USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1106 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 16 THR OG1 : rot -79:sc= 0.677 USER MOD Set 1.2: A 31 HIS : no HD1:sc= -0.0258 X(o=1.3,f=1.3) USER MOD Set 1.3: A 128 THR OG1 : rot 180:sc= 0.607 USER MOD Set 2.1: A 8 SER OG : rot 6:sc= 0.0316 USER MOD Set 2.2: A 12 GLN : amide:sc= -0.0223 K(o=0.0094,f=-1.5) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0656 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 GLN :FLIP amide:sc= -0.968 F(o=-2.5!,f=-0.97) USER MOD Single : A 19 HIS : no HD1:sc= -6.2! C(o=-6.2!,f=-14!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0.0135 USER MOD Single : A 22 GLN : amide:sc= -0.109 X(o=-0.11,f=-0.032) USER MOD Single : A 24 ASN : amide:sc= -5.3! C(o=-5.3!,f=-6.5!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 CYS SG : rot -170:sc= -0.211 USER MOD Single : A 35 ASN : amide:sc= -0.0626 K(o=-0.063,f=-1.7!) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 MET CE :methyl -137:sc= -3.27! (180deg=-4.22!) USER MOD Single : A 51 TYR OH : rot 180:sc= -0.158 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 170:sc= -2.45 (180deg=-2.74) USER MOD Single : A 64 THR OG1 : rot 131:sc= 1.78 USER MOD Single : A 65 HIS : no HD1:sc= -0.13 X(o=-0.13,f=-0.13) USER MOD Single : A 67 SER OG : rot -140:sc= -1.01 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ -167:sc=-0.000389 (180deg=-0.105) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN :FLIP amide:sc= -2.42! C(o=-3.2!,f=-2.4!) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= -0.189 USER MOD Single : A 82 SER OG : rot 43:sc= 0.669 USER MOD Single : A 84 SER OG : rot 180:sc= 0.00872 USER MOD Single : A 89 GLN : amide:sc= -5.11! C(o=-5.1!,f=-4.7!) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.025 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN :FLIP amide:sc= -4.11! C(o=-6.7!,f=-4.1!) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0211) USER MOD Single : A 108 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0193) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 158:sc= 1.28 (180deg=1.15) USER MOD Single : A 129 GLN : amide:sc= -0.359 X(o=-0.36,f=-0.11) USER MOD Single : A 131 TYR OH : rot 150:sc= 0.942 USER MOD Single : A 134 THR OG1 : rot -13:sc= 0.0654 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 35:sc= 0.792 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 15.560 -6.093 8.736 1.00 0.00 N ATOM 2 CA GLY A 1 14.806 -4.918 8.339 1.00 0.00 C ATOM 3 C GLY A 1 14.893 -3.801 9.361 1.00 0.00 C ATOM 4 O GLY A 1 15.986 -3.397 9.757 1.00 0.00 O ATOM 0 H1 GLY A 1 15.469 -6.827 8.005 1.00 0.00 H new ATOM 0 H2 GLY A 1 16.562 -5.840 8.850 1.00 0.00 H new ATOM 0 H3 GLY A 1 15.190 -6.455 9.638 1.00 0.00 H new ATOM 0 HA2 GLY A 1 15.178 -4.558 7.380 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.761 -5.193 8.193 1.00 0.00 H new ATOM 8 N SER A 2 13.739 -3.300 9.787 1.00 0.00 N ATOM 9 CA SER A 2 13.689 -2.219 10.765 1.00 0.00 C ATOM 10 C SER A 2 14.622 -1.080 10.363 1.00 0.00 C ATOM 11 O SER A 2 15.388 -0.573 11.182 1.00 0.00 O ATOM 12 CB SER A 2 14.069 -2.740 12.152 1.00 0.00 C ATOM 13 OG SER A 2 13.060 -3.587 12.673 1.00 0.00 O ATOM 0 H SER A 2 12.825 -3.625 9.471 1.00 0.00 H new ATOM 0 HA SER A 2 12.669 -1.836 10.796 1.00 0.00 H new ATOM 0 HB2 SER A 2 15.011 -3.285 12.094 1.00 0.00 H new ATOM 0 HB3 SER A 2 14.228 -1.900 12.828 1.00 0.00 H new ATOM 0 HG SER A 2 13.328 -3.908 13.559 1.00 0.00 H new ATOM 19 N SER A 3 14.550 -0.684 9.097 1.00 0.00 N ATOM 20 CA SER A 3 15.389 0.393 8.584 1.00 0.00 C ATOM 21 C SER A 3 14.651 1.727 8.630 1.00 0.00 C ATOM 22 O SER A 3 15.198 2.737 9.070 1.00 0.00 O ATOM 23 CB SER A 3 15.826 0.088 7.150 1.00 0.00 C ATOM 24 OG SER A 3 14.710 0.033 6.278 1.00 0.00 O ATOM 0 H SER A 3 13.919 -1.092 8.407 1.00 0.00 H new ATOM 0 HA SER A 3 16.272 0.465 9.218 1.00 0.00 H new ATOM 0 HB2 SER A 3 16.522 0.854 6.808 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.360 -0.862 7.123 1.00 0.00 H new ATOM 0 HG SER A 3 15.016 -0.162 5.367 1.00 0.00 H new ATOM 30 N GLY A 4 13.403 1.722 8.172 1.00 0.00 N ATOM 31 CA GLY A 4 12.609 2.937 8.169 1.00 0.00 C ATOM 32 C GLY A 4 12.824 3.767 6.919 1.00 0.00 C ATOM 33 O GLY A 4 13.952 4.146 6.604 1.00 0.00 O ATOM 0 H GLY A 4 12.928 0.898 7.803 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.554 2.678 8.252 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.861 3.534 9.046 1.00 0.00 H new ATOM 37 N SER A 5 11.740 4.049 6.204 1.00 0.00 N ATOM 38 CA SER A 5 11.815 4.835 4.979 1.00 0.00 C ATOM 39 C SER A 5 11.442 6.291 5.243 1.00 0.00 C ATOM 40 O SER A 5 10.263 6.638 5.312 1.00 0.00 O ATOM 41 CB SER A 5 10.891 4.246 3.911 1.00 0.00 C ATOM 42 OG SER A 5 11.306 4.626 2.611 1.00 0.00 O ATOM 0 H SER A 5 10.799 3.744 6.452 1.00 0.00 H new ATOM 0 HA SER A 5 12.843 4.801 4.618 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.885 3.159 3.991 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.869 4.584 4.083 1.00 0.00 H new ATOM 0 HG SER A 5 10.700 4.235 1.947 1.00 0.00 H new ATOM 48 N SER A 6 12.456 7.138 5.390 1.00 0.00 N ATOM 49 CA SER A 6 12.236 8.556 5.650 1.00 0.00 C ATOM 50 C SER A 6 13.024 9.417 4.668 1.00 0.00 C ATOM 51 O SER A 6 14.232 9.252 4.510 1.00 0.00 O ATOM 52 CB SER A 6 12.639 8.901 7.085 1.00 0.00 C ATOM 53 OG SER A 6 12.721 10.303 7.269 1.00 0.00 O ATOM 0 H SER A 6 13.438 6.867 5.333 1.00 0.00 H new ATOM 0 HA SER A 6 11.174 8.764 5.518 1.00 0.00 H new ATOM 0 HB2 SER A 6 11.912 8.482 7.781 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.601 8.444 7.316 1.00 0.00 H new ATOM 0 HG SER A 6 12.979 10.497 8.194 1.00 0.00 H new ATOM 59 N GLY A 7 12.327 10.338 4.008 1.00 0.00 N ATOM 60 CA GLY A 7 12.976 11.213 3.049 1.00 0.00 C ATOM 61 C GLY A 7 12.464 11.006 1.637 1.00 0.00 C ATOM 62 O GLY A 7 12.775 10.001 0.998 1.00 0.00 O ATOM 0 H GLY A 7 11.325 10.493 4.121 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.816 12.251 3.342 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.052 11.038 3.072 1.00 0.00 H new ATOM 66 N SER A 8 11.676 11.958 1.150 1.00 0.00 N ATOM 67 CA SER A 8 11.115 11.873 -0.194 1.00 0.00 C ATOM 68 C SER A 8 10.451 13.189 -0.589 1.00 0.00 C ATOM 69 O SER A 8 9.468 13.623 0.012 1.00 0.00 O ATOM 70 CB SER A 8 10.100 10.732 -0.274 1.00 0.00 C ATOM 71 OG SER A 8 8.873 11.096 0.335 1.00 0.00 O ATOM 0 H SER A 8 11.411 12.797 1.665 1.00 0.00 H new ATOM 0 HA SER A 8 11.930 11.674 -0.890 1.00 0.00 H new ATOM 0 HB2 SER A 8 9.927 10.468 -1.317 1.00 0.00 H new ATOM 0 HB3 SER A 8 10.504 9.847 0.217 1.00 0.00 H new ATOM 0 HG SER A 8 8.905 12.040 0.596 1.00 0.00 H new ATOM 77 N PRO A 9 10.999 13.839 -1.626 1.00 0.00 N ATOM 78 CA PRO A 9 10.477 15.114 -2.126 1.00 0.00 C ATOM 79 C PRO A 9 9.125 14.957 -2.815 1.00 0.00 C ATOM 80 O PRO A 9 8.319 15.888 -2.843 1.00 0.00 O ATOM 81 CB PRO A 9 11.540 15.563 -3.132 1.00 0.00 C ATOM 82 CG PRO A 9 12.196 14.302 -3.578 1.00 0.00 C ATOM 83 CD PRO A 9 12.172 13.380 -2.389 1.00 0.00 C ATOM 0 HA PRO A 9 10.305 15.827 -1.320 1.00 0.00 H new ATOM 0 HB2 PRO A 9 11.091 16.094 -3.971 1.00 0.00 H new ATOM 0 HB3 PRO A 9 12.258 16.242 -2.672 1.00 0.00 H new ATOM 0 HG2 PRO A 9 11.665 13.863 -4.423 1.00 0.00 H new ATOM 0 HG3 PRO A 9 13.218 14.489 -3.906 1.00 0.00 H new ATOM 0 HD2 PRO A 9 12.072 12.337 -2.691 1.00 0.00 H new ATOM 0 HD3 PRO A 9 13.088 13.456 -1.803 1.00 0.00 H new ATOM 91 N LEU A 10 8.883 13.773 -3.368 1.00 0.00 N ATOM 92 CA LEU A 10 7.627 13.493 -4.056 1.00 0.00 C ATOM 93 C LEU A 10 6.530 13.130 -3.061 1.00 0.00 C ATOM 94 O LEU A 10 5.420 13.656 -3.125 1.00 0.00 O ATOM 95 CB LEU A 10 7.817 12.357 -5.062 1.00 0.00 C ATOM 96 CG LEU A 10 8.888 12.577 -6.130 1.00 0.00 C ATOM 97 CD1 LEU A 10 8.915 11.412 -7.107 1.00 0.00 C ATOM 98 CD2 LEU A 10 8.645 13.887 -6.866 1.00 0.00 C ATOM 0 H LEU A 10 9.539 12.992 -3.353 1.00 0.00 H new ATOM 0 HA LEU A 10 7.324 14.394 -4.589 1.00 0.00 H new ATOM 0 HB2 LEU A 10 8.063 11.449 -4.512 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.865 12.179 -5.562 1.00 0.00 H new ATOM 0 HG LEU A 10 9.859 12.634 -5.638 1.00 0.00 H new ATOM 0 HD11 LEU A 10 9.684 11.586 -7.860 1.00 0.00 H new ATOM 0 HD12 LEU A 10 9.137 10.491 -6.569 1.00 0.00 H new ATOM 0 HD13 LEU A 10 7.944 11.323 -7.594 1.00 0.00 H new ATOM 0 HD21 LEU A 10 9.417 14.028 -7.623 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.667 13.859 -7.346 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.677 14.714 -6.157 1.00 0.00 H new ATOM 110 N GLY A 11 6.850 12.226 -2.139 1.00 0.00 N ATOM 111 CA GLY A 11 5.881 11.809 -1.142 1.00 0.00 C ATOM 112 C GLY A 11 5.989 10.333 -0.811 1.00 0.00 C ATOM 113 O GLY A 11 6.845 9.632 -1.348 1.00 0.00 O ATOM 0 H GLY A 11 7.762 11.776 -2.065 1.00 0.00 H new ATOM 0 HA2 GLY A 11 6.025 12.394 -0.233 1.00 0.00 H new ATOM 0 HA3 GLY A 11 4.876 12.025 -1.504 1.00 0.00 H new ATOM 117 N GLN A 12 5.120 9.863 0.077 1.00 0.00 N ATOM 118 CA GLN A 12 5.123 8.462 0.481 1.00 0.00 C ATOM 119 C GLN A 12 3.701 7.921 0.582 1.00 0.00 C ATOM 120 O GLN A 12 2.731 8.664 0.424 1.00 0.00 O ATOM 121 CB GLN A 12 5.840 8.297 1.822 1.00 0.00 C ATOM 122 CG GLN A 12 7.310 8.682 1.777 1.00 0.00 C ATOM 123 CD GLN A 12 7.917 8.832 3.158 1.00 0.00 C ATOM 124 OE1 GLN A 12 7.235 8.666 4.169 1.00 0.00 O ATOM 125 NE2 GLN A 12 9.206 9.147 3.207 1.00 0.00 N ATOM 0 H GLN A 12 4.405 10.431 0.531 1.00 0.00 H new ATOM 0 HA GLN A 12 5.656 7.892 -0.280 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.336 8.907 2.572 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.754 7.260 2.145 1.00 0.00 H new ATOM 0 HG2 GLN A 12 7.863 7.925 1.222 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.419 9.620 1.232 1.00 0.00 H new ATOM 0 HE21 GLN A 12 9.733 9.275 2.343 1.00 0.00 H new ATOM 0 HE22 GLN A 12 9.669 9.261 4.109 1.00 0.00 H new ATOM 134 N ILE A 13 3.583 6.624 0.845 1.00 0.00 N ATOM 135 CA ILE A 13 2.279 5.984 0.967 1.00 0.00 C ATOM 136 C ILE A 13 2.364 4.721 1.817 1.00 0.00 C ATOM 137 O ILE A 13 3.235 3.877 1.605 1.00 0.00 O ATOM 138 CB ILE A 13 1.697 5.624 -0.412 1.00 0.00 C ATOM 139 CG1 ILE A 13 0.281 5.064 -0.262 1.00 0.00 C ATOM 140 CG2 ILE A 13 2.596 4.622 -1.121 1.00 0.00 C ATOM 141 CD1 ILE A 13 -0.478 4.981 -1.568 1.00 0.00 C ATOM 0 H ILE A 13 4.375 5.995 0.978 1.00 0.00 H new ATOM 0 HA ILE A 13 1.619 6.702 1.454 1.00 0.00 H new ATOM 0 HB ILE A 13 1.647 6.530 -1.017 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.337 4.069 0.180 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.277 5.691 0.434 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.171 4.377 -2.095 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.587 5.055 -1.256 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.674 3.715 -0.521 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.473 4.575 -1.385 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.566 5.977 -2.002 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.058 4.331 -2.259 1.00 0.00 H new ATOM 153 N GLN A 14 1.453 4.597 2.777 1.00 0.00 N ATOM 154 CA GLN A 14 1.425 3.435 3.657 1.00 0.00 C ATOM 155 C GLN A 14 0.383 2.424 3.191 1.00 0.00 C ATOM 156 O GLN A 14 -0.808 2.728 3.127 1.00 0.00 O ATOM 157 CB GLN A 14 1.127 3.866 5.095 1.00 0.00 C ATOM 158 CG GLN A 14 1.441 2.795 6.128 1.00 0.00 C ATOM 159 CD GLN A 14 1.545 3.354 7.533 1.00 0.00 C ATOM 160 OE1 GLN A 14 2.716 3.209 8.142 1.00 0.00 O flip ATOM 161 NE2 GLN A 14 0.584 3.909 8.066 1.00 0.00 N flip ATOM 0 H GLN A 14 0.725 5.286 2.965 1.00 0.00 H new ATOM 0 HA GLN A 14 2.406 2.960 3.622 1.00 0.00 H new ATOM 0 HB2 GLN A 14 1.705 4.761 5.325 1.00 0.00 H new ATOM 0 HB3 GLN A 14 0.074 4.137 5.174 1.00 0.00 H new ATOM 0 HG2 GLN A 14 0.664 2.031 6.101 1.00 0.00 H new ATOM 0 HG3 GLN A 14 2.379 2.306 5.865 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -0.298 3.999 7.561 1.00 0.00 H new ATOM 0 HE22 GLN A 14 0.669 4.279 9.013 1.00 0.00 H new ATOM 170 N LEU A 15 0.840 1.220 2.865 1.00 0.00 N ATOM 171 CA LEU A 15 -0.052 0.162 2.403 1.00 0.00 C ATOM 172 C LEU A 15 0.298 -1.170 3.058 1.00 0.00 C ATOM 173 O LEU A 15 1.471 -1.515 3.203 1.00 0.00 O ATOM 174 CB LEU A 15 0.025 0.031 0.881 1.00 0.00 C ATOM 175 CG LEU A 15 -0.045 1.338 0.090 1.00 0.00 C ATOM 176 CD1 LEU A 15 0.481 1.135 -1.323 1.00 0.00 C ATOM 177 CD2 LEU A 15 -1.471 1.868 0.060 1.00 0.00 C ATOM 0 H LEU A 15 1.823 0.952 2.912 1.00 0.00 H new ATOM 0 HA LEU A 15 -1.070 0.429 2.687 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.956 -0.475 0.627 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.789 -0.614 0.550 1.00 0.00 H new ATOM 0 HG LEU A 15 0.584 2.076 0.587 1.00 0.00 H new ATOM 0 HD11 LEU A 15 0.424 2.075 -1.871 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.518 0.802 -1.281 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -0.121 0.382 -1.831 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.502 2.798 -0.507 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.122 1.133 -0.413 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.812 2.053 1.079 1.00 0.00 H new ATOM 189 N THR A 16 -0.729 -1.918 3.451 1.00 0.00 N ATOM 190 CA THR A 16 -0.530 -3.213 4.090 1.00 0.00 C ATOM 191 C THR A 16 -0.836 -4.354 3.126 1.00 0.00 C ATOM 192 O THR A 16 -1.997 -4.634 2.829 1.00 0.00 O ATOM 193 CB THR A 16 -1.415 -3.364 5.342 1.00 0.00 C ATOM 194 OG1 THR A 16 -1.069 -2.366 6.309 1.00 0.00 O ATOM 195 CG2 THR A 16 -1.257 -4.747 5.953 1.00 0.00 C ATOM 0 H THR A 16 -1.706 -1.649 3.338 1.00 0.00 H new ATOM 0 HA THR A 16 0.518 -3.261 4.386 1.00 0.00 H new ATOM 0 HB THR A 16 -2.455 -3.234 5.043 1.00 0.00 H new ATOM 0 HG1 THR A 16 -0.255 -2.637 6.782 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.891 -4.830 6.835 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.549 -5.503 5.224 1.00 0.00 H new ATOM 0 HG23 THR A 16 -0.217 -4.902 6.238 1.00 0.00 H new ATOM 203 N ILE A 17 0.214 -5.009 2.641 1.00 0.00 N ATOM 204 CA ILE A 17 0.057 -6.121 1.711 1.00 0.00 C ATOM 205 C ILE A 17 0.128 -7.459 2.439 1.00 0.00 C ATOM 206 O ILE A 17 1.093 -7.740 3.149 1.00 0.00 O ATOM 207 CB ILE A 17 1.132 -6.090 0.610 1.00 0.00 C ATOM 208 CG1 ILE A 17 1.221 -4.693 -0.008 1.00 0.00 C ATOM 209 CG2 ILE A 17 0.826 -7.129 -0.459 1.00 0.00 C ATOM 210 CD1 ILE A 17 2.460 -4.482 -0.850 1.00 0.00 C ATOM 0 H ILE A 17 1.182 -4.789 2.876 1.00 0.00 H new ATOM 0 HA ILE A 17 -0.925 -6.012 1.251 1.00 0.00 H new ATOM 0 HB ILE A 17 2.096 -6.331 1.058 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.339 -4.521 -0.625 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.203 -3.950 0.789 1.00 0.00 H new ATOM 0 HG21 ILE A 17 1.595 -7.095 -1.231 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.809 -8.121 -0.008 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -0.145 -6.916 -0.905 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.456 -3.470 -1.256 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.347 -4.622 -0.233 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.470 -5.201 -1.669 1.00 0.00 H new ATOM 222 N ARG A 18 -0.899 -8.282 2.255 1.00 0.00 N ATOM 223 CA ARG A 18 -0.953 -9.592 2.892 1.00 0.00 C ATOM 224 C ARG A 18 -1.849 -10.543 2.106 1.00 0.00 C ATOM 225 O ARG A 18 -3.069 -10.376 2.068 1.00 0.00 O ATOM 226 CB ARG A 18 -1.464 -9.463 4.329 1.00 0.00 C ATOM 227 CG ARG A 18 -1.733 -10.799 5.002 1.00 0.00 C ATOM 228 CD ARG A 18 -2.695 -10.650 6.170 1.00 0.00 C ATOM 229 NE ARG A 18 -3.197 -11.941 6.634 1.00 0.00 N ATOM 230 CZ ARG A 18 -3.965 -12.088 7.707 1.00 0.00 C ATOM 231 NH1 ARG A 18 -4.319 -11.029 8.423 1.00 0.00 N ATOM 232 NH2 ARG A 18 -4.382 -13.295 8.066 1.00 0.00 N ATOM 0 H ARG A 18 -1.705 -8.064 1.670 1.00 0.00 H new ATOM 0 HA ARG A 18 0.057 -10.002 2.908 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -0.732 -8.910 4.918 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -2.382 -8.875 4.328 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -2.147 -11.497 4.275 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -0.794 -11.226 5.355 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -2.192 -10.140 6.992 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -3.534 -10.021 5.871 1.00 0.00 H new ATOM 0 HE ARG A 18 -2.944 -12.775 6.105 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -4.001 -10.099 8.150 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -4.909 -11.145 9.247 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -4.113 -14.112 7.517 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -4.972 -13.406 8.891 1.00 0.00 H new ATOM 246 N HIS A 19 -1.237 -11.542 1.478 1.00 0.00 N ATOM 247 CA HIS A 19 -1.980 -12.521 0.691 1.00 0.00 C ATOM 248 C HIS A 19 -2.232 -13.789 1.501 1.00 0.00 C ATOM 249 O HIS A 19 -1.299 -14.518 1.838 1.00 0.00 O ATOM 250 CB HIS A 19 -1.217 -12.862 -0.589 1.00 0.00 C ATOM 251 