USER MOD reduce.3.24.130724 H: found=0, std=0, add=1148, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1153 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: A 71 GLN : amide:sc= -0.241 K(o=1.5,f=-3.3!) USER MOD Set 1.2: B 71 GLN : amide:sc= 0.515 K(o=1.5,f=-3.3) USER MOD Set 1.3: B 75 THR OG1 : rot 66:sc= 1.23 USER MOD Set 2.1: B 39 GLN : amide:sc= 0.634 K(o=1.3,f=-4!) USER MOD Set 2.2: B 40 LYS NZ :NH3+ -171:sc= 0.62 (180deg=-0.21) USER MOD Set 3.1: A 82 MET CE :methyl -167:sc= -0.0468 (180deg=-0.297) USER MOD Set 3.2: B 27 HIS : no HE2:sc= -0.0547 K(o=-0.1,f=-2.9) USER MOD Set 4.1: B 18 LYS NZ :NH3+ 176:sc= 0.407 (180deg=0.366) USER MOD Set 4.2: B 19 TYR OH : rot 6:sc= 1.2 USER MOD Set 5.1: A 39 GLN : amide:sc= 0.889 K(o=1.7,f=-2.2) USER MOD Set 5.2: A 40 LYS NZ :NH3+ -167:sc= 0.768 (180deg=-0.306) USER MOD Set 6.1: A 17 HIS : no HE2:sc= 0.231 K(o=1.9,f=-4.7!) USER MOD Set 6.2: A 20 SER OG : rot -174:sc= 1.66 USER MOD Set 7.1: A 18 LYS NZ :NH3+ -172:sc= 0.596 (180deg=-0.1) USER MOD Set 7.2: A 19 TYR OH : rot 6:sc= 1.78 USER MOD Single : A 3 SER OG : rot -170:sc= 0.0796 USER MOD Single : A 7 GLN : amide:sc= -0.197 X(o=-0.2,f=-0.19) USER MOD Single : A 28 THR OG1 : rot -38:sc= 0.01 USER MOD Single : A 30 SER OG : rot -37:sc= 1.21 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 171:sc= 0.231 (180deg=0.16) USER MOD Single : A 35 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.126) USER MOD Single : A 55 LYS NZ :NH3+ 160:sc= -0.0189 (180deg=-0.234) USER MOD Single : A 57 MET CE :methyl 156:sc= -0.101 (180deg=-1.55) USER MOD Single : A 69 ASN : amide:sc= 1.89 K(o=1.9,f=-3.1!) USER MOD Single : A 73 TYR OH : rot 157:sc= 1.03 USER MOD Single : A 75 THR OG1 : rot 74:sc= 1.21 USER MOD Single : A 84 TYR OH : rot 44:sc= 1.23 USER MOD Single : A 85 ASN : amide:sc= 0.989 K(o=0.99,f=-0.048) USER MOD Single : B 3 SER OG : rot 180:sc= 0.181 USER MOD Single : B 7 GLN : amide:sc= -0.107 X(o=-0.11,f=0) USER MOD Single : B 17 HIS : no HE2:sc= 0.345 K(o=0.35,f=-3.1!) USER MOD Single : B 20 SER OG : rot 71:sc= 1.21 USER MOD Single : B 28 THR OG1 : rot 98:sc= 1.2 USER MOD Single : B 30 SER OG : rot -72:sc= 1.16 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 LYS NZ :NH3+ 172:sc= 0.6 (180deg=0.567) USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 LYS NZ :NH3+ -106:sc= -0.0597 (180deg=-2.25!) USER MOD Single : B 57 MET CE :methyl -111:sc= -0.0176 (180deg=-0.85) USER MOD Single : B 63 ASN : amide:sc= 0.502 K(o=0.5,f=-4.7!) USER MOD Single : B 69 ASN : amide:sc= -1.11 K(o=-1.1,f=-8!) USER MOD Single : B 73 TYR OH : rot 157:sc= 1.09 USER MOD Single : B 82 MET CE :methyl -170:sc= -0.0296 (180deg=-0.172) USER MOD Single : B 84 TYR OH : rot 180:sc= 0 USER MOD Single : B 85 ASN : amide:sc= -0.053 K(o=-0.053,f=-1.7!) USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 -6.359 -6.989 -9.036 1.00 0.00 N ATOM 21 CA ALA A 2 -6.346 -5.725 -8.313 1.00 0.00 C ATOM 22 C ALA A 2 -7.428 -5.715 -7.230 1.00 0.00 C ATOM 23 O ALA A 2 -8.397 -4.962 -7.313 1.00 0.00 O ATOM 24 CB ALA A 2 -6.482 -4.545 -9.279 1.00 0.00 C ATOM 0 HA ALA A 2 -5.385 -5.617 -7.811 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -6.470 -3.611 -8.717 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -5.651 -4.555 -9.984 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -7.422 -4.628 -9.825 1.00 0.00 H new ATOM 30 N SER A 3 -7.258 -6.560 -6.211 1.00 0.00 N ATOM 31 CA SER A 3 -8.145 -6.646 -5.061 1.00 0.00 C ATOM 32 C SER A 3 -8.254 -5.291 -4.342 1.00 0.00 C ATOM 33 O SER A 3 -7.407 -4.425 -4.558 1.00 0.00 O ATOM 34 CB SER A 3 -7.564 -7.702 -4.114 1.00 0.00 C ATOM 35 OG SER A 3 -6.917 -8.724 -4.846 1.00 0.00 O ATOM 0 H SER A 3 -6.479 -7.217 -6.167 1.00 0.00 H new ATOM 0 HA SER A 3 -9.149 -6.921 -5.384 1.00 0.00 H new ATOM 0 HB2 SER A 3 -6.857 -7.234 -3.429 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.361 -8.131 -3.506 1.00 0.00 H new ATOM 0 HG SER A 3 -6.691 -9.464 -4.245 1.00 0.00 H new ATOM 41 N PRO A 4 -9.237 -5.101 -3.442 1.00 0.00 N ATOM 42 CA PRO A 4 -9.403 -3.867 -2.685 1.00 0.00 C ATOM 43 C PRO A 4 -8.092 -3.350 -2.086 1.00 0.00 C ATOM 44 O PRO A 4 -7.761 -2.177 -2.246 1.00 0.00 O ATOM 45 CB PRO A 4 -10.453 -4.174 -1.614 1.00 0.00 C ATOM 46 CG PRO A 4 -11.311 -5.241 -2.292 1.00 0.00 C ATOM 47 CD PRO A 4 -10.283 -6.048 -3.084 1.00 0.00 C ATOM 0 HA PRO A 4 -9.728 -3.056 -3.337 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -9.999 -4.542 -0.694 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -11.035 -3.291 -1.351 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -11.837 -5.859 -1.565 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -12.067 -4.800 -2.942 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -9.883 -6.867 -2.487 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -10.732 -6.491 -3.973 1.00 0.00 H new ATOM 55 N LEU A 5 -7.323 -4.228 -1.428 1.00 0.00 N ATOM 56 CA LEU A 5 -6.013 -3.853 -0.915 1.00 0.00 C ATOM 57 C LEU A 5 -5.108 -3.327 -2.027 1.00 0.00 C ATOM 58 O LEU A 5 -4.500 -2.275 -1.863 1.00 0.00 O ATOM 59 CB LEU A 5 -5.316 -5.028 -0.207 1.00 0.00 C ATOM 60 CG LEU A 5 -5.385 -5.016 1.326 1.00 0.00 C ATOM 61 CD1 LEU A 5 -4.460 -6.124 1.847 1.00 0.00 C ATOM 62 CD2 LEU A 5 -4.916 -3.686 1.938 1.00 0.00 C ATOM 0 H LEU A 5 -7.589 -5.195 -1.243 1.00 0.00 H new ATOM 0 HA LEU A 5 -6.184 -3.059 -0.188 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -5.758 -5.958 -0.565 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -4.268 -5.038 -0.505 1.00 0.00 H new ATOM 0 HG LEU A 5 -6.426 -5.164 1.612 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -4.489 -6.139 2.937 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -4.793 -7.088 1.462 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -3.440 -5.933 1.513 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -4.988 -3.740 3.024 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -3.881 -3.499 1.652 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -5.546 -2.875 1.572 1.00 0.00 H new ATOM 74 N ASP A 6 -4.992 -4.051 -3.143 1.00 0.00 N ATOM 75 CA ASP A 6 -4.122 -3.640 -4.239 1.00 0.00 C ATOM 76 C ASP A 6 -4.545 -2.266 -4.749 1.00 0.00 C ATOM 77 O ASP A 6 -3.705 -1.399 -4.960 1.00 0.00 O ATOM 78 CB ASP A 6 -4.144 -4.660 -5.378 1.00 0.00 C ATOM 79 CG ASP A 6 -3.200 -4.228 -6.495 1.00 0.00 C ATOM 80 OD1 ASP A 6 -1.985 -4.473 -6.335 1.00 0.00 O ATOM 81 OD2 ASP A 6 -3.710 -3.654 -7.480 1.00 0.00 O ATOM 0 H ASP A 6 -5.492 -4.925 -3.308 1.00 0.00 H new ATOM 0 HA ASP A 6 -3.101 -3.585 -3.862 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -3.850 -5.640 -5.003 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -5.157 -4.759 -5.767 1.00 0.00 H new ATOM 86 N GLN A 7 -5.852 -2.070 -4.930 1.00 0.00 N ATOM 87 CA GLN A 7 -6.405 -0.805 -5.381 1.00 0.00 C ATOM 88 C GLN A 7 -6.040 0.315 -4.397 1.00 0.00 C ATOM 89 O GLN A 7 -5.548 1.367 -4.796 1.00 0.00 O ATOM 90 CB GLN A 7 -7.923 -0.964 -5.551 1.00 0.00 C ATOM 91 CG GLN A 7 -8.561 0.195 -6.329 1.00 0.00 C ATOM 92 CD GLN A 7 -8.031 0.312 -7.755 1.00 0.00 C ATOM 93 OE1 GLN A 7 -7.553 1.365 -8.163 1.00 0.00 O ATOM 94 NE2 GLN A 7 -8.102 -0.767 -8.530 1.00 0.00 N ATOM 0 H GLN A 7 -6.554 -2.791 -4.765 1.00 0.00 H new ATOM 0 HA GLN A 7 -5.981 -0.524 -6.345 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -8.129 -1.900 -6.070 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -8.388 -1.035 -4.568 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -9.642 0.056 -6.358 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -8.374 1.129 -5.799 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -8.504 -1.631 -8.166 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -7.754 -0.731 -9.488 1.00 0.00 H new ATOM 103 N ALA A 8 -6.280 0.089 -3.105 1.00 0.00 N ATOM 104 CA ALA A 8 -6.044 1.076 -2.061 1.00 0.00 C ATOM 105 C ALA A 8 -4.552 1.415 -1.928 1.00 0.00 C ATOM 106 O ALA A 8 -4.167 2.584 -1.865 1.00 0.00 O ATOM 107 CB ALA A 8 -6.631 0.547 -0.755 1.00 0.00 C ATOM 0 H ALA A 8 -6.648 -0.795 -2.754 1.00 0.00 H new ATOM 0 HA ALA A 8 -6.538 2.011 -2.323 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -6.464 1.274 0.040 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -7.702 0.383 -0.877 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.147 -0.394 -0.494 1.00 0.00 H new ATOM 113 N ILE A 9 -3.698 0.390 -1.914 1.00 0.00 N ATOM 114 CA ILE A 9 -2.250 0.550 -1.976 1.00 0.00 C ATOM 115 C ILE A 9 -1.909 1.383 -3.215 1.00 0.00 C ATOM 116 O ILE A 9 -1.210 2.387 -3.111 1.00 0.00 O ATOM 117 CB ILE A 9 -1.568 -0.836 -1.964 1.00 0.00 C ATOM 118 CG1 ILE A 9 -1.699 -1.464 -0.563 1.00 0.00 C ATOM 119 CG2 ILE A 9 -0.090 -0.738 -2.364 1.00 0.00 C ATOM 120 CD1 ILE A 9 -1.354 -2.957 -0.546 1.00 0.00 C ATOM 0 H ILE A 9 -3.999 -0.583 -1.859 1.00 0.00 H new ATOM 0 HA ILE A 9 -1.872 1.083 -1.103 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.068 -1.469 -2.697 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -1.043 -0.936 0.129 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -2.719 -1.327 -0.203 1.00 0.00 H new ATOM 0 HG21 ILE A 9 0.359 -1.731 -2.345 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -0.012 -0.324 -3.369 1.00 0.00 H new ATOM 0 HG23 ILE A 9 0.435 -0.089 -1.662 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -1.464 -3.344 0.467 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -2.027 -3.494 -1.215 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -0.325 -3.096 -0.878 1.00 0.00 H new ATOM 132 N GLY A 10 -2.440 0.987 -4.374 1.00 0.00 N ATOM 133 CA GLY A 10 -2.322 1.703 -5.633 1.00 0.00 C ATOM 134 C GLY A 10 -2.637 3.187 -5.465 1.00 0.00 C ATOM 135 O GLY A 10 -1.857 4.032 -5.892 1.00 0.00 O ATOM 0 H GLY A 10 -2.982 0.127 -4.458 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -1.312 1.587 -6.025 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -3.001 1.267 -6.366 1.00 0.00 H new ATOM 139 N LEU A 11 -3.760 3.511 -4.822 1.00 0.00 N ATOM 140 CA LEU A 11 -4.117 4.881 -4.480 1.00 0.00 C ATOM 141 C LEU A 11 -2.998 5.553 -3.676 1.00 0.00 C ATOM 142 O LEU A 11 -2.497 6.592 -4.098 1.00 0.00 O ATOM 143 CB LEU A 11 -5.473 4.917 -3.754 1.00 0.00 C ATOM 144 CG LEU A 11 -6.645 5.031 -4.741 1.00 0.00 C ATOM 145 CD1 LEU A 11 -7.888 4.300 -4.219 1.00 0.00 C ATOM 146 CD2 LEU A 11 -6.980 6.510 -4.966 1.00 0.00 C ATOM 0 H LEU A 11 -4.450 2.822 -4.523 1.00 0.00 H new ATOM 0 HA LEU A 11 -4.230 5.458 -5.398 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -5.589 4.014 -3.155 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.494 5.761 -3.065 1.00 0.00 H new ATOM 0 HG LEU A 11 -6.346 4.566 -5.680 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -8.699 4.400 -4.941 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -7.657 3.244 -4.077 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -8.193 4.735 -3.268 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -7.811 6.592 -5.666 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -7.258 6.969 -4.017 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -6.109 7.022 -5.375 1.00 0.00 H new ATOM 158 N LEU A 12 -2.582 4.987 -2.537 1.00 0.00 N ATOM 159 CA LEU A 12 -1.539 5.605 -1.709 1.00 0.00 C ATOM 160 C LEU A 12 -0.237 5.822 -2.501 1.00 0.00 C ATOM 161 O LEU A 12 0.390 6.879 -2.384 1.00 0.00 O ATOM 162 CB LEU A 12 -1.304 4.807 -0.413 1.00 0.00 C ATOM 163 CG LEU A 12 -2.203 5.276 0.747 1.00 0.00 C ATOM 164 CD1 LEU A 12 -3.690 5.107 0.438 1.00 0.00 C ATOM 165 CD2 LEU A 12 -1.889 4.486 2.023 1.00 0.00 C ATOM 0 H LEU A 12 -2.948 4.109 -2.169 1.00 0.00 H new ATOM 0 HA LEU A 12 -1.895 6.593 -1.416 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -1.487 3.750 -0.604 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -0.259 4.901 -0.118 1.00 0.00 H new ATOM 0 HG LEU A 12 -1.992 6.336 0.887 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -4.280 5.452 1.287 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.947 5.693 -0.444 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.905 4.055 0.250 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.533 4.830 2.832 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -2.064 3.425 1.846 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -0.846 4.640 2.299 1.00 0.00 H new ATOM 177 N ILE A 13 0.170 4.837 -3.307 1.00 0.00 N ATOM 178 CA ILE A 13 1.322 4.950 -4.204 1.00 0.00 C ATOM 179 C ILE A 13 1.125 6.093 -5.206 1.00 0.00 C ATOM 180 O ILE A 13 1.990 6.955 -5.343 1.00 0.00 O ATOM 181 CB ILE A 13 1.581 3.618 -4.934 1.00 0.00 C ATOM 182 CG1 ILE A 13 1.999 2.537 -3.924 1.00 0.00 C ATOM 183 CG2 ILE A 13 2.668 3.778 -6.015 1.00 0.00 C ATOM 184 CD1 ILE A 13 2.094 1.157 -4.578 1.00 0.00 C ATOM 0 H ILE A 13 -0.296 3.931 -3.355 1.00 0.00 H new ATOM 0 HA ILE A 13 2.199 5.180 -3.599 1.00 0.00 H new ATOM 0 HB ILE A 13 0.656 3.315 -5.425 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.963 2.800 -3.488 1.00 0.00 H new ATOM 0 HG13 ILE A 13 1.278 2.504 -3.107 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.829 2.822 -6.513 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.347 4.519 -6.747 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.598 4.106 -5.550 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.392 0.420 -3.832 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.123 0.883 -4.991 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.834 1.183 -5.377 1.00 0.00 H new ATOM 196 N GLY A 14 0.013 6.087 -5.940 1.00 0.00 N ATOM 197 CA GLY A 14 -0.278 7.082 -6.960 1.00 0.00 C ATOM 198 C GLY A 14 -0.237 8.476 -6.350 1.00 0.00 C ATOM 199 O GLY A 14 0.458 9.360 -6.847 1.00 0.00 O ATOM 0 H GLY A 14 -0.717 5.381 -5.839 1.00 0.00 H new ATOM 0 HA2 GLY A 14 0.448 7.008 -7.770 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -1.260 6.894 -7.394 1.00 0.00 H new ATOM 203 N ILE A 15 -0.954 8.649 -5.240 1.00 0.00 N ATOM 204 CA ILE A 15 -0.935 9.862 -4.445 1.00 0.00 C ATOM 205 C ILE A 15 0.508 10.256 -4.128 1.00 0.00 C ATOM 206 O ILE A 15 0.886 11.399 -4.363 1.00 0.00 O ATOM 207 CB ILE A 15 -1.770 9.659 -3.170 1.00 0.00 C ATOM 208 CG1 ILE A 15 -3.280 9.571 -3.473 1.00 0.00 C ATOM 209 CG2 ILE A 15 -1.466 10.765 -2.158 1.00 0.00 C ATOM 210 CD1 ILE A 15 -3.959 10.915 -3.750 1.00 0.00 C ATOM 0 H ILE A 15 -1.575 7.931 -4.866 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.382 10.681 -5.008 1.00 0.00 H new ATOM 0 HB ILE A 15 -1.486 8.702 -2.733 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -3.426 8.922 -4.336 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.779 9.095 -2.628 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -2.063 10.610 -1.259 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -0.408 10.740 -1.899 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -1.710 11.734 -2.594 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -5.018 10.753 -3.952 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -3.851 11.563 -2.881 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -3.493 11.387 -4.615 1.00 0.00 H new ATOM 222 N PHE A 16 1.313 9.330 -3.593 1.00 0.00 N ATOM 223 CA PHE A 16 2.712 9.610 -3.296 1.00 0.00 C ATOM 224 C PHE A 16 3.401 10.182 -4.537 1.00 0.00 C ATOM 225 O PHE A 16 3.860 11.324 -4.538 1.00 0.00 O ATOM 226 CB PHE A 16 3.412 8.335 -2.796 1.00 0.00 C ATOM 227 CG PHE A 16 4.838 8.516 -2.312 1.00 0.00 C ATOM 228 CD1 PHE A 16 5.105 9.385 -1.241 1.00 0.00 C ATOM 229 CD2 PHE A 16 5.879 7.739 -2.857 1.00 0.00 C ATOM 230 CE1 PHE A 16 6.402 9.471 -0.709 1.00 0.00 C ATOM 231 CE2 PHE A 16 7.191 7.879 -2.369 1.00 0.00 C ATOM 232 CZ PHE A 16 7.451 8.746 -1.294 1.00 0.00 C ATOM 0 H PHE A 16 1.014 8.383 -3.359 1.00 0.00 H new ATOM 0 HA PHE A 16 2.775 10.355 -2.503 1.00 0.00 H new ATOM 0 HB2 PHE A 16 2.822 7.914 -1.982 1.00 0.00 H new ATOM 0 HB3 PHE A 16 3.412 7.602 -3.603 1.00 0.00 H new ATOM 0 HD1 PHE A 16 4.311 9.988 -0.826 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.670 7.036 -3.650 1.00 0.00 H new ATOM 0 HE1 PHE A 16 6.592 10.096 0.151 1.00 0.00 H new ATOM 0 HE2 PHE A 16 7.998 7.321 -2.820 1.00 0.00 H new ATOM 0 HZ PHE A 16 8.458 8.854 -0.918 1.00 0.00 H new ATOM 242 N HIS A 17 3.439 9.392 -5.612 1.00 0.00 N ATOM 243 CA HIS A 17 4.188 9.742 -6.806 1.00 0.00 C ATOM 244 C HIS A 17 3.658 10.973 -7.530 1.00 0.00 C ATOM 245 O HIS A 17 4.443 11.654 -8.186 1.00 0.00 O ATOM 246 CB HIS A 17 4.378 8.523 -7.708 1.00 0.00 C ATOM 247 CG HIS A 17 5.434 7.576 -7.186 1.00 0.00 C ATOM 248 ND1 HIS A 17 6.495 7.897 -6.360 1.00 0.00 N ATOM 249 CD2 HIS A 17 5.583 6.269 -7.564 1.00 0.00 C ATOM 250 CE1 HIS A 17 7.262 6.799 -6.250 1.00 0.00 C ATOM 251 NE2 HIS A 17 6.745 5.784 -6.961 1.00 0.00 N ATOM 0 H HIS A 17 2.952 8.498 -5.673 1.00 0.00 H new ATOM 0 HA HIS A 17 5.181 10.052 -6.479 1.00 0.00 H new ATOM 0 HB2 HIS A 17 3.431 7.991 -7.799 1.00 0.00 H new ATOM 0 HB3 HIS A 17 4.655 8.855 -8.709 1.00 0.00 H new ATOM 0 HD1 HIS A 17 6.664 8.800 -5.916 1.00 0.00 H new ATOM 0 HD2 HIS A 17 4.921 5.713 -8.212 1.00 0.00 H new ATOM 0 HE1 HIS A 17 8.170 6.741 -5.669 1.00 0.00 H new ATOM 259 N LYS A 18 2.380 11.319 -7.358 1.00 0.00 N ATOM 260 CA LYS A 18 1.850 12.592 -7.824 1.00 0.00 C ATOM 261 C LYS A 18 2.731 13.764 -7.358 1.00 0.00 C ATOM 262 O LYS A 18 2.841 14.759 -8.075 1.00 0.00 O ATOM 263 CB LYS A 18 0.391 12.736 -7.365 1.00 0.00 C ATOM 264 CG LYS A 18 -0.314 13.951 -7.980 1.00 0.00 C ATOM 265 CD LYS A 18 -1.779 13.985 -7.523 1.00 0.00 C ATOM 266 CE LYS A 18 -2.546 15.169 -8.124 1.00 0.00 C ATOM 267 NZ LYS A 18 -1.959 16.469 -7.746 1.00 0.00 N ATOM 0 H LYS A 18 1.692 10.726 -6.895 1.00 0.00 H new ATOM 0 HA LYS A 18 1.865 12.615 -8.914 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -0.158 11.832 -7.629 1.00 0.00 H new ATOM 0 HB3 LYS A 18 0.364 12.819 -6.278 1.00 0.00 H new ATOM 0 HG2 LYS A 18 0.192 14.868 -7.679 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -0.263 13.901 -9.068 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -2.269 13.054 -7.809 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -1.817 14.044 -6.435 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -2.555 15.079 -9.210 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -3.584 15.132 -7.