2.221 1.00 0.00 H new ATOM 0 HG11 VAL B 96 6.288 0.654 1.268 1.00 0.00 H new ATOM 0 HG12 VAL B 96 4.895 0.899 2.348 1.00 0.00 H new ATOM 0 HG13 VAL B 96 4.668 0.920 0.583 1.00 0.00 H new ATOM 0 HG21 VAL B 96 7.229 2.537 -0.009 1.00 0.00 H new ATOM 0 HG22 VAL B 96 5.655 2.899 -0.756 1.00 0.00 H new ATOM 0 HG23 VAL B 96 6.528 4.167 0.136 1.00 0.00 H new ATOM 1510 N THR B 97 2.515 2.437 2.852 1.00 0.00 N ATOM 1511 CA THR B 97 1.868 1.933 4.049 1.00 0.00 C ATOM 1512 C THR B 97 1.926 0.407 4.062 1.00 0.00 C ATOM 1513 O THR B 97 1.263 -0.256 3.264 1.00 0.00 O ATOM 1514 CB THR B 97 0.404 2.402 4.121 1.00 0.00 C ATOM 1515 OG1 THR B 97 0.335 3.807 3.835 1.00 0.00 O ATOM 1516 CG2 THR B 97 -0.186 2.133 5.496 1.00 0.00 C ATOM 0 H THR B 97 2.012 2.237 1.987 1.00 0.00 H new ATOM 0 HA THR B 97 2.396 2.325 4.918 1.00 0.00 H new ATOM 0 HB THR B 97 -0.173 1.845 3.383 1.00 0.00 H new ATOM 0 HG1 THR B 97 -0.473 4.184 4.242 1.00 0.00 H new ATOM 0 HG21 THR B 97 -1.221 2.474 5.521 1.00 0.00 H new ATOM 0 HG22 THR B 97 -0.151 1.064 5.704 1.00 0.00 H new ATOM 0 HG23 THR B 97 0.390 2.669 6.250 1.00 0.00 H new ATOM 1524 N ARG B 98 2.734 -0.147 4.955 1.00 0.00 N ATOM 1525 CA ARG B 98 2.939 -1.589 5.004 1.00 0.00 C ATOM 1526 C ARG B 98 1.905 -2.273 5.891 1.00 0.00 C ATOM 1527 O ARG B 98 1.393 -1.680 6.843 1.00 0.00 O ATOM 1528 CB ARG B 98 4.349 -1.912 5.501 1.00 0.00 C ATOM 1529 CG ARG B 98 5.451 -1.390 4.593 1.00 0.00 C ATOM 1530 CD ARG B 98 6.826 -1.830 5.072 1.00 0.00 C ATOM 1531 NE ARG B 98 7.140 -1.305 6.401 1.00 0.00 N ATOM 1532 CZ ARG B 98 7.625 -2.039 7.405 1.00 0.00 C ATOM 1533 NH1 ARG B 98 7.808 -3.346 7.258 1.00 0.00 N ATOM 1534 NH2 ARG B 98 7.916 -1.460 8.561 1.00 0.00 N ATOM 0 H ARG B 98 3.258 0.379 5.655 1.00 0.00 H new ATOM 0 HA ARG B 98 2.820 -1.972 3.990 1.00 0.00 H new ATOM 0 HB2 ARG B 98 4.480 -1.488 6.497 1.00 0.00 H new ATOM 0 HB3 ARG B 98 4.452 -2.993 5.598 1.00 0.00 H new ATOM 0 HG2 ARG B 98 5.287 -1.749 3.577 1.00 0.00 H new ATOM 0 HG3 ARG B 98 5.409 -0.301 4.557 1.00 0.00 H new ATOM 0 HD2 ARG B 98 6.871 -2.919 5.093 1.00 0.00 H new ATOM 0 HD3 ARG B 98 7.582 -1.494 4.362 1.00 0.00 H new ATOM 0 HE ARG B 98 6.978 -0.313 6.572 1.00 0.00 H new ATOM 0 HH11 ARG B 98 7.578 -3.797 6.373 1.00 0.00 H new ATOM 0 HH12 ARG B 98 8.179 -3.899 8.031 1.00 0.00 H new ATOM 0 HH21 ARG B 98 7.769 -0.458 8.681 1.00 0.00 H new ATOM 0 HH22 ARG B 98 8.287 -2.017 9.331 1.00 0.00 H new ATOM 1548 N PHE B 99 1.601 -3.521 5.560 1.00 0.00 N ATOM 1549 CA PHE B 99 0.675 -4.333 6.335 1.00 0.00 C ATOM 1550 C PHE B 99 1.056 -5.805 6.216 1.00 0.00 C ATOM 1551 O PHE B 99 1.996 -6.152 5.497 1.00 0.00 