USER MOD reduce.3.24.130724 H: found=0, std=0, add=1205, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1205 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 71 GLN : amide:sc= 0.162 K(o=2.1,f=1.1) USER MOD Set 1.2: B 75 THR OG1 : rot 69:sc= 1.9 USER MOD Set 2.1: A 85 ASN : amide:sc= 1.76 K(o=3.8,f=-0.13) USER MOD Set 2.2: B 20 SER OG : rot 55:sc= 0.813 USER MOD Set 2.3: B 27 HIS : no HE2:sc= 1.22 K(o=3.8,f=-4.2!) USER MOD Set 3.1: B 18 LYS NZ :NH3+ -115:sc= 0.903 (180deg=-0.0755) USER MOD Set 3.2: B 19 TYR OH : rot 170:sc= 0.712 USER MOD Set 3.3: B 40 LYS NZ :NH3+ 160:sc= 0.825 (180deg=0) USER MOD Set 4.1: A 63 ASN : amide:sc= 0.121 K(o=0.21,f=-1.1) USER MOD Set 4.2: A 64 LYS NZ :NH3+ 169:sc= 0.093 (180deg=-0.249) USER MOD Single : A 3 SER OG : rot -42:sc= 0.919 USER MOD Single : A 7 GLN : amide:sc= -1.07 X(o=-1.1,f=-0.92) USER MOD Single : A 17 HIS : no HE2:sc= 0.926 K(o=0.93,f=-3.1!) USER MOD Single : A 18 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.049) USER MOD Single : A 19 TYR OH : rot 90:sc= -0.0284 USER MOD Single : A 20 SER OG : rot 78:sc= 1.16 USER MOD Single : A 22 LYS NZ :NH3+ -133:sc= 0.904 (180deg=0.411) USER MOD Single : A 26 LYS NZ :NH3+ 153:sc= 0.0159 (180deg=-0.0319) USER MOD Single : A 27 HIS : no HE2:sc= -0.0477 K(o=-0.048,f=-2.6!) USER MOD Single : A 28 THR OG1 : rot -74:sc= 1.12 USER MOD Single : A 30 SER OG : rot 178:sc= -0.0949 USER MOD Single : A 31 LYS NZ :NH3+ 159:sc= 1.89 (180deg=1.25) USER MOD Single : A 32 LYS NZ :NH3+ 155:sc= 0.779 (180deg=0.167) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= 0.827 K(o=0.83,f=-0.033) USER MOD Single : A 40 LYS NZ :NH3+ -139:sc= 0.486 (180deg=0.0109) USER MOD Single : A 55 LYS NZ :NH3+ -106:sc= 0.0195 (180deg=0.000313) USER MOD Single : A 57 MET CE :methyl -170:sc= -0.002 (180deg=-0.198) USER MOD Single : A 66 GLN : amide:sc= -0.0574 X(o=-0.057,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.411 K(o=0.41,f=-3.6!) USER MOD Single : A 71 GLN : amide:sc= 0.765 K(o=0.77,f=-0.07) USER MOD Single : A 73 TYR OH : rot 15:sc= 0 USER MOD Single : A 75 THR OG1 : rot 12:sc= 0.709 USER MOD Single : A 82 MET CE :methyl 170:sc= -0.0172 (180deg=-0.176) USER MOD Single : A 84 TYR OH : rot -170:sc= 1.24 USER MOD Single : B 3 SER OG : rot -32:sc= 0.176 USER MOD Single : B 7 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : B 17 HIS : no HE2:sc= 0.646 K(o=0.65,f=-3.1!) USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 LYS NZ :NH3+ -165:sc= 0.963 (180deg=0.739) USER MOD Single : B 28 THR OG1 : rot -61:sc= 0.826 USER MOD Single : B 30 SER OG : rot -77:sc= 1.74 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0317) USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 GLN : amide:sc= -0.142 X(o=-0.14,f=-0.14) USER MOD Single : B 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 63 ASN : amide:sc= 0.912 K(o=0.91,f=-0.015) USER MOD Single : B 64 LYS NZ :NH3+ -179:sc= 0.335 (180deg=0.328) USER MOD Single : B 66 GLN : amide:sc= -0.209 K(o=-0.21,f=-2) USER MOD Single : B 69 ASN : amide:sc= 0.587 K(o=0.59,f=-5.9!) USER MOD Single : B 73 TYR OH : rot 156:sc= 1.13 USER MOD Single : B 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 84 TYR OH : rot -4:sc= 1.24 USER MOD Single : B 85 ASN : amide:sc= -0.456 X(o=-0.46,f=-0.25) USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -11.885 7.376 9.342 1.00 0.00 N ATOM 31 CA SER A 3 -11.768 8.070 8.067 1.00 0.00 C ATOM 32 C SER A 3 -12.174 7.160 6.903 1.00 0.00 C ATOM 33 O SER A 3 -12.135 5.936 7.035 1.00 0.00 O ATOM 34 CB SER A 3 -10.309 8.520 7.878 1.00 0.00 C ATOM 35 OG SER A 3 -9.418 7.485 8.252 1.00 0.00 O ATOM 0 HA SER A 3 -12.436 8.931 8.075 1.00 0.00 H new ATOM 0 HB2 SER A 3 -10.139 8.795 6.837 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.116 9.409 8.479 1.00 0.00 H new ATOM 0 HG SER A 3 -9.736 7.061 9.076 1.00 0.00 H new ATOM 41 N PRO A 4 -12.495 7.736 5.729 1.00 0.00 N ATOM 42 CA PRO A 4 -12.652 6.962 4.507 1.00 0.00 C ATOM 43 C PRO A 4 -11.365 6.175 4.223 1.00 0.00 C ATOM 44 O PRO A 4 -11.426 5.019 3.810 1.00 0.00 O ATOM 45 CB PRO A 4 -12.980 7.975 3.406 1.00 0.00 C ATOM 46 CG PRO A 4 -12.445 9.301 3.946 1.00 0.00 C ATOM 47 CD PRO A 4 -12.643 9.158 5.455 1.00 0.00 C ATOM 0 HA PRO A 4 -13.449 6.221 4.577 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -12.503 7.707 2.463 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -14.052 8.025 3.217 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -11.396 9.449 3.688 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -12.995 10.152 3.545 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -11.906 9.743 6.005 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -13.627 9.517 5.758 1.00 0.00 H new ATOM 55 N LEU A 5 -10.205 6.793 4.483 1.00 0.00 N ATOM 56 CA LEU A 5 -8.904 6.142 4.408 1.00 0.00 C ATOM 57 C LEU A 5 -8.876 4.903 5.301 1.00 0.00 C ATOM 58 O LEU A 5 -8.626 3.802 4.815 1.00 0.00 O ATOM 59 CB LEU A 5 -7.798 7.139 4.785 1.00 0.00 C ATOM 60 CG LEU A 5 -6.384 6.531 4.762 1.00 0.00 C ATOM 61 CD1 LEU A 5 -6.030 5.941 3.392 1.00 0.00 C ATOM 62 CD2 LEU A 5 -5.366 7.617 5.127 1.00 0.00 C ATOM 0 H LEU A 5 -10.151 7.775 4.755 1.00 0.00 H new ATOM 0 HA LEU A 5 -8.724 5.811 3.385 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -7.832 7.984 4.097 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -7.999 7.532 5.782 1.00 0.00 H new ATOM 0 HG LEU A 5 -6.357 5.718 5.487 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -5.023 5.524 3.425 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -6.741 5.154 3.140 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -6.074 6.725 2.636 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -4.362 7.194 5.113 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -5.427 8.431 4.404 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -5.584 8.000 6.124 1.00 0.00 H new ATOM 74 N ASP A 6 -9.140 5.060 6.603 1.00 0.00 N ATOM 75 CA ASP A 6 -9.162 3.914 7.505 1.00 0.00 C ATOM 76 C ASP A 6 -10.140 2.849 7.012 1.00 0.00 C ATOM 77 O ASP A 6 -9.803 1.670 6.998 1.00 0.00 O ATOM 78 CB ASP A 6 -9.502 4.358 8.925 1.00 0.00 C ATOM 79 CG ASP A 6 -9.528 3.168 9.882 1.00 0.00 C ATOM 80 OD1 ASP A 6 -10.567 2.472 9.906 1.00 0.00 O ATOM 81 OD2 ASP A 6 -8.512 2.983 10.585 1.00 0.00 O ATOM 0 H ASP A 6 -9.338 5.957 7.046 1.00 0.00 H new ATOM 0 HA ASP A 6 -8.167 3.469 7.518 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -8.768 5.087 9.267 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -10.472 4.855 8.931 1.00 0.00 H new ATOM 86 N GLN A 7 -11.335 3.255 6.579 1.00 0.00 N ATOM 87 CA GLN A 7 -12.290 2.351 5.954 1.00 0.00 C ATOM 88 C GLN A 7 -11.647 1.601 4.781 1.00 0.00 C ATOM 89 O GLN A 7 -11.850 0.398 4.643 1.00 0.00 O ATOM 90 CB GLN A 7 -13.557 3.138 5.578 1.00 0.00 C ATOM 91 CG GLN A 7 -14.545 2.403 4.657 1.00 0.00 C ATOM 92 CD GLN A 7 -14.187 2.370 3.165 1.00 0.00 C ATOM 93 OE1 GLN A 7 -14.665 1.502 2.444 1.00 0.00 O ATOM 94 NE2 GLN A 7 -13.369 3.292 2.661 1.00 0.00 N ATOM 0 H GLN A 7 -11.663 4.218 6.653 1.00 0.00 H new ATOM 0 HA GLN A 7 -12.594 1.573 6.655 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -14.078 3.413 6.495 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -13.256 4.066 5.092 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -14.641 1.376 5.009 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -15.524 2.870 4.764 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -12.975 4.011 3.268 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -13.136 3.279 1.668 1.00 0.00 H new ATOM 103 N ALA A 8 -10.869 2.288 3.940 1.00 0.00 N ATOM 104 CA ALA A 8 -10.236 1.669 2.783 1.00 0.00 C ATOM 105 C ALA A 8 -9.200 0.641 3.240 1.00 0.00 C ATOM 106 O ALA A 8 -9.149 -0.469 2.711 1.00 0.00 O ATOM 107 CB ALA A 8 -9.619 2.733 1.870 1.00 0.00 C ATOM 0 H ALA A 8 -10.664 3.282 4.045 1.00 0.00 H new ATOM 0 HA ALA A 8 -10.993 1.144 2.200 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -9.151 2.250 1.012 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -10.398 3.412 1.524 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -8.867 3.296 2.423 1.00 0.00 H new ATOM 113 N ILE A 9 -8.394 1.000 4.245 1.00 0.00 N ATOM 114 CA ILE A 9 -7.460 0.070 4.871 1.00 0.00 C ATOM 115 C ILE A 9 -8.231 -1.155 5.374 1.00 0.00 C ATOM 116 O ILE A 9 -7.893 -2.280 5.021 1.00 0.00 O ATOM 117 CB ILE A 9 -6.647 0.765 5.984 1.00 0.00 C ATOM 118 CG1 ILE A 9 -5.778 1.878 5.367 1.00 0.00 C ATOM 119 CG2 ILE A 9 -5.768 -0.254 6.729 1.00 0.00 C ATOM 120 CD1 ILE A 9 -4.999 2.700 6.398 1.00 0.00 C ATOM 0 H ILE A 9 -8.374 1.939 4.643 1.00 0.00 H new ATOM 0 HA ILE A 9 -6.730 -0.271 4.137 1.00 0.00 H new ATOM 0 HB ILE A 9 -7.335 1.207 6.705 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -5.073 1.429 4.667 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -6.417 2.547 4.791 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -5.203 0.255 7.510 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -6.400 -1.019 7.179 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -5.077 -0.721 6.027 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -4.412 3.463 5.887 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.697 3.179 7.084 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -4.333 2.044 6.958 1.00 0.00 H new ATOM 132 N GLY A 10 -9.274 -0.939 6.178 1.00 0.00 N ATOM 133 CA GLY A 10 -10.129 -1.982 6.725 1.00 0.00 C ATOM 134 C GLY A 10 -10.640 -2.915 5.628 1.00 0.00 C ATOM 135 O GLY A 10 -10.495 -4.133 5.723 1.00 0.00 O ATOM 0 H GLY A 10 -9.551 -0.003 6.473 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -9.575 -2.558 7.466 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.974 -1.528 7.242 1.00 0.00 H new ATOM 139 N LEU A 11 -11.222 -2.336 4.576 1.00 0.00 N ATOM 140 CA LEU A 11 -11.700 -3.066 3.413 1.00 0.00 C ATOM 141 C LEU A 11 -10.564 -3.932 2.864 1.00 0.00 C ATOM 142 O LEU A 11 -10.693 -5.154 2.793 1.00 0.00 O ATOM 143 CB LEU A 11 -12.254 -2.053 2.391 1.00 0.00 C ATOM 144 CG LEU A 11 -12.968 -2.611 1.146 1.00 0.00 C ATOM 145 CD1 LEU A 11 -12.019 -3.268 0.138 1.00 0.00 C ATOM 146 CD2 LEU A 11 -14.123 -3.551 1.507 1.00 0.00 C ATOM 0 H LEU A 11 -11.374 -1.329 4.513 1.00 0.00 H new ATOM 0 HA LEU A 11 -12.514 -3.745 3.667 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -12.952 -1.398 2.912 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -11.425 -1.431 2.052 1.00 0.00 H new ATOM 0 HG LEU A 11 -13.391 -1.738 0.650 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -12.591 -3.638 -0.713 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -11.290 -2.535 -0.206 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -11.500 -4.099 0.615 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -14.593 -3.917 0.594 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.740 -4.395 2.081 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -14.859 -3.011 2.103 1.00 0.00 H new ATOM 158 N LEU A 12 -9.439 -3.311 2.501 1.00 0.00 N ATOM 159 CA LEU A 12 -8.316 -4.013 1.897 1.00 0.00 C ATOM 160 C LEU A 12 -7.833 -5.163 2.783 1.00 0.00 C ATOM 161 O LEU A 12 -7.737 -6.300 2.322 1.00 0.00 O ATOM 162 CB LEU A 12 -7.178 -3.028 1.598 1.00 0.00 C ATOM 163 CG LEU A 12 -5.946 -3.713 0.978 1.00 0.00 C ATOM 164 CD1 LEU A 12 -6.272 -4.378 -0.364 1.00 0.00 C ATOM 165 CD2 LEU A 12 -4.843 -2.674 0.779 1.00 0.00 C ATOM 0 H LEU A 12 -9.286 -2.309 2.619 1.00 0.00 H new ATOM 0 HA LEU A 12 -8.652 -4.451 0.957 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -7.540 -2.257 0.918 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -6.884 -2.528 2.521 1.00 0.00 H new ATOM 0 HG LEU A 12 -5.616 -4.496 1.661 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -5.374 -4.848 -0.765 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -7.043 -5.134 -0.218 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -6.631 -3.625 -1.066 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -3.967 -3.152 0.340 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -5.199 -1.888 0.113 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -4.575 -2.239 1.742 1.00 0.00 H new ATOM 177 N ILE A 13 -7.494 -4.879 4.042 1.00 0.00 N ATOM 178 CA ILE A 13 -6.945 -5.893 4.930 1.00 0.00 C ATOM 179 C ILE A 13 -7.981 -6.979 5.209 1.00 0.00 C ATOM 180 O ILE A 13 -7.609 -8.143 5.305 1.00 0.00 O ATOM 181 CB ILE A 13 -6.306 -5.294 6.199 1.00 0.00 C ATOM 182 CG1 ILE A 13 -7.303 -4.643 7.172 1.00 0.00 C ATOM 183 CG2 ILE A 13 -5.215 -4.290 5.806 1.00 0.00 C ATOM 184 CD1 ILE A 13 -7.768 -5.606 8.269 1.00 0.00 C ATOM 0 H ILE A 13 -7.592 -3.956 4.464 1.00 0.00 H new ATOM 0 HA ILE A 13 -6.114 -6.377 4.417 1.00 0.00 H new ATOM 0 HB ILE A 13 -5.877 -6.135 6.744 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -6.839 -3.770 7.632 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -8.169 -4.287 6.615 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.766 -3.869 6.706 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -4.448 -4.797 5.221 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -5.655 -3.489 5.211 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -8.470 -5.095 8.928 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -8.258 -6.467 7.814 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -6.907 -5.942 8.847 1.00 0.00 H new ATOM 196 N GLY A 14 -9.269 -6.629 5.293 1.00 0.00 N ATOM 197 CA GLY A 14 -10.349 -7.600 5.398 1.00 0.00 C ATOM 198 C GLY A 14 -10.339 -8.548 4.199 1.00 0.00 C ATOM 199 O GLY A 14 -10.296 -9.769 4.356 1.00 0.00 O ATOM 0 H GLY A 14 -9.587 -5.660 5.290 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -10.244 -8.171 6.321 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -11.307 -7.082 5.451 1.00 0.00 H new ATOM 203 N ILE A 15 -10.349 -7.983 2.986 1.00 0.00 N ATOM 204 CA ILE A 15 -10.230 -8.762 1.761 1.00 0.00 C ATOM 205 C ILE A 15 -8.983 -9.647 1.830 1.00 0.00 C ATOM 206 O ILE A 15 -9.078 -10.839 1.554 1.00 0.00 O ATOM 207 CB ILE A 15 -10.294 -7.843 0.519 1.00 0.00 C ATOM 208 CG1 ILE A 15 -11.732 -7.736 -0.023 1.00 0.00 C ATOM 209 CG2 ILE A 15 -9.412 -8.330 -0.642 1.00 0.00 C ATOM 210 CD1 ILE A 15 -12.763 -7.275 1.009 1.00 0.00 C ATOM 0 H ILE A 15 -10.440 -6.979 2.833 1.00 0.00 H new ATOM 0 HA ILE A 15 -11.079 -9.438 1.659 1.00 0.00 H new ATOM 0 HB ILE A 15 -9.929 -6.877 0.868 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -11.740 -7.041 -0.863 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -12.034 -8.709 -0.411 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -9.503 -7.641 -1.482 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -8.372 -8.371 -0.317 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -9.735 -9.324 -0.952 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -13.747 -7.227 0.544 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -12.788 -7.981 1.839 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -12.489 -6.288 1.381 1.00 0.00 H new ATOM 222 N PHE A 16 -7.828 -9.100 2.215 1.00 0.00 N ATOM 223 CA PHE A 16 -6.590 -9.871 2.252 1.00 0.00 C ATOM 224 C PHE A 16 -6.698 -11.039 3.233 1.00 0.00 C ATOM 225 O PHE A 16 -6.427 -12.180 2.862 1.00 0.00 O ATOM 226 CB PHE A 16 -5.385 -8.962 2.546 1.00 0.00 C ATOM 227 CG PHE A 16 -4.038 -9.582 2.206 1.00 0.00 C ATOM 228 CD1 PHE A 16 -3.499 -10.596 3.020 1.00 0.00 C ATOM 229 CD2 PHE A 16 -3.355 -9.202 1.032 1.00 0.00 C ATOM 230 CE1 PHE A 16 -2.334 -11.277 2.626 1.00 0.00 C ATOM 231 CE2 PHE A 16 -2.158 -9.847 0.668 1.00 0.00 C ATOM 232 CZ PHE A 16 -1.661 -10.901 1.451 1.00 0.00 C ATOM 0 H PHE A 16 -7.727 -8.127 2.505 1.00 0.00 H new ATOM 0 HA PHE A 16 -6.424 -10.305 1.266 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -5.498 -8.035 1.984 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -5.394 -8.697 3.603 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -3.983 -10.852 3.951 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -3.752 -8.413 0.410 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -1.956 -12.090 3.227 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -1.621 -9.531 -0.214 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.764 -11.422 1.151 1.00 0.00 H new ATOM 242 N HIS A 17 -7.107 -10.752 4.473 1.00 0.00 N ATOM 243 CA HIS A 17 -7.422 -11.735 5.502 1.00 0.00 C ATOM 244 C HIS A 17 -8.256 -12.868 4.907 1.00 0.00 C ATOM 245 O HIS A 17 -7.929 -14.040 5.080 1.00 0.00 O ATOM 246 CB HIS A 17 -8.174 -11.041 6.656 1.00 0.00 C ATOM 247 CG HIS A 17 -9.153 -11.921 7.397 1.00 0.00 C ATOM 248 ND1 HIS A 17 -8.854 -13.050 8.123 1.00 0.00 N ATOM 249 CD2 HIS A 17 -10.520 -11.836 7.315 1.00 0.00 C ATOM 250 CE1 HIS A 17 -10.016 -13.626 8.476 1.00 0.00 C ATOM 251 NE2 HIS A 17 -11.060 -12.919 8.014 1.00 0.00 N ATOM 0 H HIS A 17 -7.231 -9.792 4.794 1.00 0.00 H new ATOM 0 HA HIS A 17 -6.501 -12.166 5.893 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -7.443 -10.656 7.367 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -8.712 -10.182 6.255 1.00 0.00 H new ATOM 0 HD1 HIS A 17 -7.920 -13.389 8.352 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -11.080 -11.068 6.801 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -10.099 -14.535 9.053 1.00 0.00 H new ATOM 259 N LYS A 18 -9.342 -12.507 4.221 1.00 0.00 N ATOM 260 CA LYS A 18 -10.279 -13.492 3.709 1.00 0.00 C ATOM 261 C LYS A 18 -9.585 -14.318 2.631 1.00 0.00 C ATOM 262 O LYS A 18 -9.497 -15.543 2.711 1.00 0.00 O ATOM 263 CB LYS A 18 -11.537 -12.770 3.201 1.00 0.00 C ATOM 264 CG LYS A 18 -12.643 -13.726 2.733 1.00 0.00 C ATOM 265 CD LYS A 18 -12.528 -14.113 1.249 1.00 0.00 C ATOM 266 CE LYS A 18 -13.724 -14.960 0.797 1.00 0.00 C ATOM 267 NZ LYS A 18 -13.764 -16.262 1.487 1.00 0.00 N ATOM 0 H LYS A 18 -9.589 -11.540 4.011 1.00 0.00 H new ATOM 0 HA LYS A 18 -10.600 -14.182 4.489 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -11.928 -12.135 3.996 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -11.261 -12.114 2.376 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -12.612 -14.631 3.340 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -13.613 -13.260 2.905 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -12.468 -13.211 0.640 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -11.605 -14.669 1.087 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -14.649 -14.417 0.992 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -13.670 -15.121 -0.