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -2.585 17.237 -8.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -1.849 16.513 -6.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -1.028 16.574 -8.198 1.00 0.00 H new ATOM 281 N TYR A 19 3.367 13.651 -6.182 1.00 0.00 N ATOM 282 CA TYR A 19 4.247 14.682 -5.640 1.00 0.00 C ATOM 283 C TYR A 19 5.717 14.234 -5.577 1.00 0.00 C ATOM 284 O TYR A 19 6.597 15.074 -5.753 1.00 0.00 O ATOM 285 CB TYR A 19 3.713 15.167 -4.286 1.00 0.00 C ATOM 286 CG TYR A 19 2.315 15.765 -4.360 1.00 0.00 C ATOM 287 CD1 TYR A 19 1.197 14.917 -4.297 1.00 0.00 C ATOM 288 CD2 TYR A 19 2.128 17.145 -4.575 1.00 0.00 C ATOM 289 CE1 TYR A 19 -0.101 15.437 -4.431 1.00 0.00 C ATOM 290 CE2 TYR A 19 0.828 17.663 -4.735 1.00 0.00 C ATOM 291 CZ TYR A 19 -0.282 16.807 -4.674 1.00 0.00 C ATOM 292 OH TYR A 19 -1.527 17.305 -4.919 1.00 0.00 O ATOM 0 H TYR A 19 3.280 12.832 -5.580 1.00 0.00 H new ATOM 0 HA TYR A 19 4.241 15.529 -6.326 1.00 0.00 H new ATOM 0 HB2 TYR A 19 3.704 14.330 -3.588 1.00 0.00 H new ATOM 0 HB3 TYR A 19 4.397 15.913 -3.881 1.00 0.00 H new ATOM 0 HD1 TYR A 19 1.336 13.857 -4.144 1.00 0.00 H new ATOM 0 HD2 TYR A 19 2.981 17.805 -4.617 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -0.957 14.784 -4.347 1.00 0.00 H new ATOM 0 HE2 TYR A 19 0.686 18.720 -4.905 1.00 0.00 H new ATOM 0 HH TYR A 19 -2.193 16.596 -4.797 1.00 0.00 H new ATOM 302 N SER A 20 6.014 12.951 -5.331 1.00 0.00 N ATOM 303 CA SER A 20 7.390 12.461 -5.232 1.00 0.00 C ATOM 304 C SER A 20 7.969 12.016 -6.575 1.00 0.00 C ATOM 305 O SER A 20 9.172 12.141 -6.800 1.00 0.00 O ATOM 306 CB SER A 20 7.476 11.302 -4.233 1.00 0.00 C ATOM 307 OG SER A 20 6.635 10.227 -4.600 1.00 0.00 O ATOM 0 H SER A 20 5.308 12.228 -5.196 1.00 0.00 H new ATOM 0 HA SER A 20 7.987 13.304 -4.884 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.506 10.952 -4.171 1.00 0.00 H new ATOM 0 HB3 SER A 20 7.199 11.657 -3.240 1.00 0.00 H new ATOM 0 HG SER A 20 6.641 9.550 -3.891 1.00 0.00 H new ATOM 415 N THR A 28 11.385 9.435 -2.109 1.00 0.00 N ATOM 416 CA THR A 28 11.308 10.422 -1.042 1.00 0.00 C ATOM 417 C THR A 28 10.577 11.685 -1.500 1.00 0.00 C ATOM 418 O THR A 28 10.348 11.884 -2.692 1.00 0.00 O ATOM 419 CB THR A 28 12.720 10.785 -0.546 1.00 0.00 C ATOM 420 OG1 THR A 28 13.455 11.456 -1.547 1.00 0.00 O ATOM 421 CG2 THR A 28 13.555 9.595 -0.073 1.00 0.00 C ATOM 0 HA THR A 28 10.741 9.980 -0.223 1.00 0.00 H new ATOM 0 HB THR A 28 12.541 11.428 0.316 1.00 0.00 H new ATOM 0 HG1 THR A 28 13.249 11.065 -2.422 1.00 0.00 H new ATOM 0 HG21 THR A 28 14.533 9.945 0.258 1.00 0.00 H new ATOM 0 HG22 THR A 28 13.047 9.101 0.755 1.00 0.00 H new ATOM 0 HG23 THR A 28 13.681 8.890 -0.894 1.00 0.00 H new ATOM 429 N LEU A 29 10.207 12.532 -0.536 1.00 0.00 N ATOM 430 CA LEU A 29 9.717 13.890 -0.747 1.00 0.00 C ATOM 431 C LEU A 29 9.863 14.647 0.578 1.00 0.00 C ATOM 432 O LEU A 29 10.396 14.075 1.528 1.00 0.00 O ATOM 433 CB LEU A 29 8.296 13.901 -1.331 1.00 0.00 C ATOM 434 CG LEU A 29 7.303 12.912 -0.707 1.00 0.00 C ATOM 435 CD1 LEU A 29 7.245 12.982 0.820 1.00 0.00 C ATOM 436 CD2 LEU A 29 5.899 13.185 -1.256 1.00 0.00 C ATOM 0 H LEU A 29 10.243 12.277 0.451 1.00 0.00 H new ATOM 0 HA LEU A 29 10.310 14.406 -1.502 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.890 14.907 -1.227 1.00 0.00 H new ATOM 0 HB3 LEU A 29 8.362 13.693 -2.399 1.00 0.00 H new ATOM 0 HG LEU A 29 7.655 11.916 -0.974 1.00 0.00 H new ATOM 0 HD11 LEU A 29 6.522 12.255 1.190 1.00 0.00 H new ATOM 0 HD12 LEU A 29 8.229 12.758 1.232 1.00 0.00 H new ATOM 0 HD13 LEU A 29 6.942 13.983 1.127 1.00 0.00 H new ATOM 0 HD21 LEU A 29 5.192 12.483 -0.813 1.00 0.00 H new ATOM 0 HD22 LEU A 29 5.603 14.204 -1.007 1.00 0.00 H new ATOM 0 HD23 LEU A 29 5.902 13.063 -2.339 1.00 0.00 H new ATOM 448 N SER A 30 9.429 15.909 0.669 1.00 0.00 N ATOM 449 CA SER A 30 9.655 16.732 1.853 1.00 0.00 C ATOM 450 C SER A 30 8.436 17.580 2.228 1.00 0.00 C ATOM 451 O SER A 30 7.426 17.589 1.523 1.00 0.00 O ATOM 452 CB SER A 30 10.887 17.611 1.609 1.00 0.00 C ATOM 453 OG SER A 30 10.607 18.606 0.642 1.00 0.00 O ATOM 0 H SER A 30 8.915 16.383 -0.074 1.00 0.00 H new ATOM 0 HA SER A 30 9.827 16.072 2.703 1.00 0.00 H new ATOM 0 HB2 SER A 30 11.196 18.081 2.543 1.00 0.00 H new ATOM 0 HB3 SER A 30 11.720 16.994 1.272 1.00 0.00 H new ATOM 0 HG SER A 30 10.026 18.232 -0.053 1.00 0.00 H new ATOM 459 N LYS A 31 8.563 18.305 3.344 1.00 0.00 N ATOM 460 CA LYS A 31 7.586 19.212 3.932 1.00 0.00 C ATOM 461 C LYS A 31 6.667 19.905 2.928 1.00 0.00 C ATOM 462 O LYS A 31 5.450 19.829 3.073 1.00 0.00 O ATOM 463 CB LYS A 31 8.253 20.207 4.898 1.00 0.00 C ATOM 464 CG LYS A 31 9.638 20.727 4.478 1.00 0.00 C ATOM 465 CD LYS A 31 10.244 21.552 5.622 1.00 0.00 C ATOM 466 CE LYS A 31 11.735 21.825 5.388 1.00 0.00 C ATOM 467 NZ LYS A 31 12.376 22.333 6.614 1.00 0.00 N ATOM 0 H LYS A 31 9.419 18.266 3.898 1.00 0.00 H new ATOM 0 HA LYS A 31 6.916 18.575 4.510 1.00 0.00 H new ATOM 0 HB2 LYS A 31 7.589 21.062 5.024 1.00 0.00 H new ATOM 0 HB3 LYS A 31 8.346 19.729 5.873 1.00 0.00 H new ATOM 0 HG2 LYS A 31 10.293 19.891 4.232 1.00 0.00 H new ATOM 0 HG3 LYS A 31 9.551 21.339 3.580 1.00 0.00 H new ATOM 0 HD2 LYS A 31 9.710 22.498 5.713 1.00 0.00 H new ATOM 0 HD3 LYS A 31 10.114 21.020 6.564 1.00 0.00 H new ATOM 0 HE2 LYS A 31 12.230 20.909 5.067 1.00 0.00 H new ATOM 0 HE3 LYS A 31 11.854 22.551 4.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 13.384 22.510 6.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 11.916 23.219 6.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 12.281 21.628 7.373 1.00 0.00 H new ATOM 481 N LYS A 32 7.212 20.579 1.914 1.00 0.00 N ATOM 482 CA LYS A 32 6.391 21.265 0.930 1.00 0.00 C ATOM 483 C LYS A 32 5.434 20.283 0.241 1.00 0.00 C ATOM 484 O LYS A 32 4.229 20.526 0.157 1.00 0.00 O ATOM 485 CB LYS A 32 7.315 21.964 -0.069 1.00 0.00 C ATOM 486 CG LYS A 32 6.549 22.988 -0.912 1.00 0.00 C ATOM 487 CD LYS A 32 7.504 23.703 -1.876 1.00 0.00 C ATOM 488 CE LYS A 32 7.982 22.829 -3.045 1.00 0.00 C ATOM 489 NZ LYS A 32 6.863 22.330 -3.867 1.00 0.00 N ATOM 0 H LYS A 32 8.217 20.661 1.758 1.00 0.00 H new ATOM 0 HA LYS A 32 5.767 22.015 1.417 1.00 0.00 H new ATOM 0 HB2 LYS A 32 8.123 22.462 0.467 1.00 0.00 H new ATOM 0 HB3 LYS A 32 7.775 21.223 -0.722 1.00 0.00 H new ATOM 0 HG2 LYS A 32 5.760 22.489 -1.474 1.00 0.00 H new ATOM 0 HG3 LYS A 32 6.065 23.716 -0.261 1.00 0.00 H new ATOM 0 HD2 LYS A 32 7.006 24.586 -2.276 1.00 0.00 H new ATOM 0 HD3 LYS A 32 8.373 24.052 -1.318 1.00 0.00 H new ATOM 0 HE2 LYS A 32 8.661 23.406 -3.672 1.00 0.00 H new ATOM 0 HE3 LYS A 32 8.549 21.983 -2.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 7.238 21.876 -4.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 6.313 21.637 -3.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 6.249 23.125 -4.136 1.00 0.00 H new ATOM 503 N GLU A 33 5.974 19.154 -0.227 1.00 0.00 N ATOM 504 CA GLU A 33 5.188 18.117 -0.870 1.00 0.00 C ATOM 505 C GLU A 33 4.189 17.510 0.115 1.00 0.00 C ATOM 506 O GLU A 33 3.093 17.147 -0.289 1.00 0.00 O ATOM 507 CB GLU A 33 6.074 17.011 -1.448 1.00 0.00 C ATOM 508 CG GLU A 33 6.962 17.466 -2.616 1.00 0.00 C ATOM 509 CD GLU A 33 8.170 18.276 -2.163 1.00 0.00 C ATOM 510 OE1 GLU A 33 8.947 17.726 -1.351 1.00 0.00 O ATOM 511 OE2 GLU A 33 8.295 19.428 -2.628 1.00 0.00 O ATOM 0 H GLU A 33 6.970 18.941 -0.167 1.00 0.00 H new ATOM 0 HA GLU A 33 4.647 18.586 -1.692 1.00 0.00 H new ATOM 0 HB2 GLU A 33 6.709 16.617 -0.655 1.00 0.00 H new ATOM 0 HB3 GLU A 33 5.440 16.191 -1.785 1.00 0.00 H new ATOM 0 HG2 GLU A 33 7.304 16.591 -3.168 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.367 18.065 -3.306 1.00 0.00 H new ATOM 518 N LEU A 34 4.555 17.368 1.391 1.00 0.00 N ATOM 519 CA LEU A 34 3.658 16.815 2.405 1.00 0.00 C ATOM 520 C LEU A 34 2.486 17.763 2.685 1.00 0.00 C ATOM 521 O LEU A 34 1.330 17.337 2.701 1.00 0.00 O ATOM 522 CB LEU A 34 4.440 16.486 3.678 1.00 0.00 C ATOM 523 CG LEU A 34 5.424 15.323 3.465 1.00 0.00 C ATOM 524 CD1 LEU A 34 6.471 15.328 4.577 1.00 0.00 C ATOM 525 CD2 LEU A 34 4.712 13.963 3.458 1.00 0.00 C ATOM 0 H LEU A 34 5.474 17.631 1.747 1.00 0.00 H new ATOM 0 HA LEU A 34 3.231 15.888 2.024 1.00 0.00 H new ATOM 0 HB2 LEU A 34 4.988 17.369 4.005 1.00 0.00 H new ATOM 0 HB3 LEU A 34 3.743 16.230 4.476 1.00 0.00 H new ATOM 0 HG LEU A 34 5.896 15.466 2.493 1.00 0.00 H new ATOM 0 HD11 LEU A 34 7.167 14.503 4.425 1.00 0.00 H new ATOM 0 HD12 LEU A 34 7.016 16.272 4.559 1.00 0.00 H new ATOM 0 HD13 LEU A 34 5.977 15.213 5.542 1.00 0.00 H new ATOM 0 HD21 LEU A 34 5.444 13.170 3.305 1.00 0.00 H new ATOM 0 HD22 LEU A 34 4.207 13.812 4.412 1.00 0.00 H new ATOM 0 HD23 LEU A 34 3.979 13.940 2.652 1.00 0.00 H new ATOM 537 N LYS A 35 2.772 19.052 2.887 1.00 0.00 N ATOM 538 CA LYS A 35 1.752 20.081 3.029 1.00 0.00 C ATOM 539 C LYS A 35 0.844 20.071 1.795 1.00 0.00 C ATOM 540 O LYS A 35 -0.380 20.061 1.928 1.00 0.00 O ATOM 541 CB LYS A 35 2.398 21.456 3.244 1.00 0.00 C ATOM 542 CG LYS A 35 3.009 21.590 4.647 1.00 0.00 C ATOM 543 CD LYS A 35 3.768 22.918 4.744 1.00 0.00 C ATOM 544 CE LYS A 35 4.393 23.088 6.131 1.00 0.00 C ATOM 545 NZ LYS A 35 5.113 24.369 6.239 1.00 0.00 N ATOM 0 H LYS A 35 3.725 19.408 2.956 1.00 0.00 H new ATOM 0 HA LYS A 35 1.143 19.870 3.908 1.00 0.00 H new ATOM 0 HB2 LYS A 35 3.173 21.614 2.494 1.00 0.00 H new ATOM 0 HB3 LYS A 35 1.650 22.235 3.098 1.00 0.00 H new ATOM 0 HG2 LYS A 35 2.225 21.550 5.403 1.00 0.00 H new ATOM 0 HG3 LYS A 35 3.684 20.757 4.843 1.00 0.00 H new ATOM 0 HD2 LYS A 35 4.547 22.953 3.983 1.00 0.00 H new ATOM 0 HD3 LYS A 35 3.088 23.746 4.543 1.00 0.00 H new ATOM 0 HE2 LYS A 35 3.614 23.041 6.892 1.00 0.00 H new ATOM 0 HE3 LYS A 35 5.080 22.264 6.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 5.742 24.345 7.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 5.677 24.524 5.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 4.428 25.144 6.348 1.00 0.00 H new ATOM 559 N GLU A 36 1.435 20.039 0.594 1.00 0.00 N ATOM 560 CA GLU A 36 0.664 19.871 -0.628 1.00 0.00 C ATOM 561 C GLU A 36 -0.222 18.630 -0.549 1.00 0.00 C ATOM 562 O GLU A 36 -1.428 18.749 -0.701 1.00 0.00 O ATOM 563 CB GLU A 36 1.571 19.800 -1.857 1.00 0.00 C ATOM 564 CG GLU A 36 2.015 21.183 -2.335 1.00 0.00 C ATOM 565 CD GLU A 36 3.066 21.052 -3.432 1.00 0.00 C ATOM 566 OE1 GLU A 36 2.648 20.853 -4.592 1.00 0.00 O ATOM 567 OE2 GLU A 36 4.267 21.130 -3.091 1.00 0.00 O ATOM 0 H GLU A 36 2.441 20.127 0.450 1.00 0.00 H new ATOM 0 HA GLU A 36 0.024 20.747 -0.732 1.00 0.00 H new ATOM 0 HB2 GLU A 36 2.450 19.200 -1.622 1.00 0.00 H new ATOM 0 HB3 GLU A 36 1.045 19.291 -2.665 1.00 0.00 H new ATOM 0 HG2 GLU A 36 1.156 21.739 -2.710 1.00 0.00 H new ATOM 0 HG3 GLU A 36 2.422 21.751 -1.498 1.00 0.00 H new ATOM 574 N LEU A 37 0.357 17.449 -0.334 1.00 0.00 N ATOM 575 CA LEU A 37 -0.363 16.187 -0.243 1.00 0.00 C ATOM 576 C LEU A 37 -1.593 16.340 0.642 1.00 0.00 C ATOM 577 O LEU A 37 -2.715 16.141 0.178 1.00 0.00 O ATOM 578 CB LEU A 37 0.551 15.086 0.318 1.00 0.00 C ATOM 579 CG LEU A 37 1.357 14.366 -0.769 1.00 0.00 C ATOM 580 CD1 LEU A 37 2.568 13.666 -0.150 1.00 0.00 C ATOM 581 CD2 LEU A 37 0.479 13.307 -1.437 1.00 0.00 C ATOM 0 H LEU A 37 1.365 17.345 -0.216 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.683 15.902 -1.245 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.238 15.525 1.041 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -0.055 14.357 0.856 1.00 0.00 H new ATOM 0 HG LEU A 37 1.690 15.102 -1.501 1.00 0.00 H new ATOM 0 HD11 LEU A 37 3.133 13.158 -0.931 1.00 0.00 H new ATOM 0 HD12 LEU A 37 3.205 14.404 0.337 1.00 0.00 H new ATOM 0 HD13 LEU A 37 2.230 12.937 0.586 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.052 12.795 -2.210 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.149 12.584 -0.691 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.390 13.786 -1.887 1.00 0.00 H new ATOM 593 N ILE A 38 -1.390 16.689 1.914 1.00 0.00 N ATOM 594 CA ILE A 38 -2.503 16.761 2.846 1.00 0.00 C ATOM 595 C ILE A 38 -3.519 17.810 2.366 1.00 0.00 C ATOM 596 O ILE A 38 -4.697 17.498 2.227 1.00 0.00 O ATOM 597 CB ILE A 38 -1.995 16.907 4.296 1.00 0.00 C ATOM 598 CG1 ILE A 38 -3.074 16.536 5.326 1.00 0.00 C ATOM 599 CG2 ILE A 38 -1.422 18.292 4.595 1.00 0.00 C ATOM 600 CD1 ILE A 38 -2.506 16.440 6.748 1.00 0.00 C ATOM 0 H ILE A 38 -0.480 16.921 2.312 1.00 0.00 H new ATOM 0 HA ILE A 38 -3.061 15.825 2.864 1.00 0.00 H new ATOM 0 HB ILE A 38 -1.175 16.195 4.388 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -3.868 17.282 5.303 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -3.524 15.582 5.051 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -1.082 18.330 5.630 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -0.581 18.489 3.930 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.193 19.046 4.439 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -3.304 16.176 7.442 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -1.730 15.675 6.779 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -2.079 17.401 7.035 1.00 0.00 H new ATOM 612 N GLN A 39 -3.076 19.029 2.040 1.00 0.00 N ATOM 613 CA GLN A 39 -3.981 20.107 1.660 1.00 0.00 C ATOM 614 C GLN A 39 -4.782 19.776 0.391 1.00 0.00 C ATOM 615 O GLN A 39 -6.005 19.898 0.382 1.00 0.00 O ATOM 616 CB GLN A 39 -3.175 21.405 1.531 1.00 0.00 C ATOM 617 CG GLN A 39 -4.062 22.625 1.255 1.00 0.00 C ATOM 618 CD GLN A 39 -3.227 23.898 1.181 1.00 0.00 C ATOM 619 OE1 GLN A 39 -2.992 24.433 0.103 1.00 0.00 O ATOM 620 NE2 GLN A 39 -2.759 24.391 2.324 1.00 0.00 N ATOM 0 H GLN A 39 -2.090 19.290 2.033 1.00 0.00 H new ATOM 0 HA GLN A 39 -4.732 20.237 2.440 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -2.611 21.571 2.449 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -2.449 21.299 0.725 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -4.601 22.484 0.318 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -4.810 22.721 2.042 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -2.971 23.924 3.206 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -2.188 25.236 2.319 1.00 0.00 H new ATOM 629 N LYS A 40 -4.098 19.399 -0.692 1.00 0.00 N ATOM 630 CA LYS A 40 -4.712 19.088 -1.975 1.00 0.00 C ATOM 631 C LYS A 40 -5.556 17.818 -1.840 1.00 0.00 C ATOM 632 O LYS A 40 -6.749 17.821 -2.141 1.00 0.00 O ATOM 633 CB LYS A 40 -3.649 18.862 -3.078 1.00 0.00 C ATOM 634 CG LYS A 40 -3.130 20.077 -3.874 1.00 0.00 C ATOM 635 CD LYS A 40 -2.022 20.925 -3.239 1.00 0.00 C ATOM 636 CE LYS A 40 -2.590 22.016 -2.336 1.00 0.00 C ATOM 637 NZ LYS A 40 -1.549 22.945 -1.864 1.00 0.00 N ATOM 0 H LYS A 40 -3.083 19.301 -0.697 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.333 19.937 -2.261 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -2.789 18.381 -2.613 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -4.063 18.152 -3.794 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -2.767 19.717 -4.836 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -3.978 20.731 -4.078 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -1.359 20.282 -2.660 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -1.418 21.381 -4.024 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -3.353 22.574 -2.879 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -3.081 21.556 -1.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -1.929 23.528 -1.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -0.731 22.403 -1.