CG HIS A 19 -1.828 -13.986 -1.369 1.00 0.00 C ATOM 252 ND1 HIS A 19 -1.957 -15.265 -0.870 1.00 0.00 N ATOM 253 CD2 HIS A 19 -2.349 -14.016 -2.617 1.00 0.00 C ATOM 254 CE1 HIS A 19 -2.529 -16.034 -1.780 1.00 0.00 C ATOM 255 NE2 HIS A 19 -2.777 -15.299 -2.849 1.00 0.00 N ATOM 0 H HIS A 19 -0.229 -11.695 1.499 1.00 0.00 H new ATOM 0 HA HIS A 19 -2.942 -12.083 0.425 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -1.170 -11.975 -1.221 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -0.191 -13.125 -0.332 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -2.416 -13.185 -3.303 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -2.755 -17.084 -1.669 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -3.216 -15.631 -3.708 1.00 0.00 H new ATOM 263 N SER A 20 -3.499 -14.046 1.810 1.00 0.00 N ATOM 264 CA SER A 20 -3.874 -15.223 2.584 1.00 0.00 C ATOM 265 C SER A 20 -3.904 -16.467 1.700 1.00 0.00 C ATOM 266 O SER A 20 -4.488 -16.459 0.617 1.00 0.00 O ATOM 267 CB SER A 20 -5.242 -15.016 3.238 1.00 0.00 C ATOM 268 OG SER A 20 -5.463 -15.963 4.268 1.00 0.00 O ATOM 0 H SER A 20 -4.283 -13.454 1.536 1.00 0.00 H new ATOM 0 HA SER A 20 -3.125 -15.369 3.363 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.304 -14.008 3.647 1.00 0.00 H new ATOM 0 HB3 SER A 20 -6.025 -15.103 2.485 1.00 0.00 H new ATOM 0 HG SER A 20 -6.343 -15.809 4.671 1.00 0.00 H new ATOM 274 N SER A 21 -3.269 -17.535 2.172 1.00 0.00 N ATOM 275 CA SER A 21 -3.218 -18.786 1.424 1.00 0.00 C ATOM 276 C SER A 21 -4.546 -19.530 1.520 1.00 0.00 C ATOM 277 O SER A 21 -4.936 -20.246 0.598 1.00 0.00 O ATOM 278 CB SER A 21 -2.086 -19.672 1.948 1.00 0.00 C ATOM 279 OG SER A 21 -2.116 -19.757 3.362 1.00 0.00 O ATOM 0 H SER A 21 -2.783 -17.559 3.068 1.00 0.00 H new ATOM 0 HA SER A 21 -3.029 -18.548 0.377 1.00 0.00 H new ATOM 0 HB2 SER A 21 -2.173 -20.670 1.519 1.00 0.00 H new ATOM 0 HB3 SER A 21 -1.126 -19.269 1.625 1.00 0.00 H new ATOM 0 HG SER A 21 -1.384 -20.330 3.671 1.00 0.00 H new ATOM 285 N GLN A 22 -5.236 -19.355 2.643 1.00 0.00 N ATOM 286 CA GLN A 22 -6.520 -20.010 2.860 1.00 0.00 C ATOM 287 C GLN A 22 -7.613 -19.359 2.018 1.00 0.00 C ATOM 288 O GLN A 22 -8.383 -20.044 1.345 1.00 0.00 O ATOM 289 CB GLN A 22 -6.901 -19.957 4.340 1.00 0.00 C ATOM 290 CG GLN A 22 -8.200 -20.677 4.661 1.00 0.00 C ATOM 291 CD GLN A 22 -8.096 -22.178 4.478 1.00 0.00 C ATOM 292 OE1 GLN A 22 -7.783 -22.910 5.418 1.00 0.00 O ATOM 293 NE2 GLN A 22 -8.358 -22.647 3.263 1.00 0.00 N ATOM 0 H GLN A 22 -4.927 -18.765 3.416 1.00 0.00 H new ATOM 0 HA GLN A 22 -6.423 -21.052 2.555 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -6.097 -20.397 4.929 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -6.988 -18.915 4.647 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -8.487 -20.459 5.690 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -8.993 -20.291 4.020 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -8.614 -22.005 2.513 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -8.304 -23.649 3.080 1.00 0.00 H new ATOM 302 N ARG A 23 -7.674 -18.032 2.061 1.00 0.00 N ATOM 303 CA ARG A 23 -8.674 -17.288 1.304 1.00 0.00 C ATOM 304 C ARG A 23 -8.171 -16.980 -0.103 1.00 0.00 C ATOM 305 O ARG A 23 -8.939 -16.566 -0.971 1.00 0.00 O ATOM 306 CB ARG A 23 -9.029 -15.988 2.027 1.00 0.00 C ATOM 307 CG ARG A 23 -10.184 -16.130 3.004 1.00 0.00 C ATOM 308 CD ARG A 23 -11.521 -15.866 2.328 1.00 0.00 C ATOM 309 NE ARG A 23 -11.766 -14.439 2.139 1.00 0.00 N ATOM 310 CZ ARG A 23 -12.245 -13.643 3.089 1.00 0.00 C ATOM 311 NH1 ARG A 23 -12.527 -14.133 4.289 1.00 0.00 N ATOM 312 NH2 ARG A 23 -12.441 -12.355 2.841 1.00 0.00 N ATOM 0 H ARG A 23 -7.043 -17.450 2.612 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.568 -17.906 1.225 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -8.151 -15.630 2.565 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -9.281 -15.228 1.287 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -10.182 -17.134 3.429 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -10.050 -15.434 3.832 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -11.544 -16.369 1.361 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -12.322 -16.295 2.930 1.00 0.00 H new ATOM 0 HE ARG A 23 -11.558 -14.031 1.228 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -12.376 -15.123 4.484 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -12.895 -13.520 5.017 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -12.224 -11.974 1.920 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -12.809 -11.745 3.571 1.00 0.00 H new ATOM 326 N ASN A 24 -6.876 -17.184 -0.321 1.00 0.00 N ATOM 327 CA ASN A 24 -6.270 -16.926 -1.623 1.00 0.00 C ATOM 328 C ASN A 24 -6.713 -15.573 -2.171 1.00 0.00 C ATOM 329 O ASN A 24 -7.159 -15.470 -3.314 1.00 0.00 O ATOM 330 CB ASN A 24 -6.640 -18.035 -2.609 1.00 0.00 C ATOM 331 CG ASN A 24 -8.138 -18.156 -2.808 1.00 0.00 C ATOM 332 OD1 ASN A 24 -8.833 -18.789 -2.013 1.00 0.00 O ATOM 333 ND2 ASN A 24 -8.644 -17.546 -3.874 1.00 0.00 N ATOM 0 H ASN A 24 -6.226 -17.527 0.386 1.00 0.00 H new ATOM 0 HA ASN A 24 -5.188 -16.909 -1.496 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -6.164 -17.837 -3.569 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -6.246 -18.985 -2.247 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -9.646 -17.591 -4.060 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -8.031 -17.032 -4.507 1.00 0.00 H new ATOM 340 N LYS A 25 -6.588 -14.538 -1.348 1.00 0.00 N ATOM 341 CA LYS A 25 -6.973 -13.190 -1.749 1.00 0.00 C ATOM 342 C LYS A 25 -5.896 -12.180 -1.368 1.00 0.00 C ATOM 343 O LYS A 25 -5.172 -12.369 -0.390 1.00 0.00 O ATOM 344 CB LYS A 25 -8.303 -12.803 -1.099 1.00 0.00 C ATOM 345 CG LYS A 25 -9.496 -13.558 -1.658 1.00 0.00 C ATOM 346 CD LYS A 25 -10.773 -12.741 -1.554 1.00 0.00 C ATOM 347 CE LYS A 25 -11.999 -13.634 -1.443 1.00 0.00 C ATOM 348 NZ LYS A 25 -12.371 -14.231 -2.756 1.00 0.00 N ATOM 0 H LYS A 25 -6.223 -14.607 -0.398 1.00 0.00 H new ATOM 0 HA LYS A 25 -7.088 -13.180 -2.833 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.240 -12.984 -0.026 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.465 -11.734 -1.233 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.310 -13.812 -2.701 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.619 -14.497 -1.118 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.718 -12.087 -0.684 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.868 -12.099 -2.430 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.805 -14.430 -0.724 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.837 -13.054 -1.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.211 -14.833 -2.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.581 -13.472 -3.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -11.581 -14.806 -3.112 1.00 0.00 H new ATOM 362 N LEU A 26 -5.796 -11.107 -2.145 1.00 0.00 N ATOM 363 CA LEU A 26 -4.807 -10.065 -1.888 1.00 0.00 C ATOM 364 C LEU A 26 -5.467 -8.822 -1.300 1.00 0.00 C ATOM 365 O LEU A 26 -6.157 -8.083 -2.003 1.00 0.00 O ATOM 366 CB LEU A 26 -4.070 -9.704 -3.179 1.00 0.00 C ATOM 367 CG LEU A 26 -2.978 -8.641 -3.054 1.00 0.00 C ATOM 368 CD1 LEU A 26 -1.725 -9.235 -2.429 1.00 0.00 C ATOM 369 CD2 LEU A 26 -2.663 -8.037 -4.414 1.00 0.00 C ATOM 0 H LEU A 26 -6.387 -10.935 -2.958 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.089 -10.450 -1.164 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.621 -10.611 -3.583 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -4.803 -9.359 -3.908 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.343 -7.847 -2.403 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.958 -8.464 -2.348 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.960 -9.619 -1.436 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.357 -10.048 -3.054 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.884 -7.283 -4.305 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.318 -8.820 -5.089 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.561 -7.575 -4.824 1.00 0.00 H new ATOM 381 N ILE A 27 -5.248 -8.597 -0.009 1.00 0.00 N ATOM 382 CA ILE A 27 -5.818 -7.441 0.672 1.00 0.00 C ATOM 383 C ILE A 27 -4.823 -6.287 0.724 1.00 0.00 C ATOM 384 O ILE A 27 -3.695 -6.447 1.191 1.00 0.00 O ATOM 385 CB ILE A 27 -6.256 -7.792 2.106 1.00 0.00 C ATOM 386 CG1 ILE A 27 -7.442 -8.758 2.079 1.00 0.00 C ATOM 387 CG2 ILE A 27 -6.611 -6.529 2.875 1.00 0.00 C ATOM 388 CD1 ILE A 27 -7.036 -10.214 2.039 1.00 0.00 C ATOM 0 H ILE A 27 -4.680 -9.200 0.586 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.693 -7.137 0.098 1.00 0.00 H new ATOM 0 HB ILE A 27 -5.425 -8.282 2.614 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -8.060 -8.586 2.960 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -8.060 -8.538 1.208 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -6.919 -6.793 3.887 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -5.741 -5.874 2.920 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -7.428 -6.013 2.370 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -7.928 -10.840 2.021 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -6.443 -10.402 1.144 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.444 -10.451 2.923 1.00 0.00 H new ATOM 400 N VAL A 28 -5.248 -5.124 0.243 1.00 0.00 N ATOM 401 CA VAL A 28 -4.396 -3.941 0.237 1.00 0.00 C ATOM 402 C VAL A 28 -5.106 -2.748 0.867 1.00 0.00 C ATOM 403 O VAL A 28 -6.016 -2.169 0.274 1.00 0.00 O ATOM 404 CB VAL A 28 -3.962 -3.569 -1.193 1.00 0.00 C ATOM 405 CG1 VAL A 28 -2.990 -2.399 -1.169 1.00 0.00 C ATOM 406 CG2 VAL A 28 -3.345 -4.771 -1.892 1.00 0.00 C ATOM 0 H VAL A 28 -6.178 -4.975 -0.148 1.00 0.00 H new ATOM 0 HA VAL A 28 -3.512 -4.186 0.825 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.845 -3.265 -1.755 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.694 -2.151 -2.188 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.471 -1.535 -0.710 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.107 -2.672 -0.591 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.044 -4.490 -2.901 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.472 -5.108 -1.334 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.077 -5.577 -1.943 1.00 0.00 H new ATOM 416 N VAL A 29 -4.684 -2.386 2.074 1.00 0.00 N ATOM 417 CA VAL A 29 -5.279 -1.260 2.786 1.00 0.00 C ATOM 418 C VAL A 29 -4.512 0.029 2.513 1.00 0.00 C ATOM 419 O VAL A 29 -3.281 0.039 2.492 1.00 0.00 O ATOM 420 CB VAL A 29 -5.314 -1.512 4.305 1.00 0.00 C ATOM 421 CG1 VAL A 29 -5.993 -0.355 5.022 1.00 0.00 C ATOM 422 CG2 VAL A 29 -6.017 -2.826 4.610 1.00 0.00 C ATOM 0 H VAL A 29 -3.933 -2.855 2.580 1.00 0.00 H new ATOM 0 HA VAL A 29 -6.300 -1.157 2.419 1.00 0.00 H new ATOM 0 HB VAL A 29 -4.289 -1.582 4.669 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.009 -0.550 6.094 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.443 0.566 4.829 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -7.015 -0.250 4.657 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -6.033 -2.989 5.688 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -7.039 -2.788 4.234 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -5.483 -3.645 4.127 1.00 0.00 H new ATOM 432 N VAL A 30 -5.248 1.116 2.306 1.00 0.00 N ATOM 433 CA VAL A 30 -4.638 2.413 2.036 1.00 0.00 C ATOM 434 C VAL A 30 -4.928 3.401 3.160 1.00 0.00 C ATOM 435 O VAL A 30 -5.814 4.248 3.043 1.00 0.00 O ATOM 436 CB VAL A 30 -5.140 3.003 0.705 1.00 0.00 C ATOM 437 CG1 VAL A 30 -4.510 4.365 0.454 1.00 0.00 C ATOM 438 CG2 VAL A 30 -4.847 2.051 -0.444 1.00 0.00 C ATOM 0 H VAL A 30 -6.268 1.125 2.320 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.562 2.250 1.969 1.00 0.00 H new ATOM 0 HB VAL A 30 -6.220 3.135 0.770 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.876 4.767 -0.491 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.776 5.044 1.264 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.426 4.262 0.408 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.209 2.484 -1.377 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.772 1.885 -0.514 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.350 1.101 -0.266 1.00 0.00 H new ATOM 448 N HIS A 31 -4.175 3.288 4.249 1.00 0.00 N ATOM 449 CA HIS A 31 -4.350 4.173 5.395 1.00 0.00 C ATOM 450 C HIS A 31 -4.499 5.623 4.944 1.00 0.00 C ATOM 451 O HIS A 31 -5.589 6.192 5.002 1.00 0.00 O ATOM 452 CB HIS A 31 -3.164 4.044 6.352 1.00 0.00 C ATOM 453 CG HIS A 31 -3.014 2.673 6.938 1.00 0.00 C ATOM 454 ND1 HIS A 31 -3.775 2.218 7.993 1.00 0.00 N ATOM 455 CD2 HIS A 31 -2.184 1.656 6.608 1.00 0.00 C ATOM 456 CE1 HIS A 31 -3.419 0.981 8.288 1.00 0.00 C ATOM 457 NE2 HIS A 31 -2.455 0.616 7.462 1.00 0.00 N ATOM 0 H HIS A 31 -3.438 2.592 4.362 1.00 0.00 H new ATOM 0 HA HIS A 31 -5.261 3.877 5.915 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -2.249 4.305 5.821 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -3.280 4.765 7.161 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -1.446 1.662 5.820 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -3.844 0.371 9.072 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -1.988 -0.291 7.459 1.00 0.00 H new ATOM 465 N ALA A 32 -3.397 6.214 4.496 1.00 0.00 N ATOM 466 CA ALA A 32 -3.406 7.597 4.034 1.00 0.00 C ATOM 467 C ALA A 32 -2.072 7.971 3.396 1.00 0.00 C ATOM 468 O ALA A 32 -1.069 7.281 3.581 1.00 0.00 O ATOM 469 CB ALA A 32 -3.722 8.537 5.188 1.00 0.00 C ATOM 0 H ALA A 32 -2.487 5.757 4.443 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.183 7.696 3.276 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.725 9.566 4.829 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.702 8.293 5.598 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.965 8.427 5.965 1.00 0.00 H new ATOM 475 N CYS A 33 -2.069 9.066 2.643 1.00 0.00 N ATOM 476 CA CYS A 33 -0.858 9.530 1.975 1.00 0.00 C ATOM 477 C CYS A 33 -0.420 10.884 2.525 1.00 0.00 C ATOM 478 O CYS A 33 -1.251 11.726 2.864 1.00 0.00 O ATOM 479 CB CYS A 33 -1.089 9.629 0.467 1.00 0.00 C ATOM 480 SG CYS A 33 -1.626 8.083 -0.301 1.00 0.00 S ATOM 0 H CYS A 33 -2.890 9.648 2.480 1.00 0.00 H new ATOM 0 HA CYS A 33 -0.066 8.806 2.167 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -1.838 10.397 0.275 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -0.166 9.958 -0.010 1.00 0.00 H new ATOM 0 HG CYS A 33 -1.593 8.207 -1.595 1.00 0.00 H new ATOM 486 N ARG A 34 0.891 11.085 2.611 1.00 0.00 N ATOM 487 CA ARG A 34 1.440 12.335 3.122 1.00 0.00 C ATOM 488 C ARG A 34 2.604 12.812 2.258 1.00 0.00 C ATOM 489 O ARG A 34 3.158 12.047 1.469 1.00 0.00 O ATOM 490 CB ARG A 34 1.905 12.159 4.569 1.00 0.00 C ATOM 491 CG ARG A 34 3.100 11.232 4.717 1.00 0.00 C ATOM 492 CD ARG A 34 3.409 10.949 6.178 1.00 0.00 C ATOM 493 NE ARG A 34 4.678 10.246 6.344 1.00 0.00 N ATOM 494 CZ ARG A 34 5.369 10.234 7.478 1.00 0.00 C ATOM 495 NH1 ARG A 34 4.916 10.884 8.541 1.00 0.00 N ATOM 496 NH2 ARG A 34 6.516 9.571 7.550 1.00 0.00 N ATOM 0 H ARG A 34 1.592 10.398 2.333 1.00 0.00 H new ATOM 0 HA ARG A 34 0.653 13.088 3.089 1.00 0.00 H new ATOM 0 HB2 ARG A 34 2.160 13.135 4.981 1.00 0.00 H new ATOM 0 HB3 ARG A 34 1.078 11.769 5.162 1.00 0.00 H new ATOM 0 HG2 ARG A 34 2.901 10.294 4.198 1.00 0.00 H new ATOM 0 HG3 ARG A 34 3.971 11.681 4.240 1.00 0.00 H new ATOM 0 HD2 ARG A 34 3.440 11.888 6.730 1.00 0.00 H new ATOM 0 HD3 ARG A 34 2.605 10.352 6.609 1.00 0.00 H new ATOM 0 HE ARG A 34 5.054 9.736 5.545 1.00 0.00 H new ATOM 0 HH11 ARG A 34 4.035 11.395 8.489 1.00 0.00 H new ATOM 0 HH12 ARG A 34 5.449 10.873 9.411 1.00 0.00 H new ATOM 0 HH21 ARG A 34 6.868 9.070 6.734 1.00 0.00 H new ATOM 0 HH22 ARG A 34 7.046 9.562 8.421 1.00 0.00 H new ATOM 510 N ASN A 35 2.968 14.081 2.412 1.00 0.00 N ATOM 511 CA ASN A 35 4.065 14.660 1.644 1.00 0.00 C ATOM 512 C ASN A 35 3.764 14.619 0.149 1.00 0.00 C ATOM 513 O ASN A 35 4.620 14.255 -0.658 1.00 0.00 O ATOM 514 CB ASN A 35 5.368 13.912 1.934 1.00 0.00 C ATOM 515 CG ASN A 35 5.998 14.335 3.246 1.00 0.00 C ATOM 516 OD1 ASN A 35 5.562 15.300 3.875 1.00 0.00 O ATOM 517 ND2 ASN A 35 7.032 13.614 3.666 1.00 0.00 N ATOM 0 H ASN A 35 2.520 14.728 3.061 1.00 0.00 H new ATOM 0 HA ASN A 35 4.176 15.702 1.945 1.00 0.00 H new ATOM 0 HB2 ASN A 35 5.171 12.840 1.958 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.073 14.088 1.122 1.00 0.00 H new ATOM 0 HD21 ASN A 35 7.498 13.852 4.542 1.00 0.00 H new ATOM 0 HD22 ASN A 35 7.360 12.822 3.113 1.00 0.00 H new ATOM 524 N LEU A 36 2.542 14.996 -0.213 1.00 0.00 N ATOM 525 CA LEU A 36 2.127 15.004 -1.611 1.00 0.00 C ATOM 526 C LEU A 36 2.162 16.418 -2.182 1.00 0.00 C ATOM 527 O LEU A 36 1.205 17.179 -2.040 1.00 0.00 O ATOM 528 CB LEU A 36 