O ATOM 1552 CB PHE B 99 -0.775 -4.105 5.873 1.00 0.00 C ATOM 1553 CG PHE B 99 -1.021 -4.365 4.410 1.00 0.00 C ATOM 1554 CD1 PHE B 99 -0.842 -3.359 3.474 1.00 0.00 C ATOM 1555 CD2 PHE B 99 -1.447 -5.611 3.974 1.00 0.00 C ATOM 1556 CE1 PHE B 99 -1.078 -3.589 2.133 1.00 0.00 C ATOM 1557 CE2 PHE B 99 -1.684 -5.848 2.634 1.00 0.00 C ATOM 1558 CZ PHE B 99 -1.500 -4.836 1.712 1.00 0.00 C ATOM 0 H PHE B 99 1.990 -3.998 4.747 1.00 0.00 H new ATOM 0 HA PHE B 99 0.739 -4.035 7.382 1.00 0.00 H new ATOM 0 HB2 PHE B 99 -1.433 -4.748 6.457 1.00 0.00 H new ATOM 0 HB3 PHE B 99 -1.055 -3.076 6.097 1.00 0.00 H new ATOM 0 HD1 PHE B 99 -0.514 -2.382 3.798 1.00 0.00 H new ATOM 0 HD2 PHE B 99 -1.595 -6.405 4.691 1.00 0.00 H new ATOM 0 HE1 PHE B 99 -0.933 -2.796 1.414 1.00 0.00 H new ATOM 0 HE2 PHE B 99 -2.013 -6.824 2.307 1.00 0.00 H new ATOM 0 HZ PHE B 99 -1.686 -5.019 0.664 1.00 0.00 H new ATOM 1568 N ASP B 100 0.347 -6.665 6.924 1.00 0.00 N ATOM 1569 CA ASP B 100 0.641 -8.089 6.897 1.00 0.00 C ATOM 1570 C ASP B 100 -0.646 -8.898 6.904 1.00 0.00 C ATOM 1571 O ASP B 100 -1.623 -8.521 7.552 1.00 0.00 O ATOM 1572 CB ASP B 100 1.527 -8.492 8.086 1.00 0.00 C ATOM 1573 CG ASP B 100 0.838 -8.349 9.432 1.00 0.00 C ATOM 1574 OD1 ASP B 100 0.372 -9.369 9.980 1.00 0.00 O ATOM 1575 OD2 ASP B 100 0.767 -7.217 9.957 1.00 0.00 O ATOM 0 H ASP B 100 -0.435 -6.405 7.524 1.00 0.00 H new ATOM 0 HA ASP B 100 1.186 -8.302 5.977 1.00 0.00 H new ATOM 0 HB2 ASP B 100 1.845 -9.527 7.958 1.00 0.00 H new ATOM 0 HB3 ASP B 100 2.428 -7.879 8.081 1.00 0.00 H new ATOM 1580 N PHE B 101 -0.645 -9.997 6.169 1.00 0.00 N ATOM 1581 CA PHE B 101 -1.803 -10.874 6.101 1.00 0.00 C ATOM 1582 C PHE B 101 -1.386 -12.313 6.378 1.00 0.00 C ATOM 1583 O PHE B 101 -0.284 -12.728 6.021 1.00 0.00 O ATOM 1584 CB PHE B 101 -2.486 -10.763 4.726 1.00 0.00 C ATOM 1585 CG PHE B 101 -3.572 -11.782 4.496 1.00 0.00 C ATOM 1586 CD1 PHE B 101 -4.857 -11.566 4.970 1.00 0.00 C ATOM 1587 CD2 PHE B 101 -3.306 -12.957 3.808 1.00 0.00 C ATOM 1588 CE1 PHE B 101 -5.853 -12.502 4.764 1.00 0.00 C ATOM 1589 CE2 PHE B 101 -4.299 -13.896 3.599 1.00 0.00 C ATOM 1590 CZ PHE B 101 -5.574 -13.667 4.078 1.00 0.00 C ATOM 0 H PHE B 101 0.149 -10.305 5.608 1.00 0.00 H new ATOM 0 HA PHE B 101 -2.520 -10.566 6.862 1.00 0.00 H new ATOM 0 HB2 PHE B 101 -2.911 -9.765 4.623 1.00 0.00 H new ATOM 0 HB3 PHE B 101 -1.731 -10.870 3.947 1.00 0.00 H new ATOM 0 HD1 PHE B 101 -5.082 -10.656 5.506 1.00 0.00 H new ATOM 0 HD2 PHE B 101 -2.311 -13.140 3.431 1.00 0.00 H new ATOM 0 HE1 PHE B 101 -6.849 -12.322 5.140 1.00 0.00 H new ATOM 0 HE2 PHE B 101 -4.078 -14.807 3.062 1.00 