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -1.252 23.561 -2.648 1.00 0.00 H new ATOM 651 N GLU A 41 -4.919 16.711 -1.446 1.00 0.00 N ATOM 652 CA GLU A 41 -5.536 15.398 -1.520 1.00 0.00 C ATOM 653 C GLU A 41 -6.491 15.157 -0.358 1.00 0.00 C ATOM 654 O GLU A 41 -7.612 14.705 -0.585 1.00 0.00 O ATOM 655 CB GLU A 41 -4.473 14.298 -1.618 1.00 0.00 C ATOM 656 CG GLU A 41 -3.442 14.553 -2.729 1.00 0.00 C ATOM 657 CD GLU A 41 -4.066 14.676 -4.115 1.00 0.00 C ATOM 658 OE1 GLU A 41 -4.989 13.884 -4.405 1.00 0.00 O ATOM 659 OE2 GLU A 41 -3.593 15.556 -4.867 1.00 0.00 O ATOM 0 H GLU A 41 -3.970 16.707 -1.071 1.00 0.00 H new ATOM 0 HA GLU A 41 -6.133 15.364 -2.431 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -3.955 14.215 -0.662 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -4.964 13.342 -1.799 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -2.893 15.467 -2.503 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -2.717 13.739 -2.736 1.00 0.00 H new ATOM 666 N LEU A 42 -6.092 15.459 0.883 1.00 0.00 N ATOM 667 CA LEU A 42 -7.010 15.366 2.012 1.00 0.00 C ATOM 668 C LEU A 42 -7.826 16.651 2.109 1.00 0.00 C ATOM 669 O LEU A 42 -7.824 17.343 3.128 1.00 0.00 O ATOM 670 CB LEU A 42 -6.299 14.975 3.319 1.00 0.00 C ATOM 671 CG LEU A 42 -5.942 13.481 3.324 1.00 0.00 C ATOM 672 CD1 LEU A 42 -4.792 13.195 4.286 1.00 0.00 C ATOM 673 CD2 LEU A 42 -7.153 12.639 3.734 1.00 0.00 C ATOM 0 H LEU A 42 -5.150 15.766 1.124 1.00 0.00 H new ATOM 0 HA LEU A 42 -7.709 14.548 1.838 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -5.393 15.570 3.437 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -6.942 15.202 4.169 1.00 0.00 H new ATOM 0 HG LEU A 42 -5.637 13.215 2.312 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -4.560 12.130 4.270 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.913 13.763 3.981 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -5.081 13.488 5.295 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -6.880 11.584 3.732 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -7.475 12.928 4.734 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -7.967 12.805 3.028 1.00 0.00 H new ATOM 794 N ASP A 50 -8.097 17.147 15.394 1.00 0.00 N ATOM 795 CA ASP A 50 -6.743 17.582 15.715 1.00 0.00 C ATOM 796 C ASP A 50 -5.674 16.924 14.848 1.00 0.00 C ATOM 797 O ASP A 50 -4.773 17.614 14.388 1.00 0.00 O ATOM 798 CB ASP A 50 -6.431 17.339 17.196 1.00 0.00 C ATOM 799 CG ASP A 50 -7.449 17.985 18.131 1.00 0.00 C ATOM 800 OD1 ASP A 50 -8.620 17.543 18.079 1.00 0.00 O ATOM 801 OD2 ASP A 50 -7.046 18.909 18.868 1.00 0.00 O ATOM 0 HA ASP A 50 -6.714 18.650 15.501 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -6.402 16.266 17.385 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -5.439 17.729 17.422 1.00 0.00 H new ATOM 806 N ALA A 51 -5.776 15.612 14.628 1.00 0.00 N ATOM 807 CA ALA A 51 -4.901 14.820 13.770 1.00 0.00 C ATOM 808 C ALA A 51 -4.326 15.611 12.594 1.00 0.00 C ATOM 809 O ALA A 51 -3.111 15.675 12.423 1.00 0.00 O ATOM 810 CB ALA A 51 -5.700 13.636 13.233 1.00 0.00 C ATOM 0 H ALA A 51 -6.506 15.049 15.065 1.00 0.00 H new ATOM 0 HA ALA A 51 -4.053 14.498 14.374 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -5.064 13.030 12.588 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -6.055 13.029 14.066 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -6.553 14.002 12.661 1.00 0.00 H new ATOM 816 N GLU A 52 -5.198 16.202 11.773 1.00 0.00 N ATOM 817 CA GLU A 52 -4.789 16.871 10.544 1.00 0.00 C ATOM 818 C GLU A 52 -3.916 18.092 10.865 1.00 0.00 C ATOM 819 O GLU A 52 -2.897 18.345 10.221 1.00 0.00 O ATOM 820 CB GLU A 52 -6.059 17.194 9.735 1.00 0.00 C ATOM 821 CG GLU A 52 -5.817 17.703 8.306 1.00 0.00 C ATOM 822 CD GLU A 52 -5.239 19.113 8.217 1.00 0.00 C ATOM 823 OE1 GLU A 52 -5.604 19.942 9.079 1.00 0.00 O ATOM 824 OE2 GLU A 52 -4.457 19.338 7.269 1.00 0.00 O ATOM 0 H GLU A 52 -6.203 16.228 11.944 1.00 0.00 H new ATOM 0 HA GLU A 52 -4.160 16.230 9.926 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -6.675 16.296 9.684 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -6.634 17.944 10.278 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -5.139 17.015 7.801 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -6.761 17.678 7.762 1.00 0.00 H new ATOM 831 N ILE A 53 -4.313 18.835 11.893 1.00 0.00 N ATOM 832 CA ILE A 53 -3.660 20.053 12.334 1.00 0.00 C ATOM 833 C ILE A 53 -2.280 19.657 12.859 1.00 0.00 C ATOM 834 O ILE A 53 -1.252 20.179 12.433 1.00 0.00 O ATOM 835 CB ILE A 53 -4.505 20.750 13.425 1.00 0.00 C ATOM 836 CG1 ILE A 53 -5.968 21.067 13.042 1.00 0.00 C ATOM 837 CG2 ILE A 53 -3.833 22.072 13.824 1.00 0.00 C ATOM 838 CD1 ILE A 53 -6.864 19.868 12.715 1.00 0.00 C ATOM 0 H ILE A 53 -5.127 18.593 12.459 1.00 0.00 H new ATOM 0 HA ILE A 53 -3.557 20.765 11.515 1.00 0.00 H new ATOM 0 HB ILE A 53 -4.549 20.027 14.240 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -6.424 21.619 13.864 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -5.958 21.731 12.178 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -4.428 22.565 14.593 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.834 21.870 14.211 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.759 22.721 12.951 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -7.864 20.220 12.462 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -6.447 19.322 11.869 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -6.919 19.208 13.581 1.00 0.00 H new ATOM 850 N VAL A 54 -2.269 18.690 13.778 1.00 0.00 N ATOM 851 CA VAL A 54 -1.071 18.107 14.345 1.00 0.00 C ATOM 852 C VAL A 54 -0.149 17.633 13.227 1.00 0.00 C ATOM 853 O VAL A 54 1.051 17.851 13.316 1.00 0.00 O ATOM 854 CB VAL A 54 -1.453 16.989 15.330 1.00 0.00 C ATOM 855 CG1 VAL A 54 -0.224 16.213 15.825 1.00 0.00 C ATOM 856 CG2 VAL A 54 -2.165 17.607 16.541 1.00 0.00 C ATOM 0 H VAL A 54 -3.126 18.284 14.154 1.00 0.00 H new ATOM 0 HA VAL A 54 -0.517 18.853 14.914 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.106 16.292 14.804 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.541 15.434 16.518 1.00 0.00 H new ATOM 0 HG12 VAL A 54 0.285 15.758 14.976 1.00 0.00 H new ATOM 0 HG13 VAL A 54 0.457 16.896 16.333 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.439 16.819 17.243 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.498 18.316 17.032 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -3.064 18.125 16.209 1.00 0.00 H new ATOM 866 N LYS A 55 -0.680 17.023 12.166 1.00 0.00 N ATOM 867 CA LYS A 55 0.122 16.640 11.012 1.00 0.00 C ATOM 868 C LYS A 55 0.768 17.863 10.370 1.00 0.00 C ATOM 869 O LYS A 55 1.984 17.872 10.168 1.00 0.00 O ATOM 870 CB LYS A 55 -0.709 15.832 10.006 1.00 0.00 C ATOM 871 CG LYS A 55 -0.372 14.346 10.122 1.00 0.00 C ATOM 872 CD LYS A 55 -0.741 13.780 11.501 1.00 0.00 C ATOM 873 CE LYS A 55 0.135 12.581 11.854 1.00 0.00 C ATOM 874 NZ LYS A 55 1.527 12.976 12.139 1.00 0.00 N ATOM 0 H LYS A 55 -1.668 16.784 12.086 1.00 0.00 H new ATOM 0 HA LYS A 55 0.928 15.991 11.355 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -1.772 15.988 10.192 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.508 16.181 8.993 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.904 13.792 9.348 1.00 0.00 H new ATOM 0 HG3 LYS A 55 0.693 14.201 9.943 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -0.625 14.555 12.259 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -1.790 13.483 11.507 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -0.282 12.071 12.723 1.00 0.00 H new ATOM 0 HE3 LYS A 55 0.122 11.868 11.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.995 12.227 12.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.037 13.120 11.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 1.532 13.860 12.686 1.00 0.00 H new ATOM 888 N LEU A 56 -0.026 18.893 10.060 1.00 0.00 N ATOM 889 CA LEU A 56 0.515 20.128 9.502 1.00 0.00 C ATOM 890 C LEU A 56 1.660 20.665 10.371 1.00 0.00 C ATOM 891 O LEU A 56 2.676 21.096 9.829 1.00 0.00 O ATOM 892 CB LEU A 56 -0.576 21.195 9.319 1.00 0.00 C ATOM 893 CG LEU A 56 -1.607 20.893 8.220 1.00 0.00 C ATOM 894 CD1 LEU A 56 -2.758 21.899 8.341 1.00 0.00 C ATOM 895 CD2 LEU A 56 -0.998 21.014 6.818 1.00 0.00 C ATOM 0 H LEU A 56 -1.038 18.893 10.186 1.00 0.00 H new ATOM 0 HA LEU A 56 0.913 19.893 8.515 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -1.103 21.319 10.265 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -0.096 22.147 9.094 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.956 19.869 8.352 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -3.499 21.698 7.567 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.223 21.804 9.322 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.371 22.911 8.219 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -1.760 20.793 6.070 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.627 22.028 6.669 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -0.174 20.307 6.717 1.00 0.00 H new ATOM 907 N MET A 57 1.513 20.649 11.702 1.00 0.00 N ATOM 908 CA MET A 57 2.577 21.123 12.583 1.00 0.00 C ATOM 909 C MET A 57 3.776 20.159 12.524 1.00 0.00 C ATOM 910 O MET A 57 4.876 20.530 12.112 1.00 0.00 O ATOM 911 CB MET A 57 2.084 21.281 14.032 1.00 0.00 C ATOM 912 CG MET A 57 0.828 22.137 14.267 1.00 0.00 C ATOM 913 SD MET A 57 0.701 23.788 13.523 1.00 0.00 S ATOM 914 CE MET A 57 -0.185 23.436 11.985 1.00 0.00 C ATOM 0 H MET A 57 0.677 20.317 12.183 1.00 0.00 H new ATOM 0 HA MET A 57 2.891 22.107 12.235 1.00 0.00 H new ATOM 0 HB2 MET A 57 1.892 20.285 14.432 1.00 0.00 H new ATOM 0 HB3 MET A 57 2.897 21.709 14.619 1.00 0.00 H new ATOM 0 HG2 MET A 57 -0.028 21.558 13.920 1.00 0.00 H new ATOM 0 HG3 MET A 57 0.715 22.258 15.344 1.00 0.00 H new ATOM 0 HE1 MET A 57 -0.698 24.336 11.646 1.00 0.00 H new ATOM 0 HE2 MET A 57 0.524 23.113 11.222 1.00 0.00 H new ATOM 0 HE3 MET A 57 -0.916 22.646 12.159 1.00 0.00 H new ATOM 924 N ASP A 58 3.540 18.911 12.941 1.00 0.00 N ATOM 925 CA ASP A 58 4.504 17.821 13.045 1.00 0.00 C ATOM 926 C ASP A 58 5.380 17.732 11.806 1.00 0.00 C ATOM 927 O ASP A 58 6.576 17.495 11.923 1.00 0.00 O ATOM 928 CB ASP A 58 3.773 16.487 13.255 1.00 0.00 C ATOM 929 CG ASP A 58 4.734 15.298 13.263 1.00 0.00 C ATOM 930 OD1 ASP A 58 5.651 15.314 14.111 1.00 0.00 O ATOM 931 OD2 ASP A 58 4.532 14.388 12.426 1.00 0.00 O ATOM 0 H ASP A 58 2.607 18.621 13.233 1.00 0.00 H new ATOM 0 HA ASP A 58 5.145 18.027 13.902 1.00 0.00 H new ATOM 0 HB2 ASP A 58 3.228 16.518 14.198 1.00 0.00 H new ATOM 0 HB3 ASP A 58 3.035 16.350 12.465 1.00 0.00 H new ATOM 936 N ASP A 59 4.785 17.918 10.626 1.00 0.00 N ATOM 937 CA ASP A 59 5.499 17.968 9.362 1.00 0.00 C ATOM 938 C ASP A 59 6.812 18.751 9.462 1.00 0.00 C ATOM 939 O ASP A 59 7.842 18.270 8.991 1.00 0.00 O ATOM 940 CB ASP A 59 4.594 18.598 8.303 1.00 0.00 C ATOM 941 CG ASP A 59 5.302 18.646 6.962 1.00 0.00 C ATOM 942 OD1 ASP A 59 5.586 17.545 6.450 1.00 0.00 O ATOM 943 OD2 ASP A 59 5.567 19.772 6.491 1.00 0.00 O ATOM 0 H ASP A 59 3.777 18.039 10.527 1.00 0.00 H new ATOM 0 HA ASP A 59 5.759 16.947 9.083 1.00 0.00 H new ATOM 0 HB2 ASP A 59 3.672 18.023 8.214 1.00 0.00 H new ATOM 0 HB3 ASP A 59 4.313 19.606 8.609 1.00 0.00 H new ATOM 948 N LEU A 60 6.790 19.942 10.070 1.00 0.00 N ATOM 949 CA LEU A 60 7.982 20.773 10.187 1.00 0.00 C ATOM 950 C LEU A 60 9.031 20.051 11.036 1.00 0.00 C ATOM 951 O LEU A 60 10.169 19.873 10.611 1.00 0.00 O ATOM 952 CB LEU A 60 7.647 22.143 10.799 1.00 0.00 C ATOM 953 CG LEU A 60 6.929 23.114 9.844 1.00 0.00 C ATOM 954 CD1 LEU A 60 5.471 22.723 9.575 1.00 0.00 C ATOM 955 CD2 LEU A 60 6.947 24.518 10.461 1.00 0.00 C ATOM 0 H LEU A 60 5.954 20.349 10.489 1.00 0.00 H new ATOM 0 HA LEU A 60 8.383 20.945 9.188 1.00 0.00 H new ATOM 0 HB2 LEU A 60 7.021 21.990 11.678 1.00 0.00 H new ATOM 0 HB3 LEU A 60 8.571 22.609 11.142 1.00 0.00 H new ATOM 0 HG LEU A 60 7.460 23.081 8.893 1.00 0.00 H new ATOM 0 HD11 LEU A 60 5.020 23.446 8.895 1.00 0.00 H new ATOM 0 HD12 LEU A 60 5.438 21.731 9.124 1.00 0.00 H new ATOM 0 HD13 LEU A 60 4.918 22.714 10.514 1.00 0.00 H new ATOM 0 HD21 LEU A 60 6.441 25.215 9.793 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.434 24.499 11.423 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.979 24.838 10.606 1.00 0.00 H new ATOM 967 N ASP A 61 8.641 19.632 12.241 1.00 0.00 N ATOM 968 CA ASP A 61 9.527 18.964 13.191 1.00 0.00 C ATOM 969 C ASP A 61 10.072 17.660 12.617 1.00 0.00 C ATOM 970 O ASP A 61 11.196 17.276 12.911 1.00 0.00 O ATOM 971 CB ASP A 61 8.778 18.683 14.499 1.00 0.00 C ATOM 972 CG ASP A 61 8.209 19.951 15.123 1.00 0.00 C ATOM 973 OD1 ASP A 61 7.101 20.340 14.693 1.00 0.00 O ATOM 974 OD2 ASP A 61 8.894 20.511 16.006 1.00 0.00 O ATOM 0 H ASP A 61 7.689 19.749 12.587 1.00 0.00 H new ATOM 0 HA ASP A 61 10.369 19.627 13.389 1.00 0.00 H new ATOM 0 HB2 ASP A 61 7.968 17.980 14.307 1.00 0.00 H new ATOM 0 HB3 ASP A 61 9.455 18.204 15.207 1.00 0.00 H new ATOM 979 N ARG A 62 9.273 16.963 11.813 1.00 0.00 N ATOM 980 CA ARG A 62 9.697 15.777 11.096 1.00 0.00 C ATOM 981 C ARG A 62 10.763 16.181 10.072 1.00 0.00 C ATOM 982 O ARG A 62 11.881 15.669 10.072 1.00 0.00 O ATOM 983 CB ARG A 62 8.451 15.130 10.467 1.00 0.00 C ATOM 984 CG ARG A 62 8.757 13.798 9.774 1.00 0.00 C ATOM 985 CD ARG A 62 7.503 13.117 9.208 1.00 0.00 C ATOM 986 NE ARG A 62 6.495 12.864 10.253 1.00 0.00 N ATOM 987 CZ ARG A 62 5.705 11.787 10.376 1.00 0.00 C ATOM 988 NH1 ARG A 62 5.767 10.764 9.515 1.00 0.00 N ATOM 989 NH2 ARG A 62 4.817 11.765 11.374 1.00 0.00 N ATOM 0 H ARG A 62 8.299 17.215 11.643 1.00 0.00 H new ATOM 0 HA ARG A 62 10.154 15.034 11.750 1.00 0.00 H new ATOM 0 HB2 ARG A 62 7.702 14.967 11.242 1.00 0.00 H new ATOM 0 HB3 ARG A 62 8.016 15.819 9.743 1.00 0.00 H new ATOM 0 HG2 ARG A 62 9.467 13.970 8.965 1.00 0.00 H new ATOM 0 HG3 ARG A 62 9.239 13.127 10.485 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.069 13.745 8.430 1.00 0.00 H new ATOM 0 HD3 ARG A 62 7.783 12.174 8.738 1.00 0.00 H new ATOM 0 HE ARG A 62 6.386 13.589 10.962 1.00 0.00 H new ATOM 0 HH11 ARG A 62 6.428 10.790 8.739 1.00 0.00 H new ATOM 0 HH12 ARG A 62 5.153 9.958 9.635 1.00 0.00 H new ATOM 0 HH21 ARG A 62 4.753 12.554 12.017 1.00 0.00 H new ATOM 0 HH22 ARG A 62 4.203 10.959 11.492 1.00 0.00 H new ATOM 1068 N GLU A 67 14.441 15.007 3.724 1.00 0.00 N ATOM 1069 CA GLU A 67 13.333 14.364 3.037 1.00 0.00 C ATOM 1070 C GLU A 67 12.854 13.159 3.851 1.00 0.00 C ATOM 1071 O GLU A 67 13.644 12.550 4.569 1.00 0.00 O ATOM 1072 CB GLU A 67 13.757 13.932 1.628 1.00 0.00 C ATOM 1073 CG GLU A 67 14.340 15.092 0.813 1.00 0.00 C ATOM 1074 CD GLU A 67 14.272 14.798 -0.683 1.00 0.00 C ATOM 1075 OE1 GLU A 67 13.151 14.916 -1.225 1.00 0.00 O ATOM 1076 OE2 GLU A 67 15.336 14.469 -1.250 1.00 0.00 O ATOM 0 HA GLU A 67 12.511 15.073 2.940 1.00 0.00 H new ATOM 0 HB2 GLU A 67 14.497 13.135 1.702 1.00 0.00 H new ATOM 0 HB3 GLU A 67 12.896 13.519 1.103 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.791 16.008 1.033 1.00 0.00 H new ATOM 0 HG3 GLU A 67 15.376 15.263 1.107 1.00 0.00 H new ATOM 1083 N VAL A 68 11.576 12.804 3.709 1.00 0.00 N ATOM 1084 CA VAL A 68 11.001 11.583 4.251 1.00 0.00 C ATOM 1085 C VAL A 68 10.848 10.590 3.097 1.00 0.00 C ATOM 1086 O VAL A 68 10.556 11.003 1.971 1.00 0.00 O ATOM 1087 CB VAL A 68 9.660 11.881 4.953 1.00 0.00 C ATOM 1088 CG1 VAL A 68 9.801 13.008 5.983 1.00 0.00 C ATOM 1089 CG2 VAL A 68 8.511 12.200 3.995 1.00 0.00 C ATOM 0 H VAL A 68 10.900 13.375 3.201 1.00 0.00 H new ATOM 0 HA VAL A 68 11.650 11.149 5.011 1.00 0.00 H new ATOM 0 HB VAL A 68 9.400 10.952 5.460 1.00 0.00 H new ATOM 0 HG11 VAL A 68 8.837 13.190 6.457 1.00 0.00 H new ATOM 0 HG12 VAL A 68 10.529 12.719 6.741 1.00 0.00 H new ATOM 0 HG13 VAL A 68 10.137 13.917 5.484 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.604 12.397 4.567 1.00 0.00 H new ATOM 0 HG22 VAL A 68 8.765 13.079 3.402 1.00 0.00 H new ATOM 0 HG23 VAL A 68 8.344 11.351 3.332 1.00 0.00 H new ATOM 1099 N ASN A 69 11.052 9.294 3.361 1.00 0.00 N ATOM 1100 CA ASN A 69 10.818 8.239 2.378 1.00 0.00 C ATOM 1101 C ASN A 69 9.363 7.785 2.394 1.00 0.00 C ATOM 1102 O ASN A 69 8.622 8.093 3.329 1.00 0.00 O ATOM 1103 CB ASN A 69 11.774 7.049 2.576 1.00 0.00 C ATOM 1104 CG ASN A 69 11.173 5.932 3.429 1.00 0.00 C ATOM 1105 OD1 ASN A 69 10.632 4.960 2.909 1.00 0.00 O ATOM 1106 ND2 ASN A 69 11.235 6.062 4.747 1.00 0.00 N ATOM 0 H ASN A 69 11.384 8.951 4.263 1.00 0.00 H new ATOM 0 HA ASN A 69 11.028 8.661 1.395 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.049 6.646 1.601 1.00 0.00 H new ATOM 0 HB3 ASN A 69 12.692 7.402 3.045 1.00 0.00 H new ATOM 0 HD21 ASN A 69 10.829 5.346 5.350 1.00 0.00 H new ATOM 0 HD22 ASN A 69 11.689 6.878 5.158 1.00 0.00 H new ATOM 1113 N PHE A 70 8.990 7.002 1.377 1.00 0.00 N ATOM 1114 CA PHE A 70 7.699 6.334 1.279 1.00 0.00 C ATOM 1115 C PHE A 70 7.159 5.889 2.640 1.00 0.00 C ATOM 1116 O PHE A 70 6.115 6.375 3.055 1.00 0.00 O ATOM 1117 CB PHE A 70 7.786 5.159 0.302 1.00 0.00 C ATOM 1118 CG PHE A 70 6.473 4.434 0.070 1.00 0.00 C ATOM 1119 CD1 PHE A 70 5.377 5.121 -0.487 1.00 0.00 C ATOM 1120 CD2 PHE A 70 6.358 3.060 0.358 1.00 0.00 C ATOM 1121 CE1 PHE A 70 4.190 4.435 -0.790 1.00 0.00 C ATOM 1122 CE2 PHE A 70 5.165 2.377 0.066 1.00 0.00 C ATOM 1123 CZ PHE A 70 4.083 3.061 -0.515 1.00 0.00 C ATOM 0 H PHE A 70 9.598 6.814 0.580 1.00 0.00 H new ATOM 0 HA PHE A 70 6.984 7.061 0.893 1.00 0.00 H new ATOM 0 HB2 PHE A 70 8.158 