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -14.524 -16.846 1.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -12.853 -16.748 1.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -13.943 -16.112 2.500 1.00 0.00 H new ATOM 281 N TYR A 19 -9.102 -13.625 1.602 1.00 0.00 N ATOM 282 CA TYR A 19 -8.535 -14.227 0.411 1.00 0.00 C ATOM 283 C TYR A 19 -7.374 -15.161 0.761 1.00 0.00 C ATOM 284 O TYR A 19 -7.264 -16.248 0.203 1.00 0.00 O ATOM 285 CB TYR A 19 -8.146 -13.134 -0.595 1.00 0.00 C ATOM 286 CG TYR A 19 -8.294 -13.615 -2.019 1.00 0.00 C ATOM 287 CD1 TYR A 19 -7.411 -14.601 -2.485 1.00 0.00 C ATOM 288 CD2 TYR A 19 -9.503 -13.378 -2.699 1.00 0.00 C ATOM 289 CE1 TYR A 19 -7.786 -15.420 -3.562 1.00 0.00 C ATOM 290 CE2 TYR A 19 -9.865 -14.183 -3.793 1.00 0.00 C ATOM 291 CZ TYR A 19 -9.028 -15.237 -4.188 1.00 0.00 C ATOM 292 OH TYR A 19 -9.481 -16.169 -5.069 1.00 0.00 O ATOM 0 H TYR A 19 -9.097 -12.605 1.579 1.00 0.00 H new ATOM 0 HA TYR A 19 -9.288 -14.853 -0.068 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -8.772 -12.255 -0.440 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -7.115 -12.826 -0.419 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -6.446 -14.729 -2.017 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -10.153 -12.577 -2.380 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.116 -16.193 -3.909 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -10.784 -13.991 -4.327 1.00 0.00 H new ATOM 0 HH TYR A 19 -10.004 -16.845 -4.590 1.00 0.00 H new ATOM 302 N SER A 20 -6.535 -14.758 1.715 1.00 0.00 N ATOM 303 CA SER A 20 -5.461 -15.580 2.266 1.00 0.00 C ATOM 304 C SER A 20 -5.899 -16.984 2.699 1.00 0.00 C ATOM 305 O SER A 20 -5.032 -17.843 2.804 1.00 0.00 O ATOM 306 CB SER A 20 -4.813 -14.882 3.465 1.00 0.00 C ATOM 307 OG SER A 20 -4.170 -13.696 3.060 1.00 0.00 O ATOM 0 H SER A 20 -6.585 -13.830 2.135 1.00 0.00 H new ATOM 0 HA SER A 20 -4.751 -15.702 1.448 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.572 -14.653 4.213 1.00 0.00 H new ATOM 0 HB3 SER A 20 -4.092 -15.550 3.936 1.00 0.00 H new ATOM 0 HG SER A 20 -4.838 -12.991 2.927 1.00 0.00 H new ATOM 313 N GLY A 21 -7.185 -17.213 2.998 1.00 0.00 N ATOM 314 CA GLY A 21 -7.747 -18.439 3.566 1.00 0.00 C ATOM 315 C GLY A 21 -6.981 -19.738 3.280 1.00 0.00 C ATOM 316 O GLY A 21 -6.657 -20.474 4.208 1.00 0.00 O ATOM 0 H GLY A 21 -7.900 -16.503 2.839 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -7.816 -18.314 4.647 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -8.765 -18.553 3.192 1.00 0.00 H new ATOM 320 N LYS A 22 -6.707 -20.038 2.005 1.00 0.00 N ATOM 321 CA LYS A 22 -6.039 -21.273 1.600 1.00 0.00 C ATOM 322 C LYS A 22 -4.651 -21.408 2.240 1.00 0.00 C ATOM 323 O LYS A 22 -4.229 -22.511 2.586 1.00 0.00 O ATOM 324 CB LYS A 22 -5.917 -21.354 0.071 1.00 0.00 C ATOM 325 CG LYS A 22 -7.241 -21.562 -0.678 1.00 0.00 C ATOM 326 CD LYS A 22 -8.181 -20.349 -0.747 1.00 0.00 C ATOM 327 CE LYS A 22 -7.488 -19.094 -1.294 1.00 0.00 C ATOM 328 NZ LYS A 22 -8.474 -18.059 -1.648 1.00 0.00 N ATOM 0 H LYS A 22 -6.945 -19.426 1.224 1.00 0.00 H new ATOM 0 HA LYS A 22 -6.657 -22.099 1.953 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -5.454 -20.436 -0.290 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -5.242 -22.172 -0.181 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -7.012 -21.876 -1.696 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -7.777 -22.384 -0.204 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -9.035 -20.592 -1.379 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -8.571 -20.139 0.249 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -6.796 -18.702 -0.549 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -6.897 -19.354 -2.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -8.253 -17.676 -2.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -9.427 -18.476 -1.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -8.440 -17.292 -0.946 1.00 0.00 H new ATOM 342 N GLU A 23 -3.925 -20.295 2.360 1.00 0.00 N ATOM 343 CA GLU A 23 -2.649 -20.221 3.054 1.00 0.00 C ATOM 344 C GLU A 23 -2.892 -20.078 4.563 1.00 0.00 C ATOM 345 O GLU A 23 -2.225 -20.713 5.380 1.00 0.00 O ATOM 346 CB GLU A 23 -1.850 -19.054 2.451 1.00 0.00 C ATOM 347 CG GLU A 23 -0.368 -19.095 2.826 1.00 0.00 C ATOM 348 CD GLU A 23 0.356 -20.295 2.220 1.00 0.00 C ATOM 349 OE1 GLU A 23 0.551 -20.281 0.985 1.00 0.00 O ATOM 350 OE2 GLU A 23 0.686 -21.216 2.997 1.00 0.00 O ATOM 0 H GLU A 23 -4.220 -19.402 1.966 1.00 0.00 H new ATOM 0 HA GLU A 23 -2.063 -21.131 2.925 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -1.946 -19.076 1.365 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -2.280 -18.112 2.790 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.114 -18.177 2.490 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -0.272 -19.127 3.911 1.00 0.00 H new ATOM 357 N GLY A 24 -3.873 -19.251 4.927 1.00 0.00 N ATOM 358 CA GLY A 24 -4.412 -19.131 6.269 1.00 0.00 C ATOM 359 C GLY A 24 -3.404 -18.550 7.255 1.00 0.00 C ATOM 360 O GLY A 24 -3.422 -17.353 7.526 1.00 0.00 O ATOM 0 H GLY A 24 -4.327 -18.624 4.263 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -5.299 -18.497 6.245 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -4.731 -20.113 6.618 1.00 0.00 H new ATOM 364 N ASP A 25 -2.545 -19.406 7.811 1.00 0.00 N ATOM 365 CA ASP A 25 -1.659 -19.054 8.913 1.00 0.00 C ATOM 366 C ASP A 25 -0.630 -18.026 8.448 1.00 0.00 C ATOM 367 O ASP A 25 -0.658 -16.866 8.851 1.00 0.00 O ATOM 368 CB ASP A 25 -0.997 -20.320 9.469 1.00 0.00 C ATOM 369 CG ASP A 25 0.059 -19.977 10.514 1.00 0.00 C ATOM 370 OD1 ASP A 25 -0.349 -19.633 11.645 1.00 0.00 O ATOM 371 OD2 ASP A 25 1.255 -20.058 10.158 1.00 0.00 O ATOM 0 H ASP A 25 -2.447 -20.373 7.503 1.00 0.00 H new ATOM 0 HA ASP A 25 -2.234 -18.599 9.719 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -1.755 -20.965 9.913 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -0.538 -20.881 8.655 1.00 0.00 H new ATOM 376 N LYS A 26 0.275 -18.452 7.566 1.00 0.00 N ATOM 377 CA LYS A 26 1.277 -17.577 6.976 1.00 0.00 C ATOM 378 C LYS A 26 0.623 -16.785 5.839 1.00 0.00 C ATOM 379 O LYS A 26 0.957 -16.963 4.669 1.00 0.00 O ATOM 380 CB LYS A 26 2.528 -18.378 6.568 1.00 0.00 C ATOM 381 CG LYS A 26 2.218 -19.747 5.941 1.00 0.00 C ATOM 382 CD LYS A 26 3.451 -20.413 5.318 1.00 0.00 C ATOM 383 CE LYS A 26 3.920 -19.674 4.059 1.00 0.00 C ATOM 384 NZ LYS A 26 4.932 -20.450 3.324 1.00 0.00 N ATOM 0 H LYS A 26 0.330 -19.418 7.243 1.00 0.00 H new ATOM 0 HA LYS A 26 1.642 -16.849 7.700 1.00 0.00 H new ATOM 0 HB2 LYS A 26 3.109 -17.788 5.859 1.00 0.00 H new ATOM 0 HB3 LYS A 26 3.154 -18.526 7.448 1.00 0.00 H new ATOM 0 HG2 LYS A 26 1.803 -20.405 6.705 1.00 0.00 H new ATOM 0 HG3 LYS A 26 1.452 -19.625 5.175 1.00 0.00 H new ATOM 0 HD2 LYS A 26 4.260 -20.437 6.048 1.00 0.00 H new ATOM 0 HD3 LYS A 26 3.218 -21.448 5.067 1.00 0.00 H new ATOM 0 HE2 LYS A 26 3.066 -19.481 3.410 1.00 0.00 H new ATOM 0 HE3 LYS A 26 4.334 -18.705 4.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 4.899 -20.196 2.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 5.876 -20.237 3.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 4.736 -21.466 3.432 1.00 0.00 H new ATOM 398 N HIS A 27 -0.335 -15.930 6.207 1.00 0.00 N ATOM 399 CA HIS A 27 -1.169 -15.124 5.326 1.00 0.00 C ATOM 400 C HIS A 27 -0.334 -14.303 4.336 1.00 0.00 C ATOM 401 O HIS A 27 0.108 -13.189 4.622 1.00 0.00 O ATOM 402 CB HIS A 27 -2.117 -14.259 6.170 1.00 0.00 C ATOM 403 CG HIS A 27 -1.446 -13.474 7.271 1.00 0.00 C ATOM 404 ND1 HIS A 27 -0.584 -12.417 7.101 1.00 0.00 N ATOM 405 CD2 HIS A 27 -1.562 -13.697 8.616 1.00 0.00 C ATOM 406 CE1 HIS A 27 -0.212 -11.993 8.320 1.00 0.00 C ATOM 407 NE2 HIS A 27 -0.786 -12.739 9.279 1.00 0.00 N ATOM 0 H HIS A 27 -0.559 -15.776 7.190 1.00 0.00 H new ATOM 0 HA HIS A 27 -1.776 -15.786 4.708 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -2.635 -13.563 5.510 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -2.876 -14.903 6.613 1.00 0.00 H new ATOM 0 HD1 HIS A 27 -0.281 -12.025 6.209 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -2.148 -14.474 9.083 1.00 0.00 H new ATOM 0 HE1 HIS A 27 0.457 -11.165 8.504 1.00 0.00 H new ATOM 415 N THR A 28 -0.131 -14.868 3.151 1.00 0.00 N ATOM 416 CA THR A 28 0.639 -14.314 2.064 1.00 0.00 C ATOM 417 C THR A 28 -0.137 -14.593 0.776 1.00 0.00 C ATOM 418 O THR A 28 -1.095 -15.367 0.761 1.00 0.00 O ATOM 419 CB THR A 28 2.033 -14.964 2.056 1.00 0.00 C ATOM 420 OG1 THR A 28 1.912 -16.367 2.127 1.00 0.00 O ATOM 421 CG2 THR A 28 2.886 -14.483 3.235 1.00 0.00 C ATOM 0 H THR A 28 -0.527 -15.779 2.919 1.00 0.00 H new ATOM 0 HA THR A 28 0.786 -13.239 2.166 1.00 0.00 H new ATOM 0 HB THR A 28 2.523 -14.673 1.127 1.00 0.00 H new ATOM 0 HG1 THR A 28 1.655 -16.628 3.036 1.00 0.00 H new ATOM 0 HG21 THR A 28 3.864 -14.963 3.197 1.00 0.00 H new ATOM 0 HG22 THR A 28 3.010 -13.402 3.177 1.00 0.00 H new ATOM 0 HG23 THR A 28 2.391 -14.741 4.171 1.00 0.00 H new ATOM 429 N LEU A 29 0.290 -13.951 -0.304 1.00 0.00 N ATOM 430 CA LEU A 29 -0.309 -14.058 -1.620 1.00 0.00 C ATOM 431 C LEU A 29 0.465 -15.158 -2.343 1.00 0.00 C ATOM 432 O LEU A 29 1.422 -14.894 -3.068 1.00 0.00 O ATOM 433 CB LEU A 29 -0.218 -12.684 -2.303 1.00 0.00 C ATOM 434 CG LEU A 29 -0.741 -12.649 -3.749 1.00 0.00 C ATOM 435 CD1 LEU A 29 -2.263 -12.828 -3.796 1.00 0.00 C ATOM 436 CD2 LEU A 29 -0.372 -11.306 -4.384 1.00 0.00 C ATOM 0 H LEU A 29 1.091 -13.320 -0.282 1.00 0.00 H new ATOM 0 HA LEU A 29 -1.366 -14.325 -1.609 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -0.779 -11.961 -1.711 1.00 0.00 H new ATOM 0 HB3 LEU A 29 0.823 -12.360 -2.300 1.00 0.00 H new ATOM 0 HG LEU A 29 -0.283 -13.470 -4.300 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.601 -12.799 -4.832 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -2.530 -13.788 -3.354 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.741 -12.025 -3.235 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -0.740 -11.275 -5.409 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.824 -10.496 -3.811 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.712 -11.189 -4.384 1.00 0.00 H new ATOM 448 N SER A 30 0.078 -16.409 -2.087 1.00 0.00 N ATOM 449 CA SER A 30 0.741 -17.576 -2.642 1.00 0.00 C ATOM 450 C SER A 30 0.043 -18.034 -3.921 1.00 0.00 C ATOM 451 O SER A 30 -1.035 -17.556 -4.285 1.00 0.00 O ATOM 452 CB SER A 30 0.823 -18.689 -1.587 1.00 0.00 C ATOM 453 OG SER A 30 1.619 -19.761 -2.054 1.00 0.00 O ATOM 0 H SER A 30 -0.712 -16.636 -1.483 1.00 0.00 H new ATOM 0 HA SER A 30 1.762 -17.313 -2.917 1.00 0.00 H new ATOM 0 HB2 SER A 30 1.244 -18.292 -0.664 1.00 0.00 H new ATOM 0 HB3 SER A 30 -0.179 -19.049 -1.351 1.00 0.00 H new ATOM 0 HG SER A 30 1.687 -20.446 -1.357 1.00 0.00 H new ATOM 459 N LYS A 31 0.680 -18.988 -4.595 1.00 0.00 N ATOM 460 CA LYS A 31 0.190 -19.601 -5.818 1.00 0.00 C ATOM 461 C LYS A 31 -1.239 -20.119 -5.628 1.00 0.00 C ATOM 462 O LYS A 31 -2.056 -20.017 -6.539 1.00 0.00 O ATOM 463 CB LYS A 31 1.162 -20.709 -6.248 1.00 0.00 C ATOM 464 CG LYS A 31 2.488 -20.102 -6.730 1.00 0.00 C ATOM 465 CD LYS A 31 3.552 -21.190 -6.926 1.00 0.00 C ATOM 466 CE LYS A 31 4.793 -20.657 -7.658 1.00 0.00 C ATOM 467 NZ LYS A 31 5.359 -19.464 -7.006 1.00 0.00 N ATOM 0 H LYS A 31 1.578 -19.364 -4.293 1.00 0.00 H new ATOM 0 HA LYS A 31 0.147 -18.859 -6.615 1.00 0.00 H new ATOM 0 HB2 LYS A 31 1.346 -21.384 -5.412 1.00 0.00 H new ATOM 0 HB3 LYS A 31 0.716 -21.303 -7.045 1.00 0.00 H new ATOM 0 HG2 LYS A 31 2.329 -19.571 -7.668 1.00 0.00 H new ATOM 0 HG3 LYS A 31 2.841 -19.369 -6.005 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.847 -21.588 -5.955 1.00 0.00 H new ATOM 0 HD3 LYS A 31 3.124 -22.017 -7.493 1.00 0.00 H new ATOM 0 HE2 LYS A 31 5.551 -21.439 -7.700 1.00 0.00 H new ATOM 0 HE3 LYS A 31 4.528 -20.414 -8.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 6.352 -19.350 -7.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.818 -18.623 -7.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 5.307 -19.575 -5.973 1.00 0.00 H new ATOM 481 N LYS A 32 -1.559 -20.630 -4.433 1.00 0.00 N ATOM 482 CA LYS A 32 -2.916 -21.019 -4.071 1.00 0.00 C ATOM 483 C LYS A 32 -3.892 -19.851 -4.265 1.00 0.00 C ATOM 484 O LYS A 32 -4.903 -19.988 -4.958 1.00 0.00 O ATOM 485 CB LYS A 32 -2.943 -21.519 -2.619 1.00 0.00 C ATOM 486 CG LYS A 32 -2.131 -22.812 -2.457 1.00 0.00 C ATOM 487 CD LYS A 32 -2.281 -23.422 -1.056 1.00 0.00 C ATOM 488 CE LYS A 32 -1.568 -22.596 0.022 1.00 0.00 C ATOM 489 NZ LYS A 32 -1.660 -23.248 1.342 1.00 0.00 N ATOM 0 H LYS A 32 -0.877 -20.784 -3.691 1.00 0.00 H new ATOM 0 HA LYS A 32 -3.236 -21.828 -4.728 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -2.540 -20.750 -1.960 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -3.974 -21.694 -2.312 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -2.454 -23.538 -3.203 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -1.078 -22.604 -2.650 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -3.340 -23.500 -0.809 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -1.878 -24.435 -1.059 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -0.521 -22.465 -0.250 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -2.010 -21.601 0.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -0.865 -22.940 1.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -2.557 -22.984 1.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -1.623 -24.280 1.223 1.00 0.00 H new ATOM 503 N GLU A 33 -3.590 -18.698 -3.658 1.00 0.00 N ATOM 504 CA GLU A 33 -4.423 -17.515 -3.793 1.00 0.00 C ATOM 505 C GLU A 33 -4.532 -17.129 -5.265 1.00 0.00 C ATOM 506 O GLU A 33 -5.635 -16.899 -5.753 1.00 0.00 O ATOM 507 CB GLU A 33 -3.891 -16.340 -2.957 1.00 0.00 C ATOM 508 CG GLU A 33 -4.164 -16.491 -1.452 1.00 0.00 C ATOM 509 CD GLU A 33 -3.399 -17.635 -0.805 1.00 0.00 C ATOM 510 OE1 GLU A 33 -2.210 -17.789 -1.158 1.00 0.00 O ATOM 511 OE2 GLU A 33 -4.018 -18.343 0.018 1.00 0.00 O ATOM 0 H GLU A 33 -2.769 -18.567 -3.067 1.00 0.00 H new ATOM 0 HA GLU A 33 -5.415 -17.753 -3.409 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.817 -16.247 -3.117 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -4.347 -15.416 -3.311 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.903 -15.560 -0.949 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -5.232 -16.647 -1.299 1.00 0.00 H new ATOM 518 N LEU A 34 -3.407 -17.064 -5.982 1.00 0.00 N ATOM 519 CA LEU A 34 -3.446 -16.714 -7.399 1.00 0.00 C ATOM 520 C LEU A 34 -4.362 -17.656 -8.184 1.00 0.00 C ATOM 521 O LEU A 34 -5.218 -17.193 -8.935 1.00 0.00 O ATOM 522 CB LEU A 34 -2.045 -16.696 -8.015 1.00 0.00 C ATOM 523 CG LEU A 34 -1.095 -15.655 -7.404 1.00 0.00 C ATOM 524 CD1 LEU A 34 0.193 -15.675 -8.227 1.00 0.00 C ATOM 525 CD2 LEU A 34 -1.667 -14.232 -7.426 1.00 0.00 C ATOM 0 H LEU A 34 -2.475 -17.246 -5.611 1.00 0.00 H new ATOM 0 HA LEU A 34 -3.856 -15.706 -7.465 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.600 -17.685 -7.904 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -2.134 -16.505 -9.084 1.00 0.00 H new ATOM 0 HG LEU A 34 -0.931 -15.916 -6.358 1.00 0.00 H new ATOM 0 HD11 LEU A 34 0.895 -14.946 -7.822 1.00 0.00 H new ATOM 0 HD12 LEU A 34 0.637 -16.669 -8.184 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -0.033 -15.424 -9.263 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.948 -13.544 -6.981 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.863 -13.935 -8.456 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.596 -14.205 -6.857 1.00 0.00 H new ATOM 537 N LYS A 35 -4.194 -18.969 -8.014 1.00 0.00 N ATOM 538 CA LYS A 35 -4.997 -19.971 -8.700 1.00 0.00 C ATOM 539 C LYS A 35 -6.484 -19.717 -8.441 1.00 0.00 C ATOM 540 O LYS A 35 -7.280 -19.615 -9.377 1.00 0.00 O ATOM 541 CB LYS A 35 -4.559 -21.375 -8.258 1.00 0.00 C ATOM 542 CG LYS A 35 -5.355 -22.512 -8.917 1.00 0.00 C ATOM 543 CD LYS A 35 -5.299 -22.451 -10.450 1.00 0.00 C ATOM 544 CE LYS A 35 -5.915 -23.713 -11.062 1.00 0.00 C ATOM 545 NZ LYS A 35 -5.884 -23.661 -12.534 1.00 0.00 N ATOM 0 H LYS A 35 -3.490 -19.365 -7.391 1.00 0.00 H new ATOM 0 HA LYS A 35 -4.841 -19.901 -9.776 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -3.501 -21.504 -8.488 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -4.661 -21.453 -7.176 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -4.962 -23.471 -8.579 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -6.394 -22.461 -8.591 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -5.834 -21.570 -10.804 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -4.265 -22.349 -10.778 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -5.371 -24.591 -10.715 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -6.945 -23.820 -10.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -6.308 -24.528 -12.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -6.424 -22.835 -12.