0.00 H new ATOM 0 HZ PHE B 101 -6.352 -14.399 3.916 1.00 0.00 H new ATOM 1600 N THR B 102 -2.249 -13.054 7.048 1.00 0.00 N ATOM 1601 CA THR B 102 -2.020 -14.466 7.298 1.00 0.00 C ATOM 1602 C THR B 102 -3.352 -15.205 7.419 1.00 0.00 C ATOM 1603 O THR B 102 -3.494 -16.328 6.934 1.00 0.00 O ATOM 1604 CB THR B 102 -1.180 -14.690 8.575 1.00 0.00 C ATOM 1605 OG1 THR B 102 0.021 -13.907 8.512 1.00 0.00 O ATOM 1606 CG2 THR B 102 -0.814 -16.159 8.738 1.00 0.00 C ATOM 0 H THR B 102 -3.124 -12.697 7.433 1.00 0.00 H new ATOM 0 HA THR B 102 -1.460 -14.863 6.451 1.00 0.00 H new ATOM 0 HB THR B 102 -1.779 -14.382 9.432 1.00 0.00 H new ATOM 0 HG1 THR B 102 0.549 -14.052 9.325 1.00 0.00 H new ATOM 0 HG21 THR B 102 -0.223 -16.288 9.645 1.00 0.00 H new ATOM 0 HG22 THR B 102 -1.724 -16.755 8.810 1.00 0.00 H new ATOM 0 HG23 THR B 102 -0.233 -16.487 7.876 1.00 0.00 H new ATOM 1614 N THR B 103 -4.335 -14.566 8.049 1.00 0.00 N ATOM 1615 CA THR B 103 -5.645 -15.182 8.216 1.00 0.00 C ATOM 1616 C THR B 103 -6.683 -14.173 8.717 1.00 0.00 C ATOM 1617 O THR B 103 -7.871 -14.324 8.437 1.00 0.00 O ATOM 1618 CB THR B 103 -5.569 -16.385 9.188 1.00 0.00 C ATOM 1619 OG1 THR B 103 -6.809 -17.107 9.196 1.00 0.00 O ATOM 1620 CG2 THR B 103 -5.236 -15.934 10.603 1.00 0.00 C ATOM 0 H THR B 103 -4.249 -13.631 8.448 1.00 0.00 H new ATOM 0 HA THR B 103 -5.961 -15.538 7.235 1.00 0.00 H new ATOM 0 HB THR B 103 -4.772 -17.039 8.835 1.00 0.00 H new ATOM 0 HG1 THR B 103 -6.743 -17.864 9.814 1.00 0.00 H new ATOM 0 HG21 THR B 103 -5.190 -16.802 11.260 1.00 0.00 H new ATOM 0 HG22 THR B 103 -4.272 -15.426 10.605 1.00 0.00 H new ATOM 0 HG23 THR B 103 -6.007 -15.251 10.958 1.00 0.00 H new ATOM 1628 N THR B 104 -6.233 -13.147 9.438 1.00 0.00 N ATOM 1629 CA THR B 104 -7.134 -12.154 10.016 1.00 0.00 C ATOM 1630 C THR B 104 -8.178 -12.837 10.902 1.00 0.00 C ATOM 1631 O THR B 104 -9.372 -12.875 10.590 1.00 0.00 O ATOM 1632 CB THR B 104 -7.830 -11.310 8.923 1.00 0.00 C ATOM 1633 OG1 THR B 104 -6.864 -10.857 7.963 1.00 0.00 O ATOM 1634 CG2 THR B 104 -8.524 -10.100 9.531 1.00 0.00 C ATOM 0 H THR B 104 -5.246 -12.982 9.636 1.00 0.00 H new ATOM 0 HA THR B 104 -6.534 -11.478 10.626 1.00 0.00 H new ATOM 0 HB THR B 104 -8.574 -11.940 8.435 1.00 0.00 H new ATOM 0 HG1 THR B 104 -7.313 -10.325 7.273 1.00 0.00 H new ATOM 0 HG21 THR B 104 -9.006 -9.522 8.742 1.00 0.00 H new ATOM 0 HG22 THR B 104 -9.275 -10.433 10.247 1.00 0.00 H new ATOM 0 HG23 THR B 104 -7.789 -9.476 10.040 1.00 0.00 H new ATOM 1642 N SER B 105 -7.705 -13.398 12.003 1.00 0.00 N ATOM 1643 CA SER B 105 -8.558 -14.126 12.920 1.00 0.00 C ATOM 1644 C SER B 105 -9.217 -13.178 13.920 1.00 0.00 C ATOM 1645 O SER B 105 -8.558 -12.638 14.809 1.00 0.00 O ATOM 1646 CB SER B 105 -7.732 -15.194 13.635 1.00 0.00 C ATOM 1647 OG SER B 105 -6.441 -14.705 13.964 1.00 0.00 O ATOM 0 H SER B 105 -6.725 -13.361 12.283 1.00 0.00 H new ATOM 0 HA SER B 105 -9.357 -14.611 12.360 1.00 0.00 H new ATOM 0 HB2 SER B 105 -8.247 -15.510 14.542 1.00 0.00 H new ATOM 0 HB3 SER B 105 -7.640 -16.074 12.998 1.00 0.00 H new ATOM 0 HG SER B 105 -5.933 -15.406 14.422 1.00 0.00 H new ATOM 1653 N THR B 106 -10.518 -12.979 13.765 1.00 0.00 N ATOM 1654 CA THR B 106 -11.264 -12.051 14.601 1.00 0.00 C ATOM 1655 C THR B 106 -11.933 -12.756 15.785 1.00 0.00 C ATOM 1656 O THR B 106 -12.933 -12.273 16.320 1.00 0.00 O ATOM 1657 CB THR B 106 -12.328 -11.326 13.763 1.00 0.00 C ATOM 1658 OG1 THR B 106 -13.016 -12.277 12.941 1.00 0.00 O ATOM 1659 CG2 THR B 106 -11.694 -10.256 12.888 1.00 0.00 C ATOM 0 H THR B 106 -11.083 -13.453 13.061 1.00 0.00 H new ATOM 0 HA THR B 106 -10.553 -11.329 15.002 1.00 0.00 H new ATOM 0 HB THR B 106 -13.033 -10.842 14.439 1.00 0.00 H new ATOM 0 HG1 THR B 106 -13.696 -11.816 12.407 1.00 0.00 H new ATOM 0 HG21 THR B 106 -12.468 -9.757 12.305 1.00 0.00 H new ATOM 0 HG22 THR B 106 -11.186 -9.525 13.517 1.00 0.00 H new ATOM 0 HG23 THR B 106 -10.972 -10.718 12.214 1.00 0.00 H new ATOM 1667 N SER B 107 -11.379 -13.911 16.162 1.00 0.00 N ATOM 1668 CA SER B 107 -11.816 -14.672 17.339 1.00 0.00 C ATOM 1669 C SER B 107 -13.150 -15.391 17.103 1.00 0.00 C ATOM 1670 O SER B 107 -13.263 -16.588 17.368 1.00 0.00 O ATOM 1671 CB SER B 107 -11.901 -13.769 18.579 1.00 0.00 C ATOM 1672 OG SER B 107 -12.077 -14.533 19.760 1.00 0.00 O ATOM 0 H SER B 107 -10.609 -14.349 15.657 1.00 0.00 H new ATOM 0 HA SER B 107 -11.062 -15.438 17.517 1.00 0.00 H new ATOM 0 HB2 SER B 107 -10.992 -13.173 18.661 1.00 0.00 H new ATOM 0 HB3 SER B 107 -12.731 -13.071 18.467 1.00 0.00 H new ATOM 0 HG SER B 107 -12.126 -13.933 20.533 1.00 0.00 H new ATOM 1678 N THR B 108 -14.148 -14.670 16.603 1.00 0.00 N ATOM 1679 CA THR B 108 -15.477 -15.234 16.375 1.00 0.00 C ATOM 1680 C THR B 108 -15.435 -16.438 15.415 1.00 0.00 C ATOM 1681 O THR B 108 -15.929 -17.513 15.757 1.00 0.00 O ATOM 1682 CB THR B 108 -16.442 -14.164 15.827 1.00 0.00 C ATOM 1683 OG1 THR B 108 -16.216 -12.918 16.501 1.00 0.00 O ATOM 1684 CG2 THR B 108 -17.889 -14.591 16.019 1.00 0.00 C ATOM 0 H THR B 108 -14.062 -13.687 16.346 1.00 0.00 H new ATOM 0 HA THR B 108 -15.842 -15.584 17.341 1.00 0.00 H new ATOM 0 HB THR B 108 -16.254 -14.045 14.760 1.00 0.00 H new ATOM 0 HG1 THR B 108 -16.830 -12.240 16.149 1.00 0.00 H new ATOM 