5.525 -0.655 1.00 0.00 H new ATOM 0 HB3 PHE A 70 8.519 4.445 0.677 1.00 0.00 H new ATOM 0 HD1 PHE A 70 5.450 6.181 -0.682 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.187 2.531 0.804 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.359 4.963 -1.234 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.079 1.324 0.289 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.171 2.532 -0.750 1.00 0.00 H new ATOM 1133 N GLN A 71 7.849 5.009 3.373 1.00 0.00 N ATOM 1134 CA GLN A 71 7.279 4.484 4.613 1.00 0.00 C ATOM 1135 C GLN A 71 7.058 5.585 5.657 1.00 0.00 C ATOM 1136 O GLN A 71 6.123 5.499 6.447 1.00 0.00 O ATOM 1137 CB GLN A 71 8.108 3.324 5.185 1.00 0.00 C ATOM 1138 CG GLN A 71 7.284 2.476 6.178 1.00 0.00 C ATOM 1139 CD GLN A 71 6.144 1.718 5.495 1.00 0.00 C ATOM 1140 OE1 GLN A 71 6.320 1.217 4.390 1.00 0.00 O ATOM 1141 NE2 GLN A 71 4.972 1.617 6.121 1.00 0.00 N ATOM 0 H GLN A 71 8.776 4.655 3.137 1.00 0.00 H new ATOM 0 HA GLN A 71 6.299 4.082 4.357 1.00 0.00 H new ATOM 0 HB2 GLN A 71 8.461 2.692 4.371 1.00 0.00 H new ATOM 0 HB3 GLN A 71 8.991 3.719 5.688 1.00 0.00 H new ATOM 0 HG2 GLN A 71 7.942 1.764 6.676 1.00 0.00 H new ATOM 0 HG3 GLN A 71 6.873 3.125 6.951 1.00 0.00 H new ATOM 0 HE21 GLN A 71 4.847 2.041 7.040 1.00 0.00 H new ATOM 0 HE22 GLN A 71 4.200 1.115 5.681 1.00 0.00 H new ATOM 1150 N GLU A 72 7.891 6.628 5.679 1.00 0.00 N ATOM 1151 CA GLU A 72 7.691 7.744 6.596 1.00 0.00 C ATOM 1152 C GLU A 72 6.453 8.547 6.183 1.00 0.00 C ATOM 1153 O GLU A 72 5.649 8.926 7.036 1.00 0.00 O ATOM 1154 CB GLU A 72 8.940 8.621 6.632 1.00 0.00 C ATOM 1155 CG GLU A 72 10.103 7.947 7.363 1.00 0.00 C ATOM 1156 CD GLU A 72 11.407 8.679 7.066 1.00 0.00 C ATOM 1157 OE1 GLU A 72 11.906 8.486 5.933 1.00 0.00 O ATOM 1158 OE2 GLU A 72 11.861 9.431 7.953 1.00 0.00 O ATOM 0 H GLU A 72 8.707 6.720 5.073 1.00 0.00 H new ATOM 0 HA GLU A 72 7.521 7.361 7.602 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.244 8.859 5.612 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.704 9.565 7.123 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.915 7.945 8.437 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.183 6.906 7.052 1.00 0.00 H new ATOM 1165 N TYR A 73 6.280 8.789 4.881 1.00 0.00 N ATOM 1166 CA TYR A 73 5.050 9.367 4.347 1.00 0.00 C ATOM 1167 C TYR A 73 3.848 8.515 4.784 1.00 0.00 C ATOM 1168 O TYR A 73 2.885 9.020 5.361 1.00 0.00 O ATOM 1169 CB TYR A 73 5.159 9.518 2.817 1.00 0.00 C ATOM 1170 CG TYR A 73 3.877 9.294 2.031 1.00 0.00 C ATOM 1171 CD1 TYR A 73 2.902 10.306 1.943 1.00 0.00 C ATOM 1172 CD2 TYR A 73 3.664 8.069 1.370 1.00 0.00 C ATOM 1173 CE1 TYR A 73 1.748 10.106 1.166 1.00 0.00 C ATOM 1174 CE2 TYR A 73 2.489 7.855 0.631 1.00 0.00 C ATOM 1175 CZ TYR A 73 1.549 8.887 0.493 1.00 0.00 C ATOM 1176 OH TYR A 73 0.458 8.722 -0.308 1.00 0.00 O ATOM 0 H TYR A 73 6.986 8.590 4.173 1.00 0.00 H new ATOM 0 HA TYR A 73 4.896 10.368 4.749 1.00 0.00 H new ATOM 0 HB2 TYR A 73 5.526 10.520 2.596 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.911 8.816 2.455 1.00 0.00 H new ATOM 0 HD1 TYR A 73 3.041 11.237 2.473 1.00 0.00 H new ATOM 0 HD2 TYR A 73 4.409 7.289 1.432 1.00 0.00 H new ATOM 0 HE1 TYR A 73 1.011 10.891 1.085 1.00 0.00 H new ATOM 0 HE2 TYR A 73 2.309 6.896 0.169 1.00 0.00 H new ATOM 0 HH TYR A 73 0.637 8.016 -0.963 1.00 0.00 H new ATOM 1186 N ILE A 74 3.920 7.204 4.554 1.00 0.00 N ATOM 1187 CA ILE A 74 2.897 6.265 4.981 1.00 0.00 C ATOM 1188 C ILE A 74 2.679 6.375 6.494 1.00 0.00 C ATOM 1189 O ILE A 74 1.542 6.329 6.946 1.00 0.00 O ATOM 1190 CB ILE A 74 3.266 4.834 4.554 1.00 0.00 C ATOM 1191 CG1 ILE A 74 3.350 4.627 3.027 1.00 0.00 C ATOM 1192 CG2 ILE A 74 2.272 3.837 5.131 1.00 0.00 C ATOM 1193 CD1 ILE A 74 1.999 4.675 2.305 1.00 0.00 C ATOM 0 H ILE A 74 4.698 6.766 4.062 1.00 0.00 H new ATOM 0 HA ILE A 74 1.955 6.514 4.493 1.00 0.00 H new ATOM 0 HB ILE A 74 4.267 4.666 4.951 1.00 0.00 H new ATOM 0 HG12 ILE A 74 4.001 5.392 2.604 1.00 0.00 H new ATOM 0 HG13 ILE A 74 3.820 3.664 2.829 1.00 0.00 H new ATOM 0 HG21 ILE A 74 2.546 2.829 4.820 1.00 0.00 H new ATOM 0 HG22 ILE A 74 2.286 3.898 6.219 1.00 0.00 H new ATOM 0 HG23 ILE A 74 1.271 4.069 4.767 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.152 4.520 1.237 1.00 0.00 H new ATOM 0 HD12 ILE A 74 1.350 3.892 2.696 1.00 0.00 H new ATOM 0 HD13 ILE A 74 1.534 5.647 2.468 1.00 0.00 H new ATOM 1205 N THR A 75 3.739 6.533 7.289 1.00 0.00 N ATOM 1206 CA THR A 75 3.622 6.715 8.731 1.00 0.00 C ATOM 1207 C THR A 75 2.902 8.025 9.061 1.00 0.00 C ATOM 1208 O THR A 75 2.093 8.055 9.982 1.00 0.00 O ATOM 1209 CB THR A 75 4.994 6.603 9.412 1.00 0.00 C ATOM 1210 OG1 THR A 75 5.549 5.335 9.130 1.00 0.00 O ATOM 1211 CG2 THR A 75 4.890 6.729 10.935 1.00 0.00 C ATOM 0 H THR A 75 4.700 6.538 6.948 1.00 0.00 H new ATOM 0 HA THR A 75 3.007 5.911 9.134 1.00 0.00 H new ATOM 0 HB THR A 75 5.614 7.413 9.029 1.00 0.00 H new ATOM 0 HG1 THR A 75 5.864 5.315 8.202 1.00 0.00 H new ATOM 0 HG21 THR A 75 5.883 6.644 11.376 1.00 0.00 H new ATOM 0 HG22 THR A 75 4.461 7.698 11.191 1.00 0.00 H new ATOM 0 HG23 THR A 75 4.252 5.935 11.323 1.00 0.00 H new ATOM 1219 N PHE A 76 3.162 9.106 8.317 1.00 0.00 N ATOM 1220 CA PHE A 76 2.406 10.350 8.450 1.00 0.00 C ATOM 1221 C PHE A 76 0.910 10.051 8.272 1.00 0.00 C ATOM 1222 O PHE A 76 0.099 10.347 9.150 1.00 0.00 O ATOM 1223 CB PHE A 76 2.932 11.394 7.449 1.00 0.00 C ATOM 1224 CG PHE A 76 2.453 12.821 7.646 1.00 0.00 C ATOM 1225 CD1 PHE A 76 3.126 13.665 8.550 1.00 0.00 C ATOM 1226 CD2 PHE A 76 1.518 13.374 6.750 1.00 0.00 C ATOM 1227 CE1 PHE A 76 2.880 15.048 8.550 1.00 0.00 C ATOM 1228 CE2 PHE A 76 1.286 14.761 6.736 1.00 0.00 C ATOM 1229 CZ PHE A 76 1.970 15.599 7.633 1.00 0.00 C ATOM 0 H PHE A 76 3.898 9.141 7.611 1.00 0.00 H new ATOM 0 HA PHE A 76 2.539 10.776 9.444 1.00 0.00 H new ATOM 0 HB2 PHE A 76 4.021 11.390 7.493 1.00 0.00 H new ATOM 0 HB3 PHE A 76 2.652 11.075 6.445 1.00 0.00 H new ATOM 0 HD1 PHE A 76 3.836 13.246 9.248 1.00 0.00 H new ATOM 0 HD2 PHE A 76 0.977 12.731 6.071 1.00 0.00 H new ATOM 0 HE1 PHE A 76 3.390 15.687 9.255 1.00 0.00 H new ATOM 0 HE2 PHE A 76 0.581 15.183 6.035 1.00 0.00 H new ATOM 0 HZ PHE A 76 1.796 16.665 7.617 1.00 0.00 H new ATOM 1239 N LEU A 77 0.546 9.398 7.163 1.00 0.00 N ATOM 1240 CA LEU A 77 -0.843 9.005 6.924 1.00 0.00 C ATOM 1241 C LEU A 77 -1.374 8.082 8.031 1.00 0.00 C ATOM 1242 O LEU A 77 -2.507 8.228 8.480 1.00 0.00 O ATOM 1243 CB LEU A 77 -0.997 8.330 5.555 1.00 0.00 C ATOM 1244 CG LEU A 77 -0.557 9.185 4.355 1.00 0.00 C ATOM 1245 CD1 LEU A 77 -0.903 8.419 3.073 1.00 0.00 C ATOM 1246 CD2 LEU A 77 -1.227 10.564 4.327 1.00 0.00 C ATOM 0 H LEU A 77 1.193 9.132 6.420 1.00 0.00 H new ATOM 0 HA LEU A 77 -1.438 9.918 6.934 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.418 7.406 5.555 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.042 8.052 5.420 1.00 0.00 H new ATOM 0 HG LEU A 77 0.515 9.362 4.439 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -0.600 9.006 2.206 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.377 7.464 3.067 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.978 8.242 3.034 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.877 11.121 3.458 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.309 10.442 4.268 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.972 11.111 5.235 1.00 0.00 H new ATOM 1258 N GLY A 78 -0.565 7.122 8.474 1.00 0.00 N ATOM 1259 CA GLY A 78 -0.931 6.151 9.491 1.00 0.00 C ATOM 1260 C GLY A 78 -1.235 6.839 10.818 1.00 0.00 C ATOM 1261 O GLY A 78 -2.230 6.534 11.470 1.00 0.00 O ATOM 0 H GLY A 78 0.385 6.999 8.124 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.803 5.585 9.162 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -0.119 5.436 9.625 1.00 0.00 H new ATOM 1265 N ALA A 79 -0.379 7.773 11.226 1.00 0.00 N ATOM 1266 CA ALA A 79 -0.571 8.542 12.440 1.00 0.00 C ATOM 1267 C ALA A 79 -1.806 9.437 12.305 1.00 0.00 C ATOM 1268 O ALA A 79 -2.622 9.484 13.220 1.00 0.00 O ATOM 1269 CB ALA A 79 0.704 9.328 12.755 1.00 0.00 C ATOM 0 H ALA A 79 0.471 8.014 10.716 1.00 0.00 H new ATOM 0 HA ALA A 79 -0.757 7.877 13.283 1.00 0.00 H new ATOM 0 HB1 ALA A 79 0.559 9.906 13.668 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.534 8.635 12.892 1.00 0.00 H new ATOM 0 HB3 ALA A 79 0.928 10.004 11.930 1.00 0.00 H new ATOM 1275 N LEU A 80 -1.977 10.121 11.168 1.00 0.00 N ATOM 1276 CA LEU A 80 -3.193 10.889 10.898 1.00 0.00 C ATOM 1277 C LEU A 80 -4.426 10.011 11.129 1.00 0.00 C ATOM 1278 O LEU A 80 -5.304 10.336 11.935 1.00 0.00 O ATOM 1279 CB LEU A 80 -3.153 11.410 9.452 1.00 0.00 C ATOM 1280 CG LEU A 80 -4.416 12.174 9.035 1.00 0.00 C ATOM 1281 CD1 LEU A 80 -4.355 13.613 9.538 1.00 0.00 C ATOM 1282 CD2 LEU A 80 -4.539 12.178 7.511 1.00 0.00 C ATOM 0 H LEU A 80 -1.285 10.157 10.419 1.00 0.00 H new ATOM 0 HA LEU A 80 -3.251 11.740 11.576 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -2.289 12.064 9.335 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -3.009 10.567 8.776 1.00 0.00 H new ATOM 0 HG LEU A 80 -5.283 11.678 9.472 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.258 14.143 9.235 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -4.281 13.615 10.625 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -3.483 14.110 9.114 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -5.438 12.722 7.220 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.665 12.663 7.077 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -4.602 11.152 7.148 1.00 0.00 H new ATOM 1294 N ALA A 81 -4.460 8.890 10.403 1.00 0.00 N ATOM 1295 CA ALA A 81 -5.505 7.892 10.488 1.00 0.00 C ATOM 1296 C ALA A 81 -5.764 7.535 11.943 1.00 0.00 C ATOM 1297 O ALA A 81 -6.894 7.667 12.401 1.00 0.00 O ATOM 1298 CB ALA A 81 -5.105 6.656 9.678 1.00 0.00 C ATOM 0 H ALA A 81 -3.736 8.655 9.724 1.00 0.00 H new ATOM 0 HA ALA A 81 -6.428 8.292 10.069 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -5.894 5.907 9.744 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.957 6.937 8.635 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.178 6.244 10.077 1.00 0.00 H new ATOM 1304 N MET A 82 -4.726 7.106 12.662 1.00 0.00 N ATOM 1305 CA MET A 82 -4.810 6.731 14.063 1.00 0.00 C ATOM 1306 C MET A 82 -5.461 7.840 14.891 1.00 0.00 C ATOM 1307 O MET A 82 -6.419 7.580 15.614 1.00 0.00 O ATOM 1308 CB MET A 82 -3.402 6.392 14.571 1.00 0.00 C ATOM 1309 CG MET A 82 -3.411 5.784 15.975 1.00 0.00 C ATOM 1310 SD MET A 82 -1.784 5.404 16.675 1.00 0.00 S ATOM 1311 CE MET A 82 -1.131 4.260 15.438 1.00 0.00 C ATOM 0 H MET A 82 -3.788 7.010 12.274 1.00 0.00 H new ATOM 0 HA MET A 82 -5.444 5.851 14.169 1.00 0.00 H new ATOM 0 HB2 MET A 82 -2.929 5.694 13.880 1.00 0.00 H new ATOM 0 HB3 MET A 82 -2.794 7.297 14.575 1.00 0.00 H new ATOM 0 HG2 MET A 82 -3.923 6.473 16.646 1.00 0.00 H new ATOM 0 HG3 MET A 82 -3.999 4.867 15.950 1.00 0.00 H new ATOM 0 HE1 MET A 82 -0.246 3.762 15.834 1.00 0.00 H new ATOM 0 HE2 MET A 82 -1.889 3.515 15.196 1.00 0.00 H new ATOM 0 HE3 MET A 82 -0.864 4.812 14.537 1.00 0.00 H new ATOM 1321 N ILE A 83 -4.928 9.062 14.814 1.00 0.00 N ATOM 1322 CA ILE A 83 -5.348 10.144 15.692 1.00 0.00 C ATOM 1323 C ILE A 83 -6.822 10.496 15.458 1.00 0.00 C ATOM 1324 O ILE A 83 -7.545 10.670 16.442 1.00 0.00 O ATOM 1325 CB ILE A 83 -4.419 11.369 15.585 1.00 0.00 C ATOM 1326 CG1 ILE A 83 -2.960 11.044 15.955 1.00 0.00 C ATOM 1327 CG2 ILE A 83 -4.903 12.488 16.529 1.00 0.00 C ATOM 1328 CD1 ILE A 83 -2.001 12.063 15.324 1.00 0.00 C ATOM 0 H ILE A 83 -4.201 9.322 14.147 1.00 0.00 H new ATOM 0 HA ILE A 83 -5.261 9.794 16.721 1.00 0.00 H new ATOM 0 HB ILE A 83 -4.454 11.686 14.543 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -2.844 11.051 17.039 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -2.708 10.040 15.614 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -4.239 13.348 16.444 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -5.916 12.783 16.254 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -4.897 12.125 17.557 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -0.975 11.815 15.598 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -2.104 12.036 14.239 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -2.242 13.062 15.686 1.00 0.00 H new ATOM 1340 N TYR A 84 -7.277 10.629 14.200 1.00 0.00 N ATOM 1341 CA TYR A 84 -8.685 10.969 13.967 1.00 0.00 C ATOM 1342 C TYR A 84 -9.637 9.766 14.008 1.00 0.00 C ATOM 1343 O TYR A 84 -10.769 9.906 14.474 1.00 0.00 O ATOM 1344 CB TYR A 84 -8.933 12.030 12.877 1.00 0.00 C ATOM 1345 CG TYR A 84 -8.421 11.873 11.456 1.00 0.00 C ATOM 1346 CD1 TYR A 84 -8.512 10.648 10.773 1.00 0.00 C ATOM 1347 CD2 TYR A 84 -8.182 13.052 10.723 1.00 0.00 C ATOM 1348 CE1 TYR A 84 -8.358 10.605 9.373 1.00 0.00 C ATOM 1349 CE2 TYR A 84 -7.963 13.005 9.339 1.00 0.00 C ATOM 1350 CZ TYR A 84 -8.098 11.786 8.655 1.00 0.00 C ATOM 1351 OH TYR A 84 -8.055 11.766 7.292 1.00 0.00 O ATOM 0 H TYR A 84 -6.712 10.511 13.359 1.00 0.00 H new ATOM 0 HA TYR A 84 -8.988 11.525 14.854 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -10.013 12.159 12.807 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -8.524 12.967 13.255 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -8.700 9.738 11.322 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -8.167 14.004 11.233 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -8.440 9.663 8.850 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -7.692 13.902 8.802 1.00 0.00 H new ATOM 0 HH TYR A 84 -8.799 11.228 6.949 1.00 0.00 H new ATOM 1361 N ASN A 85 -9.196 8.564 13.624 1.00 0.00 N ATOM 1362 CA ASN A 85 -9.988 7.352 13.837 1.00 0.00 C ATOM 1363 C ASN A 85 -9.817 6.913 15.287 1.00 0.00 C ATOM 1364 O ASN A 85 -9.171 5.898 15.569 1.00 0.00 O ATOM 1365 CB ASN A 85 -9.627 6.214 12.871 1.00 0.00 C ATOM 1366 CG ASN A 85 -9.988 6.535 11.427 1.00 0.00 C ATOM 1367 OD1 ASN A 85 -11.048 6.154 10.942 1.00 0.00 O ATOM 1368 ND2 ASN A 85 -9.101 7.223 10.719 1.00 0.00 N ATOM 0 H ASN A 85 -8.298 8.406 13.166 1.00 0.00 H new ATOM 0 HA ASN A 85 -11.032 7.588 13.630 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -8.558 6.011 12.938 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -10.144 5.305 13.177 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -9.292 7.449 9.743 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -8.228 7.526 11.151 1.00 0.00 H new ATOM 1375 N GLU A 86 -10.427 7.680 16.197 1.00 0.00 N ATOM 1376 CA GLU A 86 -10.491 7.410 17.627 1.00 0.00 C ATOM 1377 C GLU A 86 -11.301 6.129 17.869 1.00 0.00 C ATOM 1378 O GLU A 86 -12.459 6.157 18.277 1.00 0.00 O ATOM 1379 CB GLU A 86 -11.048 8.648 18.344 1.00 0.00 C ATOM 1380 CG GLU A 86 -10.933 8.538 19.870 1.00 0.00 C ATOM 1381 CD GLU A 86 -11.241 9.876 20.535 1.00 0.00 C ATOM 1382 OE1 GLU A 86 -10.308 10.708 20.582 1.00 0.00 O ATOM 1383 OE2 GLU A 86 -12.401 10.048 20.967 1.00 0.00 O ATOM 0 H GLU A 86 -10.909 8.542 15.940 1.00 0.00 H new ATOM 0 HA GLU A 86 -9.501 7.226 18.044 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -10.511 9.534 18.004 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -12.094 8.784 18.070 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -11.622 7.777 20.237 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -9.928 8.215 20.141 1.00 0.00 H new ATOM 1390 N ALA A 87 -10.656 5.010 17.553 1.00 0.00 N ATOM 1391 CA ALA A 87 -11.176 3.658 17.462 1.00 0.00 C ATOM 1392 C ALA A 87 -9.974 2.733 17.265 1.00 0.00 C ATOM 1393 O ALA A 87 -9.831 1.743 17.978 1.00 0.00 O ATOM 1394 CB ALA A 87 -12.159 3.543 16.291 1.00 0.00 C ATOM 0 H ALA A 87 -9.660 5.035 17.334 1.00 0.00 H new ATOM 0 HA ALA A 87 -11.723 3.384 18.364 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -12.541 2.524 16.235 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -12.989 4.233 16.443 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -11.647 3.790 15.361 1.00 0.00 H new ATOM 1400 N LEU A 88 -9.074 3.092 16.335 1.00 0.00 N ATOM 1401 CA LEU A 88 -7.777 2.427 16.228 1.00 0.00 C ATOM 1402 C LEU A 88 -7.045 2.580 17.560 1.00 0.00 C ATOM 1403 O LEU A 88 -6.471 1.622 18.071 1.00 0.00 O ATOM 1404 CB LEU A 88 -6.938 3.024 15.087 1.00 0.00 C ATOM 1405 CG LEU A 88 -7.388 2.589 13.684 1.00 0.00 C ATOM 1406 CD1 LEU A 88 -6.594 3.387 12.643 1.00 0.00 C ATOM 1407 CD2 LEU A 88 -7.140 1.093 13.437 1.00 0.00 C ATOM 0 H LEU A 88 -9.225 3.835 15.653 1.00 0.00 H new ATOM 0 HA LEU A 88 -7.931 1.372 16.001 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -6.980 4.111 15.150 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -5.896 2.737 15.228 1.00 0.00 H new ATOM 0 HG LEU A 88 -8.459 2.776 13.603 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -6.904 3.088 11.642 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.784 4.452 12.779 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -5.529 3.189 12.768 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -7.473 0.830 12.433 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -6.075 0.880 13.534 