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -4.899 -23.582 -12.858 1.00 0.00 H new ATOM 559 N GLU A 36 -6.854 -19.600 -7.165 1.00 0.00 N ATOM 560 CA GLU A 36 -8.227 -19.310 -6.780 1.00 0.00 C ATOM 561 C GLU A 36 -8.697 -17.982 -7.390 1.00 0.00 C ATOM 562 O GLU A 36 -9.836 -17.880 -7.840 1.00 0.00 O ATOM 563 CB GLU A 36 -8.342 -19.325 -5.251 1.00 0.00 C ATOM 564 CG GLU A 36 -8.104 -20.733 -4.681 1.00 0.00 C ATOM 565 CD GLU A 36 -9.303 -21.659 -4.858 1.00 0.00 C ATOM 566 OE1 GLU A 36 -10.258 -21.496 -4.067 1.00 0.00 O ATOM 567 OE2 GLU A 36 -9.240 -22.521 -5.762 1.00 0.00 O ATOM 0 H GLU A 36 -6.213 -19.703 -6.378 1.00 0.00 H new ATOM 0 HA GLU A 36 -8.888 -20.082 -7.174 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -7.618 -18.631 -4.824 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -9.331 -18.975 -4.956 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -7.236 -21.175 -5.170 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -7.867 -20.654 -3.620 1.00 0.00 H new ATOM 574 N LEU A 37 -7.834 -16.964 -7.431 1.00 0.00 N ATOM 575 CA LEU A 37 -8.189 -15.666 -7.981 1.00 0.00 C ATOM 576 C LEU A 37 -8.509 -15.796 -9.468 1.00 0.00 C ATOM 577 O LEU A 37 -9.615 -15.440 -9.878 1.00 0.00 O ATOM 578 CB LEU A 37 -7.087 -14.635 -7.703 1.00 0.00 C ATOM 579 CG LEU A 37 -7.472 -13.215 -8.158 1.00 0.00 C ATOM 580 CD1 LEU A 37 -8.583 -12.612 -7.289 1.00 0.00 C ATOM 581 CD2 LEU A 37 -6.236 -12.311 -8.087 1.00 0.00 C ATOM 0 H LEU A 37 -6.876 -17.022 -7.085 1.00 0.00 H new ATOM 0 HA LEU A 37 -9.088 -15.300 -7.486 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.868 -14.623 -6.635 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -6.173 -14.940 -8.213 1.00 0.00 H new ATOM 0 HG LEU A 37 -7.845 -13.283 -9.180 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.822 -11.610 -7.647 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.472 -13.240 -7.348 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.246 -12.557 -6.254 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.503 -11.304 -8.408 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -5.867 -12.279 -7.062 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -5.458 -12.706 -8.740 1.00 0.00 H new ATOM 593 N ILE A 38 -7.568 -16.303 -10.275 1.00 0.00 N ATOM 594 CA ILE A 38 -7.796 -16.438 -11.713 1.00 0.00 C ATOM 595 C ILE A 38 -9.049 -17.279 -11.977 1.00 0.00 C ATOM 596 O ILE A 38 -9.911 -16.882 -12.761 1.00 0.00 O ATOM 597 CB ILE A 38 -6.548 -16.927 -12.477 1.00 0.00 C ATOM 598 CG1 ILE A 38 -6.132 -18.371 -12.151 1.00 0.00 C ATOM 599 CG2 ILE A 38 -5.388 -15.958 -12.223 1.00 0.00 C ATOM 600 CD1 ILE A 38 -4.900 -18.833 -12.934 1.00 0.00 C ATOM 0 H ILE A 38 -6.653 -16.622 -9.958 1.00 0.00 H new ATOM 0 HA ILE A 38 -7.985 -15.444 -12.119 1.00 0.00 H new ATOM 0 HB ILE A 38 -6.813 -16.939 -13.534 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.928 -18.452 -11.083 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.965 -19.040 -12.368 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -4.504 -16.300 -12.761 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -5.663 -14.962 -12.572 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -5.171 -15.922 -11.155 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -4.658 -19.860 -12.659 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -5.108 -18.783 -14.003 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -4.055 -18.186 -12.699 1.00 0.00 H new ATOM 612 N GLN A 39 -9.170 -18.410 -11.272 1.00 0.00 N ATOM 613 CA GLN A 39 -10.337 -19.278 -11.321 1.00 0.00 C ATOM 614 C GLN A 39 -11.618 -18.466 -11.111 1.00 0.00 C ATOM 615 O GLN A 39 -12.530 -18.533 -11.930 1.00 0.00 O ATOM 616 CB GLN A 39 -10.160 -20.356 -10.244 1.00 0.00 C ATOM 617 CG GLN A 39 -11.355 -21.292 -10.015 1.00 0.00 C ATOM 618 CD GLN A 39 -11.240 -21.928 -8.634 1.00 0.00 C ATOM 619 OE1 GLN A 39 -12.128 -21.787 -7.800 1.00 0.00 O ATOM 620 NE2 GLN A 39 -10.114 -22.580 -8.362 1.00 0.00 N ATOM 0 H GLN A 39 -8.442 -18.748 -10.642 1.00 0.00 H new ATOM 0 HA GLN A 39 -10.427 -19.753 -12.298 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -9.295 -20.964 -10.508 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -9.927 -19.862 -9.301 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -12.288 -20.735 -10.095 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -11.379 -22.065 -10.783 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -9.396 -22.679 -9.080 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -9.968 -22.982 -7.436 1.00 0.00 H new ATOM 629 N LYS A 40 -11.708 -17.737 -9.996 1.00 0.00 N ATOM 630 CA LYS A 40 -12.950 -17.104 -9.583 1.00 0.00 C ATOM 631 C LYS A 40 -13.282 -15.859 -10.407 1.00 0.00 C ATOM 632 O LYS A 40 -14.451 -15.653 -10.727 1.00 0.00 O ATOM 633 CB LYS A 40 -12.925 -16.839 -8.074 1.00 0.00 C ATOM 634 CG LYS A 40 -12.949 -18.185 -7.334 1.00 0.00 C ATOM 635 CD LYS A 40 -12.701 -18.011 -5.834 1.00 0.00 C ATOM 636 CE LYS A 40 -12.533 -19.394 -5.199 1.00 0.00 C ATOM 637 NZ LYS A 40 -12.221 -19.295 -3.763 1.00 0.00 N ATOM 0 H LYS A 40 -10.925 -17.573 -9.363 1.00 0.00 H new ATOM 0 HA LYS A 40 -13.768 -17.795 -9.786 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -12.031 -16.276 -7.805 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -13.783 -16.233 -7.783 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -13.913 -18.669 -7.490 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -12.190 -18.845 -7.754 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -11.809 -17.408 -5.666 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -13.535 -17.482 -5.372 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -13.448 -19.971 -5.335 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -11.736 -19.935 -5.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -11.494 -19.996 -3.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.868 -18.340 -3.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -13.081 -19.478 -3.207 1.00 0.00 H new ATOM 651 N GLU A 41 -12.297 -15.026 -10.771 1.00 0.00 N ATOM 652 CA GLU A 41 -12.594 -13.921 -11.682 1.00 0.00 C ATOM 653 C GLU A 41 -12.997 -14.465 -13.059 1.00 0.00 C ATOM 654 O GLU A 41 -13.864 -13.893 -13.717 1.00 0.00 O ATOM 655 CB GLU A 41 -11.456 -12.893 -11.735 1.00 0.00 C ATOM 656 CG GLU A 41 -10.232 -13.363 -12.525 1.00 0.00 C ATOM 657 CD GLU A 41 -9.115 -12.328 -12.476 1.00 0.00 C ATOM 658 OE1 GLU A 41 -8.640 -12.055 -11.352 1.00 0.00 O ATOM 659 OE2 GLU A 41 -8.768 -11.815 -13.560 1.00 0.00 O ATOM 0 H GLU A 41 -11.327 -15.093 -10.462 1.00 0.00 H new ATOM 0 HA GLU A 41 -13.450 -13.369 -11.294 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -11.832 -11.972 -12.180 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -11.149 -12.653 -10.717 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -9.874 -14.308 -12.118 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -10.514 -13.549 -13.561 1.00 0.00 H new ATOM 816 N GLU A 52 -4.643 -7.750 -16.351 1.00 0.00 N ATOM 817 CA GLU A 52 -3.442 -7.013 -15.997 1.00 0.00 C ATOM 818 C GLU A 52 -3.043 -7.237 -14.531 1.00 0.00 C ATOM 819 O GLU A 52 -1.871 -7.533 -14.291 1.00 0.00 O ATOM 820 CB GLU A 52 -3.544 -5.526 -16.355 1.00 0.00 C ATOM 821 CG GLU A 52 -3.736 -5.238 -17.851 1.00 0.00 C ATOM 822 CD GLU A 52 -2.618 -5.795 -18.732 1.00 0.00 C ATOM 823 OE1 GLU A 52 -1.465 -5.356 -18.535 1.00 0.00 O ATOM 824 OE2 GLU A 52 -2.933 -6.659 -19.579 1.00 0.00 O ATOM 0 HA GLU A 52 -2.634 -7.417 -16.606 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -4.378 -5.090 -15.805 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -2.640 -5.021 -16.015 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -4.687 -5.662 -18.174 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -3.801 -4.160 -17.999 1.00 0.00 H new ATOM 831 N ILE A 53 -3.953 -7.103 -13.546 1.00 0.00 N ATOM 832 CA ILE A 53 -3.473 -7.255 -12.160 1.00 0.00 C ATOM 833 C ILE A 53 -2.894 -8.660 -11.943 1.00 0.00 C ATOM 834 O ILE A 53 -1.790 -8.809 -11.420 1.00 0.00 O ATOM 835 CB ILE A 53 -4.475 -6.830 -11.063 1.00 0.00 C ATOM 836 CG1 ILE A 53 -5.475 -7.928 -10.656 1.00 0.00 C ATOM 837 CG2 ILE A 53 -5.148 -5.496 -11.411 1.00 0.00 C ATOM 838 CD1 ILE A 53 -6.546 -7.439 -9.677 1.00 0.00 C ATOM 0 H ILE A 53 -4.947 -6.906 -13.665 1.00 0.00 H new ATOM 0 HA ILE A 53 -2.668 -6.530 -12.040 1.00 0.00 H new ATOM 0 HB ILE A 53 -3.885 -6.671 -10.160 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -5.961 -8.317 -11.551 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.930 -8.756 -10.204 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -5.847 -5.224 -10.620 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -4.389 -4.720 -11.507 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -5.687 -5.595 -12.353 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -7.218 -8.262 -9.432 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -6.069 -7.076 -8.767 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -7.115 -6.630 -10.135 1.00 0.00 H new ATOM 850 N VAL A 54 -3.625 -9.677 -12.404 1.00 0.00 N ATOM 851 CA VAL A 54 -3.213 -11.069 -12.429 1.00 0.00 C ATOM 852 C VAL A 54 -1.852 -11.190 -13.095 1.00 0.00 C ATOM 853 O VAL A 54 -0.958 -11.787 -12.512 1.00 0.00 O ATOM 854 CB VAL A 54 -4.269 -11.923 -13.154 1.00 0.00 C ATOM 855 CG1 VAL A 54 -3.748 -13.320 -13.520 1.00 0.00 C ATOM 856 CG2 VAL A 54 -5.514 -12.076 -12.271 1.00 0.00 C ATOM 0 H VAL A 54 -4.561 -9.539 -12.786 1.00 0.00 H new ATOM 0 HA VAL A 54 -3.128 -11.440 -11.408 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.514 -11.402 -14.080 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -4.533 -13.879 -14.029 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -2.885 -13.225 -14.179 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -3.456 -13.849 -12.613 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.257 -12.681 -12.791 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.239 -12.563 -11.336 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -5.932 -11.092 -12.058 1.00 0.00 H new ATOM 866 N LYS A 55 -1.682 -10.661 -14.309 1.00 0.00 N ATOM 867 CA LYS A 55 -0.415 -10.767 -15.016 1.00 0.00 C ATOM 868 C LYS A 55 0.726 -10.219 -14.162 1.00 0.00 C ATOM 869 O LYS A 55 1.758 -10.869 -14.035 1.00 0.00 O ATOM 870 CB LYS A 55 -0.499 -10.050 -16.367 1.00 0.00 C ATOM 871 CG LYS A 55 0.840 -10.120 -17.114 1.00 0.00 C ATOM 872 CD LYS A 55 0.701 -9.645 -18.567 1.00 0.00 C ATOM 873 CE LYS A 55 0.124 -8.226 -18.653 1.00 0.00 C ATOM 874 NZ LYS A 55 0.123 -7.718 -20.034 1.00 0.00 N ATOM 0 H LYS A 55 -2.408 -10.157 -14.818 1.00 0.00 H new ATOM 0 HA LYS A 55 -0.206 -11.820 -15.207 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -1.282 -10.503 -16.975 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.779 -9.008 -16.212 1.00 0.00 H new ATOM 0 HG2 LYS A 55 1.578 -9.505 -16.598 1.00 0.00 H new ATOM 0 HG3 LYS A 55 1.213 -11.144 -17.099 1.00 0.00 H new ATOM 0 HD2 LYS A 55 1.677 -9.670 -19.052 1.00 0.00 H new ATOM 0 HD3 LYS A 55 0.056 -10.333 -19.114 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -0.894 -8.224 -18.264 1.00 0.00 H new ATOM 0 HE3 LYS A 55 0.708 -7.557 -18.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 0.875 -7.008 -20.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 0.291 -8.505 -20.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -0.798 -7.282 -20.243 1.00 0.00 H new ATOM 888 N LEU A 56 0.560 -9.024 -13.594 1.00 0.00 N ATOM 889 CA LEU A 56 1.612 -8.411 -12.791 1.00 0.00 C ATOM 890 C LEU A 56 1.911 -9.262 -11.552 1.00 0.00 C ATOM 891 O LEU A 56 3.062 -9.625 -11.303 1.00 0.00 O ATOM 892 CB LEU A 56 1.213 -6.978 -12.416 1.00 0.00 C ATOM 893 CG LEU A 56 1.097 -6.047 -13.636 1.00 0.00 C ATOM 894 CD1 LEU A 56 0.360 -4.762 -13.243 1.00 0.00 C ATOM 895 CD2 LEU A 56 2.472 -5.680 -14.208 1.00 0.00 C ATOM 0 H LEU A 56 -0.290 -8.466 -13.676 1.00 0.00 H new ATOM 0 HA LEU A 56 2.530 -8.363 -13.377 1.00 0.00 H new ATOM 0 HB2 LEU A 56 0.259 -6.998 -11.890 1.00 0.00 H new ATOM 0 HB3 LEU A 56 1.950 -6.571 -11.724 1.00 0.00 H new ATOM 0 HG LEU A 56 0.540 -6.584 -14.404 1.00 0.00 H new ATOM 0 HD11 LEU A 56 0.281 -4.108 -14.111 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.639 -5.011 -12.884 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.913 -4.253 -12.454 1.00 0.00 H new ATOM 0 HD21 LEU A 56 2.345 -5.022 -15.068 1.00 0.00 H new ATOM 0 HD22 LEU A 56 3.059 -5.170 -13.444 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.990 -6.587 -14.519 1.00 0.00 H new ATOM 907 N MET A 57 0.874 -9.595 -10.780 1.00 0.00 N ATOM 908 CA MET A 57 0.999 -10.389 -9.563 1.00 0.00 C ATOM 909 C MET A 57 1.658 -11.739 -9.877 1.00 0.00 C ATOM 910 O MET A 57 2.588 -12.160 -9.195 1.00 0.00 O ATOM 911 CB MET A 57 -0.389 -10.560 -8.926 1.00 0.00 C ATOM 912 CG MET A 57 -0.924 -9.221 -8.394 1.00 0.00 C ATOM 913 SD MET A 57 -2.721 -9.100 -8.176 1.00 0.00 S ATOM 914 CE MET A 57 -3.009 -10.321 -6.881 1.00 0.00 C ATOM 0 H MET A 57 -0.085 -9.316 -10.988 1.00 0.00 H new ATOM 0 HA MET A 57 1.641 -9.877 -8.846 1.00 0.00 H new ATOM 0 HB2 MET A 57 -1.083 -10.965 -9.663 1.00 0.00 H new ATOM 0 HB3 MET A 57 -0.332 -11.282 -8.111 1.00 0.00 H new ATOM 0 HG2 MET A 57 -0.449 -9.021 -7.434 1.00 0.00 H new ATOM 0 HG3 MET A 57 -0.609 -8.432 -9.076 1.00 0.00 H new ATOM 0 HE1 MET A 57 -4.081 -10.485 -6.768 1.00 0.00 H new ATOM 0 HE2 MET A 57 -2.525 -11.259 -7.151 1.00 0.00 H new ATOM 0 HE3 MET A 57 -2.596 -9.958 -5.940 1.00 0.00 H new ATOM 924 N ASP A 58 1.183 -12.404 -10.931 1.00 0.00 N ATOM 925 CA ASP A 58 1.697 -13.676 -11.410 1.00 0.00 C ATOM 926 C ASP A 58 3.156 -13.547 -11.827 1.00 0.00 C ATOM 927 O ASP A 58 3.972 -14.358 -11.407 1.00 0.00 O ATOM 928 CB ASP A 58 0.846 -14.202 -12.569 1.00 0.00 C ATOM 929 CG ASP A 58 1.379 -15.541 -13.066 1.00 0.00 C ATOM 930 OD1 ASP A 58 1.072 -16.554 -12.401 1.00 0.00 O ATOM 931 OD2 ASP A 58 2.088 -15.526 -14.094 1.00 0.00 O ATOM 0 H ASP A 58 0.404 -12.055 -11.489 1.00 0.00 H new ATOM 0 HA ASP A 58 1.640 -14.395 -10.593 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -0.189 -14.315 -12.245 1.00 0.00 H new ATOM 0 HB3 ASP A 58 0.847 -13.479 -13.385 1.00 0.00 H new ATOM 936 N ASP A 59 3.498 -12.544 -12.642 1.00 0.00 N ATOM 937 CA ASP A 59 4.883 -12.291 -13.021 1.00 0.00 C ATOM 938 C ASP A 59 5.762 -12.175 -11.775 1.00 0.00 C ATOM 939 O ASP A 59 6.749 -12.897 -11.641 1.00 0.00 O ATOM 940 CB ASP A 59 4.975 -11.030 -13.886 1.00 0.00 C ATOM 941 CG ASP A 59 6.427 -10.704 -14.221 1.00 0.00 C ATOM 942 OD1 ASP A 59 6.934 -11.308 -15.190 1.00 0.00 O ATOM 943 OD2 ASP A 59 7.003 -9.866 -13.496 1.00 0.00 O ATOM 0 H ASP A 59 2.827 -11.894 -13.051 1.00 0.00 H new ATOM 0 HA ASP A 59 5.248 -13.131 -13.612 1.00 0.00 H new ATOM 0 HB2 ASP A 59 4.409 -11.173 -14.806 1.00 0.00 H new ATOM 0 HB3 ASP A 59 4.521 -10.190 -13.360 1.00 0.00 H new ATOM 948 N LEU A 60 5.393 -11.286 -10.848 1.00 0.00 N ATOM 949 CA LEU A 60 6.137 -11.101 -9.608 1.00 0.00 C ATOM 950 C LEU A 60 6.269 -12.428 -8.853 1.00 0.00 C ATOM 951 O LEU A 60 7.360 -12.791 -8.418 1.00 0.00 O ATOM 952 CB LEU A 60 5.459 -10.034 -8.735 1.00 0.00 C ATOM 953 CG LEU A 60 5.551 -8.617 -9.328 1.00 0.00 C ATOM 954 CD1 LEU A 60 4.573 -7.699 -8.588 1.00 0.00 C ATOM 955 CD2 LEU A 60 6.968 -8.039 -9.207 1.00 0.00 C ATOM 0 H LEU A 60 4.577 -10.681 -10.939 1.00 0.00 H new ATOM 0 HA LEU A 60 7.141 -10.755 -9.852 1.00 0.00 H new ATOM 0 HB2 LEU A 60 4.410 -10.297 -8.600 1.00 0.00 H new ATOM 0 HB3 LEU A 60 5.918 -10.038 -7.746 1.00 0.00 H new ATOM 0 HG LEU A 60 5.300 -8.678 -10.387 1.00 0.00 H new ATOM 0 HD11 LEU A 60 4.633 -6.693 -9.003 1.00 0.00 H new ATOM 0 HD12 LEU A 60 3.558 -8.079 -8.704 1.00 0.00 H new ATOM 0 HD13 LEU A 60 4.831 -7.670 -7.529 1.00 0.00 H new ATOM 0 HD21 LEU A 60 6.990 -7.038 -9.637 1.00 0.00 H new ATOM 0 HD22 LEU A 60 7.252 -7.989 -8.156 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.669 -8.680 -9.742 1.00 0.00 H new ATOM 967 N ASP A 61 5.164 -13.161 -8.706 1.00 0.00 N ATOM 968 CA ASP A 61 5.133 -14.423 -7.984 1.00 0.00 C ATOM 969 C ASP A 61 6.017 -15.484 -8.632 1.00 0.00 C ATOM 970 O ASP A 61 6.729 -16.200 -7.940 1.00 0.00 O ATOM 971 CB ASP A 61 3.686 -14.915 -7.875 1.00 0.00 C ATOM 972 CG ASP A 61 3.593 -16.235 -7.118 1.00 0.00 C ATOM 973 OD1 ASP A 61 3.478 -16.177 -5.876 1.00 0.00 O ATOM 974 OD2 ASP A 61 3.628 -17.281 -7.800 1.00 0.00 O ATOM 0 H ASP A 61 4.260 -12.888 -9.090 1.00 0.00 H new ATOM 0 HA ASP A 61 5.536 -14.248 -6.986 1.00 0.00 H new ATOM 0 HB2 ASP A 61 3.083 -14.162 -7.368 1.00 0.00 H new ATOM 0 HB3 ASP A 61 3.268 -15.038 -8.874 1.00 0.00 H new ATOM 979 N ARG A 62 5.957 -15.607 -9.956 1.00 0.00 N ATOM 980 CA ARG A 62 6.742 -16.584 -10.688 1.00 0.00 C ATOM 981 C ARG A 62 8.212 -16.162 -10.713 1.00 0.00 C ATOM 982 O ARG A 62 9.095 -17.014 -10.739 1.00 0.00 O ATOM 983 CB ARG A 62 6.154 -16.770 -12.093 1.00 0.00 C ATOM 984 CG ARG A 62 6.846 -17.868 -12.916 1.00 0.00 C ATOM 985 CD ARG A 62 6.936 -19.203 -12.166 1.00 0.00 C ATOM 986 NE ARG A 62 7.322 -20.298 -13.063 1.00 0.00 N ATOM 987 CZ ARG A 62 7.666 -21.530 -12.659 1.00 0.00 C ATOM 988 NH1 ARG A 62 7.711 -21.835 -11.357 1.00 0.00 N ATOM 989 NH2 ARG A 62 7.968 -22.460 -13.570 1.00 0.00 N ATOM 0 H ARG A 62 5.360 -15.029 -10.548 1.00 0.00 H new ATOM 0 HA ARG A 62 6.699 -17.552 -10.188 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.094 -17.009 -12.004 1.00 0.00 H new ATOM 0 HB3 ARG A 62 6.223 -15.826 -12.633 1.00 0.00 H new ATOM 0 HG2 ARG A 62 6.300 -18.016 -13.848 1.00 0.00 H new ATOM 0 HG3 ARG A 62 7.850 -17.538 -13.183 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.663 -19.119 -11.358 1.00 0.00 H new ATOM 0 HD3 ARG A 62 5.974 -19.429 -11.707 1.00 0.00 H new ATOM 0 HE ARG A 62 7.329 -20.109 -14.065 1.00 0.00 H new ATOM 0 HH11 ARG A 62 7.482 -21.127 -10.659 1.00 0.00 H new ATOM 0 HH12 ARG A 62 7.974 -22.775 -11.062 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.936 -22.230 -14.563 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.231 -23.399 -13.272 1.00 0.00 H new ATOM 1003 N ASN A 63 8.486 -14.855 -10.691 1.00 0.00 N ATOM 1004 CA ASN A 63 9.848 -14.351 -10.566 1.00 0.00 C ATOM 1005 C ASN A 63 10.393 -14.757 -9.199 1.00 0.00 C ATOM 1006 O ASN A 63 11.355 -15.516 -9.096 1.00 0.00 O ATOM 1007 CB ASN A 63 9.873 -12.828 -10.768 1.00 0.00 C ATOM 1008 CG ASN A 63 11.187 -12.206 -10.307 1.00 0.00 C ATOM 1009 OD1 ASN A 63 11.204 -11.358 -9.419 1.00 0.00 O ATOM 1010 ND2 ASN A 63 12.305 -12.619 -10.896 1.00 0.00 N ATOM 0 H ASN A 63 7.775 -14.126 -10.759 1.00 0.00 H new ATOM 0 HA ASN A 63 10.486 -14.783 -11.337 1.00 0.00 H new ATOM 0 HB2 ASN A 63 9.716 -12.601 -11.822 1.00 0.00 H new ATOM 0 HB3 ASN A 63 9.047 -12.377 -10.218 1.00 0.00 H new ATOM 0 HD21 ASN A 63 13.204 -12.230 -10.613 1.00 0.00 H new ATOM 0 HD22 ASN A 63 12.263 -13.325 -11.631 1.00 0.00 H new ATOM 1017 N LYS A 64 9.747 -14.283 -8.137 1.00 0.00 N ATOM 1018 CA LYS A 64 10.071 -14.649 -6.769 1.00 0.00 C ATOM 1019 C LYS A 64 9.377 -15.979 -6.475 1.00 0.00 C ATOM 1020 O LYS A 64 8.479 -16.027 -5.638 1.00 0.00 O ATOM 1021 CB LYS A 64 9.616 -13.518 -5.832 1.00 0.00 C ATOM 1022 CG LYS A 64 10.238 -12.182 -6.264 1.00 0.00 C ATOM 1023 CD LYS A 64 9.812 -11.045 -5.331 1.00 0.00 C ATOM 1024 CE LYS A 64 10.469 -9.720 -5.742 1.00 0.00 C ATOM 1025 NZ LYS A 64 10.156 -9.349 -7.136 1.00 0.00 N ATOM 0 H LYS A 64 8.972 -13.624 -8.208 1.00 0.00 H new ATOM 0 HA LYS A 64 11.142 -14.778 -6.615 1.00 0.00 H new ATOM 0 HB2 LYS A 64 8.529 -13.441 -5.845 1.00 0.00 H new ATOM 0 HB3 LYS A 64 9.907 -13.747 -4.807 1.00 0.00 H new ATOM 0 HG2 LYS A 64 11.325 -12.267 -6.265 1.00 0.00 H new ATOM 0 HG3 LYS A 64 9.936 -11.950 -7.285 1.00 0.00 H new ATOM 0 HD2 LYS A 64 8.727 -10.939 -5.353 1.00 0.00 H new ATOM 0 HD3 LYS A 64 10.088 -11.289 -4.305 1.00 0.00 H new ATOM 0 HE2 LYS A 64 10.133 -8.928 -5.073 1.00 0.00 H new ATOM 0 HE3 LYS A 64 11.550 -9.801 -5.