0.720 14.421 -1.749 1.00 0.00 C ATOM 529 CG LEU A 36 0.586 12.921 -1.488 1.00 0.00 C ATOM 530 CD1 LEU A 36 -0.865 12.483 -1.618 1.00 0.00 C ATOM 531 CD2 LEU A 36 1.470 12.132 -2.442 1.00 0.00 C ATOM 0 H LEU A 36 1.822 15.300 0.442 1.00 0.00 H new ATOM 0 HA LEU A 36 2.826 14.387 -2.175 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.060 14.949 -1.061 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.360 14.628 -2.757 1.00 0.00 H new ATOM 0 HG LEU A 36 0.915 12.719 -0.469 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.940 11.412 -1.429 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.474 13.023 -0.894 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.222 12.699 -2.625 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.361 11.066 -2.241 1.00 0.00 H new ATOM 0 HD22 LEU A 36 1.172 12.340 -3.470 1.00 0.00 H new ATOM 0 HD23 LEU A 36 2.510 12.424 -2.299 1.00 0.00 H new ATOM 543 N ILE A 37 3.271 16.762 -2.828 1.00 0.00 N ATOM 544 CA ILE A 37 3.429 18.084 -3.423 1.00 0.00 C ATOM 545 C ILE A 37 2.273 18.406 -4.362 1.00 0.00 C ATOM 546 O ILE A 37 1.852 17.565 -5.156 1.00 0.00 O ATOM 547 CB ILE A 37 4.754 18.196 -4.200 1.00 0.00 C ATOM 548 CG1 ILE A 37 4.788 17.179 -5.342 1.00 0.00 C ATOM 549 CG2 ILE A 37 5.936 17.991 -3.265 1.00 0.00 C ATOM 550 CD1 ILE A 37 4.213 17.706 -6.638 1.00 0.00 C ATOM 0 H ILE A 37 4.073 16.144 -2.953 1.00 0.00 H new ATOM 0 HA ILE A 37 3.437 18.801 -2.602 1.00 0.00 H new ATOM 0 HB ILE A 37 4.824 19.196 -4.627 1.00 0.00 H new ATOM 0 HG12 ILE A 37 5.819 16.869 -5.511 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.233 16.290 -5.043 1.00 0.00 H new ATOM 0 HG21 ILE A 37 6.865 18.073 -3.829 1.00 0.00 H new ATOM 0 HG22 ILE A 37 5.918 18.751 -2.484 1.00 0.00 H new ATOM 0 HG23 ILE A 37 5.874 17.002 -2.811 1.00 0.00 H new ATOM 0 HD11 ILE A 37 4.270 16.931 -7.403 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.172 17.989 -6.485 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.783 18.577 -6.961 1.00 0.00 H new ATOM 562 N ALA A 38 1.763 19.629 -4.267 1.00 0.00 N ATOM 563 CA ALA A 38 0.657 20.064 -5.112 1.00 0.00 C ATOM 564 C ALA A 38 1.160 20.884 -6.296 1.00 0.00 C ATOM 565 O ALA A 38 1.970 21.796 -6.133 1.00 0.00 O ATOM 566 CB ALA A 38 -0.344 20.870 -4.297 1.00 0.00 C ATOM 0 H ALA A 38 2.098 20.337 -3.613 1.00 0.00 H new ATOM 0 HA ALA A 38 0.160 19.176 -5.503 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -1.164 21.188 -4.940 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -0.735 20.253 -3.488 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.150 21.747 -3.878 1.00 0.00 H new ATOM 572 N PHE A 39 0.675 20.552 -7.487 1.00 0.00 N ATOM 573 CA PHE A 39 1.076 21.256 -8.699 1.00 0.00 C ATOM 574 C PHE A 39 0.891 22.763 -8.540 1.00 0.00 C ATOM 575 O PHE A 39 1.672 23.554 -9.068 1.00 0.00 O ATOM 576 CB PHE A 39 0.267 20.756 -9.898 1.00 0.00 C ATOM 577 CG PHE A 39 1.011 20.838 -11.200 1.00 0.00 C ATOM 578 CD1 PHE A 39 0.995 22.004 -11.949 1.00 0.00 C ATOM 579 CD2 PHE A 39 1.725 19.750 -11.675 1.00 0.00 C ATOM 580 CE1 PHE A 39 1.678 22.082 -13.148 1.00 0.00 C ATOM 581 CE2 PHE A 39 2.410 19.823 -12.873 1.00 0.00 C ATOM 582 CZ PHE A 39 2.388 20.990 -13.610 1.00 0.00 C ATOM 0 H PHE A 39 0.003 19.800 -7.639 1.00 0.00 H new ATOM 0 HA PHE A 39 2.133 21.053 -8.873 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -0.027 19.721 -9.721 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.650 21.339 -9.976 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.443 22.861 -11.592 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.747 18.834 -11.103 1.00 0.00 H new ATOM 0 HE1 PHE A 39 1.657 22.996 -13.723 1.00 0.00 H new ATOM 0 HE2 PHE A 39 2.962 18.967 -13.232 1.00 0.00 H new ATOM 0 HZ PHE A 39 2.924 21.050 -14.545 1.00 0.00 H new ATOM 592 N SER A 40 -0.149 23.151 -7.808 1.00 0.00 N ATOM 593 CA SER A 40 -0.440 24.561 -7.582 1.00 0.00 C ATOM 594 C SER A 40 -0.759 24.821 -6.113 1.00 0.00 C ATOM 595 O SER A 40 -1.697 24.249 -5.560 1.00 0.00 O ATOM 596 CB SER A 40 -1.613 25.008 -8.457 1.00 0.00 C ATOM 597 OG SER A 40 -1.917 26.376 -8.243 1.00 0.00 O ATOM 0 H SER A 40 -0.803 22.508 -7.362 1.00 0.00 H new ATOM 0 HA SER A 40 0.445 25.137 -7.851 1.00 0.00 H new ATOM 0 HB2 SER A 40 -1.370 24.846 -9.507 1.00 0.00 H new ATOM 0 HB3 SER A 40 -2.489 24.399 -8.235 1.00 0.00 H new ATOM 0 HG SER A 40 -2.669 26.637 -8.815 1.00 0.00 H new ATOM 603 N GLU A 41 0.030 25.689 -5.487 1.00 0.00 N ATOM 604 CA GLU A 41 -0.167 26.025 -4.082 1.00 0.00 C ATOM 605 C GLU A 41 -1.653 26.090 -3.742 1.00 0.00 C ATOM 606 O GLU A 41 -2.101 25.504 -2.756 1.00 0.00 O ATOM 607 CB GLU A 41 0.502 27.362 -3.755 1.00 0.00 C ATOM 608 CG GLU A 41 1.998 27.250 -3.511 1.00 0.00 C ATOM 609 CD GLU A 41 2.631 28.582 -3.157 1.00 0.00 C ATOM 610 OE1 GLU A 41 2.365 29.573 -3.869 1.00 0.00 O ATOM 611 OE2 GLU A 41 3.394 28.633 -2.170 1.00 0.00 O ATOM 0 H GLU A 41 0.811 26.172 -5.931 1.00 0.00 H new ATOM 0 HA GLU A 41 0.292 25.241 -3.480 1.00 0.00 H new ATOM 0 HB2 GLU A 41 0.327 28.057 -4.577 1.00 0.00 H new ATOM 0 HB3 GLU A 41 0.029 27.789 -2.871 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.179 26.540 -2.704 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.479 26.849 -4.403 1.00 0.00 H new ATOM 618 N ASP A 42 -2.411 26.807 -4.564 1.00 0.00 N ATOM 619 CA ASP A 42 -3.846 26.950 -4.351 1.00 0.00 C ATOM 620 C ASP A 42 -4.446 25.658 -3.803 1.00 0.00 C ATOM 621 O ASP A 42 -5.228 25.679 -2.854 1.00 0.00 O ATOM 622 CB ASP A 42 -4.541 27.335 -5.658 1.00 0.00 C ATOM 623 CG ASP A 42 -4.279 28.776 -6.051 1.00 0.00 C ATOM 624 OD1 ASP A 42 -3.111 29.108 -6.344 1.00 0.00 O ATOM 625 OD2 ASP A 42 -5.242 29.571 -6.066 1.00 0.00 O ATOM 0 H ASP A 42 -2.055 27.298 -5.384 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.002 27.742 -3.618 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -4.199 26.676 -6.456 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -5.615 27.179 -5.555 1.00 0.00 H new ATOM 630 N GLY A 43 -4.073 24.535 -4.410 1.00 0.00 N ATOM 631 CA GLY A 43 -4.584 23.250 -3.970 1.00 0.00 C ATOM 632 C GLY A 43 -4.505 22.193 -5.054 1.00 0.00 C ATOM 633 O GLY A 43 -4.323 22.511 -6.229 1.00 0.00 O ATOM 0 H GLY A 43 -3.427 24.492 -5.198 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -4.019 22.916 -3.100 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -5.621 23.364 -3.653 1.00 0.00 H new ATOM 637 N SER A 44 -4.640 20.931 -4.658 1.00 0.00 N ATOM 638 CA SER A 44 -4.577 19.823 -5.604 1.00 0.00 C ATOM 639 C SER A 44 -5.514 18.695 -5.182 1.00 0.00 C ATOM 640 O SER A 44 -5.904 18.600 -4.018 1.00 0.00 O ATOM 641 CB SER A 44 -3.144 19.298 -5.711 1.00 0.00 C ATOM 642 OG SER A 44 -2.777 18.576 -4.548 1.00 0.00 O ATOM 0 H SER A 44 -4.794 20.651 -3.689 1.00 0.00 H new ATOM 0 HA SER A 44 -4.896 20.191 -6.579 1.00 0.00 H new ATOM 0 HB2 SER A 44 -3.054 18.654 -6.586 1.00 0.00 H new ATOM 0 HB3 SER A 44 -2.458 20.132 -5.857 1.00 0.00 H new ATOM 0 HG SER A 44 -1.858 18.250 -4.642 1.00 0.00 H new ATOM 648 N ASP A 45 -5.871 17.843 -6.137 1.00 0.00 N ATOM 649 CA ASP A 45 -6.761 16.720 -5.866 1.00 0.00 C ATOM 650 C ASP A 45 -6.024 15.394 -6.018 1.00 0.00 C ATOM 651 O ASP A 45 -6.090 14.734 -7.055 1.00 0.00 O ATOM 652 CB ASP A 45 -7.966 16.759 -6.807 1.00 0.00 C ATOM 653 CG ASP A 45 -7.561 16.910 -8.260 1.00 0.00 C ATOM 654 OD1 ASP A 45 -6.402 16.582 -8.591 1.00 0.00 O ATOM 655 OD2 ASP A 45 -8.404 17.355 -9.067 1.00 0.00 O ATOM 0 H ASP A 45 -5.558 17.909 -7.105 1.00 0.00 H new ATOM 0 HA ASP A 45 -7.110 16.805 -4.837 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -8.546 15.844 -6.688 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -8.616 17.588 -6.526 1.00 0.00 H new ATOM 660 N PRO A 46 -5.304 14.992 -4.960 1.00 0.00 N ATOM 661 CA PRO A 46 -4.540 13.741 -4.951 1.00 0.00 C ATOM 662 C PRO A 46 -5.441 12.512 -4.927 1.00 0.00 C ATOM 663 O PRO A 46 -6.544 12.549 -4.381 1.00 0.00 O ATOM 664 CB PRO A 46 -3.725 13.832 -3.658 1.00 0.00 C ATOM 665 CG PRO A 46 -4.513 14.738 -2.776 1.00 0.00 C ATOM 666 CD PRO A 46 -5.180 15.729 -3.691 1.00 0.00 C ATOM 0 HA PRO A 46 -3.931 13.629 -5.848 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -3.595 12.850 -3.202 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -2.728 14.231 -3.846 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -5.251 14.179 -2.202 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -3.867 15.243 -2.058 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.153 16.037 -3.309 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -4.583 16.633 -3.808 1.00 0.00 H new ATOM 674 N TYR A 47 -4.965 11.423 -5.522 1.00 0.00 N ATOM 675 CA TYR A 47 -5.730 10.183 -5.571 1.00 0.00 C ATOM 676 C TYR A 47 -4.821 8.995 -5.872 1.00 0.00 C ATOM 677 O TYR A 47 -3.875 9.104 -6.652 1.00 0.00 O ATOM 678 CB TYR A 47 -6.831 10.279 -6.628 1.00 0.00 C ATOM 679 CG TYR A 47 -6.353 9.972 -8.030 1.00 0.00 C ATOM 680 CD1 TYR A 47 -6.302 8.665 -8.497 1.00 0.00 C ATOM 681 CD2 TYR A 47 -5.952 10.990 -8.886 1.00 0.00 C ATOM 682 CE1 TYR A 47 -5.865 8.380 -9.776 1.00 0.00 C ATOM 683 CE2 TYR A 47 -5.515 10.715 -10.167 1.00 0.00 C ATOM 684 CZ TYR A 47 -5.473 9.408 -10.608 1.00 0.00 C ATOM 685 OH TYR A 47 -5.038 9.130 -11.883 1.00 0.00 O ATOM 0 H TYR A 47 -4.053 11.374 -5.977 1.00 0.00 H new ATOM 0 HA TYR A 47 -6.188 10.029 -4.594 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.634 9.589 -6.368 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -7.255 11.283 -6.609 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -6.609 7.858 -7.849 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -5.982 12.014 -8.544 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -5.830 7.358 -10.123 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.208 11.518 -10.820 1.00 0.00 H new ATOM 0 HH TYR A 47 -4.801 9.965 -12.337 1.00 0.00 H new ATOM 695 N VAL A 48 -5.117 7.859 -5.249 1.00 0.00 N ATOM 696 CA VAL A 48 -4.329 6.648 -5.451 1.00 0.00 C ATOM 697 C VAL A 48 -5.037 5.683 -6.395 1.00 0.00 C ATOM 698 O VAL A 48 -6.266 5.618 -6.425 1.00 0.00 O ATOM 699 CB VAL A 48 -4.050 5.932 -4.116 1.00 0.00 C ATOM 700 CG1 VAL A 48 -3.234 4.669 -4.349 1.00 0.00 C ATOM 701 CG2 VAL A 48 -3.338 6.866 -3.149 1.00 0.00 C ATOM 0 H VAL A 48 -5.897 7.751 -4.600 1.00 0.00 H new ATOM 0 HA VAL A 48 -3.382 6.956 -5.895 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.003 5.644 -3.671 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.046 4.176 -3.395 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.786 3.995 -5.004 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.284 4.930 -4.815 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.149 6.344 -2.211 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.391 7.186 -3.583 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -3.963 7.738 -2.959 1.00 0.00 H new ATOM 711 N ARG A 49 -4.253 4.934 -7.164 1.00 0.00 N ATOM 712 CA ARG A 49 -4.805 3.972 -8.110 1.00 0.00 C ATOM 713 C ARG A 49 -4.078 2.634 -8.011 1.00 0.00 C ATOM 714 O ARG A 49 -2.851 2.588 -7.931 1.00 0.00 O ATOM 715 CB ARG A 49 -4.707 4.514 -9.537 1.00 0.00 C ATOM 716 CG ARG A 49 -5.498 3.705 -10.552 1.00 0.00 C ATOM 717 CD ARG A 49 -5.993 4.577 -11.695 1.00 0.00 C ATOM 718 NE ARG A 49 -6.874 5.644 -11.228 1.00 0.00 N ATOM 719 CZ ARG A 49 -7.405 6.562 -12.028 1.00 0.00 C ATOM 720 NH1 ARG A 49 -7.146 6.542 -13.328 1.00 0.00 N ATOM 721 NH2 ARG A 49 -8.197 7.501 -11.527 1.00 0.00 N ATOM 0 H ARG A 49 -3.234 4.975 -7.150 1.00 0.00 H new ATOM 0 HA ARG A 49 -5.854 3.815 -7.860 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -5.062 5.544 -9.550 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -3.660 4.534 -9.838 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -4.873 2.905 -10.948 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -6.348 3.232 -10.059 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -5.139 5.013 -12.214 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -6.524 3.959 -12.419 1.00 0.00 H new ATOM 0 HE ARG A 49 -7.094 5.687 -10.233 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -6.538 5.821 -13.716 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -7.555 7.248 -13.940 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -8.398 7.518 -10.527 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -8.605 8.206 -12.142 1.00 0.00 H new ATOM 735 N MET A 50 -4.845 1.549 -8.017 1.00 0.00 N ATOM 736 CA MET A 50 -4.273 0.210 -7.929 1.00 0.00 C ATOM 737 C MET A 50 -4.519 -0.572 -9.215 1.00 0.00 C ATOM 738 O MET A 50 -5.570 -0.437 -9.844 1.00 0.00 O ATOM 739 CB MET A 50 -4.867 -0.544 -6.738 1.00 0.00 C ATOM 740 CG MET A 50 -4.334 -0.075 -5.394 1.00 0.00 C ATOM 741 SD MET A 50 -4.775 -1.188 -4.045 1.00 0.00 S ATOM 742 CE MET A 50 -6.345 -0.495 -3.535 1.00 0.00 C ATOM 0 H MET A 50 -5.863 1.570 -8.082 1.00 0.00 H new ATOM 0 HA MET A 50 -3.197 0.310 -7.786 1.00 0.00 H new ATOM 0 HB2 MET A 50 -5.951 -0.429 -6.750 1.00 0.00 H new ATOM 0 HB3 MET A 50 -4.658 -1.608 -6.851 1.00 0.00 H new ATOM 0 HG2 MET A 50 -3.249 0.012 -5.448 1.00 0.00 H new ATOM 0 HG3 MET A 50 -4.723 0.921 -5.180 1.00 0.00 H new ATOM 0 HE1 MET A 50 -6.393 -0.464 -2.446 1.00 0.00 H new ATOM 0 HE2 MET A 50 -6.443 0.516 -3.932 1.00 0.00 H new ATOM 0 HE3 MET A 50 -7.157 -1.114 -3.916 1.00 0.00 H new ATOM 752 N TYR A 51 -3.545 -1.389 -9.601 1.00 0.00 N ATOM 753 CA TYR A 51 -3.656 -2.190 -10.814 1.00 0.00 C ATOM 754 C TYR A 51 -2.851 -3.480 -10.690 1.00 0.00 C ATOM 755 O TYR A 51 -1.622 -3.454 -10.607 1.00 0.00 O ATOM 756 CB TYR A 51 -3.174 -1.390 -12.026 1.00 0.00 C ATOM 757 CG TYR A 51 -4.265 -0.579 -12.688 1.00 0.00 C ATOM 758 CD1 TYR A 51 -5.294 -1.200 -13.384 1.00 0.00 C ATOM 759 CD2 TYR A 51 -4.266 0.809 -12.617 1.00 0.00 C ATOM 760 CE1 TYR A 51 -6.292 -0.463 -13.992 1.00 0.00 C ATOM 761 CE2 TYR A 51 -5.261 1.554 -13.221 1.00 0.00 C ATOM 762 CZ TYR A 51 -6.271 0.913 -13.907 1.00 0.00 C ATOM 763 OH TYR A 51 -7.264 1.651 -14.510 1.00 0.00 O ATOM 0 H TYR A 51 -2.670 -1.514 -9.092 1.00 0.00 H new ATOM 0 HA TYR A 51 -4.706 -2.449 -10.953 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -2.373 -0.720 -11.713 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -2.748 -2.076 -12.758 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -5.314 -2.278 -13.451 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -3.476 1.314 -12.081 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -7.084 -0.962 -14.531 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -5.248 2.632 -13.156 1.00 0.00 H new ATOM 0 HH TYR A 51 -7.103 2.605 -14.355 1.00 0.00 H new ATOM 773 N LEU A 52 -3.552 -4.609 -10.680 1.00 0.00 N ATOM 774 CA LEU A 52 -2.904 -5.911 -10.567 1.00 0.00 C ATOM 775 C LEU A 52 -2.141 -6.252 -11.843 1.00 0.00 C ATOM 776 O LEU A 52 -2.620 -7.019 -12.679 1.00 0.00 O ATOM 777 CB LEU A 52 -3.942 -6.995 -10.274 1.00 0.00 C ATOM 778 CG LEU A 52 -3.400 -8.311 -9.714 1.00 0.00 C ATOM 779 CD1 LEU A 52 -2.605 -8.062 -8.442 1.00 0.00 C ATOM 780 CD2 LEU A 52 -4.536 -9.288 -9.453 1.00 0.00 C ATOM 0 H LEU A 52 -4.569 -4.649 -10.749 1.00 0.00 H new ATOM 0 HA LEU A 52 -2.193 -5.865 -9.742 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -4.667 -6.593 -9.566 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.482 -7.211 -11.196 1.00 0.00 H new ATOM 0 HG LEU A 52 -2.733 -8.752 -10.455 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -2.227 -9.009 -8.058 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.768 -7.399 -8.660 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -3.249 -7.599 -7.695 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -4.131 -10.219 -9.055 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -5.229 -8.856 -8.731 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.063 -9.491 -10.385 1.00 0.00 H new ATOM 792 N LEU A 53 -0.951 -5.680 -11.985 1.00 0.00 N ATOM 793 CA LEU A 53 -0.120 -5.925 -13.159 1.00 0.00 C ATOM 794 C LEU A 53 0.175 -7.413 -13.316 1.00 0.00 C ATOM 795 O LEU A 53 0.147 -8.181 -12.354 1.00 0.00 O ATOM 796 CB LEU A 53 1.190 -5.142 -13.053 1.00 0.00 C ATOM 797 CG LEU A 53 1.085 -3.628 -13.241 1.00 0.00 C ATOM 798 CD1 LEU A 53 2.418 -2.959 -12.946 1.00 0.00 C ATOM 799 CD2 LEU A 53 0.621 -3.297 -14.652 1.00 0.00 C ATOM 0 H LEU A 53 -0.540 -5.044 -11.302 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.668 -5.587 -14.039 1.00 0.00 H new ATOM 0 HB2 LEU A 53 1.628 -5.337 -12.074 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.885 -5.533 -13.797 1.00 0.00 H new ATOM 0 HG LEU A 53 0.346 -3.245 -12.537 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.323 -1.882 -13.085 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.710 -3.168 -11.917 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.178 -3.347 -13.624 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.552 -2.215 -14.768 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.336 -3.694 -15.373 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.358 -3.744 -14.827 1.00 0.00 H new ATOM 811 N PRO A 54 0.467 -7.831 -14.557 1.00 0.00 N ATOM 812 CA PRO A 54 0.502 -6.925 -15.709 1.00 0.00 C ATOM 813 C PRO A 54 -0.885 -6.427 -16.098 1.00 0.00 C ATOM 814 O PRO A 54 -1.107 -5.224 -16.235 1.00 0.00 O ATOM 815 CB PRO A 54 1.090 -7.793 -16.824 1.00 0.00 C ATOM 816 CG PRO A 54 0.754 -9.191 -16.433 1.00 0.00 C ATOM 817 CD PRO A 54 0.784 -9.219 -14.930 1.00 0.00 C ATOM 0 HA PRO A 54 1.079 -6.024 -15.501 1.00 0.00 H new ATOM 0 HB2 PRO A 54 0.660 -7.538 -17.793 1.00 0.00 H new ATOM 0 HB3 PRO A 54 2.168 -7.653 -16.908 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.229 -9.476 -16.809 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.472 -9.896 -16.851 1.00 0.00 H new ATOM 0 HD2 PRO A 54 0.054 -9.920 -14.526 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.760 -9.523 -14.553 1.00 0.00 H new ATOM 825 N ASP A 55 -1.816 -7.359 -16.273 1.00 0.00 N ATOM 826 CA ASP A 55 -3.183 -7.013 -16.644 1.00 0.00 C ATOM 827 C ASP A 55 -3.718 -5.888 -15.763 1.00 0.00 C ATOM 828 O ASP A 55 -3.428 -5.830 -14.568 1.00 0.00 O ATOM 829 CB ASP A 55 -4.090 -8.240 -16.533 1.00 0.00 C ATOM 830 CG ASP A 55 -3.504 -9.457 -17.221 1.00 0.00 C ATOM 831 OD1 ASP A 55 -2.745 -10.202 -16.566 1.00 0.00 O ATOM 832 OD2 ASP A 55 -3.806 -9.666 -18.415 1.00 0.00 O ATOM 0 H ASP A 55 -1.649 -8.359 -16.164 1.00 0.00 H new ATOM 0 HA ASP A 55 -3.176 -6.668 -17.678 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -4.261 -8.468 -15.481 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -5.061 -8.011 -16.971 1.00 0.00 H new ATOM 837 N LYS A 56 -4.499 -4.996 -16.362 1.00 0.00 N ATOM 838 CA LYS A 56 -5.076 -3.872 -15.633 1.00 0.00 C ATOM 839 C LYS A 56 -6.598 -3.958 -15.617 1.00 0.00 C ATOM 840 O LYS A 56 -7.284 -2.949 -15.449 1.00 0.00 O ATOM 841 CB LYS A 56 -4.635 -2.549 -16.264 1.00 0.00 C ATOM 842 CG LYS A 56 -3.167 -2.230 -16.045 1.00 0.00 C ATOM 843 CD LYS A 56 -2.281 -2.971 -17.032 1.00 0.00 C ATOM 844 CE LYS A 56 -2.177 -2.228 -18.355 1.00 0.00 C ATOM 845 NZ LYS A 56 -0.952 -2.609 -19.111 1.00 0.00 N ATOM 0 H LYS A 56 -4.747 -5.029 -17.351 1.00 0.00 H new ATOM 0 HA LYS A 56 -4.717 -3.915 -14.605 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -4.835 -2.583 -17.335 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -5.239 -1.741 -15.852 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -3.008 -1.157 -16.147 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -2.883 -2.499 -15.027 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -1.286 -3.097 -16.605 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.683 -3.969 -17.205 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -3.058 -2.440 -18.961 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -2.169 -1.154 -18.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -0.918 -2.081 -20.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -0.110 -2.383 -18.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -0.971 -3.629 -19.311 1.00 0.00 H new ATOM 859 N ARG A 57 -7.121 -5.167 -15.790 1.00 0.00 N ATOM 860 CA ARG A 57 -8.562 -5.384 -15.794 1.00 0.00 C ATOM 861 C ARG A 57 -9.247 -4.508 -14.749 1.00 0.00 C ATOM 862 O ARG A 57 -8.617 -4.062 -13.790 1.00 0.00 O ATOM 863 CB ARG A 57 -8.879 -6.856 -15.527 1.00 0.00 C ATOM 864 CG ARG A 57 -8.337 -7.798 -16.590 1.00 0.00 C ATOM 865 CD ARG A 57 -9.347 -8.021 -17.705 1.00 0.00 C ATOM 866 NE ARG A 57 -9.004 -9.175 -18.532 1.00 0.00 N ATOM 867 CZ ARG A 57 -9.715 -9.561 -19.586 1.00 0.00 C ATOM 868 NH1 ARG A 57 -10.802 -8.888 -19.939 1.00 0.00 N ATOM 869 NH2 ARG A 57 -9.339 -10.622 -20.288 1.00 0.00 N ATOM 0 H ARG A 57 -6.567 -6.012 -15.929 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.942 -5.110 -16.778 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -8.466 -7.138 -14.559 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -9.960 -6.980 -15.461 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -7.418 -7.387 -17.007 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -8.080 -8.754 -16.134 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -10.337 -8.166 -17.273 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -9.399 -7.130 -18.330 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.173 -9.714 -18.287 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -11.094 -8.072 -19.401 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -11.346 -9.186 -20.749 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -8.504 -11.142 -20.019 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -9.885 -10.918 -21.097 1.00 0.00 H new ATOM 883 N ARG A 58 -10.539 -4.265 -14.943 1.00 0.00 N ATOM 884 CA ARG A 58 -11.308 -3.441 -14.018 1.00 0.00 C ATOM 885 C ARG A 58 -11.305 -4.047 -12.618 1.00 0.00 C ATOM 886 O ARG A 58 -10.964 -3.378 -11.642 1.00 0.00 O ATOM 887 CB ARG A 58 -12.747 -3.286 -14.516 1.00 0.00 C ATOM 888 CG ARG A 58 -12.862 -2.499 -15.811 1.00 0.00 C ATOM 889 CD ARG A 58 -14.210 -2.722 -16.480 1.00 0.00 C ATOM 890 NE ARG A 58 -14.169 -2.418 -17.908 1.00 0.00 N ATOM 891 CZ ARG A 58 -13.695 -3.255 -18.824 1.00 0.00 C ATOM 892 NH1 ARG A 58 -13.225 -4.441 -18.463 1.00 0.00 N ATOM 893 NH2 ARG A 58 -13.692 -2.906 -20.104 1.00 0.00 N ATOM 0 H ARG A 58 -11.075 -4.627 -15.732 1.00 0.00 H new ATOM 0 HA ARG A 58 -10.839 -2.458 -13.970 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -13.180 -4.275 -14.662 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -13.338 -2.790 -13.746 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -12.727 -1.437 -15.606 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -12.063 -2.796 -16.491 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -14.518 -3.758 -16.339 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -14.962 -2.097 -15.998 1.00 0.00 H new ATOM 0 HE ARG A 58 -14.524 -1.514 -18.219 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -13.227 -4.713 -17.480 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -12.862 -5.082 -19.168 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -14.054 -1.995 -20.385 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -13.328 -3.549 -20.807 1.00 0.00 H new ATOM 907 N SER A 59 -11.688 -5.316 -12.527 1.00 0.00 N ATOM 908 CA SER A 59 -11.734 -6.012 -11.246 1.00 0.00 C ATOM 909 C SER A 59 -10.570 -5.587 -10.356 1.00 0.00 C ATOM 910 O SER A 59 -10.767 -5.140 -9.228 1.00 0.00 O ATOM 911 CB SER A 59 -11.700 -7.526 -11.462 1.00 0.00 C ATOM 912 OG SER A 59 -12.905 -7.984 -12.051 1.00 0.00 O ATOM 0 H SER A 59 -11.971 -5.884 -13.325 1.00 0.00 H new ATOM 0 HA SER A 59 -12.666 -5.745 -10.748 1.00 0.00 H new ATOM 0 HB2 SER A 59 -10.857 -7.786 -12.102 1.00 0.00 H new ATOM 0 HB3 SER A 59 -11.544 -8.029 -10.508 1.00 0.00 H new ATOM 0 HG SER A 59 -12.858 -8.954 -12.180 1.00 0.00 H new ATOM 918 N GLY A 60 -9.354 -5.732 -10.874 1.00 0.00 N ATOM 919 CA GLY A 60 -8.175 -5.360 -10.114 1.00 0.00 C ATOM 920 C GLY A 60 -8.026 -3.858 -9.972 1.00 0.00 C ATOM 921 O GLY A 60 -7.382 -3.377 -9.040 1.00 0.00 O ATOM 0 H GLY A 60 -9.165 -6.100 -11.806 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -8.228 -5.812 -9.123 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -7.289 -5.765 -10.603 1.00 0.00 H new ATOM 925 N ARG A 61 -8.623 -3.116 -10.900 1.00 0.00 N ATOM 926 CA ARG A 61 -8.551 -1.660 -10.875 1.00 0.00 C ATOM 927 C ARG A 61 -9.390 -1.094 -9.733 1.00 0.00 C ATOM 928 O ARG A 61 -10.619 -1.078 -9.801 1.00 0.00 O ATOM 929 CB ARG A 61 -9.029 -1.082 -12.208 1.00 0.00 C ATOM 930 CG ARG A 61 -9.164 0.432 -12.202 1.00 0.00 C ATOM 931 CD ARG A 61 -10.249 0.898 -13.161 1.00 0.00 C ATOM 932 NE ARG A 61 -10.743 2.230 -12.822 1.00 0.00 N ATOM 933 CZ ARG A 61 -11.901 2.716 -13.253 1.00 0.00 C ATOM 934 NH1 ARG A 61 -12.681 1.983 -14.035 1.00 0.00 N ATOM 935 NH2 ARG A 61 -12.282 3.938 -12.902 1.00 0.00 N ATOM 0 H ARG A 61 -9.161 -3.499 -11.677 1.00 0.00 H new ATOM 0 HA ARG A 61 -7.511 -1.375 -10.715 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -8.330 -1.373 -12.992 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -9.993 -1.523 -12.461 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -9.397 0.774 -11.193 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -8.212 0.884 -12.480 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -9.856 0.905 -14.178 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -11.077 0.189 -13.144 1.00 0.00 H new ATOM 0 HE ARG A 61 -10.167 2.819 -12.221 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -12.392 1.043 -14.307 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -13.570 2.359 -14.365 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -11.685 4.505 -12.300 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -13.172 4.310 -13.234 1.00 0.00 H new ATOM 949 N ARG A 62 -8.717 -0.631 -8.685 1.00 0.00 N ATOM 950 CA ARG A 62 -9.401 -0.065 -7.527 1.00 0.00 C ATOM 951 C ARG A 62 -8.708 1.210 -7.056 1.00 0.00 C ATOM 952 O ARG A 62 -7.541 1.187 -6.663 1.00 0.00 O ATOM 953 CB ARG A 62 -9.447 -1.085 -6.387 1.00 0.00 C ATOM 954 CG ARG A 62 -10.370 -2.261 -6.659 1.00 0.00 C ATOM 955 CD ARG A 62 -11.827 -1.890 -6.429 1.00 0.00 C ATOM 956 NE ARG A 62 -12.733 -2.702 -7.236 1.00 0.00 N ATOM 957 CZ ARG A 62 -13.140 -3.917 -6.886 1.00 0.00 C ATOM 958 NH1 ARG A 62 -12.725 -4.457 -5.749 1.00 0.00 N ATOM 959 NH2 ARG A 62 -13.965 -4.594 -7.674 1.00 0.00 N ATOM 0 H ARG A 62 -7.700 -0.636 -8.613 1.00 0.00 H new ATOM 0 HA ARG A 62 -10.420 0.185 -7.824 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.440 -1.459 -6.205 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -9.771 -0.583 -5.475 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -10.237 -2.599 -7.687 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.099 -3.095 -6.012 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -12.071 -2.015 -5.374 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -11.975 -0.837 -6.667 1.00 0.00 H new ATOM 0 HE ARG A 62 -13.072 -2.315 -8.117 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -12.091 -3.939 -5.140 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -13.039 -5.390 -5.483 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -14.287 -4.182 -8.549 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -14.277 -5.527 -7.404 1.00 0.00 H new ATOM 973 N LYS A 63 -9.434 2.322 -7.099 1.00 0.00 N ATOM 974 CA LYS A 63 -8.891 3.607 -6.676 1.00 0.00 C ATOM 975 C LYS A 63 -9.625 4.130 -5.446 1.00 0.00 C ATOM 976 O LYS A 63 -10.712 3.658 -5.111 1.00 0.00 O ATOM 977 CB LYS A 63 -8.991 4.626 -7.814 1.00 0.00 C ATOM 978 CG LYS A 63 -10.406 5.115 -8.069 1.00 0.00 C ATOM 979 CD LYS A 63 -10.475 6.007 -9.297 1.00 0.00 C ATOM 980 CE LYS A 63 -10.248 7.468 -8.939 1.00 0.00 C ATOM 981 NZ LYS A 63 -9.022 7.653 -8.115 1.00 0.00 N ATOM 0 H LYS A 63 -10.401 2.359 -7.423 1.00 0.00 H new ATOM 0 HA LYS A 63 -7.842 3.462 -6.417 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -8.356 5.481 -7.582 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -8.600 4.178 -8.727 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -11.069 4.260 -8.202 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -10.764 5.664 -7.199 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -9.726 5.688 -10.022 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -11.448 5.895 -9.775 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -10.164 8.057 -9.852 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -11.113 7.847 -8.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -8.808 8.668 -8.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -9.178 7.255 -7.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -8.223 7.165 -8.568 1.00 0.00 H new ATOM 995 N THR A 64 -9.026 5.109 -4.776 1.00 0.00 N ATOM 996 CA THR A 64 -9.623 5.696 -3.583 1.00 0.00 C ATOM 997 C THR A 64 -10.232 7.060 -3.887 1.00 0.00 C ATOM 998 O THR A 64 -9.974 7.645 -4.939 1.00 0.00 O ATOM 999 CB THR A 64 -8.587 5.850 -2.453 1.00 0.00 C ATOM 1000 OG1 THR A 64 -7.500 6.671 -2.894 1.00 0.00 O ATOM 1001 CG2 THR A 64 -8.058 4.492 -2.016 1.00 0.00 C ATOM 0 H THR A 64 -8.127 5.512 -5.040 1.00 0.00 H new ATOM 0 HA THR A 64 -10.408 5.015 -3.256 1.00 0.00 H new ATOM 0 HB THR A 64 -9.077 6.323 -1.602 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.326 7.369 -2.228 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.328 4.626 -1.218 1.00 0.00 H new ATOM 0 HG22 THR A 64 -8.884 3.879 -1.654 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.583 3.997 -2.863 1.00 0.00 H new ATOM 1009 N HIS A 65 -11.040 7.562 -2.959 1.00 0.00 N ATOM 1010 CA HIS A 65 -11.685 8.860 -3.128 1.00 0.00 C ATOM 1011 C HIS A 65 -10.661 9.934 -3.481 1.00 0.00 C ATOM 1012 O HIS A 65 -9.470 9.783 -3.209 1.00 0.00 O ATOM 1013 CB HIS A 65 -12.433 9.251 -1.853 1.00 0.00 C ATOM 1014 CG HIS A 65 -13.385 10.392 -2.043 1.00 0.00 C ATOM 1015 ND1 HIS A 65 -14.563 10.279 -2.752 1.00 0.00 N ATOM 1016 CD2 HIS A 65 -13.328 11.673 -1.612 1.00 0.00 C ATOM 1017 CE1 HIS A 65 -15.189 11.443 -2.748 1.00 0.00 C ATOM 1018 NE2 HIS A 65 -14.461 12.306 -2.063 1.00 0.00 N ATOM 0 H HIS A 65 -11.264 7.091 -2.083 1.00 0.00 H new ATOM 0 HA HIS A 65 -12.398 8.780 -3.949 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -12.985 8.386 -1.485 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -11.708 9.517 -1.084 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -12.539 12.116 -1.023 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -16.135 11.653 -3.224 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -14.701 13.283 -1.896 1.00 0.00 H new ATOM 1026 N VAL A 66 -11.133 11.018 -4.088 1.00 0.00 N ATOM 1027 CA VAL A 66 -10.258 12.118 -4.477 1.00 0.00 C ATOM 1028 C VAL A 66 -10.449 13.322 -3.562 1.00 0.00 C ATOM 1029 O VAL A 66 -11.417 14.070 -3.697 1.00 0.00 O ATOM 1030 CB VAL A 66 -10.513 12.548 -5.934 1.00 0.00 C ATOM 1031 CG1 VAL A 66 -9.712 13.798 -6.270 1.00 0.00 C ATOM 1032 CG2 VAL A 66 -10.174 11.415 -6.891 1.00 0.00 C ATOM 0 H VAL A 66 -12.116 11.158 -4.321 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.234 11.756 -4.386 1.00 0.00 H new ATOM 0 HB VAL A 66 -11.572 12.783 -6.045 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -9.905 14.087 -7.303 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -10.008 14.609 -5.605 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -8.649 13.594 -6.143 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -10.360 11.736 -7.916 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.123 11.147 -6.780 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -10.795 10.549 -6.664 1.00 0.00 H new ATOM 1042 N SER A 67 -9.517 13.504 -2.631 1.00 0.00 N ATOM 1043 CA SER A 67 -9.584 14.617 -1.691 1.00 0.00 C ATOM 1044 C SER A 67 -9.363 15.946 -2.405 1.00 0.00 C ATOM 1045 O SER A 67 -8.555 16.042 -3.329 1.00 0.00 O ATOM 1046 CB SER A 67 -8.542 14.440 -0.584 1.00 0.00 C ATOM 1047 OG SER A 67 -8.495 13.095 -0.139 1.00 0.00 O ATOM 0 H SER A 67 -8.708 12.896 -2.508 1.00 0.00 H new ATOM 0 HA SER A 67 -10.579 14.625 -1.246 1.00 0.00 H new ATOM 0 HB2 SER A 67 -7.561 14.739 -0.953 1.00 0.00 H new ATOM 0 HB3 SER A 67 -8.781 15.095 0.253 1.00 0.00 H new ATOM 0 HG SER A 67 -8.389 13.076 0.835 1.00 0.00 H new ATOM 1053 N LYS A 68 -10.088 16.972 -1.971 1.00 0.00 N ATOM 1054 CA LYS A 68 -9.972 18.298 -2.566 1.00 0.00 C ATOM 1055 C LYS A 68 -9.517 19.321 -1.531 1.00 0.00 C ATOM 1056 O LYS A 68 -9.885 19.240 -0.359 1.00 0.00 O ATOM 1057 CB LYS A 68 -11.311 18.727 -3.169 1.00 0.00 C ATOM 1058 CG LYS A 68 -11.883 17.725 -4.156 1.00 0.00 C ATOM 1059 CD LYS A 68 -11.404 18.000 -5.572 1.00 0.00 C ATOM 1060 CE LYS A 68 -12.397 17.490 -6.605 1.00 0.00 C ATOM 1061 NZ LYS A 68 -12.218 18.160 -7.923 1.00 0.00 N ATOM 0 H LYS A 68 -10.763 16.910 -1.209 1.00 0.00 H new ATOM 0 HA LYS A 68 -9.223 18.250 -3.356 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -12.029 18.882 -2.364 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -11.183 19.686 -3.671 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -11.592 16.717 -3.862 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -12.972 17.764 -4.125 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -11.256 19.072 -5.706 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -10.437 17.523 -5.729 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -12.276 16.413 -6.725 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -13.413 17.658 -6.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -12.913 17.785 -8.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -12.359 19.185 -7.