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -7.695 0.506 14.169 1.00 0.00 H new ATOM 1469 N ALA B 2 -14.950 12.212 2.313 1.00 0.00 N ATOM 1470 CA ALA B 2 -13.954 11.158 2.194 1.00 0.00 C ATOM 1471 C ALA B 2 -13.140 11.366 0.915 1.00 0.00 C ATOM 1472 O ALA B 2 -13.342 10.671 -0.082 1.00 0.00 O ATOM 1473 CB ALA B 2 -14.627 9.783 2.233 1.00 0.00 C ATOM 0 HA ALA B 2 -13.267 11.202 3.039 1.00 0.00 H new ATOM 0 HB1 ALA B 2 -13.869 9.004 2.143 1.00 0.00 H new ATOM 0 HB2 ALA B 2 -15.158 9.665 3.177 1.00 0.00 H new ATOM 0 HB3 ALA B 2 -15.333 9.700 1.407 1.00 0.00 H new ATOM 1479 N SER B 3 -12.223 12.337 0.953 1.00 0.00 N ATOM 1480 CA SER B 3 -11.256 12.627 -0.096 1.00 0.00 C ATOM 1481 C SER B 3 -10.536 11.340 -0.530 1.00 0.00 C ATOM 1482 O SER B 3 -10.468 10.403 0.263 1.00 0.00 O ATOM 1483 CB SER B 3 -10.256 13.653 0.461 1.00 0.00 C ATOM 1484 OG SER B 3 -10.781 14.340 1.584 1.00 0.00 O ATOM 0 H SER B 3 -12.135 12.966 1.751 1.00 0.00 H new ATOM 0 HA SER B 3 -11.756 13.032 -0.976 1.00 0.00 H new ATOM 0 HB2 SER B 3 -9.333 13.146 0.743 1.00 0.00 H new ATOM 0 HB3 SER B 3 -10.000 14.371 -0.318 1.00 0.00 H new ATOM 0 HG SER B 3 -10.119 14.983 1.913 1.00 0.00 H new ATOM 1490 N PRO B 4 -9.962 11.267 -1.745 1.00 0.00 N ATOM 1491 CA PRO B 4 -9.366 10.042 -2.268 1.00 0.00 C ATOM 1492 C PRO B 4 -8.384 9.408 -1.279 1.00 0.00 C ATOM 1493 O PRO B 4 -8.483 8.218 -0.984 1.00 0.00 O ATOM 1494 CB PRO B 4 -8.713 10.419 -3.604 1.00 0.00 C ATOM 1495 CG PRO B 4 -8.606 11.945 -3.557 1.00 0.00 C ATOM 1496 CD PRO B 4 -9.801 12.352 -2.696 1.00 0.00 C ATOM 0 HA PRO B 4 -10.122 9.272 -2.421 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -7.733 9.955 -3.712 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -9.317 10.089 -4.449 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -7.663 12.269 -3.116 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -8.660 12.383 -4.554 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -9.618 13.299 -2.188 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -10.698 12.483 -3.301 1.00 0.00 H new ATOM 1504 N LEU B 5 -7.468 10.209 -0.723 1.00 0.00 N ATOM 1505 CA LEU B 5 -6.606 9.735 0.350 1.00 0.00 C ATOM 1506 C LEU B 5 -7.403 9.177 1.525 1.00 0.00 C ATOM 1507 O LEU B 5 -7.131 8.067 1.965 1.00 0.00 O ATOM 1508 CB LEU B 5 -5.658 10.834 0.853 1.00 0.00 C ATOM 1509 CG LEU B 5 -4.215 10.730 0.351 1.00 0.00 C ATOM 1510 CD1 LEU B 5 -3.369 11.787 1.078 1.00 0.00 C ATOM 1511 CD2 LEU B 5 -3.586 9.355 0.639 1.00 0.00 C ATOM 0 H LEU B 5 -7.310 11.178 -0.999 1.00 0.00 H new ATOM 0 HA LEU B 5 -6.012 8.929 -0.081 1.00 0.00 H new ATOM 0 HB2 LEU B 5 -6.060 11.803 0.556 1.00 0.00 H new ATOM 0 HB3 LEU B 5 -5.649 10.813 1.943 1.00 0.00 H new ATOM 0 HG LEU B 5 -4.233 10.880 -0.728 1.00 0.00 H new ATOM 0 HD11 LEU B 5 -2.337 11.727 0.733 1.00 0.00 H new ATOM 0 HD12 LEU B 5 -3.766 12.780 0.866 1.00 0.00 H new ATOM 0 HD13 LEU B 5 -3.403 11.605 2.152 1.00 0.00 H new ATOM 0 HD21 LEU B 5 -2.563 9.337 0.262 1.00 0.00 H new ATOM 0 HD22 LEU B 5 -3.580 9.176 1.714 1.00 0.00 H new ATOM 0 HD23 LEU B 5 -4.169 8.578 0.145 1.00 0.00 H new ATOM 1523 N ASP B 6 -8.359 9.942 2.061 1.00 0.00 N ATOM 1524 CA ASP B 6 -9.105 9.523 3.242 1.00 0.00 C ATOM 1525 C ASP B 6 -9.819 8.197 2.975 1.00 0.00 C ATOM 1526 O ASP B 6 -9.862 7.328 3.838 1.00 0.00 O ATOM 1527 CB ASP B 6 -10.112 10.591 3.677 1.00 0.00 C ATOM 1528 CG ASP B 6 -10.727 10.220 5.021 1.00 0.00 C ATOM 1529 OD1 ASP B 6 -9.983 10.308 6.025 1.00 0.00 O ATOM 1530 OD2 ASP B 6 -11.921 9.852 5.019 1.00 0.00 O ATOM 0 H ASP B 6 -8.631 10.853 1.693 1.00 0.00 H new ATOM 0 HA ASP B 6 -8.393 9.386 4.056 1.00 0.00 H new ATOM 0 HB2 ASP B 6 -9.617 11.559 3.751 1.00 0.00 H new ATOM 0 HB3 ASP B 6 -10.895 10.690 2.926 1.00 0.00 H new ATOM 1535 N GLN B 7 -10.365 8.046 1.770 1.00 0.00 N ATOM 1536 CA GLN B 7 -11.040 6.843 1.318 1.00 0.00 C ATOM 1537 C GLN B 7 -10.056 5.669 1.250 1.00 0.00 C ATOM 1538 O GLN B 7 -10.324 4.600 1.791 1.00 0.00 O ATOM 1539 CB GLN B 7 -11.688 7.144 -0.038 1.00 0.00 C ATOM 1540 CG GLN B 7 -12.674 6.054 -0.471 1.00 0.00 C ATOM 1541 CD GLN B 7 -13.246 6.336 -1.856 1.00 0.00 C ATOM 1542 OE1 GLN B 7 -13.247 5.467 -2.721 1.00 0.00 O ATOM 1543 NE2 GLN B 7 -13.730 7.554 -2.092 1.00 0.00 N ATOM 0 H GLN B 7 -10.346 8.782 1.064 1.00 0.00 H new ATOM 0 HA GLN B 7 -11.819 6.548 2.021 1.00 0.00 H new ATOM 0 HB2 GLN B 7 -12.209 8.100 0.016 1.00 0.00 H new ATOM 0 HB3 GLN B 7 -10.910 7.247 -0.794 1.00 0.00 H new ATOM 0 HG2 GLN B 7 -12.171 5.087 -0.474 1.00 0.00 H new ATOM 0 HG3 GLN B 7 -13.486 5.988 0.253 1.00 0.00 H new ATOM 0 HE21 GLN B 7 -13.718 8.259 -1.355 1.00 0.00 H new ATOM 0 HE22 GLN B 7 -14.113 7.782 -3.009 1.00 0.00 H new ATOM 1552 N ALA B 8 -8.913 5.859 0.586 1.00 0.00 N ATOM 1553 CA ALA B 8 -7.893 4.826 0.440 1.00 0.00 C ATOM 1554 C ALA B 8 -7.341 4.396 1.807 1.00 0.00 C ATOM 1555 O ALA B 8 -7.218 3.208 2.105 1.00 0.00 O ATOM 1556 CB ALA B 8 -6.792 5.356 -0.474 1.00 0.00 C ATOM 0 H ALA B 8 -8.671 6.740 0.133 1.00 0.00 H new ATOM 0 HA ALA B 8 -8.332 3.935 -0.010 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -6.021 4.595 -0.594 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -7.215 5.601 -1.448 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -6.353 6.251 -0.034 1.00 0.00 H new ATOM 1562 N ILE B 9 -7.039 5.374 2.659 1.00 0.00 N ATOM 1563 CA ILE B 9 -6.709 5.153 4.058 1.00 0.00 C ATOM 1564 C ILE B 9 -7.830 4.325 4.690 1.00 0.00 C ATOM 1565 O ILE B 9 -7.568 3.265 5.250 1.00 0.00 O ATOM 1566 CB ILE B 9 -6.487 6.512 4.752 1.00 0.00 C ATOM 1567 CG1 ILE B 9 -5.152 7.120 4.284 1.00 0.00 C ATOM 1568 CG2 ILE B 9 -6.511 6.383 6.278 1.00 0.00 C ATOM 1569 CD1 ILE B 9 -5.007 8.596 4.670 1.00 0.00 C ATOM 0 H ILE B 9 -7.018 6.357 2.388 1.00 0.00 H new ATOM 0 HA ILE B 9 -5.781 4.593 4.171 1.00 0.00 H new ATOM 0 HB ILE B 9 -7.307 7.173 4.471 1.00 0.00 H new ATOM 0 HG12 ILE B 9 -4.328 6.553 4.716 1.00 0.00 H new ATOM 0 HG13 ILE B 9 -5.073 7.022 3.201 1.00 0.00 H new ATOM 0 HG21 ILE B 9 -6.351 7.363 6.729 1.00 0.00 H new ATOM 0 HG22 ILE B 9 -7.478 5.991 6.595 1.00 0.00 H new ATOM 0 HG23 ILE B 9 -5.722 5.703 6.598 1.00 0.00 H new ATOM 0 HD11 ILE B 9 -4.048 8.972 4.315 1.00 0.00 H new ATOM 0 HD12 ILE B 9 -5.813 9.172 4.216 1.00 0.00 H new ATOM 0 HD13 ILE B 9 -5.057 8.695 5.754 1.00 0.00 H new ATOM 1581 N GLY B 10 -9.075 4.788 4.567 1.00 0.00 N ATOM 1582 CA GLY B 10 -10.275 4.109 5.029 1.00 0.00 C ATOM 1583 C GLY B 10 -10.288 2.636 4.629 1.00 0.00 C ATOM 1584 O GLY B 10 -10.556 1.776 5.461 1.00 0.00 O ATOM 0 H GLY B 10 -9.277 5.684 4.124 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -10.343 4.191 6.114 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -11.154 4.605 4.616 1.00 0.00 H new ATOM 1588 N LEU B 11 -9.978 2.335 3.368 1.00 0.00 N ATOM 1589 CA LEU B 11 -9.819 0.969 2.886 1.00 0.00 C ATOM 1590 C LEU B 11 -8.778 0.214 3.725 1.00 0.00 C ATOM 1591 O LEU B 11 -9.099 -0.831 4.290 1.00 0.00 O ATOM 1592 CB LEU B 11 -9.488 0.983 1.382 1.00 0.00 C ATOM 1593 CG LEU B 11 -10.757 0.925 0.517 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -10.581 1.715 -0.786 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -11.082 -0.536 0.186 1.00 0.00 C ATOM 0 H LEU B 11 -9.829 3.042 2.648 1.00 0.00 H new ATOM 0 HA LEU B 11 -10.756 0.425 3.005 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -8.926 1.885 1.142 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -8.846 0.135 1.143 1.00 0.00 H new ATOM 0 HG LEU B 11 -11.574 1.374 1.081 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -11.496 1.654 -1.375 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -10.368 2.758 -0.553 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -9.753 1.295 -1.357 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -11.982 -0.579 -0.428 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -10.249 -0.979 -0.360 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -11.246 -1.091 1.110 1.00 0.00 H new ATOM 1607 N LEU B 12 -7.547 0.723 3.841 1.00 0.00 N ATOM 1608 CA LEU B 12 -6.504 0.055 4.629 1.00 0.00 C ATOM 1609 C LEU B 12 -6.941 -0.148 6.091 1.00 0.00 C ATOM 1610 O LEU B 12 -6.717 -1.221 6.661 1.00 0.00 O ATOM 1611 CB LEU B 12 -5.162 0.804 4.532 1.00 0.00 C ATOM 1612 CG LEU B 12 -4.292 0.339 3.346 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -4.991 0.528 2.002 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -2.978 1.125 3.304 1.00 0.00 C ATOM 0 H LEU B 12 -7.248 1.593 3.401 1.00 0.00 H new ATOM 0 HA LEU B 12 -6.354 -0.936 4.201 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -5.356 1.872 4.436 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -4.607 0.663 5.459 1.00 0.00 H new ATOM 0 HG LEU B 12 -4.106 -0.723 3.503 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -4.337 0.186 1.200 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -5.915 -0.050 1.988 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -5.221 1.584 1.857 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -2.377 0.784 2.461 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -3.193 2.187 3.190 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -2.428 0.964 4.231 1.00 0.00 H new ATOM 1626 N ILE B 13 -7.563 0.866 6.699 1.00 0.00 N ATOM 1627 CA ILE B 13 -8.141 0.767 8.039 1.00 0.00 C ATOM 1628 C ILE B 13 -9.164 -0.371 8.090 1.00 0.00 C ATOM 1629 O ILE B 13 -9.060 -1.249 8.938 1.00 0.00 O ATOM 1630 CB ILE B 13 -8.780 2.098 8.483 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -7.717 3.202 8.601 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -9.512 1.933 9.830 1.00 0.00 C ATOM 1633 CD1 ILE B 13 -8.349 4.546 8.973 1.00 0.00 C ATOM 0 H ILE B 13 -7.680 1.784 6.271 1.00 0.00 H new ATOM 0 HA ILE B 13 -7.334 0.547 8.737 1.00 0.00 H new ATOM 0 HB ILE B 13 -9.505 2.388 7.722 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -6.982 2.922 9.355 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -7.183 3.298 7.656 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -9.955 2.885 10.123 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -10.297 1.184 9.728 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -8.802 1.613 10.593 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -7.571 5.305 9.049 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -9.066 4.836 8.205 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -8.861 4.455 9.931 1.00 0.00 H new ATOM 1645 N GLY B 14 -10.166 -0.347 7.210 1.00 0.00 N ATOM 1646 CA GLY B 14 -11.234 -1.336 7.178 1.00 0.00 C ATOM 1647 C GLY B 14 -10.652 -2.738 7.062 1.00 0.00 C ATOM 1648 O GLY B 14 -10.991 -3.625 7.843 1.00 0.00 O ATOM 0 H GLY B 14 -10.256 0.371 6.491 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -11.837 -1.259 8.082 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -11.896 -1.139 6.335 1.00 0.00 H new ATOM 1652 N ILE B 15 -9.742 -2.920 6.103 1.00 0.00 N ATOM 1653 CA ILE B 15 -9.012 -4.162 5.924 1.00 0.00 C ATOM 1654 C ILE B 15 -8.359 -4.585 7.244 1.00 0.00 C ATOM 1655 O ILE B 15 -8.500 -5.735 7.650 1.00 0.00 O ATOM 1656 CB ILE B 15 -7.991 -4.004 4.783 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -8.674 -3.868 3.407 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -6.996 -5.165 4.793 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -9.183 -5.186 2.817 1.00 0.00 C ATOM 0 H ILE B 15 -9.494 -2.198 5.426 1.00 0.00 H new ATOM 0 HA ILE B 15 -9.698 -4.960 5.639 1.00 0.00 H new ATOM 0 HB ILE B 15 -7.445 -3.077 4.956 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -9.513 -3.178 3.499 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -7.968 -3.420 2.708 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -6.281 -5.038 3.980 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -6.465 -5.181 5.745 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -7.532 -6.105 4.661 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -9.648 -4.996 1.850 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -8.347 -5.874 2.689 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -9.916 -5.628 3.492 1.00 0.00 H new ATOM 1671 N PHE B 16 -7.656 -3.676 7.928 1.00 0.00 N ATOM 1672 CA PHE B 16 -7.077 -3.998 9.227 1.00 0.00 C ATOM 1673 C PHE B 16 -8.162 -4.478 10.192 1.00 0.00 C ATOM 1674 O PHE B 16 -8.096 -5.587 10.719 1.00 0.00 O ATOM 1675 CB PHE B 16 -6.346 -2.782 9.808 1.00 0.00 C ATOM 1676 CG PHE B 16 -5.553 -3.081 11.063 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -4.405 -3.887 10.984 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -5.943 -2.543 12.305 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -3.586 -4.062 12.111 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -5.153 -2.767 13.446 1.00 0.00 C ATOM 1681 CZ PHE B 16 -3.962 -3.508 13.343 1.00 0.00 C ATOM 0 H PHE B 16 -7.478 -2.725 7.605 1.00 0.00 H new ATOM 0 HA PHE B 16 -6.354 -4.802 9.090 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -5.672 -2.381 9.051 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -7.076 -2.004 10.029 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -4.152 -4.373 10.054 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -6.848 -1.959 12.381 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -2.667 -4.623 12.029 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -5.461 -2.370 14.402 1.00 0.00 H new ATOM 0 HZ PHE B 16 -3.337 -3.650 14.212 1.00 0.00 H new ATOM 1691 N HIS B 17 -9.165 -3.628 10.416 1.00 0.00 N ATOM 1692 CA HIS B 17 -10.235 -3.836 11.377 1.00 0.00 C ATOM 1693 C HIS B 17 -10.943 -5.172 11.137 1.00 0.00 C ATOM 1694 O HIS B 17 -11.330 -5.834 12.100 1.00 0.00 O ATOM 1695 CB HIS B 17 -11.208 -2.650 11.317 1.00 0.00 C ATOM 1696 CG HIS B 17 -12.176 -2.587 12.474 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -12.734 -3.658 13.134 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -12.644 -1.447 13.072 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -13.520 -3.171 14.110 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -13.499 -1.828 14.111 1.00 0.00 N ATOM 0 H HIS B 17 -9.252 -2.746 9.912 1.00 0.00 H new ATOM 0 HA HIS B 17 -9.813 -3.886 12.381 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -10.634 -1.724 11.287 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -11.774 -2.705 10.387 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -12.579 -4.643 12.921 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -12.397 -0.434 12.791 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -14.090 -3.777 14.799 1.00 0.00 H new ATOM 1708 N LYS B 18 -11.111 -5.568 9.873 1.00 0.00 N ATOM 1709 CA LYS B 18 -11.712 -6.838 9.489 1.00 0.00 C ATOM 1710 C LYS B 18 -11.086 -8.021 10.243 1.00 0.00 C ATOM 1711 O LYS B 18 -11.791 -8.979 10.560 1.00 0.00 O ATOM 1712 CB LYS B 18 -11.602 -6.988 7.964 1.00 0.00 C ATOM 1713 CG LYS B 18 -12.333 -8.218 7.411 1.00 0.00 C ATOM 1714 CD LYS B 18 -12.280 -8.189 5.878 1.00 0.00 C ATOM 1715 CE LYS B 18 -12.966 -9.411 5.254 1.00 0.00 C ATOM 1716 NZ LYS B 18 -12.226 -10.656 5.520 1.00 0.00 N ATOM 0 H LYS B 18 -10.826 -5.000 9.075 1.00 0.00 H new ATOM 0 HA LYS B 18 -12.765 -6.843 9.770 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -12.005 -6.093 7.490 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -10.549 -7.048 7.689 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -11.869 -9.131 7.786 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -13.369 -8.224 7.751 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -12.760 -7.280 5.516 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -11.241 -8.152 5.552 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -13.978 -9.500 5.649 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -13.056 -9.266 4.177 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -12.758 -11.464 5.139 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -11.293 -10.610 5.063 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -12.103 -10.774 6.546 1.00 0.00 H new ATOM 1730 N TYR B 19 -9.780 -7.958 10.536 1.00 0.00 N ATOM 1731 CA TYR B 19 -9.071 -9.003 11.269 1.00 0.00 C ATOM 1732 C TYR B 19 -8.755 -8.548 12.698 1.00 0.00 C ATOM 1733 O TYR B 19 -9.021 -9.280 13.644 1.00 0.00 O ATOM 1734 CB TYR B 19 -7.823 -9.435 10.488 1.00 0.00 C ATOM 1735 CG TYR B 19 -8.146 -10.114 9.167 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -8.448 -9.333 8.035 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -8.260 -11.516 9.088 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -8.827 -9.944 6.828 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -8.686 -12.123 7.894 1.00 0.00 C ATOM 1740 CZ TYR B 19 -8.942 -11.342 6.757 1.00 0.00 C ATOM 1741 OH TYR B 19 -9.336 -11.947 5.600 1.00 0.00 O ATOM 0 H TYR B 19 -9.186 -7.173 10.267 1.00 0.00 H new ATOM 0 HA TYR B 19 -9.712 -9.880 11.363 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -7.202 -8.560 10.297 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -7.235 -10.115 11.104 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -8.388 -8.256 8.095 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -8.020 -12.126 9.947 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -9.030 -9.340 5.956 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -8.817 -13.194 7.852 1.00 0.00 H new ATOM 0 HH TYR B 19 -9.409 -11.277 4.889 1.00 0.00 H new ATOM 1751 N SER B 20 -8.214 -7.338 12.871 1.00 0.00 N ATOM 1752 CA SER B 20 -7.823 -6.800 14.172 1.00 0.00 C ATOM 1753 C SER B 20 -9.020 -6.617 15.113 1.00 0.00 C ATOM 1754 O SER B 20 -8.848 -6.602 16.331 1.00 0.00 O ATOM 1755 CB SER B 20 -7.064 -5.475 13.987 1.00 0.00 C ATOM 1756 OG SER B 20 -6.543 -5.010 15.217 1.00 0.00 O ATOM 0 H SER B 20 -8.034 -6.697 12.098 1.00 0.00 H new ATOM 0 HA SER B 20 -7.164 -7.528 14.644 1.00 0.00 H new ATOM 0 HB2 SER B 20 -6.251 -5.614 13.274 1.00 0.00 H new ATOM 0 HB3 SER B 20 -7.733 -4.725 13.565 1.00 0.00 H new ATOM 0 HG SER B 20 -5.802 -5.586 15.497 1.00 0.00 H new ATOM 1847 N HIS B 27 -5.990 -2.793 17.821 1.00 0.00 N ATOM 1848 CA HIS B 27 -4.843 -2.017 17.369 1.00 0.00 C ATOM 1849 C HIS B 27 -3.704 -2.926 16.894 1.00 0.00 C ATOM 1850 O HIS B 27 -2.729 -2.434 16.316 1.00 0.00 O ATOM 1851 CB HIS B 27 -4.383 -1.115 18.521 1.00 0.00 C ATOM 1852 CG HIS B 27 -3.330 -0.120 18.110 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -1.993 -0.169 18.430 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -3.513 0.928 17.250 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -1.387 0.838 17.777 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -2.270 1.527 17.035 1.00 0.00 N ATOM 0 HA HIS B 27 -5.134 -1.406 16.515 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -5.244 -0.579 18.921 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -3.992 -1.736 19.327 1.00 0.00 H new ATOM 0 HD1 HIS B 27 -1.544 -0.845 19.049 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -4.452 1.237 16.815 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -0.333 1.063 17.840 1.00 0.00 H new ATOM 1864 N THR B 28 -3.810 -4.235 17.149 1.00 0.00 N ATOM 1865 CA THR B 28 -2.784 -5.224 16.862 1.00 0.00 C ATOM 1866 C THR B 28 -3.402 -6.462 16.213 1.00 0.00 C ATOM 1867 O THR B 28 -4.614 -6.655 16.300 1.00 0.00 O ATOM 1868 CB THR B 28 -2.056 -5.600 18.166 1.00 0.00 C ATOM 1869 OG1 THR B 28 -2.985 -6.017 19.147 1.00 0.00 O ATOM 1870 CG2 THR B 28 -1.238 -4.455 18.764 1.00 0.00 C ATOM 0 H THR B 28 -4.643 -4.641 17.575 1.00 0.00 H new ATOM 0 HA THR B 28 -2.063 -4.801 16.162 1.00 0.00 H new ATOM 0 HB THR B 28 -1.372 -6.403 17.892 1.00 0.00 H new ATOM 0 HG1 THR B 28 -3.030 -6.996 19.160 1.00 0.00 H new ATOM 0 HG21 THR B 28 -0.754 -4.793 19.680 1.00 0.00 H new ATOM 0 HG22 THR B 28 -0.479 -4.138 18.049 1.00 0.00 H new ATOM 0 HG23 THR B 28 -1.897 -3.617 18.990 1.00 0.00 H new ATOM 1878 N LEU B 29 -2.574 -7.302 15.579 1.00 0.00 N ATOM 1879 CA LEU B 29 -2.974 -8.623 15.104 1.00 0.00 C ATOM 1880 C LEU B 29 -1.751 -9.521 14.884 1.00 0.00 C ATOM 1881 O LEU B 29 -0.617 -9.041 14.897 1.00 0.00 O ATOM 1882 CB LEU B 29 -3.922 -8.544 13.894 1.00 0.00 C ATOM 1883 CG LEU B 29 -3.540 -7.547 12.794 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -2.166 -7.828 12.187 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -4.591 -7.609 11.684 1.00 0.00 C ATOM 0 H LEU B 29 -1.599 -7.077 15.382 1.00 0.00 H new ATOM 0 HA LEU B 29 -3.564 -9.102 15.886 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -3.990 -9.536 13.448 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -4.918 -8.289 14.256 1.00 0.00 H new ATOM 0 HG LEU B 29 -3.498 -6.559 13.252 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -1.952 -7.089 11.415 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -1.405 -7.770 12.966 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -2.160 -8.825 11.747 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -4.329 -6.903 10.895 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -4.626 -8.617 11.272 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -5.568 -7.350 12.093 1.00 0.00 H new ATOM 1897 N SER B 30 -1.980 -10.831 14.752 1.00 0.00 N ATOM 1898 CA SER B 30 -0.942 -11.856 14.766 1.00 0.00 C ATOM 1899 C SER B 30 -0.507 -12.310 13.367 1.00 0.00 C ATOM 1900 O SER B 30 -1.179 -12.055 12.370 1.00 0.00 O ATOM 1901 CB SER B 30 -1.466 -13.059 15.562 1.00 0.00 C ATOM 1902 OG SER B 30 -2.595 -13.623 14.918 1.00 0.00 O ATOM 0 H SER B 30 -2.918 -11.214 14.630 1.00 0.00 H new ATOM 0 HA SER B 30 -0.056 -11.422 15.230 1.00 0.00 H new ATOM 0 HB2 SER B 30 -0.681 -13.809 15.658 1.00 0.00 H new ATOM 0 HB3 SER B 30 -1.733 -12.747 16.571 1.00 0.00 H new ATOM 0 HG SER B 30 -3.366 -13.027 15.028 1.00 0.00 H new ATOM 1908 N LYS B 31 0.602 -13.054 13.320 1.00 0.00 N ATOM 1909 CA LYS B 31 1.135 -13.753 12.158 1.00 0.00 C ATOM 1910 C LYS B 31 0.042 -14.407 11.313 1.00 0.00 C ATOM 1911 O LYS B 31 -0.048 -14.166 10.111 1.00 0.00 O ATOM 1912 CB LYS B 31 2.214 -14.768 12.590 1.00 0.00 C ATOM 1913 CG LYS B 31 1.945 -15.498 13.919 1.00 0.00 C ATOM 1914 CD LYS B 31 2.991 -16.601 14.130 1.00 0.00 C ATOM 1915 CE LYS B 31 2.715 -17.419 15.398 1.00 0.00 C ATOM 1916 NZ LYS B 31 2.975 -16.642 16.623 1.00 0.00 N ATOM 0 H LYS B 31 1.184 -13.190 14.147 1.00 0.00 H new ATOM 0 HA LYS B 31 1.604 -13.009 11.514 1.00 0.00 H new ATOM 0 HB2 LYS B 31 2.323 -15.513 11.802 1.00 0.00 H new ATOM 0 HB3 LYS B 31 3.168 -14.246 12.669 1.00 0.00 H new ATOM 0 HG2 LYS B 31 1.979 -14.789 14.747 1.00 0.00 H new ATOM 0 HG3 LYS B 31 0.944 -15.930 13.910 1.00 0.00 H new ATOM 0 HD2 LYS B 31 2.998 -17.264 13.265 1.00 0.00 H new ATOM 0 HD3 LYS B 31 3.982 -16.153 14.196 1.00 0.00 H new ATOM 0 HE2 LYS B 31 1.678 -17.754 15.395 1.00 0.00 H new ATOM 0 HE3 LYS B 31 3.339 -18.313 15.396 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 2.776 -17.231 17.457 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 3.971 -16.343 16.640 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 2.361 -15.802 16.638 1.00 0.00 H new ATOM 1930 N LYS B 32 -0.807 -15.220 11.947 1.00 0.00 N ATOM 1931 CA LYS B 32 -1.911 -15.893 11.288 1.00 0.00 C ATOM 1932 C LYS B 32 -2.790 -14.870 10.565 1.00 0.00 C ATOM 1933 O LYS B 32 -3.171 -15.068 9.415 1.00 0.00 O ATOM 1934 CB LYS B 32 -2.702 -16.654 12.357 1.00 0.00 C ATOM 1935 CG LYS B 32 -3.747 -17.594 11.747 1.00 0.00 C ATOM 1936 CD LYS B 32 -4.513 -18.334 12.852 1.00 0.00 C ATOM 1937 CE LYS B 32 -5.519 -17.452 13.610 1.00 0.00 C ATOM 1938 NZ LYS B 32 -6.596 -16.957 12.735 1.00 0.00 N ATOM 0 H LYS B 32 -0.740 -15.427 12.944 1.00 0.00 H new ATOM 0 HA LYS B 32 -1.547 -16.595 10.538 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -2.013 -17.231 12.974 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -3.198 -15.941 13.015 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -4.444 -17.024 11.133 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -3.258 -18.314 11.090 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -5.044 -19.177 12.410 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -3.797 -18.746 13.564 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -5.954 -18.023 14.431 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -4.995 -16.605 14.053 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -7.321 -16.482 13.311 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -6.203 -16.282 12.048 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -7.026 -17.756 12.227 1.00 0.00 H new ATOM 1952 N GLU B 33 -3.098 -13.770 11.250 1.00 0.00 N ATOM 1953 CA GLU B 33 -3.973 -12.732 10.744 1.00 0.00 C ATOM 1954 C GLU B 33 -3.295 -11.938 9.624 1.00 0.00 C ATOM 1955 O GLU B 33 -3.967 -11.567 8.669 1.00 0.00 O ATOM 1956 CB GLU B 33 -4.445 -11.857 11.906 1.00 0.00 C ATOM 1957 CG GLU B 33 -5.316 -12.689 12.862 1.00 0.00 C ATOM 1958 CD GLU B 33 -5.600 -11.948 14.160 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -4.625 -11.782 14.927 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -6.777 -11.583 14.363 1.00 0.00 O ATOM 0 H GLU B 33 -2.738 -13.579 12.185 1.00 0.00 H new ATOM 0 HA GLU B 33 -4.857 -13.180 10.292 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -3.586 -11.452 12.441 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -5.014 -11.008 11.527 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -6.258 -12.937 12.372 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -4.814 -13.631 13.084 1.00 0.00 H new ATOM 1967 N LEU B 34 -1.981 -11.701 9.695 1.00 0.00 N ATOM 1968 CA LEU B 34 -1.241 -11.123 8.572 1.00 0.00 C ATOM 1969 C LEU B 34 -1.279 -12.055 7.354 1.00 0.00 C ATOM 1970 O LEU B 34 -1.572 -11.615 6.241 1.00 0.00 O ATOM 1971 CB LEU B 34 0.213 -10.805 8.946 1.00 0.00 C ATOM 1972 CG LEU B 34 0.452 -9.440 9.620 1.00 0.00 C ATOM 1973 CD1 LEU B 34 1.965 -9.271 9.815 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -0.053 -8.257 8.780 1.00 0.00 C ATOM 0 H LEU B 34 -1.411 -11.900 10.517 1.00 0.00 H new ATOM 0 HA LEU B 34 -1.733 -10.185 8.316 1.00 0.00 H new ATOM 0 HB2 LEU B 34 0.575 -11.587 9.614 1.00 0.00 H new ATOM 0 HB3 LEU B 34 0.819 -10.853 8.041 1.00 0.00 H new ATOM 0 HG LEU B 34 -0.099 -9.434 10.561 1.00 0.00 H new ATOM 0 HD11 LEU B 34 2.166 -8.311 10.291 1.00 0.00 H new ATOM 0 HD12 LEU B 34 2.343 -10.075 10.446 1.00 0.00 H new ATOM 0 HD13 LEU B 34 2.463 -9.306 8.846 1.00 0.00 H new ATOM 0 HD21 LEU B 34 0.144 -7.325 9.309 1.00 0.00 H new ATOM 0 HD22 LEU B 34 0.463 -8.246 7.820 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -1.125 -8.360 8.614 1.00 0.00 H new ATOM 1986 N LYS B 35 -0.969 -13.339 7.551 1.00 0.00 N ATOM 1987 CA LYS B 35 -0.994 -14.325 6.477 1.00 0.00 C ATOM 1988 C LYS B 35 -2.393 -14.382 5.851 1.00 0.00 C ATOM 1989 O LYS B 35 -2.533 -14.334 4.629 1.00 0.00 O ATOM 1990 CB LYS B 35 -0.519 -15.689 6.997 1.00 0.00 C ATOM 1991 CG LYS B 35 0.990 -15.656 7.296 1.00 0.00 C ATOM 1992 CD LYS B 35 1.456 -16.867 8.112 1.00 0.00 C ATOM 1993 CE LYS B 35 1.268 -18.183 7.350 1.00 0.00 C ATOM 1994 NZ LYS B 35 1.845 -19.316 8.094 1.00 0.00 N ATOM 0 H LYS B 35 -0.695 -13.719 8.457 1.00 0.00 H new ATOM 0 HA LYS B 35 -0.302 -14.030 5.688 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -1.069 -15.952 7.901 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -0.732 -16.461 6.258 1.00 0.00 H new ATOM 0 HG2 LYS B 35 1.542 -15.621 6.357 1.00 0.00 H new ATOM 0 HG3 LYS B 35 1.229 -14.742 7.840 1.00 0.00 H new ATOM 0 HD2 LYS B 35 2.508 -16.746 8.371 1.00 0.00 H new ATOM 0 HD3 LYS B 35 0.900 -16.908 9.048 1.00 0.00 H new ATOM 0 HE2 LYS B 35 0.206 -18.359 7.180 1.00 0.00 H new ATOM 0 HE3 LYS B 35 1.740 -18.110 6.370 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 1.703 -20.194 7.555 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 2.863 -19.157 8.235 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 1.377 -19.399 9.019 1.00 0.00 H new ATOM 2008 N GLU B 36 -3.433 -14.433 6.692 1.00 0.00 N ATOM 2009 CA GLU B 36 -4.808 -14.300 6.240 1.00 0.00 C ATOM 2010 C GLU B 36 -4.987 -13.020 5.431 1.00 0.00 C ATOM 2011 O GLU B 36 -5.435 -13.094 4.296 1.00 0.00 O ATOM 2012 CB GLU B 36 -5.784 -14.310 7.418 1.00 0.00 C ATOM 2013 CG GLU B 36 -6.088 -15.727 7.907 1.00 0.00 C ATOM 2014 CD GLU B 36 -6.934 -15.682 9.175 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -6.334 -15.491 10.256 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -8.168 -15.822 9.040 1.00 0.00 O ATOM 0 H GLU B 36 -3.338 -14.567 7.699 1.00 0.00 H new ATOM 0 HA GLU B 36 -5.028 -15.157 5.604 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -5.366 -13.727 8.238 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -6.713 -13.823 7.122 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -6.615 -16.281 7.130 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -5.157 -16.259 8.102 1.00 0.00 H new ATOM 2023 N LEU B 37 -4.670 -11.858 6.005 1.00 0.00 N ATOM 2024 CA LEU B 37 -4.820 -10.566 5.348 1.00 0.00 C ATOM 2025 C LEU B 37 -4.284 -10.627 3.924 1.00 0.00 C ATOM 2026 O LEU B 37 -5.039 -10.411 2.977 1.00 0.00 O ATOM 2027 CB LEU B 37 -4.097 -9.465 6.139 1.00 0.00 C ATOM 2028 CG LEU B 37 -4.994 -8.800 7.188 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -4.134 -8.067 8.217 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -5.901 -7.775 6.506 1.00 0.00 C ATOM 0 H LEU B 37 -4.297 -11.791 6.952 1.00 0.00 H new ATOM 0 HA LEU B 37 -5.882 -10.325 5.313 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -3.224 -9.892 6.633 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -3.732 -8.707 5.446 1.00 0.00 H new ATOM 0 HG LEU B 37 -5.590 -9.569 7.679 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -4.778 -7.596 8.960 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -3.471 -8.778 8.710 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -3.539 -7.303 7.716 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -6.540 -7.301 7.252 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -5.290 -7.016 6.017 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -6.521 -8.276 5.762 1.00 0.00 H new ATOM 2042 N ILE B 38 -2.994 -10.927 3.762 1.00 0.00 N ATOM 2043 CA ILE B 38 -2.406 -10.944 2.431 1.00 0.00 C ATOM 2044 C ILE B 38 -3.124 -11.978 1.549 1.00 0.00 C ATOM 2045 O ILE B 38 -3.624 -11.627 0.483 1.00 0.00 O ATOM 2046 CB ILE B 38 -0.869 -11.062 2.502 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -0.215 -10.784 1.139 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -0.384 -12.402 3.059 1.00 0.00 C ATOM 2049 CD1 ILE B 38 1.296 -10.558 1.245 1.00 0.00 C ATOM 0 H ILE B 38 -2.352 -11.156 4.521 1.00 0.00 H new ATOM 0 HA ILE B 38 -2.568 -9.989 1.930 1.00 0.00 H new ATOM 0 HB ILE B 38 -0.554 -10.294 3.208 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -0.407 -11.623 0.470 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -0.679 -9.906 0.690 1.00 0.00 H new ATOM 0 HG21 ILE B 38 0.706 -12.414 3.080 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -0.768 -12.536 4.070 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -0.744 -13.212 2.424 1.00 0.00 H new ATOM 0 HD11 ILE B 38 1.706 -10.366 0.253 1.00 0.00 H new ATOM 0 HD12 ILE B 38 1.491 -9.701 1.890 1.00 0.00 H new ATOM 0 HD13 ILE B 38 1.768 -11.445 1.667 1.00 0.00 H new ATOM 2061 N GLN B 39 -3.239 -13.231 2.001 1.00 0.00 N ATOM 2062 CA GLN B 39 -3.799 -14.302 1.185 1.00 0.00 C ATOM 2063 C GLN B 39 -5.243 -14.012 0.742 1.00 0.00 C ATOM 2064 O GLN B 39 -5.576 -14.176 -0.428 1.00 0.00 O ATOM 2065 CB GLN B 39 -3.674 -15.625 1.954 1.00 0.00 C ATOM 2066 CG GLN B 39 -4.174 -16.828 1.143 1.00 0.00 C ATOM 2067 CD GLN B 39 -4.148 -18.108 1.971 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -5.191 -18.679 2.274 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -2.961 -18.569 2.353 1.00 0.00 N ATOM 0 H GLN B 39 -2.949 -13.525 2.934 1.00 0.00 H new ATOM 0 HA GLN B 39 -3.231 -14.376 0.258 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -2.631 -15.784 2.228 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -4.241 -15.556 2.882 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -5.190 -16.638 0.796 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -3.553 -16.954 0.256 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -2.111 -18.073 2.086 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -2.900 -19.419 2.913 1.00 0.00 H new ATOM 2078 N LYS B 40 -6.113 -13.636 1.682 1.00 0.00 N ATOM 2079 CA LYS B 40 -7.525 -13.394 1.425 1.00 0.00 C ATOM 2080 C LYS B 40 -7.695 -12.081 0.657 1.00 0.00 C ATOM 2081 O LYS B 40 -8.371 -12.043 -0.368 1.00 0.00 O ATOM 2082 CB LYS B 40 -8.338 -13.307 2.736 1.00 0.00 C ATOM 2083 CG LYS B 40 -8.868 -14.615 3.359 1.00 0.00 C ATOM 2084 CD LYS B 40 -7.929 -15.341 4.331 1.00 0.00 C ATOM 2085 CE LYS B 40 -6.985 -16.332 3.644 1.00 0.00 C ATOM 2086 NZ LYS B 40 -7.695 -17.493 3.081 1.00 0.00 N ATOM 0 H LYS B 40 -5.847 -13.490 2.656 1.00 0.00 H new ATOM 0 HA LYS B 40 -7.898 -14.233 0.838 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -7.714 -12.813 3.481 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -9.193 -12.656 2.554 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -9.796 -14.391 3.885 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -9.118 -15.301 2.550 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -7.337 -14.602 4.871 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -8.526 -15.874 5.071 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -6.444 -15.821 2.848 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -6.242 -16.678 4.363 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -7.004 -18.203 2.765 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -8.311 -17.910 3.808 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -8.273 -17.188 2.272 1.00 0.00 H new ATOM 2100 N GLU B 41 -7.136 -10.987 1.185 1.00 0.00 N ATOM 2101 CA GLU B 41 -7.450 -9.653 0.697 1.00 0.00 C ATOM 2102 C GLU B 41 -6.667 -9.267 -0.559 1.00 0.00 C ATOM 2103 O GLU B 41 -7.154 -8.431 -1.319 1.00 0.00 O ATOM 2104 CB GLU B 41 -7.286 -8.614 1.812 1.00 0.00 C ATOM 2105 CG GLU B 41 -7.998 -8.992 3.122 1.00 0.00 C ATOM 2106 CD GLU B 41 -9.494 -9.239 2.967 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -10.141 -8.438 2.258 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -9.968 -10.214 3.592 1.00 0.00 O