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 10.460 -8.370 -7.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 10.656 -9.988 -7.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 9.131 -9.427 -7.294 1.00 0.00 H new ATOM 1039 N ASP A 65 9.796 -17.030 -7.198 1.00 0.00 N ATOM 1040 CA ASP A 65 9.153 -18.343 -7.312 1.00 0.00 C ATOM 1041 C ASP A 65 8.930 -19.091 -5.990 1.00 0.00 C ATOM 1042 O ASP A 65 9.499 -20.157 -5.767 1.00 0.00 O ATOM 1043 CB ASP A 65 9.935 -19.211 -8.310 1.00 0.00 C ATOM 1044 CG ASP A 65 9.158 -20.464 -8.712 1.00 0.00 C ATOM 1045 OD1 ASP A 65 7.944 -20.330 -8.985 1.00 0.00 O ATOM 1046 OD2 ASP A 65 9.795 -21.539 -8.771 1.00 0.00 O ATOM 0 H ASP A 65 10.650 -16.979 -7.754 1.00 0.00 H new ATOM 0 HA ASP A 65 8.145 -18.146 -7.676 1.00 0.00 H new ATOM 0 HB2 ASP A 65 10.162 -18.624 -9.200 1.00 0.00 H new ATOM 0 HB3 ASP A 65 10.888 -19.502 -7.868 1.00 0.00 H new ATOM 1051 N GLN A 66 8.062 -18.556 -5.136 1.00 0.00 N ATOM 1052 CA GLN A 66 7.625 -19.127 -3.877 1.00 0.00 C ATOM 1053 C GLN A 66 6.180 -18.680 -3.659 1.00 0.00 C ATOM 1054 O GLN A 66 5.244 -19.324 -4.129 1.00 0.00 O ATOM 1055 CB GLN A 66 8.558 -18.688 -2.732 1.00 0.00 C ATOM 1056 CG GLN A 66 9.943 -19.347 -2.790 1.00 0.00 C ATOM 1057 CD GLN A 66 10.811 -18.943 -1.603 1.00 0.00 C ATOM 1058 OE1 GLN A 66 11.922 -18.450 -1.772 1.00 0.00 O ATOM 1059 NE2 GLN A 66 10.318 -19.140 -0.384 1.00 0.00 N ATOM 0 H GLN A 66 7.621 -17.655 -5.322 1.00 0.00 H new ATOM 0 HA GLN A 66 7.668 -20.216 -3.896 1.00 0.00 H new ATOM 0 HB2 GLN A 66 8.677 -17.605 -2.765 1.00 0.00 H new ATOM 0 HB3 GLN A 66 8.089 -18.928 -1.778 1.00 0.00 H new ATOM 0 HG2 GLN A 66 9.830 -20.431 -2.805 1.00 0.00 H new ATOM 0 HG3 GLN A 66 10.441 -19.065 -3.718 1.00 0.00 H new ATOM 0 HE21 GLN A 66 9.392 -19.551 -0.269 1.00 0.00 H new ATOM 0 HE22 GLN A 66 10.866 -18.880 0.436 1.00 0.00 H new ATOM 1068 N GLU A 67 6.022 -17.563 -2.956 1.00 0.00 N ATOM 1069 CA GLU A 67 4.792 -16.842 -2.717 1.00 0.00 C ATOM 1070 C GLU A 67 5.175 -15.367 -2.649 1.00 0.00 C ATOM 1071 O GLU A 67 6.335 -15.056 -2.381 1.00 0.00 O ATOM 1072 CB GLU A 67 4.150 -17.330 -1.410 1.00 0.00 C ATOM 1073 CG GLU A 67 5.115 -17.284 -0.214 1.00 0.00 C ATOM 1074 CD GLU A 67 4.479 -17.817 1.064 1.00 0.00 C ATOM 1075 OE1 GLU A 67 3.663 -18.759 0.952 1.00 0.00 O ATOM 1076 OE2 GLU A 67 4.856 -17.298 2.138 1.00 0.00 O ATOM 0 H GLU A 67 6.817 -17.109 -2.507 1.00 0.00 H new ATOM 0 HA GLU A 67 4.055 -17.004 -3.504 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.277 -16.716 -1.189 1.00 0.00 H new ATOM 0 HB3 GLU A 67 3.796 -18.352 -1.545 1.00 0.00 H new ATOM 0 HG2 GLU A 67 6.005 -17.869 -0.446 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.442 -16.257 -0.053 1.00 0.00 H new ATOM 1083 N VAL A 68 4.211 -14.469 -2.842 1.00 0.00 N ATOM 1084 CA VAL A 68 4.408 -13.040 -2.653 1.00 0.00 C ATOM 1085 C VAL A 68 3.974 -12.710 -1.224 1.00 0.00 C ATOM 1086 O VAL A 68 2.906 -13.130 -0.774 1.00 0.00 O ATOM 1087 CB VAL A 68 3.614 -12.258 -3.715 1.00 0.00 C ATOM 1088 CG1 VAL A 68 3.701 -10.741 -3.511 1.00 0.00 C ATOM 1089 CG2 VAL A 68 4.142 -12.583 -5.115 1.00 0.00 C ATOM 0 H VAL A 68 3.266 -14.718 -3.136 1.00 0.00 H new ATOM 0 HA VAL A 68 5.451 -12.752 -2.781 1.00 0.00 H new ATOM 0 HB VAL A 68 2.573 -12.564 -3.611 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.124 -10.236 -4.286 1.00 0.00 H new ATOM 0 HG12 VAL A 68 3.298 -10.482 -2.532 1.00 0.00 H new ATOM 0 HG13 VAL A 68 4.743 -10.425 -3.570 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.573 -12.024 -5.857 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.194 -12.306 -5.180 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.036 -13.651 -5.305 1.00 0.00 H new ATOM 1099 N ASN A 69 4.790 -11.947 -0.497 1.00 0.00 N ATOM 1100 CA ASN A 69 4.531 -11.636 0.901 1.00 0.00 C ATOM 1101 C ASN A 69 3.707 -10.353 0.968 1.00 0.00 C ATOM 1102 O ASN A 69 3.782 -9.519 0.071 1.00 0.00 O ATOM 1103 CB ASN A 69 5.861 -11.444 1.642 1.00 0.00 C ATOM 1104 CG ASN A 69 5.632 -10.935 3.063 1.00 0.00 C ATOM 1105 OD1 ASN A 69 5.574 -9.730 3.294 1.00 0.00 O ATOM 1106 ND2 ASN A 69 5.443 -11.840 4.018 1.00 0.00 N ATOM 0 H ASN A 69 5.646 -11.530 -0.863 1.00 0.00 H new ATOM 0 HA ASN A 69 3.983 -12.452 1.372 1.00 0.00 H new ATOM 0 HB2 ASN A 69 6.402 -12.390 1.674 1.00 0.00 H new ATOM 0 HB3 ASN A 69 6.486 -10.737 1.096 1.00 0.00 H new ATOM 0 HD21 ASN A 69 5.244 -11.540 4.972 1.00 0.00 H new ATOM 0 HD22 ASN A 69 5.497 -12.834 3.796 1.00 0.00 H new ATOM 1113 N PHE A 70 2.918 -10.187 2.032 1.00 0.00 N ATOM 1114 CA PHE A 70 2.082 -9.011 2.225 1.00 0.00 C ATOM 1115 C PHE A 70 2.817 -7.704 1.905 1.00 0.00 C ATOM 1116 O PHE A 70 2.309 -6.874 1.154 1.00 0.00 O ATOM 1117 CB PHE A 70 1.546 -8.994 3.657 1.00 0.00 C ATOM 1118 CG PHE A 70 0.605 -7.837 3.909 1.00 0.00 C ATOM 1119 CD1 PHE A 70 1.117 -6.561 4.206 1.00 0.00 C ATOM 1120 CD2 PHE A 70 -0.771 -7.999 3.675 1.00 0.00 C ATOM 1121 CE1 PHE A 70 0.242 -5.480 4.387 1.00 0.00 C ATOM 1122 CE2 PHE A 70 -1.644 -6.908 3.813 1.00 0.00 C ATOM 1123 CZ PHE A 70 -1.135 -5.649 4.169 1.00 0.00 C ATOM 0 H PHE A 70 2.844 -10.871 2.785 1.00 0.00 H new ATOM 0 HA PHE A 70 1.252 -9.077 1.522 1.00 0.00 H new ATOM 0 HB2 PHE A 70 1.027 -9.931 3.858 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.382 -8.937 4.354 1.00 0.00 H new ATOM 0 HD1 PHE A 70 2.183 -6.414 4.295 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -1.158 -8.966 3.388 1.00 0.00 H new ATOM 0 HE1 PHE A 70 0.627 -4.519 4.694 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -2.703 -7.037 3.646 1.00 0.00 H new ATOM 0 HZ PHE A 70 -1.804 -4.808 4.276 1.00 0.00 H new ATOM 1133 N GLN A 71 4.015 -7.504 2.462 1.00 0.00 N ATOM 1134 CA GLN A 71 4.759 -6.273 2.224 1.00 0.00 C ATOM 1135 C GLN A 71 5.038 -6.103 0.727 1.00 0.00 C ATOM 1136 O GLN A 71 4.967 -4.990 0.200 1.00 0.00 O ATOM 1137 CB GLN A 71 6.048 -6.271 3.060 1.00 0.00 C ATOM 1138 CG GLN A 71 6.910 -5.009 2.877 1.00 0.00 C ATOM 1139 CD GLN A 71 6.176 -3.718 3.227 1.00 0.00 C ATOM 1140 OE1 GLN A 71 6.285 -3.213 4.338 1.00 0.00 O ATOM 1141 NE2 GLN A 71 5.426 -3.161 2.281 1.00 0.00 N ATOM 0 H GLN A 71 4.483 -8.173 3.074 1.00 0.00 H new ATOM 0 HA GLN A 71 4.162 -5.417 2.539 1.00 0.00 H new ATOM 0 HB2 GLN A 71 5.786 -6.370 4.113 1.00 0.00 H new ATOM 0 HB3 GLN A 71 6.642 -7.146 2.796 1.00 0.00 H new ATOM 0 HG2 GLN A 71 7.800 -5.093 3.500 1.00 0.00 H new ATOM 0 HG3 GLN A 71 7.249 -4.956 1.842 1.00 0.00 H new ATOM 0 HE21 GLN A 71 5.352 -3.601 1.364 1.00 0.00 H new ATOM 0 HE22 GLN A 71 4.925 -2.293 2.472 1.00 0.00 H new ATOM 1150 N GLU A 72 5.334 -7.211 0.042 1.00 0.00 N ATOM 1151 CA GLU A 72 5.567 -7.203 -1.388 1.00 0.00 C ATOM 1152 C GLU A 72 4.264 -6.867 -2.115 1.00 0.00 C ATOM 1153 O GLU A 72 4.275 -6.084 -3.067 1.00 0.00 O ATOM 1154 CB GLU A 72 6.155 -8.535 -1.860 1.00 0.00 C ATOM 1155 CG GLU A 72 7.498 -8.838 -1.185 1.00 0.00 C ATOM 1156 CD GLU A 72 8.048 -10.186 -1.637 1.00 0.00 C ATOM 1157 OE1 GLU A 72 7.296 -11.175 -1.496 1.00 0.00 O ATOM 1158 OE2 GLU A 72 9.201 -10.201 -2.117 1.00 0.00 O ATOM 0 H GLU A 72 5.417 -8.133 0.471 1.00 0.00 H new ATOM 0 HA GLU A 72 6.303 -6.435 -1.626 1.00 0.00 H new ATOM 0 HB2 GLU A 72 5.451 -9.339 -1.645 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.290 -8.510 -2.941 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.214 -8.051 -1.423 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.373 -8.838 -0.102 1.00 0.00 H new ATOM 1165 N TYR A 73 3.135 -7.425 -1.656 1.00 0.00 N ATOM 1166 CA TYR A 73 1.836 -7.105 -2.224 1.00 0.00 C ATOM 1167 C TYR A 73 1.579 -5.602 -2.089 1.00 0.00 C ATOM 1168 O TYR A 73 1.148 -4.965 -3.044 1.00 0.00 O ATOM 1169 CB TYR A 73 0.727 -7.953 -1.587 1.00 0.00 C ATOM 1170 CG TYR A 73 -0.666 -7.481 -1.952 1.00 0.00 C ATOM 1171 CD1 TYR A 73 -1.108 -7.564 -3.285 1.00 0.00 C ATOM 1172 CD2 TYR A 73 -1.436 -6.781 -1.004 1.00 0.00 C ATOM 1173 CE1 TYR A 73 -2.298 -6.925 -3.676 1.00 0.00 C ATOM 1174 CE2 TYR A 73 -2.615 -6.128 -1.398 1.00 0.00 C ATOM 1175 CZ TYR A 73 -3.034 -6.182 -2.738 1.00 0.00 C ATOM 1176 OH TYR A 73 -4.147 -5.495 -3.124 1.00 0.00 O ATOM 0 H TYR A 73 3.105 -8.100 -0.892 1.00 0.00 H new ATOM 0 HA TYR A 73 1.832 -7.353 -3.285 1.00 0.00 H new ATOM 0 HB2 TYR A 73 0.846 -8.990 -1.900 1.00 0.00 H new ATOM 0 HB3 TYR A 73 0.839 -7.932 -0.503 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -0.532 -8.120 -4.010 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -1.119 -6.746 0.028 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -2.645 -7.005 -4.695 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -3.200 -5.584 -0.671 1.00 0.00 H new ATOM 0 HH TYR A 73 -4.433 -5.805 -4.009 1.00 0.00 H new ATOM 1186 N ILE A 74 1.886 -5.016 -0.932 1.00 0.00 N ATOM 1187 CA ILE A 74 1.797 -3.577 -0.736 1.00 0.00 C ATOM 1188 C ILE A 74 2.711 -2.821 -1.711 1.00 0.00 C ATOM 1189 O ILE A 74 2.261 -1.868 -2.344 1.00 0.00 O ATOM 1190 CB ILE A 74 1.997 -3.226 0.753 1.00 0.00 C ATOM 1191 CG1 ILE A 74 0.645 -3.096 1.477 1.00 0.00 C ATOM 1192 CG2 ILE A 74 2.709 -1.886 0.939 1.00 0.00 C ATOM 1193 CD1 ILE A 74 -0.288 -4.294 1.280 1.00 0.00 C ATOM 0 H ILE A 74 2.202 -5.528 -0.108 1.00 0.00 H new ATOM 0 HA ILE A 74 0.793 -3.233 -0.986 1.00 0.00 H new ATOM 0 HB ILE A 74 2.597 -4.037 1.166 1.00 0.00 H new ATOM 0 HG12 ILE A 74 0.828 -2.963 2.543 1.00 0.00 H new ATOM 0 HG13 ILE A 74 0.142 -2.196 1.125 1.00 0.00 H new ATOM 0 HG21 ILE A 74 2.827 -1.681 2.003 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.690 -1.927 0.466 1.00 0.00 H new ATOM 0 HG23 ILE A 74 2.118 -1.093 0.481 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.218 -4.124 1.822 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.504 -4.417 0.219 1.00 0.00 H new ATOM 0 HD13 ILE A 74 0.193 -5.196 1.659 1.00 0.00 H new ATOM 1205 N THR A 75 3.977 -3.211 -1.878 1.00 0.00 N ATOM 1206 CA THR A 75 4.808 -2.509 -2.856 1.00 0.00 C ATOM 1207 C THR A 75 4.233 -2.649 -4.272 1.00 0.00 C ATOM 1208 O THR A 75 4.258 -1.690 -5.038 1.00 0.00 O ATOM 1209 CB THR A 75 6.272 -2.958 -2.773 1.00 0.00 C ATOM 1210 OG1 THR A 75 6.387 -4.362 -2.759 1.00 0.00 O ATOM 1211 CG2 THR A 75 6.932 -2.422 -1.500 1.00 0.00 C ATOM 0 H THR A 75 4.432 -3.973 -1.375 1.00 0.00 H new ATOM 0 HA THR A 75 4.793 -1.447 -2.610 1.00 0.00 H new ATOM 0 HB THR A 75 6.769 -2.560 -3.658 1.00 0.00 H new ATOM 0 HG1 THR A 75 5.525 -4.763 -2.996 1.00 0.00 H new ATOM 0 HG21 THR A 75 7.970 -2.753 -1.461 1.00 0.00 H new ATOM 0 HG22 THR A 75 6.898 -1.333 -1.504 1.00 0.00 H new ATOM 0 HG23 THR A 75 6.399 -2.799 -0.627 1.00 0.00 H new ATOM 1219 N PHE A 76 3.678 -3.818 -4.615 1.00 0.00 N ATOM 1220 CA PHE A 76 2.948 -4.004 -5.865 1.00 0.00 C ATOM 1221 C PHE A 76 1.752 -3.046 -5.937 1.00 0.00 C ATOM 1222 O PHE A 76 1.534 -2.419 -6.973 1.00 0.00 O ATOM 1223 CB PHE A 76 2.519 -5.470 -6.027 1.00 0.00 C ATOM 1224 CG PHE A 76 1.377 -5.676 -7.004 1.00 0.00 C ATOM 1225 CD1 PHE A 76 1.576 -5.427 -8.374 1.00 0.00 C ATOM 1226 CD2 PHE A 76 0.071 -5.882 -6.518 1.00 0.00 C ATOM 1227 CE1 PHE A 76 0.482 -5.412 -9.254 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -1.018 -5.907 -7.406 1.00 0.00 C ATOM 1229 CZ PHE A 76 -0.812 -5.675 -8.775 1.00 0.00 C ATOM 0 H PHE A 76 3.724 -4.655 -4.034 1.00 0.00 H new ATOM 0 HA PHE A 76 3.609 -3.764 -6.698 1.00 0.00 H new ATOM 0 HB2 PHE A 76 3.377 -6.054 -6.359 1.00 0.00 H new ATOM 0 HB3 PHE A 76 2.225 -5.861 -5.053 1.00 0.00 H new ATOM 0 HD1 PHE A 76 2.572 -5.247 -8.750 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -0.094 -6.021 -5.460 1.00 0.00 H new ATOM 0 HE1 PHE A 76 0.636 -5.198 -10.301 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -2.013 -6.105 -7.035 1.00 0.00 H new ATOM 0 HZ PHE A 76 -1.647 -5.699 -9.459 1.00 0.00 H new ATOM 1239 N LEU A 77 1.001 -2.912 -4.837 1.00 0.00 N ATOM 1240 CA LEU A 77 -0.119 -1.988 -4.738 1.00 0.00 C ATOM 1241 C LEU A 77 0.396 -0.609 -5.141 1.00 0.00 C ATOM 1242 O LEU A 77 -0.147 0.016 -6.045 1.00 0.00 O ATOM 1243 CB LEU A 77 -0.691 -2.011 -3.307 1.00 0.00 C ATOM 1244 CG LEU A 77 -2.131 -1.503 -3.148 1.00 0.00 C ATOM 1245 CD1 LEU A 77 -2.498 -1.575 -1.665 1.00 0.00 C ATOM 1246 CD2 LEU A 77 -2.319 -0.056 -3.611 1.00 0.00 C ATOM 0 H LEU A 77 1.161 -3.451 -3.986 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.937 -2.270 -5.401 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.645 -3.035 -2.935 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.043 -1.411 -2.669 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.767 -2.131 -3.772 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.519 -1.219 -1.525 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.423 -2.607 -1.321 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.814 -0.951 -1.090 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.359 0.239 -3.471 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.674 0.600 -3.026 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.058 0.025 -4.666 1.00 0.00 H new ATOM 1258 N GLY A 78 1.493 -0.175 -4.517 1.00 0.00 N ATOM 1259 CA GLY A 78 2.177 1.052 -4.876 1.00 0.00 C ATOM 1260 C GLY A 78 2.494 1.125 -6.367 1.00 0.00 C ATOM 1261 O GLY A 78 2.101 2.082 -7.027 1.00 0.00 O ATOM 0 H GLY A 78 1.929 -0.675 -3.743 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.559 1.905 -4.596 1.00 0.00 H new ATOM 0 HA3 GLY A 78 3.103 1.129 -4.306 1.00 0.00 H new ATOM 1265 N ALA A 79 3.216 0.133 -6.894 1.00 0.00 N ATOM 1266 CA ALA A 79 3.662 0.096 -8.282 1.00 0.00 C ATOM 1267 C ALA A 79 2.494 0.283 -9.253 1.00 0.00 C ATOM 1268 O ALA A 79 2.564 1.113 -10.156 1.00 0.00 O ATOM 1269 CB ALA A 79 4.403 -1.215 -8.556 1.00 0.00 C ATOM 0 H ALA A 79 3.511 -0.681 -6.354 1.00 0.00 H new ATOM 0 HA ALA A 79 4.348 0.927 -8.444 1.00 0.00 H new ATOM 0 HB1 ALA A 79 4.733 -1.236 -9.595 1.00 0.00 H new ATOM 0 HB2 ALA A 79 5.269 -1.288 -7.898 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.735 -2.056 -8.371 1.00 0.00 H new ATOM 1275 N LEU A 80 1.417 -0.482 -9.070 1.00 0.00 N ATOM 1276 CA LEU A 80 0.223 -0.353 -9.893 1.00 0.00 C ATOM 1277 C LEU A 80 -0.408 1.027 -9.677 1.00 0.00 C ATOM 1278 O LEU A 80 -0.646 1.787 -10.615 1.00 0.00 O ATOM 1279 CB LEU A 80 -0.747 -1.492 -9.539 1.00 0.00 C ATOM 1280 CG LEU A 80 -2.116 -1.391 -10.237 1.00 0.00 C ATOM 1281 CD1 LEU A 80 -1.988 -1.400 -11.765 1.00 0.00 C ATOM 1282 CD2 LEU A 80 -2.997 -2.565 -9.796 1.00 0.00 C ATOM 0 H LEU A 80 1.352 -1.203 -8.351 1.00 0.00 H new ATOM 0 HA LEU A 80 0.474 -0.433 -10.951 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.285 -2.443 -9.804 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -0.901 -1.502 -8.460 1.00 0.00 H new ATOM 0 HG LEU A 80 -2.567 -0.442 -9.947 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -2.979 -1.327 -12.214 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -1.382 -0.552 -12.084 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -1.512 -2.327 -12.085 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -3.967 -2.497 -10.288 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -2.516 -3.504 -10.070 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -3.135 -2.530 -8.715 1.00 0.00 H new ATOM 1294 N ALA A 81 -0.710 1.343 -8.421 1.00 0.00 N ATOM 1295 CA ALA A 81 -1.498 2.505 -8.069 1.00 0.00 C ATOM 1296 C ALA A 81 -0.813 3.814 -8.473 1.00 0.00 C ATOM 1297 O ALA A 81 -1.506 4.758 -8.831 1.00 0.00 O ATOM 1298 CB ALA A 81 -1.819 2.471 -6.577 1.00 0.00 C ATOM 0 H ALA A 81 -0.409 0.791 -7.618 1.00 0.00 H new ATOM 0 HA ALA A 81 -2.431 2.470 -8.631 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.412 3.346 -6.312 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.383 1.567 -6.347 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -0.891 2.475 -6.005 1.00 0.00 H new ATOM 1304 N MET A 82 0.522 3.904 -8.429 1.00 0.00 N ATOM 1305 CA MET A 82 1.207 5.142 -8.785 1.00 0.00 C ATOM 1306 C MET A 82 0.985 5.500 -10.258 1.00 0.00 C ATOM 1307 O MET A 82 0.670 6.648 -10.569 1.00 0.00 O ATOM 1308 CB MET A 82 2.691 5.129 -8.380 1.00 0.00 C ATOM 1309 CG MET A 82 3.591 4.151 -9.144 1.00 0.00 C ATOM 1310 SD MET A 82 5.352 4.205 -8.717 1.00 0.00 S ATOM 1311 CE MET A 82 5.320 3.774 -6.963 1.00 0.00 C ATOM 0 H MET A 82 1.139 3.140 -8.153 1.00 0.00 H new ATOM 0 HA MET A 82 0.756 5.944 -8.201 1.00 0.00 H new ATOM 0 HB2 MET A 82 3.090 6.135 -8.509 1.00 0.00 H new ATOM 0 HB3 MET A 82 2.754 4.895 -7.317 1.00 0.00 H new ATOM 0 HG2 MET A 82 3.225 3.139 -8.971 1.00 0.00 H new ATOM 0 HG3 MET A 82 3.489 4.349 -10.211 1.00 0.00 H new ATOM 0 HE1 MET A 82 6.337 3.596 -6.614 1.00 0.00 H new ATOM 0 HE2 MET A 82 4.879 4.593 -6.395 1.00 0.00 H new ATOM 0 HE3 MET A 82 4.724 2.872 -6.821 1.00 0.00 H new ATOM 1321 N ILE A 83 1.125 4.525 -11.168 1.00 0.00 N ATOM 1322 CA ILE A 83 0.850 4.775 -12.580 1.00 0.00 C ATOM 1323 C ILE A 83 -0.635 5.110 -12.745 1.00 0.00 C ATOM 1324 O ILE A 83 -0.983 6.117 -13.361 1.00 0.00 O ATOM 1325 CB ILE A 83 1.380 3.655 -13.505 1.00 0.00 C ATOM 1326 CG1 ILE A 83 1.051 3.903 -14.989 1.00 0.00 C ATOM 1327 CG2 ILE A 83 0.897 2.245 -13.149 1.00 0.00 C ATOM 1328 CD1 ILE A 83 1.613 5.224 -15.519 1.00 0.00 C ATOM 0 H ILE A 83 1.422 3.574 -10.952 1.00 0.00 H new ATOM 0 HA ILE A 83 1.414 5.645 -12.916 1.00 0.00 H new ATOM 0 HB ILE A 83 2.457 3.698 -13.341 1.00 0.00 H new ATOM 0 HG12 ILE A 83 1.449 3.081 -15.585 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -0.031 3.897 -15.120 1.00 0.00 H new ATOM 0 HG21 ILE A 83 1.320 1.527 -13.852 1.00 0.00 H new ATOM 0 HG22 ILE A 83 1.218 1.995 -12.138 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -0.191 2.208 -13.204 1.00 0.00 H new ATOM 0 HD11 ILE A 83 1.346 5.338 -16.570 1.00 0.00 H new ATOM 0 HD12 ILE A 83 1.196 6.053 -14.947 1.00 0.00 H new ATOM 0 HD13 ILE A 83 2.698 5.224 -15.419 1.00 0.00 H new ATOM 1340 N TYR A 84 -1.497 4.291 -12.136 1.00 0.00 N ATOM 1341 CA TYR A 84 -2.948 4.449 -12.155 1.00 0.00 C ATOM 1342 C TYR A 84 -3.351 5.874 -11.751 1.00 0.00 C ATOM 1343 O TYR A 84 -4.148 6.519 -12.428 1.00 0.00 O ATOM 