0 HG21 THR B 108 -18.551 -13.820 15.625 1.00 0.00 H new ATOM 0 HG22 THR B 108 -18.066 -15.527 15.489 1.00 0.00 H new ATOM 0 HG23 THR B 108 -18.089 -14.732 17.081 1.00 0.00 H new ATOM 1692 N PRO B 109 -14.836 -16.294 14.206 1.00 0.00 N ATOM 1693 CA PRO B 109 -14.715 -17.410 13.254 1.00 0.00 C ATOM 1694 C PRO B 109 -13.794 -18.513 13.767 1.00 0.00 C ATOM 1695 O PRO B 109 -13.733 -19.600 13.189 1.00 0.00 O ATOM 1696 CB PRO B 109 -14.113 -16.760 12.003 1.00 0.00 C ATOM 1697 CG PRO B 109 -13.418 -15.546 12.507 1.00 0.00 C ATOM 1698 CD PRO B 109 -14.252 -15.054 13.655 1.00 0.00 C ATOM 0 HA PRO B 109 -15.676 -17.893 13.078 1.00 0.00 H new ATOM 0 HB2 PRO B 109 -13.419 -17.434 11.501 1.00 0.00 H new ATOM 0 HB3 PRO B 109 -14.886 -16.502 11.279 1.00 0.00 H new ATOM 0 HG2 PRO B 109 -12.404 -15.780 12.831 1.00 0.00 H new ATOM 0 HG3 PRO B 109 -13.337 -14.788 11.728 1.00 0.00 H new ATOM 0 HD2 PRO B 109 -13.648 -14.530 14.396 1.00 0.00 H new ATOM 0 HD3 PRO B 109 -15.023 -14.359 13.323 1.00 0.00 H new ATOM 1706 N GLY B 110 -13.096 -18.226 14.866 1.00 0.00 N ATOM 1707 CA GLY B 110 -12.152 -19.170 15.436 1.00 0.00 C ATOM 1708 C GLY B 110 -12.824 -20.410 15.985 1.00 0.00 C ATOM 1709 O GLY B 110 -12.178 -21.436 16.190 1.00 0.00 O ATOM 0 H GLY B 110 -13.171 -17.345 15.375 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -11.430 -19.461 14.673 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -11.593 -18.681 16.234 1.00 0.00 H new ATOM 1713 N SER B 111 -14.127 -20.324 16.211 1.00 0.00 N ATOM 1714 CA SER B 111 -14.907 -21.472 16.653 1.00 0.00 C ATOM 1715 C SER B 111 -15.285 -22.352 15.458 1.00 0.00 C ATOM 1716 O SER B 111 -16.371 -22.933 15.421 1.00 0.00 O ATOM 1717 CB SER B 111 -16.165 -20.992 17.376 1.00 0.00 C ATOM 1718 OG SER B 111 -15.834 -20.102 18.433 1.00 0.00 O ATOM 0 H SER B 111 -14.669 -19.467 16.095 1.00 0.00 H new ATOM 0 HA SER B 111 -14.305 -22.066 17.341 1.00 0.00 H new ATOM 0 HB2 SER B 111 -16.827 -20.493 16.669 1.00 0.00 H new ATOM 0 HB3 SER B 111 -16.710 -21.848 17.773 1.00 0.00 H new ATOM 0 HG SER B 111 -16.654 -19.806 18.881 1.00 0.00 H new ATOM 1724 N ARG B 112 -14.369 -22.441 14.491 1.00 0.00 N ATOM 1725 CA ARG B 112 -14.601 -23.158 13.243 1.00 0.00 C ATOM 1726 C ARG B 112 -15.903 -22.678 12.604 1.00 0.00 C ATOM 1727 O ARG B 112 -16.792 -23.467 12.280 1.00 0.00 O ATOM 1728 CB ARG B 112 -14.630 -24.673 13.475 1.00 0.00 C ATOM 1729 CG ARG B 112 -14.590 -25.475 12.186 1.00 0.00 C ATOM 1730 CD ARG B 112 -14.628 -26.970 12.439 1.00 0.00 C ATOM 1731 NE ARG B 112 -14.577 -27.715 11.186 1.00 0.00 N ATOM 1732 CZ ARG B 112 -14.478 -29.039 11.094 1.00 0.00 C