ATOM 0 H GLU B 41 -6.463 -11.006 1.952 1.00 0.00 H new ATOM 0 HA GLU B 41 -8.497 -9.670 0.394 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -6.224 -8.476 2.014 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -7.672 -7.656 1.463 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -7.533 -9.889 3.530 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -7.846 -8.195 3.849 1.00 0.00 H new ATOM 2115 N LEU B 42 -5.476 -9.831 -0.787 1.00 0.00 N ATOM 2116 CA LEU B 42 -4.771 -9.698 -2.058 1.00 0.00 C ATOM 2117 C LEU B 42 -4.969 -10.998 -2.826 1.00 0.00 C ATOM 2118 O LEU B 42 -4.171 -11.928 -2.723 1.00 0.00 O ATOM 2119 CB LEU B 42 -3.295 -9.327 -1.847 1.00 0.00 C ATOM 2120 CG LEU B 42 -3.150 -7.840 -1.483 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -1.814 -7.594 -0.785 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -3.222 -6.954 -2.732 1.00 0.00 C ATOM 0 H LEU B 42 -4.978 -10.391 -0.095 1.00 0.00 H new ATOM 0 HA LEU B 42 -5.177 -8.876 -2.647 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -2.871 -9.943 -1.054 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -2.729 -9.541 -2.754 1.00 0.00 H new ATOM 0 HG LEU B 42 -3.973 -7.584 -0.816 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -1.724 -6.537 -0.533 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -1.764 -8.190 0.126 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -0.998 -7.879 -1.450 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -3.116 -5.908 -2.443 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -2.418 -7.224 -3.417 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -4.183 -7.099 -3.226 1.00 0.00 H new ATOM 2243 N ASP B 50 8.265 -11.654 -6.062 1.00 0.00 N ATOM 2244 CA ASP B 50 8.852 -12.148 -4.819 1.00 0.00 C ATOM 2245 C ASP B 50 8.245 -11.538 -3.554 1.00 0.00 C ATOM 2246 O ASP B 50 8.074 -12.242 -2.561 1.00 0.00 O ATOM 2247 CB ASP B 50 10.364 -11.893 -4.820 1.00 0.00 C ATOM 2248 CG ASP B 50 11.065 -12.516 -6.024 1.00 0.00 C ATOM 2249 OD1 ASP B 50 10.798 -12.025 -7.144 1.00 0.00 O ATOM 2250 OD2 ASP B 50 11.840 -13.471 -5.805 1.00 0.00 O ATOM 0 HA ASP B 50 8.631 -13.215 -4.790 1.00 0.00 H new ATOM 0 HB2 ASP B 50 10.547 -10.819 -4.814 1.00 0.00 H new ATOM 0 HB3 ASP B 50 10.797 -12.295 -3.904 1.00 0.00 H new ATOM 2255 N ALA B 51 7.957 -10.235 -3.576 1.00 0.00 N ATOM 2256 CA ALA B 51 7.461 -9.462 -2.445 1.00 0.00 C ATOM 2257 C ALA B 51 6.513 -10.253 -1.547 1.00 0.00 C ATOM 2258 O ALA B 51 6.755 -10.365 -0.350 1.00 0.00 O ATOM 2259 CB ALA B 51 6.754 -8.215 -2.969 1.00 0.00 C ATOM 0 H ALA B 51 8.069 -9.671 -4.418 1.00 0.00 H new ATOM 0 HA ALA B 51 8.321 -9.194 -1.831 1.00 0.00 H new ATOM 0 HB1 ALA B 51 6.379 -7.630 -2.130 1.00 0.00 H new ATOM 0 HB2 ALA B 51 7.457 -7.614 -3.546 1.00 0.00 H new ATOM 0 HB3 ALA B 51 5.921 -8.510 -3.607 1.00 0.00 H new ATOM 2265 N GLU B 52 5.437 -10.796 -2.125 1.00 0.00 N ATOM 2266 CA GLU B 52 4.401 -11.508 -1.386 1.00 0.00 C ATOM 2267 C GLU B 52 4.972 -12.745 -0.685 1.00 0.00 C ATOM 2268 O GLU B 52 4.641 -13.029 0.466 1.00 0.00 O ATOM 2269 CB GLU B 52 3.253 -11.845 -2.355 1.00 0.00 C ATOM 2270 CG GLU B 52 2.169 -12.739 -1.736 1.00 0.00 C ATOM 2271 CD GLU B 52 0.898 -12.740 -2.582 1.00 0.00 C ATOM 2272 OE1 GLU B 52 0.810 -13.600 -3.486 1.00 0.00 O ATOM 2273 OE2 GLU B 52 0.041 -11.870 -2.316 1.00 0.00 O ATOM 0 H GLU B 52 5.263 -10.751 -3.129 1.00 0.00 H new ATOM 0 HA GLU B 52 4.005 -10.877 -0.590 1.00 0.00 H new ATOM 0 HB2 GLU B 52 2.795 -10.918 -2.699 1.00 0.00 H new ATOM 0 HB3 GLU B 52 3.664 -12.342 -3.234 1.00 0.00 H new ATOM 0 HG2 GLU B 52 2.546 -13.757 -1.641 1.00 0.00 H new ATOM 0 HG3 GLU B 52 1.938 -12.390 -0.730 1.00 0.00 H new ATOM 2280 N ILE B 53 5.840 -13.474 -1.385 1.00 0.00 N ATOM 2281 CA ILE B 53 6.455 -14.696 -0.899 1.00 0.00 C ATOM 2282 C ILE B 53 7.310 -14.312 0.308 1.00 0.00 C ATOM 2283 O ILE B 53 7.151 -14.841 1.410 1.00 0.00 O ATOM 2284 CB ILE B 53 7.305 -15.347 -2.015 1.00 0.00 C ATOM 2285 CG1 ILE B 53 6.544 -15.691 -3.312 1.00 0.00 C ATOM 2286 CG2 ILE B 53 7.939 -16.644 -1.490 1.00 0.00 C ATOM 2287 CD1 ILE B 53 5.906 -14.515 -4.068 1.00 0.00 C ATOM 0 H ILE B 53 6.138 -13.221 -2.327 1.00 0.00 H new ATOM 0 HA ILE B 53 5.705 -15.431 -0.607 1.00 0.00 H new ATOM 0 HB ILE B 53 8.044 -14.589 -2.276 1.00 0.00 H new ATOM 0 HG12 ILE B 53 7.234 -16.196 -3.988 1.00 0.00 H new ATOM 0 HG13 ILE B 53 5.758 -16.405 -3.067 1.00 0.00 H new ATOM 0 HG21 ILE B 53 8.538 -17.101 -2.278 1.00 0.00 H new ATOM 0 HG22 ILE B 53 8.576 -16.417 -0.635 1.00 0.00 H new ATOM 0 HG23 ILE B 53 7.154 -17.335 -1.184 1.00 0.00 H new ATOM 0 HD11 ILE B 53 5.402 -14.887 -4.960 1.00 0.00 H new ATOM 0 HD12 ILE B 53 5.182 -14.017 -3.423 1.00 0.00 H new ATOM 0 HD13 ILE B 53 6.681 -13.806 -4.358 1.00 0.00 H new ATOM 2299 N VAL B 54 8.200 -13.342 0.090 1.00 0.00 N ATOM 2300 CA VAL B 54 9.083 -12.837 1.124 1.00 0.00 C ATOM 2301 C VAL B 54 8.257 -12.337 2.309 1.00 0.00 C ATOM 2302 O VAL B 54 8.629 -12.598 3.444 1.00 0.00 O ATOM 2303 CB VAL B 54 10.029 -11.773 0.544 1.00 0.00 C ATOM 2304 CG1 VAL B 54 10.960 -11.204 1.624 1.00 0.00 C ATOM 2305 CG2 VAL B 54 10.902 -12.401 -0.551 1.00 0.00 C ATOM 0 H VAL B 54 8.323 -12.888 -0.815 1.00 0.00 H new ATOM 0 HA VAL B 54 9.720 -13.638 1.500 1.00 0.00 H new ATOM 0 HB VAL B 54 9.413 -10.969 0.140 1.00 0.00 H new ATOM 0 HG11 VAL B 54 11.616 -10.455 1.181 1.00 0.00 H new ATOM 0 HG12 VAL B 54 10.364 -10.744 2.413 1.00 0.00 H new ATOM 0 HG13 VAL B 54 11.562 -12.009 2.046 1.00 0.00 H new ATOM 0 HG21 VAL B 54 11.572 -11.645 -0.961 1.00 0.00 H new ATOM 0 HG22 VAL B 54 11.490 -13.214 -0.126 1.00 0.00 H new ATOM 0 HG23 VAL B 54 10.265 -12.790 -1.345 1.00 0.00 H new ATOM 2315 N LYS B 55 7.138 -11.648 2.071 1.00 0.00 N ATOM 2316 CA LYS B 55 6.257 -11.176 3.134 1.00 0.00 C ATOM 2317 C LYS B 55 5.745 -12.360 3.956 1.00 0.00 C ATOM 2318 O LYS B 55 5.852 -12.357 5.181 1.00 0.00 O ATOM 2319 CB LYS B 55 5.095 -10.348 2.560 1.00 0.00 C ATOM 2320 CG LYS B 55 5.041 -8.910 3.092 1.00 0.00 C ATOM 2321 CD LYS B 55 6.057 -7.929 2.486 1.00 0.00 C ATOM 2322 CE LYS B 55 7.459 -7.921 3.113 1.00 0.00 C ATOM 2323 NZ LYS B 55 8.408 -8.767 2.374 1.00 0.00 N ATOM 0 H LYS B 55 6.820 -11.403 1.133 1.00 0.00 H new ATOM 0 HA LYS B 55 6.826 -10.522 3.794 1.00 0.00 H new ATOM 0 HB2 LYS B 55 5.181 -10.321 1.474 1.00 0.00 H new ATOM 0 HB3 LYS B 55 4.155 -10.848 2.793 1.00 0.00 H new ATOM 0 HG2 LYS B 55 4.039 -8.517 2.919 1.00 0.00 H new ATOM 0 HG3 LYS B 55 5.191 -8.937 4.171 1.00 0.00 H new ATOM 0 HD2 LYS B 55 6.159 -8.156 1.425 1.00 0.00 H new ATOM 0 HD3 LYS B 55 5.645 -6.923 2.559 1.00 0.00 H new ATOM 0 HE2 LYS B 55 7.835 -6.898 3.143 1.00 0.00 H new ATOM 0 HE3 LYS B 55 7.395 -8.267 4.145 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 8.590 -9.637 2.913 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 8.005 -9.012 1.447 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 9.300 -8.251 2.238 1.00 0.00 H new ATOM 2337 N LEU B 56 5.190 -13.372 3.283 1.00 0.00 N ATOM 2338 CA LEU B 56 4.668 -14.561 3.944 1.00 0.00 C ATOM 2339 C LEU B 56 5.723 -15.205 4.853 1.00 0.00 C ATOM 2340 O LEU B 56 5.389 -15.629 5.958 1.00 0.00 O ATOM 2341 CB LEU B 56 4.122 -15.554 2.906 1.00 0.00 C ATOM 2342 CG LEU B 56 2.778 -15.114 2.297 1.00 0.00 C ATOM 2343 CD1 LEU B 56 2.517 -15.904 1.010 1.00 0.00 C ATOM 2344 CD2 LEU B 56 1.619 -15.352 3.274 1.00 0.00 C ATOM 0 H LEU B 56 5.092 -13.386 2.268 1.00 0.00 H new ATOM 0 HA LEU B 56 3.840 -14.262 4.587 1.00 0.00 H new ATOM 0 HB2 LEU B 56 4.854 -15.674 2.107 1.00 0.00 H new ATOM 0 HB3 LEU B 56 3.999 -16.530 3.375 1.00 0.00 H new ATOM 0 HG LEU B 56 2.837 -14.047 2.082 1.00 0.00 H new ATOM 0 HD11 LEU B 56 1.566 -15.593 0.579 1.00 0.00 H new ATOM 0 HD12 LEU B 56 3.319 -15.713 0.297 1.00 0.00 H new ATOM 0 HD13 LEU B 56 2.481 -16.969 1.238 1.00 0.00 H new ATOM 0 HD21 LEU B 56 0.684 -15.031 2.815 1.00 0.00 H new ATOM 0 HD22 LEU B 56 1.559 -16.413 3.516 1.00 0.00 H new ATOM 0 HD23 LEU B 56 1.789 -14.781 4.187 1.00 0.00 H new ATOM 2356 N MET B 57 6.987 -15.279 4.417 1.00 0.00 N ATOM 2357 CA MET B 57 8.060 -15.787 5.269 1.00 0.00 C ATOM 2358 C MET B 57 8.349 -14.782 6.395 1.00 0.00 C ATOM 2359 O MET B 57 8.208 -15.089 7.581 1.00 0.00 O ATOM 2360 CB MET B 57 9.331 -16.054 4.444 1.00 0.00 C ATOM 2361 CG MET B 57 9.424 -17.446 3.794 1.00 0.00 C ATOM 2362 SD MET B 57 8.803 -17.672 2.104 1.00 0.00 S ATOM 2363 CE MET B 57 7.038 -17.952 2.357 1.00 0.00 C ATOM 0 H MET B 57 7.287 -14.994 3.484 1.00 0.00 H new ATOM 0 HA MET B 57 7.741 -16.731 5.710 1.00 0.00 H new ATOM 0 HB2 MET B 57 9.397 -15.301 3.658 1.00 0.00 H new ATOM 0 HB3 MET B 57 10.198 -15.917 5.091 1.00 0.00 H new ATOM 0 HG2 MET B 57 10.473 -17.743 3.802 1.00 0.00 H new ATOM 0 HG3 MET B 57 8.890 -18.146 4.437 1.00 0.00 H new ATOM 0 HE1 MET B 57 6.795 -18.986 2.112 1.00 0.00 H new ATOM 0 HE2 MET B 57 6.784 -17.757 3.399 1.00 0.00 H new ATOM 0 HE3 MET B 57 6.467 -17.283 1.713 1.00 0.00 H new ATOM 2373 N ASP B 58 8.767 -13.576 6.000 1.00 0.00 N ATOM 2374 CA ASP B 58 9.162 -12.466 6.861 1.00 0.00 C ATOM 2375 C ASP B 58 8.194 -12.272 8.019 1.00 0.00 C ATOM 2376 O ASP B 58 8.631 -11.949 9.117 1.00 0.00 O ATOM 2377 CB ASP B 58 9.258 -11.174 6.042 1.00 0.00 C ATOM 2378 CG ASP B 58 9.505 -9.959 6.932 1.00 0.00 C ATOM 2379 OD1 ASP B 58 10.637 -9.855 7.452 1.00 0.00 O ATOM 2380 OD2 ASP B 58 8.552 -9.164 7.081 1.00 0.00 O ATOM 0 H ASP B 58 8.842 -13.338 5.011 1.00 0.00 H new ATOM 0 HA ASP B 58 10.138 -12.709 7.281 1.00 0.00 H new ATOM 0 HB2 ASP B 58 10.065 -11.263 5.315 1.00 0.00 H new ATOM 0 HB3 ASP B 58 8.336 -11.031 5.478 1.00 0.00 H new ATOM 2385 N ASP B 59 6.898 -12.486 7.780 1.00 0.00 N ATOM 2386 CA ASP B 59 5.827 -12.384 8.759 1.00 0.00 C ATOM 2387 C ASP B 59 6.240 -12.893 10.142 1.00 0.00 C ATOM 2388 O ASP B 59 5.994 -12.220 11.144 1.00 0.00 O ATOM 2389 CB ASP B 59 4.644 -13.207 8.239 1.00 0.00 C ATOM 2390 CG ASP B 59 3.521 -13.265 9.260 1.00 0.00 C ATOM 2391 OD1 ASP B 59 3.050 -12.171 9.635 1.00 0.00 O ATOM 2392 OD2 ASP B 59 3.169 -14.394 9.659 1.00 0.00 O ATOM 0 H ASP B 59 6.557 -12.747 6.855 1.00 0.00 H new ATOM 0 HA ASP B 59 5.565 -11.333 8.881 1.00 0.00 H new ATOM 0 HB2 ASP B 59 4.273 -12.769 7.312 1.00 0.00 H new ATOM 0 HB3 ASP B 59 4.977 -14.218 8.004 1.00 0.00 H new ATOM 2397 N LEU B 60 6.875 -14.066 10.205 1.00 0.00 N ATOM 2398 CA LEU B 60 7.309 -14.642 11.472 1.00 0.00 C ATOM 2399 C LEU B 60 8.278 -13.692 12.187 1.00 0.00 C ATOM 2400 O LEU B 60 8.096 -13.378 13.363 1.00 0.00 O ATOM 2401 CB LEU B 60 7.956 -16.018 11.238 1.00 0.00 C ATOM 2402 CG LEU B 60 6.982 -17.182 10.965 1.00 0.00 C ATOM 2403 CD1 LEU B 60 6.037 -17.431 12.145 1.00 0.00 C ATOM 2404 CD2 LEU B 60 6.164 -17.025 9.678 1.00 0.00 C ATOM 0 H LEU B 60 7.099 -14.634 9.388 1.00 0.00 H new ATOM 0 HA LEU B 60 6.438 -14.781 12.113 1.00 0.00 H new ATOM 0 HB2 LEU B 60 8.641 -15.937 10.394 1.00 0.00 H new ATOM 0 HB3 LEU B 60 8.556 -16.269 12.113 1.00 0.00 H new ATOM 0 HG LEU B 60 7.629 -18.049 10.831 1.00 0.00 H new ATOM 0 HD11 LEU B 60 5.369 -18.259 11.908 1.00 0.00 H new ATOM 0 HD12 LEU B 60 6.620 -17.677 13.032 1.00 0.00 H new ATOM 0 HD13 LEU B 60 5.448 -16.534 12.335 1.00 0.00 H new ATOM 0 HD21 LEU B 60 5.504 -17.884 9.559 1.00 0.00 H new ATOM 0 HD22 LEU B 60 5.567 -16.115 9.735 1.00 0.00 H new ATOM 0 HD23 LEU B 60 6.838 -16.964 8.824 1.00 0.00 H new ATOM 2416 N ASP B 61 9.295 -13.214 11.468 1.00 0.00 N ATOM 2417 CA ASP B 61 10.299 -12.289 11.985 1.00 0.00 C ATOM 2418 C ASP B 61 9.646 -10.957 12.353 1.00 0.00 C ATOM 2419 O ASP B 61 9.939 -10.380 13.393 1.00 0.00 O ATOM 2420 CB ASP B 61 11.404 -12.064 10.944 1.00 0.00 C ATOM 2421 CG ASP B 61 12.038 -13.371 10.483 1.00 0.00 C ATOM 2422 OD1 ASP B 61 11.465 -13.977 9.549 1.00 0.00 O ATOM 2423 OD2 ASP B 61 13.072 -13.745 11.076 1.00 0.00 O ATOM 0 H ASP B 61 9.445 -13.465 10.491 1.00 0.00 H new ATOM 0 HA ASP B 61 10.745 -12.723 12.880 1.00 0.00 H new ATOM 0 HB2 ASP B 61 10.988 -11.541 10.083 1.00 0.00 H new ATOM 0 HB3 ASP B 61 12.174 -11.419 11.368 1.00 0.00 H new ATOM 2428 N ARG B 62 8.752 -10.481 11.486 1.00 0.00 N ATOM 2429 CA ARG B 62 7.958 -9.271 11.661 1.00 0.00 C ATOM 2430 C ARG B 62 7.215 -9.338 13.004 1.00 0.00 C ATOM 2431 O ARG B 62 7.188 -8.372 13.768 1.00 0.00 O ATOM 2432 CB ARG B 62 7.008 -9.134 10.447 1.00 0.00 C ATOM 2433 CG ARG B 62 6.978 -7.748 9.782 1.00 0.00 C ATOM 2434 CD ARG B 62 5.910 -6.834 10.386 1.00 0.00 C ATOM 2435 NE ARG B 62 6.206 -6.587 11.797 1.00 0.00 N ATOM 2436 CZ ARG B 62 6.850 -5.537 12.315 1.00 0.00 C ATOM 2437 NH1 ARG B 62 7.129 -4.452 11.587 1.00 0.00 N ATOM 2438 NH2 ARG B 62 7.213 -5.600 13.597 1.00 0.00 N ATOM 0 H ARG B 62 8.555 -10.952 10.603 1.00 0.00 H new ATOM 0 HA ARG B 62 8.585 -8.380 11.695 1.00 0.00 H new ATOM 0 HB2 ARG B 62 7.296 -9.871 9.697 1.00 0.00 H new ATOM 0 HB3 ARG B 62 5.997 -9.385 10.769 1.00 0.00 H new ATOM 0 HG2 ARG B 62 7.956 -7.277 9.885 1.00 0.00 H new ATOM 0 HG3 ARG B 62 6.791 -7.864 8.714 1.00 0.00 H new ATOM 0 HD2 ARG B 62 5.877 -5.890 9.842 1.00 0.00 H new ATOM 0 HD3 ARG B 62 4.927 -7.294 10.287 1.00 0.00 H new ATOM 0 HE ARG B 62 5.885 -7.294 12.458 1.00 0.00 H new ATOM 0 HH11 ARG B 62 6.849 -4.409 10.607 1.00 0.00 H new ATOM 0 HH12 ARG B 62 7.622 -3.666 12.011 1.00 0.00 H new ATOM 0 HH21 ARG B 62 6.997 -6.431 14.148 1.00 0.00 H new ATOM 0 HH22 ARG B 62 7.706 -4.817 14.026 1.00 0.00 H new ATOM 2452 N ASN B 63 6.610 -10.492 13.295 1.00 0.00 N ATOM 2453 CA ASN B 63 5.892 -10.718 14.544 1.00 0.00 C ATOM 2454 C ASN B 63 6.838 -10.878 15.730 1.00 0.00 C ATOM 2455 O ASN B 63 6.552 -10.383 16.816 1.00 0.00 O ATOM 2456 CB ASN B 63 5.023 -11.982 14.446 1.00 0.00 C ATOM 2457 CG ASN B 63 3.673 -11.711 13.801 1.00 0.00 C ATOM 2458 OD1 ASN B 63 2.638 -11.762 14.458 1.00 0.00 O ATOM 2459 ND2 ASN B 63 3.662 -11.468 12.497 1.00 0.00 N ATOM 0 H ASN B 63 6.606 -11.296 12.667 1.00 0.00 H new ATOM 0 HA ASN B 63 5.269 -9.839 14.707 1.00 0.00 H new ATOM 0 HB2 ASN B 63 5.553 -12.739 13.868 1.00 0.00 H new ATOM 0 HB3 ASN B 63 4.870 -12.392 15.444 1.00 0.00 H new ATOM 0 HD21 ASN B 63 2.776 -11.317 12.014 1.00 0.00 H new ATOM 0 HD22 ASN B 63 4.539 -11.432 11.978 1.00 0.00 H new ATOM 2517 N GLU B 67 2.111 -9.987 18.505 1.00 0.00 N ATOM 2518 CA GLU B 67 1.241 -9.306 17.560 1.00 0.00 C ATOM 2519 C GLU B 67 1.927 -8.049 17.025 1.00 0.00 C ATOM 2520 O GLU B 67 2.589 -7.335 17.778 1.00 0.00 O ATOM 2521 CB GLU B 67 -0.110 -8.949 18.179 1.00 0.00 C ATOM 2522 CG GLU B 67 -0.927 -10.179 18.589 1.00 0.00 C ATOM 2523 CD GLU B 67 -2.429 -9.898 18.542 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -2.814 -8.753 18.873 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -3.161 -10.830 18.145 1.00 0.00 O ATOM 0 HA GLU B 67 1.050 -9.993 16.736 1.00 0.00 H new ATOM 0 HB2 GLU B 67 0.053 -8.320 19.054 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -0.685 -8.359 17.465 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -0.691 -11.011 17.926 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -0.645 -10.485 19.596 1.00 0.00 H new ATOM 2532 N VAL B 68 1.732 -7.759 15.738 1.00 0.00 N ATOM 2533 CA VAL B 68 2.173 -6.514 15.132 1.00 0.00 C ATOM 2534 C VAL B 68 1.071 -5.473 15.345 1.00 0.00 C ATOM 2535 O VAL B 68 -0.099 -5.847 15.440 1.00 0.00 O ATOM 2536 CB VAL B 68 2.517 -6.727 13.645 1.00 0.00 C ATOM 2537 CG1 VAL B 68 3.527 -7.867 13.469 1.00 0.00 C ATOM 2538 CG2 VAL B 68 1.292 -6.989 12.762 1.00 0.00 C ATOM 0 H VAL B 68 1.261 -8.388 15.088 1.00 0.00 H new ATOM 0 HA VAL B 68 3.089 -6.153 15.600 1.00 0.00 H new ATOM 0 HB VAL B 68 2.958 -5.787 13.313 1.00 0.00 H new ATOM 0 HG11 VAL B 68 3.751 -7.994 12.410 1.00 0.00 H new ATOM 0 HG12 VAL B 68 4.444 -7.627 14.007 1.00 0.00 H new ATOM 0 HG13 VAL B 68 3.105 -8.791 13.864 1.00 0.00 H new ATOM 0 HG21 VAL B 68 1.611 -7.129 11.729 1.00 0.00 H new ATOM 0 HG22 VAL B 68 0.779 -7.886 13.108 1.00 0.00 H new ATOM 0 HG23 VAL B 68 0.613 -6.138 12.820 1.00 0.00 H new ATOM 2548 N ASN B 69 1.432 -4.187 15.433 1.00 0.00 N ATOM 2549 CA ASN B 69 0.471 -3.089 15.558 1.00 0.00 C ATOM 2550 C ASN B 69 0.068 -2.529 14.197 1.00 0.00 C ATOM 2551 O ASN B 69 0.658 -2.886 13.180 1.00 0.00 O ATOM 2552 CB ASN B 69 0.982 -1.995 16.511 1.00 0.00 C ATOM 2553 CG ASN B 69 2.036 -1.062 15.910 1.00 0.00 C ATOM 2554 OD1 ASN B 69 1.860 -0.500 14.831 1.00 0.00 O ATOM 2555 ND2 ASN B 69 3.148 -0.870 16.612 1.00 0.00 N ATOM 0 H ASN B 69 2.404 -3.879 15.419 1.00 0.00 H new ATOM 0 HA ASN B 69 -0.434 -3.500 16.005 1.00 0.00 H new ATOM 0 HB2 ASN B 69 0.134 -1.396 16.843 1.00 0.00 H new ATOM 0 HB3 ASN B 69 1.402 -2.471 17.397 1.00 0.00 H new ATOM 0 HD21 ASN B 69 3.874 -0.247 16.257 1.00 0.00 H new ATOM 0 HD22 ASN B 69 3.276 -1.345 17.505 1.00 0.00 H new ATOM 2562 N PHE B 70 -0.916 -1.625 14.194 1.00 0.00 N ATOM 2563 CA PHE B 70 -1.394 -0.937 13.002 1.00 0.00 C ATOM 2564 C PHE B 70 -0.268 -0.493 12.055 1.00 0.00 C ATOM 2565 O PHE B 70 -0.216 -0.966 10.923 1.00 0.00 O ATOM 2566 CB PHE B 70 -2.310 0.231 13.397 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.895 0.983 12.214 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -3.719 0.309 