1344 CB TYR A 84 -3.532 3.400 -11.196 1.00 0.00 C ATOM 1345 CG TYR A 84 -4.933 2.866 -11.407 1.00 0.00 C ATOM 1346 CD1 TYR A 84 -5.966 3.622 -11.994 1.00 0.00 C ATOM 1347 CD2 TYR A 84 -5.225 1.603 -10.863 1.00 0.00 C ATOM 1348 CE1 TYR A 84 -7.276 3.109 -12.029 1.00 0.00 C ATOM 1349 CE2 TYR A 84 -6.535 1.109 -10.864 1.00 0.00 C ATOM 1350 CZ TYR A 84 -7.563 1.857 -11.459 1.00 0.00 C ATOM 1351 OH TYR A 84 -8.835 1.368 -11.492 1.00 0.00 O ATOM 0 H TYR A 84 -1.193 3.477 -11.602 1.00 0.00 H new ATOM 0 HA TYR A 84 -3.340 4.296 -13.160 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -2.856 2.545 -11.204 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -3.497 3.825 -10.193 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -5.753 4.593 -12.416 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -4.430 1.007 -10.440 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -8.065 3.680 -12.496 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -6.754 0.155 -10.408 1.00 0.00 H new ATOM 0 HH TYR A 84 -8.895 0.574 -10.921 1.00 0.00 H new ATOM 1361 N ASN A 85 -2.786 6.374 -10.650 1.00 0.00 N ATOM 1362 CA ASN A 85 -3.027 7.703 -10.107 1.00 0.00 C ATOM 1363 C ASN A 85 -2.304 8.741 -10.972 1.00 0.00 C ATOM 1364 O ASN A 85 -1.411 9.443 -10.499 1.00 0.00 O ATOM 1365 CB ASN A 85 -2.568 7.727 -8.635 1.00 0.00 C ATOM 1366 CG ASN A 85 -3.055 8.936 -7.829 1.00 0.00 C ATOM 1367 OD1 ASN A 85 -3.717 8.779 -6.808 1.00 0.00 O ATOM 1368 ND2 ASN A 85 -2.718 10.150 -8.245 1.00 0.00 N ATOM 0 H ASN A 85 -2.121 5.838 -10.093 1.00 0.00 H new ATOM 0 HA ASN A 85 -4.088 7.953 -10.126 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -2.917 6.818 -8.146 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -1.479 7.706 -8.609 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -3.010 10.970 -7.714 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -2.167 10.263 -9.096 1.00 0.00 H new ATOM 1375 N GLU A 86 -2.692 8.859 -12.244 1.00 0.00 N ATOM 1376 CA GLU A 86 -2.211 9.885 -13.160 1.00 0.00 C ATOM 1377 C GLU A 86 -0.685 9.938 -13.248 1.00 0.00 C ATOM 1378 O GLU A 86 -0.133 11.021 -13.407 1.00 0.00 O ATOM 1379 CB GLU A 86 -2.811 11.249 -12.772 1.00 0.00 C ATOM 1380 CG GLU A 86 -4.335 11.207 -12.575 1.00 0.00 C ATOM 1381 CD GLU A 86 -5.059 10.674 -13.807 1.00 0.00 C ATOM 1382 OE1 GLU A 86 -5.207 11.464 -14.765 1.00 0.00 O ATOM 1383 OE2 GLU A 86 -5.439 9.484 -13.773 1.00 0.00 O ATOM 0 H GLU A 86 -3.367 8.225 -12.672 1.00 0.00 H new ATOM 0 HA GLU A 86 -2.549 9.622 -14.162 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -2.342 11.596 -11.852 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -2.571 11.978 -13.547 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -4.572 10.579 -11.716 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.698 12.209 -12.347 1.00 0.00 H new ATOM 1390 N ALA A 87 0.003 8.796 -13.128 1.00 0.00 N ATOM 1391 CA ALA A 87 1.463 8.744 -13.055 1.00 0.00 C ATOM 1392 C ALA A 87 2.029 9.700 -11.997 1.00 0.00 C ATOM 1393 O ALA A 87 3.121 10.241 -12.159 1.00 0.00 O ATOM 1394 CB ALA A 87 2.058 8.983 -14.447 1.00 0.00 C ATOM 0 H ALA A 87 -0.442 7.880 -13.079 1.00 0.00 H new ATOM 0 HA ALA A 87 1.758 7.747 -12.726 1.00 0.00 H new ATOM 0 HB1 ALA A 87 3.146 8.944 -14.389 1.00 0.00 H new ATOM 0 HB2 ALA A 87 1.703 8.213 -15.132 1.00 0.00 H new ATOM 0 HB3 ALA A 87 1.749 9.963 -14.811 1.00 0.00 H new ATOM 1400 N LEU A 88 1.273 9.912 -10.915 1.00 0.00 N ATOM 1401 CA LEU A 88 1.522 10.924 -9.901 1.00 0.00 C ATOM 1402 C LEU A 88 1.743 12.309 -10.520 1.00 0.00 C ATOM 1403 O LEU A 88 2.610 13.051 -10.063 1.00 0.00 O ATOM 1404 CB LEU A 88 2.667 10.493 -8.966 1.00 0.00 C ATOM 1405 CG LEU A 88 2.430 9.138 -8.276 1.00 0.00 C ATOM 1406 CD1 LEU A 88 3.651 8.803 -7.410 1.00 0.00 C ATOM 1407 CD2 LEU A 88 1.179 9.142 -7.388 1.00 0.00 C ATOM 0 H LEU A 88 0.439 9.358 -10.720 1.00 0.00 H new ATOM 0 HA LEU A 88 0.628 11.014 -9.285 1.00 0.00 H new ATOM 0 HB2 LEU A 88 3.592 10.441 -9.540 1.00 0.00 H new ATOM 0 HB3 LEU A 88 2.808 11.259 -8.203 1.00 0.00 H new ATOM 0 HG LEU A 88 2.279 8.392 -9.056 1.00 0.00 H new ATOM 0 HD11 LEU A 88 3.494 7.844 -6.916 1.00 0.00 H new ATOM 0 HD12 LEU A 88 4.539 8.746 -8.040 1.00 0.00 H new ATOM 0 HD13 LEU A 88 3.788 9.580 -6.658 1.00 0.00 H new ATOM 0 HD21 LEU A 88 1.058 8.163 -6.925 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.286 9.899 -6.612 1.00 0.00 H new ATOM 0 HD23 LEU A 88 0.302 9.367 -7.995 1.00 0.00 H new ATOM 1479 N SER B 3 -14.086 -7.022 -9.087 1.00 0.00 N ATOM 1480 CA SER B 3 -12.722 -6.714 -8.674 1.00 0.00 C ATOM 1481 C SER B 3 -12.594 -5.935 -7.349 1.00 0.00 C ATOM 1482 O SER B 3 -12.144 -4.788 -7.349 1.00 0.00 O ATOM 1483 CB SER B 3 -12.017 -6.035 -9.857 1.00 0.00 C ATOM 1484 OG SER B 3 -12.750 -4.931 -10.352 1.00 0.00 O ATOM 0 HA SER B 3 -12.222 -7.650 -8.426 1.00 0.00 H new ATOM 0 HB2 SER B 3 -11.027 -5.702 -9.545 1.00 0.00 H new ATOM 0 HB3 SER B 3 -11.872 -6.761 -10.657 1.00 0.00 H new ATOM 0 HG SER B 3 -13.709 -5.099 -10.241 1.00 0.00 H new ATOM 1490 N PRO B 4 -12.906 -6.557 -6.196 1.00 0.00 N ATOM 1491 CA PRO B 4 -12.743 -5.948 -4.878 1.00 0.00 C ATOM 1492 C PRO B 4 -11.369 -5.294 -4.691 1.00 0.00 C ATOM 1493 O PRO B 4 -11.262 -4.181 -4.181 1.00 0.00 O ATOM 1494 CB PRO B 4 -12.975 -7.079 -3.871 1.00 0.00 C ATOM 1495 CG PRO B 4 -13.924 -8.013 -4.622 1.00 0.00 C ATOM 1496 CD PRO B 4 -13.431 -7.908 -6.064 1.00 0.00 C ATOM 0 HA PRO B 4 -13.452 -5.132 -4.740 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -12.044 -7.579 -3.603 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -13.418 -6.712 -2.945 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -13.866 -9.035 -4.248 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -14.963 -7.697 -4.526 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -12.661 -8.651 -6.271 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -14.242 -8.085 -6.770 1.00 0.00 H new ATOM 1504 N LEU B 5 -10.313 -5.978 -5.141 1.00 0.00 N ATOM 1505 CA LEU B 5 -8.966 -5.427 -5.158 1.00 0.00 C ATOM 1506 C LEU B 5 -8.959 -4.067 -5.865 1.00 0.00 C ATOM 1507 O LEU B 5 -8.462 -3.086 -5.319 1.00 0.00 O ATOM 1508 CB LEU B 5 -8.001 -6.406 -5.847 1.00 0.00 C ATOM 1509 CG LEU B 5 -7.862 -7.761 -5.128 1.00 0.00 C ATOM 1510 CD1 LEU B 5 -7.062 -8.724 -6.014 1.00 0.00 C ATOM 1511 CD2 LEU B 5 -7.152 -7.625 -3.775 1.00 0.00 C ATOM 0 H LEU B 5 -10.374 -6.930 -5.503 1.00 0.00 H new ATOM 0 HA LEU B 5 -8.630 -5.281 -4.131 1.00 0.00 H new ATOM 0 HB2 LEU B 5 -8.344 -6.581 -6.867 1.00 0.00 H new ATOM 0 HB3 LEU B 5 -7.018 -5.941 -5.917 1.00 0.00 H new ATOM 0 HG LEU B 5 -8.866 -8.143 -4.946 1.00 0.00 H new ATOM 0 HD11 LEU B 5 -6.961 -9.685 -5.509 1.00 0.00 H new ATOM 0 HD12 LEU B 5 -7.583 -8.865 -6.961 1.00 0.00 H new ATOM 0 HD13 LEU B 5 -6.072 -8.308 -6.203 1.00 0.00 H new ATOM 0 HD21 LEU B 5 -7.076 -8.605 -3.304 1.00 0.00 H new ATOM 0 HD22 LEU B 5 -6.153 -7.218 -3.928 1.00 0.00 H new ATOM 0 HD23 LEU B 5 -7.722 -6.956 -3.131 1.00 0.00 H new ATOM 1523 N ASP B 6 -9.535 -3.987 -7.067 1.00 0.00 N ATOM 1524 CA ASP B 6 -9.579 -2.738 -7.810 1.00 0.00 C ATOM 1525 C ASP B 6 -10.430 -1.700 -7.094 1.00 0.00 C ATOM 1526 O ASP B 6 -10.075 -0.528 -7.113 1.00 0.00 O ATOM 1527 CB ASP B 6 -10.088 -2.942 -9.235 1.00 0.00 C ATOM 1528 CG ASP B 6 -10.138 -1.610 -9.981 1.00 0.00 C ATOM 1529 OD1 ASP B 6 -9.044 -1.072 -10.261 1.00 0.00 O ATOM 1530 OD2 ASP B 6 -11.265 -1.153 -10.266 1.00 0.00 O ATOM 0 H ASP B 6 -9.976 -4.775 -7.541 1.00 0.00 H new ATOM 0 HA ASP B 6 -8.555 -2.369 -7.867 1.00 0.00 H new ATOM 0 HB2 ASP B 6 -9.437 -3.638 -9.764 1.00 0.00 H new ATOM 0 HB3 ASP B 6 -11.081 -3.390 -9.212 1.00 0.00 H new ATOM 1535 N GLN B 7 -11.531 -2.103 -6.453 1.00 0.00 N ATOM 1536 CA GLN B 7 -12.273 -1.170 -5.611 1.00 0.00 C ATOM 1537 C GLN B 7 -11.338 -0.571 -4.554 1.00 0.00 C ATOM 1538 O GLN B 7 -11.325 0.643 -4.352 1.00 0.00 O ATOM 1539 CB GLN B 7 -13.494 -1.830 -4.959 1.00 0.00 C ATOM 1540 CG GLN B 7 -14.506 -2.351 -5.989 1.00 0.00 C ATOM 1541 CD GLN B 7 -15.750 -2.913 -5.305 1.00 0.00 C ATOM 1542 OE1 GLN B 7 -16.250 -2.343 -4.342 1.00 0.00 O ATOM 1543 NE2 GLN B 7 -16.266 -4.039 -5.782 1.00 0.00 N ATOM 0 H GLN B 7 -11.918 -3.045 -6.500 1.00 0.00 H new ATOM 0 HA GLN B 7 -12.653 -0.369 -6.245 1.00 0.00 H new ATOM 0 HB2 GLN B 7 -13.163 -2.657 -4.331 1.00 0.00 H new ATOM 0 HB3 GLN B 7 -13.985 -1.110 -4.305 1.00 0.00 H new ATOM 0 HG2 GLN B 7 -14.792 -1.543 -6.663 1.00 0.00 H new ATOM 0 HG3 GLN B 7 -14.042 -3.126 -6.599 1.00 0.00 H new ATOM 0 HE21 GLN B 7 -15.835 -4.498 -6.584 1.00 0.00 H new ATOM 0 HE22 GLN B 7 -17.094 -4.445 -5.346 1.00 0.00 H new ATOM 1552 N ALA B 8 -10.528 -1.411 -3.901 1.00 0.00 N ATOM 1553 CA ALA B 8 -9.573 -0.947 -2.902 1.00 0.00 C ATOM 1554 C ALA B 8 -8.577 0.040 -3.518 1.00 0.00 C ATOM 1555 O ALA B 8 -8.397 1.140 -2.990 1.00 0.00 O ATOM 1556 CB ALA B 8 -8.866 -2.126 -2.227 1.00 0.00 C ATOM 0 H ALA B 8 -10.519 -2.420 -4.051 1.00 0.00 H new ATOM 0 HA ALA B 8 -10.122 -0.414 -2.125 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -8.159 -1.751 -1.487 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -9.604 -2.760 -1.736 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -8.331 -2.707 -2.978 1.00 0.00 H new ATOM 1562 N ILE B 9 -7.947 -0.333 -4.642 1.00 0.00 N ATOM 1563 CA ILE B 9 -7.055 0.569 -5.370 1.00 0.00 C ATOM 1564 C ILE B 9 -7.770 1.902 -5.613 1.00 0.00 C ATOM 1565 O ILE B 9 -7.255 2.955 -5.249 1.00 0.00 O ATOM 1566 CB ILE B 9 -6.571 -0.042 -6.704 1.00 0.00 C ATOM 1567 CG1 ILE B 9 -5.828 -1.385 -6.579 1.00 0.00 C ATOM 1568 CG2 ILE B 9 -5.672 0.960 -7.442 1.00 0.00 C ATOM 1569 CD1 ILE B 9 -4.495 -1.307 -5.839 1.00 0.00 C ATOM 0 H ILE B 9 -8.042 -1.257 -5.064 1.00 0.00 H new ATOM 0 HA ILE B 9 -6.167 0.734 -4.760 1.00 0.00 H new ATOM 0 HB ILE B 9 -7.482 -0.254 -7.264 1.00 0.00 H new ATOM 0 HG12 ILE B 9 -6.474 -2.096 -6.064 1.00 0.00 H new ATOM 0 HG13 ILE B 9 -5.651 -1.782 -7.579 1.00 0.00 H new ATOM 0 HG21 ILE B 9 -5.334 0.523 -8.382 1.00 0.00 H new ATOM 0 HG22 ILE B 9 -6.234 1.871 -7.647 1.00 0.00 H new ATOM 0 HG23 ILE B 9 -4.808 1.199 -6.822 1.00 0.00 H new ATOM 0 HD11 ILE B 9 -4.043 -2.298 -5.799 1.00 0.00 H new ATOM 0 HD12 ILE B 9 -3.827 -0.624 -6.364 1.00 0.00 H new ATOM 0 HD13 ILE B 9 -4.662 -0.943 -4.825 1.00 0.00 H new ATOM 1581 N GLY B 10 -8.960 1.838 -6.215 1.00 0.00 N ATOM 1582 CA GLY B 10 -9.817 2.966 -6.538 1.00 0.00 C ATOM 1583 C GLY B 10 -9.992 3.894 -5.343 1.00 0.00 C ATOM 1584 O GLY B 10 -9.703 5.086 -5.438 1.00 0.00 O ATOM 0 H GLY B 10 -9.367 0.948 -6.503 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -9.389 3.522 -7.372 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -10.792 2.602 -6.863 1.00 0.00 H new ATOM 1588 N LEU B 11 -10.448 3.348 -4.211 1.00 0.00 N ATOM 1589 CA LEU B 11 -10.585 4.107 -2.976 1.00 0.00 C ATOM 1590 C LEU B 11 -9.262 4.793 -2.635 1.00 0.00 C ATOM 1591 O LEU B 11 -9.224 6.007 -2.451 1.00 0.00 O ATOM 1592 CB LEU B 11 -11.037 3.195 -1.823 1.00 0.00 C ATOM 1593 CG LEU B 11 -12.495 2.720 -1.939 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -12.728 1.559 -0.965 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -13.484 3.848 -1.616 1.00 0.00 C ATOM 0 H LEU B 11 -10.730 2.371 -4.131 1.00 0.00 H new ATOM 0 HA LEU B 11 -11.349 4.871 -3.119 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -10.383 2.324 -1.784 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -10.913 3.729 -0.881 1.00 0.00 H new ATOM 0 HG LEU B 11 -12.664 2.400 -2.967 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -13.761 1.219 -1.044 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -12.056 0.737 -1.211 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -12.533 1.894 0.054 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -14.504 3.475 -1.708 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -13.317 4.198 -0.597 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -13.335 4.673 -2.312 1.00 0.00 H new ATOM 1607 N LEU B 12 -8.173 4.024 -2.554 1.00 0.00 N ATOM 1608 CA LEU B 12 -6.880 4.551 -2.139 1.00 0.00 C ATOM 1609 C LEU B 12 -6.417 5.698 -3.044 1.00 0.00 C ATOM 1610 O LEU B 12 -6.076 6.772 -2.537 1.00 0.00 O ATOM 1611 CB LEU B 12 -5.847 3.417 -2.075 1.00 0.00 C ATOM 1612 CG LEU B 12 -6.153 2.413 -0.950 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -5.395 1.109 -1.213 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -5.759 2.963 0.429 1.00 0.00 C ATOM 0 H LEU B 12 -8.167 3.028 -2.773 1.00 0.00 H new ATOM 0 HA LEU B 12 -6.985 4.973 -1.139 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -5.826 2.893 -3.031 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -4.854 3.841 -1.921 1.00 0.00 H new ATOM 0 HG LEU B 12 -7.228 2.233 -0.944 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -5.610 0.396 -0.417 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -5.710 0.691 -2.169 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -4.324 1.310 -1.240 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -5.991 2.224 1.196 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -4.690 3.177 0.444 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -6.315 3.879 0.628 1.00 0.00 H new ATOM 1626 N ILE B 13 -6.393 5.490 -4.365 1.00 0.00 N ATOM 1627 CA ILE B 13 -5.958 6.524 -5.299 1.00 0.00 C ATOM 1628 C ILE B 13 -6.917 7.712 -5.264 1.00 0.00 C ATOM 1629 O ILE B 13 -6.471 8.852 -5.222 1.00 0.00 O ATOM 1630 CB ILE B 13 -5.709 5.989 -6.725 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -6.981 5.533 -7.460 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -4.636 4.893 -6.677 1.00 0.00 C ATOM 1633 CD1 ILE B 13 -6.696 4.994 -8.866 1.00 0.00 C ATOM 0 H ILE B 13 -6.670 4.614 -4.807 1.00 0.00 H new ATOM 0 HA ILE B 13 -4.982 6.878 -4.966 1.00 0.00 H new ATOM 0 HB ILE B 13 -5.346 6.823 -7.325 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -7.476 4.759 -6.873 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -7.674 6.371 -7.531 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -4.458 4.513 -7.683 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -3.711 5.307 -6.277 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -4.976 4.079 -6.037 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -7.631 4.688 -9.335 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -6.227 5.774 -9.466 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -6.027 4.136 -8.798 1.00 0.00 H new ATOM 1645 N GLY B 14 -8.230 7.464 -5.238 1.00 0.00 N ATOM 1646 CA GLY B 14 -9.226 8.521 -5.179 1.00 0.00 C ATOM 1647 C GLY B 14 -8.990 9.414 -3.962 1.00 0.00 C ATOM 1648 O GLY B 14 -8.817 10.625 -4.093 1.00 0.00 O ATOM 0 H GLY B 14 -8.625 6.524 -5.257 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -9.184 9.119 -6.089 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -10.224 8.086 -5.129 1.00 0.00 H new ATOM 1652 N ILE B 15 -8.960 8.806 -2.774 1.00 0.00 N ATOM 1653 CA ILE B 15 -8.725 9.508 -1.520 1.00 0.00 C ATOM 1654 C ILE B 15 -7.412 10.290 -1.608 1.00 0.00 C ATOM 1655 O ILE B 15 -7.378 11.472 -1.267 1.00 0.00 O ATOM 1656 CB ILE B 15 -8.758 8.509 -0.347 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -10.193 7.972 -0.173 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -8.282 9.164 0.958 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -10.250 6.712 0.695 1.00 0.00 C ATOM 0 H ILE B 15 -9.100 7.802 -2.659 1.00 0.00 H new ATOM 0 HA ILE B 15 -9.516 10.234 -1.335 1.00 0.00 H new ATOM 0 HB ILE B 15 -8.080 7.687 -0.575 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -10.815 8.746 0.276 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -10.616 7.753 -1.153 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -8.317 8.433 1.766 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -7.259 9.520 0.835 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -8.932 10.005 1.201 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -11.284 6.378 0.784 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -9.653 5.925 0.234 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -9.854 6.935 1.686 1.00 0.00 H new ATOM 1671 N PHE B 16 -6.339 9.647 -2.082 1.00 0.00 N ATOM 1672 CA PHE B 16 -5.053 10.317 -2.222 1.00 0.00 C ATOM 1673 C PHE B 16 -5.180 11.560 -3.101 1.00 0.00 C ATOM 1674 O PHE B 16 -4.856 12.671 -2.682 1.00 0.00 O ATOM 1675 CB PHE B 16 -4.006 9.346 -2.783 1.00 0.00 C ATOM 1676 CG PHE B 16 -2.591 9.875 -2.693 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -1.854 9.678 -1.512 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -2.045 10.644 -3.738 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -0.545 10.172 -1.406 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -0.759 11.196 -3.600 1.00 0.00 C ATOM 1681 CZ PHE B 16 0.006 10.922 -2.455 1.00 0.00 C ATOM 0 H PHE B 16 -6.341 8.669 -2.372 1.00 0.00 H new ATOM 0 HA PHE B 16 -4.722 10.643 -1.236 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -4.069 8.402 -2.242 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -4.241 9.132 -3.826 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -2.297 9.145 -0.684 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -2.612 10.809 -4.642 1.00 0.00 H new ATOM 0 HE1 PHE B 16 0.037 9.975 -0.518 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -0.359 11.832 -4.376 1.00 0.00 H new ATOM 0 HZ PHE B 16 1.019 11.289 -2.382 1.00 0.00 H new ATOM 1691 N HIS B 17 -5.668 11.363 -4.324 1.00 0.00 N ATOM 1692 CA HIS B 17 -5.832 12.398 -5.327 1.00 0.00 C ATOM 1693 C HIS B 17 -6.749 13.514 -4.825 1.00 0.00 C ATOM 1694 O HIS B 17 -6.573 14.663 -5.227 1.00 0.00 O ATOM 1695 CB HIS B 17 -6.341 11.764 -6.629 1.00 0.00 C ATOM 1696 CG HIS B 17 -6.238 12.654 -7.845 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -6.499 14.005 -7.898 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -5.865 12.258 -9.102 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -6.293 14.410 -9.164 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -5.903 13.380 -9.934 1.00 0.00 N ATOM 0 H HIS B 17 -5.969 10.444 -4.649 1.00 0.00 H new ATOM 0 HA HIS B 17 -4.868 12.865 -5.529 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -5.779 10.849 -6.816 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -7.383 11.475 -6.494 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -6.795 14.592 -7.118 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -5.590 