ATOM 1733 NH1 ARG B 112 -14.451 -29.791 12.185 1.00 0.00 N ATOM 1734 NH2 ARG B 112 -14.409 -29.606 9.901 1.00 0.00 N ATOM 0 H ARG B 112 -13.444 -22.015 14.555 1.00 0.00 H new ATOM 0 HA ARG B 112 -13.777 -22.947 12.561 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -13.781 -24.955 14.098 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -15.532 -24.932 14.029 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -15.435 -25.193 11.558 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -13.685 -25.225 11.633 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -13.787 -27.257 13.071 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -15.537 -27.227 12.982 1.00 0.00 H new ATOM 0 HE ARG B 112 -14.620 -27.183 10.317 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -14.506 -29.356 13.106 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -14.375 -30.805 12.104 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -14.432 -29.029 9.060 1.00 0.00 H new ATOM 0 HH22 ARG B 112 -14.333 -30.620 9.822 1.00 0.00 H new ATOM 1748 N SER B 113 -16.013 -21.370 12.447 1.00 0.00 N ATOM 1749 CA SER B 113 -17.218 -20.776 11.903 1.00 0.00 C ATOM 1750 C SER B 113 -16.871 -19.862 10.738 1.00 0.00 C ATOM 1751 O SER B 113 -16.687 -18.657 10.909 1.00 0.00 O ATOM 1752 CB SER B 113 -17.962 -20.001 12.995 1.00 0.00 C ATOM 1753 OG SER B 113 -19.248 -19.599 12.556 1.00 0.00 O ATOM 0 H SER B 113 -15.282 -20.701 12.689 1.00 0.00 H new ATOM 0 HA SER B 113 -17.870 -21.569 11.537 1.00 0.00 H new ATOM 0 HB2 SER B 113 -18.057 -20.623 13.885 1.00 0.00 H new ATOM 0 HB3 SER B 113 -17.382 -19.123 13.280 1.00 0.00 H new ATOM 0 HG SER B 113 -19.700 -19.108 13.274 1.00 0.00 H new ATOM 1759 N HIS B 114 -16.756 -20.445 9.555 1.00 0.00 N ATOM 1760 CA HIS B 114 -16.442 -19.681 8.358 1.00 0.00 C ATOM 1761 C HIS B 114 -17.561 -19.803 7.333 1.00 0.00 C ATOM 1762 O HIS B 114 -17.488 -20.616 6.411 1.00 0.00 O ATOM 1763 CB HIS B 114 -15.115 -20.141 7.746 1.00 0.00 C ATOM 1764 CG HIS B 114 -13.922 -19.816 8.590 1.00 0.00 C ATOM 1765 ND1 HIS B 114 -13.106 -18.729 8.361 1.00 0.00 N ATOM 1766 CD2 HIS B 114 -13.410 -20.443 9.675 1.00 0.00 C ATOM 1767 CE1 HIS B 114 -12.146 -18.703 9.265 1.00 0.00 C ATOM 1768 NE2 HIS B 114 -12.308 -19.732 10.075 1.00 0.00 N ATOM 0 H HIS B 114 -16.876 -21.446 9.398 1.00 0.00 H new ATOM 0 HA HIS B 114 -16.344 -18.634 8.647 1.00 0.00 H new ATOM 0 HB2 HIS B 114 -15.153 -21.218 7.585 1.00 0.00 H new ATOM 0 HB3 HIS B 114 -14.995 -19.676 6.767 1.00 0.00 H new ATOM 0 HD2 HIS B 114 -13.798 -21.338 10.140 1.00 0.00 H new ATOM 0 HE1 HIS B 114 -11.361 -17.965 9.331 1.00 0.00 H new