USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 904 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 85 LYS NZ :NH3+ 143:sc= 1.24 (180deg=-0.111) USER MOD Set 1.2: A 115 THR OG1 : rot -119:sc= 1.73 USER MOD Set 2.1: A 56 ASN : amide:sc= 1.58 K(o=3.4,f=-1.3!) USER MOD Set 2.2: A 102 ASN : amide:sc= -2.66! C(o=3.4!,f=-0.92!) USER MOD Set 2.3: A 104 SER OG : rot -118:sc= 2.15 USER MOD Set 2.4: A 108 SER OG : rot 58:sc= 2.27 USER MOD Set 3.1: A 36 ASN : amide:sc= 0.819 K(o=2.5,f=-3.2!) USER MOD Set 3.2: A 86 TYR OH : rot -65:sc= 1.68 USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 THR OG1 : rot -56:sc= 1.26 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.00701 USER MOD Single : A 26 GLN :FLIP amide:sc= -0.506 F(o=-1.9!,f=-0.51) USER MOD Single : A 28 LYS NZ :NH3+ -157:sc= 0.959 (180deg=0.571) USER MOD Single : A 37 LYS NZ :NH3+ 141:sc= 1.16 (180deg=0.642) USER MOD Single : A 40 LYS NZ :NH3+ -136:sc= 1.16 (180deg=-0.529!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.0711 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 HIS : +bothHN:sc= 1.09 K(o=1.1,f=-11!) USER MOD Single : A 52 SER OG : rot 69:sc= 0.764 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.0109 USER MOD Single : A 54 ASN : amide:sc= 0.312 K(o=0.31,f=-3.3!) USER MOD Single : A 59 MET CE :methyl 166:sc= -1.36! (180deg=-2.23!) USER MOD Single : A 60 THR OG1 : rot -170:sc= 0.0228 USER MOD Single : A 66 ASN : amide:sc= -1.68! C(o=-1.7!,f=-7.5!) USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -0.504 K(o=-0.5,f=-2.5!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 TYR OH : rot 86:sc= 0.286 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 71:sc= 1.25 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ -174:sc= 2.08 (180deg=2.03) USER MOD Single : A 101 LYS NZ :NH3+ -156:sc= 2.45 (180deg=2.27) USER MOD Single : A 103 ASN : amide:sc= 0.708 K(o=0.71,f=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 ASN : amide:sc= -0.0349 K(o=-0.035,f=-0.73) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 120 LYS NZ :NH3+ -140:sc= 1.18 (180deg=-0.792) USER MOD Single : A 123 SER OG : rot 78:sc= 1.3 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 14 -7.658 -16.865 9.600 1.00 0.00 N ATOM 2 CA ARG A 14 -7.219 -16.404 8.292 1.00 0.00 C ATOM 3 C ARG A 14 -8.291 -15.522 7.669 1.00 0.00 C ATOM 4 O ARG A 14 -9.408 -15.971 7.415 1.00 0.00 O ATOM 5 CB ARG A 14 -6.914 -17.590 7.368 1.00 0.00 C ATOM 6 CG ARG A 14 -6.241 -17.189 6.062 1.00 0.00 C ATOM 7 CD ARG A 14 -7.237 -17.145 4.911 1.00 0.00 C ATOM 8 NE ARG A 14 -6.589 -17.294 3.608 1.00 0.00 N ATOM 9 CZ ARG A 14 -6.480 -18.455 2.961 1.00 0.00 C ATOM 10 NH1 ARG A 14 -6.922 -19.575 3.521 1.00 0.00 N ATOM 11 NH2 ARG A 14 -5.921 -18.494 1.757 1.00 0.00 N ATOM 0 HA ARG A 14 -6.304 -15.826 8.420 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -6.272 -18.295 7.896 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -7.844 -18.112 7.142 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -5.774 -16.211 6.178 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -5.445 -17.897 5.829 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -7.973 -17.938 5.041 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -7.779 -16.200 4.939 1.00 0.00 H new ATOM 0 HE ARG A 14 -6.198 -16.461 3.168 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -7.346 -19.549 4.448 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -6.837 -20.462 3.024 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -5.575 -17.636 1.327 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -5.838 -19.382 1.262 1.00 0.00 H new ATOM 25 N ILE A 15 -7.953 -14.261 7.447 1.00 0.00 N ATOM 26 CA ILE A 15 -8.867 -13.328 6.804 1.00 0.00 C ATOM 27 C ILE A 15 -8.983 -13.654 5.317 1.00 0.00 C ATOM 28 O ILE A 15 -7.976 -13.808 4.634 1.00 0.00 O ATOM 29 CB ILE A 15 -8.406 -11.861 6.981 1.00 0.00 C ATOM 30 CG1 ILE A 15 -7.506 -11.724 8.217 1.00 0.00 C ATOM 31 CG2 ILE A 15 -9.610 -10.934 7.094 1.00 0.00 C ATOM 32 CD1 ILE A 15 -6.902 -10.345 8.387 1.00 0.00 C ATOM 0 H ILE A 15 -7.051 -13.859 7.703 1.00 0.00 H new ATOM 0 HA ILE A 15 -9.840 -13.435 7.283 1.00 0.00 H new ATOM 0 HB ILE A 15 -7.829 -11.574 6.102 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -8.087 -11.967 9.106 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -6.702 -12.457 8.152 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -9.268 -9.907 7.218 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -10.213 -11.009 6.189 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -10.212 -11.222 7.956 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -6.280 -10.328 9.282 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -6.292 -10.105 7.516 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -7.699 -9.608 8.486 1.00 0.00 H new ATOM 44 N PRO A 16 -10.210 -13.787 4.798 1.00 0.00 N ATOM 45 CA PRO A 16 -10.439 -14.167 3.400 1.00 0.00 C ATOM 46 C PRO A 16 -10.082 -13.061 2.406 1.00 0.00 C ATOM 47 O PRO A 16 -10.048 -13.291 1.198 1.00 0.00 O ATOM 48 CB PRO A 16 -11.947 -14.467 3.342 1.00 0.00 C ATOM 49 CG PRO A 16 -12.410 -14.502 4.763 1.00 0.00 C ATOM 50 CD PRO A 16 -11.475 -13.615 5.525 1.00 0.00 C ATOM 0 HA PRO A 16 -9.808 -15.009 3.116 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -12.477 -13.700 2.777 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -12.138 -15.418 2.845 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -13.438 -14.149 4.847 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -12.389 -15.519 5.155 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -11.807 -12.577 5.521 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -11.388 -13.918 6.568 1.00 0.00 H new ATOM 58 N ASN A 17 -9.807 -11.862 2.908 1.00 0.00 N ATOM 59 CA ASN A 17 -9.548 -10.720 2.035 1.00 0.00 C ATOM 60 C ASN A 17 -8.192 -10.093 2.319 1.00 0.00 C ATOM 61 O ASN A 17 -8.069 -8.870 2.387 1.00 0.00 O ATOM 62 CB ASN A 17 -10.642 -9.655 2.182 1.00 0.00 C ATOM 63 CG ASN A 17 -12.046 -10.228 2.143 1.00 0.00 C ATOM 64 OD1 ASN A 17 -12.839 -10.003 3.058 1.00 0.00 O ATOM 65 ND2 ASN A 17 -12.370 -10.967 1.090 1.00 0.00 N ATOM 0 H ASN A 17 -9.758 -11.655 3.906 1.00 0.00 H new ATOM 0 HA ASN A 17 -9.549 -11.097 1.012 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -10.499 -9.125 3.124 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -10.534 -8.921 1.384 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -13.304 -11.371 1.018 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -11.685 -11.131 0.352 1.00 0.00 H new ATOM 72 N ILE A 18 -7.174 -10.921 2.495 1.00 0.00 N ATOM 73 CA ILE A 18 -5.825 -10.406 2.655 1.00 0.00 C ATOM 74 C ILE A 18 -5.064 -10.506 1.343 1.00 0.00 C ATOM 75 O ILE A 18 -4.663 -11.592 0.912 1.00 0.00 O ATOM 76 CB ILE A 18 -5.032 -11.124 3.768 1.00 0.00 C ATOM 77 CG1 ILE A 18 -5.389 -12.610 3.824 1.00 0.00 C ATOM 78 CG2 ILE A 18 -5.291 -10.454 5.109 1.00 0.00 C ATOM 79 CD1 ILE A 18 -4.483 -13.420 4.727 1.00 0.00 C ATOM 0 H ILE A 18 -7.254 -11.937 2.530 1.00 0.00 H new ATOM 0 HA ILE A 18 -5.926 -9.362 2.952 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.969 -11.047 3.540 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -6.418 -12.715 4.168 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -5.346 -13.023 2.816 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.727 -10.968 5.887 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -4.977 -9.411 5.062 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.355 -10.502 5.340 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -4.797 -14.464 4.716 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -3.455 -13.347 4.372 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.543 -13.034 5.744 1.00 0.00 H new ATOM 91 N ALA A 19 -4.889 -9.370 0.699 1.00 0.00 N ATOM 92 CA ALA A 19 -4.152 -9.308 -0.542 1.00 0.00 C ATOM 93 C ALA A 19 -2.708 -8.939 -0.254 1.00 0.00 C ATOM 94 O ALA A 19 -2.346 -7.762 -0.249 1.00 0.00 O ATOM 95 CB ALA A 19 -4.789 -8.307 -1.493 1.00 0.00 C ATOM 0 H ALA A 19 -5.251 -8.472 1.019 1.00 0.00 H new ATOM 0 HA ALA A 19 -4.177 -10.285 -1.024 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.220 -8.275 -2.422 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -5.814 -8.609 -1.706 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -4.790 -7.319 -1.034 1.00 0.00 H new ATOM 101 N THR A 20 -1.902 -9.949 0.035 1.00 0.00 N ATOM 102 CA THR A 20 -0.495 -9.745 0.316 1.00 0.00 C ATOM 103 C THR A 20 0.272 -9.436 -0.964 1.00 0.00 C ATOM 104 O THR A 20 0.616 -10.335 -1.731 1.00 0.00 O ATOM 105 CB THR A 20 0.116 -10.985 0.994 1.00 0.00 C ATOM 106 OG1 THR A 20 -0.877 -11.638 1.799 1.00 0.00 O ATOM 107 CG2 THR A 20 1.312 -10.602 1.856 1.00 0.00 C ATOM 0 H THR A 20 -2.203 -10.922 0.080 1.00 0.00 H new ATOM 0 HA THR A 20 -0.414 -8.896 0.994 1.00 0.00 H new ATOM 0 HB THR A 20 0.460 -11.667 0.216 1.00 0.00 H new ATOM 0 HG1 THR A 20 -1.239 -11.003 2.451 1.00 0.00 H new ATOM 0 HG21 THR A 20 1.725 -11.496 2.323 1.00 0.00 H new ATOM 0 HG22 THR A 20 2.074 -10.133 1.233 1.00 0.00 H new ATOM 0 HG23 THR A 20 0.994 -9.902 2.629 1.00 0.00 H new ATOM 115 N TYR A 21 0.531 -8.161 -1.185 1.00 0.00 N ATOM 116 CA TYR A 21 1.305 -7.727 -2.331 1.00 0.00 C ATOM 117 C TYR A 21 2.780 -7.950 -2.053 1.00 0.00 C ATOM 118 O TYR A 21 3.357 -7.329 -1.160 1.00 0.00 O ATOM 119 CB TYR A 21 1.031 -6.254 -2.640 1.00 0.00 C ATOM 120 CG TYR A 21 -0.388 -5.994 -3.100 1.00 0.00 C ATOM 121 CD1 TYR A 21 -0.766 -6.234 -4.415 1.00 0.00 C ATOM 122 CD2 TYR A 21 -1.350 -5.518 -2.218 1.00 0.00 C ATOM 123 CE1 TYR A 21 -2.061 -6.008 -4.837 1.00 0.00 C ATOM 124 CE2 TYR A 21 -2.650 -5.294 -2.632 1.00 0.00 C ATOM 125 CZ TYR A 21 -2.998 -5.540 -3.943 1.00 0.00 C ATOM 126 OH TYR A 21 -4.291 -5.323 -4.362 1.00 0.00 O ATOM 0 H TYR A 21 0.214 -7.403 -0.581 1.00 0.00 H new ATOM 0 HA TYR A 21 1.012 -8.311 -3.204 1.00 0.00 H new ATOM 0 HB2 TYR A 21 1.232 -5.659 -1.749 1.00 0.00 H new ATOM 0 HB3 TYR A 21 1.723 -5.916 -3.411 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -0.035 -6.603 -5.119 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -1.078 -5.320 -1.192 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -2.338 -6.197 -5.864 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -3.388 -4.929 -1.933 1.00 0.00 H new ATOM 0 HH TYR A 21 -4.828 -4.994 -3.611 1.00 0.00 H new ATOM 136 N THR A 22 3.376 -8.858 -2.796 1.00 0.00 N ATOM 137 CA THR A 22 4.760 -9.222 -2.587 1.00 0.00 C ATOM 138 C THR A 22 5.593 -8.884 -3.815 1.00 0.00 C ATOM 139 O THR A 22 5.367 -9.423 -4.899 1.00 0.00 O ATOM 140 CB THR A 22 4.887 -10.720 -2.273 1.00 0.00 C ATOM 141 OG1 THR A 22 3.630 -11.376 -2.509 1.00 0.00 O ATOM 142 CG2 THR A 22 5.315 -10.939 -0.831 1.00 0.00 C ATOM 0 H THR A 22 2.918 -9.361 -3.556 1.00 0.00 H new ATOM 0 HA THR A 22 5.132 -8.651 -1.736 1.00 0.00 H new ATOM 0 HB THR A 22 5.649 -11.143 -2.927 1.00 0.00 H new ATOM 0 HG1 THR A 22 3.717 -12.331 -2.309 1.00 0.00 H new ATOM 0 HG21 THR A 22 5.398 -12.008 -0.634 1.00 0.00 H new ATOM 0 HG22 THR A 22 6.281 -10.463 -0.662 1.00 0.00 H new ATOM 0 HG23 THR A 22 4.574 -10.503 -0.161 1.00 0.00 H new ATOM 150 N GLY A 23 6.548 -7.986 -3.648 1.00 0.00 N ATOM 151 CA GLY A 23 7.368 -7.574 -4.766 1.00 0.00 C ATOM 152 C GLY A 23 8.800 -7.313 -4.368 1.00 0.00 C ATOM 153 O GLY A 23 9.071 -6.876 -3.245 1.00 0.00 O ATOM 0 H GLY A 23 6.771 -7.535 -2.761 1.00 0.00 H new ATOM 0 HA2 GLY A 23 7.343 -8.346 -5.535 1.00 0.00 H new ATOM 0 HA3 GLY A 23 6.947 -6.671 -5.208 1.00 0.00 H new ATOM 157 N THR A 24 9.717 -7.583 -5.280 1.00 0.00 N ATOM 158 CA THR A 24 11.126 -7.354 -5.030 1.00 0.00 C ATOM 159 C THR A 24 11.539 -5.956 -5.486 1.00 0.00 C ATOM 160 O THR A 24 11.982 -5.758 -6.619 1.00 0.00 O ATOM 161 CB THR A 24 12.000 -8.411 -5.732 1.00 0.00 C ATOM 162 OG1 THR A 24 11.188 -9.526 -6.135 1.00 0.00 O ATOM 163 CG2 THR A 24 13.109 -8.895 -4.811 1.00 0.00 C ATOM 0 H THR A 24 9.508 -7.963 -6.203 1.00 0.00 H new ATOM 0 HA THR A 24 11.282 -7.437 -3.954 1.00 0.00 H new ATOM 0 HB THR A 24 12.453 -7.952 -6.610 1.00 0.00 H new ATOM 0 HG1 THR A 24 11.748 -10.194 -6.582 1.00 0.00 H new ATOM 0 HG21 THR A 24 13.713 -9.641 -5.329 1.00 0.00 H new ATOM 0 HG22 THR A 24 13.739 -8.052 -4.526 1.00 0.00 H new ATOM 0 HG23 THR A 24 12.672 -9.340 -3.917 1.00 0.00 H new ATOM 171 N ILE A 25 11.353 -4.984 -4.604 1.00 0.00 N ATOM 172 CA ILE A 25 11.816 -3.624 -4.847 1.00 0.00 C ATOM 173 C ILE A 25 13.350 -3.599 -4.807 1.00 0.00 C ATOM 174 O ILE A 25 13.975 -4.452 -4.165 1.00 0.00 O ATOM 175 CB ILE A 25 11.213 -2.625 -3.810 1.00 0.00 C ATOM 176 CG1 ILE A 25 12.099 -1.383 -3.640 1.00 0.00 C ATOM 177 CG2 ILE A 25 10.996 -3.306 -2.467 1.00 0.00 C ATOM 178 CD1 ILE A 25 11.468 -0.290 -2.811 1.00 0.00 C ATOM 0 H ILE A 25 10.882 -5.113 -3.709 1.00 0.00 H new ATOM 0 HA ILE A 25 11.476 -3.305 -5.832 1.00 0.00 H new ATOM 0 HB ILE A 25 10.248 -2.298 -4.197 1.00 0.00 H new ATOM 0 HG12 ILE A 25 13.039 -1.680 -3.176 1.00 0.00 H new ATOM 0 HG13 ILE A 25 12.342 -0.984 -4.625 1.00 0.00 H new ATOM 0 HG21 ILE A 25 10.575 -2.591 -1.760 1.00 0.00 H new ATOM 0 HG22 ILE A 25 10.308 -4.142 -2.590 1.00 0.00 H new ATOM 0 HG23 ILE A 25 11.949 -3.673 -2.087 1.00 0.00 H new ATOM 0 HD11 ILE A 25 12.155 0.553 -2.737 1.00 0.00 H new ATOM 0 HD12 ILE A 25 10.542 0.037 -3.284 1.00 0.00 H new ATOM 0 HD13 ILE A 25 11.251 -0.670 -1.813 1.00 0.00 H new ATOM 190 N GLN A 26 13.964 -2.644 -5.492 1.00 0.00 N ATOM 191 CA GLN A 26 15.414 -2.621 -5.586 1.00 0.00 C ATOM 192 C GLN A 26 16.006 -1.424 -4.854 