11.256 -9.398 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -6.423 15.424 -9.514 1.00 0.00 H new ATOM 1708 N LYS B 18 -7.722 13.201 -3.965 1.00 0.00 N ATOM 1709 CA LYS B 18 -8.659 14.199 -3.464 1.00 0.00 C ATOM 1710 C LYS B 18 -7.906 15.345 -2.782 1.00 0.00 C ATOM 1711 O LYS B 18 -8.183 16.513 -3.041 1.00 0.00 O ATOM 1712 CB LYS B 18 -9.680 13.544 -2.522 1.00 0.00 C ATOM 1713 CG LYS B 18 -10.871 14.477 -2.261 1.00 0.00 C ATOM 1714 CD LYS B 18 -11.963 13.798 -1.420 1.00 0.00 C ATOM 1715 CE LYS B 18 -11.515 13.435 0.001 1.00 0.00 C ATOM 1716 NZ LYS B 18 -11.046 14.616 0.745 1.00 0.00 N ATOM 0 H LYS B 18 -7.878 12.260 -3.603 1.00 0.00 H new ATOM 0 HA LYS B 18 -9.210 14.625 -4.303 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -10.035 12.610 -2.958 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -9.198 13.292 -1.577 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -10.523 15.373 -1.747 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -11.294 14.799 -3.212 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -12.827 14.460 -1.360 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -12.290 12.892 -1.930 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -12.344 12.974 0.537 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -10.716 12.695 -0.048 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -10.032 14.515 0.954 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -11.198 15.470 0.172 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -11.576 14.698 1.636 1.00 0.00 H new ATOM 1730 N TYR B 19 -6.948 15.008 -1.913 1.00 0.00 N ATOM 1731 CA TYR B 19 -6.073 15.995 -1.294 1.00 0.00 C ATOM 1732 C TYR B 19 -4.957 16.371 -2.265 1.00 0.00 C ATOM 1733 O TYR B 19 -4.777 17.541 -2.596 1.00 0.00 O ATOM 1734 CB TYR B 19 -5.492 15.443 0.010 1.00 0.00 C ATOM 1735 CG TYR B 19 -6.501 15.331 1.130 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -7.291 14.175 1.240 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -6.679 16.397 2.031 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -8.275 14.094 2.241 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -7.660 16.313 3.034 1.00 0.00 C ATOM 1740 CZ TYR B 19 -8.469 15.168 3.126 1.00 0.00 C ATOM 1741 OH TYR B 19 -9.503 15.135 4.013 1.00 0.00 O ATOM 0 H TYR B 19 -6.762 14.048 -1.623 1.00 0.00 H new ATOM 0 HA TYR B 19 -6.649 16.889 -1.058 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -5.065 14.458 -0.182 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -4.674 16.087 0.334 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -7.143 13.351 0.558 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -6.062 17.280 1.952 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -8.882 13.205 2.330 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -7.792 17.126 3.732 1.00 0.00 H new ATOM 0 HH TYR B 19 -9.402 15.864 4.661 1.00 0.00 H new ATOM 1751 N SER B 20 -4.204 15.366 -2.719 1.00 0.00 N ATOM 1752 CA SER B 20 -2.988 15.558 -3.497 1.00 0.00 C ATOM 1753 C SER B 20 -3.218 16.409 -4.751 1.00 0.00 C ATOM 1754 O SER B 20 -2.313 17.116 -5.189 1.00 0.00 O ATOM 1755 CB SER B 20 -2.368 14.195 -3.817 1.00 0.00 C ATOM 1756 OG SER B 20 -1.085 14.379 -4.366 1.00 0.00 O ATOM 0 H SER B 20 -4.429 14.385 -2.552 1.00 0.00 H new ATOM 0 HA SER B 20 -2.280 16.128 -2.895 1.00 0.00 H new ATOM 0 HB2 SER B 20 -2.304 13.591 -2.912 1.00 0.00 H new ATOM 0 HB3 SER B 20 -3.001 13.652 -4.519 1.00 0.00 H new ATOM 0 HG SER B 20 -0.542 14.919 -3.754 1.00 0.00 H new ATOM 1762 N GLY B 21 -4.435 16.400 -5.305 1.00 0.00 N ATOM 1763 CA GLY B 21 -4.864 17.295 -6.372 1.00 0.00 C ATOM 1764 C GLY B 21 -4.468 18.756 -6.135 1.00 0.00 C ATOM 1765 O GLY B 21 -4.156 19.461 -7.090 1.00 0.00 O ATOM 0 H GLY B 21 -5.165 15.750 -5.012 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -4.433 16.958 -7.315 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -5.947 17.232 -6.476 1.00 0.00 H new ATOM 1769 N LYS B 22 -4.455 19.217 -4.879 1.00 0.00 N ATOM 1770 CA LYS B 22 -3.993 20.559 -4.537 1.00 0.00 C ATOM 1771 C LYS B 22 -2.530 20.769 -4.948 1.00 0.00 C ATOM 1772 O LYS B 22 -2.175 21.835 -5.445 1.00 0.00 O ATOM 1773 CB LYS B 22 -4.175 20.807 -3.032 1.00 0.00 C ATOM 1774 CG LYS B 22 -5.628 20.678 -2.549 1.00 0.00 C ATOM 1775 CD LYS B 22 -6.553 21.741 -3.153 1.00 0.00 C ATOM 1776 CE LYS B 22 -7.963 21.585 -2.576 1.00 0.00 C ATOM 1777 NZ LYS B 22 -8.887 22.584 -3.139 1.00 0.00 N ATOM 0 H LYS B 22 -4.764 18.669 -4.076 1.00 0.00 H new ATOM 0 HA LYS B 22 -4.595 21.279 -5.091 1.00 0.00 H new ATOM 0 HB2 LYS B 22 -3.555 20.100 -2.480 1.00 0.00 H new ATOM 0 HB3 LYS B 22 -3.810 21.806 -2.792 1.00 0.00 H new ATOM 0 HG2 LYS B 22 -6.004 19.688 -2.805 1.00 0.00 H new ATOM 0 HG3 LYS B 22 -5.653 20.757 -1.462 1.00 0.00 H new ATOM 0 HD2 LYS B 22 -6.169 22.738 -2.936 1.00 0.00 H new ATOM 0 HD3 LYS B 22 -6.580 21.640 -4.238 1.00 0.00 H new ATOM 0 HE2 LYS B 22 -8.335 20.583 -2.787 1.00 0.00 H new ATOM 0 HE3 LYS B 22 -7.928 21.690 -1.492 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 -9.833 22.452 -2.728 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 -8.543 23.540 -2.916 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 -8.938 22.467 -4.171 1.00 0.00 H new ATOM 1791 N GLU B 23 -1.684 19.756 -4.747 1.00 0.00 N ATOM 1792 CA GLU B 23 -0.294 19.772 -5.186 1.00 0.00 C ATOM 1793 C GLU B 23 -0.233 19.513 -6.699 1.00 0.00 C ATOM 1794 O GLU B 23 0.651 20.007 -7.402 1.00 0.00 O ATOM 1795 CB GLU B 23 0.511 18.730 -4.399 1.00 0.00 C ATOM 1796 CG GLU B 23 0.197 18.703 -2.893 1.00 0.00 C ATOM 1797 CD GLU B 23 0.252 20.084 -2.246 1.00 0.00 C ATOM 1798 OE1 GLU B 23 1.350 20.680 -2.274 1.00 0.00 O ATOM 1799 OE2 GLU B 23 -0.804 20.518 -1.736 1.00 0.00 O ATOM 0 H GLU B 23 -1.951 18.895 -4.270 1.00 0.00 H new ATOM 0 HA GLU B 23 0.149 20.749 -4.992 1.00 0.00 H new ATOM 0 HB2 GLU B 23 0.316 17.743 -4.818 1.00 0.00 H new ATOM 0 HB3 GLU B 23 1.574 18.929 -4.534 1.00 0.00 H new ATOM 0 HG2 GLU B 23 -0.795 18.277 -2.742 1.00 0.00 H new ATOM 0 HG3 GLU B 23 0.906 18.045 -2.392 1.00 0.00 H new ATOM 1806 N GLY B 24 -1.189 18.723 -7.193 1.00 0.00 N ATOM 1807 CA GLY B 24 -1.470 18.526 -8.602 1.00 0.00 C ATOM 1808 C GLY B 24 -0.350 17.765 -9.295 1.00 0.00 C ATOM 1809 O GLY B 24 -0.422 16.544 -9.430 1.00 0.00 O ATOM 0 H GLY B 24 -1.810 18.184 -6.590 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -2.406 17.979 -8.714 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -1.607 19.493 -9.085 1.00 0.00 H new ATOM 1813 N ASP B 25 0.673 18.508 -9.724 1.00 0.00 N ATOM 1814 CA ASP B 25 1.834 17.988 -10.427 1.00 0.00 C ATOM 1815 C ASP B 25 2.789 17.341 -9.431 1.00 0.00 C ATOM 1816 O ASP B 25 3.234 16.215 -9.635 1.00 0.00 O ATOM 1817 CB ASP B 25 2.532 19.120 -11.191 1.00 0.00 C ATOM 1818 CG ASP B 25 3.823 18.625 -11.837 1.00 0.00 C ATOM 1819 OD1 ASP B 25 3.712 17.900 -12.848 1.00 0.00 O ATOM 1820 OD2 ASP B 25 4.896 18.978 -11.301 1.00 0.00 O ATOM 0 H ASP B 25 0.711 19.518 -9.584 1.00 0.00 H new ATOM 0 HA ASP B 25 1.516 17.233 -11.146 1.00 0.00 H new ATOM 0 HB2 ASP B 25 1.864 19.513 -11.958 1.00 0.00 H new ATOM 0 HB3 ASP B 25 2.753 19.942 -10.510 1.00 0.00 H new ATOM 1825 N LYS B 26 3.090 18.039 -8.332 1.00 0.00 N ATOM 1826 CA LYS B 26 3.901 17.490 -7.252 1.00 0.00 C ATOM 1827 C LYS B 26 2.989 16.607 -6.402 1.00 0.00 C ATOM 1828 O LYS B 26 2.788 16.862 -5.215 1.00 0.00 O ATOM 1829 CB LYS B 26 4.533 18.637 -6.446 1.00 0.00 C ATOM 1830 CG LYS B 26 5.336 19.621 -7.312 1.00 0.00 C ATOM 1831 CD LYS B 26 6.463 18.929 -8.093 1.00 0.00 C ATOM 1832 CE LYS B 26 7.368 19.944 -8.801 1.00 0.00 C ATOM 1833 NZ LYS B 26 6.622 20.745 -9.789 1.00 0.00 N ATOM 0 H LYS B 26 2.778 18.996 -8.170 1.00 0.00 H new ATOM 0 HA LYS B 26 4.726 16.885 -7.629 1.00 0.00 H new ATOM 0 HB2 LYS B 26 3.746 19.182 -5.925 1.00 0.00 H new ATOM 0 HB3 LYS B 26 5.189 18.217 -5.683 1.00 0.00 H new ATOM 0 HG2 LYS B 26 4.664 20.117 -8.012 1.00 0.00 H new ATOM 0 HG3 LYS B 26 5.762 20.397 -6.676 1.00 0.00 H new ATOM 0 HD2 LYS B 26 7.060 18.323 -7.411 1.00 0.00 H new ATOM 0 HD3 LYS B 26 6.032 18.250 -8.829 1.00 0.00 H new ATOM 0 HE2 LYS B 26 7.820 20.606 -8.062 1.00 0.00 H new ATOM 0 HE3 LYS B 26 8.183 19.419 -9.299 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 7.292 21.231 -10.419 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 6.010 20.120 -10.351 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 6.038 21.449 -9.295 1.00 0.00 H new ATOM 1847 N HIS B 27 2.418 15.578 -7.036 1.00 0.00 N ATOM 1848 CA HIS B 27 1.325 14.774 -6.538 1.00 0.00 C ATOM 1849 C HIS B 27 1.725 13.940 -5.317 1.00 0.00 C ATOM 1850 O HIS B 27 1.941 12.731 -5.389 1.00 0.00 O ATOM 1851 CB HIS B 27 0.793 13.954 -7.714 1.00 0.00 C ATOM 1852 CG HIS B 27 -0.662 13.650 -7.577 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -1.699 14.504 -7.858 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -1.178 12.521 -7.022 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -2.831 13.884 -7.482 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -2.571 12.663 -6.979 1.00 0.00 N ATOM 0 H HIS B 27 2.731 15.277 -7.959 1.00 0.00 H new ATOM 0 HA HIS B 27 0.521 15.404 -6.158 1.00 0.00 H new ATOM 0 HB2 HIS B 27 0.962 14.500 -8.642 1.00 0.00 H new ATOM 0 HB3 HIS B 27 1.352 13.021 -7.787 1.00 0.00 H new ATOM 0 HD1 HIS B 27 -1.625 15.433 -8.273 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -0.614 11.667 -6.676 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -3.819 14.310 -7.572 1.00 0.00 H new ATOM 1864 N THR B 28 1.827 14.628 -4.185 1.00 0.00 N ATOM 1865 CA THR B 28 2.183 14.139 -2.881 1.00 0.00 C ATOM 1866 C THR B 28 1.154 14.713 -1.901 1.00 0.00 C ATOM 1867 O THR B 28 0.324 15.539 -2.284 1.00 0.00 O ATOM 1868 CB THR B 28 3.621 14.588 -2.576 1.00 0.00 C ATOM 1869 OG1 THR B 28 3.743 15.992 -2.690 1.00 0.00 O ATOM 1870 CG2 THR B 28 4.619 13.945 -3.545 1.00 0.00 C ATOM 0 H THR B 28 1.644 15.631 -4.168 1.00 0.00 H new ATOM 0 HA THR B 28 2.165 13.052 -2.806 1.00 0.00 H new ATOM 0 HB THR B 28 3.843 14.273 -1.556 1.00 0.00 H new ATOM 0 HG1 THR B 28 3.533 16.265 -3.607 1.00 0.00 H new ATOM 0 HG21 THR B 28 5.628 14.281 -3.305 1.00 0.00 H new ATOM 0 HG22 THR B 28 4.567 12.860 -3.454 1.00 0.00 H new ATOM 0 HG23 THR B 28 4.373 14.236 -4.566 1.00 0.00 H new ATOM 1878 N LEU B 29 1.182 14.240 -0.662 1.00 0.00 N ATOM 1879 CA LEU B 29 0.457 14.804 0.468 1.00 0.00 C ATOM 1880 C LEU B 29 1.448 15.648 1.270 1.00 0.00 C ATOM 1881 O LEU B 29 2.640 15.671 0.963 1.00 0.00 O ATOM 1882 CB LEU B 29 -0.162 13.691 1.326 1.00 0.00 C ATOM 1883 CG LEU B 29 -1.257 12.896 0.602 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -1.682 11.715 1.483 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -2.490 13.740 0.271 1.00 0.00 C ATOM 0 H LEU B 29 1.733 13.420 -0.407 1.00 0.00 H new ATOM 0 HA LEU B 29 -0.369 15.427 0.126 1.00 0.00 H new ATOM 0 HB2 LEU B 29 0.625 13.006 1.641 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -0.582 14.131 2.230 1.00 0.00 H new ATOM 0 HG LEU B 29 -0.836 12.555 -0.344 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -2.460 11.144 0.976 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -0.822 11.071 1.668 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -2.066 12.089 2.432 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -3.228 13.121 -0.240 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -2.921 14.132 1.192 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -2.201 14.569 -0.376 1.00 0.00 H new ATOM 1897 N SER B 30 0.979 16.379 2.279 1.00 0.00 N ATOM 1898 CA SER B 30 1.840 17.172 3.140 1.00 0.00 C ATOM 1899 C SER B 30 1.282 17.184 4.553 1.00 0.00 C ATOM 1900 O SER B 30 0.092 16.931 4.750 1.00 0.00 O ATOM 1901 CB SER B 30 1.931 18.597 2.589 1.00 0.00 C ATOM 1902 OG SER B 30 0.626 19.137 2.491 1.00 0.00 O ATOM 0 H SER B 30 -0.011 16.435 2.519 1.00 0.00 H new ATOM 0 HA SER B 30 2.839 16.736 3.165 1.00 0.00 H new ATOM 0 HB2 SER B 30 2.546 19.215 3.243 1.00 0.00 H new ATOM 0 HB3 SER B 30 2.411 18.592 1.610 1.00 0.00 H new ATOM 0 HG SER B 30 0.175 18.763 1.705 1.00 0.00 H new ATOM 1908 N LYS B 31 2.123 17.549 5.526 1.00 0.00 N ATOM 1909 CA LYS B 31 1.659 17.813 6.877 1.00 0.00 C ATOM 1910 C LYS B 31 0.516 18.833 6.846 1.00 0.00 C ATOM 1911 O LYS B 31 -0.426 18.730 7.626 1.00 0.00 O ATOM 1912 CB LYS B 31 2.814 18.245 7.791 1.00 0.00 C ATOM 1913 CG LYS B 31 3.402 19.629 7.481 1.00 0.00 C ATOM 1914 CD LYS B 31 4.492 19.960 8.507 1.00 0.00 C ATOM 1915 CE LYS B 31 4.923 21.424 8.378 1.00 0.00 C ATOM 1916 NZ LYS B 31 6.100 21.710 9.216 1.00 0.00 N ATOM 0 H LYS B 31 3.128 17.666 5.395 1.00 0.00 H new ATOM 0 HA LYS B 31 1.266 16.891 7.305 1.00 0.00 H new ATOM 0 HB2 LYS B 31 2.463 18.238 8.823 1.00 0.00 H new ATOM 0 HB3 LYS B 31 3.610 17.504 7.720 1.00 0.00 H new ATOM 0 HG2 LYS B 31 3.819 19.642 6.474 1.00 0.00 H new ATOM 0 HG3 LYS B 31 2.617 20.385 7.511 1.00 0.00 H new ATOM 0 HD2 LYS B 31 4.121 19.771 9.514 1.00 0.00 H new ATOM 0 HD3 LYS B 31 5.352 19.307 8.357 1.00 0.00 H new ATOM 0 HE2 LYS B 31 5.152 21.648 7.336 1.00 0.00 H new ATOM 0 HE3 LYS B 31 4.099 22.075 8.670 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 6.369 22.709 9.108 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 5.871 21.519 10.212 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 6.892 21.105 8.920 1.00 0.00 H new ATOM 1930 N LYS B 32 0.591 19.801 5.925 1.00 0.00 N ATOM 1931 CA LYS B 32 -0.455 20.785 5.711 1.00 0.00 C ATOM 1932 C LYS B 32 -1.768 20.079 5.361 1.00 0.00 C ATOM 1933 O LYS B 32 -2.757 20.245 6.066 1.00 0.00 O ATOM 1934 CB LYS B 32 -0.041 21.791 4.626 1.00 0.00 C ATOM 1935 CG LYS B 32 1.324 22.436 4.912 1.00 0.00 C ATOM 1936 CD LYS B 32 1.599 23.541 3.884 1.00 0.00 C ATOM 1937 CE LYS B 32 3.043 24.052 3.967 1.00 0.00 C ATOM 1938 NZ LYS B 32 3.367 24.588 5.301 1.00 0.00 N ATOM 0 H LYS B 32 1.392 19.917 5.305 1.00 0.00 H new ATOM 0 HA LYS B 32 -0.610 21.350 6.630 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -0.005 21.286 3.661 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -0.799 22.571 4.550 1.00 0.00 H new ATOM 0 HG2 LYS B 32 1.337 22.852 5.919 1.00 0.00 H new ATOM 0 HG3 LYS B 32 2.110 21.682 4.869 1.00 0.00 H new ATOM 0 HD2 LYS B 32 1.406 23.160 2.881 1.00 0.00 H new ATOM 0 HD3 LYS B 32 0.910 24.370 4.049 1.00 0.00 H new ATOM 0 HE2 LYS B 32 3.729 23.239 3.727 1.00 0.00 H new ATOM 0 HE3 LYS B 32 3.195 24.829 3.218 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 4.309 25.029 5.279 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 2.658 25.300 5.571 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 3.363 23.815 5.996 1.00 0.00 H new ATOM 1952 N GLU B 33 -1.785 19.269 4.299 1.00 0.00 N ATOM 1953 CA GLU B 33 -2.989 18.541 3.898 1.00 0.00 C ATOM 1954 C GLU B 33 -3.514 17.651 5.035 1.00 0.00 C ATOM 1955 O GLU B 33 -4.718 17.600 5.289 1.00 0.00 O ATOM 1956 CB GLU B 33 -2.703 17.734 2.629 1.00 0.00 C ATOM 1957 CG GLU B 33 -2.514 18.665 1.420 1.00 0.00 C ATOM 1958 CD GLU B 33 -1.795 17.957 0.280 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -2.491 17.285 -0.508 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -0.550 18.073 0.249 1.00 0.00 O ATOM 0 H GLU B 33 -0.976 19.101 3.701 1.00 0.00 H new ATOM 0 HA GLU B 33 -3.778 19.260 3.679 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -1.807 17.129 2.771 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -3.526 17.045 2.438 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -3.486 19.018 1.075 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -1.944 19.544 1.721 1.00 0.00 H new ATOM 1967 N LEU B 34 -2.617 16.963 5.745 1.00 0.00 N ATOM 1968 CA LEU B 34 -3.000 16.199 6.927 1.00 0.00 C ATOM 1969 C LEU B 34 -3.677 17.112 7.964 1.00 0.00 C ATOM 1970 O LEU B 34 -4.738 16.777 8.488 1.00 0.00 O ATOM 1971 CB LEU B 34 -1.780 15.471 7.506 1.00 0.00 C ATOM 1972 CG LEU B 34 -1.537 14.070 6.919 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -1.486 14.020 5.387 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -0.214 13.535 7.479 1.00 0.00 C ATOM 0 H LEU B 34 -1.623 16.921 5.520 1.00 0.00 H new ATOM 0 HA LEU B 34 -3.729 15.440 6.642 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -0.893 16.082 7.335 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -1.904 15.383 8.585 1.00 0.00 H new ATOM 0 HG LEU B 34 -2.391 13.458 7.210 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -1.311 12.994 5.062 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -2.433 14.373 4.980 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -0.677 14.657 5.029 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -0.023 12.541 7.074 1.00 0.00 H new ATOM 0 HD22 LEU B 34 0.598 14.204 7.196 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -0.275 13.479 8.566 1.00 0.00 H new ATOM 1986 N LYS B 35 -3.106 18.285 8.251 1.00 0.00 N ATOM 1987 CA LYS B 35 -3.766 19.258 9.111 1.00 0.00 C ATOM 1988 C LYS B 35 -5.131 19.663 8.540 1.00 0.00 C ATOM 1989 O LYS B 35 -6.095 19.748 9.294 1.00 0.00 O ATOM 1990 CB LYS B 35 -2.867 20.467 9.403 1.00 0.00 C ATOM 1991 CG LYS B 35 -1.737 20.082 10.370 1.00 0.00 C ATOM 1992 CD LYS B 35 -0.870 21.283 10.773 1.00 0.00 C ATOM 1993 CE LYS B 35 -0.106 21.872 9.583 1.00 0.00 C ATOM 1994 NZ LYS B 35 0.854 22.901 10.021 1.00 0.00 N ATOM 0 H LYS B 35 -2.194 18.578 7.901 1.00 0.00 H new ATOM 0 HA LYS B 35 -3.952 18.780 10.073 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -2.443 20.845 8.472 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -3.461 21.273 9.833 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -2.167 19.633 11.265 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -1.107 19.324 9.904 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -1.503 22.054 11.214 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -0.161 20.975 11.541 1.00 0.00 H new ATOM 0 HE2 LYS B 35 0.424 21.077 9.058 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -0.811 22.307 8.874 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 1.356 23.282 9.194 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 0.344 23.670 10.500 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 1.540 22.478 10.678 1.00 0.00 H new ATOM 2008 N GLU B 36 -5.262 19.868 7.226 1.00 0.00 N ATOM 2009 CA GLU B 36 -6.575 20.120 6.641 1.00 0.00 C ATOM 