ATOM 0 HE2 HIS B 114 -11.711 -19.961 10.869 1.00 0.00 H new ATOM 1777 N HIS B 115 -18.601 -19.002 7.510 1.00 0.00 N ATOM 1778 CA HIS B 115 -19.716 -18.976 6.573 1.00 0.00 C ATOM 1779 C HIS B 115 -19.405 -18.036 5.419 1.00 0.00 C ATOM 1780 O HIS B 115 -19.209 -16.837 5.618 1.00 0.00 O ATOM 1781 CB HIS B 115 -21.011 -18.540 7.267 1.00 0.00 C ATOM 1782 CG HIS B 115 -21.635 -19.599 8.123 1.00 0.00 C ATOM 1783 ND1 HIS B 115 -22.934 -20.029 7.956 1.00 0.00 N ATOM 1784 CD2 HIS B 115 -21.139 -20.306 9.165 1.00 0.00 C ATOM 1785 CE1 HIS B 115 -23.209 -20.955 8.854 1.00 0.00 C ATOM 1786 NE2 HIS B 115 -22.137 -21.142 9.600 1.00 0.00 N ATOM 0 H HIS B 115 -18.697 -18.359 8.296 1.00 0.00 H new ATOM 0 HA HIS B 115 -19.859 -19.986 6.188 1.00 0.00 H new ATOM 0 HB2 HIS B 115 -20.803 -17.666 7.884 1.00 0.00 H new ATOM 0 HB3 HIS B 115 -21.730 -18.231 6.509 1.00 0.00 H new ATOM 0 HD2 HIS B 115 -20.144 -20.227 9.577 1.00 0.00 H new ATOM 0 HE1 HIS B 115 -24.151 -21.472 8.961 1.00 0.00 H new ATOM 0 HE2 HIS B 115 -22.062 -21.801 10.375 1.00 0.00 H new ATOM 1795 N HIS B 116 -19.356 -18.587 4.219 1.00 0.00 N ATOM 1796 CA HIS B 116 -19.043 -17.808 3.033 1.00 0.00 C ATOM 1797 C HIS B 116 -20.285 -17.644 2.170 1.00 0.00 C ATOM 1798 O HIS B 116 -20.298 -18.023 0.995 1.00 0.00 O ATOM 1799 CB HIS B 116 -17.926 -18.479 2.227 1.00 0.00 C ATOM 1800 CG HIS B 116 -16.610 -18.523 2.939 1.00 0.00 C ATOM 1801 ND1 HIS B 116 -16.106 -19.667 3.522 1.00 0.00 N ATOM 1802 CD2 HIS B 116 -15.686 -17.559 3.152 1.00 0.00 C ATOM 1803 CE1 HIS B 116 -14.934 -19.403 4.065 1.00 0.00 C ATOM 1804 NE2 HIS B 116 -14.655 -18.130 3.855 1.00 0.00 N ATOM 0 H HIS B 116 -19.530 -19.576 4.039 1.00 0.00 H new ATOM 0 HA HIS B 116 -18.699 -16.823 3.348 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -18.229 -19.497 1.981 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -17.801 -17.947 1.284 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -15.748 -16.530 2.829 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -14.309 -20.108 4.592 1.00 0.00 H new ATOM 0 HE2 HIS B 116 -13.811 -17.649 4.165 1.00 0.00 H new ATOM 1813 N HIS B 117 -21.336 -17.093 2.764 1.00 0.00 N ATOM 1814 CA HIS B 117 -22.585 -16.858 2.053 1.00 0.00 C ATOM 1815 C HIS B 117 -22.445 -15.633 1.159 1.00 0.00 C ATOM 1816 O HIS B 117 -22.938 -14.552 1.479 1.00 0.00 O ATOM 1817 CB HIS B 117 -23.741 -16.673 3.045 1.00 0.00 C ATOM 1818 CG HIS B 117 -25.091 -16.561 2.400 1.00 0.00 C ATOM 1819 ND1 HIS B 117 -25.797 -17.651 1.944 1.00 0.00 N ATOM 1820 CD2 HIS B 117 -25.865 -15.481 2.141 1.00 0.00 C ATOM 1821 CE1 HIS B 117 -26.944 -17.249 1.432 1.00 0.00 C ATOM 