1.00 0.00 C ATOM 193 O GLN A 26 16.323 -0.406 -5.470 1.00 0.00 O ATOM 194 CB GLN A 26 15.862 -2.610 -7.047 1.00 0.00 C ATOM 195 CG GLN A 26 15.150 -3.631 -7.920 1.00 0.00 C ATOM 196 CD GLN A 26 16.055 -4.770 -8.354 1.00 0.00 C ATOM 197 OE1 GLN A 26 17.363 -4.556 -8.297 1.00 0.00 O flip ATOM 198 NE2 GLN A 26 15.581 -5.840 -8.736 1.00 0.00 N flip ATOM 0 H GLN A 26 13.488 -1.887 -5.983 1.00 0.00 H new ATOM 0 HA GLN A 26 15.783 -3.528 -5.107 1.00 0.00 H new ATOM 0 HB2 GLN A 26 15.695 -1.615 -7.460 1.00 0.00 H new ATOM 0 HB3 GLN A 26 16.935 -2.797 -7.089 1.00 0.00 H new ATOM 0 HG2 GLN A 26 14.299 -4.038 -7.374 1.00 0.00 H new ATOM 0 HG3 GLN A 26 14.753 -3.132 -8.804 1.00 0.00 H new ATOM 0 HE21 GLN A 26 14.569 -5.968 -8.766 1.00 0.00 H new ATOM 0 HE22 GLN A 26 16.200 -6.599 -9.022 1.00 0.00 H new ATOM 207 N GLY A 27 16.138 -1.563 -3.534 1.00 0.00 N ATOM 208 CA GLY A 27 16.890 -0.607 -2.734 1.00 0.00 C ATOM 209 C GLY A 27 16.383 0.804 -2.866 1.00 0.00 C ATOM 210 O GLY A 27 15.300 1.122 -2.401 1.00 0.00 O ATOM 0 H GLY A 27 15.732 -2.331 -3.000 1.00 0.00 H new ATOM 0 HA2 GLY A 27 16.846 -0.906 -1.687 1.00 0.00 H new ATOM 0 HA3 GLY A 27 17.938 -0.639 -3.031 1.00 0.00 H new ATOM 214 N LYS A 28 17.169 1.642 -3.511 1.00 0.00 N ATOM 215 CA LYS A 28 16.804 3.036 -3.753 1.00 0.00 C ATOM 216 C LYS A 28 15.650 3.135 -4.750 1.00 0.00 C ATOM 217 O LYS A 28 15.721 3.860 -5.747 1.00 0.00 O ATOM 218 CB LYS A 28 18.013 3.824 -4.267 1.00 0.00 C ATOM 219 CG LYS A 28 19.186 3.871 -3.296 1.00 0.00 C ATOM 220 CD LYS A 28 18.732 3.878 -1.843 1.00 0.00 C ATOM 221 CE LYS A 28 18.664 5.289 -1.282 1.00 0.00 C ATOM 222 NZ LYS A 28 19.569 5.463 -0.115 1.00 0.00 N ATOM 0 H LYS A 28 18.081 1.382 -3.885 1.00 0.00 H new ATOM 0 HA LYS A 28 16.477 3.467 -2.807 1.00 0.00 H new ATOM 0 HB2 LYS A 28 18.349 3.381 -5.204 1.00 0.00 H new ATOM 0 HB3 LYS A 28 17.700 4.844 -4.490 1.00 0.00 H new ATOM 0 HG2 LYS A 28 19.832 3.010 -3.468 1.00 0.00 H new ATOM 0 HG3 LYS A 28 19.782 4.762 -3.493 1.00 0.00 H new ATOM 0 HD2 LYS A 28 17.752 3.408 -1.766 1.00 0.00 H new ATOM 0 HD3 LYS A 28 19.420 3.281 -1.244 1.00 0.00 H new ATOM 0 HE2 LYS A 28 18.933 6.003 -2.060 1.00 0.00 H new ATOM 0 HE3 LYS A 28 17.640 5.513 -0.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 19.235 6.256 0.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 19.573 4.592 0.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 20.533 5.662 -0.450 1.00 0.00 H new ATOM 236 N GLY A 29 14.596 2.396 -4.467 1.00 0.00 N ATOM 237 CA GLY A 29 13.420 2.417 -5.284 1.00 0.00 C ATOM 238 C GLY A 29 12.285 3.116 -4.584 1.00 0.00 C ATOM 239 O GLY A 29 12.124 2.991 -3.366 1.00 0.00 O ATOM 0 H GLY A 29 14.540 1.769 -3.665 1.00 0.00 H new ATOM 0 HA2 GLY A 29 13.637 2.922 -6.225 1.00 0.00 H new ATOM 0 HA3 GLY A 29 13.126 1.397 -5.530 1.00 0.00 H new ATOM 243 N GLU A 30 11.531 3.876 -5.357 1.00 0.00 N ATOM 244 CA GLU A 30 10.363 4.594 -4.868 1.00 0.00 C ATOM 245 C GLU A 30 9.268 4.506 -5.918 1.00 0.00 C ATOM 246 O GLU A 30 9.417 5.035 -7.020 1.00 0.00 O ATOM 247 CB GLU A 30 10.697 6.067 -4.590 1.00 0.00 C ATOM 248 CG GLU A 30 11.981 6.276 -3.800 1.00 0.00 C ATOM 249 CD GLU A 30 11.960 7.548 -2.980 1.00 0.00 C ATOM 250 OE1 GLU A 30 11.093 7.675 -2.094 1.00 0.00 O ATOM 251 OE2 GLU A 30 12.802 8.433 -3.224 1.00 0.00 O ATOM 0 H GLU A 30 11.712 4.015 -6.351 1.00 0.00 H new ATOM 0 HA GLU A 30 10.032 4.143 -3.933 1.00 0.00 H new ATOM 0 HB2 GLU A 30 10.778 6.595 -5.540 1.00 0.00 H new ATOM 0 HB3 GLU A 30 9.869 6.519 -4.043 1.00 0.00 H new ATOM 0 HG2 GLU A 30 12.139 5.424 -3.138 1.00 0.00 H new ATOM 0 HG3 GLU A 30 12.826 6.306 -4.488 1.00 0.00 H new ATOM 258 N VAL A 31 8.188 3.810 -5.601 1.00 0.00 N ATOM 259 CA VAL A 31 7.131 3.584 -6.579 1.00 0.00 C ATOM 260 C VAL A 31 5.752 3.745 -5.957 1.00 0.00 C ATOM 261 O VAL A 31 5.593 3.713 -4.737 1.00 0.00 O ATOM 262 CB VAL A 31 7.254 2.176 -7.259 1.00 0.00 C ATOM 263 CG1 VAL A 31 8.608 1.533 -6.981 1.00 0.00 C ATOM 264 CG2 VAL A 31 6.149 1.221 -6.814 1.00 0.00 C ATOM 0 H VAL A 31 8.019 3.395 -4.685 1.00 0.00 H new ATOM 0 HA VAL A 31 7.254 4.344 -7.350 1.00 0.00 H new ATOM 0 HB VAL A 31 7.153 2.353 -8.330 1.00 0.00 H new ATOM 0 HG11 VAL A 31 8.655 0.559 -7.468 1.00 0.00 H new ATOM 0 HG12 VAL A 31 9.401 2.172 -7.369 1.00 0.00 H new ATOM 0 HG13 VAL A 31 8.737 1.407 -5.906 1.00 0.00 H new ATOM 0 HG21 VAL A 31 6.277 0.260 -7.312 1.00 0.00 H new ATOM 0 HG22 VAL A 31 6.202 1.081 -5.734 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.178 1.640 -7.078 1.00 0.00 H new ATOM 274 N CYS A 32 4.770 3.926 -6.826 1.00 0.00 N ATOM 275 CA CYS A 32 3.391 4.139 -6.439 1.00 0.00 C ATOM 276 C CYS A 32 2.523 2.957 -6.873 1.00 0.00 C ATOM 277 O CYS A 32 2.333 2.729 -8.066 1.00 0.00 O ATOM 278 CB CYS A 32 2.899 5.416 -7.115 1.00 0.00 C ATOM 279 SG CYS A 32 4.136 6.172 -8.231 1.00 0.00 S ATOM 0 H CYS A 32 4.915 3.928 -7.836 1.00 0.00 H new ATOM 0 HA CYS A 32 3.323 4.230 -5.355 1.00 0.00 H new ATOM 0 HB2 CYS A 32 1.996 5.192 -7.684 1.00 0.00 H new ATOM 0 HB3 CYS A 32 2.622 6.140 -6.349 1.00 0.00 H new ATOM 284 N ILE A 33 2.012 2.197 -5.915 1.00 0.00 N ATOM 285 CA ILE A 33 1.113 1.092 -6.233 1.00 0.00 C ATOM 286 C ILE A 33 -0.307 1.420 -5.787 1.00 0.00 C ATOM 287 O ILE A 33 -0.506 2.089 -4.770 1.00 0.00 O ATOM 288 CB ILE A 33 1.565 -0.240 -5.595 1.00 0.00 C ATOM 289 CG1 ILE A 33 1.878 -0.064 -4.112 1.00 0.00 C ATOM 290 CG2 ILE A 33 2.777 -0.792 -6.330 1.00 0.00 C ATOM 291 CD1 ILE A 33 1.881 -1.364 -3.339 1.00 0.00 C ATOM 0 H ILE A 33 2.201 2.321 -4.920 1.00 0.00 H new ATOM 0 HA ILE A 33 1.140 0.963 -7.315 1.00 0.00 H new ATOM 0 HB ILE A 33 0.744 -0.952 -5.683 1.00 0.00 H new ATOM 0 HG12 ILE A 33 2.852 0.414 -4.008 1.00 0.00 H new ATOM 0 HG13 ILE A 33 1.144 0.610 -3.671 1.00 0.00 H new ATOM 0 HG21 ILE A 33 3.085 -1.731 -5.870 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.520 -0.967 -7.375 1.00 0.00 H new ATOM 0 HG23 ILE A 33 3.595 -0.074 -6.273 1.00 0.00 H new ATOM 0 HD11 ILE A 33 2.111 -1.164 -2.292 1.00 0.00 H new ATOM 0 HD12 ILE A 33 0.900 -1.833 -3.412 1.00 0.00 H new ATOM 0 HD13 ILE A 33 2.635 -2.033 -3.755 1.00 0.00 H new ATOM 303 N ILE A 34 -1.286 0.961 -6.561 1.00 0.00 N ATOM 304 CA ILE A 34 -2.684 1.287 -6.301 1.00 0.00 C ATOM 305 C ILE A 34 -3.333 0.259 -5.375 1.00 0.00 C ATOM 306 O ILE A 34 -3.286 0.397 -4.153 1.00 0.00 O ATOM 307 CB ILE A 34 -3.508 1.382 -7.608 1.00 0.00 C ATOM 308 CG1 ILE A 34 -2.596 1.640 -8.819 1.00 0.00 C ATOM 309 CG2 ILE A 34 -4.571 2.469 -7.484 1.00 0.00 C ATOM 310 CD1 ILE A 34 -2.157 3.084 -8.977 1.00 0.00 C ATOM 0 H ILE A 34 -1.137 0.362 -7.373 1.00 0.00 H new ATOM 0 HA ILE A 34 -2.686 2.262 -5.814 1.00 0.00 H new ATOM 0 HB ILE A 34 -4.008 0.427 -7.769 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -1.710 1.011 -8.732 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -3.118 1.331 -9.724 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.143 2.525 -8.410 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.240 2.231 -6.657 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -4.090 3.429 -7.296 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -1.517 3.176 -9.855 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -3.034 3.720 -9.099 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -1.604 3.395 -8.091 1.00 0.00 H new ATOM 322 N GLY A 35 -3.946 -0.765 -5.958 1.00 0.00 N ATOM 323 CA GLY A 35 -4.637 -1.765 -5.166 1.00 0.00 C ATOM 324 C GLY A 35 -5.977 -1.257 -4.677 1.00 0.00 C ATOM 325 O GLY A 35 -6.464 -1.668 -3.623 1.00 0.00 O ATOM 0 H GLY A 35 -3.977 -0.920 -6.966 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -4.784 -2.665 -5.763 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -4.019 -2.045 -4.313 1.00 0.00 H new ATOM 329 N ASN A 36 -6.572 -0.365 -5.456 1.00 0.00 N ATOM 330 CA ASN A 36 -7.824 0.278 -5.075 1.00 0.00 C ATOM 331 C ASN A 36 -9.010 -0.410 -5.744 1.00 0.00 C ATOM 332 O ASN A 36 -8.836 -1.335 -6.539 1.00 0.00 O ATOM 333 CB ASN A 36 -7.791 1.761 -5.462 1.00 0.00 C ATOM 334 CG ASN A 36 -8.648 2.623 -4.552 1.00 0.00 C ATOM 335 OD1 ASN A 36 -9.747 3.030 -4.922 1.00 0.00 O ATOM 336 ND2 ASN A 36 -8.153 2.908 -3.358 1.00 0.00 N ATOM 0 H ASN A 36 -6.206 -0.068 -6.361 1.00 0.00 H new ATOM 0 HA ASN A 36 -7.941 0.192 -3.995 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -6.762 2.118 -5.430 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -8.135 1.872 -6.490 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -8.688 3.484 -2.708 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -7.237 2.551 -3.087 1.00 0.00 H new ATOM 343 N LYS A 37 -10.210 0.052 -5.423 1.00 0.00 N ATOM 344 CA LYS A 37 -11.431 -0.496 -5.991 1.00 0.00 C ATOM 345 C LYS A 37 -12.451 0.622 -6.164 1.00 0.00 C ATOM 346 O LYS A 37 -12.516 1.532 -5.339 1.00 0.00 O ATOM 347 CB LYS A 37 -11.999 -1.589 -5.075 1.00 0.00 C ATOM 348 CG LYS A 37 -13.034 -2.483 -5.743 1.00 0.00 C ATOM 349 CD LYS A 37 -12.379 -3.612 -6.522 1.00 0.00 C ATOM 350 CE LYS A 37 -12.656 -4.966 -5.890 1.00 0.00 C ATOM 351 NZ LYS A 37 -11.495 -5.882 -6.029 1.00 0.00 N ATOM 0 H LYS A 37 -10.363 0.815 -4.764 1.00 0.00 H new ATOM 0 HA LYS A 37 -11.209 -0.939 -6.962 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -11.178 -2.209 -4.714 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -12.451 -1.118 -4.202 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -13.698 -2.900 -4.986 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -13.651 -1.887 -6.415 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -12.747 -3.607 -7.548 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -11.303 -3.445 -6.568 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -12.892 -4.834 -4.834 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -13.532 -5.414 -6.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -11.383 -6.436 -5.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -11.655 -6.526 -6.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -10.633 -5.326 -6.199 1.00 0.00 H new ATOM 365 N GLU A 38 -13.226 0.562 -7.244 1.00 0.00 N ATOM 366 CA GLU A 38 -14.260 1.565 -7.503 1.00 0.00 C ATOM 367 C GLU A 38 -15.268 1.602 -6.359 1.00 0.00 C ATOM 368 O GLU A 38 -15.816 2.654 -6.030 1.00 0.00 O ATOM 369 CB GLU A 38 -14.981 1.294 -8.831 1.00 0.00 C ATOM 370 CG GLU A 38 -14.669 -0.061 -9.453 1.00 0.00 C ATOM 371 CD GLU A 38 -13.387 -0.059 -10.258 1.00 0.00 C ATOM 372 OE1 GLU A 38 -13.390 0.456 -11.396 1.00 0.00 O ATOM 373 OE2 GLU A 38 -12.370 -0.584 -9.757 1.00 0.00 O ATOM 0 H GLU A 38 -13.159 -0.168 -7.953 1.00 0.00 H new ATOM 0 HA GLU A 38 -13.769 2.535 -7.575 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -16.056 1.366 -8.668 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -14.714 2.076 -9.541 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -14.595 -0.809 -8.664 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -15.496 -0.358 -10.098 1.00 0.00 H new ATOM 380 N GLY A 39 -15.507 0.447 -5.754 1.00 0.00 N ATOM 381 CA GLY A 39 -16.346 0.389 -4.577 1.00 0.00 C ATOM 382 C GLY A 39 -15.582 0.788 -3.328 1.00 0.00 C ATOM 383 O GLY A 39 -15.206 -0.064 -2.523 1.00 0.00 O ATOM 0 H GLY A 39 -15.133 -0.452 -6.059 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -17.203 1.050 -4.707 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -16.738 -0.621 -4.458 1.00 0.00 H new ATOM 387 N LYS A 40 -15.342 2.087 -3.180 1.00 0.00 N ATOM 388 CA LYS A 40 -14.568 2.608 -2.061 1.00 0.00 C ATOM 389 C LYS A 40 -15.406 2.643 -0.787 1.00 0.00 C ATOM 390 O LYS A 40 -16.060 3.645 -0.489 1.00 0.00 O ATOM 391 CB LYS A 40 -14.055 4.013 -2.384 1.00 0.00 C ATOM 392 CG LYS A 40 -12.540 4.110 -2.430 1.00 0.00 C ATOM 393 CD LYS A 40 -12.068 4.991 -3.575 1.00 0.00 C ATOM 394 CE LYS A 40 -12.260 6.468 -3.265 1.00 0.00 C ATOM 395 NZ LYS A 40 -11.047 7.075 -2.651 1.00 0.00 N ATOM 0 H LYS A 40 -15.676 2.802 -3.827 1.00 0.00 H new ATOM 0 HA LYS A 40 -13.719 1.944 -1.897 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -14.460 4.327 -3.346 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -14.433 4.710 -1.636 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -12.172 4.512 -1.486 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -12.115 3.112 -2.539 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -11.014 4.795 -3.774 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -12.617 4.735 -4.481 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -12.506 7.001 -4.183 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -13.107 6.589 -2.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -11.327 7.678 -1.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -10.416 6.322 -2.