2010 C GLU B 36 -7.556 19.000 7.006 1.00 0.00 C ATOM 2011 O GLU B 36 -8.687 19.293 7.384 1.00 0.00 O ATOM 2012 CB GLU B 36 -6.518 20.353 5.123 1.00 0.00 C ATOM 2013 CG GLU B 36 -5.652 21.556 4.719 1.00 0.00 C ATOM 2014 CD GLU B 36 -6.095 22.849 5.396 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -7.207 23.311 5.059 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -5.322 23.344 6.245 1.00 0.00 O ATOM 0 H GLU B 36 -4.489 19.864 6.561 1.00 0.00 H new ATOM 0 HA GLU B 36 -6.943 21.051 7.073 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -6.128 19.457 4.640 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -7.531 20.502 4.748 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -4.612 21.353 4.975 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -5.695 21.683 3.637 1.00 0.00 H new ATOM 2023 N LEU B 37 -7.142 17.727 6.946 1.00 0.00 N ATOM 2024 CA LEU B 37 -7.991 16.645 7.446 1.00 0.00 C ATOM 2025 C LEU B 37 -8.367 16.872 8.917 1.00 0.00 C ATOM 2026 O LEU B 37 -9.551 16.813 9.252 1.00 0.00 O ATOM 2027 CB LEU B 37 -7.363 15.260 7.217 1.00 0.00 C ATOM 2028 CG LEU B 37 -8.174 14.106 7.845 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -9.551 13.922 7.196 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -7.383 12.800 7.709 1.00 0.00 C ATOM 0 H LEU B 37 -6.244 17.428 6.565 1.00 0.00 H new ATOM 0 HA LEU B 37 -8.914 16.662 6.866 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -7.268 15.086 6.145 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -6.355 15.253 7.632 1.00 0.00 H new ATOM 0 HG LEU B 37 -8.337 14.362 8.892 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -10.074 13.097 7.679 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -10.132 14.837 7.311 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -9.427 13.702 6.136 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -7.952 11.982 8.151 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -7.206 12.590 6.654 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -6.428 12.898 8.225 1.00 0.00 H new ATOM 2042 N ILE B 38 -7.398 17.119 9.808 1.00 0.00 N ATOM 2043 CA ILE B 38 -7.746 17.276 11.226 1.00 0.00 C ATOM 2044 C ILE B 38 -8.728 18.437 11.425 1.00 0.00 C ATOM 2045 O ILE B 38 -9.693 18.312 12.173 1.00 0.00 O ATOM 2046 CB ILE B 38 -6.537 17.316 12.189 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -5.975 18.718 12.486 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -5.448 16.336 11.745 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -4.812 18.691 13.482 1.00 0.00 C ATOM 0 H ILE B 38 -6.407 17.211 9.586 1.00 0.00 H new ATOM 0 HA ILE B 38 -8.260 16.359 11.515 1.00 0.00 H new ATOM 0 HB ILE B 38 -6.931 16.989 13.151 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -5.640 19.175 11.555 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -6.772 19.348 12.881 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -4.610 16.385 12.440 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -5.852 15.324 11.734 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -5.106 16.601 10.745 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -4.456 19.707 13.653 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -5.150 18.261 14.425 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -4.001 18.086 13.078 1.00 0.00 H new ATOM 2061 N GLN B 39 -8.514 19.557 10.727 1.00 0.00 N ATOM 2062 CA GLN B 39 -9.413 20.702 10.781 1.00 0.00 C ATOM 2063 C GLN B 39 -10.777 20.380 10.161 1.00 0.00 C ATOM 2064 O GLN B 39 -11.791 20.883 10.634 1.00 0.00 O ATOM 2065 CB GLN B 39 -8.770 21.926 10.113 1.00 0.00 C ATOM 2066 CG GLN B 39 -7.491 22.402 10.822 1.00 0.00 C ATOM 2067 CD GLN B 39 -7.685 22.661 12.314 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -6.947 22.136 13.140 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -8.678 23.467 12.678 1.00 0.00 N ATOM 0 H GLN B 39 -7.712 19.690 10.111 1.00 0.00 H new ATOM 0 HA GLN B 39 -9.588 20.940 11.830 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -8.534 21.684 9.077 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -9.492 22.742 10.094 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -6.711 21.653 10.689 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -7.139 23.317 10.345 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -9.277 23.891 11.969 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -8.841 23.662 13.666 1.00 0.00 H new ATOM 2078 N LYS B 40 -10.822 19.536 9.127 1.00 0.00 N ATOM 2079 CA LYS B 40 -12.071 19.057 8.554 1.00 0.00 C ATOM 2080 C LYS B 40 -12.847 18.248 9.598 1.00 0.00 C ATOM 2081 O LYS B 40 -14.045 18.456 9.770 1.00 0.00 O ATOM 2082 CB LYS B 40 -11.776 18.258 7.278 1.00 0.00 C ATOM 2083 CG LYS B 40 -13.038 17.918 6.477 1.00 0.00 C ATOM 2084 CD LYS B 40 -12.709 17.044 5.258 1.00 0.00 C ATOM 2085 CE LYS B 40 -11.814 17.769 4.244 1.00 0.00 C ATOM 2086 NZ LYS B 40 -11.586 16.945 3.045 1.00 0.00 N ATOM 0 H LYS B 40 -9.989 19.168 8.667 1.00 0.00 H new ATOM 0 HA LYS B 40 -12.705 19.897 8.270 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -11.096 18.830 6.647 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -11.262 17.334 7.545 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -13.749 17.397 7.119 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -13.521 18.838 6.147 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -12.212 16.133 5.591 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -13.636 16.742 4.770 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -12.277 18.713 3.956 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -10.858 18.012 4.708 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -11.283 17.554 2.258 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -10.847 16.241 3.243 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -12.467 16.458 2.786 1.00 0.00 H new ATOM 2337 N LEU B 56 -0.817 8.787 15.152 1.00 0.00 N ATOM 2338 CA LEU B 56 0.117 7.851 14.553 1.00 0.00 C ATOM 2339 C LEU B 56 0.822 8.501 13.366 1.00 0.00 C ATOM 2340 O LEU B 56 2.047 8.580 13.347 1.00 0.00 O ATOM 2341 CB LEU B 56 -0.633 6.569 14.161 1.00 0.00 C ATOM 2342 CG LEU B 56 0.238 5.501 13.484 1.00 0.00 C ATOM 2343 CD1 LEU B 56 1.421 5.080 14.360 1.00 0.00 C ATOM 2344 CD2 LEU B 56 -0.636 4.275 13.196 1.00 0.00 C ATOM 0 HA LEU B 56 0.891 7.578 15.270 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -1.083 6.139 15.056 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -1.450 6.833 13.489 1.00 0.00 H new ATOM 0 HG LEU B 56 0.644 5.923 12.565 1.00 0.00 H new ATOM 0 HD11 LEU B 56 2.008 4.323 13.839 1.00 0.00 H new ATOM 0 HD12 LEU B 56 2.048 5.947 14.566 1.00 0.00 H new ATOM 0 HD13 LEU B 56 1.050 4.669 15.299 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -0.034 3.504 12.714 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -1.040 3.888 14.132 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -1.456 4.560 12.537 1.00 0.00 H new ATOM 2356 N MET B 57 0.063 8.982 12.379 1.00 0.00 N ATOM 2357 CA MET B 57 0.617 9.564 11.164 1.00 0.00 C ATOM 2358 C MET B 57 1.436 10.818 11.481 1.00 0.00 C ATOM 2359 O MET B 57 2.481 11.055 10.872 1.00 0.00 O ATOM 2360 CB MET B 57 -0.519 9.846 10.173 1.00 0.00 C ATOM 2361 CG MET B 57 -0.018 9.862 8.725 1.00 0.00 C ATOM 2362 SD MET B 57 -1.343 9.944 7.493 1.00 0.00 S ATOM 2363 CE MET B 57 -0.388 9.635 5.993 1.00 0.00 C ATOM 0 H MET B 57 -0.957 8.977 12.404 1.00 0.00 H new ATOM 0 HA MET B 57 1.304 8.856 10.701 1.00 0.00 H new ATOM 0 HB2 MET B 57 -1.293 9.087 10.282 1.00 0.00 H new ATOM 0 HB3 MET B 57 -0.978 10.806 10.410 1.00 0.00 H new ATOM 0 HG2 MET B 57 0.645 10.717 8.589 1.00 0.00 H new ATOM 0 HG3 MET B 57 0.576 8.966 8.546 1.00 0.00 H new ATOM 0 HE1 MET B 57 -1.052 9.650 5.129 1.00 0.00 H new ATOM 0 HE2 MET B 57 0.372 10.408 5.880 1.00 0.00 H new ATOM 0 HE3 MET B 57 0.094 8.660 6.063 1.00 0.00 H new ATOM 2373 N ASP B 58 0.972 11.621 12.444 1.00 0.00 N ATOM 2374 CA ASP B 58 1.716 12.769 12.936 1.00 0.00 C ATOM 2375 C ASP B 58 3.086 12.332 13.439 1.00 0.00 C ATOM 2376 O ASP B 58 4.106 12.757 12.893 1.00 0.00 O ATOM 2377 CB ASP B 58 0.914 13.513 14.013 1.00 0.00 C ATOM 2378 CG ASP B 58 1.683 14.701 14.583 1.00 0.00 C ATOM 2379 OD1 ASP B 58 1.586 15.788 13.977 1.00 0.00 O ATOM 2380 OD2 ASP B 58 2.358 14.501 15.617 1.00 0.00 O ATOM 0 H ASP B 58 0.069 11.487 12.900 1.00 0.00 H new ATOM 0 HA ASP B 58 1.876 13.469 12.116 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -0.027 13.861 13.588 1.00 0.00 H new ATOM 0 HB3 ASP B 58 0.664 12.823 14.819 1.00 0.00 H new ATOM 2385 N ASP B 59 3.103 11.504 14.484 1.00 0.00 N ATOM 2386 CA ASP B 59 4.325 11.086 15.157 1.00 0.00 C ATOM 2387 C ASP B 59 5.251 10.374 14.173 1.00 0.00 C ATOM 2388 O ASP B 59 6.432 10.694 14.074 1.00 0.00 O ATOM 2389 CB ASP B 59 3.988 10.169 16.344 1.00 0.00 C ATOM 2390 CG ASP B 59 3.205 10.864 17.458 1.00 0.00 C ATOM 2391 OD1 ASP B 59 3.365 12.094 17.606 1.00 0.00 O ATOM 2392 OD2 ASP B 59 2.469 10.142 18.167 1.00 0.00 O ATOM 0 H ASP B 59 2.257 11.102 14.889 1.00 0.00 H new ATOM 0 HA ASP B 59 4.839 11.969 15.537 1.00 0.00 H new ATOM 0 HB2 ASP B 59 3.409 9.319 15.982 1.00 0.00 H new ATOM 0 HB3 ASP B 59 4.914 9.771 16.758 1.00 0.00 H new ATOM 2397 N LEU B 60 4.705 9.389 13.460 1.00 0.00 N ATOM 2398 CA LEU B 60 5.454 8.528 12.561 1.00 0.00 C ATOM 2399 C LEU B 60 5.987 9.311 11.364 1.00 0.00 C ATOM 2400 O LEU B 60 7.146 9.130 10.996 1.00 0.00 O ATOM 2401 CB LEU B 60 4.558 7.362 12.116 1.00 0.00 C ATOM 2402 CG LEU B 60 5.222 6.358 11.158 1.00 0.00 C ATOM 2403 CD1 LEU B 60 6.491 5.728 11.742 1.00 0.00 C ATOM 2404 CD2 LEU B 60 4.215 5.246 10.845 1.00 0.00 C ATOM 0 H LEU B 60 3.710 9.167 13.496 1.00 0.00 H new ATOM 0 HA LEU B 60 6.321 8.127 13.087 1.00 0.00 H new ATOM 0 HB2 LEU B 60 4.219 6.825 13.002 1.00 0.00 H new ATOM 0 HB3 LEU B 60 3.671 7.770 11.632 1.00 0.00 H new ATOM 0 HG LEU B 60 5.515 6.902 10.260 1.00 0.00 H new ATOM 0 HD11 LEU B 60 6.915 5.029 11.021 1.00 0.00 H new ATOM 0 HD12 LEU B 60 7.218 6.510 11.960 1.00 0.00 H new ATOM 0 HD13 LEU B 60 6.244 5.196 12.661 1.00 0.00 H new ATOM 0 HD21 LEU B 60 4.669 4.524 10.166 1.00 0.00 H new ATOM 0 HD22 LEU B 60 3.928 4.744 11.769 1.00 0.00 H new ATOM 0 HD23 LEU B 60 3.330 5.678 10.377 1.00 0.00 H new ATOM 2416 N ASP B 61 5.144 10.137 10.730 1.00 0.00 N ATOM 2417 CA ASP B 61 5.474 10.754 9.452 1.00 0.00 C ATOM 2418 C ASP B 61 5.516 12.272 9.530 1.00 0.00 C ATOM 2419 O ASP B 61 6.586 12.866 9.406 1.00 0.00 O ATOM 2420 CB ASP B 61 4.504 10.290 8.350 1.00 0.00 C ATOM 2421 CG ASP B 61 4.440 8.772 8.217 1.00 0.00 C ATOM 2422 OD1 ASP B 61 5.342 8.216 7.556 1.00 0.00 O ATOM 2423 OD2 ASP B 61 3.480 8.195 8.774 1.00 0.00 O ATOM 0 H ASP B 61 4.224 10.390 11.090 1.00 0.00 H new ATOM 0 HA ASP B 61 6.480 10.422 9.194 1.00 0.00 H new ATOM 0 HB2 ASP B 61 3.507 10.673 8.566 1.00 0.00 H new ATOM 0 HB3 ASP B 61 4.812 10.721 7.397 1.00 0.00 H new ATOM 2428 N ARG B 62 4.356 12.908 9.713 1.00 0.00 N ATOM 2429 CA ARG B 62 4.213 14.354 9.534 1.00 0.00 C ATOM 2430 C ARG B 62 5.172 15.185 10.396 1.00 0.00 C ATOM 2431 O ARG B 62 5.474 16.321 10.038 1.00 0.00 O ATOM 2432 CB ARG B 62 2.732 14.779 9.608 1.00 0.00 C ATOM 2433 CG ARG B 62 2.398 15.815 10.694 1.00 0.00 C ATOM 2434 CD ARG B 62 0.905 16.174 10.708 1.00 0.00 C ATOM 2435 NE ARG B 62 0.054 15.005 10.966 1.00 0.00 N ATOM 2436 CZ ARG B 62 -1.269 15.043 11.160 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -1.929 16.204 11.072 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -1.927 13.911 11.430 1.00 0.00 N ATOM 0 H ARG B 62 3.494 12.437 9.988 1.00 0.00 H new ATOM 0 HA ARG B 62 4.541 14.590 8.522 1.00 0.00 H new ATOM 0 HB2 ARG B 62 2.439 15.185 8.640 1.00 0.00 H new ATOM 0 HB3 ARG B 62 2.124 13.890 9.778 1.00 0.00 H new ATOM 0 HG2 ARG B 62 2.686 15.423 11.670 1.00 0.00 H new ATOM 0 HG3 ARG B 62 2.986 16.717 10.527 1.00 0.00 H new ATOM 0 HD2 ARG B 62 0.722 16.930 11.472 1.00 0.00 H new ATOM 0 HD3 ARG B 62 0.631 16.616 9.750 1.00 0.00 H new ATOM 0 HE ARG B 62 0.508 14.092 11.000 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -1.423 17.063 10.856 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -2.938 16.230 11.220 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -1.420 13.028 11.487 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -2.936 13.931 11.579 1.00 0.00 H new ATOM 2452 N ASN B 63 5.674 14.629 11.505 1.00 0.00 N ATOM 2453 CA ASN B 63 6.689 15.301 12.320 1.00 0.00 C ATOM 2454 C ASN B 63 7.916 15.685 11.489 1.00 0.00 C ATOM 2455 O ASN B 63 8.507 16.735 11.726 1.00 0.00 O ATOM 2456 CB ASN B 63 7.118 14.435 13.518 1.00 0.00 C ATOM 2457 CG ASN B 63 6.339 14.791 14.779 1.00 0.00 C ATOM 2458 OD1 ASN B 63 6.902 15.256 15.765 1.00 0.00 O ATOM 2459 ND2 ASN B 63 5.031 14.585 14.744 1.00 0.00 N ATOM 0 H ASN B 63 5.392 13.714 11.858 1.00 0.00 H new ATOM 0 HA ASN B 63 6.230 16.214 12.700 1.00 0.00 H new ATOM 0 HB2 ASN B 63 6.964 13.383 13.280 1.00 0.00 H new ATOM 0 HB3 ASN B 63 8.185 14.568 13.700 1.00 0.00 H new ATOM 0 HD21 ASN B 63 4.457 14.815 15.555 1.00 0.00 H new ATOM 0 HD22 ASN B 63 4.598 14.197 13.906 1.00 0.00 H new ATOM 2466 N LYS B 64 8.313 14.825 10.546 1.00 0.00 N ATOM 2467 CA LYS B 64 9.506 15.007 9.725 1.00 0.00 C ATOM 2468 C LYS B 64 9.148 15.214 8.254 1.00 0.00 C ATOM 2469 O LYS B 64 9.680 16.094 7.578 1.00 0.00 O ATOM 2470 CB LYS B 64 10.486 13.841 9.946 1.00 0.00 C ATOM 2471 CG LYS B 64 9.843 12.446 9.884 1.00 0.00 C ATOM 2472 CD LYS B 64 10.908 11.360 10.077 1.00 0.00 C ATOM 2473 CE LYS B 64 10.265 9.977 10.238 1.00 0.00 C ATOM 2474 NZ LYS B 64 9.515 9.562 9.038 1.00 0.00 N ATOM 0 H LYS B 64 7.803 13.969 10.331 1.00 0.00 H new ATOM 0 HA LYS B 64 10.013 15.920 10.039 1.00 0.00 H new ATOM 0 HB2 LYS B 64 11.273 13.898 9.194 1.00 0.00 H new ATOM 0 HB3 LYS B 64 10.964 13.964 10.918 1.00 0.00 H new ATOM 0 HG2 LYS B 64 9.078 12.356 10.655 1.00 0.00 H new ATOM 0 HG3 LYS B 64 9.345 12.310 8.924 1.00 0.00 H new ATOM 0 HD2 LYS B 64 11.583 11.353 9.222 1.00 0.00 H new ATOM 0 HD3 LYS B 64 11.510 11.589 10.956 1.00 0.00 H new ATOM 0 HE2 LYS B 64 11.041 9.241 10.451 1.00 0.00 H new ATOM 0 HE3 LYS B 64 9.593 9.989 11.096 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 9.085 8.629 9.202 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 8.768 10.257 8.838 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 10.162 9.507 8.226 1.00 0.00 H new ATOM 2488 N ASP B 65 8.234 14.390 7.757 1.00 0.00 N ATOM 2489 CA ASP B 65 7.825 14.364 6.364 1.00 0.00 C ATOM 2490 C ASP B 65 6.886 15.535 6.092 1.00 0.00 C ATOM 2491 O ASP B 65 5.677 15.360 5.970 1.00 0.00 O ATOM 2492 CB ASP B 65 7.187 13.013 6.028 1.00 0.00 C ATOM 2493 CG ASP B 65 8.167 11.864 6.234 1.00 0.00 C ATOM 2494 OD1 ASP B 65 9.180 11.834 5.502 1.00 0.00 O ATOM 2495 OD2 ASP B 65 7.893 11.039 7.132 1.00 0.00 O ATOM 0 H ASP B 65 7.745 13.703 8.331 1.00 0.00 H new ATOM 0 HA ASP B 65 8.693 14.476 5.714 1.00 0.00 H new ATOM 0 HB2 ASP B 65 6.308 12.859 6.654 1.00 0.00 H new ATOM 0 HB3 ASP B 65 6.844 13.019 4.993 1.00 0.00 H new ATOM 2500 N GLN B 66 7.468 16.734 5.991 1.00 0.00 N ATOM 2501 CA GLN B 66 6.786 17.964 5.608 1.00 0.00 C ATOM 2502 C GLN B 66 5.872 17.702 4.410 1.00 0.00 C ATOM 2503 O GLN B 66 4.684 18.026 4.427 1.00 0.00 O ATOM 2504 CB GLN B 66 7.852 19.039 5.319 1.00 0.00 C ATOM 2505 CG GLN B 66 7.328 20.480 5.260 1.00 0.00 C ATOM 2506 CD GLN B 66 6.255 20.725 4.203 1.00 0.00 C ATOM 2507 OE1 GLN B 66 5.163 21.185 4.523 1.00 0.00 O ATOM 2508 NE2 GLN B 66 6.541 20.422 2.939 1.00 0.00 N ATOM 0 H GLN B 66 8.460 16.875 6.181 1.00 0.00 H new ATOM 0 HA GLN B 66 6.147 18.325 6.414 1.00 0.00 H new ATOM 0 HB2 GLN B 66 8.622 18.981 6.089 1.00 0.00 H new ATOM 0 HB3 GLN B 66 8.333 18.805 4.369 1.00 0.00 H new ATOM 0 HG2 GLN B 66 6.924 20.746 6.237 1.00 0.00 H new ATOM 0 HG3 GLN B 66 8.167 21.150 5.069 1.00 0.00 H new ATOM 0 HE21 GLN B 66 7.457 20.041 2.701 1.00 0.00 H new ATOM 0 HE22 GLN B 66 5.845 20.571 2.209 1.00 0.00 H new ATOM 2517 N GLU B 67 6.465 17.090 3.390 1.00 0.00 N ATOM 2518 CA GLU B 67 5.810 16.532 2.228 1.00 0.00 C ATOM 2519 C GLU B 67 5.833 15.016 2.417 1.00 0.00 C ATOM 2520 O GLU B 67 6.887 14.437 2.668 1.00 0.00 O ATOM 2521 CB GLU B 67 6.463 17.012 0.917 1.00 0.00 C ATOM 2522 CG GLU B 67 7.989 16.842 0.809 1.00 0.00 C ATOM 2523 CD GLU B 67 8.755 17.726 1.789 1.00 0.00 C ATOM 2524 OE1 GLU B 67 8.613 18.966 1.681 1.00 0.00 O ATOM 2525 OE2 GLU B 67 9.421 17.145 2.673 1.00 0.00 O ATOM 0 H GLU B 67 7.477 16.967 3.358 1.00 0.00 H new ATOM 0 HA GLU B 67 4.779 16.873 2.139 1.00 0.00 H new ATOM 0 HB2 GLU B 67 6.000 16.475 0.089 1.00 0.00 H new ATOM 0 HB3 GLU B 67 6.227 18.068 0.785 1.00 0.00 H new ATOM 0 HG2 GLU B 67 8.247 15.799 0.990 1.00 0.00 H new ATOM 0 HG3 GLU B 67 8.305 17.077 -0.208 1.00 0.00 H new ATOM 2532 N VAL B 68 4.658 14.399 2.353 1.00 0.00 N ATOM 2533 CA VAL B 68 4.436 12.975 2.515 1.00 0.00 C ATOM 2534 C VAL B 68 4.228 12.398 1.115 1.00 0.00 C ATOM 2535 O VAL B 68 3.267 12.749 0.433 1.00 0.00 O ATOM 2536 CB VAL B 68 3.213 12.744 3.421 1.00 0.00 C ATOM 2537 CG1 VAL B 68 2.924 11.247 3.597 1.00 0.00 C ATOM 2538 CG2 VAL B 68 3.407 13.377 4.804 1.00 0.00 C ATOM 0 H VAL B 68 3.793 14.909 2.177 1.00 0.00 H new ATOM 0 HA VAL B 68 5.282 12.481 2.993 1.00 0.00 H new ATOM 0 HB VAL B 68 2.367 13.221 2.926 1.00 0.00 H new ATOM 0 HG11 VAL B 68 2.055 11.118 4.242 1.00 0.00 H new ATOM 0 HG12 VAL B 68 2.724 10.798 2.624 1.00 0.00 H new ATOM 0 HG13 VAL B 68 3.788 10.761 4.050 1.00 0.00 H new ATOM 0 HG21 VAL B 68 2.524 13.193 5.415 1.00 0.00 H new ATOM 0 HG22 VAL B 68 4.280 12.937 5.286 1.00 0.00 H new ATOM 0 HG23 VAL B 68 3.556 14.451 4.695 1.00 0.00 H new ATOM 2548 N ASN B 69 5.109 11.505 0.669 1.00 0.00 N ATOM 2549 CA ASN B 69 5.102 11.047 -0.713 1.00 0.00 C ATOM 2550 C ASN B 69 4.193 9.824 -0.842 1.00 0.00 C ATOM 2551 O ASN B 69 3.944 9.117 0.133 1.00 0.00 O ATOM 2552 CB ASN B 69 6.538 10.695 -1.126 1.00 0.00 C ATOM 2553 CG ASN B 69 6.611 10.258 -2.586 1.00 0.00 C ATOM 2554 OD1 ASN B 69 6.432 9.086 -2.900 1.00 0.00 O ATOM 2555 ND2 ASN B 69 6.831 11.198 -3.500 1.00 0.00 N ATOM 0 H ASN B 69 5.837 11.085 1.248 1.00 0.00 H new ATOM 0 HA ASN B 69 4.722 11.832 -1.367 1.00 0.00 H new ATOM 0 HB2 ASN B 69 7.184 11.559 -0.972 1.00 0.00 H new ATOM 0 HB3 ASN B 69 6.916 9.897 -0.487 1.00 0.00 H new ATOM 0 HD21 ASN B 69 6.854 10.952 -4.490 