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -11.257 17.978 -8.277 1.00 0.00 H new ATOM 1075 N LYS A 69 -8.715 20.285 -1.971 1.00 0.00 N ATOM 1076 CA LYS A 69 -8.211 21.327 -1.084 1.00 0.00 C ATOM 1077 C LYS A 69 -7.435 20.721 0.081 1.00 0.00 C ATOM 1078 O LYS A 69 -7.629 21.103 1.236 1.00 0.00 O ATOM 1079 CB LYS A 69 -9.368 22.176 -0.552 1.00 0.00 C ATOM 1080 CG LYS A 69 -10.224 22.790 -1.647 1.00 0.00 C ATOM 1081 CD LYS A 69 -9.616 24.079 -2.173 1.00 0.00 C ATOM 1082 CE LYS A 69 -9.821 25.230 -1.201 1.00 0.00 C ATOM 1083 NZ LYS A 69 -11.235 25.696 -1.182 1.00 0.00 N ATOM 0 H LYS A 69 -8.400 20.366 -2.938 1.00 0.00 H new ATOM 0 HA LYS A 69 -7.535 21.962 -1.657 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -9.998 21.557 0.087 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -8.966 22.973 0.073 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -10.335 22.079 -2.465 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -11.223 22.989 -1.260 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -8.550 23.935 -2.348 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -10.066 24.329 -3.134 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -9.529 24.915 -0.199 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -9.169 26.059 -1.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -11.293 26.608 -0.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -11.576 25.811 -2.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -11.825 24.995 -0.690 1.00 0.00 H new ATOM 1097 N THR A 70 -6.554 19.775 -0.229 1.00 0.00 N ATOM 1098 CA THR A 70 -5.748 19.117 0.792 1.00 0.00 C ATOM 1099 C THR A 70 -4.536 18.428 0.176 1.00 0.00 C ATOM 1100 O THR A 70 -4.557 18.040 -0.993 1.00 0.00 O ATOM 1101 CB THR A 70 -6.572 18.077 1.574 1.00 0.00 C ATOM 1102 OG1 THR A 70 -5.801 17.561 2.665 1.00 0.00 O ATOM 1103 CG2 THR A 70 -7.004 16.935 0.666 1.00 0.00 C ATOM 0 H THR A 70 -6.381 19.447 -1.179 1.00 0.00 H new ATOM 0 HA THR A 70 -5.411 19.894 1.478 1.00 0.00 H new ATOM 0 HB THR A 70 -7.464 18.569 1.961 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.333 16.902 3.158 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.584 16.213 1.240 1.00 0.00 H new ATOM 0 HG22 THR A 70 -7.615 17.328 -0.147 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.122 16.445 0.253 1.00 0.00 H new ATOM 1111 N LEU A 71 -3.480 18.280 0.968 1.00 0.00 N ATOM 1112 CA LEU A 71 -2.257 17.637 0.500 1.00 0.00 C ATOM 1113 C LEU A 71 -2.130 16.228 1.071 1.00 0.00 C ATOM 1114 O LEU A 71 -1.513 15.354 0.462 1.00 0.00 O ATOM 1115 CB LEU A 71 -1.036 18.471 0.894 1.00 0.00 C ATOM 1116 CG LEU A 71 -0.907 19.834 0.214 1.00 0.00 C ATOM 1117 CD1 LEU A 71 0.287 20.596 0.767 1.00 0.00 C ATOM 1118 CD2 LEU A 71 -0.785 19.669 -1.294 1.00 0.00 C ATOM 0 H LEU A 71 -3.446 18.596 1.937 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.306 17.566 -0.587 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -1.060 18.626 1.973 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -0.139 17.892 0.675 1.00 0.00 H new ATOM 0 HG LEU A 71 -1.808 20.410 0.424 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.363 21.564 0.271 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.158 20.747 1.839 1.00 0.00 H new ATOM 0 HD13 LEU A 71 1.198 20.025 0.588 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -0.694 20.650 -1.761 1.00 0.00 H new ATOM 0 HD22 LEU A 71 0.099 19.074 -1.525 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.672 19.165 -1.678 1.00 0.00 H new ATOM 1130 N ASN A 72 -2.719 16.014 2.242 1.00 0.00 N ATOM 1131 CA ASN A 72 -2.674 14.711 2.895 1.00 0.00 C ATOM 1132 C ASN A 72 -4.064 14.087 2.961 1.00 0.00 C ATOM 1133 O ASN A 72 -4.810 14.272 3.923 1.00 0.00 O ATOM 1134 CB ASN A 72 -2.094 14.842 4.304 1.00 0.00 C ATOM 1135 CG ASN A 72 -2.577 13.746 5.233 1.00 0.00 C ATOM 1136 OD1 ASN A 72 -2.819 12.564 4.678 1.00 0.00 O flip ATOM 1137 ND2 ASN A 72 -2.731 13.959 6.436 1.00 0.00 N flip ATOM 0 H ASN A 72 -3.234 16.727 2.759 1.00 0.00 H new ATOM 0 HA ASN A 72 -2.030 14.059 2.304 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -1.006 14.815 4.250 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -2.368 15.812 4.718 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -2.533 14.883 6.820 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -3.057 13.211 7.049 1.00 0.00 H new ATOM 1144 N PRO A 73 -4.423 13.328 1.915 1.00 0.00 N ATOM 1145 CA PRO A 73 -5.725 12.660 1.831 1.00 0.00 C ATOM 1146 C PRO A 73 -5.855 11.516 2.831 1.00 0.00 C ATOM 1147 O PRO A 73 -4.867 10.875 3.189 1.00 0.00 O ATOM 1148 CB PRO A 73 -5.757 12.123 0.398 1.00 0.00 C ATOM 1149 CG PRO A 73 -4.325 11.965 0.021 1.00 0.00 C ATOM 1150 CD PRO A 73 -3.585 13.063 0.734 1.00 0.00 C ATOM 0 HA PRO A 73 -6.546 13.337 2.065 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -6.288 11.173 0.343 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.269 12.813 -0.272 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -3.949 10.985 0.317 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.195 12.044 -1.058 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -2.579 12.752 1.017 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -3.481 13.949 0.108 1.00 0.00 H new ATOM 1158 N VAL A 74 -7.081 11.264 3.280 1.00 0.00 N ATOM 1159 CA VAL A 74 -7.341 10.196 4.237 1.00 0.00 C ATOM 1160 C VAL A 74 -8.507 9.324 3.786 1.00 0.00 C ATOM 1161 O VAL A 74 -9.651 9.776 3.736 1.00 0.00 O ATOM 1162 CB VAL A 74 -7.647 10.759 5.637 1.00 0.00 C ATOM 1163 CG1 VAL A 74 -7.831 9.630 6.640 1.00 0.00 C ATOM 1164 CG2 VAL A 74 -6.543 11.705 6.084 1.00 0.00 C ATOM 0 H VAL A 74 -7.910 11.786 2.996 1.00 0.00 H new ATOM 0 HA VAL A 74 -6.437 9.590 4.287 1.00 0.00 H new ATOM 0 HB VAL A 74 -8.579 11.322 5.586 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -8.046 10.048 7.623 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -8.660 8.996 6.326 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -6.919 9.036 6.690 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -6.776 12.093 7.075 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -5.595 11.168 6.118 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -6.466 12.533 5.379 1.00 0.00 H new ATOM 1174 N PHE A 75 -8.210 8.071 3.458 1.00 0.00 N ATOM 1175 CA PHE A 75 -9.234 7.135 3.009 1.00 0.00 C ATOM 1176 C PHE A 75 -9.467 6.044 4.050 1.00 0.00 C ATOM 1177 O PHE A 75 -10.588 5.847 4.518 1.00 0.00 O ATOM 1178 CB PHE A 75 -8.830 6.504 1.675 1.00 0.00 C ATOM 1179 CG PHE A 75 -8.196 7.476 0.720 1.00 0.00 C ATOM 1180 CD1 PHE A 75 -8.911 8.561 0.240 1.00 0.00 C ATOM 1181 CD2 PHE A 75 -6.887 7.302 0.303 1.00 0.00 C ATOM 1182 CE1 PHE A 75 -8.331 9.457 -0.638 1.00 0.00 C ATOM 1183 CE2 PHE A 75 -6.301 8.195 -0.574 1.00 0.00 C ATOM 1184 CZ PHE A 75 -7.024 9.273 -1.047 1.00 0.00 C ATOM 0 H PHE A 75 -7.269 7.680 3.495 1.00 0.00 H new ATOM 0 HA PHE A 75 -10.163 7.689 2.874 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -8.134 5.687 1.865 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -9.712 6.069 1.206 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -9.933 8.708 0.555 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -6.318 6.459 0.667 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -8.899 10.300 -1.004 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -5.278 8.050 -0.889 1.00 0.00 H new ATOM 0 HZ PHE A 75 -6.569 9.970 -1.735 1.00 0.00 H new ATOM 1194 N ASP A 76 -8.400 5.338 4.407 1.00 0.00 N ATOM 1195 CA ASP A 76 -8.486 4.267 5.393 1.00 0.00 C ATOM 1196 C ASP A 76 -9.380 3.137 4.891 1.00 0.00 C ATOM 1197 O ASP A 76 -10.116 2.525 5.664 1.00 0.00 O ATOM 1198 CB ASP A 76 -9.024 4.807 6.719 1.00 0.00 C ATOM 1199 CG ASP A 76 -8.742 3.875 7.881 1.00 0.00 C ATOM 1200 OD1 ASP A 76 -7.553 3.598 8.145 1.00 0.00 O ATOM 1201 OD2 ASP A 76 -9.710 3.424 8.528 1.00 0.00 O ATOM 0 H ASP A 76 -7.465 5.488 4.028 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.483 3.871 5.551 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.576 5.780 6.920 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -10.100 4.963 6.635 1.00 0.00 H new ATOM 1206 N GLN A 77 -9.309 2.867 3.591 1.00 0.00 N ATOM 1207 CA GLN A 77 -10.113 1.812 2.986 1.00 0.00 C ATOM 1208 C GLN A 77 -9.283 0.551 2.770 1.00 0.00 C ATOM 1209 O GLN A 77 -8.053 0.603 2.745 1.00 0.00 O ATOM 1210 CB GLN A 77 -10.698 2.287 1.655 1.00 0.00 C ATOM 1211 CG GLN A 77 -12.062 2.943 1.789 1.00 0.00 C ATOM 1212 CD GLN A 77 -12.674 3.299 0.448 1.00 0.00 C ATOM 1213 OE1 GLN A 77 -13.574 2.614 -0.037 1.00 0.00 O ATOM 1214 NE2 GLN A 77 -12.186 4.375 -0.158 1.00 0.00 N ATOM 0 H GLN A 77 -8.704 3.364 2.938 1.00 0.00 H new ATOM 0 HA GLN A 77 -10.929 1.575 3.669 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -10.007 2.995 1.196 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -10.778 1.436 0.979 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -12.733 2.270 2.323 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -11.969 3.846 2.392 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -11.439 4.913 0.282 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -12.558 4.663 -1.063 1.00 0.00 H new ATOM 1223 N SER A 78 -9.963 -0.580 2.614 1.00 0.00 N ATOM 1224 CA SER A 78 -9.288 -1.855 2.403 1.00 0.00 C ATOM 1225 C SER A 78 -9.886 -2.597 1.212 1.00 0.00 C ATOM 1226 O SER A 78 -11.062 -2.963 1.221 1.00 0.00 O ATOM 1227 CB SER A 78 -9.386 -2.722 3.660 1.00 0.00 C ATOM 1228 OG SER A 78 -8.887 -4.027 3.421 1.00 0.00 O ATOM 0 H SER A 78 -10.981 -0.639 2.630 1.00 0.00 H new ATOM 0 HA SER A 78 -8.238 -1.651 2.191 1.00 0.00 H new ATOM 0 HB2 SER A 78 -8.824 -2.257 4.470 1.00 0.00 H new ATOM 0 HB3 SER A 78 -10.425 -2.781 3.985 1.00 0.00 H new ATOM 0 HG SER A 78 -8.960 -4.560 4.240 1.00 0.00 H new ATOM 1234 N PHE A 79 -9.069 -2.816 0.188 1.00 0.00 N ATOM 1235 CA PHE A 79 -9.517 -3.513 -1.012 1.00 0.00 C ATOM 1236 C PHE A 79 -9.073 -4.973 -0.990 1.00 0.00 C ATOM 1237 O PHE A 79 -8.160 -5.345 -0.253 1.00 0.00 O ATOM 1238 CB PHE A 79 -8.971 -2.821 -2.263 1.00 0.00 C ATOM 1239 CG PHE A 79 -9.340 -1.368 -2.353 1.00 0.00 C ATOM 1240 CD1 PHE A 79 -8.699 -0.427 -1.563 1.00 0.00 C ATOM 1241 CD2 PHE A 79 -10.326 -0.943 -3.228 1.00 0.00 C ATOM 1242 CE1 PHE A 79 -9.037 0.911 -1.643 1.00 0.00 C ATOM 1243 CE2 PHE A 79 -10.668 0.394 -3.313 1.00 0.00 C ATOM 1244 CZ PHE A 79 -10.022 1.322 -2.520 1.00 0.00 C ATOM 0 H PHE A 79 -8.093 -2.521 0.165 1.00 0.00 H new ATOM 0 HA PHE A 79 -10.606 -3.483 -1.035 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -7.885 -2.913 -2.275 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.345 -3.338 -3.147 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -7.927 -0.743 -0.877 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -10.834 -1.664 -3.851 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -8.531 1.634 -1.020 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -11.439 0.712 -3.999 1.00 0.00 H new ATOM 0 HZ PHE A 79 -10.286 2.367 -2.585 1.00 0.00 H new ATOM 1254 N ASP A 80 -9.726 -5.796 -1.804 1.00 0.00 N ATOM 1255 CA ASP A 80 -9.399 -7.215 -1.880 1.00 0.00 C ATOM 1256 C ASP A 80 -9.483 -7.716 -3.318 1.00 0.00 C ATOM 1257 O ASP A 80 -10.221 -7.166 -4.136 1.00 0.00 O ATOM 1258 CB ASP A 80 -10.342 -8.025 -0.989 1.00 0.00 C ATOM 1259 CG ASP A 80 -11.768 -7.510 -1.035 1.00 0.00 C ATOM 1260 OD1 ASP A 80 -12.407 -7.626 -2.102 1.00 0.00 O ATOM 1261 OD2 ASP A 80 -12.244 -6.992 -0.004 1.00 0.00 O ATOM 0 H ASP A 80 -10.485 -5.505 -2.420 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.376 -7.346 -1.528 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -10.326 -9.069 -1.302 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -9.981 -7.995 0.039 1.00 0.00 H new ATOM 1266 N PHE A 81 -8.721 -8.762 -3.620 1.00 0.00 N ATOM 1267 CA PHE A 81 -8.707 -9.336 -4.961 1.00 0.00 C ATOM 1268 C PHE A 81 -8.495 -10.846 -4.903 1.00 0.00 C ATOM 1269 O PHE A 81 -7.609 -11.333 -4.201 1.00 0.00 O ATOM 1270 CB PHE A 81 -7.609 -8.687 -5.805 1.00 0.00 C ATOM 1271 CG PHE A 81 -7.619 -7.186 -5.751 1.00 0.00 C ATOM 1272 CD1 PHE A 81 -8.460 -6.456 -6.575 1.00 0.00 C ATOM 1273 CD2 PHE A 81 -6.787 -6.505 -4.876 1.00 0.00 C ATOM 1274 CE1 PHE A 81 -8.472 -5.074 -6.528 1.00 0.00 C ATOM 1275 CE2 PHE A 81 -6.796 -5.124 -4.824 1.00 0.00 C ATOM 1276 CZ PHE A 81 -7.638 -4.408 -5.652 1.00 0.00 C ATOM 0 H PHE A 81 -8.105 -9.229 -2.955 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.674 -9.140 -5.424 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -6.639 -9.048 -5.464 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -7.722 -9.006 -6.841 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.114 -6.972 -7.262 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -6.125 -7.060 -4.228 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -9.133 -4.517 -7.175 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -6.145 -4.605 -4.136 1.00 0.00 H new ATOM 0 HZ PHE A 81 -7.644 -3.329 -5.614 1.00 0.00 H new ATOM 1286 N SER A 82 -9.316 -11.581 -5.647 1.00 0.00 N ATOM 1287 CA SER A 82 -9.222 -13.036 -5.678 1.00 0.00 C ATOM 1288 C SER A 82 -8.055 -13.487 -6.551 1.00 0.00 C ATOM 1289 O SER A 82 -8.203 -13.671 -7.759 1.00 0.00 O ATOM 1290 CB SER A 82 -10.527 -13.641 -6.200 1.00 0.00 C ATOM 1291 OG SER A 82 -10.849 -13.130 -7.481 1.00 0.00 O ATOM 0 H SER A 82 -10.053 -11.193 -6.236 1.00 0.00 H new ATOM 0 HA SER A 82 -9.048 -13.386 -4.660 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.434 -14.726 -6.251 1.00 0.00 H new ATOM 0 HB3 SER A 82 -11.337 -13.423 -5.504 1.00 0.00 H new ATOM 0 HG SER A 82 -10.040 -13.100 -8.034 1.00 0.00 H new ATOM 1297 N VAL A 83 -6.893 -13.662 -5.929 1.00 0.00 N ATOM 1298 CA VAL A 83 -5.699 -14.092 -6.648 1.00 0.00 C ATOM 1299 C VAL A 83 -4.853 -15.031 -5.796 1.00 0.00 C ATOM 1300 O VAL A 83 -4.586 -14.754 -4.626 1.00 0.00 O ATOM 1301 CB VAL A 83 -4.837 -12.889 -7.075 1.00 0.00 C ATOM 1302 CG1 VAL A 83 -4.504 -12.017 -5.873 1.00 0.00 C ATOM 1303 CG2 VAL A 83 -3.569 -13.362 -7.769 1.00 0.00 C ATOM 0 H VAL A 83 -6.753 -13.513 -4.930 1.00 0.00 H new ATOM 0 HA VAL A 83 -6.039 -14.621 -7.538 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.408 -12.288 -7.782 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -3.895 -11.172 -6.194 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.426 -11.649 -5.424 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -3.952 -12.604 -5.139 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -2.972 -12.499 -8.064 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -2.992 -13.986 -7.087 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -3.833 -13.940 -8.655 1.00 0.00 H new ATOM 1313 N SER A 84 -4.435 -16.145 -6.389 1.00 0.00 N ATOM 1314 CA SER A 84 -3.622 -17.128 -5.684 1.00 0.00 C ATOM 1315 C SER A 84 -2.187 -16.633 -5.524 1.00 0.00 C ATOM 1316 O SER A 84 -1.668 -15.912 -6.377 1.00 0.00 O ATOM 1317 CB SER A 84 -3.632 -18.462 -6.433 1.00 0.00 C ATOM 1318 OG SER A 84 -4.885 -18.687 -7.057 1.00 0.00 O ATOM 0 H SER A 84 -4.646 -16.389 -7.357 1.00 0.00 H new ATOM 0 HA SER A 84 -4.051 -17.273 -4.692 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.842 -18.467 -7.184 1.00 0.00 H new ATOM 0 HB3 SER A 84 -3.417 -19.274 -5.739 1.00 0.00 H new ATOM 0 HG SER A 84 -4.865 -19.545 -7.530 1.00 0.00 H new ATOM 1324 N LEU A 85 -1.552 -17.026 -4.425 1.00 0.00 N ATOM 1325 CA LEU A 85 -0.177 -16.623 -4.152 1.00 0.00 C ATOM 1326 C LEU A 85 0.732 -16.950 -5.332 1.00 0.00 C ATOM 1327 O LEU A 85 1.563 -16.144 -5.750 1.00 0.00 O ATOM 1328 CB LEU A 85 0.337 -17.318 -2.890 1.00 0.00 C ATOM 1329 CG LEU A 85 1.857 -17.404 -2.743 1.00 0.00 C ATOM 1330 CD1 LEU A 85 2.435 -18.389 -3.748 1.00 0.00 C ATOM 1331 CD2 LEU A 85 2.489 -16.031 -2.916 1.00 0.00 C ATOM 0 H LEU A 85 -1.967 -17.623 -3.709 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.165 -15.544 -3.997 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -0.063 -16.794 -2.022 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -0.068 -18.330 -2.866 1.00 0.00 H new ATOM 0 HG LEU A 85 2.086 -17.763 -1.739 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.517 -18.437 -3.629 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.007 -19.377 -3.577 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.196 -18.060 -4.759 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.571 -16.112 -2.808 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.251 -15.643 -3.907 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.099 -15.353 -2.157 1.00 0.00 H new ATOM 1343 N PRO A 86 0.569 -18.161 -5.887 1.00 0.00 N ATOM 1344 CA PRO A 86 1.364 -18.621 -7.029 1.00 0.00 C ATOM 1345 C PRO A 86 1.428 -17.585 -8.146 1.00 0.00 C ATOM 1346 O PRO A 86 2.462 -17.422 -8.794 1.00 0.00 O ATOM 1347 CB PRO A 86 0.615 -19.870 -7.501 1.00 0.00 C ATOM 1348 CG PRO A 86 -0.094 -20.368 -6.289 1.00 0.00 C ATOM 1349 CD PRO A 86 -0.403 -19.173 -5.441 1.00 0.00 C ATOM 0 HA PRO A 86 2.402 -18.807 -6.755 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -0.087 -19.632 -8.300 1.00 0.00 H new ATOM 0 HB3 PRO A 86 1.303 -20.619 -7.893 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -1.009 -20.892 -6.565 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.527 -21.078 -5.743 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.428 -18.834 -5.587 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.289 -19.396 -4.380 1.00 0.00 H new ATOM 1357 N GLU A 87 0.318 -16.888 -8.365 1.00 0.00 N ATOM 1358 CA GLU A 87 0.250 -15.867 -9.404 1.00 0.00 C ATOM 1359 C GLU A 87 0.759 -14.526 -8.884 1.00 0.00 C ATOM 1360 O GLU A 87 1.719 -13.965 -9.414 1.00 0.00 O ATOM 1361 CB GLU A 87 -1.186 -15.719 -9.911 1.00 0.00 C ATOM 1362 CG GLU A 87 -1.586 -16.777 -10.926 1.00 0.00 C ATOM 1363 CD GLU A 87 -1.121 -16.443 -12.330 1.00 0.00 C ATOM 1364 OE1 GLU A 87 0.079 -16.633 -12.620 1.00 0.00 O ATOM 1365 OE2 GLU A 87 -1.958 -15.993 -13.140 1.00 0.00 O ATOM 0 H GLU A 87 -0.546 -17.011 -7.837 1.00 0.00 H new ATOM 0 HA GLU A 87 0.888 -16.182 -10.229 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.868 -15.766 -9.062 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.304 -14.733 -10.361 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -1.167 -17.738 -10.628 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -2.670 -16.887 -10.923 1.00 0.00 H new ATOM 1372 N VAL A 88 0.108 -14.016 -7.843 1.00 0.00 N ATOM 1373 CA VAL A 88 0.494 -12.741 -7.250 1.00 0.00 C ATOM 1374 C VAL A 88 2.010 -12.583 -7.226 1.00 0.00 C ATOM 1375 O VAL A 88 2.526 -11.466 -7.234 1.00 0.00 O ATOM 1376 CB VAL A 88 -0.049 -12.603 -5.815 1.00 0.00 C ATOM 1377 CG1 VAL A 88 0.924 -13.207 -4.815 1.00 0.00 C ATOM 1378 CG2 VAL A 88 -0.324 -11.142 -5.489 1.00 0.00 C ATOM 0 H VAL A 88 -0.689 -14.466 -7.393 1.00 0.00 H new ATOM 0 HA VAL A 88 0.060 -11.958 -7.872 1.00 0.00 H new ATOM 0 HB VAL A 88 -0.989 -13.151 -5.746 1.00 0.00 H new ATOM 0 HG11 VAL A 88 0.523 -13.100 -3.807 1.00 0.00 H new ATOM 0 HG12 VAL A 88 1.066 -14.264 -5.039 1.00 0.00 H new ATOM 0 HG13 VAL A 88 1.881 -12.690 -4.881 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -0.707 -11.062 -4.472 1.00 0.00 H new ATOM 0 HG22 VAL A 88 0.600 -10.570 -5.575 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.062 -10.746 -6.187 1.00 0.00 H new ATOM 1388 N GLN A 89 2.717 -13.708 -7.196 1.00 0.00 N ATOM 1389 CA GLN A 89 4.174 -13.693 -7.170 1.00 0.00 C ATOM 1390 C GLN A 89 4.734 -13.027 -8.423 1.00 0.00 C ATOM 1391 O GLN A 89 5.606 -12.161 -8.340 1.00 0.00 O ATOM 1392 CB GLN A 89 4.718 -15.118 -7.050 1.00 0.00 C ATOM 1393 CG GLN A 89 4.685 -15.664 -5.631 1.00 0.00 C ATOM 1394 CD GLN A 89 4.923 -17.160 -5.576 1.00 0.00 C ATOM 1395 OE1 GLN A 89 4.918 -17.839 -6.603 1.00 0.00 O ATOM 1396 NE2 GLN A 89 5.133 -17.682 -4.373 1.00 0.00 N ATOM 0 H GLN A 89 2.304 -14.641 -7.189 1.00 0.00 H new ATOM 0 HA GLN A 89 4.491 -13.116 -6.301 1.00 0.00 H new ATOM 0 HB2 GLN A 89 4.137 -15.775 -7.697 1.00 0.00 H new ATOM 0 HB3 GLN A 89 5.745 -15.138 -7.414 1.00 0.00 H new ATOM 0 HG2 GLN A 89 5.442 -15.157 -5.033 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.719 -15.437 -5.181 1.00 0.00 H new ATOM 0 HE21 GLN A 89 5.128 -17.081 -3.549 1.00 0.00 H new ATOM 0 HE22 GLN A 89 5.299 -18.683 -4.274 1.00 0.00 H new ATOM 1405 N ARG A 90 4.229 -13.437 -9.581 1.00 0.00 N ATOM 1406 CA ARG A 90 4.680 -12.881 -10.851 1.00 0.00 C ATOM 1407 C ARG A 90 4.036 -11.521 -11.109 1.00 0.00 C ATOM 1408 O ARG A 90 4.558 -10.712 -11.875 1.00 0.00 O ATOM 1409 CB ARG A 90 4.349 -13.838 -11.998 1.00 0.00 C ATOM 1410 CG ARG A 90 4.902 -15.240 -11.799 1.00 0.00 C ATOM 1411 CD ARG A 90 4.416 -16.190 -12.883 1.00 0.00 C ATOM 1412 NE ARG A 90 5.308 -17.335 -13.047 1.00 0.00 N ATOM 1413 CZ ARG A 90 5.050 -18.357 -13.855 1.00 0.00 C ATOM 1414 NH1 ARG A 90 3.932 -18.376 -14.569 1.00 0.00 N ATOM 1415 NH2 ARG A 90 5.910 -19.362 -13.951 1.00 0.00 N ATOM 0 H ARG A 90 3.507 -14.152 -9.666 1.00 0.00 H new ATOM 0 HA ARG A 90 5.761 -12.749 -10.797 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.266 -13.896 -12.111 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.745 -13.429 -12.927 1.00 0.00 H new ATOM 0 HG2 ARG A 90 5.991 -15.207 -11.805 1.00 0.00 H new ATOM 0 HG3 ARG A 90 4.600 -15.616 -10.822 1.00 0.00 H new ATOM 0 HD2 ARG A 90 3.415 -16.543 -12.634 1.00 0.00 H new ATOM 0 HD3 ARG A 90 4.338 -15.653 -13.828 1.00 0.00 H new ATOM 0 HE ARG A 90 6.176 -17.351 -12.512 1.00 0.00 H new ATOM 0 HH11 ARG A 90 3.268 -17.605 -14.498 1.00 0.00 H new ATOM 0 HH12 ARG A 90 3.736 -19.162 -15.189 1.00 0.00 H new ATOM 0 HH21 ARG A 90 6.771 -19.351 -13.404 1.00 0.00 H new ATOM 0 HH22 ARG A 90 5.711 -20.146 -14.572 1.00 0.00 H new ATOM 1429 N ARG A 91 2.900 -11.278 -10.463 1.00 0.00 N ATOM 1430 CA ARG A 91 2.185 -10.018 -10.623 1.00 0.00 C ATOM 1431 C ARG A 91 2.842 -8.912 -9.803 1.00 0.00 C ATOM 1432 O ARG A 91 3.747 -9.167 -9.007 1.00 0.00 O ATOM 1433 CB ARG A 91 0.723 -10.180 -10.202 1.00 0.00 C ATOM 1434 CG ARG A 91 -0.100 -11.014 -11.170 1.00 0.00 C ATOM 1435 CD ARG A 91 -1.388 -11.505 -10.526 1.00 0.00 C ATOM 1436 NE ARG A 91 -2.165 -12.347 -11.431 1.00 0.00 N ATOM 1437 CZ ARG A 91 -2.820 -11.881 -12.488 1.00 0.00 C ATOM 1438 NH1 ARG A 91 -2.791 -10.586 -12.772 1.00 0.00 N ATOM 1439 NH2 ARG A 91 -3.506 -12.711 -13.264 1.00 0.00 N ATOM 0 H ARG A 91 2.455 -11.937 -9.824 1.00 0.00 H new ATOM 0 HA ARG A 91 2.224 -9.738 -11.676 1.00 0.00 H new ATOM 0 HB2 ARG A 91 0.687 -10.642 -9.216 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.269 -9.193 -10.109 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -0.337 -10.421 -12.053 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.488 -11.868 -11.508 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -1.151 -12.067 -9.622 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -1.990 -10.649 -10.220 1.00 0.00 H new ATOM 0 HE ARG A 91 -2.207 -13.348 -11.241 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -2.265 -9.945 -12.178 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -3.295 -10.231 -13.585 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -3.530 -13.708 -13.049 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -4.009 -12.352 -14.076 1.00 0.00 H new ATOM 1453 N THR A 92 2.382 -7.681 -10.003 1.00 0.00 N ATOM 1454 CA THR A 92 2.925 -6.535 -9.284 1.00 0.00 C ATOM 1455 C THR A 92 1.842 -5.503 -8.994 1.00 0.00 C ATOM 1456 O THR A 92 1.014 -5.199 -9.854 1.00 0.00 O ATOM 1457 CB THR A 92 4.061 -5.861 -10.077 1.00 0.00 C ATOM 1458 OG1 THR A 92 4.920 -6.857 -10.645 1.00 0.00 O ATOM 1459 CG2 THR A 92 4.871 -4.936 -9.182 1.00 0.00 C ATOM 0 H THR A 92 1.634 -7.452 -10.658 1.00 0.00 H new ATOM 0 HA THR A 92 3.323 -6.913 -8.343 1.00 0.00 H new ATOM 0 HB THR A 92 3.615 -5.268 -10.876 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.639 -6.421 -11.149 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.667 -4.472 -9.764 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.220 -4.162 -8.775 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.307 -5.510 -8.365 1.00 0.00 H new ATOM 1467 N LEU A 93 1.852 -4.968 -7.779 1.00 0.00 N ATOM 1468 CA LEU A 93 0.869 -3.968 -7.375 1.00 0.00 C ATOM 1469 C LEU A 93 1.284 -2.577 -7.843 1.00 0.00 C ATOM 1470 O LEU A 93 2.124 -1.926 -7.221 1.00 0.00 O ATOM 1471 CB LEU A 93 0.698 -3.977 -5.855 1.00 0.00 C ATOM 1472 CG LEU A 93 -0.680 -3.570 -5.332 1.00 0.00 C ATOM 1473 CD1 LEU A 93 -1.623 -4.764 -5.326 1.00 0.00 C ATOM 1474 CD2 LEU A 93 -0.566 -2.971 -3.938 1.00 0.00 C ATOM 0 H LEU A 93 2.530 -5.209 -7.056 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.083 -4.220 -7.843 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.921 -4.980 -5.490 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.441 -3.307 -5.422 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.091 -2.812 -5.999 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.599 -4.455 -4.951 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.729 -5.149 -6.340 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.217 -5.545 -4.683 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.556 -2.687 -3.582 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.134 -3.707 -3.260 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.074 -2.089 -3.972 1.00 0.00 H new ATOM 1486 N ASP A 94 0.687 -2.126 -8.941 1.00 0.00 N ATOM 1487 CA ASP A 94 0.992 -0.810 -9.491 1.00 0.00 C ATOM 1488 C ASP A 94 0.328 0.290 -8.669 1.00 0.00 C ATOM 1489 O ASP A 94 -0.865 0.555 -8.816 1.00 0.00 O ATOM 1490 CB ASP A 94 0.532 -0.723 -10.947 1.00 0.00 C ATOM 1491 CG ASP A 94 1.127 0.468 -11.672 1.00 0.00 C ATOM 1492 OD1 ASP A 94 2.250 0.340 -12.203 1.00 0.00 O ATOM 1493 OD2 ASP A 94 0.468 1.528 -11.709 1.00 0.00 O ATOM 0 H ASP A 94 -0.011 -2.652 -9.467 1.00 0.00 H new ATOM 0 HA ASP A 94 2.072 -0.668 -9.450 1.00 0.00 H new ATOM 0 HB2 ASP A 94 0.811 -1.639 -11.468 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -0.556 -0.657 -10.978 1.00 0.00 H new ATOM 1498 N VAL A 95 1.109 0.927 -7.802 1.00 0.00 N ATOM 1499 CA VAL A 95 0.597 1.999 -6.956 1.00 0.00 C ATOM 1500 C VAL A 95 1.137 3.354 -7.398 1.00 0.00 C ATOM 1501 O VAL A 95 2.317 3.651 -7.220 1.00 0.00 O ATOM 1502 CB VAL A 95 0.963 1.770 -5.478 1.00 0.00 C ATOM 1503 CG1 VAL A 95 0.188 2.723 -4.582 1.00 0.00 C ATOM 1504 CG2 VAL A 95 0.704 0.324 -5.082 1.00 0.00 C ATOM 0 H VAL A 95 2.098 0.719 -7.667 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.488 1.993 -7.059 1.00 0.00 H new ATOM 0 HB VAL A 95 2.026 1.973 -5.350 1.00 0.00 H new ATOM 0 HG11 VAL A 95 0.460 2.546 -3.541 1.00 0.00 H new ATOM 0 HG12 VAL A 95 0.429 3.752 -4.850 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.881 2.555 -4.711 1.00 0.00 H new ATOM 0 HG21 VAL A 95 0.968 0.181 -4.034 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -0.351 0.091 -5.225 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.309 -0.337 -5.703 1.00 0.00 H new ATOM 1514 N ALA A 96 0.264 4.173 -7.976 1.00 0.00 N ATOM 1515 CA ALA A 96 0.652 5.498 -8.442 1.00 0.00 C ATOM 1516 C ALA A 96 -0.281 6.570 -7.888 1.00 0.00 C ATOM 1517 O ALA A 96 -1.500 6.481 -8.034 1.00 0.00 O ATOM 1518 CB ALA A 96 0.664 5.541 -9.963 1.00 0.00 C ATOM 0 H ALA A 96 -0.717 3.942 -8.133 1.00 0.00 H new ATOM 0 HA ALA A 96 1.658 5.704 -8.076 1.00 0.00 H new ATOM 0 HB1 ALA A 96 0.956 6.537 -10.297 1.00 0.00 H new ATOM 0 HB2 ALA A 96 1.376 4.808 -10.342 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -0.331 5.309 -10.341 1.00 0.00 H new ATOM 1524 N VAL A 97 0.299 7.583 -7.253 1.00 0.00 N ATOM 1525 CA VAL A 97 -0.481 8.672 -6.678 1.00 0.00 C ATOM 1526 C VAL A 97 -0.393 9.926 -7.540 1.00 0.00 C ATOM 1527 O VAL A 97 0.621 10.625 -7.538 1.00 0.00 O ATOM 1528 CB VAL A 97 -0.007 9.009 -5.251 1.00 0.00 C ATOM 1529 CG1 VAL A 97 -0.798 10.180 -4.688 1.00 0.00 C ATOM 1530 CG2 VAL A 97 -0.127 7.791 -4.348 1.00 0.00 C ATOM 0 H VAL A 97 1.307 7.672 -7.124 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.516 8.334 -6.639 1.00 0.00 H new ATOM 0 HB VAL A 97 1.043 9.298 -5.295 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.449 10.403 -3.680 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.656 11.054 -5.323 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.857 9.923 -4.657 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.212 8.047 -3.344 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.167 7.469 -4.308 1.00 0.00 H new ATOM 0 HG23 VAL A 97 0.488 6.983 -4.743 1.00 0.00 H new ATOM 1540 N LYS A 98 -1.462 10.206 -8.278 1.00 0.00 N ATOM 1541 CA LYS A 98 -1.508 11.377 -9.145 1.00 0.00 C ATOM 1542 C LYS A 98 -2.683 12.279 -8.780 1.00 0.00 C ATOM 1543 O LYS A 98 -3.485 11.946 -7.909 1.00 0.00 O ATOM 1544 CB LYS A 98 -1.617 10.948 -10.610 1.00 0.00 C ATOM 1545 CG LYS A 98 -0.581 9.916 -11.020 1.00 0.00 C ATOM 1546 CD LYS A 98 -1.098 9.019 -12.132 1.00 0.00 C ATOM 1547 CE LYS A 98 0.033 8.252 -12.801 1.00 0.00 C ATOM 1548 NZ LYS A 98 -0.478 7.179 -13.698 1.00 0.00 N ATOM 0 H LYS A 98 -2.309 9.637 -8.293 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.584 11.939 -9.004 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -2.613 10.542 -10.788 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -1.513 11.827 -11.246 1.00 0.00 H new ATOM 0 HG2 LYS A 98 0.326 10.421 -11.351 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -0.310 9.308 -10.157 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -1.825 8.316 -11.725 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -1.619 9.623 -12.875 1.00 0.00 H new ATOM 0 HE2 LYS A 98 0.650 8.943 -13.376 1.00 0.00 H new ATOM 0 HE3 LYS A 98 0.675 7.812 -12.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 0.324 6.680 -14.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -1.045 6.505 -13.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.070 7.601 -14.442 1.00 0.00 H new ATOM 1562 N ASN A 99 -2.778 13.421 -9.452 1.00 0.00 N ATOM 1563 CA ASN A 99 -3.856 14.370 -9.199 1.00 0.00 C ATOM 1564 C ASN A 99 -4.872 14.356 -10.337 1.00 0.00 C ATOM 1565 O ASN A 99 -4.506 14.273 -11.509 1.00 0.00 O ATOM 1566 CB ASN A 99 -3.290 15.781 -9.022 1.00 0.00 C ATOM 1567 CG ASN A 99 -2.494 16.240 -10.228 1.00 0.00 C ATOM 1568 OD1 ASN A 99 -1.259 16.667 -9.994 1.00 0.00 O flip ATOM 1569 ND2 ASN A 99 -2.985 16.210 -11.357 1.00 0.00 N flip ATOM 0 H ASN A 99 -2.121 13.712 -10.176 1.00 0.00 H new ATOM 0 HA ASN A 99 -4.362 14.071 -8.281 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -4.109 16.478 -8.844 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -2.652 15.806 -8.138 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -3.939 15.874 -11.490 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -2.438 16.521 -12.160 1.00 0.00 H new ATOM 1576 N SER A 100 -6.151 14.439 -9.982 1.00 0.00 N ATOM 1577 CA SER A 100 -7.220 14.433 -10.973 1.00 0.00 C ATOM 1578 C SER A 100 -7.231 15.734 -11.769 1.00 0.00 C ATOM 1579 O SER A 100 -7.744 16.753 -11.307 1.00 0.00 O ATOM 1580 CB SER A 100 -8.574 14.227 -10.291 1.00 0.00 C ATOM 1581 OG SER A 100 -9.631 14.267 -11.234 1.00 0.00 O ATOM 0 H SER A 100 -6.471 14.511 -9.016 1.00 0.00 H new ATOM 0 HA SER A 100 -7.039 13.608 -11.662 1.00 0.00 H new ATOM 0 HB2 SER A 100 -8.581 13.268 -9.772 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.726 14.999 -9.537 1.00 0.00 H new ATOM 0 HG SER A 100 -10.485 14.131 -10.774 1.00 0.00 H new ATOM 1587 N GLY A 101 -6.660 15.692 -12.969 1.00 0.00 N ATOM 1588 CA GLY A 101 -6.614 16.873 -13.811 1.00 0.00 C ATOM 1589 C GLY A 101 -6.371 16.537 -15.268 1.00 0.00 C ATOM 1590 O GLY A 101 -5.602 17.215 -15.949 1.00 0.00 O ATOM 0 H GLY A 101 -6.228 14.861 -13.373 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -7.554 17.418 -13.719 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -5.825 17.537 -13.458 1.00 0.00 H new ATOM 1594 N GLY A 102 -7.027 15.485 -15.750 1.00 0.00 N ATOM 1595 CA GLY A 102 -6.863 15.078 -17.133 1.00 0.00 C ATOM 1596 C GLY A 102 -7.614 15.976 -18.095 1.00 0.00 C ATOM 1597 O GLY A 102 -8.657 16.532 -17.750 1.00 0.00 O ATOM 0 H GLY A 102 -7.669 14.908 -15.207 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -5.803 15.085 -17.387 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -7.213 14.052 -17.250 1.00 0.00 H new ATOM 1601 N PHE A 103 -7.083 16.121 -19.304 1.00 0.00 N ATOM 1602 CA PHE A 103 -7.709 16.960 -20.319 1.00 0.00 C ATOM 1603 C PHE A 103 -8.717 16.161 -21.140 1.00 0.00 C ATOM 1604 O PHE A 103 -9.866 16.572 -21.304 1.00 0.00 O ATOM 1605 CB PHE A 103 -6.646 17.562 -21.240 1.00 0.00 C ATOM 1606 CG PHE A 103 -7.161 18.682 -22.098 1.00 0.00 C ATOM 1607 CD1 PHE A 103 -8.025 18.426 -23.151 1.00 0.00 C ATOM 1608 CD2 PHE A 103 -6.780 19.992 -21.852 1.00 0.00 C ATOM 1609 CE1 PHE A 103 -8.500 19.455 -23.942 1.00 0.00 C ATOM 1610 CE2 PHE A 103 -7.253 21.025 -22.639 1.00 0.00 C ATOM 1611 CZ PHE A 103 -8.113 20.756 -23.686 1.00 0.00 C ATOM 0 H PHE A 103 -6.220 15.668 -19.605 1.00 0.00 H new ATOM 0 HA PHE A 103 -8.239 17.766 -19.812 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -5.818 17.930 -20.634 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -6.246 16.777 -21.882 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -8.331 17.411 -23.356 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -6.106 20.208 -21.036 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -9.173 19.242 -24.759 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -6.951 22.042 -22.436 1.00 0.00 H new ATOM 0 HZ PHE A 103 -8.482 21.562 -24.303 1.00 0.00 H new ATOM 1621 N LEU A 104 -8.277 15.018 -21.655 1.00 0.00 N ATOM 1622 CA LEU A 104 -9.140 14.160 -22.460 1.00 0.00 C ATOM 1623 C LEU A 104 -9.644 12.975 -21.644 1.00 0.00 C ATOM 1624 O LEU A 104 -10.803 