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -10.549 7.650 -3.361 1.00 0.00 H new ATOM 409 N THR A 41 -15.400 1.536 -0.058 1.00 0.00 N ATOM 410 CA THR A 41 -16.103 1.443 1.210 1.00 0.00 C ATOM 411 C THR A 41 -15.524 2.413 2.236 1.00 0.00 C ATOM 412 O THR A 41 -14.311 2.460 2.451 1.00 0.00 O ATOM 413 CB THR A 41 -16.032 0.012 1.770 1.00 0.00 C ATOM 414 OG1 THR A 41 -15.887 -0.923 0.690 1.00 0.00 O ATOM 415 CG2 THR A 41 -17.277 -0.320 2.575 1.00 0.00 C ATOM 0 H THR A 41 -14.910 0.683 -0.328 1.00 0.00 H new ATOM 0 HA THR A 41 -17.144 1.707 1.023 1.00 0.00 H new ATOM 0 HB THR A 41 -15.169 -0.056 2.432 1.00 0.00 H new ATOM 0 HG1 THR A 41 -15.840 -1.833 1.050 1.00 0.00 H new ATOM 0 HG21 THR A 41 -17.201 -1.337 2.959 1.00 0.00 H new ATOM 0 HG22 THR A 41 -17.368 0.377 3.408 1.00 0.00 H new ATOM 0 HG23 THR A 41 -18.156 -0.238 1.936 1.00 0.00 H new ATOM 423 N ARG A 42 -16.398 3.187 2.859 1.00 0.00 N ATOM 424 CA ARG A 42 -15.983 4.140 3.869 1.00 0.00 C ATOM 425 C ARG A 42 -15.943 3.467 5.236 1.00 0.00 C ATOM 426 O ARG A 42 -16.961 3.361 5.919 1.00 0.00 O ATOM 427 CB ARG A 42 -16.934 5.337 3.892 1.00 0.00 C ATOM 428 CG ARG A 42 -16.434 6.494 4.739 1.00 0.00 C ATOM 429 CD ARG A 42 -17.580 7.373 5.205 1.00 0.00 C ATOM 430 NE ARG A 42 -17.515 7.643 6.641 1.00 0.00 N ATOM 431 CZ ARG A 42 -17.319 8.854 7.163 1.00 0.00 C ATOM 432 NH1 ARG A 42 -17.083 9.893 6.369 1.00 0.00 N ATOM 433 NH2 ARG A 42 -17.329 9.011 8.481 1.00 0.00 N ATOM 0 H ARG A 42 -17.402 3.172 2.680 1.00 0.00 H new ATOM 0 HA ARG A 42 -14.983 4.499 3.625 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -17.090 5.686 2.871 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -17.904 5.013 4.270 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -15.895 6.108 5.604 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -15.727 7.090 4.162 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -17.560 8.315 4.658 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -18.528 6.888 4.970 1.00 0.00 H new ATOM 0 HE ARG A 42 -17.626 6.857 7.282 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -17.051 9.765 5.358 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -16.933 10.818 6.771 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -17.486 8.207 9.089 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -17.180 9.935 8.886 1.00 0.00 H new ATOM 447 N GLY A 43 -14.766 3.002 5.619 1.00 0.00 N ATOM 448 CA GLY A 43 -14.614 2.343 6.897 1.00 0.00 C ATOM 449 C GLY A 43 -14.133 3.298 7.964 1.00 0.00 C ATOM 450 O GLY A 43 -14.669 3.328 9.072 1.00 0.00 O ATOM 0 H GLY A 43 -13.911 3.069 5.066 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -15.568 1.910 7.199 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -13.907 1.519 6.800 1.00 0.00 H new ATOM 454 N GLY A 44 -13.129 4.095 7.618 1.00 0.00 N ATOM 455 CA GLY A 44 -12.586 5.050 8.559 1.00 0.00 C ATOM 456 C GLY A 44 -11.457 4.473 9.390 1.00 0.00 C ATOM 457 O GLY A 44 -11.057 5.061 10.395 1.00 0.00 O ATOM 0 H GLY A 44 -12.682 4.095 6.701 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -12.223 5.923 8.016 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -13.381 5.394 9.221 1.00 0.00 H new ATOM 461 N GLU A 45 -10.943 3.323 8.980 1.00 0.00 N ATOM 462 CA GLU A 45 -9.836 2.699 9.686 1.00 0.00 C ATOM 463 C GLU A 45 -8.727 2.310 8.716 1.00 0.00 C ATOM 464 O GLU A 45 -8.906 1.445 7.857 1.00 0.00 O ATOM 465 CB GLU A 45 -10.310 1.474 10.463 1.00 0.00 C ATOM 466 CG GLU A 45 -9.866 1.474 11.918 1.00 0.00 C ATOM 467 CD GLU A 45 -9.897 0.094 12.542 1.00 0.00 C ATOM 468 OE1 GLU A 45 -10.736 -0.735 12.129 1.00 0.00 O ATOM 469 OE2 GLU A 45 -9.089 -0.164 13.460 1.00 0.00 O ATOM 0 H GLU A 45 -11.274 2.805 8.166 1.00 0.00 H new ATOM 0 HA GLU A 45 -9.438 3.426 10.394 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -11.398 1.426 10.423 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -9.933 0.575 9.975 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -8.855 1.875 11.984 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -10.511 2.141 12.490 1.00 0.00 H new ATOM 476 N LEU A 46 -7.589 2.969 8.857 1.00 0.00 N ATOM 477 CA LEU A 46 -6.441 2.714 8.006 1.00 0.00 C ATOM 478 C LEU A 46 -5.652 1.494 8.492 1.00 0.00 C ATOM 479 O LEU A 46 -4.760 1.627 9.329 1.00 0.00 O ATOM 480 CB LEU A 46 -5.519 3.939 7.986 1.00 0.00 C ATOM 481 CG LEU A 46 -6.142 5.241 7.463 1.00 0.00 C ATOM 482 CD1 LEU A 46 -5.072 6.309 7.312 1.00 0.00 C ATOM 483 CD2 LEU A 46 -6.853 5.026 6.133 1.00 0.00 C ATOM 0 H LEU A 46 -7.436 3.692 9.561 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.809 2.513 7.000 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -5.158 4.114 8.999 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -4.649 3.704 7.373 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.883 5.571 8.191 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -5.525 7.228 6.940 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -4.608 6.499 8.280 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -4.314 5.967 6.607 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.282 5.969 5.793 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.139 4.664 5.393 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -7.648 4.291 6.260 1.00 0.00 H new ATOM 495 N TYR A 47 -5.964 0.309 7.968 1.00 0.00 N ATOM 496 CA TYR A 47 -5.114 -0.855 8.207 1.00 0.00 C ATOM 497 C TYR A 47 -4.647 -1.533 6.905 1.00 0.00 C ATOM 498 O TYR A 47 -5.447 -2.060 6.127 1.00 0.00 O ATOM 499 CB TYR A 47 -5.804 -1.873 9.132 1.00 0.00 C ATOM 500 CG TYR A 47 -5.474 -3.318 8.801 1.00 0.00 C ATOM 501 CD1 TYR A 47 -4.189 -3.815 8.976 1.00 0.00 C ATOM 502 CD2 TYR A 47 -6.440 -4.171 8.284 1.00 0.00 C ATOM 503 CE1 TYR A 47 -3.876 -5.117 8.648 1.00 0.00 C ATOM 504 CE2 TYR A 47 -6.134 -5.476 7.951 1.00 0.00 C ATOM 505 CZ TYR A 47 -4.848 -5.945 8.134 1.00 0.00 C ATOM 506 OH TYR A 47 -4.537 -7.245 7.796 1.00 0.00 O ATOM 0 H TYR A 47 -6.783 0.132 7.386 1.00 0.00 H new ATOM 0 HA TYR A 47 -4.221 -0.480 8.708 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -5.513 -1.670 10.163 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -6.883 -1.733 9.072 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -3.421 -3.170 9.376 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -7.447 -3.808 8.140 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -2.872 -5.486 8.794 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -6.897 -6.127 7.549 1.00 0.00 H new ATOM 0 HH TYR A 47 -5.337 -7.693 7.449 1.00 0.00 H new ATOM 516 N ALA A 48 -3.334 -1.474 6.689 1.00 0.00 N ATOM 517 CA ALA A 48 -2.644 -2.211 5.629 1.00 0.00 C ATOM 518 C ALA A 48 -1.196 -2.414 6.061 1.00 0.00 C ATOM 519 O ALA A 48 -0.410 -1.472 6.059 1.00 0.00 O ATOM 520 CB ALA A 48 -2.702 -1.465 4.298 1.00 0.00 C ATOM 0 H ALA A 48 -2.707 -0.902 7.256 1.00 0.00 H new ATOM 0 HA ALA A 48 -3.136 -3.171 5.477 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -2.180 -2.042 3.535 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -3.742 -1.329 4.002 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -2.226 -0.491 4.406 1.00 0.00 H new ATOM 526 N VAL A 49 -0.839 -3.621 6.464 1.00 0.00 N ATOM 527 CA VAL A 49 0.463 -3.835 7.083 1.00 0.00 C ATOM 528 C VAL A 49 1.521 -4.218 6.063 1.00 0.00 C ATOM 529 O VAL A 49 1.316 -5.110 5.242 1.00 0.00 O ATOM 530 CB VAL A 49 0.409 -4.912 8.195 1.00 0.00 C ATOM 531 CG1 VAL A 49 -0.371 -6.133 7.738 1.00 0.00 C ATOM 532 CG2 VAL A 49 1.813 -5.307 8.643 1.00 0.00 C ATOM 0 H VAL A 49 -1.418 -4.456 6.378 1.00 0.00 H new ATOM 0 HA VAL A 49 0.739 -2.882 7.534 1.00 0.00 H new ATOM 0 HB VAL A 49 -0.111 -4.479 9.049 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -0.392 -6.872 8.539 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -1.391 -5.840 7.487 1.00 0.00 H new ATOM 0 HG13 VAL A 49 0.109 -6.564 6.860 1.00 0.00 H new ATOM 0 HG21 VAL A 49 1.746 -6.064 9.424 1.00 0.00 H new ATOM 0 HG22 VAL A 49 2.366 -5.709 7.794 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.331 -4.430 9.031 1.00 0.00 H new ATOM 542 N LEU A 50 2.654 -3.541 6.118 1.00 0.00 N ATOM 543 CA LEU A 50 3.787 -3.932 5.317 1.00 0.00 C ATOM 544 C LEU A 50 4.746 -4.720 6.181 1.00 0.00 C ATOM 545 O LEU A 50 5.200 -4.232 7.225 1.00 0.00 O ATOM 546 CB LEU A 50 4.502 -2.725 4.715 1.00 0.00 C ATOM 547 CG LEU A 50 5.518 -3.065 3.619 1.00 0.00 C ATOM 548 CD1 LEU A 50 4.952 -2.741 2.248 1.00 0.00 C ATOM 549 CD2 LEU A 50 6.826 -2.320 3.844 1.00 0.00 C ATOM 0 H LEU A 50 2.808 -2.723 6.707 1.00 0.00 H new ATOM 0 HA LEU A 50 3.429 -4.543 4.489 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.756 -2.046 4.302 1.00 0.00 H new ATOM 0 HB3 LEU A 50 5.015 -2.188 5.513 1.00 0.00 H new ATOM 0 HG LEU A 50 5.722 -4.135 3.665 1.00 0.00 H new ATOM 0 HD11 LEU A 50 5.688 -2.989 1.483 1.00 0.00 H new ATOM 0 HD12 LEU A 50 4.045 -3.323 2.082 1.00 0.00 H new ATOM 0 HD13 LEU A 50 4.716 -1.678 2.194 1.00 0.00 H new ATOM 0 HD21 LEU A 50 7.532 -2.577 3.054 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.640 -1.246 3.829 1.00 0.00 H new ATOM 0 HD23 LEU A 50 7.244 -2.603 4.810 1.00 0.00 H new ATOM 561 N HIS A 51 5.002 -5.950 5.764 1.00 0.00 N ATOM 562 CA HIS A 51 5.974 -6.802 6.421 1.00 0.00 C ATOM 563 C HIS A 51 7.292 -6.702 5.678 1.00 0.00 C ATOM 564 O HIS A 51 7.326 -6.764 4.445 1.00 0.00 O ATOM 565 CB HIS A 51 5.529 -8.270 6.450 1.00 0.00 C ATOM 566 CG HIS A 51 4.079 -8.488 6.755 1.00 0.00 C ATOM 567 ND1 HIS A 51 3.580 -8.619 8.028 1.00 0.00 N ATOM 568 CD2 HIS A 51 3.026 -8.631 5.928 1.00 0.00 C ATOM 569 CE1 HIS A 51 2.281 -8.834 7.969 1.00 0.00 C ATOM 570 NE2 HIS A 51 1.915 -8.847 6.702 1.00 0.00 N ATOM 0 H HIS A 51 4.542 -6.383 4.963 1.00 0.00 H new ATOM 0 HA HIS A 51 6.076 -6.464 7.452 1.00 0.00 H new ATOM 0 HB2 HIS A 51 5.753 -8.721 5.483 1.00 0.00 H new ATOM 0 HB3 HIS A 51 6.124 -8.799 7.194 1.00 0.00 H new ATOM 0 HD1 HIS A 51 4.129 -8.559 8.885 1.00 0.00 H new ATOM 0 HD2 HIS A 51 3.052 -8.584 4.849 1.00 0.00 H new ATOM 0 HE1 HIS A 51 1.626 -8.976 8.816 1.00 0.00 H new ATOM 0 HE2 HIS A 51 0.966 -8.993 6.357 1.00 0.00 H new ATOM 579 N SER A 52 8.358 -6.534 6.422 1.00 0.00 N ATOM 580 CA SER A 52 9.685 -6.437 5.839 1.00 0.00 C ATOM 581 C SER A 52 10.479 -7.710 6.120 1.00 0.00 C ATOM 582 O SER A 52 10.920 -7.942 7.247 1.00 0.00 O ATOM 583 CB SER A 52 10.414 -5.212 6.398 1.00 0.00 C ATOM 584 OG SER A 52 9.495 -4.196 6.777 1.00 0.00 O ATOM 0 H SER A 52 8.338 -6.461 7.439 1.00 0.00 H new ATOM 0 HA SER A 52 9.591 -6.323 4.759 1.00 0.00 H new ATOM 0 HB2 SER A 52 11.013 -5.504 7.260 1.00 0.00 H new ATOM 0 HB3 SER A 52 11.103 -4.822 5.649 1.00 0.00 H new ATOM 0 HG SER A 52 8.983 -4.493 7.558 1.00 0.00 H new ATOM 590 N THR A 53 10.630 -8.542 5.100 1.00 0.00 N ATOM 591 CA THR A 53 11.365 -9.789 5.227 1.00 0.00 C ATOM 592 C THR A 53 12.722 -9.692 4.536 1.00 0.00 C ATOM 593 O THR A 53 12.824 -9.877 3.320 1.00 0.00 O ATOM 594 CB THR A 53 10.561 -10.953 4.618 1.00 0.00 C ATOM 595 OG1 THR A 53 9.374 -10.443 3.988 1.00 0.00 O ATOM 596 CG2 THR A 53 10.177 -11.966 5.686 1.00 0.00 C ATOM 0 H THR A 53 10.249 -8.373 4.169 1.00 0.00 H new ATOM 0 HA THR A 53 11.522 -9.977 6.289 1.00 0.00 H new ATOM 0 HB THR A 53 11.186 -11.453 3.878 1.00 0.00 H new ATOM 0 HG1 THR A 53 8.865 -11.185 3.600 1.00 0.00 H new ATOM 0 HG21 THR A 53 9.610 -12.778 5.230 1.00 0.00 H new ATOM 0 HG22 THR A 53 11.079 -12.368 6.148 1.00 0.00 H new ATOM 0 HG23 THR A 53 9.566 -11.479 6.446 1.00 0.00 H new ATOM 604 N ASN A 54 13.762 -9.395 5.312 1.00 0.00 N ATOM 605 CA ASN A 54 15.109 -9.247 4.772 1.00 0.00 C ATOM 606 C ASN A 54 16.123 -9.019 5.886 1.00 0.00 C ATOM 607 O ASN A 54 15.764 -8.926 7.058 1.00 0.00 O ATOM 608 CB ASN A 54 15.165 -8.078 3.788 1.00 0.00 C ATOM 609 CG ASN A 54 15.959 -8.414 2.548 1.00 0.00 C ATOM 610 OD1 ASN A 54 17.187 -8.482 2.585 1.00 0.00 O ATOM 611 ND2 ASN A 54 15.261 -8.647 1.450 1.00 0.00 N ATOM 0 H ASN A 54 13.696 -9.252 6.320 1.00 0.00 H new ATOM 0 HA ASN A 54 15.361 -10.171 4.251 1.00 0.00 H new ATOM 0 HB2 ASN A 54 14.151 -7.796 3.503 1.00 0.00 H new ATOM 0 HB3 ASN A 54 15.610 -7.213 4.279 1.00 0.00 H new ATOM 0 HD21 ASN A 54 15.740 -8.896 0.584 1.00 0.00 H new ATOM 0 HD22 ASN A 54 14.243 -8.578 1.468 1.00 0.00 H new ATOM 618 N VAL A 55 17.390 -8.912 5.506 1.00 0.00 N ATOM 619 CA VAL A 55 18.462 -8.668 6.462 1.00 0.00 C ATOM 620 C VAL A 55 18.475 -7.204 6.881 1.00 0.00 C ATOM 621 O VAL A 55 18.300 -6.881 8.051 1.00 0.00 O ATOM 622 CB VAL A 55 19.842 -9.027 5.872 1.00 0.00 C ATOM 623 CG1 VAL A 55 20.878 -9.165 6.977 1.00 0.00 C ATOM 624 CG2 VAL A 55 19.766 -10.303 5.044 1.00 0.00 C ATOM 0 H VAL A 55 17.701 -8.991 4.538 1.00 0.00 H new ATOM 0 HA VAL A 55 18.273 -9.304 7.327 1.00 0.00 H new ATOM 0 HB VAL A 55 20.149 -8.215 5.213 1.00 0.00 H new ATOM 0 HG11 VAL A 55 21.844 -9.418 6.540 1.00 0.00 H new ATOM 0 HG12 VAL A 55 20.960 -8.222 7.518 1.00 0.00 H new ATOM 0 HG13 VAL A 55 20.573 -9.953 7.665 1.00 0.00 H new ATOM 0 HG21 VAL A 55 20.752 -10.534 4.640 1.00 0.00 H new ATOM 0 HG22 VAL A 55 19.431 -11.126 5.675 1.00 0.00 H new ATOM 0 HG23 VAL A 55 19.061 -10.163 4.224 1.00 0.00 H new ATOM 634 N ASN A 56 18.664 -6.327 5.903 1.00 0.00 N ATOM 635 CA ASN A 56 18.689 -4.887 6.144 1.00 0.00 C ATOM 636 C ASN A 56 17.284 -4.357 6.371 1.00 0.00 C ATOM 637 O ASN A 56 17.120 -3.244 6.860 1.00 0.00 O ATOM 638 CB ASN A 56 19.318 -4.150 4.952 1.00 0.00 C ATOM 639 CG ASN A 56 18.824 -4.680 3.613 1.00 0.00 C ATOM 640 OD1 ASN A 56 19.150 -5.799 3.216 1.00 0.00 O ATOM 641 ND2 ASN A 56 18.043 -3.881 2.907 1.00 0.00 N ATOM 0 H ASN A 56 18.803 -6.589 4.927 1.00 0.00 H new ATOM 0 HA ASN A 56 19.290 -4.710 7.036 1.00 0.00 H new ATOM 0 HB2 ASN A 56 19.090 -3.087 5.025 1.00 0.00 H new ATOM 0 HB3 ASN A 56 20.403 -4.247 5.000 1.00 0.00 H new ATOM 0 HD21 ASN A 56 17.689 -4.185 2.000 1.00 0.00 H new ATOM 0 HD22 ASN A 56 17.794 -2.960 3.269 1.00 0.00 H new ATOM 648 N ALA A 57 16.301 -5.214 6.053 1.00 0.00 N ATOM 649 CA ALA A 57 14.870 -4.872 5.972 1.00 0.00 C ATOM 650 C ALA A 57 14.485 -3.581 6.686 1.00 0.00 C ATOM 651 O ALA A 57 14.068 -3.592 7.846 1.00 0.00 O ATOM 652 CB ALA A 57 14.031 -6.019 6.511 1.00 0.00 C ATOM 0 H ALA A 57 16.484 -6.194 5.838 1.00 0.00 H new ATOM 0 HA ALA A 57 14.669 -4.703 4.914 1.00 0.00 H new ATOM 0 HB1 ALA A 57 12.975 -5.758 6.448 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.219 -6.916 5.921 1.00 0.00 H new ATOM 0 HB3 ALA A 57 14.297 -6.206 7.551 1.00 0.00 H new ATOM 