1822 NE2 HIS B 117 -27.011 -15.937 1.541 1.00 0.00 N ATOM 0 H HIS B 117 -21.347 -16.800 3.741 1.00 0.00 H new ATOM 0 HA HIS B 117 -22.808 -17.725 1.431 1.00 0.00 H new ATOM 0 HB2 HIS B 117 -23.750 -17.515 3.737 1.00 0.00 H new ATOM 0 HB3 HIS B 117 -23.558 -15.776 3.637 1.00 0.00 H new ATOM 0 HD2 HIS B 117 -25.625 -14.452 2.365 1.00 0.00 H new ATOM 0 HE1 HIS B 117 -27.700 -17.886 0.997 1.00 0.00 H new ATOM 0 HE2 HIS B 117 -27.789 -15.355 1.230 1.00 0.00 H new ATOM 1831 N HIS B 118 -21.752 -15.810 0.051 1.00 0.00 N ATOM 1832 CA HIS B 118 -21.509 -14.723 -0.879 1.00 0.00 C ATOM 1833 C HIS B 118 -22.587 -14.698 -1.953 1.00 0.00 C ATOM 1834 O HIS B 118 -22.903 -15.736 -2.537 1.00 0.00 O ATOM 1835 CB HIS B 118 -20.125 -14.882 -1.517 1.00 0.00 C ATOM 1836 CG HIS B 118 -19.717 -13.743 -2.405 1.00 0.00 C ATOM 1837 ND1 HIS B 118 -18.973 -12.673 -1.960 1.00 0.00 N ATOM 1838 CD2 HIS B 118 -19.934 -13.524 -3.723 1.00 0.00 C ATOM 1839 CE1 HIS B 118 -18.750 -11.847 -2.964 1.00 0.00 C ATOM 1840 NE2 HIS B 118 -19.322 -12.341 -4.044 1.00 0.00 N ATOM 0 H HIS B 118 -21.345 -16.702 -0.229 1.00 0.00 H new ATOM 0 HA HIS B 118 -21.540 -13.779 -0.336 1.00 0.00 H new ATOM 0 HB2 HIS B 118 -19.384 -14.993 -0.725 1.00 0.00 H new ATOM 0 HB3 HIS B 118 -20.110 -15.804 -2.099 1.00 0.00 H new ATOM 0 HD2 HIS B 118 -20.487 -14.163 -4.396 1.00 0.00 H new ATOM 0 HE1 HIS B 118 -18.193 -10.923 -2.910 1.00 0.00 H new ATOM 0 HE2 HIS B 118 -19.311 -11.912 -4.969 1.00 0.00 H new ATOM 1849 N HIS B 119 -23.142 -13.515 -2.191 1.00 0.00 N ATOM 1850 CA HIS B 119 -24.159 -13.313 -3.219 1.00 0.00 C ATOM 1851 C HIS B 119 -25.406 -14.143 -2.911 1.00 0.00 C ATOM 1852 O HIS B 119 -25.578 -15.224 -3.512 1.00 0.00 O ATOM 1853 CB HIS B 119 -23.594 -13.662 -4.604 1.00 0.00 C ATOM 1854 CG HIS B 119 -24.467 -13.237 -5.743 1.00 0.00 C ATOM 1855 ND1 HIS B 119 -24.418 -11.974 -6.295 1.00 0.00 N ATOM 1856 CD2 HIS B 119 -25.406 -13.914 -6.443 1.00 0.00 C ATOM 1857 CE1 HIS B 119 -25.287 -11.895 -7.284 1.00 0.00 C ATOM 1858 NE2 HIS B 119 -25.898 -13.058 -7.394 1.00 0.00 N ATOM 1859 OXT HIS B 119 -26.203 -13.716 -2.052 1.00 0.00 O ATOM 0 H HIS B 119 -22.900 -12.668 -1.677 1.00 0.00 H new ATOM 0 HA HIS B 119 -24.447 -12.262 -3.223 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -22.616 -13.193 -4.715 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -23.439 -14.739 -4.661 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -25.711 -14.938 -6.283 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -25.467 -11.026 -7.899 1.00 0.00 H new ATOM 0 HE2 HIS B 119 -26.621 -13.285 -8.077 1.00 0.00 H new TER 1868 HIS B 119