12.940 -21.231 1.00 0.00 O ATOM 1625 CB LEU A 104 -8.387 13.661 -23.694 1.00 0.00 C ATOM 1626 CG LEU A 104 -6.864 13.593 -23.569 1.00 0.00 C ATOM 1627 CD1 LEU A 104 -6.290 12.606 -24.574 1.00 0.00 C ATOM 1628 CD2 LEU A 104 -6.251 14.972 -23.763 1.00 0.00 C ATOM 0 H LEU A 104 -7.329 14.664 -21.530 1.00 0.00 H new ATOM 0 HA LEU A 104 -10.000 14.749 -22.780 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.756 12.666 -23.942 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -8.634 14.311 -24.533 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.616 13.245 -22.566 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.205 12.571 -24.471 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.705 11.615 -24.388 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -6.548 12.924 -25.584 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.167 14.905 -23.671 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.508 15.348 -24.753 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -6.638 15.652 -23.004 1.00 0.00 H new ATOM 1640 N SER A 105 -8.764 12.005 -21.413 1.00 0.00 N ATOM 1641 CA SER A 105 -9.120 10.817 -20.647 1.00 0.00 C ATOM 1642 C SER A 105 -8.370 10.782 -19.318 1.00 0.00 C ATOM 1643 O SER A 105 -8.960 10.537 -18.265 1.00 0.00 O ATOM 1644 CB SER A 105 -8.812 9.553 -21.453 1.00 0.00 C ATOM 1645 OG SER A 105 -9.614 9.484 -22.619 1.00 0.00 O ATOM 0 H SER A 105 -7.800 12.019 -21.746 1.00 0.00 H new ATOM 0 HA SER A 105 -10.189 10.856 -20.440 1.00 0.00 H new ATOM 0 HB2 SER A 105 -7.758 9.543 -21.731 1.00 0.00 H new ATOM 0 HB3 SER A 105 -8.987 8.672 -20.835 1.00 0.00 H new ATOM 0 HG SER A 105 -9.397 8.669 -23.117 1.00 0.00 H new ATOM 1651 N LYS A 106 -7.066 11.028 -19.376 1.00 0.00 N ATOM 1652 CA LYS A 106 -6.233 11.026 -18.179 1.00 0.00 C ATOM 1653 C LYS A 106 -5.279 12.217 -18.179 1.00 0.00 C ATOM 1654 O LYS A 106 -5.133 12.908 -19.187 1.00 0.00 O ATOM 1655 CB LYS A 106 -5.438 9.722 -18.088 1.00 0.00 C ATOM 1656 CG LYS A 106 -6.308 8.477 -18.101 1.00 0.00 C ATOM 1657 CD LYS A 106 -6.569 7.995 -19.518 1.00 0.00 C ATOM 1658 CE LYS A 106 -5.399 7.184 -20.055 1.00 0.00 C ATOM 1659 NZ LYS A 106 -5.374 5.806 -19.491 1.00 0.00 N ATOM 0 H LYS A 106 -6.563 11.231 -20.239 1.00 0.00 H new ATOM 0 HA LYS A 106 -6.887 11.106 -17.311 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -4.738 9.674 -18.922 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -4.845 9.731 -17.174 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -5.822 7.686 -17.530 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -7.256 8.689 -17.607 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -7.473 7.387 -19.536 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -6.748 8.852 -20.168 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -5.463 7.130 -21.142 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -4.465 7.692 -19.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -4.625 5.254 -19.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -5.186 5.852 -18.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -6.293 5.348 -19.653 1.00 0.00 H new ATOM 1673 N ASP A 107 -4.632 12.450 -17.042 1.00 0.00 N ATOM 1674 CA ASP A 107 -3.690 13.555 -16.912 1.00 0.00 C ATOM 1675 C ASP A 107 -2.262 13.086 -17.172 1.00 0.00 C ATOM 1676 O ASP A 107 -1.930 11.921 -16.952 1.00 0.00 O ATOM 1677 CB ASP A 107 -3.790 14.177 -15.518 1.00 0.00 C ATOM 1678 CG ASP A 107 -3.610 13.154 -14.414 1.00 0.00 C ATOM 1679 OD1 ASP A 107 -4.427 12.212 -14.339 1.00 0.00 O ATOM 1680 OD2 ASP A 107 -2.652 13.295 -13.625 1.00 0.00 O ATOM 0 H ASP A 107 -4.743 11.888 -16.198 1.00 0.00 H new ATOM 0 HA ASP A 107 -3.947 14.308 -17.657 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -3.034 14.955 -15.415 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -4.761 14.660 -15.407 1.00 0.00 H new ATOM 1685 N LYS A 108 -1.420 14.000 -17.642 1.00 0.00 N ATOM 1686 CA LYS A 108 -0.027 13.682 -17.932 1.00 0.00 C ATOM 1687 C LYS A 108 0.893 14.221 -16.842 1.00 0.00 C ATOM 1688 O LYS A 108 2.100 14.349 -17.042 1.00 0.00 O ATOM 1689 CB LYS A 108 0.378 14.262 -19.289 1.00 0.00 C ATOM 1690 CG LYS A 108 -0.140 13.462 -20.472 1.00 0.00 C ATOM 1691 CD LYS A 108 0.228 14.117 -21.792 1.00 0.00 C ATOM 1692 CE LYS A 108 0.153 13.128 -22.946 1.00 0.00 C ATOM 1693 NZ LYS A 108 -1.227 12.602 -23.136 1.00 0.00 N ATOM 0 H LYS A 108 -1.679 14.968 -17.830 1.00 0.00 H new ATOM 0 HA LYS A 108 0.073 12.597 -17.963 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.008 15.285 -19.363 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.465 14.312 -19.343 1.00 0.00 H new ATOM 0 HG2 LYS A 108 0.271 12.453 -20.438 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -1.224 13.367 -20.402 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -0.444 14.953 -21.984 1.00 0.00 H new ATOM 0 HD3 LYS A 108 1.236 14.527 -21.727 1.00 0.00 H new ATOM 0 HE2 LYS A 108 0.486 13.614 -23.863 1.00 0.00 H new ATOM 0 HE3 LYS A 108 0.835 12.299 -22.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -1.259 12.012 -23.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -1.497 12.030 -22.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -1.890 13.396 -23.239 1.00 0.00 H new ATOM 1707 N GLY A 109 0.314 14.533 -15.686 1.00 0.00 N ATOM 1708 CA GLY A 109 1.098 15.053 -14.581 1.00 0.00 C ATOM 1709 C GLY A 109 1.224 14.060 -13.442 1.00 0.00 C ATOM 1710 O GLY A 109 0.382 14.023 -12.544 1.00 0.00 O ATOM 0 H GLY A 109 -0.683 14.435 -15.495 1.00 0.00 H new ATOM 0 HA2 GLY A 109 2.093 15.319 -14.939 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.637 15.969 -14.211 1.00 0.00 H new ATOM 1714 N LEU A 110 2.277 13.251 -13.479 1.00 0.00 N ATOM 1715 CA LEU A 110 2.511 12.251 -12.443 1.00 0.00 C ATOM 1716 C LEU A 110 3.162 12.880 -11.216 1.00 0.00 C ATOM 1717 O LEU A 110 4.240 13.470 -11.305 1.00 0.00 O ATOM 1718 CB LEU A 110 3.395 11.126 -12.983 1.00 0.00 C ATOM 1719 CG LEU A 110 4.171 10.323 -11.939 1.00 0.00 C ATOM 1720 CD1 LEU A 110 3.248 9.357 -11.213 1.00 0.00 C ATOM 1721 CD2 LEU A 110 5.324 9.573 -12.591 1.00 0.00 C ATOM 0 H LEU A 110 2.983 13.268 -14.215 1.00 0.00 H new ATOM 0 HA LEU A 110 1.547 11.837 -12.148 1.00 0.00 H new ATOM 0 HB2 LEU A 110 2.767 10.438 -13.549 1.00 0.00 H new ATOM 0 HB3 LEU A 110 4.109 11.557 -13.685 1.00 0.00 H new ATOM 0 HG LEU A 110 4.583 11.018 -11.208 1.00 0.00 H new ATOM 0 HD11 LEU A 110 3.819 8.794 -10.474 1.00 0.00 H new ATOM 0 HD12 LEU A 110 2.457 9.916 -10.712 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.805 8.667 -11.932 1.00 0.00 H new ATOM 0 HD21 LEU A 110 5.865 9.007 -11.833 1.00 0.00 H new ATOM 0 HD22 LEU A 110 4.933 8.889 -13.344 1.00 0.00 H new ATOM 0 HD23 LEU A 110 6.000 10.285 -13.064 1.00 0.00 H new ATOM 1733 N LEU A 111 2.502 12.749 -10.070 1.00 0.00 N ATOM 1734 CA LEU A 111 3.018 13.303 -8.823 1.00 0.00 C ATOM 1735 C LEU A 111 3.989 12.334 -8.157 1.00 0.00 C ATOM 1736 O LEU A 111 4.964 12.748 -7.531 1.00 0.00 O ATOM 1737 CB LEU A 111 1.865 13.624 -7.869 1.00 0.00 C ATOM 1738 CG LEU A 111 0.792 14.570 -8.408 1.00 0.00 C ATOM 1739 CD1 LEU A 111 -0.331 14.735 -7.396 1.00 0.00 C ATOM 1740 CD2 LEU A 111 1.398 15.921 -8.759 1.00 0.00 C ATOM 0 H LEU A 111 1.609 12.264 -9.979 1.00 0.00 H new ATOM 0 HA LEU A 111 3.555 14.222 -9.057 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.385 12.688 -7.583 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.282 14.059 -6.961 1.00 0.00 H new ATOM 0 HG LEU A 111 0.375 14.135 -9.316 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -1.086 15.412 -7.797 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.784 13.765 -7.194 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.071 15.147 -6.470 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.619 16.581 -9.141 1.00 0.00 H new ATOM 0 HD22 LEU A 111 1.843 16.363 -7.867 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.167 15.788 -9.520 1.00 0.00 H new ATOM 1752 N GLY A 112 3.717 11.040 -8.299 1.00 0.00 N ATOM 1753 CA GLY A 112 4.578 10.032 -7.708 1.00 0.00 C ATOM 1754 C GLY A 112 4.040 8.628 -7.898 1.00 0.00 C ATOM 1755 O GLY A 112 2.829 8.425 -7.990 1.00 0.00 O ATOM 0 H GLY A 112 2.916 10.672 -8.813 1.00 0.00 H new ATOM 0 HA2 GLY A 112 5.571 10.101 -8.152 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.691 10.234 -6.643 1.00 0.00 H new ATOM 1759 N LYS A 113 4.942 7.654 -7.958 1.00 0.00 N ATOM 1760 CA LYS A 113 4.553 6.260 -8.138 1.00 0.00 C ATOM 1761 C LYS A 113 5.636 5.321 -7.616 1.00 0.00 C ATOM 1762 O LYS A 113 6.821 5.653 -7.634 1.00 0.00 O ATOM 1763 CB LYS A 113 4.283 5.972 -9.617 1.00 0.00 C ATOM 1764 CG LYS A 113 5.527 6.038 -10.486 1.00 0.00 C ATOM 1765 CD LYS A 113 5.246 5.555 -11.899 1.00 0.00 C ATOM 1766 CE LYS A 113 5.414 4.048 -12.017 1.00 0.00 C ATOM 1767 NZ LYS A 113 6.830 3.667 -12.279 1.00 0.00 N ATOM 0 H LYS A 113 5.948 7.804 -7.885 1.00 0.00 H new ATOM 0 HA LYS A 113 3.641 6.087 -7.567 1.00 0.00 H new ATOM 0 HB2 LYS A 113 3.837 4.982 -9.710 1.00 0.00 H new ATOM 0 HB3 LYS A 113 3.551 6.688 -9.990 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.896 7.063 -10.518 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.315 5.429 -10.042 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.231 5.832 -12.184 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.920 6.053 -12.596 1.00 0.00 H new ATOM 0 HE2 LYS A 113 5.074 3.571 -11.098 1.00 0.00 H new ATOM 0 HE3 LYS A 113 4.782 3.674 -12.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 6.903 2.632 -12.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 7.147 4.101 -13.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 7.430 4.001 -11.498 1.00 0.00 H new ATOM 1781 N VAL A 114 5.221 4.146 -7.153 1.00 0.00 N ATOM 1782 CA VAL A 114 6.155 3.158 -6.628 1.00 0.00 C ATOM 1783 C VAL A 114 5.588 1.748 -6.745 1.00 0.00 C ATOM 1784 O VAL A 114 4.487 1.468 -6.267 1.00 0.00 O ATOM 1785 CB VAL A 114 6.501 3.440 -5.154 1.00 0.00 C ATOM 1786 CG1 VAL A 114 5.263 3.308 -4.280 1.00 0.00 C ATOM 1787 CG2 VAL A 114 7.602 2.504 -4.677 1.00 0.00 C ATOM 0 H VAL A 114 4.244 3.855 -7.131 1.00 0.00 H new ATOM 0 HA VAL A 114 7.063 3.232 -7.227 1.00 0.00 H new ATOM 0 HB VAL A 114 6.866 4.464 -5.074 1.00 0.00 H new ATOM 0 HG11 VAL A 114 5.527 3.511 -3.242 1.00 0.00 H new ATOM 0 HG12 VAL A 114 4.508 4.022 -4.609 1.00 0.00 H new ATOM 0 HG13 VAL A 114 4.866 2.296 -4.362 1.00 0.00 H new ATOM 0 HG21 VAL A 114 7.834 2.717 -3.634 1.00 0.00 H new ATOM 0 HG22 VAL A 114 7.267 1.471 -4.771 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.495 2.653 -5.285 1.00 0.00 H new ATOM 1797 N LEU A 115 6.345 0.862 -7.383 1.00 0.00 N ATOM 1798 CA LEU A 115 5.918 -0.521 -7.562 1.00 0.00 C ATOM 1799 C LEU A 115 6.352 -1.383 -6.381 1.00 0.00 C ATOM 1800 O LEU A 115 7.315 -1.061 -5.685 1.00 0.00 O ATOM 1801 CB LEU A 115 6.493 -1.088 -8.861 1.00 0.00 C ATOM 1802 CG LEU A 115 5.902 -0.531 -10.157 1.00 0.00 C ATOM 1803 CD1 LEU A 115 4.543 -1.153 -10.434 1.00 0.00 C ATOM 1804 CD2 LEU A 115 5.793 0.985 -10.084 1.00 0.00 C ATOM 0 H LEU A 115 7.258 1.077 -7.785 1.00 0.00 H new ATOM 0 HA LEU A 115 4.829 -0.535 -7.617 1.00 0.00 H new ATOM 0 HB2 LEU A 115 7.568 -0.907 -8.868 1.00 0.00 H new ATOM 0 HB3 LEU A 115 6.352 -2.169 -8.856 1.00 0.00 H new ATOM 0 HG LEU A 115 6.570 -0.788 -10.979 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.138 -0.745 -11.360 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.650 -2.233 -10.530 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.865 -0.927 -9.611 1.00 0.00 H new ATOM 0 HD21 LEU A 115 5.371 1.365 -11.014 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.147 1.264 -9.252 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.784 1.414 -9.934 1.00 0.00 H new ATOM 1816 N VAL A 116 5.636 -2.481 -6.162 1.00 0.00 N ATOM 1817 CA VAL A 116 5.949 -3.392 -5.067 1.00 0.00 C ATOM 1818 C VAL A 116 5.930 -4.842 -5.536 1.00 0.00 C ATOM 1819 O VAL A 116 4.870 -5.401 -5.815 1.00 0.00 O ATOM 1820 CB VAL A 116 4.958 -3.228 -3.900 1.00 0.00 C ATOM 1821 CG1 VAL A 116 5.180 -4.311 -2.855 1.00 0.00 C ATOM 1822 CG2 VAL A 116 5.088 -1.844 -3.281 1.00 0.00 C ATOM 0 H VAL A 116 4.835 -2.761 -6.728 1.00 0.00 H new ATOM 0 HA VAL A 116 6.951 -3.139 -4.721 1.00 0.00 H new ATOM 0 HB VAL A 116 3.945 -3.333 -4.289 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.471 -4.179 -2.038 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.032 -5.291 -3.309 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.197 -4.240 -2.468 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.380 -1.746 -2.458 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.102 -1.707 -2.906 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.875 -1.087 -4.035 1.00 0.00 H new ATOM 1832 N ALA A 117 7.111 -5.447 -5.621 1.00 0.00 N ATOM 1833 CA ALA A 117 7.229 -6.833 -6.054 1.00 0.00 C ATOM 1834 C ALA A 117 6.598 -7.781 -5.040 1.00 0.00 C ATOM 1835 O ALA A 117 7.119 -7.965 -3.939 1.00 0.00 O ATOM 1836 CB ALA A 117 8.691 -7.193 -6.278 1.00 0.00 C ATOM 0 H ALA A 117 7.999 -4.998 -5.396 1.00 0.00 H new ATOM 0 HA ALA A 117 6.691 -6.941 -6.996 1.00 0.00 H new ATOM 0 HB1 ALA A 117 8.765 -8.231 -6.601 1.00 0.00 H new ATOM 0 HB2 ALA A 117 9.112 -6.543 -7.045 1.00 0.00 H new ATOM 0 HB3 ALA A 117 9.244 -7.062 -5.348 1.00 0.00 H new ATOM 1842 N LEU A 118 5.474 -8.380 -5.417 1.00 0.00 N ATOM 1843 CA LEU A 118 4.771 -9.309 -4.540 1.00 0.00 C ATOM 1844 C LEU A 118 5.342 -10.718 -4.668 1.00 0.00 C ATOM 1845 O LEU A 118 4.649 -11.704 -4.421 1.00 0.00 O ATOM 1846 CB LEU A 118 3.277 -9.321 -4.868 1.00 0.00 C ATOM 1847 CG LEU A 118 2.660 -7.970 -5.235 1.00 0.00 C ATOM 1848 CD1 LEU A 118 1.287 -8.163 -5.861 1.00 0.00 C ATOM 1849 CD2 LEU A 118 2.568 -7.075 -4.008 1.00 0.00 C ATOM 0 H LEU A 118 5.030 -8.239 -6.324 1.00 0.00 H new ATOM 0 HA LEU A 118 4.908 -8.973 -3.512 1.00 0.00 H new ATOM 0 HB2 LEU A 118 3.113 -10.010 -5.696 1.00 0.00 H new ATOM 0 HB3 LEU A 118 2.740 -9.722 -4.008 1.00 0.00 H new ATOM 0 HG LEU A 118 3.305 -7.484 -5.967 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.863 -7.191 -6.116 1.00 0.00 H new ATOM 0 HD12 LEU A 118 1.380 -8.766 -6.764 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.632 -8.670 -5.152 1.00 0.00 H new ATOM 0 HD21 LEU A 118 2.127 -6.118 -4.288 1.00 0.00 H new ATOM 0 HD22 LEU A 118 1.945 -7.555 -3.253 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.566 -6.910 -3.603 1.00 0.00 H new ATOM 1861 N ALA A 119 6.611 -10.803 -5.054 1.00 0.00 N ATOM 1862 CA ALA A 119 7.277 -12.090 -5.211 1.00 0.00 C ATOM 1863 C ALA A 119 7.893 -12.553 -3.895 1.00 0.00 C ATOM 1864 O ALA A 119 8.881 -13.287 -3.886 1.00 0.00 O ATOM 1865 CB ALA A 119 8.342 -12.005 -6.294 1.00 0.00 C ATOM 0 H ALA A 119 7.198 -9.996 -5.264 1.00 0.00 H new ATOM 0 HA ALA A 119 6.529 -12.824 -5.510 1.00 0.00 H new ATOM 0 HB1 ALA A 119 8.831 -12.973 -6.400 1.00 0.00 H new ATOM 0 HB2 ALA A 119 7.877 -11.727 -7.240 1.00 0.00 H new ATOM 0 HB3 ALA A 119 9.082 -11.253 -6.019 1.00 0.00 H new ATOM 1871 N SER A 120 7.303 -12.119 -2.786 1.00 0.00 N ATOM 1872 CA SER A 120 7.798 -12.486 -1.464 1.00 0.00 C ATOM 1873 C SER A 120 7.079 -13.726 -0.940 1.00 0.00 C ATOM 1874 O SER A 120 5.995 -14.072 -1.409 1.00 0.00 O ATOM 1875 CB SER A 120 7.613 -11.324 -0.487 1.00 0.00 C ATOM 1876 OG SER A 120 8.488 -10.253 -0.796 1.00 0.00 O ATOM 0 H SER A 120 6.482 -11.513 -2.776 1.00 0.00 H new ATOM 0 HA SER A 120 8.861 -12.713 -1.550 1.00 0.00 H new ATOM 0 HB2 SER A 120 6.581 -10.976 -0.522 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.799 -11.667 0.531 1.00 0.00 H new ATOM 0 HG SER A 120 8.349 -9.522 -0.158 1.00 0.00 H new ATOM 1882 N GLU A 121 7.692 -14.389 0.036 1.00 0.00 N ATOM 1883 CA GLU A 121 7.111 -15.591 0.623 1.00 0.00 C ATOM 1884 C GLU A 121 6.454 -15.278 1.965 1.00 0.00 C ATOM 1885 O GLU A 121 5.651 -16.060 2.472 1.00 0.00 O ATOM 1886 CB GLU A 121 8.184 -16.666 0.807 1.00 0.00 C ATOM 1887 CG GLU A 121 7.685 -17.908 1.524 1.00 0.00 C ATOM 1888 CD GLU A 121 8.800 -18.884 1.846 1.00 0.00 C ATOM 1889 OE1 GLU A 121 9.642 -18.558 2.708 1.00 0.00 O ATOM 1890 OE2 GLU A 121 8.830 -19.973 1.236 1.00 0.00 O ATOM 0 H GLU A 121 8.589 -14.115 0.436 1.00 0.00 H new ATOM 0 HA GLU A 121 6.347 -15.964 -0.059 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.571 -16.952 -0.171 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.017 -16.243 1.368 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.187 -17.614 2.448 1.00 0.00 H new ATOM 0 HG3 GLU A 121 6.939 -18.406 0.904 1.00 0.00 H new ATOM 1897 N GLU A 122 6.803 -14.128 2.534 1.00 0.00 N ATOM 1898 CA GLU A 122 6.248 -13.712 3.817 1.00 0.00 C ATOM 1899 C GLU A 122 4.997 -12.862 3.619 1.00 0.00 C ATOM 1900 O GLU A 122 4.801 -11.856 4.303 1.00 0.00 O ATOM 1901 CB GLU A 122 7.290 -12.928 4.617 1.00 0.00 C ATOM 1902 