658 N ASP A 58 14.646 -2.473 5.982 1.00 0.00 N ATOM 659 CA ASP A 58 14.163 -1.185 6.440 1.00 0.00 C ATOM 660 C ASP A 58 13.430 -0.509 5.291 1.00 0.00 C ATOM 661 O ASP A 58 13.809 0.558 4.814 1.00 0.00 O ATOM 662 CB ASP A 58 15.308 -0.305 6.994 1.00 0.00 C ATOM 663 CG ASP A 58 16.328 0.140 5.957 1.00 0.00 C ATOM 664 OD1 ASP A 58 17.019 -0.722 5.377 1.00 0.00 O ATOM 665 OD2 ASP A 58 16.465 1.364 5.742 1.00 0.00 O ATOM 0 H ASP A 58 15.116 -2.443 5.077 1.00 0.00 H new ATOM 0 HA ASP A 58 13.473 -1.331 7.271 1.00 0.00 H new ATOM 0 HB2 ASP A 58 14.875 0.580 7.460 1.00 0.00 H new ATOM 0 HB3 ASP A 58 15.825 -0.857 7.778 1.00 0.00 H new ATOM 670 N MET A 59 12.342 -1.137 4.866 1.00 0.00 N ATOM 671 CA MET A 59 11.643 -0.707 3.670 1.00 0.00 C ATOM 672 C MET A 59 10.364 -0.016 4.072 1.00 0.00 C ATOM 673 O MET A 59 9.515 -0.607 4.735 1.00 0.00 O ATOM 674 CB MET A 59 11.328 -1.908 2.771 1.00 0.00 C ATOM 675 CG MET A 59 12.560 -2.566 2.166 1.00 0.00 C ATOM 676 SD MET A 59 12.929 -4.175 2.898 1.00 0.00 S ATOM 677 CE MET A 59 11.331 -4.972 2.776 1.00 0.00 C ATOM 0 H MET A 59 11.928 -1.944 5.333 1.00 0.00 H new ATOM 0 HA MET A 59 12.276 -0.018 3.111 1.00 0.00 H new ATOM 0 HB2 MET A 59 10.780 -2.650 3.352 1.00 0.00 H new ATOM 0 HB3 MET A 59 10.669 -1.584 1.966 1.00 0.00 H new ATOM 0 HG2 MET A 59 12.411 -2.686 1.093 1.00 0.00 H new ATOM 0 HG3 MET A 59 13.419 -1.907 2.297 1.00 0.00 H new ATOM 0 HE1 MET A 59 11.444 -6.042 2.951 1.00 0.00 H new ATOM 0 HE2 MET A 59 10.657 -4.551 3.522 1.00 0.00 H new ATOM 0 HE3 MET A 59 10.918 -4.809 1.780 1.00 0.00 H new ATOM 687 N THR A 60 10.210 1.210 3.628 1.00 0.00 N ATOM 688 CA THR A 60 9.161 2.067 4.121 1.00 0.00 C ATOM 689 C THR A 60 7.878 1.908 3.332 1.00 0.00 C ATOM 690 O THR A 60 7.847 2.130 2.123 1.00 0.00 O ATOM 691 CB THR A 60 9.599 3.541 4.066 1.00 0.00 C ATOM 692 OG1 THR A 60 11.022 3.626 3.896 1.00 0.00 O ATOM 693 CG2 THR A 60 9.192 4.274 5.332 1.00 0.00 C ATOM 0 H THR A 60 10.805 1.638 2.919 1.00 0.00 H new ATOM 0 HA THR A 60 8.971 1.770 5.153 1.00 0.00 H new ATOM 0 HB THR A 60 9.103 4.011 3.217 1.00 0.00 H new ATOM 0 HG1 THR A 60 11.311 4.554 4.020 1.00 0.00 H new ATOM 0 HG21 THR A 60 9.513 5.314 5.269 1.00 0.00 H new ATOM 0 HG22 THR A 60 8.108 4.234 5.443 1.00 0.00 H new ATOM 0 HG23 THR A 60 9.663 3.801 6.194 1.00 0.00 H new ATOM 701 N LEU A 61 6.823 1.500 4.021 1.00 0.00 N ATOM 702 CA LEU A 61 5.496 1.608 3.468 1.00 0.00 C ATOM 703 C LEU A 61 5.003 3.003 3.768 1.00 0.00 C ATOM 704 O LEU A 61 4.644 3.322 4.905 1.00 0.00 O ATOM 705 CB LEU A 61 4.551 0.571 4.072 1.00 0.00 C ATOM 706 CG LEU A 61 3.061 0.835 3.836 1.00 0.00 C ATOM 707 CD1 LEU A 61 2.606 0.201 2.534 1.00 0.00 C ATOM 708 CD2 LEU A 61 2.236 0.316 5.003 1.00 0.00 C ATOM 0 H LEU A 61 6.866 1.095 4.956 1.00 0.00 H new ATOM 0 HA LEU A 61 5.523 1.421 2.394 1.00 0.00 H new ATOM 0 HB2 LEU A 61 4.800 -0.408 3.662 1.00 0.00 H new ATOM 0 HB3 LEU A 61 4.730 0.521 5.146 1.00 0.00 H new ATOM 0 HG LEU A 61 2.910 1.912 3.762 1.00 0.00 H new ATOM 0 HD11 LEU A 61 1.545 0.400 2.384 1.00 0.00 H new ATOM 0 HD12 LEU A 61 3.175 0.623 1.705 1.00 0.00 H new ATOM 0 HD13 LEU A 61 2.771 -0.876 2.576 1.00 0.00 H new ATOM 0 HD21 LEU A 61 1.180 0.512 4.818 1.00 0.00 H new ATOM 0 HD22 LEU A 61 2.392 -0.757 5.110 1.00 0.00 H new ATOM 0 HD23 LEU A 61 2.544 0.821 5.919 1.00 0.00 H new ATOM 720 N ILE A 62 5.026 3.853 2.774 1.00 0.00 N ATOM 721 CA ILE A 62 4.660 5.223 3.001 1.00 0.00 C ATOM 722 C ILE A 62 3.324 5.541 2.343 1.00 0.00 C ATOM 723 O ILE A 62 3.090 5.241 1.172 1.00 0.00 O ATOM 724 CB ILE A 62 5.784 6.212 2.569 1.00 0.00 C ATOM 725 CG1 ILE A 62 5.232 7.384 1.760 1.00 0.00 C ATOM 726 CG2 ILE A 62 6.882 5.503 1.792 1.00 0.00 C ATOM 727 CD1 ILE A 62 5.078 8.645 2.575 1.00 0.00 C ATOM 0 H ILE A 62 5.290 3.625 1.816 1.00 0.00 H new ATOM 0 HA ILE A 62 4.538 5.360 4.075 1.00 0.00 H new ATOM 0 HB ILE A 62 6.217 6.613 3.486 1.00 0.00 H new ATOM 0 HG12 ILE A 62 5.896 7.581 0.918 1.00 0.00 H new ATOM 0 HG13 ILE A 62 4.263 7.107 1.344 1.00 0.00 H new ATOM 0 HG21 ILE A 62 7.649 6.223 1.507 1.00 0.00 H new ATOM 0 HG22 ILE A 62 7.326 4.727 2.416 1.00 0.00 H new ATOM 0 HG23 ILE A 62 6.459 5.050 0.896 1.00 0.00 H new ATOM 0 HD11 ILE A 62 4.682 9.440 1.944 1.00 0.00 H new ATOM 0 HD12 ILE A 62 4.392 8.462 3.402 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.049 8.944 2.969 1.00 0.00 H new ATOM 739 N LEU A 63 2.453 6.126 3.141 1.00 0.00 N ATOM 740 CA LEU A 63 1.131 6.531 2.714 1.00 0.00 C ATOM 741 C LEU A 63 1.264 7.817 1.929 1.00 0.00 C ATOM 742 O LEU A 63 1.831 8.795 2.418 1.00 0.00 O ATOM 743 CB LEU A 63 0.269 6.730 3.953 1.00 0.00 C ATOM 744 CG LEU A 63 -1.122 6.112 3.930 1.00 0.00 C ATOM 745 CD1 LEU A 63 -1.755 6.194 5.313 1.00 0.00 C ATOM 746 CD2 LEU A 63 -2.018 6.780 2.900 1.00 0.00 C ATOM 0 H LEU A 63 2.648 6.336 4.120 1.00 0.00 H new ATOM 0 HA LEU A 63 0.663 5.778 2.080 1.00 0.00 H new ATOM 0 HB2 LEU A 63 0.807 6.323 4.809 1.00 0.00 H new ATOM 0 HB3 LEU A 63 0.162 7.801 4.123 1.00 0.00 H new ATOM 0 HG LEU A 63 -1.016 5.065 3.644 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -2.750 5.749 5.285 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -1.136 5.654 6.029 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -1.833 7.238 5.616 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -3.002 6.311 2.914 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.118 7.839 3.137 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -1.578 6.670 1.909 1.00 0.00 H new ATOM 758 N LEU A 64 0.766 7.803 0.714 1.00 0.00 N ATOM 759 CA LEU A 64 1.128 8.808 -0.255 1.00 0.00 C ATOM 760 C LEU A 64 -0.051 9.563 -0.849 1.00 0.00 C ATOM 761 O LEU A 64 -1.218 9.269 -0.624 1.00 0.00 O ATOM 762 CB LEU A 64 2.011 8.233 -1.359 1.00 0.00 C ATOM 763 CG LEU A 64 3.189 9.126 -1.763 1.00 0.00 C ATOM 764 CD1 LEU A 64 3.915 9.642 -0.536 1.00 0.00 C ATOM 765 CD2 LEU A 64 4.147 8.373 -2.657 1.00 0.00 C ATOM 0 H LEU A 64 0.107 7.103 0.374 1.00 0.00 H new ATOM 0 HA LEU A 64 1.700 9.545 0.309 1.00 0.00 H new ATOM 0 HB2 LEU A 64 2.399 7.269 -1.031 1.00 0.00 H new ATOM 0 HB3 LEU A 64 1.395 8.046 -2.239 1.00 0.00 H new ATOM 0 HG LEU A 64 2.793 9.978 -2.316 1.00 0.00 H new ATOM 0 HD11 LEU A 64 4.748 10.274 -0.845 1.00 0.00 H new ATOM 0 HD12 LEU A 64 3.226 10.223 0.077 1.00 0.00 H new ATOM 0 HD13 LEU A 64 4.294 8.800 0.044 1.00 0.00 H new ATOM 0 HD21 LEU A 64 4.976 9.025 -2.933 1.00 0.00 H new ATOM 0 HD22 LEU A 64 4.531 7.502 -2.127 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.626 8.049 -3.558 1.00 0.00 H new ATOM 777 N ARG A 65 0.354 10.561 -1.588 1.00 0.00 N ATOM 778 CA ARG A 65 -0.428 11.654 -2.118 1.00 0.00 C ATOM 779 C ARG A 65 -1.113 11.355 -3.450 1.00 0.00 C ATOM 780 O ARG A 65 -1.353 10.205 -3.812 1.00 0.00 O ATOM 781 CB ARG A 65 0.516 12.813 -2.280 1.00 0.00 C ATOM 782 CG ARG A 65 0.665 13.659 -1.022 1.00 0.00 C ATOM 783 CD ARG A 65 1.302 15.004 -1.322 1.00 0.00 C ATOM 784 NE ARG A 65 0.669 15.665 -2.461 1.00 0.00 N ATOM 785 CZ ARG A 65 -0.417 16.433 -2.368 1.00 0.00 C ATOM 786 NH1 ARG A 65 -0.949 16.702 -1.182 1.00 0.00 N ATOM 787 NH2 ARG A 65 -0.963 16.941 -3.461 1.00 0.00 N ATOM 0 H ARG A 65 1.333 10.639 -1.862 1.00 0.00 H new ATOM 0 HA ARG A 65 -1.243 11.859 -1.424 1.00 0.00 H new ATOM 0 HB2 ARG A 65 1.496 12.435 -2.571 1.00 0.00 H new ATOM 0 HB3 ARG A 65 0.164 13.446 -3.094 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -0.314 13.813 -0.569 1.00 0.00 H new ATOM 0 HG3 ARG A 65 1.273 13.123 -0.293 1.00 0.00 H new ATOM 0 HD2 ARG A 65 1.228 15.645 -0.443 1.00 0.00 H new ATOM 0 HD3 ARG A 65 2.364 14.865 -1.527 1.00 0.00 H new ATOM 0 HE ARG A 65 1.083 15.531 -3.383 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -0.527 16.321 -0.335 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -1.780 17.290 -1.117 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -0.553 16.745 -4.374 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -1.794 17.529 -3.390 1.00 0.00 H new ATOM 801 N ASN A 66 -1.511 12.450 -4.102 1.00 0.00 N ATOM 802 CA ASN A 66 -2.262 12.457 -5.361 1.00 0.00 C ATOM 803 C ASN A 66 -1.670 11.536 -6.422 1.00 0.00 C ATOM 804 O ASN A 66 -0.480 11.283 -6.450 1.00 0.00 O ATOM 805 CB ASN A 66 -2.189 13.880 -5.949 1.00 0.00 C ATOM 806 CG ASN A 66 -0.734 14.342 -6.179 1.00 0.00 C ATOM 807 OD1 ASN A 66 -0.257 15.263 -5.518 1.00 0.00 O ATOM 808 ND2 ASN A 66 -0.025 13.705 -7.123 1.00 0.00 N ATOM 0 H ASN A 66 -1.313 13.389 -3.756 1.00 0.00 H new ATOM 0 HA ASN A 66 -3.273 12.122 -5.128 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -2.731 13.909 -6.894 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -2.687 14.576 -5.274 1.00 0.00 H new ATOM 0 HD21 ASN A 66 0.939 13.981 -7.310 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -0.450 12.945 -7.654 1.00 0.00 H new ATOM 815 N VAL A 67 -2.516 11.088 -7.329 1.00 0.00 N ATOM 816 CA VAL A 67 -2.065 10.368 -8.504 1.00 0.00 C ATOM 817 C VAL A 67 -2.720 10.982 -9.736 1.00 0.00 C ATOM 818 O VAL A 67 -3.946 11.018 -9.850 1.00 0.00 O ATOM 819 CB VAL A 67 -2.367 8.855 -8.406 1.00 0.00 C ATOM 820 CG1 VAL A 67 -3.766 8.612 -7.856 1.00 0.00 C ATOM 821 CG2 VAL A 67 -2.179 8.168 -9.753 1.00 0.00 C ATOM 0 H VAL A 67 -3.527 11.211 -7.274 1.00 0.00 H new ATOM 0 HA VAL A 67 -0.982 10.460 -8.580 1.00 0.00 H new ATOM 0 HB VAL A 67 -1.653 8.417 -7.709 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.953 7.540 -7.797 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -3.847 9.049 -6.861 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -4.501 9.073 -8.516 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -2.398 7.105 -9.653 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -2.855 8.611 -10.485 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.149 8.296 -10.086 1.00 0.00 H new ATOM 831 N GLY A 68 -1.898 11.493 -10.638 1.00 0.00 N ATOM 832 CA GLY A 68 -2.415 12.291 -11.726 1.00 0.00 C ATOM 833 C GLY A 68 -2.546 13.735 -11.302 1.00 0.00 C ATOM 834 O GLY A 68 -3.621 14.327 -11.383 1.00 0.00 O ATOM 0 H GLY A 68 -0.885 11.370 -10.636 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.751 12.217 -12.588 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -3.386 11.907 -12.038 1.00 0.00 H new ATOM 838 N GLY A 69 -1.443 14.297 -10.833 1.00 0.00 N ATOM 839 CA GLY A 69 -1.462 15.635 -10.290 1.00 0.00 C ATOM 840 C GLY A 69 -0.135 16.336 -10.476 1.00 0.00 C ATOM 841 O GLY A 69 0.257 16.638 -11.605 1.00 0.00 O ATOM 0 H GLY A 69 -0.529 13.845 -10.820 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -2.249 16.213 -10.775 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -1.705 15.593 -9.228 1.00 0.00 H new ATOM 845 N ASN A 70 0.576 16.562 -9.380 1.00 0.00 N ATOM 846 CA ASN A 70 1.832 17.302 -9.428 1.00 0.00 C ATOM 847 C ASN A 70 2.933 16.583 -8.655 1.00 0.00 C ATOM 848 O ASN A 70 3.433 17.091 -7.654 1.00 0.00 O ATOM 849 CB ASN A 70 1.635 18.711 -8.862 1.00 0.00 C ATOM 850 CG ASN A 70 2.338 19.770 -9.685 1.00 0.00 C ATOM 851 OD1 ASN A 70 3.469 20.157 -9.391 1.00 0.00 O ATOM 852 ND2 ASN A 70 1.671 20.250 -10.721 1.00 0.00 N ATOM 0 H ASN A 70 0.307 16.245 -8.449 1.00 0.00 H new ATOM 0 HA ASN A 70 2.140 17.369 -10.472 1.00 0.00 H new ATOM 0 HB2 ASN A 70 0.569 18.936 -8.820 1.00 0.00 H new ATOM 0 HB3 ASN A 70 2.009 18.743 -7.839 1.00 0.00 H new ATOM 0 HD21 ASN A 70 2.092 20.968 -11.310 1.00 0.00 H new ATOM 0 HD22 ASN A 70 0.735 19.902 -10.931 1.00 0.00 H new ATOM 859 N GLY A 71 3.303 15.392 -9.112 1.00 0.00 N ATOM 860 CA GLY A 71 4.403 14.670 -8.487 1.00 0.00 C ATOM 861 C GLY A 71 3.975 13.900 -7.250 1.00 0.00 C ATOM 862 O GLY A 71 2.782 13.829 -6.942 1.00 0.00 O ATOM 0 H GLY A 71 2.866 14.913 -9.899 1.00 0.00 H new ATOM 0 HA2 GLY A 71 4.834 13.977 -9.210 1.00 0.00 H new ATOM 0 HA3 GLY A 71 5.188 15.376 -8.216 1.00 0.00 H new ATOM 866 N TRP A 72 4.949 13.345 -6.533 1.00 0.00 N ATOM 867 CA TRP A 72 4.671 12.512 -5.368 1.00 0.00 C ATOM 868 C TRP A 72 5.308 13.097 -4.113 1.00 0.00 C ATOM 869 O TRP A 72 6.518 12.981 -3.908 1.00 0.00 O ATOM 870 CB TRP A 72 5.187 11.087 -5.601 1.00 0.00 C ATOM 871 CG TRP A 72 4.299 10.284 -6.499 1.00 0.00 C ATOM 872 CD1 TRP A 72 4.569 9.865 -7.766 1.00 0.00 C ATOM 873 CD2 TRP A 72 2.990 9.808 -6.196 1.00 0.00 C ATOM 874 NE1 TRP A 72 3.501 9.179 -8.278 1.00 0.00 N ATOM 875 CE2 TRP A 72 2.519 9.125 -7.332 1.00 0.00 C ATOM 876 CE3 TRP A 72 2.169 9.896 -5.078 1.00 0.00 C ATOM 877 CZ2 TRP A 72 1.262 8.535 -7.379 1.00 0.00 C ATOM 878 CZ3 TRP A 72 0.929 9.311 -5.125 1.00 0.00 C ATOM 879 CH2 TRP A 72 0.482 8.639 -6.265 1.00 0.00 C ATOM 0 H TRP A 72 5.941 13.458 -6.740 1.00 0.00 H new ATOM 0 HA TRP A 72 3.591 12.483 -5.223 1.00 0.00 H new ATOM 0 HB2 TRP A 72 6.186 11.134 -6.035 1.00 0.00 H new ATOM 0 HB3 TRP A 72 5.280 10.578 -4.641 1.00 0.00 H new ATOM 0 HD1 TRP A 72 5.494 10.048 -8.292 1.00 0.00 H new ATOM 0 HE1 TRP A 72 3.448 8.775 -9.213 1.00 0.00 H new ATOM 0 HE3 TRP A 72 2.500 10.414 -4.190 1.00 0.00 H new ATOM 0 HZ2 TRP A 72 0.917 8.016 -8.261 1.00 0.00 H new ATOM 0 HZ3 TRP A 72 0.284 9.371 -4.261 1.00 0.00 H new ATOM 0 HH2 TRP A 72 -0.501 8.193 -6.264 1.00 0.00 H new ATOM 890 N GLY A 73 4.496 13.741 -3.288 1.00 0.00 N ATOM 891 CA GLY A 73 4.985 14.304 -2.043 1.00 0.00 C ATOM 892 C GLY A 73 4.881 13.322 -0.893 1.00 0.00 C ATOM 893 O GLY A 73 3.830 12.717 -0.681 1.00 0.00 O ATOM 0 H GLY A 73 3.501 13.885 -3.459 1.00 0.00 H new ATOM 0 HA2 GLY A 73 6.024 14.608 -2.167 1.00 0.00 H new ATOM 0 HA3 GLY A 73 4.416 15.203 -1.804 1.00 0.00 H new ATOM 897 N GLU A 74 5.972 13.168 -0.153 1.00 0.00 N ATOM 898 CA GLU A 74 6.035 