11.293 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -2.594 2.344 12.013 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -4.222 0.983 10.167 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -3.112 3.022 10.895 1.00 0.00 C ATOM 2572 CZ PHE B 70 -3.908 2.338 9.960 1.00 0.00 C ATOM 0 H PHE B 70 -1.410 -1.348 15.042 1.00 0.00 H new ATOM 0 HA PHE B 70 -1.975 -1.659 12.428 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.125 -0.151 14.011 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -1.746 0.929 14.015 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.966 -0.730 11.452 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -1.965 2.867 12.718 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -4.850 0.460 9.461 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -2.898 4.071 10.754 1.00 0.00 H new ATOM 0 HZ PHE B 70 -4.278 2.852 9.085 1.00 0.00 H new ATOM 2582 N GLN B 71 0.653 0.387 12.472 1.00 0.00 N ATOM 2583 CA GLN B 71 1.681 0.848 11.537 1.00 0.00 C ATOM 2584 C GLN B 71 2.599 -0.303 11.129 1.00 0.00 C ATOM 2585 O GLN B 71 3.086 -0.317 10.006 1.00 0.00 O ATOM 2586 CB GLN B 71 2.472 2.072 12.030 1.00 0.00 C ATOM 2587 CG GLN B 71 3.592 2.528 11.055 1.00 0.00 C ATOM 2588 CD GLN B 71 3.172 2.761 9.599 1.00 0.00 C ATOM 2589 OE1 GLN B 71 3.842 2.325 8.664 1.00 0.00 O ATOM 2590 NE2 GLN B 71 2.066 3.466 9.382 1.00 0.00 N ATOM 0 H GLN B 71 0.707 0.779 13.412 1.00 0.00 H new ATOM 0 HA GLN B 71 1.152 1.197 10.650 1.00 0.00 H new ATOM 0 HB2 GLN B 71 1.781 2.900 12.188 1.00 0.00 H new ATOM 0 HB3 GLN B 71 2.917 1.840 12.997 1.00 0.00 H new ATOM 0 HG2 GLN B 71 4.024 3.452 11.439 1.00 0.00 H new ATOM 0 HG3 GLN B 71 4.383 1.778 11.067 1.00 0.00 H new ATOM 0 HE21 GLN B 71 1.524 3.819 10.170 1.00 0.00 H new ATOM 0 HE22 GLN B 71 1.760 3.654 8.427 1.00 0.00 H new ATOM 2599 N GLU B 72 2.836 -1.285 11.999 1.00 0.00 N ATOM 2600 CA GLU B 72 3.630 -2.443 11.611 1.00 0.00 C ATOM 2601 C GLU B 72 2.920 -3.238 10.499 1.00 0.00 C ATOM 2602 O GLU B 72 3.552 -3.642 9.525 1.00 0.00 O ATOM 2603 CB GLU B 72 3.968 -3.291 12.838 1.00 0.00 C ATOM 2604 CG GLU B 72 4.737 -2.519 13.924 1.00 0.00 C ATOM 2605 CD GLU B 72 6.044 -1.894 13.441 1.00 0.00 C ATOM 2606 OE1 GLU B 72 5.975 -0.750 12.944 1.00 0.00 O ATOM 2607 OE2 GLU B 72 7.091 -2.564 13.589 1.00 0.00 O ATOM 0 H GLU B 72 2.495 -1.300 12.960 1.00 0.00 H new ATOM 0 HA GLU B 72 4.579 -2.110 11.192 1.00 0.00 H new ATOM 0 HB2 GLU B 72 3.045 -3.681 13.266 1.00 0.00 H new ATOM 0 HB3 GLU B 72 4.562 -4.150 12.524 1.00 0.00 H new ATOM 0 HG2 GLU B 72 4.095 -1.731 14.318 1.00 0.00 H new ATOM 0 HG3 GLU B 72 4.955 -3.196 14.750 1.00 0.00 H new ATOM 2614 N TYR B 73 1.599 -3.412 10.594 1.00 0.00 N ATOM 2615 CA TYR B 73 0.791 -3.952 9.501 1.00 0.00 C ATOM 2616 C TYR B 73 0.952 -3.081 8.249 1.00 0.00 C ATOM 2617 O TYR B 73 1.242 -3.584 7.164 1.00 0.00 O ATOM 2618 CB TYR B 73 -0.677 -4.086 9.944 1.00 0.00 C ATOM 2619 CG TYR B 73 -1.717 -3.808 8.870 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -2.022 -4.780 7.900 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -2.393 -2.572 8.851 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -3.039 -4.538 6.958 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -3.371 -2.314 7.878 1.00 0.00 C ATOM 2624 CZ TYR B 73 -3.727 -3.312 6.960 1.00 0.00 C ATOM 2625 OH TYR B 73 -4.761 -3.108 6.096 1.00 0.00 O ATOM 0 H TYR B 73 1.062 -3.182 11.430 1.00 0.00 H new ATOM 0 HA TYR B 73 1.140 -4.952 9.244 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -0.833 -5.096 10.322 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -0.850 -3.404 10.777 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -1.476 -5.712 7.878 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -2.157 -1.819 9.589 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -3.292 -5.296 6.232 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -3.849 -1.347 7.836 1.00 0.00 H new ATOM 0 HH TYR B 73 -5.344 -2.401 6.444 1.00 0.00 H new ATOM 2635 N ILE B 74 0.797 -1.764 8.394 1.00 0.00 N ATOM 2636 CA ILE B 74 1.001 -0.834 7.293 1.00 0.00 C ATOM 2637 C ILE B 74 2.443 -0.927 6.759 1.00 0.00 C ATOM 2638 O ILE B 74 2.679 -0.647 5.587 1.00 0.00 O ATOM 2639 CB ILE B 74 0.626 0.595 7.722 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -0.836 0.781 8.171 1.00 0.00 C ATOM 2641 CG2 ILE B 74 0.935 1.593 6.612 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -1.859 0.731 7.032 1.00 0.00 C ATOM 0 H ILE B 74 0.529 -1.319 9.272 1.00 0.00 H new ATOM 0 HA ILE B 74 0.341 -1.108 6.470 1.00 0.00 H new ATOM 0 HB ILE B 74 1.243 0.783 8.601 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -1.081 0.007 8.898 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -0.927 1.739 8.683 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.661 2.596 6.938 1.00 0.00 H new ATOM 0 HG22 ILE B 74 2.000 1.564 6.383 1.00 0.00 H new ATOM 0 HG23 ILE B 74 0.365 1.333 5.720 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -2.861 0.871 7.437 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -1.644 1.523 6.315 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -1.801 -0.236 6.533 1.00 0.00 H new ATOM 2654 N THR B 75 3.416 -1.332 7.577 1.00 0.00 N ATOM 2655 CA THR B 75 4.782 -1.595 7.142 1.00 0.00 C ATOM 2656 C THR B 75 4.852 -2.917 6.384 1.00 0.00 C ATOM 2657 O THR B 75 5.561 -3.002 5.389 1.00 0.00 O ATOM 2658 CB THR B 75 5.762 -1.509 8.320 1.00 0.00 C ATOM 2659 OG1 THR B 75 5.629 -0.252 8.950 1.00 0.00 O ATOM 2660 CG2 THR B 75 7.217 -1.643 7.861 1.00 0.00 C ATOM 0 H THR B 75 3.271 -1.488 8.575 1.00 0.00 H new ATOM 0 HA THR B 75 5.093 -0.820 6.442 1.00 0.00 H new ATOM 0 HB THR B 75 5.524 -2.327 9.000 1.00 0.00 H new ATOM 0 HG1 THR B 75 4.741 -0.183 9.359 1.00 0.00 H new ATOM 0 HG21 THR B 75 7.879 -1.577 8.725 1.00 0.00 H new ATOM 0 HG22 THR B 75 7.356 -2.606 7.370 1.00 0.00 H new ATOM 0 HG23 THR B 75 7.453 -0.841 7.161 1.00 0.00 H new ATOM 2668 N PHE B 76 4.098 -3.940 6.798 1.00 0.00 N ATOM 2669 CA PHE B 76 3.958 -5.163 6.015 1.00 0.00 C ATOM 2670 C PHE B 76 3.467 -4.807 4.604 1.00 0.00 C ATOM 2671 O PHE B 76 4.121 -5.122 3.608 1.00 0.00 O ATOM 2672 CB PHE B 76 3.026 -6.148 6.742 1.00 0.00 C ATOM 2673 CG PHE B 76 3.105 -7.587 6.273 1.00 0.00 C ATOM 2674 CD1 PHE B 76 4.152 -8.408 6.731 1.00 0.00 C ATOM 2675 CD2 PHE B 76 2.064 -8.150 5.509 1.00 0.00 C ATOM 2676 CE1 PHE B 76 4.152 -9.784 6.443 1.00 0.00 C ATOM 2677 CE2 PHE B 76 2.055 -9.530 5.237 1.00 0.00 C ATOM 2678 CZ PHE B 76 3.097 -10.348 5.705 1.00 0.00 C ATOM 0 H PHE B 76 3.575 -3.941 7.674 1.00 0.00 H new ATOM 0 HA PHE B 76 4.921 -5.662 5.910 1.00 0.00 H new ATOM 0 HB2 PHE B 76 3.254 -6.118 7.807 1.00 0.00 H new ATOM 0 HB3 PHE B 76 1.999 -5.802 6.626 1.00 0.00 H new ATOM 0 HD1 PHE B 76 4.959 -7.979 7.306 1.00 0.00 H new ATOM 0 HD2 PHE B 76 1.271 -7.521 5.131 1.00 0.00 H new ATOM 0 HE1 PHE B 76 4.963 -10.408 6.789 1.00 0.00 H new ATOM 0 HE2 PHE B 76 1.245 -9.962 4.667 1.00 0.00 H new ATOM 0 HZ PHE B 76 3.087 -11.408 5.498 1.00 0.00 H new ATOM 2688 N LEU B 77 2.340 -4.091 4.517 1.00 0.00 N ATOM 2689 CA LEU B 77 1.797 -3.651 3.233 1.00 0.00 C ATOM 2690 C LEU B 77 2.771 -2.731 2.492 1.00 0.00 C ATOM 2691 O LEU B 77 2.998 -2.889 1.296 1.00 0.00 O ATOM 2692 CB LEU B 77 0.462 -2.920 3.416 1.00 0.00 C ATOM 2693 CG LEU B 77 -0.667 -3.756 4.038 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -1.952 -2.928 3.945 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -0.876 -5.099 3.327 1.00 0.00 C ATOM 0 H LEU B 77 1.787 -3.805 5.325 1.00 0.00 H new ATOM 0 HA LEU B 77 1.639 -4.551 2.638 1.00 0.00 H new ATOM 0 HB2 LEU B 77 0.630 -2.044 4.042 1.00 0.00 H new ATOM 0 HB3 LEU B 77 0.129 -2.558 2.443 1.00 0.00 H new ATOM 0 HG LEU B 77 -0.400 -3.988 5.069 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -2.779 -3.490 4.378 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -1.823 -1.994 4.491 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -2.170 -2.710 2.899 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -1.686 -5.645 3.811 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -1.131 -4.922 2.282 1.00 0.00 H new ATOM 0 HD23 LEU B 77 0.041 -5.686 3.382 1.00 0.00 H new ATOM 2707 N GLY B 78 3.324 -1.744 3.187 1.00 0.00 N ATOM 2708 CA GLY B 78 4.198 -0.741 2.606 1.00 0.00 C ATOM 2709 C GLY B 78 5.458 -1.382 2.032 1.00 0.00 C ATOM 2710 O GLY B 78 5.888 -1.036 0.937 1.00 0.00 O ATOM 0 H GLY B 78 3.173 -1.619 4.188 1.00 0.00 H new ATOM 0 HA2 GLY B 78 3.668 -0.203 1.820 1.00 0.00 H new ATOM 0 HA3 GLY B 78 4.472 -0.008 3.365 1.00 0.00 H new ATOM 2714 N ALA B 79 6.035 -2.344 2.750 1.00 0.00 N ATOM 2715 CA ALA B 79 7.184 -3.104 2.294 1.00 0.00 C ATOM 2716 C ALA B 79 6.798 -3.986 1.104 1.00 0.00 C ATOM 2717 O ALA B 79 7.505 -4.003 0.099 1.00 0.00 O ATOM 2718 CB ALA B 79 7.741 -3.923 3.459 1.00 0.00 C ATOM 0 H ALA B 79 5.708 -2.617 3.677 1.00 0.00 H new ATOM 0 HA ALA B 79 7.966 -2.427 1.950 1.00 0.00 H new ATOM 0 HB1 ALA B 79 8.605 -4.496 3.121 1.00 0.00 H new ATOM 0 HB2 ALA B 79 8.043 -3.253 4.264 1.00 0.00 H new ATOM 0 HB3 ALA B 79 6.973 -4.605 3.824 1.00 0.00 H new ATOM 2724 N LEU B 80 5.669 -4.701 1.196 1.00 0.00 N ATOM 2725 CA LEU B 80 5.143 -5.481 0.077 1.00 0.00 C ATOM 2726 C LEU B 80 5.090 -4.607 -1.179 1.00 0.00 C ATOM 2727 O LEU B 80 5.651 -4.956 -2.221 1.00 0.00 O ATOM 2728 CB LEU B 80 3.754 -6.036 0.443 1.00 0.00 C ATOM 2729 CG LEU B 80 3.097 -6.857 -0.669 1.00 0.00 C ATOM 2730 CD1 LEU B 80 3.721 -8.246 -0.735 1.00 0.00 C ATOM 2731 CD2 LEU B 80 1.601 -7.010 -0.384 1.00 0.00 C ATOM 0 H LEU B 80 5.102 -4.753 2.042 1.00 0.00 H new ATOM 0 HA LEU B 80 5.799 -6.327 -0.131 1.00 0.00 H new ATOM 0 HB2 LEU B 80 3.846 -6.658 1.333 1.00 0.00 H new ATOM 0 HB3 LEU B 80 3.099 -5.204 0.702 1.00 0.00 H new ATOM 0 HG LEU B 80 3.248 -6.340 -1.616 1.00 0.00 H new ATOM 0 HD11 LEU B 80 3.246 -8.821 -1.530 1.00 0.00 H new ATOM 0 HD12 LEU B 80 4.788 -8.156 -0.940 1.00 0.00 H new ATOM 0 HD13 LEU B 80 3.576 -8.755 0.218 1.00 0.00 H new ATOM 0 HD21 LEU B 80 1.137 -7.595 -1.178 1.00 0.00 H new ATOM 0 HD22 LEU B 80 1.463 -7.519 0.570 1.00 0.00 H new ATOM 0 HD23 LEU B 80 1.136 -6.025 -0.340 1.00 0.00 H new ATOM 2743 N ALA B 81 4.435 -3.452 -1.047 1.00 0.00 N ATOM 2744 CA ALA B 81 4.343 -2.448 -2.087 1.00 0.00 C ATOM 2745 C ALA B 81 5.735 -2.072 -2.588 1.00 0.00 C ATOM 2746 O ALA B 81 6.008 -2.207 -3.774 1.00 0.00 O ATOM 2747 CB ALA B 81 3.578 -1.229 -1.570 1.00 0.00 C ATOM 0 H ALA B 81 3.945 -3.191 -0.191 1.00 0.00 H new ATOM 0 HA ALA B 81 3.790 -2.855 -2.934 1.00 0.00 H new ATOM 0 HB1 ALA B 81 3.513 -0.479 -2.358 1.00 0.00 H new ATOM 0 HB2 ALA B 81 2.574 -1.529 -1.272 1.00 0.00 H new ATOM 0 HB3 ALA B 81 4.101 -0.809 -0.711 1.00 0.00 H new ATOM 2753 N MET B 82 6.620 -1.625 -1.696 1.00 0.00 N ATOM 2754 CA MET B 82 7.981 -1.230 -2.033 1.00 0.00 C ATOM 2755 C MET B 82 8.659 -2.286 -2.908 1.00 0.00 C ATOM 2756 O MET B 82 9.284 -1.947 -3.911 1.00 0.00 O ATOM 2757 CB MET B 82 8.771 -0.954 -0.746 1.00 0.00 C ATOM 2758 CG MET B 82 10.068 -0.181 -1.010 1.00 0.00 C ATOM 2759 SD MET B 82 11.138 0.060 0.434 1.00 0.00 S ATOM 2760 CE MET B 82 10.034 0.956 1.551 1.00 0.00 C ATOM 0 H MET B 82 6.404 -1.527 -0.704 1.00 0.00 H new ATOM 0 HA MET B 82 7.953 -0.311 -2.618 1.00 0.00 H new ATOM 0 HB2 MET B 82 8.148 -0.387 -0.055 1.00 0.00 H new ATOM 0 HB3 MET B 82 9.008 -1.900 -0.259 1.00 0.00 H new ATOM 0 HG2 MET B 82 10.635 -0.708 -1.777 1.00 0.00 H new ATOM 0 HG3 MET B 82 9.812 0.797 -1.418 1.00 0.00 H new ATOM 0 HE1 MET B 82 10.602 1.327 2.404 1.00 0.00 H new ATOM 0 HE2 MET B 82 9.584 1.796 1.021 1.00 0.00 H new ATOM 0 HE3 MET B 82 9.249 0.286 1.902 1.00 0.00 H new ATOM 2770 N ILE B 83 8.544 -3.562 -2.528 1.00 0.00 N ATOM 2771 CA ILE B 83 9.215 -4.641 -3.236 1.00 0.00 C ATOM 2772 C ILE B 83 8.547 -4.922 -4.593 1.00 0.00 C ATOM 2773 O ILE B 83 9.269 -4.988 -5.588 1.00 0.00 O ATOM 2774 CB ILE B 83 9.339 -5.896 -2.353 1.00 0.00 C ATOM 2775 CG1 ILE B 83 10.071 -5.622 -1.026 1.00 0.00 C ATOM 2776 CG2 ILE B 83 10.114 -6.992 -3.106 1.00 0.00 C ATOM 2777 CD1 ILE B 83 9.695 -6.665 0.033 1.00 0.00 C ATOM 0 H ILE B 83 7.988 -3.868 -1.729 1.00 0.00 H new ATOM 0 HA ILE B 83 10.233 -4.321 -3.459 1.00 0.00 H new ATOM 0 HB ILE B 83 8.322 -6.214 -2.125 1.00 0.00 H new ATOM 0 HG12 ILE B 83 11.148 -5.637 -1.191 1.00 0.00 H new ATOM 0 HG13 ILE B 83 9.818 -4.625 -0.666 1.00 0.00 H new ATOM 0 HG21 ILE B 83 10.198 -7.877 -2.475 1.00 0.00 H new ATOM 0 HG22 ILE B 83 9.583 -7.249 -4.023 1.00 0.00 H new ATOM 0 HG23 ILE B 83 11.111 -6.628 -3.354 1.00 0.00 H new ATOM 0 HD11 ILE B 83 10.225 -6.449 0.961 1.00 0.00 H new ATOM 0 HD12 ILE B 83 8.620 -6.630 0.213 1.00 0.00 H new ATOM 0 HD13 ILE B 83 9.972 -7.658 -0.320 1.00 0.00 H new ATOM 2789 N TYR B 84 7.218 -5.134 -4.666 1.00 0.00 N ATOM 2790 CA TYR B 84 6.584 -5.507 -5.941 1.00 0.00 C ATOM 2791 C TYR B 84 6.216 -4.324 -6.844 1.00 0.00 C ATOM 2792 O TYR B 84 6.398 -4.403 -8.059 1.00 0.00 O ATOM 2793 CB TYR B 84 5.538 -6.639 -5.859 1.00 0.00 C ATOM 2794 CG TYR B 84 4.289 -6.554 -4.995 1.00 0.00 C ATOM 2795 CD1 TYR B 84 3.672 -5.332 -4.667 1.00 0.00 C ATOM 2796 CD2 TYR B 84 3.598 -7.756 -4.746 1.00 0.00 C ATOM 2797 CE1 TYR B 84 2.363 -5.314 -4.152 1.00 0.00 C ATOM 2798 CE2 TYR B 84 2.309 -7.743 -4.190 1.00 0.00 C ATOM 2799 CZ TYR B 84 1.672 -6.518 -3.937 1.00 0.00 C ATOM 2800 OH TYR B 84 0.391 -6.502 -3.473 1.00 0.00 O ATOM 0 H TYR B 84 6.578 -5.055 -3.876 1.00 0.00 H new ATOM 0 HA TYR B 84 7.392 -5.991 -6.489 1.00 0.00 H new ATOM 0 HB2 TYR B 84 5.197 -6.819 -6.878 1.00 0.00 H new ATOM 0 HB3 TYR B 84 6.074 -7.533 -5.540 1.00 0.00 H new ATOM 0 HD1 TYR B 84 4.206 -4.404 -4.811 1.00 0.00 H new ATOM 0 HD2 TYR B 84 4.066 -8.699 -4.986 1.00 0.00 H new ATOM 0 HE1 TYR B 84 1.888 -4.372 -3.921 1.00 0.00 H new ATOM 0 HE2 TYR B 84 1.809 -8.672 -3.958 1.00 0.00 H new ATOM 0 HH TYR B 84 0.064 -7.422 -3.383 1.00 0.00 H new ATOM 2810 N ASN B 85 5.778 -3.194 -6.290 1.00 0.00 N ATOM 2811 CA ASN B 85 5.585 -1.959 -7.044 1.00 0.00 C ATOM 2812 C ASN B 85 6.952 -1.282 -7.164 1.00 0.00 C ATOM 2813 O ASN B 85 7.160 -0.173 -6.672 1.00 0.00 O ATOM 2814 CB ASN B 85 4.545 -1.042 -6.376 1.00 0.00 C ATOM 2815 CG ASN B 85 3.186 -1.708 -6.175 1.00 0.00 C ATOM 2816 OD1 ASN B 85 2.795 -2.008 -5.054 1.00 0.00 O ATOM 2817 ND2 ASN B 85 2.432 -1.928 -7.248 1.00 0.00 N ATOM 0 H ASN B 85 5.546 -3.111 -5.300 1.00 0.00 H new ATOM 0 HA ASN B 85 5.187 -2.177 -8.035 1.00 0.00 H new ATOM 0 HB2 ASN B 85 4.928 -0.716 -5.409 1.00 0.00 H new ATOM 0 HB3 ASN B 85 4.416 -0.148 -6.986 1.00 0.00 H new ATOM 0 HD21 ASN B 85 1.511 -2.353 -7.145 1.00 0.00 H new ATOM 0 HD22 ASN B 85 2.775 -1.671 -8.174 1.00 0.00 H new ATOM 2824 N GLU B 86 7.880 -1.976 -7.834 1.00 0.00 N ATOM 2825 CA GLU B 86 9.304 -1.661 -7.907 1.00 0.00 C ATOM 2826 C GLU B 86 9.591 -0.185 -8.162 1.00 0.00 C ATOM 2827 O GLU B 86 10.559 0.350 -7.625 1.00 0.00 O ATOM 2828 CB GLU B 86 9.964 -2.519 -8.996 1.00 0.00 C ATOM 2829 CG GLU B 86 10.008 -3.996 -8.586 1.00 0.00 C ATOM 2830 CD GLU B 86 10.607 -4.894 -9.664 1.00 0.00 C ATOM 2831 OE1 GLU B 86 11.450 -4.389 -10.434 1.00 0.00 O ATOM 2832 OE2 GLU B 86 10.213 -6.082 -9.688 1.00 0.00 O ATOM 0 H GLU B 86 7.642 -2.814 -8.365 1.00 0.00 H new ATOM 0 HA GLU B 86 9.727 -1.890 -6.929 1.00 0.00 H new ATOM 0 HB2 GLU B 86 9.412 -2.414 -9.930 1.00 0.00 H new ATOM 0 HB3 GLU B 86 10.976 -2.160 -9.182 1.00 0.00 H new ATOM 0 HG2 GLU B 86 10.592 -4.097 -7.671 1.00 0.00 H new ATOM 0 HG3 GLU B 86 8.997 -4.335 -8.358 1.00 0.00 H new ATOM 2839 N ALA B 87 8.754 0.462 -8.980 1.00 0.00 N ATOM 2840 CA ALA B 87 8.854 1.876 -9.307 1.00 0.00 C ATOM 2841 C ALA B 87 9.044 2.765 -8.072 1.00 0.00 C ATOM 2842 O ALA B 87 9.715 3.790 -8.160 1.00 0.00 O ATOM 2843 CB ALA B 87 7.612 2.306 -10.093 1.00 0.00 C ATOM 0 H ALA B 87 7.971 -0.001 -9.441 1.00 0.00 H new ATOM 0 HA ALA B 87 9.747 2.008 -9.918 1.00 0.00 H new ATOM 0 HB1 ALA B 87 7.686 3.365 -10.339 1.00 0.00 H new ATOM 0 HB2 ALA B 87 7.544 1.724 -11.012 1.00 0.00 H new ATOM 0 HB3 ALA B 87 6.721 2.135 -9.488 1.00 0.00 H new ATOM 2849 N LEU B 88 8.478 2.371 -6.923 1.00 0.00 N ATOM 2850 CA LEU B 88 8.690 3.067 -5.660 1.00 0.00 C ATOM 2851 C LEU B 88 10.173 3.301 -5.379 1.00 0.00 C ATOM 2852 O LEU B 88 10.536 4.363 -4.879 1.00 0.00 O ATOM 2853 CB LEU B 88 8.055 2.285 -4.501 1.00 0.00 C ATOM 2854 CG LEU B 88 6.533 2.482 -4.406 1.00 0.00 C ATOM 2855 CD1 LEU B 88 5.946 1.408 -3.488 1.00 0.00 C ATOM 2856 CD2 LEU B 88 6.181 3.855 -3.821 1.00 0.00 C ATOM 0 H LEU B 88 7.862 1.561 -6.850 1.00 0.00 H new ATOM 0 HA LEU B 88 8.209 4.041 -5.744 1.00 0.00 H new ATOM 0 HB2 LEU B 88 8.271 1.224 -4.624 1.00 0.00 H new ATOM 0 HB3 LEU B 88 8.515 2.597 -3.564 1.00 0.00 H new ATOM 0 HG LEU B 88 6.121 2.411 -5.413 1.00 0.00 H new ATOM 0 HD11 LEU B 88 4.867 1.541 -3.416 1.00 0.00 H new ATOM 0 HD12 LEU B 88 6.163 0.421 -3.897 1.00 0.00 H new ATOM 0 HD13 LEU B 88 6.390 1.495 -2.496 1.00 0.00 H new ATOM 0 HD21 LEU B 88 5.097 3.961 -3.768 1.00 0.00 H new ATOM 0 HD22 LEU B 88 6.604 3.943 -2.820 1.00 0.00 H new ATOM 0 HD23 LEU B 88 6.591 4.638 -4.458 1.00 0.00 H new