1.00 0.00 H new ATOM 0 HD22 ASN B 69 6.977 12.165 -3.212 1.00 0.00 H new ATOM 2562 N PHE B 70 3.688 9.564 -2.050 1.00 0.00 N ATOM 2563 CA PHE B 70 2.879 8.382 -2.329 1.00 0.00 C ATOM 2564 C PHE B 70 3.522 7.100 -1.778 1.00 0.00 C ATOM 2565 O PHE B 70 2.847 6.283 -1.156 1.00 0.00 O ATOM 2566 CB PHE B 70 2.610 8.267 -3.831 1.00 0.00 C ATOM 2567 CG PHE B 70 1.548 7.240 -4.164 1.00 0.00 C ATOM 2568 CD1 PHE B 70 0.205 7.518 -3.860 1.00 0.00 C ATOM 2569 CD2 PHE B 70 1.890 6.005 -4.743 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -0.803 6.598 -4.183 1.00 0.00 C ATOM 2571 CE2 PHE B 70 0.881 5.083 -5.074 1.00 0.00 C ATOM 2572 CZ PHE B 70 -0.464 5.381 -4.792 1.00 0.00 C ATOM 0 H PHE B 70 3.830 10.168 -2.860 1.00 0.00 H new ATOM 0 HA PHE B 70 1.926 8.501 -1.813 1.00 0.00 H new ATOM 0 HB2 PHE B 70 2.301 9.239 -4.215 1.00 0.00 H new ATOM 0 HB3 PHE B 70 3.536 8.003 -4.341 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -0.053 8.447 -3.374 1.00 0.00 H new ATOM 0 HD2 PHE B 70 2.926 5.765 -4.933 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -1.836 6.826 -3.964 1.00 0.00 H new ATOM 0 HE2 PHE B 70 1.139 4.146 -5.545 1.00 0.00 H new ATOM 0 HZ PHE B 70 -1.238 4.671 -5.045 1.00 0.00 H new ATOM 2582 N GLN B 71 4.840 6.945 -1.946 1.00 0.00 N ATOM 2583 CA GLN B 71 5.595 5.860 -1.326 1.00 0.00 C ATOM 2584 C GLN B 71 5.270 5.749 0.165 1.00 0.00 C ATOM 2585 O GLN B 71 5.015 4.654 0.663 1.00 0.00 O ATOM 2586 CB GLN B 71 7.098 6.079 -1.568 1.00 0.00 C ATOM 2587 CG GLN B 71 8.001 5.102 -0.790 1.00 0.00 C ATOM 2588 CD GLN B 71 8.346 5.606 0.613 1.00 0.00 C ATOM 2589 OE1 GLN B 71 8.864 6.707 0.766 1.00 0.00 O ATOM 2590 NE2 GLN B 71 8.066 4.831 1.658 1.00 0.00 N ATOM 0 H GLN B 71 5.410 7.570 -2.516 1.00 0.00 H new ATOM 0 HA GLN B 71 5.307 4.913 -1.783 1.00 0.00 H new ATOM 0 HB2 GLN B 71 7.303 5.979 -2.634 1.00 0.00 H new ATOM 0 HB3 GLN B 71 7.357 7.100 -1.288 1.00 0.00 H new ATOM 0 HG2 GLN B 71 7.502 4.136 -0.712 1.00 0.00 H new ATOM 0 HG3 GLN B 71 8.922 4.941 -1.350 1.00 0.00 H new ATOM 0 HE21 GLN B 71 7.635 3.918 1.515 1.00 0.00 H new ATOM 0 HE22 GLN B 71 8.282 5.150 2.602 1.00 0.00 H new ATOM 2599 N GLU B 72 5.286 6.874 0.880 1.00 0.00 N ATOM 2600 CA GLU B 72 5.000 6.900 2.302 1.00 0.00 C ATOM 2601 C GLU B 72 3.546 6.519 2.551 1.00 0.00 C ATOM 2602 O GLU B 72 3.280 5.776 3.485 1.00 0.00 O ATOM 2603 CB GLU B 72 5.298 8.273 2.903 1.00 0.00 C ATOM 2604 CG GLU B 72 6.759 8.691 2.712 1.00 0.00 C ATOM 2605 CD GLU B 72 6.936 10.136 3.149 1.00 0.00 C ATOM 2606 OE1 GLU B 72 6.563 10.424 4.305 1.00 0.00 O ATOM 2607 OE2 GLU B 72 7.358 10.939 2.289 1.00 0.00 O ATOM 0 H GLU B 72 5.498 7.789 0.483 1.00 0.00 H new ATOM 0 HA GLU B 72 5.648 6.173 2.790 1.00 0.00 H new ATOM 0 HB2 GLU B 72 4.647 9.017 2.443 1.00 0.00 H new ATOM 0 HB3 GLU B 72 5.063 8.259 3.967 1.00 0.00 H new ATOM 0 HG2 GLU B 72 7.413 8.042 3.294 1.00 0.00 H new ATOM 0 HG3 GLU B 72 7.047 8.579 1.667 1.00 0.00 H new ATOM 2614 N TYR B 73 2.603 7.001 1.733 1.00 0.00 N ATOM 2615 CA TYR B 73 1.201 6.605 1.861 1.00 0.00 C ATOM 2616 C TYR B 73 1.075 5.080 1.781 1.00 0.00 C ATOM 2617 O TYR B 73 0.499 4.444 2.664 1.00 0.00 O ATOM 2618 CB TYR B 73 0.367 7.319 0.793 1.00 0.00 C ATOM 2619 CG TYR B 73 -1.114 6.989 0.764 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -1.977 7.593 1.697 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -1.656 6.284 -0.330 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -3.368 7.561 1.494 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -3.046 6.275 -0.544 1.00 0.00 C ATOM 2624 CZ TYR B 73 -3.902 6.931 0.357 1.00 0.00 C ATOM 2625 OH TYR B 73 -5.231 7.059 0.084 1.00 0.00 O ATOM 0 H TYR B 73 2.787 7.663 0.979 1.00 0.00 H new ATOM 0 HA TYR B 73 0.815 6.906 2.835 1.00 0.00 H new ATOM 0 HB2 TYR B 73 0.475 8.394 0.937 1.00 0.00 H new ATOM 0 HB3 TYR B 73 0.789 7.084 -0.184 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -1.570 8.082 2.570 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -1.003 5.750 -1.005 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -4.028 8.022 2.214 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -3.456 5.763 -1.402 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.382 6.927 -0.875 1.00 0.00 H new ATOM 2635 N ILE B 74 1.661 4.483 0.743 1.00 0.00 N ATOM 2636 CA ILE B 74 1.668 3.037 0.573 1.00 0.00 C ATOM 2637 C ILE B 74 2.322 2.349 1.778 1.00 0.00 C ATOM 2638 O ILE B 74 1.751 1.439 2.378 1.00 0.00 O ATOM 2639 CB ILE B 74 2.385 2.674 -0.738 1.00 0.00 C ATOM 2640 CG1 ILE B 74 1.678 3.218 -1.991 1.00 0.00 C ATOM 2641 CG2 ILE B 74 2.540 1.157 -0.845 1.00 0.00 C ATOM 2642 CD1 ILE B 74 0.283 2.631 -2.238 1.00 0.00 C ATOM 0 H ILE B 74 2.142 4.990 0.000 1.00 0.00 H new ATOM 0 HA ILE B 74 0.640 2.680 0.515 1.00 0.00 H new ATOM 0 HB ILE B 74 3.364 3.152 -0.700 1.00 0.00 H new ATOM 0 HG12 ILE B 74 1.592 4.301 -1.903 1.00 0.00 H new ATOM 0 HG13 ILE B 74 2.303 3.017 -2.861 1.00 0.00 H new ATOM 0 HG21 ILE B 74 3.049 0.908 -1.776 1.00 0.00 H new ATOM 0 HG22 ILE B 74 3.126 0.791 -0.002 1.00 0.00 H new ATOM 0 HG23 ILE B 74 1.556 0.689 -0.833 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -0.142 3.070 -3.141 1.00 0.00 H new ATOM 0 HD12 ILE B 74 0.359 1.551 -2.361 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -0.362 2.855 -1.388 1.00 0.00 H new ATOM 2654 N THR B 75 3.538 2.764 2.129 1.00 0.00 N ATOM 2655 CA THR B 75 4.299 2.117 3.192 1.00 0.00 C ATOM 2656 C THR B 75 3.556 2.251 4.526 1.00 0.00 C ATOM 2657 O THR B 75 3.534 1.318 5.322 1.00 0.00 O ATOM 2658 CB THR B 75 5.726 2.687 3.243 1.00 0.00 C ATOM 2659 OG1 THR B 75 6.310 2.659 1.952 1.00 0.00 O ATOM 2660 CG2 THR B 75 6.624 1.866 4.174 1.00 0.00 C ATOM 0 H THR B 75 4.018 3.549 1.689 1.00 0.00 H new ATOM 0 HA THR B 75 4.392 1.051 2.985 1.00 0.00 H new ATOM 0 HB THR B 75 5.649 3.709 3.614 1.00 0.00 H new ATOM 0 HG1 THR B 75 5.860 3.311 1.375 1.00 0.00 H new ATOM 0 HG21 THR B 75 7.625 2.296 4.187 1.00 0.00 H new ATOM 0 HG22 THR B 75 6.211 1.879 5.183 1.00 0.00 H new ATOM 0 HG23 THR B 75 6.676 0.838 3.816 1.00 0.00 H new ATOM 2668 N PHE B 76 2.910 3.397 4.750 1.00 0.00 N ATOM 2669 CA PHE B 76 2.038 3.653 5.885 1.00 0.00 C ATOM 2670 C PHE B 76 0.861 2.677 5.869 1.00 0.00 C ATOM 2671 O PHE B 76 0.542 2.094 6.903 1.00 0.00 O ATOM 2672 CB PHE B 76 1.581 5.117 5.861 1.00 0.00 C ATOM 2673 CG PHE B 76 0.631 5.515 6.972 1.00 0.00 C ATOM 2674 CD1 PHE B 76 1.144 5.860 8.234 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -0.753 5.602 6.730 1.00 0.00 C ATOM 2676 CE1 PHE B 76 0.279 6.289 9.254 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -1.617 6.051 7.745 1.00 0.00 C ATOM 2678 CZ PHE B 76 -1.100 6.398 9.006 1.00 0.00 C ATOM 0 H PHE B 76 2.986 4.196 4.121 1.00 0.00 H new ATOM 0 HA PHE B 76 2.579 3.491 6.817 1.00 0.00 H new ATOM 0 HB2 PHE B 76 2.462 5.757 5.912 1.00 0.00 H new ATOM 0 HB3 PHE B 76 1.098 5.315 4.904 1.00 0.00 H new ATOM 0 HD1 PHE B 76 2.206 5.795 8.420 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -1.151 5.324 5.765 1.00 0.00 H new ATOM 0 HE1 PHE B 76 0.674 6.535 10.229 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -2.677 6.129 7.556 1.00 0.00 H new ATOM 0 HZ PHE B 76 -1.763 6.748 9.784 1.00 0.00 H new ATOM 2688 N LEU B 77 0.242 2.450 4.701 1.00 0.00 N ATOM 2689 CA LEU B 77 -0.794 1.427 4.570 1.00 0.00 C ATOM 2690 C LEU B 77 -0.232 0.101 5.094 1.00 0.00 C ATOM 2691 O LEU B 77 -0.832 -0.550 5.951 1.00 0.00 O ATOM 2692 CB LEU B 77 -1.243 1.307 3.102 1.00 0.00 C ATOM 2693 CG LEU B 77 -2.706 0.872 2.931 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -2.967 0.594 1.448 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -3.075 -0.381 3.734 1.00 0.00 C ATOM 0 H LEU B 77 0.443 2.960 3.841 1.00 0.00 H new ATOM 0 HA LEU B 77 -1.672 1.700 5.155 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -1.100 2.269 2.609 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -0.599 0.590 2.593 1.00 0.00 H new ATOM 0 HG LEU B 77 -3.323 1.687 3.311 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -4.003 0.284 1.313 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -2.781 1.499 0.870 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -2.303 -0.199 1.104 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -4.123 -0.627 3.563 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -2.450 -1.215 3.415 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -2.915 -0.193 4.796 1.00 0.00 H new ATOM 2707 N GLY B 78 0.958 -0.258 4.604 1.00 0.00 N ATOM 2708 CA GLY B 78 1.729 -1.388 5.095 1.00 0.00 C ATOM 2709 C GLY B 78 1.809 -1.401 6.621 1.00 0.00 C ATOM 2710 O GLY B 78 1.379 -2.363 7.251 1.00 0.00 O ATOM 0 H GLY B 78 1.415 0.242 3.841 1.00 0.00 H new ATOM 0 HA2 GLY B 78 1.275 -2.316 4.747 1.00 0.00 H new ATOM 0 HA3 GLY B 78 2.736 -1.349 4.679 1.00 0.00 H new ATOM 2714 N ALA B 79 2.356 -0.336 7.213 1.00 0.00 N ATOM 2715 CA ALA B 79 2.572 -0.212 8.648 1.00 0.00 C ATOM 2716 C ALA B 79 1.279 -0.416 9.440 1.00 0.00 C ATOM 2717 O ALA B 79 1.275 -1.132 10.438 1.00 0.00 O ATOM 2718 CB ALA B 79 3.196 1.152 8.962 1.00 0.00 C ATOM 0 H ALA B 79 2.667 0.482 6.690 1.00 0.00 H new ATOM 0 HA ALA B 79 3.260 -1.000 8.956 1.00 0.00 H new ATOM 0 HB1 ALA B 79 3.356 1.240 10.037 1.00 0.00 H new ATOM 0 HB2 ALA B 79 4.151 1.243 8.444 1.00 0.00 H new ATOM 0 HB3 ALA B 79 2.526 1.944 8.629 1.00 0.00 H new ATOM 2724 N LEU B 80 0.182 0.209 9.008 1.00 0.00 N ATOM 2725 CA LEU B 80 -1.114 0.005 9.644 1.00 0.00 C ATOM 2726 C LEU B 80 -1.502 -1.470 9.545 1.00 0.00 C ATOM 2727 O LEU B 80 -1.728 -2.129 10.559 1.00 0.00 O ATOM 2728 CB LEU B 80 -2.185 0.906 8.999 1.00 0.00 C ATOM 2729 CG LEU B 80 -2.360 2.276 9.676 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -3.036 2.153 11.048 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -1.043 3.047 9.805 1.00 0.00 C ATOM 0 H LEU B 80 0.168 0.859 8.222 1.00 0.00 H new ATOM 0 HA LEU B 80 -1.045 0.280 10.696 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -1.926 1.063 7.952 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -3.141 0.382 9.016 1.00 0.00 H new ATOM 0 HG LEU B 80 -3.013 2.848 9.017 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -3.141 3.143 11.492 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -4.021 1.703 10.929 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -2.427 1.526 11.699 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -1.228 4.005 10.290 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -0.339 2.468 10.403 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -0.622 3.217 8.814 1.00 0.00 H new ATOM 2743 N ALA B 81 -1.576 -1.996 8.322 1.00 0.00 N ATOM 2744 CA ALA B 81 -2.000 -3.369 8.084 1.00 0.00 C ATOM 2745 C ALA B 81 -1.184 -4.376 8.895 1.00 0.00 C ATOM 2746 O ALA B 81 -1.741 -5.334 9.427 1.00 0.00 O ATOM 2747 CB ALA B 81 -1.903 -3.673 6.597 1.00 0.00 C ATOM 0 H ALA B 81 -1.344 -1.481 7.473 1.00 0.00 H new ATOM 0 HA ALA B 81 -3.034 -3.467 8.414 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -2.219 -4.700 6.414 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -2.548 -2.991 6.043 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -0.872 -3.547 6.266 1.00 0.00 H new ATOM 2753 N MET B 82 0.125 -4.133 9.007 1.00 0.00 N ATOM 2754 CA MET B 82 1.077 -4.937 9.764 1.00 0.00 C ATOM 2755 C MET B 82 0.633 -5.225 11.207 1.00 0.00 C ATOM 2756 O MET B 82 1.137 -6.170 11.808 1.00 0.00 O ATOM 2757 CB MET B 82 2.466 -4.283 9.698 1.00 0.00 C ATOM 2758 CG MET B 82 3.581 -5.179 10.248 1.00 0.00 C ATOM 2759 SD MET B 82 5.249 -4.530 9.981 1.00 0.00 S ATOM 2760 CE MET B 82 6.217 -5.838 10.761 1.00 0.00 C ATOM 0 H MET B 82 0.565 -3.334 8.551 1.00 0.00 H new ATOM 0 HA MET B 82 1.124 -5.920 9.295 1.00 0.00 H new ATOM 0 HB2 MET B 82 2.691 -4.027 8.663 1.00 0.00 H new ATOM 0 HB3 MET B 82 2.448 -3.349 10.260 1.00 0.00 H new ATOM 0 HG2 MET B 82 3.425 -5.320 11.317 1.00 0.00 H new ATOM 0 HG3 MET B 82 3.506 -6.162 9.782 1.00 0.00 H new ATOM 0 HE1 MET B 82 7.278 -5.599 10.687 1.00 0.00 H new ATOM 0 HE2 MET B 82 5.936 -5.922 11.811 1.00 0.00 H new ATOM 0 HE3 MET B 82 6.023 -6.785 10.257 1.00 0.00 H new ATOM 2770 N ILE B 83 -0.316 -4.461 11.767 1.00 0.00 N ATOM 2771 CA ILE B 83 -0.945 -4.803 13.043 1.00 0.00 C ATOM 2772 C ILE B 83 -1.433 -6.265 13.026 1.00 0.00 C ATOM 2773 O ILE B 83 -1.311 -6.972 14.021 1.00 0.00 O ATOM 2774 CB ILE B 83 -2.058 -3.778 13.359 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -2.332 -3.564 14.860 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -3.359 -4.033 12.582 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -2.797 -4.790 15.652 1.00 0.00 C ATOM 0 H ILE B 83 -0.664 -3.598 11.350 1.00 0.00 H new ATOM 0 HA ILE B 83 -0.220 -4.741 13.854 1.00 0.00 H new ATOM 0 HB ILE B 83 -1.643 -2.837 12.999 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -1.421 -3.185 15.322 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -3.088 -2.786 14.961 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -4.097 -3.278 12.851 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -3.160 -3.981 11.512 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -3.744 -5.022 12.831 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -2.956 -4.511 16.694 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -3.730 -5.163 15.230 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -2.036 -5.569 15.597 1.00 0.00 H new ATOM 2789 N TYR B 84 -1.961 -6.722 11.882 1.00 0.00 N ATOM 2790 CA TYR B 84 -2.378 -8.098 11.641 1.00 0.00 C ATOM 2791 C TYR B 84 -3.218 -8.665 12.787 1.00 0.00 C ATOM 2792 O TYR B 84 -2.804 -9.616 13.444 1.00 0.00 O ATOM 2793 CB TYR B 84 -1.164 -8.997 11.348 1.00 0.00 C ATOM 2794 CG TYR B 84 -0.293 -8.631 10.162 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -0.860 -8.195 8.949 1.00 0.00 C ATOM 2796 CD2 TYR B 84 1.092 -8.879 10.229 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -0.048 -7.968 7.826 1.00 0.00 C ATOM 2798 CE2 TYR B 84 1.901 -8.684 9.097 1.00 0.00 C ATOM 2799 CZ TYR B 84 1.331 -8.229 7.900 1.00 0.00 C ATOM 2800 OH TYR B 84 2.125 -8.004 6.821 1.00 0.00 O ATOM 0 H TYR B 84 -2.112 -6.117 11.075 1.00 0.00 H new ATOM 0 HA TYR B 84 -3.019 -8.085 10.759 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -0.533 -9.011 12.237 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -1.527 -10.014 11.198 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -1.926 -8.034 8.882 1.00 0.00 H new ATOM 0 HD2 TYR B 84 1.534 -9.220 11.154 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -0.481 -7.595 6.910 1.00 0.00 H new ATOM 0 HE2 TYR B 84 2.961 -8.884 9.149 1.00 0.00 H new ATOM 0 HH TYR B 84 1.574 -7.719 6.063 1.00 0.00 H new ATOM 2810 N ASN B 85 -4.424 -8.121 12.982 1.00 0.00 N ATOM 2811 CA ASN B 85 -5.394 -8.540 13.995 1.00 0.00 C ATOM 2812 C ASN B 85 -5.407 -10.059 14.218 1.00 0.00 C ATOM 2813 O ASN B 85 -6.038 -10.793 13.453 1.00 0.00 O ATOM 2814 CB ASN B 85 -6.790 -8.044 13.588 1.00 0.00 C ATOM 2815 CG ASN B 85 -7.865 -8.420 14.609 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -8.345 -7.572 15.350 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -8.263 -9.689 14.658 1.00 0.00 N ATOM 0 H ASN B 85 -4.763 -7.345 12.414 1.00 0.00 H new ATOM 0 HA ASN B 85 -5.096 -8.095 14.945 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -6.767 -6.961 13.471 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -7.053 -8.464 12.617 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -8.983 -9.972 15.323 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -7.849 -10.378 14.030 1.00 0.00 H new ATOM 2824 N GLU B 86 -4.748 -10.529 15.280 1.00 0.00 N ATOM 2825 CA GLU B 86 -4.655 -11.942 15.623 1.00 0.00 C ATOM 2826 C GLU B 86 -4.043 -12.732 14.459 1.00 0.00 C ATOM 2827 O GLU B 86 -4.615 -13.717 14.005 1.00 0.00 O ATOM 2828 CB GLU B 86 -6.036 -12.455 16.088 1.00 0.00 C ATOM 2829 CG GLU B 86 -5.955 -13.575 17.135 1.00 0.00 C ATOM 2830 CD GLU B 86 -5.351 -14.867 16.590 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -6.131 -15.660 16.018 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -4.125 -15.035 16.765 1.00 0.00 O ATOM 0 H GLU B 86 -4.256 -9.922 15.936 1.00 0.00 H new ATOM 0 HA GLU B 86 -3.977 -12.091 16.464 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -6.603 -11.622 16.503 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -6.590 -12.818 15.222 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -5.358 -13.231 17.980 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -6.956 -13.781 17.515 1.00 0.00 H new ATOM 2839 N ALA B 87 -2.908 -12.257 13.937 1.00 0.00 N ATOM 2840 CA ALA B 87 -2.289 -12.774 12.722 1.00 0.00 C ATOM 2841 C ALA B 87 -3.332 -12.838 11.605 1.00 0.00 C ATOM 2842 O ALA B 87 -3.521 -13.877 10.983 1.00 0.00 O ATOM 2843 CB ALA B 87 -1.624 -14.130 12.990 1.00 0.00 C ATOM 0 H ALA B 87 -2.387 -11.488 14.358 1.00 0.00 H new ATOM 0 HA ALA B 87 -1.496 -12.101 12.395 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -1.168 -14.499 12.072 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -0.856 -14.014 13.755 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -2.375 -14.842 13.334 1.00 0.00 H new ATOM 2849 N LEU B 88 -4.069 -11.738 11.414 1.00 0.00 N ATOM 2850 CA LEU B 88 -5.238 -11.668 10.537 1.00 0.00 C ATOM 2851 C LEU B 88 -6.170 -12.876 10.719 1.00 0.00 C ATOM 2852 O LEU B 88 -6.701 -13.395 9.739 1.00 0.00 O ATOM 2853 CB LEU B 88 -4.808 -11.508 9.065 1.00 0.00 C ATOM 2854 CG LEU B 88 -4.070 -10.201 8.741 1.00 0.00 C ATOM 2855 CD1 LEU B 88 -3.663 -10.216 7.261 1.00 0.00 C ATOM 2856 CD2 LEU B 88 -4.946 -8.963 8.985 1.00 0.00 C ATOM 0 H LEU B 88 -3.863 -10.853 11.877 1.00 0.00 H new ATOM 0 HA LEU B 88 -5.808 -10.784 10.824 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -4.165 -12.346 8.797 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -5.695 -11.572 8.434 1.00 0.00 H new ATOM 0 HG LEU B 88 -3.202 -10.140 9.398 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -3.138 -9.292 7.019 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -3.008 -11.066 7.072 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -4.554 -10.300 6.639 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -4.380 -8.063 8.742 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -5.833 -9.015 8.354 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -5.247 -8.931 10.032 1.00 0.00 H new