12.230 0.965 1.00 0.00 C ATOM 899 C GLU A 74 5.259 12.762 2.168 1.00 0.00 C ATOM 900 O GLU A 74 5.181 13.974 2.373 1.00 0.00 O ATOM 901 CB GLU A 74 7.496 11.991 1.355 1.00 0.00 C ATOM 902 CG GLU A 74 7.766 10.599 1.896 1.00 0.00 C ATOM 903 CD GLU A 74 8.856 9.878 1.133 1.00 0.00 C ATOM 904 OE1 GLU A 74 8.836 9.905 -0.109 1.00 0.00 O ATOM 905 OE2 GLU A 74 9.741 9.277 1.779 1.00 0.00 O ATOM 0 H GLU A 74 6.836 13.687 -0.309 1.00 0.00 H new ATOM 0 HA GLU A 74 5.581 11.290 0.653 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.127 12.160 0.483 1.00 0.00 H new ATOM 0 HB3 GLU A 74 7.786 12.725 2.106 1.00 0.00 H new ATOM 0 HG2 GLU A 74 8.049 10.670 2.946 1.00 0.00 H new ATOM 0 HG3 GLU A 74 6.848 10.012 1.852 1.00 0.00 H new ATOM 912 N ILE A 75 4.674 11.858 2.957 1.00 0.00 N ATOM 913 CA ILE A 75 3.952 12.263 4.159 1.00 0.00 C ATOM 914 C ILE A 75 4.002 11.190 5.264 1.00 0.00 C ATOM 915 O ILE A 75 4.673 11.389 6.277 1.00 0.00 O ATOM 916 CB ILE A 75 2.486 12.677 3.849 1.00 0.00 C ATOM 917 CG1 ILE A 75 1.641 12.711 5.135 1.00 0.00 C ATOM 918 CG2 ILE A 75 1.868 11.762 2.800 1.00 0.00 C ATOM 919 CD1 ILE A 75 0.150 12.569 4.902 1.00 0.00 C ATOM 0 H ILE A 75 4.687 10.853 2.786 1.00 0.00 H new ATOM 0 HA ILE A 75 4.470 13.143 4.540 1.00 0.00 H new ATOM 0 HB ILE A 75 2.500 13.686 3.436 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.972 11.910 5.795 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.828 13.650 5.655 1.00 0.00 H new ATOM 0 HG21 ILE A 75 0.843 12.075 2.603 1.00 0.00 H new ATOM 0 HG22 ILE A 75 2.448 11.820 1.879 1.00 0.00 H new ATOM 0 HG23 ILE A 75 1.870 10.735 3.166 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.373 12.603 5.858 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -0.199 13.385 4.269 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.053 11.617 4.411 1.00 0.00 H new ATOM 931 N LYS A 76 3.309 10.056 5.099 1.00 0.00 N ATOM 932 CA LYS A 76 3.215 9.093 6.197 1.00 0.00 C ATOM 933 C LYS A 76 4.153 7.908 6.003 1.00 0.00 C ATOM 934 O LYS A 76 3.913 7.057 5.160 1.00 0.00 O ATOM 935 CB LYS A 76 1.776 8.604 6.360 1.00 0.00 C ATOM 936 CG LYS A 76 1.554 7.778 7.616 1.00 0.00 C ATOM 937 CD LYS A 76 1.933 8.550 8.870 1.00 0.00 C ATOM 938 CE LYS A 76 2.694 7.679 9.855 1.00 0.00 C ATOM 939 NZ LYS A 76 3.721 8.454 10.594 1.00 0.00 N ATOM 0 H LYS A 76 2.821 9.790 4.244 1.00 0.00 H new ATOM 0 HA LYS A 76 3.523 9.611 7.105 1.00 0.00 H new ATOM 0 HB2 LYS A 76 1.108 9.465 6.379 1.00 0.00 H new ATOM 0 HB3 LYS A 76 1.503 8.007 5.490 1.00 0.00 H new ATOM 0 HG2 LYS A 76 0.507 7.479 7.675 1.00 0.00 H new ATOM 0 HG3 LYS A 76 2.144 6.863 7.559 1.00 0.00 H new ATOM 0 HD2 LYS A 76 2.544 9.411 8.597 1.00 0.00 H new ATOM 0 HD3 LYS A 76 1.032 8.937 9.346 1.00 0.00 H new ATOM 0 HE2 LYS A 76 1.995 7.234 10.563 1.00 0.00 H new ATOM 0 HE3 LYS A 76 3.172 6.858 9.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 4.220 7.826 11.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 4.403 8.858 9.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 3.262 9.222 11.124 1.00 0.00 H new ATOM 953 N ARG A 77 5.206 7.842 6.806 1.00 0.00 N ATOM 954 CA ARG A 77 6.168 6.750 6.717 1.00 0.00 C ATOM 955 C ARG A 77 5.958 5.752 7.853 1.00 0.00 C ATOM 956 O ARG A 77 5.892 6.136 9.020 1.00 0.00 O ATOM 957 CB ARG A 77 7.593 7.300 6.757 1.00 0.00 C ATOM 958 CG ARG A 77 8.089 7.788 5.407 1.00 0.00 C ATOM 959 CD ARG A 77 9.580 8.087 5.436 1.00 0.00 C ATOM 960 NE ARG A 77 9.945 9.103 4.452 1.00 0.00 N ATOM 961 CZ ARG A 77 10.453 10.297 4.755 1.00 0.00 C ATOM 962 NH1 ARG A 77 10.717 10.614 6.018 1.00 0.00 N ATOM 963 NH2 ARG A 77 10.715 11.166 3.785 1.00 0.00 N ATOM 0 H ARG A 77 5.417 8.532 7.527 1.00 0.00 H new ATOM 0 HA ARG A 77 6.014 6.232 5.771 1.00 0.00 H new ATOM 0 HB2 ARG A 77 7.637 8.122 7.471 1.00 0.00 H new ATOM 0 HB3 ARG A 77 8.264 6.523 7.123 1.00 0.00 H new ATOM 0 HG2 ARG A 77 7.883 7.033 4.648 1.00 0.00 H new ATOM 0 HG3 ARG A 77 7.542 8.686 5.120 1.00 0.00 H new ATOM 0 HD2 ARG A 77 9.864 8.426 6.432 1.00 0.00 H new ATOM 0 HD3 ARG A 77 10.139 7.172 5.239 1.00 0.00 H new ATOM 0 HE ARG A 77 9.801 8.884 3.466 1.00 0.00 H new ATOM 0 HH11 ARG A 77 10.531 9.942 6.762 1.00 0.00 H new ATOM 0 HH12 ARG A 77 11.106 11.530 6.243 1.00 0.00 H new ATOM 0 HH21 ARG A 77 10.527 10.918 2.814 1.00 0.00 H new ATOM 0 HH22 ARG A 77 11.104 12.081 4.012 1.00 0.00 H new ATOM 977 N ASN A 78 5.833 4.479 7.496 1.00 0.00 N ATOM 978 CA ASN A 78 5.649 3.403 8.472 1.00 0.00 C ATOM 979 C ASN A 78 6.265 2.116 7.941 1.00 0.00 C ATOM 980 O ASN A 78 5.824 1.602 6.914 1.00 0.00 O ATOM 981 CB ASN A 78 4.154 3.183 8.731 1.00 0.00 C ATOM 982 CG ASN A 78 3.762 3.389 10.181 1.00 0.00 C ATOM 983 OD1 ASN A 78 4.538 3.896 10.985 1.00 0.00 O ATOM 984 ND2 ASN A 78 2.548 2.992 10.524 1.00 0.00 N ATOM 0 H ASN A 78 5.856 4.161 6.527 1.00 0.00 H new ATOM 0 HA ASN A 78 6.139 3.683 9.404 1.00 0.00 H new ATOM 0 HB2 ASN A 78 3.579 3.866 8.106 1.00 0.00 H new ATOM 0 HB3 ASN A 78 3.885 2.171 8.429 1.00 0.00 H new ATOM 0 HD21 ASN A 78 2.228 3.103 11.486 1.00 0.00 H new ATOM 0 HD22 ASN A 78 1.932 2.575 9.826 1.00 0.00 H new ATOM 991 N ASP A 79 7.284 1.585 8.609 1.00 0.00 N ATOM 992 CA ASP A 79 7.954 0.407 8.068 1.00 0.00 C ATOM 993 C ASP A 79 8.502 -0.554 9.119 1.00 0.00 C ATOM 994 O ASP A 79 9.493 -0.275 9.790 1.00 0.00 O ATOM 995 CB ASP A 79 9.097 0.845 7.159 1.00 0.00 C ATOM 996 CG ASP A 79 10.145 1.705 7.854 1.00 0.00 C ATOM 997 OD1 ASP A 79 9.789 2.762 8.416 1.00 0.00 O ATOM 998 OD2 ASP A 79 11.340 1.335 7.823 1.00 0.00 O ATOM 0 H ASP A 79 7.654 1.935 9.493 1.00 0.00 H new ATOM 0 HA ASP A 79 7.187 -0.142 7.521 1.00 0.00 H new ATOM 0 HB2 ASP A 79 9.582 -0.041 6.749 1.00 0.00 H new ATOM 0 HB3 ASP A 79 8.685 1.401 6.317 1.00 0.00 H new ATOM 1003 N ILE A 80 7.817 -1.685 9.259 1.00 0.00 N ATOM 1004 CA ILE A 80 8.350 -2.894 9.897 1.00 0.00 C ATOM 1005 C ILE A 80 7.389 -4.042 9.654 1.00 0.00 C ATOM 1006 O ILE A 80 7.538 -4.837 8.726 1.00 0.00 O ATOM 1007 CB ILE A 80 8.618 -2.766 11.424 1.00 0.00 C ATOM 1008 CG1 ILE A 80 7.749 -1.679 12.066 1.00 0.00 C ATOM 1009 CG2 ILE A 80 10.094 -2.503 11.691 1.00 0.00 C ATOM 1010 CD1 ILE A 80 7.001 -2.155 13.294 1.00 0.00 C ATOM 0 H ILE A 80 6.858 -1.793 8.928 1.00 0.00 H new ATOM 0 HA ILE A 80 9.324 -3.070 9.440 1.00 0.00 H new ATOM 0 HB ILE A 80 8.345 -3.716 11.884 1.00 0.00 H new ATOM 0 HG12 ILE A 80 8.380 -0.834 12.339 1.00 0.00 H new ATOM 0 HG13 ILE A 80 7.031 -1.316 11.330 1.00 0.00 H new ATOM 0 HG21 ILE A 80 10.260 -2.417 12.765 1.00 0.00 H new ATOM 0 HG22 ILE A 80 10.688 -3.328 11.297 1.00 0.00 H new ATOM 0 HG23 ILE A 80 10.393 -1.576 11.202 1.00 0.00 H new ATOM 0 HD11 ILE A 80 6.406 -1.336 13.698 1.00 0.00 H new ATOM 0 HD12 ILE A 80 6.344 -2.981 13.022 1.00 0.00 H new ATOM 0 HD13 ILE A 80 7.714 -2.491 14.047 1.00 0.00 H new ATOM 1022 N ASP A 81 6.415 -4.104 10.539 1.00 0.00 N ATOM 1023 CA ASP A 81 5.230 -4.916 10.381 1.00 0.00 C ATOM 1024 C ASP A 81 4.066 -3.991 10.666 1.00 0.00 C ATOM 1025 O ASP A 81 3.196 -4.274 11.487 1.00 0.00 O ATOM 1026 CB ASP A 81 5.236 -6.099 11.356 1.00 0.00 C ATOM 1027 CG ASP A 81 4.409 -7.270 10.862 1.00 0.00 C ATOM 1028 OD1 ASP A 81 4.961 -8.131 10.149 1.00 0.00 O ATOM 1029 OD2 ASP A 81 3.205 -7.340 11.185 1.00 0.00 O ATOM 0 H ASP A 81 6.428 -3.576 11.411 1.00 0.00 H new ATOM 0 HA ASP A 81 5.171 -5.346 9.381 1.00 0.00 H new ATOM 0 HB2 ASP A 81 6.263 -6.427 11.516 1.00 0.00 H new ATOM 0 HB3 ASP A 81 4.852 -5.770 12.322 1.00 0.00 H new ATOM 1034 N LYS A 82 4.093 -2.848 9.992 1.00 0.00 N ATOM 1035 CA LYS A 82 3.239 -1.725 10.359 1.00 0.00 C ATOM 1036 C LYS A 82 1.978 -1.686 9.517 1.00 0.00 C ATOM 1037 O LYS A 82 2.045 -1.565 8.295 1.00 0.00 O ATOM 1038 CB LYS A 82 4.006 -0.409 10.211 1.00 0.00 C ATOM 1039 CG LYS A 82 4.587 0.110 11.517 1.00 0.00 C ATOM 1040 CD LYS A 82 3.501 0.361 12.552 1.00 0.00 C ATOM 1041 CE LYS A 82 3.938 1.392 13.578 1.00 0.00 C ATOM 1042 NZ LYS A 82 3.149 1.293 14.833 1.00 0.00 N ATOM 0 H LYS A 82 4.697 -2.674 9.189 1.00 0.00 H new ATOM 0 HA LYS A 82 2.944 -1.858 11.400 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.815 -0.549 9.494 1.00 0.00 H new ATOM 0 HB3 LYS A 82 3.338 0.346 9.795 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.304 -0.611 11.909 1.00 0.00 H new ATOM 0 HG3 LYS A 82 5.134 1.034 11.331 1.00 0.00 H new ATOM 0 HD2 LYS A 82 2.594 0.704 12.054 1.00 0.00 H new ATOM 0 HD3 LYS A 82 3.254 -0.573 13.056 1.00 0.00 H new ATOM 0 HE2 LYS A 82 4.996 1.255 13.802 1.00 0.00 H new ATOM 0 HE3 LYS A 82 3.828 2.392 13.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 3.478 2.013 15.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 2.142 1.449 14.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 3.274 0.348 15.248 1.00 0.00 H new ATOM 1056 N PRO A 83 0.808 -1.787 10.163 1.00 0.00 N ATOM 1057 CA PRO A 83 -0.474 -1.778 9.488 1.00 0.00 C ATOM 1058 C PRO A 83 -1.071 -0.379 9.382 1.00 0.00 C ATOM 1059 O PRO A 83 -1.642 0.149 10.337 1.00 0.00 O ATOM 1060 CB PRO A 83 -1.344 -2.662 10.392 1.00 0.00 C ATOM 1061 CG PRO A 83 -0.593 -2.816 11.687 1.00 0.00 C ATOM 1062 CD PRO A 83 0.626 -1.935 11.602 1.00 0.00 C ATOM 0 HA PRO A 83 -0.397 -2.128 8.459 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -2.319 -2.204 10.561 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -1.523 -3.633 9.929 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -1.219 -2.527 12.531 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -0.306 -3.856 11.844 1.00 0.00 H new ATOM 0 HD2 PRO A 83 0.467 -0.974 12.092 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.493 -2.395 12.076 1.00 0.00 H new ATOM 1070 N LEU A 84 -0.937 0.211 8.210 1.00 0.00 N ATOM 1071 CA LEU A 84 -1.569 1.480 7.900 1.00 0.00 C ATOM 1072 C LEU A 84 -2.204 1.386 6.527 1.00 0.00 C ATOM 1073 O LEU A 84 -1.518 1.075 5.573 1.00 0.00 O ATOM 1074 CB LEU A 84 -0.544 2.620 7.929 1.00 0.00 C ATOM 1075 CG LEU A 84 -0.645 3.578 9.123 1.00 0.00 C ATOM 1076 CD1 LEU A 84 -0.182 4.966 8.720 1.00 0.00 C ATOM 1077 CD2 LEU A 84 -2.067 3.635 9.666 1.00 0.00 C ATOM 0 H LEU A 84 -0.386 -0.176 7.444 1.00 0.00 H new ATOM 0 HA LEU A 84 -2.331 1.695 8.649 1.00 0.00 H new ATOM 0 HB2 LEU A 84 0.455 2.185 7.920 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -0.648 3.200 7.012 1.00 0.00 H new ATOM 0 HG LEU A 84 0.003 3.201 9.914 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.258 5.638 9.575 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.854 4.921 8.385 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.809 5.338 7.910 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -2.106 4.322 10.511 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -2.742 3.983 8.884 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.372 2.641 9.992 1.00 0.00 H new ATOM 1089 N LYS A 85 -3.512 1.590 6.441 1.00 0.00 N ATOM 1090 CA LYS A 85 -4.211 1.568 5.152 1.00 0.00 C ATOM 1091 C LYS A 85 -4.302 2.962 4.583 1.00 0.00 C ATOM 1092 O LYS A 85 -3.844 3.925 5.188 1.00 0.00 O ATOM 1093 CB LYS A 85 -5.631 1.006 5.257 1.00 0.00 C ATOM 1094 CG LYS A 85 -6.104 0.227 4.036 1.00 0.00 C ATOM 1095 CD LYS A 85 -7.604 -0.025 4.100 1.00 0.00 C ATOM 1096 CE LYS A 85 -7.995 -1.304 3.372 1.00 0.00 C ATOM 1097 NZ LYS A 85 -8.827 -2.197 4.224 1.00 0.00 N ATOM 0 H LYS A 85 -4.114 1.773 7.244 1.00 0.00 H new ATOM 0 HA LYS A 85 -3.628 0.916 4.502 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -5.685 0.354 6.129 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -6.321 1.831 5.433 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -5.863 0.782 3.130 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -5.574 -0.724 3.978 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -7.917 -0.090 5.142 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -8.133 0.820 3.660 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -8.545 -1.052 2.465 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -7.095 -1.834 3.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -9.550 -2.662 3.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -8.222 -2.919 4.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -9.292 -1.635 4.966 1.00 0.00 H new ATOM 1111 N TYR A 86 -4.913 3.050 3.426 1.00 0.00 N ATOM 1112 CA TYR A 86 -5.055 4.314 2.726 1.00 0.00 C ATOM 1113 C TYR A 86 -6.482 4.512 2.238 1.00 0.00 C ATOM 1114 O TYR A 86 -7.074 3.615 1.631 1.00 0.00 O ATOM 1115 CB TYR A 86 -4.057 4.405 1.563 1.00 0.00 C ATOM 1116 CG TYR A 86 -4.470 3.672 0.302 1.00 0.00 C ATOM 1117 CD1 TYR A 86 -4.498 2.285 0.253 1.00 0.00 C ATOM 1118 CD2 TYR A 86 -4.822 4.372 -0.840 1.00 0.00 C ATOM 1119 CE1 TYR A 86 -4.862 1.619 -0.899 1.00 0.00 C ATOM 1120 CE2 TYR A 86 -5.189 3.713 -1.994 1.00 0.00 C ATOM 1121 CZ TYR A 86 -5.208 2.338 -2.018 1.00 0.00 C ATOM 1122 OH TYR A 86 -5.570 1.682 -3.167 1.00 0.00 O ATOM 0 H TYR A 86 -5.326 2.254 2.941 1.00 0.00 H new ATOM 0 HA TYR A 86 -4.831 5.117 3.429 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -3.902 5.456 1.319 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -3.097 4.010 1.896 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -4.230 1.717 1.132 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -4.809 5.452 -0.826 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -4.875 0.539 -0.921 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -5.461 4.274 -2.876 1.00 0.00 H new ATOM 0 HH TYR A 86 -4.802 1.181 -3.514 1.00 0.00 H new ATOM 1132 N GLU A 87 -7.017 5.681 2.554 1.00 0.00 N ATOM 1133 CA GLU A 87 -8.339 6.119 2.125 1.00 0.00 C ATOM 1134 C GLU A 87 -8.657 7.424 2.831 1.00 0.00 C ATOM 1135 O GLU A 87 -7.946 7.817 3.760 1.00 0.00 O ATOM 1136 CB GLU A 87 -9.427 5.080 2.428 1.00 0.00 C ATOM 1137 CG GLU A 87 -10.185 4.607 1.189 1.00 0.00 C ATOM 1138 CD GLU A 87 -10.260 5.659 0.094 1.00 0.00 C ATOM 1139 OE1 GLU A 87 -10.835 6.742 0.338 1.00 0.00 O ATOM 1140 OE2 GLU A 87 -9.754 5.406 -1.022 1.00 0.00 O ATOM 0 H GLU A 87 -6.533 6.370 3.130 1.00 0.00 H new ATOM 0 HA GLU A 87 -8.326 6.252 1.043 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -8.969 4.218 2.914 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -10.137 5.506 3.137 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -9.700 3.714 0.793 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -11.196 4.320 1.477 1.00 0.00 H new ATOM 1147 N ASP A 88 -9.699 8.103 2.393 1.00 0.00 N ATOM 1148 CA ASP A 88 -10.043 9.394 2.963 1.00 0.00 C ATOM 1149 C ASP A 88 -10.662 9.237 4.342 1.00 0.00 C ATOM 1150 O ASP A 88 -11.651 8.523 4.522 1.00 0.00 O ATOM 1151 CB ASP A 88 -10.995 10.162 2.053 1.00 0.00 C ATOM 1152 CG ASP A 88 -10.973 11.655 2.324 1.00 0.00 C ATOM 1153 OD1 ASP A 88 -10.330 12.085 3.309 1.00 0.00 O ATOM 1154 OD2 ASP A 88 -11.593 12.409 1.548 1.00 0.00 O ATOM 0 H ASP A 88 -10.320 7.786 1.649 1.00 0.00 H new ATOM 0 HA ASP A 88 -9.118 9.962 3.058 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -10.725 9.980 1.013 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -12.008 9.785 2.190 1.00 0.00 H new ATOM 1159 N TYR A 89 -10.061 9.902 5.313 1.00 0.00 N ATOM 1160 CA TYR A 89 -10.582 9.922 6.668 1.00 0.00 C ATOM 1161 C TYR A 89 -11.682 10.971 6.782 1.00 0.00 C ATOM 1162 O TYR A 89 -12.399 11.034 7.780 1.00 0.00 O ATOM 1163 CB TYR A 89 -9.459 10.228 7.663 1.00 0.00 C ATOM 1164 CG TYR A 89 -9.358 9.238 8.805 1.00 0.00 C ATOM 1165 CD1 TYR A 89 -10.239 9.289 9.877 1.00 0.00 C ATOM 1166 CD2 TYR A 89 -8.374 8.256 8.812 1.00 0.00 C ATOM 1167 CE1 TYR A 89 -10.142 8.392 10.925 1.00 0.00 C ATOM 1168 CE2 TYR A 89 -8.271 7.355 9.854 1.00 0.00 C ATOM 1169 CZ TYR A 89 -9.156 7.427 10.909 1.00 0.00 C ATOM 1170 OH TYR A 89 -9.052 6.533 11.953 1.00 0.00 O ATOM 0 H TYR A 89 -9.204 10.440 5.186 1.00 0.00 H new ATOM 0 HA TYR A 89 -10.997 8.942 6.902 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -8.509 10.247 7.128 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -9.614 11.226 8.074 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -11.013 10.042 9.893 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -7.678 8.197 7.988 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -10.835 8.447 11.752 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -7.501 6.598 9.842 1.00 0.00 H new ATOM 0 HH TYR A 89 -9.655 5.777 11.797 1.00 0.00 H new ATOM 1180 N TYR A 90 -11.803 11.791 5.746 1.00 0.00 N ATOM 1181 CA TYR A 90 -12.804 12.841 5.708 1.00 0.00 C ATOM 1182 C TYR A 90 -13.803 12.578 4.582 1.00 0.00 C ATOM 1183 O TYR A 90 -13.980 11.436 4.153 1.00 0.00 O ATOM 1184 CB TYR A 90 -12.131 14.205 5.522 1.00 0.00 C ATOM 1185 CG TYR A 90 -11.991 15.000 6.802 1.00 0.00 C ATOM 1186 CD1 TYR A 90 -12.303 14.437 8.033 1.00 0.00 C ATOM 1187 CD2 TYR A 90 -11.545 16.315 6.780 1.00 0.00 C ATOM 1188 CE1 TYR A 90 -12.178 15.160 9.202 1.00 0.00 C ATOM 1189 CE2 TYR A 90 -11.416 17.046 7.946 1.00 0.00 C ATOM 1190 CZ TYR A 90 -11.733 16.463 9.154 1.00 0.00 C ATOM 1191 OH TYR A 90 -11.612 17.187 10.317 1.00 0.00 O ATOM 0 H TYR A 90 -11.213 11.745 4.915 1.00 0.00 H new ATOM 0 HA TYR A 90 -13.345 12.847 6.654 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -11.142 14.055 5.089 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -12.708 14.789 4.805 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -12.650 13.415 8.076 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -11.295 16.775 5.835 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -12.428 14.707 10.150 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -11.069 18.068 7.911 1.00 0.00 H new ATOM 0 HH TYR A 90 -11.285 18.087 10.109 1.00 0.00 H new ATOM 1201 N THR A 91 -14.448 13.632 4.106 1.00 0.00 N ATOM 1202 CA THR A 91 -15.452 13.509 3.060 1.00 0.00 C ATOM 1203 C THR A 91 -15.064 14.316 1.821 1.00 0.00 C ATOM 1204 O THR A 91 -15.863 15.096 1.300 1.00 0.00 O ATOM 1205 CB THR A 91 -16.821 13.995 3.570 1.00 0.00 C ATOM 1206 OG1 THR A 91 -16.708 14.399 4.944 1.00 0.00 O ATOM 1207 CG2 THR A 91 -17.873 12.902 3.440 1.00 0.00 C ATOM 0 H THR A 91 -14.293 14.587 4.429 1.00 0.00 H new ATOM 0 HA THR A 91 -15.514 12.455 2.788 1.00 0.00 H new ATOM 0 HB THR A 91 -17.133 14.843 2.961 1.00 0.00 H new ATOM 0 HG1 THR A 91 -17.580 14.710 5.266 1.00 0.00 H new ATOM 0 HG21 THR A 91 -18.830 13.273 3.807 1.00 0.00 H new ATOM 0 HG22 THR A 91 -17.973 12.616 2.393 1.00 0.00 H new ATOM 0 HG23 THR A 91 -17.571 12.034 4.026 1.00 0.00 H new ATOM 1215 N SER A 92 -13.840 14.124 1.350 1.00 0.00 N ATOM 1216 CA SER A 92 -13.343 14.875 0.205 1.00 0.00 C ATOM 1217 C SER A 92 -13.226 13.984 -1.031 1.00 0.00 C ATOM 1218 O SER A 92 -13.516 14.412 -2.150 1.00 0.00 O ATOM 1219 CB SER A 92 -11.985 15.496 0.535 1.00 0.00 C ATOM 1220 OG SER A 92 -11.490 15.015 1.776 1.00 0.00 O ATOM 0 H SER A 92 -13.175 13.457 1.741 1.00 0.00 H new ATOM 0 HA SER A 92 -14.057 15.668 -0.016 1.00 0.00 H new ATOM 0 HB2 SER A 92 -11.274 15.265 -0.258 1.00 0.00 H new ATOM 0 HB3 SER A 92 -12.078 16.581 0.573 1.00 0.00 H new ATOM 0 HG SER A 92 -11.226 14.076 1.681 1.00 0.00 H new ATOM 1226 N GLY A 93 -12.802 12.744 -0.823 1.00 0.00 N ATOM 1227 CA GLY A 93 -12.583 11.838 -1.935 1.00 0.00 C ATOM 1228 C GLY A 93 -11.192 12.002 -2.504 1.00 0.00 C ATOM 1229 O GLY A 93 -11.013 12.154 -3.714 1.00 0.00 O ATOM 0 H GLY A 93 -12.606 12.349 0.097 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -12.725 10.809 -1.604 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -13.322 12.027 -2.713 1.00 0.00 H new ATOM 1233 N LEU A 94 -10.205 11.983 -1.620 1.00 0.00 N ATOM 1234 CA LEU A 94 -8.824 12.218 -2.011 1.00 0.00 C ATOM 1235 C LEU A 94 -8.178 10.948 -2.555 1.00 0.00 C ATOM 1236 O LEU A 94 -8.680 9.840 -2.348 1.00 0.00 O ATOM 1237 CB LEU A 94 -8.019 12.746 -0.820 1.00 0.00 C ATOM 1238 CG LEU A 94 -6.978 13.812 -1.163 1.00 0.00 C ATOM 1239 CD1 LEU A 94 -7.600 15.200 -1.112 1.00 0.00 C ATOM 1240 CD2 LEU A 94 -5.793 13.717 -0.217 1.00 0.00 C ATOM 0 H LEU A 94 -10.336 11.807 -0.624 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.824 12.965 -2.805 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -8.712 13.159 -0.087 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.513 11.907 -0.342 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.621 13.636 -2.178 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.845 15.946 -1.359 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -8.417 15.259 -1.831 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -7.984 15.390 -0.110 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.060 14.482 -0.474 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -6.132 13.869 0.808 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.335 12.732 -0.305 1.00 0.00 H new ATOM 1252 N SER A 95 -7.069 11.122 -3.257 1.00 0.00 N ATOM 1253 CA SER A 95 -6.320 10.003 -3.803 1.00 0.00 C ATOM 1254 C SER A 95 -5.026 9.800 -3.020 1.00 0.00 C ATOM 1255 O SER A 95 -4.291 10.755 -2.763 1.00 0.00 O ATOM 1256 CB SER A 95 -6.014 10.246 -5.282 1.00 0.00 C ATOM 1257 OG SER A 95 -6.417 11.551 -5.680 1.00 0.00 O ATOM 0 H SER A 95 -6.666 12.036 -3.463 1.00 0.00 H new ATOM 0 HA SER A 95 -6.924 9.100 -3.715 1.00 0.00 H new ATOM 0 HB2 SER A 95 -4.946 10.121 -5.461 1.00 0.00 H new ATOM 0 HB3 SER A 95 -6.528 9.502 -5.890 1.00 0.00 H new ATOM 0 HG SER A 95 -6.209 11.682 -6.629 1.00 0.00 H new ATOM 1263 N TRP A 96 -4.774 8.559 -2.638 1.00 0.00 N ATOM 1264 CA TRP A 96 -3.598 8.200 -1.860 1.00 0.00 C ATOM 1265 C TRP A 96 -2.912 7.019 -2.525 1.00 0.00 C ATOM 1266 O TRP A 96 -3.587 6.129 -3.039 1.00 0.00 O ATOM 1267 CB TRP A 96 -3.983 7.805 -0.419 1.00 0.00 C ATOM 1268 CG TRP A 96 -5.172 8.533 0.140 1.00 0.00 C ATOM 1269 CD1 TRP A 96 -6.477 8.390 -0.238 1.00 0.00 C ATOM 1270 CD2 TRP A 96 -5.164 9.497 1.198 1.00 0.00 C ATOM 1271 NE1 TRP A 96 -7.276 9.220 0.504 1.00 0.00 N ATOM 1272 CE2 TRP A 96 -6.495 9.906 1.397 1.00 0.00 C ATOM 1273 CE3 TRP A 96 -4.159 10.056 1.994 1.00 0.00 C ATOM 1274 CZ2 TRP A 96 -6.847 10.849 2.361 1.00 0.00 C ATOM 1275 CZ3 TRP A 96 -4.509 10.991 2.950 1.00 0.00 C ATOM 1276 CH2 TRP A 96 -5.843 11.378 3.128 1.00 0.00 C ATOM 0 H TRP A 96 -5.381 7.769 -2.859 1.00 0.00 H new ATOM 0 HA TRP A 96 -2.933 9.063 -1.818 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -4.186 6.734 -0.393 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -3.127 7.983 0.232 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -6.828 7.720 -1.009 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -8.287 9.312 0.407 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -3.128 9.762 1.864 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -7.875 11.152 2.498 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -3.741 11.430 3.570 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -6.085 12.109 3.886 1.00 0.00 H new ATOM 1287 N ILE A 97 -1.589 7.012 -2.558 1.00 0.00 N ATOM 1288 CA ILE A 97 -0.882 5.848 -3.089 1.00 0.00 C ATOM 1289 C ILE A 97 0.002 5.190 -2.033 1.00 0.00 C ATOM 1290 O ILE A 97 0.337 5.803 -1.027 1.00 0.00 O ATOM 1291 CB ILE A 97 -0.048 6.214 -4.336 1.00 0.00 C ATOM 1292 CG1 ILE A 97 -0.369 5.262 -5.488 1.00 0.00 C ATOM 1293 CG2 ILE A 97 1.448 6.219 -4.043 1.00 0.00 C ATOM 1294 CD1 ILE A 97 -1.701 5.539 -6.149 1.00 0.00 C ATOM 0 H ILE A 97 -0.993 7.774 -2.234 1.00 0.00 H new ATOM 0 HA ILE A 97 -1.643 5.127 -3.386 1.00 0.00 H new ATOM 0 HB ILE A 97 -0.322 7.228 -4.627 1.00 0.00 H new ATOM 0 HG12 ILE A 97 0.420 5.332 -6.237 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -0.364 4.238 -5.114 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.995 6.482 -4.948 1.00 0.00 H new ATOM 0 HG22 ILE A 97 1.664 6.950 -3.264 1.00 0.00 H new ATOM 0 HG23 ILE A 97 1.756 5.229 -3.707 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -1.862 4.825 -6.957 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -2.500 5.441 -5.414 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -1.703 6.551 -6.553 1.00 0.00 H new ATOM 1306 N TRP A 98 0.326 3.921 -2.237 1.00 0.00 N ATOM 1307 CA TRP A 98 1.340 3.268 -1.424 1.00 0.00 C ATOM 1308 C TRP A 98 2.705 3.502 -2.038 1.00 0.00 C ATOM 1309 O TRP A 98 2.939 3.131 -3.191 1.00 0.00 O ATOM 1310 CB TRP A 98 1.110 1.767 -1.335 1.00 0.00 C ATOM 1311 CG TRP A 98 -0.042 1.374 -0.482 1.00 0.00 C ATOM 1312 CD1 TRP A 98 -0.976 0.429 -0.787 1.00 0.00 C ATOM 1313 CD2 TRP A 98 -0.392 1.894 0.808 1.00 0.00 C ATOM 1314 NE1 TRP A 98 -1.879 0.316 0.231 1.00 0.00 N ATOM 1315 CE2 TRP A 98 -1.548 1.207 1.215 1.00 0.00 C ATOM 1316 CE3 TRP A 98 0.149 2.869 1.670 1.00 0.00 C ATOM 1317 CZ2 TRP A 98 -2.163 1.460 2.424 1.00 0.00 C ATOM 1318 CZ3 TRP A 98 -0.473 3.109 2.862 1.00 0.00 C ATOM 1319 CH2 TRP A 98 -1.613 2.410 3.226 1.00 0.00 C ATOM 0 H TRP A 98 -0.095 3.328 -2.952 1.00 0.00 H new ATOM 0 HA TRP A 98 1.282 3.692 -0.422 1.00 0.00 H new ATOM 0 HB2 TRP A 98 0.953 1.375 -2.340 1.00 0.00 H new ATOM 0 HB3 TRP A 98 2.012 1.295 -0.946 1.00 0.00 H new ATOM 0 HD1 TRP A 98 -0.998 -0.146 -1.701 1.00 0.00 H new ATOM 0 HE1 TRP A 98 -2.670 -0.327 0.254 1.00 0.00 H new ATOM 0 HE3 TRP A 98 1.038 3.416 1.393 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 -3.051 0.922 2.723 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 -0.070 3.855 3.531 1.00 0.00 H new ATOM 0 HH2 TRP A 98 -2.079 2.627 4.176 1.00 0.00 H new ATOM 1330 N LYS A 99 3.597 4.127 -1.295 1.00 0.00 N ATOM 1331 CA LYS A 99 4.957 4.298 -1.761 1.00 0.00 C ATOM 1332 C LYS A 99 5.846 3.200 -1.211 1.00 0.00 C ATOM 1333 O LYS A 99 6.008 3.065 0.001 1.00 0.00 O ATOM 1334 CB LYS A 99 5.521 5.661 -1.368 1.00 0.00 C ATOM 1335 CG LYS A 99 6.863 5.965 -2.020 1.00 0.00 C ATOM 1336 CD LYS A 99 7.393 7.331 -1.612 1.00 0.00 C ATOM 1337 CE LYS A 99 7.796 8.157 -2.825 1.00 0.00 C ATOM 1338 NZ LYS A 99 8.942 9.054 -2.528 1.00 0.00 N ATOM 0 H LYS A 99 3.406 4.522 -0.374 1.00 0.00 H new ATOM 0 HA LYS A 99 4.938 4.240 -2.849 1.00 0.00 H new ATOM 0 HB2 LYS A 99 4.806 6.436 -1.644 1.00 0.00 H new ATOM 0 HB3 LYS A 99 5.633 5.702 -0.285 1.00 0.00 H new ATOM 0 HG2 LYS A 99 7.585 5.197 -1.741 1.00 0.00 H new ATOM 0 HG3 LYS A 99 6.758 5.925 -3.104 1.00 0.00 H new ATOM 0 HD2 LYS A 99 6.630 7.864 -1.045 1.00 0.00 H new ATOM 0 HD3 LYS A 99 8.252 7.207 -0.953 1.00 0.00 H new ATOM 0 HE2 LYS A 99 8.060 7.491 -3.646 1.00 0.00 H new ATOM 0 HE3 LYS A 99 6.946 8.752 -3.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 9.121 9.671 -3.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 8.720 9.637 -1.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 9.789 8.483 -2.334 1.00 0.00 H new ATOM 1352 N ILE A 100 6.386 2.401 -2.108 1.00 0.00 N ATOM 1353 CA ILE A 100 7.398 1.429 -1.745 1.00 0.00 C ATOM 1354 C ILE A 100 8.760 2.073 -1.891 1.00 0.00 C ATOM 1355 O ILE A 100 9.242 2.282 -3.005 1.00 0.00 O ATOM 1356 CB ILE A 100 7.320 0.160 -2.619 1.00 0.00 C ATOM 1357 CG1 ILE A 100 5.863 -0.273 -2.828 1.00 0.00 C ATOM 1358 CG2 ILE A 100 8.119 -0.963 -1.981 1.00 0.00 C ATOM 1359 CD1 ILE A 100 5.142 -0.649 -1.547 1.00 0.00 C ATOM 0 H ILE A 100 6.140 2.405 -3.098 1.00 0.00 H new ATOM 0 HA ILE A 100 7.227 1.120 -0.714 1.00 0.00 H new ATOM 0 HB ILE A 100 7.748 0.389 -3.595 1.00 0.00 H new ATOM 0 HG12 ILE A 100 5.320 0.537 -3.314 1.00 0.00 H new ATOM 0 HG13 ILE A 100 5.842 -1.124 -3.508 1.00 0.00 H new ATOM 0 HG21 ILE A 100 8.057 -1.854 -2.606 1.00 0.00 H new ATOM 0 HG22 ILE A 100 9.161 -0.659 -1.885 1.00 0.00 H new ATOM 0 HG23 ILE A 100 7.713 -1.183 -0.994 1.00 0.00 H new ATOM 0 HD11 ILE A 100 4.118 -0.943 -1.779 1.00 0.00 H new ATOM 0 HD12 ILE A 100 5.659 -1.481 -1.069 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.130 0.207 -0.872 1.00 0.00 H new ATOM 1371 N LYS A 101 9.344 2.428 -0.762 1.00 0.00 N ATOM 1372 CA LYS A 101 10.627 3.102 -0.741 1.00 0.00 C ATOM 1373 C LYS A 101 11.595 2.349 0.155 1.00 0.00 C ATOM 1374 O LYS A 101 11.216 1.865 1.220 1.00 0.00 O ATOM 1375 CB LYS A 101 10.452 4.540 -0.247 1.00 0.00 C ATOM 1376 CG LYS A 101 11.763 5.275 -0.011 1.00 0.00 C ATOM 1377 CD LYS A 101 11.711 6.113 1.256 1.00 0.00 C ATOM 1378 CE LYS A 101 12.547 7.375 1.121 1.00 0.00 C ATOM 1379 NZ LYS A 101 11.833 8.433 0.358 1.00 0.00 N ATOM 0 H LYS A 101 8.945 2.258 0.161 1.00 0.00 H new ATOM 0 HA LYS A 101 11.035 3.126 -1.752 1.00 0.00 H new ATOM 0 HB2 LYS A 101 9.862 5.095 -0.976 1.00 0.00 H new ATOM 0 HB3 LYS A 101 9.881 4.528 0.682 1.00 0.00 H new ATOM 0 HG2 LYS A 101 12.578 4.554 0.061 1.00 0.00 H new ATOM 0 HG3 LYS A 101 11.980 5.917 -0.865 1.00 0.00 H new ATOM 0 HD2 LYS A 101 10.677 6.381 1.474 1.00 0.00 H new ATOM 0 HD3 LYS A 101 12.072 5.524 2.099 1.00 0.00 H new ATOM 0 HE2 LYS A 101 12.800 7.751 2.112 1.00 0.00 H new ATOM 0 HE3 LYS A 101 13.486 7.137 0.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 12.525 9.086 -0.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 11.269 7.995 -0.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 11.205 8.959 0.999 1.00 0.00 H new ATOM 1393 N ASN A 102 12.832 2.224 -0.287 1.00 0.00 N ATOM 1394 CA ASN A 102 13.854 1.559 0.506 1.00 0.00 C ATOM 1395 C ASN A 102 15.119 2.422 0.574 1.00 0.00 C ATOM 1396 O ASN A 102 15.311 3.317 -0.253 1.00 0.00 O ATOM 1397 CB ASN A 102 14.148 0.183 -0.087 1.00 0.00 C ATOM 1398 CG ASN A 102 15.088 -0.651 0.758 1.00 0.00 C ATOM 1399 OD1 ASN A 102 15.260 -0.415 1.951 1.00 0.00 O ATOM 1400 ND2 ASN A 102 15.694 -1.645 0.138 1.00 0.00 N ATOM 0 H ASN A 102 13.155 2.573 -1.189 1.00 0.00 H new ATOM 0 HA ASN A 102 13.493 1.423 1.525 1.00 0.00 H new ATOM 0 HB2 ASN A 102 13.210 -0.357 -0.213 1.00 0.00 H new ATOM 0 HB3 ASN A 102 14.580 0.309 -1.080 1.00 0.00 H new ATOM 0 HD21 ASN A 102 16.333 -2.252 0.651 1.00 0.00 H new ATOM 0 HD22 ASN A 102 15.523 -1.807 -0.855 1.00 0.00 H new ATOM 1407 N ASN A 103 15.970 2.153 1.559 1.00 0.00 N ATOM 1408 CA ASN A 103 17.123 3.010 1.842 1.00 0.00 C ATOM 1409 C ASN A 103 18.447 2.291 1.625 1.00 0.00 C ATOM 1410 O ASN A 103 19.431 2.901 1.210 1.00 0.00 O ATOM 1411 CB ASN A 103 17.077 3.494 3.292 1.00 0.00 C ATOM 1412 CG ASN A 103 15.732 4.073 3.671 1.00 0.00 C ATOM 1413 OD1 ASN A 103 15.423 5.224 3.354 1.00 0.00 O ATOM 1414 ND2 ASN A 103 14.924 3.278 4.352 1.00 0.00 N ATOM 0 H ASN A 103 15.885 1.347 2.178 1.00 0.00 H new ATOM 0 HA ASN A 103 17.064 3.849 1.149 1.00 0.00 H new ATOM 0 HB2 ASN A 103 17.310 2.662 3.956 1.00 0.00 H new ATOM 0 HB3 ASN A 103 17.849 4.249 3.444 1.00 0.00 H new ATOM 0 HD21 ASN A 103 14.003 3.610 4.637 1.00 0.00 H new ATOM 0 HD22 ASN A 103 15.222 2.333 4.592 1.00 0.00 H new ATOM 1421 N SER A 104 18.467 1.005 1.918 1.00 0.00 N ATOM 1422 CA SER A 104 19.706 0.242 1.963 1.00 0.00 C ATOM 1423 C SER A 104 20.139 -0.237 0.571 1.00 0.00 C ATOM 1424 O SER A 104 19.746 0.337 -0.450 1.00 0.00 O ATOM 1425 CB SER A 104 19.493 -0.946 2.896 1.00 0.00 C ATOM 1426 OG SER A 104 18.102 -1.180 3.088 1.00 0.00 O ATOM 0 H SER A 104 17.632 0.459 2.131 1.00 0.00 H new ATOM 0 HA SER A 104 20.507 0.883 2.332 1.00 0.00 H new ATOM 0 HB2 SER A 104 19.964 -1.835 2.477 1.00 0.00 H new ATOM 0 HB3 SER A 104 19.972 -0.754 3.856 1.00 0.00 H new ATOM 0 HG SER A 104 17.879 -1.065 4.035 1.00 0.00 H new ATOM 1432 N SER A 105 20.969 -1.279 0.544 1.00 0.00 N ATOM 1433 CA SER A 105 21.364 -1.925 -0.692 1.00 0.00 C ATOM 1434 C SER A 105 20.164 -2.659 -1.246 1.00 0.00 C ATOM 1435 O SER A 105 19.214 -2.939 -0.510 1.00 0.00 O ATOM 1436 CB SER A 105 22.527 -2.883 -0.438 1.00 0.00 C ATOM 1437 OG SER A 105 23.492 -2.275 0.406 1.00 0.00 O ATOM 0 H SER A 105 21.382 -1.693 1.380 1.00 0.00 H new ATOM 0 HA SER A 105 21.703 -1.185 -1.417 1.00 0.00 H new ATOM 0 HB2 SER A 105 22.158 -3.800 0.022 1.00 0.00 H new ATOM 0 HB3 SER A 105 22.988 -3.165 -1.385 1.00 0.00 H new ATOM 0 HG SER A 105 24.230 -2.900 0.562 1.00 0.00 H new ATOM 1443 N GLU A 106 20.174 -2.976 -2.524 1.00 0.00 N ATOM 1444 CA GLU A 106 18.928 -3.348 -3.136 1.00 0.00 C ATOM 1445 C GLU A 106 18.718 -4.854 -3.256 1.00 0.00 C ATOM 1446 O GLU A 106 18.776 -5.436 -4.342 1.00 0.00 O ATOM 1447 CB GLU A 106 18.866 -2.678 -4.501 1.00 0.00 C ATOM 1448 CG GLU A 106 20.066 -2.948 -5.389 1.00 0.00 C ATOM 1449 CD GLU A 106 19.970 -2.237 -6.719 1.00 0.00 C ATOM 1450 OE1 GLU A 106 18.977 -2.443 -7.441 1.00 0.00 O ATOM 1451 OE2 GLU A 106 20.895 -1.469 -7.052 1.00 0.00 O ATOM 0 H GLU A 106 20.993 -2.983 -3.131 1.00 0.00 H new ATOM 0 HA GLU A 106 18.118 -3.009 -2.490 1.00 0.00 H new ATOM 0 HB2 GLU A 106 17.966 -3.014 -5.016 1.00 0.00 H new ATOM 0 HB3 GLU A 106 18.769 -1.602 -4.359 1.00 0.00 H new ATOM 0 HG2 GLU A 106 20.973 -2.631 -4.875 1.00 0.00 H new ATOM 0 HG3 GLU A 106 20.155 -4.021 -5.559 1.00 0.00 H new ATOM 1458 N THR A 107 18.461 -5.477 -2.123 1.00 0.00 N ATOM 1459 CA THR A 107 17.621 -6.651 -2.051 1.00 0.00 C ATOM 1460 C THR A 107 16.426 -6.331 -1.168 1.00 0.00 C ATOM 1461 O THR A 107 16.542 -6.394 0.056 1.00 0.00 O ATOM 1462 CB THR A 107 18.365 -7.893 -1.530 1.00 0.00 C ATOM 1463 OG1 THR A 107 19.751 -7.591 -1.313 1.00 0.00 O ATOM 1464 CG2 THR A 107 18.239 -9.028 -2.533 1.00 0.00 C ATOM 0 H THR A 107 18.833 -5.179 -1.221 1.00 0.00 H new ATOM 0 HA THR A 107 17.298 -6.901 -3.061 1.00 0.00 H new ATOM 0 HB THR A 107 17.919 -8.196 -0.583 1.00 0.00 H new ATOM 0 HG1 THR A 107 20.212 -8.389 -0.980 1.00 0.00 H new ATOM 0 HG21 THR A 107 18.768 -9.905 -2.159 1.00 0.00 H new ATOM 0 HG22 THR A 107 17.186 -9.272 -2.675 1.00 0.00 H new ATOM 0 HG23 THR A 107 18.672 -8.722 -3.485 1.00 0.00 H new ATOM 1472 N SER A 108 15.295 -5.958 -1.735 1.00 0.00 N ATOM 1473 CA SER A 108 14.172 -5.577 -0.899 1.00 0.00 C ATOM 1474 C SER A 108 12.911 -6.328 -1.290 1.00 0.00 C ATOM 1475 O SER A 108 12.405 -6.187 -2.397 1.00 0.00 O ATOM 1476 CB SER A 108 13.950 -4.068 -0.971 1.00 0.00 C ATOM 1477 OG SER A 108 14.814 -3.473 -1.928 1.00 0.00 O ATOM 0 H SER A 108 15.130 -5.911 -2.740 1.00 0.00 H new ATOM 0 HA SER A 108 14.408 -5.847 0.130 1.00 0.00 H new ATOM 0 HB2 SER A 108 12.913 -3.861 -1.234 1.00 0.00 H new ATOM 0 HB3 SER A 108 14.125 -3.624 0.009 1.00 0.00 H new ATOM 0 HG SER A 108 14.661 -3.881 -2.806 1.00 0.00 H new ATOM 1483 N ASN A 109 12.419 -7.142 -0.377 1.00 0.00 N ATOM 1484 CA ASN A 109 11.200 -7.898 -0.604 1.00 0.00 C ATOM 1485 C ASN A 109 10.148 -7.496 0.420 1.00 0.00 C ATOM 1486 O ASN A 109 10.310 -7.742 1.617 1.00 0.00 O ATOM 1487 CB ASN A 109 11.499 -9.397 -0.528 1.00 0.00 C ATOM 1488 CG ASN A 109 10.259 -10.265 -0.599 1.00 0.00 C ATOM 1489 OD1 ASN A 109 9.232 -9.879 -1.156 1.00 0.00 O ATOM 1490 ND2 ASN A 109 10.363 -11.458 -0.045 1.00 0.00 N ATOM 0 H ASN A 109 12.847 -7.298 0.536 1.00 0.00 H new ATOM 0 HA ASN A 109 10.811 -7.678 -1.598 1.00 0.00 H new ATOM 0 HB2 ASN A 109 12.169 -9.668 -1.344 1.00 0.00 H new ATOM 0 HB3 ASN A 109 12.027 -9.607 0.402 1.00 0.00 H new ATOM 0 HD21 ASN A 109 9.572 -12.102 -0.068 1.00 0.00 H new ATOM 0 HD22 ASN A 109 11.234 -11.736 0.406 1.00 0.00 H new ATOM 1497 N TYR A 110 9.092 -6.848 -0.047 1.00 0.00 N ATOM 1498 CA TYR A 110 8.048 -6.369 0.843 1.00 0.00 C ATOM 1499 C TYR A 110 6.799 -7.230 0.722 1.00 0.00 C ATOM 1500 O TYR A 110 6.455 -7.701 -0.364 1.00 0.00 O ATOM 1501 CB TYR A 110 7.711 -4.895 0.551 1.00 0.00 C ATOM 1502 CG TYR A 110 6.936 -4.658 -0.736 1.00 0.00 C ATOM 1503 CD1 TYR A 110 5.546 -4.690 -0.748 1.00 0.00 C ATOM 1504 CD2 TYR A 110 7.592 -4.402 -1.936 1.00 0.00 C ATOM 1505 CE1 TYR A 110 4.835 -4.475 -1.911 1.00 0.00 C ATOM 1506 CE2 TYR A 110 6.887 -4.186 -3.104 1.00 0.00 C ATOM 1507 CZ TYR A 110 5.510 -4.226 -3.087 1.00 0.00 C ATOM 1508 OH TYR A 110 4.805 -4.008 -4.249 1.00 0.00 O ATOM 0 H TYR A 110 8.936 -6.643 -1.034 1.00 0.00 H new ATOM 0 HA TYR A 110 8.420 -6.441 1.865 1.00 0.00 H new ATOM 0 HB2 TYR A 110 7.132 -4.498 1.385 1.00 0.00 H new ATOM 0 HB3 TYR A 110 8.640 -4.327 0.508 1.00 0.00 H new ATOM 0 HD1 TYR A 110 5.013 -4.887 0.170 1.00 0.00 H new ATOM 0 HD2 TYR A 110 8.671 -4.372 -1.955 1.00 0.00 H new ATOM 0 HE1 TYR A 110 3.755 -4.502 -1.900 1.00 0.00 H new ATOM 0 HE2 TYR A 110 7.413 -3.987 -4.026 1.00 0.00 H new ATOM 0 HH TYR A 110 5.431 -3.847 -4.986 1.00 0.00 H new ATOM 1518 N SER A 111 6.139 -7.452 1.844 1.00 0.00 N ATOM 1519 CA SER A 111 4.853 -8.125 1.851 1.00 0.00 C ATOM 1520 C SER A 111 3.782 -7.179 2.380 1.00 0.00 C ATOM 1521 O SER A 111 3.678 -6.955 3.584 1.00 0.00 O ATOM 1522 CB SER A 111 4.915 -9.394 2.703 1.00 0.00 C ATOM 1523 OG SER A 111 6.220 -9.949 2.694 1.00 0.00 O ATOM 0 H SER A 111 6.474 -7.174 2.766 1.00 0.00 H new ATOM 0 HA SER A 111 4.599 -8.414 0.831 1.00 0.00 H new ATOM 0 HB2 SER A 111 4.621 -9.163 3.727 1.00 0.00 H new ATOM 0 HB3 SER A 111 4.202 -10.126 2.324 1.00 0.00 H new ATOM 0 HG SER A 111 6.235 -10.758 3.247 1.00 0.00 H new ATOM 1529 N LEU A 112 3.011 -6.599 1.475 1.00 0.00 N ATOM 1530 CA LEU A 112 1.966 -5.656 1.858 1.00 0.00 C ATOM 1531 C LEU A 112 0.629 -6.369 2.023 1.00 0.00 C ATOM 1532 O LEU A 112 0.009 -6.766 1.043 1.00 0.00 O ATOM 1533 CB LEU A 112 1.843 -4.542 0.813 1.00 0.00 C ATOM 1534 CG LEU A 112 0.594 -3.662 0.938 1.00 0.00 C ATOM 1535 CD1 LEU A 112 0.653 -2.814 2.199 1.00 0.00 C ATOM 1536 CD2 LEU A 112 0.444 -2.782 -0.291 1.00 0.00 C ATOM 0 H LEU A 112 3.086 -6.762 0.471 1.00 0.00 H new ATOM 0 HA LEU A 112 2.242 -5.213 2.815 1.00 0.00 H new ATOM 0 HB2 LEU A 112 2.725 -3.905 0.880 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.851 -4.994 -0.179 1.00 0.00 H new ATOM 0 HG LEU A 112 -0.278 -4.312 1.009 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -0.244 -2.198 2.266 1.00 0.00 H new ATOM 0 HD12 LEU A 112 0.713 -3.464 3.072 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.533 -2.171 2.164 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -0.447 -2.163 -0.188 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.321 -2.142 -0.390 1.00 0.00 H new ATOM 0 HD23 LEU A 112 0.350 -3.409 -1.178 1.00 0.00 H new ATOM 1548 N ASP A 113 0.191 -6.525 3.262 1.00 0.00 N ATOM 1549 CA ASP A 113 -1.080 -7.181 3.549 1.00 0.00 C ATOM 1550 C ASP A 113 -2.206 -6.158 3.577 1.00 0.00 C ATOM 1551 O ASP A 113 -2.515 -5.580 4.626 1.00 0.00 O ATOM 1552 CB ASP A 113 -1.021 -7.914 4.891 1.00 0.00 C ATOM 1553 CG ASP A 113 -0.870 -9.415 4.745 1.00 0.00 C ATOM 1554 OD1 ASP A 113 -1.389 -9.982 3.765 1.00 0.00 O ATOM 1555 OD2 ASP A 113 -0.218 -10.031 5.620 1.00 0.00 O ATOM 0 H ASP A 113 0.696 -6.206 4.089 1.00 0.00 H new ATOM 0 HA ASP A 113 -1.272 -7.908 2.760 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -0.185 -7.526 5.473 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -1.929 -7.700 5.455 1.00 0.00 H new ATOM 1560 N ALA A 114 -2.803 -5.917 2.420 1.00 0.00 N ATOM 1561 CA ALA A 114 -3.901 -4.970 2.316 1.00 0.00 C ATOM 1562 C ALA A 114 -5.232 -5.710 2.290 1.00 0.00 C ATOM 1563 O ALA A 114 -5.349 -6.778 1.689 1.00 0.00 O ATOM 1564 CB ALA A 114 -3.740 -4.091 1.084 1.00 0.00 C ATOM 0 H ALA A 114 -2.545 -6.364 1.540 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.886 -4.321 3.192 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -4.573 -3.390 1.026 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -2.804 -3.537 1.152 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -3.728 -4.715 0.191 1.00 0.00 H new ATOM 1570 N THR A 115 -6.232 -5.141 2.941 1.00 0.00 N ATOM 1571 CA THR A 115 -7.529 -5.782 3.051 1.00 0.00 C ATOM 1572 C THR A 115 -8.438 -5.389 1.894 1.00 0.00 C ATOM 1573 O THR A 115 -9.183 -4.410 1.976 1.00 0.00 O ATOM 1574 CB THR A 115 -8.205 -5.408 4.379 1.00 0.00 C ATOM 1575 OG1 THR A 115 -7.416 -4.412 5.055 1.00 0.00 O ATOM 1576 CG2 THR A 115 -8.366 -6.631 5.269 1.00 0.00 C ATOM 0 H THR A 115 -6.169 -4.233 3.402 1.00 0.00 H new ATOM 0 HA THR A 115 -7.366 -6.859 3.018 1.00 0.00 H new ATOM 0 HB THR A 115 -9.196 -5.009 4.165 1.00 0.00 H new ATOM 0 HG1 THR A 115 -7.124 -4.760 5.923 1.00 0.00 H new ATOM 0 HG21 THR A 115 -8.847 -6.340 6.203 1.00 0.00 H new ATOM 0 HG22 THR A 115 -8.981 -7.373 4.760 1.00 0.00 H new ATOM 0 HG23 THR A 115 -7.386 -7.057 5.483 1.00 0.00 H new ATOM 1584 N VAL A 116 -8.351 -6.148 0.813 1.00 0.00 N ATOM 1585 CA VAL A 116 -9.201 -5.947 -0.350 1.00 0.00 C ATOM 1586 C VAL A 116 -9.600 -7.294 -0.933 1.00 0.00 C ATOM 1587 O VAL A 116 -8.780 -8.208 -1.019 1.00 0.00 O ATOM 1588 CB VAL A 116 -8.512 -5.109 -1.453 1.00 0.00 C ATOM 1589 CG1 VAL A 116 -8.807 -3.627 -1.270 1.00 0.00 C ATOM 1590 CG2 VAL A 116 -7.011 -5.363 -1.478 1.00 0.00 C ATOM 0 H VAL A 116 -7.690 -6.919 0.717 1.00 0.00 H new ATOM 0 HA VAL A 116 -10.078 -5.396 -0.011 1.00 0.00 H new ATOM 0 HB VAL A 116 -8.920 -5.421 -2.414 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -8.312 -3.058 -2.057 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -9.883 -3.461 -1.324 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -8.437 -3.300 -0.298 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -6.553 -4.761 -2.263 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -6.580 -5.092 -0.514 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -6.824 -6.419 -1.675 1.00 0.00 H new ATOM 1600 N HIS A 117 -10.862 -7.429 -1.309 1.00 0.00 N ATOM 1601 CA HIS A 117 -11.335 -8.658 -1.925 1.00 0.00 C ATOM 1602 C HIS A 117 -10.895 -8.726 -3.385 1.00 0.00 C ATOM 1603 O HIS A 117 -11.383 -7.969 -4.226 1.00 0.00 O ATOM 1604 CB HIS A 117 -12.863 -8.765 -1.825 1.00 0.00 C ATOM 1605 CG HIS A 117 -13.447 -9.896 -2.623 1.00 0.00 C ATOM 1606 ND1 HIS A 117 -14.323 -9.706 -3.669 1.00 0.00 N ATOM 1607 CD2 HIS A 117 -13.255 -11.234 -2.536 1.00 0.00 C ATOM 1608 CE1 HIS A 117 -14.643 -10.876 -4.189 1.00 0.00 C ATOM 1609 NE2 HIS A 117 -14.009 -11.818 -3.521 1.00 0.00 N ATOM 0 H HIS A 117 -11.574 -6.707 -1.199 1.00 0.00 H new ATOM 0 HA HIS A 117 -10.896 -9.498 -1.387 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -13.141 -8.890 -0.779 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -13.306 -7.828 -2.163 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -12.625 -11.746 -1.823 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -15.312 -11.035 -5.022 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -14.069 -12.819 -3.706 1.00 0.00 H new ATOM 1618 N ASP A 118 -9.964 -9.621 -3.674 1.00 0.00 N ATOM 1619 CA ASP A 118 -9.538 -9.854 -5.046 1.00 0.00 C ATOM 1620 C ASP A 118 -10.562 -10.714 -5.765 1.00 0.00 C ATOM 1621 O ASP A 118 -10.843 -11.837 -5.343 1.00 0.00 O ATOM 1622 CB ASP A 118 -8.166 -10.540 -5.088 1.00 0.00 C ATOM 1623 CG ASP A 118 -7.844 -11.120 -6.458 1.00 0.00 C ATOM 1624 OD1 ASP A 118 -7.653 -10.338 -7.407 1.00 0.00 O ATOM 1625 OD2 ASP A 118 -7.779 -12.361 -6.592 1.00 0.00 O ATOM 0 H ASP A 118 -9.489 -10.197 -2.979 1.00 0.00 H new ATOM 0 HA ASP A 118 -9.455 -8.889 -5.546 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -7.395 -9.820 -4.812 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -8.139 -11.337 -4.345 1.00 0.00 H new ATOM 1630 N ASP A 119 -11.138 -10.178 -6.825 1.00 0.00 N ATOM 1631 CA ASP A 119 -12.049 -10.947 -7.654 1.00 0.00 C ATOM 1632 C ASP A 119 -11.231 -11.713 -8.676 1.00 0.00 C ATOM 1633 O ASP A 119 -11.363 -12.929 -8.816 1.00 0.00 O ATOM 1634 CB ASP A 119 -13.063 -10.037 -8.351 1.00 0.00 C ATOM 1635 CG ASP A 119 -13.906 -10.781 -9.369 1.00 0.00 C ATOM 1636 OD1 ASP A 119 -14.640 -11.711 -8.978 1.00 0.00 O ATOM 1637 OD2 ASP A 119 -13.840 -10.439 -10.571 1.00 0.00 O ATOM 0 H ASP A 119 -10.992 -9.216 -7.132 1.00 0.00 H new ATOM 0 HA ASP A 119 -12.613 -11.640 -7.029 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -13.716 -9.586 -7.604 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -12.535 -9.222 -8.847 1.00 0.00 H new ATOM 1642 N LYS A 120 -10.372 -10.973 -9.372 1.00 0.00 N ATOM 1643 CA LYS A 120 -9.383 -11.544 -10.271 1.00 0.00 C ATOM 1644 C LYS A 120 -8.497 -10.447 -10.842 1.00 0.00 C ATOM 1645 O LYS A 120 -8.264 -10.376 -12.049 1.00 0.00 O ATOM 1646 CB LYS A 120 -10.029 -12.350 -11.407 1.00 0.00 C ATOM 1647 CG LYS A 120 -9.646 -13.827 -11.396 1.00 0.00 C ATOM 1648 CD LYS A 120 -8.223 -14.045 -10.884 1.00 0.00 C ATOM 1649 CE LYS A 120 -8.207 -14.547 -9.444 1.00 0.00 C ATOM 1650 NZ LYS A 120 -7.107 -13.932 -8.651 1.00 0.00 N ATOM 0 H LYS A 120 -10.345 -9.954 -9.325 1.00 0.00 H new ATOM 0 HA LYS A 120 -8.774 -12.235 -9.688 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -11.113 -12.263 -11.333 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -9.738 -11.914 -12.363 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -10.346 -14.378 -10.768 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -9.735 -14.232 -12.404 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -7.713 -14.764 -11.525 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -7.667 -13.110 -10.949 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -9.163 -14.323 -8.971 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -8.095 -15.631 -9.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -6.682 -14.651 -8.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -6.382 -13.558 -9.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -7.488 -13.157 -8.072 1.00 0.00 H new ATOM 1664 N GLU A 121 -8.002 -9.593 -9.961 1.00 0.00 N ATOM 1665 CA GLU A 121 -7.077 -8.547 -10.354 1.00 0.00 C ATOM 1666 C GLU A 121 -5.659 -9.013 -10.072 1.00 0.00 C ATOM 1667 O GLU A 121 -4.788 -8.933 -10.940 1.00 0.00 O ATOM 1668 CB GLU A 121 -7.378 -7.232 -9.619 1.00 0.00 C ATOM 1669 CG GLU A 121 -7.897 -7.413 -8.198 1.00 0.00 C ATOM 1670 CD GLU A 121 -9.332 -6.959 -8.036 1.00 0.00 C ATOM 1671 OE1 GLU A 121 -9.584 -5.738 -8.099 1.00 0.00 O ATOM 1672 OE2 GLU A 121 -10.222 -7.813 -7.837 1.00 0.00 O ATOM 0 H GLU A 121 -8.227 -9.605 -8.966 1.00 0.00 H new ATOM 0 HA GLU A 121 -7.191 -8.351 -11.420 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -6.469 -6.631 -9.588 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -8.114 -6.669 -10.193 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -7.819 -8.464 -7.919 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -7.263 -6.853 -7.510 1.00 0.00 H new ATOM 1679 N ASP A 122 -5.465 -9.545 -8.861 1.00 0.00 N ATOM 1680 CA ASP A 122 -4.188 -10.119 -8.419 1.00 0.00 C ATOM 1681 C ASP A 122 -3.071 -9.076 -8.344 1.00 0.00 C ATOM 1682 O ASP A 122 -2.635 -8.698 -7.260 1.00 0.00 O ATOM 1683 CB ASP A 122 -3.768 -11.270 -9.338 1.00 0.00 C ATOM 1684 CG ASP A 122 -2.388 -11.806 -9.015 1.00 0.00 C ATOM 1685 OD1 ASP A 122 -2.186 -12.306 -7.890 1.00 0.00 O ATOM 1686 OD2 ASP A 122 -1.501 -11.734 -9.893 1.00 0.00 O ATOM 0 H ASP A 122 -6.197 -9.590 -8.152 1.00 0.00 H new ATOM 0 HA ASP A 122 -4.347 -10.499 -7.410 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -4.495 -12.078 -9.256 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -3.787 -10.928 -10.373 1.00 0.00 H new ATOM 1691 N SER A 123 -2.617 -8.607 -9.495 1.00 0.00 N ATOM 1692 CA SER A 123 -1.486 -7.705 -9.553 1.00 0.00 C ATOM 1693 C SER A 123 -1.895 -6.331 -10.079 1.00 0.00 C ATOM 1694 O SER A 123 -1.893 -6.091 -11.287 1.00 0.00 O ATOM 1695 CB SER A 123 -0.389 -8.305 -10.438 1.00 0.00 C ATOM 1696 OG SER A 123 0.028 -9.576 -9.956 1.00 0.00 O ATOM 0 H SER A 123 -3.019 -8.839 -10.403 1.00 0.00 H new ATOM 0 HA SER A 123 -1.104 -7.573 -8.541 1.00 0.00 H new ATOM 0 HB2 SER A 123 -0.757 -8.404 -11.459 1.00 0.00 H new ATOM 0 HB3 SER A 123 0.465 -7.628 -10.471 1.00 0.00 H new ATOM 0 HG SER A 123 -0.635 -10.254 -10.205 1.00 0.00 H new ATOM 1702 N ASP A 124 -2.244 -5.426 -9.168 1.00 0.00 N ATOM 1703 CA ASP A 124 -2.531 -4.040 -9.538 1.00 0.00 C ATOM 1704 C ASP A 124 -1.234 -3.236 -9.525 1.00 0.00 C ATOM 1705 O ASP A 124 -1.177 -2.099 -9.050 1.00 0.00 O ATOM 1706 CB ASP A 124 -3.557 -3.418 -8.583 1.00 0.00 C ATOM 1707 CG ASP A 124 -4.295 -2.238 -9.201 1.00 0.00 C ATOM 1708 OD1 ASP A 124 -4.262 -2.084 -10.439 1.00 0.00 O ATOM 1709 OD2 ASP A 124 -4.917 -1.458 -8.443 1.00 0.00 O ATOM 0 H ASP A 124 -2.335 -5.625 -8.172 1.00 0.00 H new ATOM 0 HA ASP A 124 -2.958 -4.023 -10.541 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.280 -4.179 -8.287 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -3.050 -3.089 -7.676 1.00 0.00 H new ATOM 1714 N VAL A 125 -0.185 -3.866 -10.039 1.00 0.00 N ATOM 1715 CA VAL A 125 1.144 -3.278 -10.090 1.00 0.00 C ATOM 1716 C VAL A 125 1.724 -3.472 -11.483 1.00 0.00 C ATOM 1717 O VAL A 125 2.147 -4.574 -11.836 1.00 0.00 O ATOM 1718 CB VAL A 125 2.099 -3.925 -9.060 1.00 0.00 C ATOM 1719 CG1 VAL A 125 3.434 -3.194 -9.028 1.00 0.00 C ATOM 1720 CG2 VAL A 125 1.475 -3.953 -7.674 1.00 0.00 C ATOM 0 H VAL A 125 -0.235 -4.805 -10.434 1.00 0.00 H new ATOM 0 HA VAL A 125 1.049 -2.219 -9.851 1.00 0.00 H new ATOM 0 HB VAL A 125 2.276 -4.954 -9.372 1.00 0.00 H new ATOM 0 HG11 VAL A 125 4.090 -3.666 -8.297 1.00 0.00 H new ATOM 0 HG12 VAL A 125 3.897 -3.239 -10.014 1.00 0.00 H new ATOM 0 HG13 VAL A 125 3.272 -2.152 -8.751 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.170 -4.413 -6.971 1.00 0.00 H new ATOM 0 HG22 VAL A 125 1.256 -2.935 -7.353 1.00 0.00 H new ATOM 0 HG23 VAL A 125 0.551 -4.531 -7.702 1.00 0.00 H new ATOM 1730 N LEU A 126 1.734 -2.412 -12.271 1.00 0.00 N ATOM 1731 CA LEU A 126 2.209 -2.492 -13.641 1.00 0.00 C ATOM 1732 C LEU A 126 2.913 -1.204 -14.037 1.00 0.00 C ATOM 1733 O LEU A 126 2.955 -0.251 -13.259 1.00 0.00 O ATOM 1734 CB LEU A 126 1.039 -2.769 -14.587 1.00 0.00 C ATOM 1735 CG LEU A 126 1.316 -3.809 -15.672 1.00 0.00 C ATOM 1736 CD1 LEU A 126 0.793 -5.172 -15.255 1.00 0.00 C ATOM 1737 CD2 LEU A 126 0.697 -3.377 -16.988 1.00 0.00 C ATOM 0 H LEU A 126 1.418 -1.485 -11.986 1.00 0.00 H new ATOM 0 HA LEU A 126 2.924 -3.312 -13.714 1.00 0.00 H new ATOM 0 HB2 LEU A 126 0.185 -3.101 -13.997 1.00 0.00 H new ATOM 0 HB3 LEU A 126 0.750 -1.834 -15.067 1.00 0.00 H new ATOM 0 HG LEU A 126 2.395 -3.887 -15.807 1.00 0.00 H new ATOM 0 HD11 LEU A 126 1.000 -5.898 -16.042 1.00 0.00 H new ATOM 0 HD12 LEU A 126 1.285 -5.484 -14.334 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -0.283 -5.114 -15.090 1.00 0.00 H new ATOM 0 HD21 LEU A 126 0.903 -4.128 -17.751 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.381 -3.270 -16.865 1.00 0.00 H new ATOM 0 HD23 LEU A 126 1.124 -2.422 -17.295 1.00 0.00 H new ATOM 1749 N THR A 127 3.466 -1.192 -15.247 1.00 0.00 N ATOM 1750 CA THR A 127 4.174 -0.029 -15.769 1.00 0.00 C ATOM 1751 C THR A 127 5.346 0.354 -14.852 1.00 0.00 C ATOM 1752 O THR A 127 6.063 -0.522 -14.362 1.00 0.00 O ATOM 1753 CB THR A 127 3.212 1.168 -15.962 1.00 0.00 C ATOM 1754 OG1 THR A 127 1.879 0.690 -16.200 1.00 0.00 O ATOM 1755 CG2 THR A 127 3.650 2.037 -17.133 1.00 0.00 C ATOM 0 H THR A 127 3.436 -1.984 -15.889 1.00 0.00 H new ATOM 0 HA THR A 127 4.579 -0.294 -16.746 1.00 0.00 H new ATOM 0 HB THR A 127 3.233 1.769 -15.053 1.00 0.00 H new ATOM 0 HG1 THR A 127 1.275 1.452 -16.320 1.00 0.00 H new ATOM 0 HG21 THR A 127 2.957 2.871 -17.247 1.00 0.00 H new ATOM 0 HG22 THR A 127 4.653 2.421 -16.946 1.00 0.00 H new ATOM 0 HG23 THR A 127 3.654 1.442 -18.046 1.00 0.00 H new ATOM 1763 N LYS A 128 5.546 1.648 -14.631 1.00 0.00 N ATOM 1764 CA LYS A 128 6.633 2.128 -13.786 1.00 0.00 C ATOM 1765 C LYS A 128 6.232 3.440 -13.126 1.00 0.00 C ATOM 1766 O LYS A 128 5.277 4.085 -13.557 1.00 0.00 O ATOM 1767 CB LYS A 128 7.928 2.324 -14.593 1.00 0.00 C ATOM 1768 CG LYS A 128 7.756 2.209 -16.101 1.00 0.00 C ATOM 1769 CD LYS A 128 8.931 1.484 -16.744 1.00 0.00 C ATOM 1770 CE LYS A 128 9.033 0.041 -16.275 1.00 0.00 C ATOM 1771 NZ LYS A 128 8.404 -0.908 -17.233 1.00 0.00 N ATOM 0 H LYS A 128 4.966 2.387 -15.028 1.00 0.00 H new ATOM 0 HA LYS A 128 6.824 1.375 -13.021 1.00 0.00 H new ATOM 0 HB2 LYS A 128 8.340 3.306 -14.361 1.00 0.00 H new ATOM 0 HB3 LYS A 128 8.660 1.585 -14.266 1.00 0.00 H new ATOM 0 HG2 LYS A 128 6.832 1.675 -16.323 1.00 0.00 H new ATOM 0 HG3 LYS A 128 7.661 3.205 -16.534 1.00 0.00 H new ATOM 0 HD2 LYS A 128 8.822 1.506 -17.828 1.00 0.00 H new ATOM 0 HD3 LYS A 128 9.856 2.009 -16.506 1.00 0.00 H new ATOM 0 HE2 LYS A 128 10.082 -0.222 -16.142 1.00 0.00 H new ATOM 0 HE3 LYS A 128 8.553 -0.057 -15.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 8.498 -1.879 -16.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 7.396 -0.675 -17.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 8.878 -0.835 -18.156 1.00 0.00 H new ATOM 1785 N CYS A 129 6.960 3.831 -12.093 1.00 0.00 N ATOM 1786 CA CYS A 129 6.658 5.056 -11.371 1.00 0.00 C ATOM 1787 C CYS A 129 7.882 5.966 -11.327 1.00 0.00 C ATOM 1788 O CYS A 129 8.906 5.616 -10.739 1.00 0.00 O ATOM 1789 CB CYS A 129 6.182 4.736 -9.953 1.00 0.00 C ATOM 1790 SG CYS A 129 4.373 4.824 -9.732 1.00 0.00 S ATOM 0 H CYS A 129 7.765 3.317 -11.735 1.00 0.00 H new ATOM 0 HA CYS A 129 5.858 5.577 -11.897 1.00 0.00 H new ATOM 0 HB2 CYS A 129 6.521 3.735 -9.685 1.00 0.00 H new ATOM 0 HB3 CYS A 129 6.656 5.429 -9.258 1.00 0.00 H new ATOM 1795 N PRO A 130 7.792 7.140 -11.967 1.00 0.00 N ATOM 1796 CA PRO A 130 8.891 8.104 -12.031 1.00 0.00 C ATOM 1797 C PRO A 130 9.098 8.834 -10.705 1.00 0.00 C ATOM 1798 O PRO A 130 8.803 10.024 -10.583 1.00 0.00 O ATOM 1799 CB PRO A 130 8.455 9.095 -13.124 1.00 0.00 C ATOM 1800 CG PRO A 130 7.221 8.512 -13.737 1.00 0.00 C ATOM 1801 CD PRO A 130 6.615 7.621 -12.694 1.00 0.00 C ATOM 0 HA PRO A 130 9.841 7.614 -12.244 1.00 0.00 H new ATOM 0 HB2 PRO A 130 8.254 10.079 -12.701 1.00 0.00 H new ATOM 0 HB3 PRO A 130 9.239 9.223 -13.870 1.00 0.00 H new ATOM 0 HG2 PRO A 130 6.524 9.297 -14.030 1.00 0.00 H new ATOM 0 HG3 PRO A 130 7.463 7.948 -14.638 1.00 0.00 H new ATOM 0 HD2 PRO A 130 5.930 8.165 -12.043 1.00 0.00 H new ATOM 0 HD3 PRO A 130 6.050 6.802 -13.138 1.00 0.00 H new ATOM 1809 N VAL A 131 9.591 8.110 -9.709 1.00 0.00 N ATOM 1810 CA VAL A 131 9.897 8.695 -8.411 1.00 0.00 C ATOM 1811 C VAL A 131 11.318 8.337 -8.006 1.00 0.00 C ATOM 1812 O VAL A 131 11.782 7.240 -8.382 1.00 0.00 O ATOM 1813 CB VAL A 131 8.929 8.226 -7.297 1.00 0.00 C ATOM 1814 CG1 VAL A 131 8.620 9.372 -6.349 1.00 0.00 C ATOM 1815 CG2 VAL A 131 7.644 7.656 -7.878 1.00 0.00 C ATOM 1816 OXT VAL A 131 11.973 9.155 -7.332 1.00 0.00 O ATOM 0 H VAL A 131 9.788 7.112 -9.776 1.00 0.00 H new ATOM 0 HA VAL A 131 9.783 9.774 -8.519 1.00 0.00 H new ATOM 0 HB VAL A 131 9.423 7.430 -6.740 1.00 0.00 H new ATOM 0 HG11 VAL A 131 7.938 9.027 -5.571 1.00 0.00 H new ATOM 0 HG12 VAL A 131 9.544 9.725 -5.891 1.00 0.00 H new ATOM 0 HG13 VAL A 131 8.155 10.187 -6.903 1.00 0.00 H new ATOM 0 HG21 VAL A 131 6.988 7.337 -7.068 1.00 0.00 H new ATOM 0 HG22 VAL A 131 7.142 8.421 -8.471 1.00 0.00 H new ATOM 0 HG23 VAL A 131 7.879 6.801 -8.512 1.00 0.00 H new TER 1826 VAL A 131