CG GLU A 122 8.329 -13.808 5.291 1.00 0.00 C ATOM 1903 CD GLU A 122 7.854 -14.356 6.623 1.00 0.00 C ATOM 1904 OE1 GLU A 122 6.931 -15.197 6.622 1.00 0.00 O ATOM 1905 OE2 GLU A 122 8.404 -13.943 7.665 1.00 0.00 O ATOM 0 H GLU A 122 7.467 -13.469 2.127 1.00 0.00 H new ATOM 0 HA GLU A 122 5.972 -14.608 4.373 1.00 0.00 H new ATOM 0 HB2 GLU A 122 7.796 -12.228 3.951 1.00 0.00 H new ATOM 0 HB3 GLU A 122 6.781 -12.334 5.377 1.00 0.00 H new ATOM 0 HG2 GLU A 122 8.581 -14.637 4.630 1.00 0.00 H new ATOM 0 HG3 GLU A 122 9.242 -13.233 5.444 1.00 0.00 H new ATOM 1912 N LEU A 123 4.153 -13.272 2.678 1.00 0.00 N ATOM 1913 CA LEU A 123 2.920 -12.548 2.389 1.00 0.00 C ATOM 1914 C LEU A 123 1.813 -12.949 3.358 1.00 0.00 C ATOM 1915 O LEU A 123 1.181 -12.096 3.982 1.00 0.00 O ATOM 1916 CB LEU A 123 2.474 -12.816 0.950 1.00 0.00 C ATOM 1917 CG LEU A 123 3.016 -11.855 -0.110 1.00 0.00 C ATOM 1918 CD1 LEU A 123 2.756 -12.400 -1.506 1.00 0.00 C ATOM 1919 CD2 LEU A 123 2.394 -10.476 0.052 1.00 0.00 C ATOM 0 H LEU A 123 4.300 -14.101 2.103 1.00 0.00 H new ATOM 0 HA LEU A 123 3.116 -11.483 2.511 1.00 0.00 H new ATOM 0 HB2 LEU A 123 2.773 -13.829 0.681 1.00 0.00 H new ATOM 0 HB3 LEU A 123 1.385 -12.786 0.917 1.00 0.00 H new ATOM 0 HG LEU A 123 4.093 -11.763 0.027 1.00 0.00 H new ATOM 0 HD11 LEU A 123 3.148 -11.704 -2.247 1.00 0.00 H new ATOM 0 HD12 LEU A 123 3.250 -13.365 -1.618 1.00 0.00 H new ATOM 0 HD13 LEU A 123 1.683 -12.522 -1.655 1.00 0.00 H new ATOM 0 HD21 LEU A 123 2.791 -9.806 -0.710 1.00 0.00 H new ATOM 0 HD22 LEU A 123 1.312 -10.550 -0.058 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.632 -10.083 1.040 1.00 0.00 H new ATOM 1931 N ALA A 124 1.585 -14.252 3.482 1.00 0.00 N ATOM 1932 CA ALA A 124 0.557 -14.766 4.379 1.00 0.00 C ATOM 1933 C ALA A 124 0.539 -13.994 5.693 1.00 0.00 C ATOM 1934 O ALA A 124 -0.525 -13.677 6.225 1.00 0.00 O ATOM 1935 CB ALA A 124 0.777 -16.249 4.639 1.00 0.00 C ATOM 0 H ALA A 124 2.098 -14.971 2.973 1.00 0.00 H new ATOM 0 HA ALA A 124 -0.411 -14.632 3.896 1.00 0.00 H new ATOM 0 HB1 ALA A 124 0.002 -16.620 5.310 1.00 0.00 H new ATOM 0 HB2 ALA A 124 0.732 -16.794 3.696 1.00 0.00 H new ATOM 0 HB3 ALA A 124 1.755 -16.397 5.097 1.00 0.00 H new ATOM 1941 N LYS A 125 1.724 -13.693 6.214 1.00 0.00 N ATOM 1942 CA LYS A 125 1.846 -12.957 7.466 1.00 0.00 C ATOM 1943 C LYS A 125 1.460 -11.494 7.277 1.00 0.00 C ATOM 1944 O LYS A 125 0.721 -10.927 8.081 1.00 0.00 O ATOM 1945 CB LYS A 125 3.277 -13.053 8.001 1.00 0.00 C ATOM 1946 CG LYS A 125 3.503 -14.238 8.924 1.00 0.00 C ATOM 1947 CD LYS A 125 4.983 -14.544 9.085 1.00 0.00 C ATOM 1948 CE LYS A 125 5.641 -13.604 10.082 1.00 0.00 C ATOM 1949 NZ LYS A 125 7.122 -13.766 10.104 1.00 0.00 N ATOM 0 H LYS A 125 2.615 -13.948 5.787 1.00 0.00 H new ATOM 0 HA LYS A 125 1.164 -13.404 8.189 1.00 0.00 H new ATOM 0 HB2 LYS A 125 3.967 -13.122 7.160 1.00 0.00 H new ATOM 0 HB3 LYS A 125 3.518 -12.135 8.537 1.00 0.00 H new ATOM 0 HG2 LYS A 125 3.065 -14.029 9.900 1.00 0.00 H new ATOM 0 HG3 LYS A 125 2.990 -15.114 8.526 1.00 0.00 H new ATOM 0 HD2 LYS A 125 5.108 -15.574 9.417 1.00 0.00 H new ATOM 0 HD3 LYS A 125 5.481 -14.458 8.119 1.00 0.00 H new ATOM 0 HE2 LYS A 125 5.392 -12.574 9.828 1.00 0.00 H new ATOM 0 HE3 LYS A 125 5.240 -13.793 11.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 7.560 -12.903 10.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 7.374 -14.576 10.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 7.467 -13.932 9.137 1.00 0.00 H new ATOM 1963 N GLY A 126 1.963 -10.887 6.206 1.00 0.00 N ATOM 1964 CA GLY A 126 1.658 -9.495 5.930 1.00 0.00 C ATOM 1965 C GLY A 126 2.676 -8.548 6.534 1.00 0.00 C ATOM 1966 O GLY A 126 3.316 -8.870 7.535 1.00 0.00 O ATOM 0 H GLY A 126 2.576 -11.334 5.525 1.00 0.00 H new ATOM 0 HA2 GLY A 126 1.619 -9.342 4.852 1.00 0.00 H new ATOM 0 HA3 GLY A 126 0.669 -9.258 6.322 1.00 0.00 H new ATOM 1970 N TRP A 127 2.827 -7.378 5.924 1.00 0.00 N ATOM 1971 CA TRP A 127 3.777 -6.381 6.407 1.00 0.00 C ATOM 1972 C TRP A 127 3.271 -4.970 6.132 1.00 0.00 C ATOM 1973 O TRP A 127 2.414 -4.762 5.272 1.00 0.00 O ATOM 1974 CB TRP A 127 5.141 -6.585 5.747 1.00 0.00 C ATOM 1975 CG TRP A 127 5.171 -6.177 4.305 1.00 0.00 C ATOM 1976 CD1 TRP A 127 5.331 -4.913 3.814 1.00 0.00 C ATOM 1977 CD2 TRP A 127 5.035 -7.037 3.168 1.00 0.00 C ATOM 1978 NE1 TRP A 127 5.303 -4.935 2.441 1.00 0.00 N ATOM 1979 CE2 TRP A 127 5.123 -6.226 2.020 1.00 0.00 C ATOM 1980 CE3 TRP A 127 4.849 -8.412 3.009 1.00 0.00 C ATOM 1981 CZ2 TRP A 127 5.030 -6.747 0.732 1.00 0.00 C ATOM 1982 CZ3 TRP A 127 4.757 -8.928 1.730 1.00 0.00 C ATOM 1983 CH2 TRP A 127 4.848 -8.097 0.605 1.00 0.00 C ATOM 0 H TRP A 127 2.305 -7.096 5.095 1.00 0.00 H new ATOM 0 HA TRP A 127 3.881 -6.506 7.485 1.00 0.00 H new ATOM 0 HB2 TRP A 127 5.890 -6.013 6.294 1.00 0.00 H new ATOM 0 HB3 TRP A 127 5.421 -7.635 5.826 1.00 0.00 H new ATOM 0 HD1 TRP A 127 5.461 -4.026 4.417 1.00 0.00 H new ATOM 0 HE1 TRP A 127 5.400 -4.122 1.833 1.00 0.00 H new ATOM 0 HE3 TRP A 127 4.778 -9.060 3.870 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 5.099 -6.108 -0.136 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 4.613 -9.990 1.595 1.00 0.00 H new ATOM 0 HH2 TRP A 127 4.773 -8.531 -0.381 1.00 0.00 H new ATOM 1994 N THR A 128 3.807 -4.000 6.866 1.00 0.00 N ATOM 1995 CA THR A 128 3.409 -2.607 6.702 1.00 0.00 C ATOM 1996 C THR A 128 4.625 -1.691 6.644 1.00 0.00 C ATOM 1997 O THR A 128 5.509 -1.764 7.497 1.00 0.00 O ATOM 1998 CB THR A 128 2.487 -2.147 7.847 1.00 0.00 C ATOM 1999 OG1 THR A 128 1.313 -2.964 7.890 1.00 0.00 O ATOM 2000 CG2 THR A 128 2.091 -0.689 7.670 1.00 0.00 C ATOM 0 H THR A 128 4.519 -4.154 7.581 1.00 0.00 H new ATOM 0 HA THR A 128 2.865 -2.543 5.760 1.00 0.00 H new ATOM 0 HB THR A 128 3.032 -2.248 8.785 1.00 0.00 H new ATOM 0 HG1 THR A 128 0.733 -2.665 8.622 1.00 0.00 H new ATOM 0 HG21 THR A 128 1.440 -0.387 8.490 1.00 0.00 H new ATOM 0 HG22 THR A 128 2.986 -0.067 7.668 1.00 0.00 H new ATOM 0 HG23 THR A 128 1.563 -0.568 6.724 1.00 0.00 H new ATOM 2008 N GLN A 129 4.663 -0.829 5.633 1.00 0.00 N ATOM 2009 CA GLN A 129 5.773 0.102 5.465 1.00 0.00 C ATOM 2010 C GLN A 129 5.414 1.204 4.474 1.00 0.00 C ATOM 2011 O GLN A 129 4.453 1.080 3.714 1.00 0.00 O ATOM 2012 CB GLN A 129 7.022 -0.641 4.989 1.00 0.00 C ATOM 2013 CG GLN A 129 7.004 -0.973 3.505 1.00 0.00 C ATOM 2014 CD GLN A 129 8.252 -1.707 3.056 1.00 0.00 C ATOM 2015 OE1 GLN A 129 9.365 -1.196 3.180 1.00 0.00 O ATOM 2016 NE2 GLN A 129 8.073 -2.913 2.531 1.00 0.00 N ATOM 0 H GLN A 129 3.939 -0.756 4.918 1.00 0.00 H new ATOM 0 HA GLN A 129 5.979 0.561 6.432 1.00 0.00 H new ATOM 0 HB2 GLN A 129 7.901 -0.034 5.206 1.00 0.00 H new ATOM 0 HB3 GLN A 129 7.124 -1.565 5.558 1.00 0.00 H new ATOM 0 HG2 GLN A 129 6.129 -1.584 3.284 1.00 0.00 H new ATOM 0 HG3 GLN A 129 6.903 -0.052 2.932 1.00 0.00 H new ATOM 0 HE21 GLN A 129 7.132 -3.298 2.447 1.00 0.00 H new ATOM 0 HE22 GLN A 129 8.876 -3.454 2.211 1.00 0.00 H new ATOM 2025 N TRP A 130 6.190 2.282 4.488 1.00 0.00 N ATOM 2026 CA TRP A 130 5.953 3.406 3.590 1.00 0.00 C ATOM 2027 C TRP A 130 6.786 3.274 2.320 1.00 0.00 C ATOM 2028 O TRP A 130 8.010 3.151 2.380 1.00 0.00 O ATOM 2029 CB TRP A 130 6.278 4.725 4.294 1.00 0.00 C ATOM 2030 CG TRP A 130 5.308 5.073 5.382 1.00 0.00 C ATOM 2031 CD1 TRP A 130 5.350 4.655 6.682 1.00 0.00 C ATOM 2032 CD2 TRP A 130 4.152 5.908 5.265 1.00 0.00 C ATOM 2033 NE1 TRP A 130 4.289 5.181 7.379 1.00 0.00 N ATOM 2034 CE2 TRP A 130 3.540 5.954 6.533 1.00 0.00 C ATOM 2035 CE3 TRP A 130 3.575 6.624 4.213 1.00 0.00 C ATOM 2036 CZ2 TRP A 130 2.380 6.685 6.773 1.00 0.00 C ATOM 2037 CZ3 TRP A 130 2.423 7.350 4.453 1.00 0.00 C ATOM 2038 CH2 TRP A 130 1.836 7.377 5.725 1.00 0.00 C ATOM 0 H TRP A 130 6.989 2.401 5.111 1.00 0.00 H new ATOM 0 HA TRP A 130 4.899 3.401 3.312 1.00 0.00 H new ATOM 0 HB2 TRP A 130 7.281 4.665 4.717 1.00 0.00 H new ATOM 0 HB3 TRP A 130 6.290 5.528 3.557 1.00 0.00 H new ATOM 0 HD1 TRP A 130 6.106 4.007 7.100 1.00 0.00 H new ATOM 0 HE1 TRP A 130 4.091 5.021 8.367 1.00 0.00 H new ATOM 0 HE3 TRP A 130 4.021 6.611 3.230 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 1.925 6.705 7.752 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 1.968 7.906 3.646 1.00 0.00 H new ATOM 0 HH2 TRP A 130 0.937 7.955 5.881 1.00 0.00 H new ATOM 2049 N TYR A 131 6.117 3.301 1.173 1.00 0.00 N ATOM 2050 CA TYR A 131 6.796 3.182 -0.111 1.00 0.00 C ATOM 2051 C TYR A 131 7.083 4.557 -0.706 1.00 0.00 C ATOM 2052 O TYR A 131 6.197 5.198 -1.272 1.00 0.00 O ATOM 2053 CB TYR A 131 5.951 2.359 -1.085 1.00 0.00 C ATOM 2054 CG TYR A 131 5.614 0.976 -0.575 1.00 0.00 C ATOM 2055 CD1 TYR A 131 6.610 0.121 -0.119 1.00 0.00 C ATOM 2056 CD2 TYR A 131 4.300 0.524 -0.549 1.00 0.00 C ATOM 2057 CE1 TYR A 131 6.307 -1.144 0.347 1.00 0.00 C ATOM 2058 CE2 TYR A 131 3.988 -0.739 -0.084 1.00 0.00 C ATOM 2059 CZ TYR A 131 4.995 -1.569 0.362 1.00 0.00 C ATOM 2060 OH TYR A 131 4.689 -2.828 0.827 1.00 0.00 O ATOM 0 H TYR A 131 5.104 3.404 1.106 1.00 0.00 H new ATOM 0 HA TYR A 131 7.745 2.673 0.056 1.00 0.00 H new ATOM 0 HB2 TYR A 131 5.025 2.896 -1.293 1.00 0.00 H new ATOM 0 HB3 TYR A 131 6.486 2.268 -2.030 1.00 0.00 H new ATOM 0 HD1 TYR A 131 7.638 0.451 -0.129 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.509 1.171 -0.898 1.00 0.00 H new ATOM 0 HE1 TYR A 131 7.093 -1.796 0.698 1.00 0.00 H new ATOM 0 HE2 TYR A 131 2.961 -1.074 -0.070 1.00 0.00 H new ATOM 0 HH TYR A 131 3.791 -2.822 1.220 1.00 0.00 H new ATOM 2070 N ASP A 132 8.326 5.004 -0.573 1.00 0.00 N ATOM 2071 CA ASP A 132 8.732 6.303 -1.098 1.00 0.00 C ATOM 2072 C ASP A 132 8.456 6.394 -2.595 1.00 0.00 C ATOM 2073 O ASP A 132 9.048 5.665 -3.392 1.00 0.00 O ATOM 2074 CB ASP A 132 10.218 6.546 -0.825 1.00 0.00 C ATOM 2075 CG ASP A 132 11.111 5.881 -1.853 1.00 0.00 C ATOM 2076 OD1 ASP A 132 11.285 6.456 -2.949 1.00 0.00 O ATOM 2077 OD2 ASP A 132 11.638 4.787 -1.563 1.00 0.00 O ATOM 0 H ASP A 132 9.071 4.486 -0.106 1.00 0.00 H new ATOM 0 HA ASP A 132 8.147 7.071 -0.591 1.00 0.00 H new ATOM 0 HB2 ASP A 132 10.413 7.618 -0.818 1.00 0.00 H new ATOM 0 HB3 ASP A 132 10.468 6.170 0.167 1.00 0.00 H new ATOM 2082 N LEU A 133 7.553 7.293 -2.971 1.00 0.00 N ATOM 2083 CA LEU A 133 7.197 7.479 -4.374 1.00 0.00 C ATOM 2084 C LEU A 133 8.396 7.971 -5.179 1.00 0.00 C ATOM 2085 O LEU A 133 9.202 8.765 -4.692 1.00 0.00 O ATOM 2086 CB LEU A 133 6.041 8.473 -4.499 1.00 0.00 C ATOM 2087 CG LEU A 133 4.685 7.993 -3.982 1.00 0.00 C ATOM 2088 CD1 LEU A 133 3.741 9.170 -3.787 1.00 0.00 C ATOM 2089 CD2 LEU A 133 4.079 6.975 -4.937 1.00 0.00 C ATOM 0 H LEU A 133 7.054 7.904 -2.325 1.00 0.00 H new ATOM 0 HA LEU A 133 6.884 6.515 -4.776 1.00 0.00 H new ATOM 0 HB2 LEU A 133 6.311 9.383 -3.962 1.00 0.00 H new ATOM 0 HB3 LEU A 133 5.932 8.743 -5.549 1.00 0.00 H new ATOM 0 HG LEU A 133 4.837 7.510 -3.017 1.00 0.00 H new ATOM 0 HD11 LEU A 133 2.781 8.809 -3.419 1.00 0.00 H new ATOM 0 HD12 LEU A 133 4.169 9.864 -3.064 1.00 0.00 H new ATOM 0 HD13 LEU A 133 3.596 9.681 -4.739 1.00 0.00 H new ATOM 0 HD21 LEU A 133 3.114 6.645 -4.552 1.00 0.00 H new ATOM 0 HD22 LEU A 133 3.942 7.432 -5.917 1.00 0.00 H new ATOM 0 HD23 LEU A 133 4.746 6.118 -5.027 1.00 0.00 H new ATOM 2101 N THR A 134 8.506 7.497 -6.416 1.00 0.00 N ATOM 2102 CA THR A 134 9.605 7.889 -7.290 1.00 0.00 C ATOM 2103 C THR A 134 9.093 8.302 -8.665 1.00 0.00 C ATOM 2104 O THR A 134 7.992 7.926 -9.066 1.00 0.00 O ATOM 2105 CB THR A 134 10.625 6.747 -7.456 1.00 0.00 C ATOM 2106 OG1 THR A 134 9.996 5.612 -8.062 1.00 0.00 O ATOM 2107 CG2 THR A 134 11.215 6.348 -6.112 1.00 0.00 C ATOM 0 H THR A 134 7.847 6.841 -6.835 1.00 0.00 H new ATOM 0 HA THR A 134 10.097 8.740 -6.818 1.00 0.00 H new ATOM 0 HB THR A 134 11.431 7.101 -8.098 1.00 0.00 H new ATOM 0 HG1 THR A 134 9.024 5.733 -8.052 1.00 0.00 H new ATOM 0 HG21 THR A 134 11.932 5.540 -6.255 1.00 0.00 H new ATOM 0 HG22 THR A 134 11.719 7.206 -5.667 1.00 0.00 H new ATOM 0 HG23 THR A 134 10.417 6.012 -5.450 1.00 0.00 H new ATOM 2115 N GLU A 135 9.900 9.077 -9.383 1.00 0.00 N ATOM 2116 CA GLU A 135 9.527 9.540 -10.714 1.00 0.00 C ATOM 2117 C GLU A 135 9.562 8.393 -11.720 1.00 0.00 C ATOM 2118 O GLU A 135 10.284 7.413 -11.535 1.00 0.00 O ATOM 2119 CB GLU A 135 10.464 10.661 -11.170 1.00 0.00 C ATOM 2120 CG GLU A 135 10.473 11.862 -10.239 1.00 0.00 C ATOM 2121 CD GLU A 135 11.305 13.011 -10.777 1.00 0.00 C ATOM 2122 OE1 GLU A 135 10.758 13.832 -11.542 1.00 0.00 O ATOM 2123 OE2 GLU A 135 12.502 13.088 -10.432 1.00 0.00 O ATOM 0 H GLU A 135 10.815 9.397 -9.066 1.00 0.00 H new ATOM 0 HA GLU A 135 8.508 9.925 -10.664 1.00 0.00 H new ATOM 0 HB2 GLU A 135 11.477 10.266 -11.250 1.00 0.00 H new ATOM 0 HB3 GLU A 135 10.169 10.987 -12.167 1.00 0.00 H new ATOM 0 HG2 GLU A 135 9.450 12.202 -10.081 1.00 0.00 H new ATOM 0 HG3 GLU A 135 10.862 11.560 -9.267 1.00 0.00 H new ATOM 2130 N ASP A 136 8.778 8.523 -12.784 1.00 0.00 N ATOM 2131 CA ASP A 136 8.719 7.498 -13.820 1.00 0.00 C ATOM 2132 C ASP A 136 10.093 7.278 -14.445 1.00 0.00 C ATOM 2133 O ASP A 136 10.844 8.227 -14.667 1.00 0.00 O ATOM 2134 CB ASP A 136 7.711 7.892 -14.900 1.00 0.00 C ATOM 2135 CG ASP A 136 7.377 6.741 -15.829 1.00 0.00 C ATOM 2136 OD1 ASP A 136 8.209 6.425 -16.704 1.00 0.00 O ATOM 2137 OD2 ASP A 136 6.283 6.156 -15.680 1.00 0.00 O ATOM 0 H ASP A 136 8.174 9.328 -12.952 1.00 0.00 H new ATOM 0 HA ASP A 136 8.397 6.566 -13.356 1.00 0.00 H new ATOM 0 HB2 ASP A 136 6.797 8.250 -14.426 1.00 0.00 H new ATOM 0 HB3 ASP A 136 8.113 8.721 -15.483 1.00 0.00 H new ATOM 2142 N SER A 137 10.415 6.019 -14.726 1.00 0.00 N ATOM 2143 CA SER A 137 11.701 5.673 -15.321 1.00 0.00 C ATOM 2144 C SER A 137 11.511 5.051 -16.701 1.00 0.00 C ATOM 2145 O SER A 137 10.796 4.062 -16.855 1.00 0.00 O ATOM 2146 CB SER A 137 12.463 4.706 -14.413 1.00 0.00 C ATOM 2147 OG SER A 137 12.682 5.273 -13.133 1.00 0.00 O ATOM 0 H SER A 137 9.803 5.222 -14.551 1.00 0.00 H new ATOM 0 HA SER A 137 12.281 6.589 -15.432 1.00 0.00 H new ATOM 0 HB2 SER A 137 11.900 3.778 -14.312 1.00 0.00 H new ATOM 0 HB3 SER A 137 13.419 4.451 -14.870 1.00 0.00 H new ATOM 0 HG SER A 137 13.169 4.635 -12.571 1.00 0.00 H new ATOM 2153 N GLY A 138 12.158 5.639 -17.702 1.00 0.00 N ATOM 2154 CA GLY A 138 12.048 5.130 -19.057 1.00 0.00 C ATOM 2155 C GLY A 138 12.546 6.120 -20.091 1.00 0.00 C ATOM 2156 O GLY A 138 11.765 6.753 -20.802 1.00 0.00 O ATOM 0 H GLY A 138 12.756 6.459 -17.599 1.00 0.00 H new ATOM 0 HA2 GLY A 138 12.617 4.204 -19.141 1.00 0.00 H new ATOM 0 HA3 GLY A 138 11.007 4.884 -19.266 1.00 0.00 H new ATOM 2160 N PRO A 139 13.876 6.267 -20.183 1.00 0.00 N ATOM 2161 CA PRO A 139 14.507 7.187 -21.134 1.00 0.00 C ATOM 2162 C PRO A 139 14.360 6.720 -22.578 1.00 0.00 C ATOM 2163 O PRO A 139 15.178 5.946 -23.075 1.00 0.00 O ATOM 2164 CB PRO A 139 15.979 7.176 -20.715 1.00 0.00 C ATOM 2165 CG PRO A 139 16.171 5.860 -20.043 1.00 0.00 C ATOM 2166 CD PRO A 139 14.866 5.546 -19.366 1.00 0.00 C ATOM 0 HA PRO A 139 14.050 8.176 -21.108 1.00 0.00 H new ATOM 0 HB2 PRO A 139 16.637 7.280 -21.578 1.00 0.00 H new ATOM 0 HB3 PRO A 139 16.205 8.002 -20.040 1.00 0.00 H new ATOM 0 HG2 PRO A 139 16.431 5.087 -20.766 1.00 0.00 H new ATOM 0 HG3 PRO A 139 16.985 5.907 -19.319 1.00 0.00 H new ATOM 0 HD2 PRO A 139 14.669 4.474 -19.350 1.00 0.00 H new ATOM 0 HD3 PRO A 139 14.858 5.887 -18.331 1.00 0.00 H new ATOM 2174 N SER A 140 13.313 7.194 -23.245 1.00 0.00 N ATOM 2175 CA SER A 140 13.058 6.822 -24.632 1.00 0.00 C ATOM 2176 C SER A 140 13.152 5.310 -24.814 1.00 0.00 C ATOM 2177 O SER A 140 13.731 4.826 -25.786 1.00 0.00 O ATOM 2178 CB SER A 140 14.051 7.522 -25.561 1.00 0.00 C ATOM 2179 OG SER A 140 13.792 8.913 -25.630 1.00 0.00 O ATOM 0 H SER A 140 12.627 7.836 -22.848 1.00 0.00 H new ATOM 0 HA SER A 140 12.047 7.139 -24.888 1.00 0.00 H new ATOM 0 HB2 SER A 140 15.067 7.356 -25.204 1.00 0.00 H new ATOM 0 HB3 SER A 140 13.989 7.087 -26.559 1.00 0.00 H new ATOM 0 HG SER A 140 14.441 9.337 -26.229 1.00 0.00 H new ATOM 2185 N SER A 141 12.577 4.570 -23.871 1.00 0.00 N ATOM 2186 CA SER A 141 12.599 3.113 -23.924 1.00 0.00 C ATOM 2187 C SER A 141 11.517 2.520 -23.027 1.00 0.00 C ATOM 2188 O SER A 141 11.435 2.838 -21.841 1.00 0.00 O ATOM 2189 CB SER A 141 13.972 2.586 -23.502 1.00 0.00 C ATOM 2190 OG SER A 141 14.854 2.519 -24.609 1.00 0.00 O ATOM 0 H SER A 141 12.090 4.955 -23.062 1.00 0.00 H new ATOM 0 HA SER A 141 12.401 2.809 -24.952 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.394 3.235 -22.735 1.00 0.00 H new ATOM 0 HB3 SER A 141 13.865 1.596 -23.058 1.00 0.00 H new ATOM 0 HG SER A 141 14.666 3.260 -25.222 1.00 0.00 H new ATOM 2196 N GLY A 142 10.686 1.656 -23.603 1.00 0.00 N ATOM 2197 CA GLY A 142 9.620 1.032 -22.842 1.00 0.00 C ATOM 2198 C GLY A 142 8.274 1.143 -23.531 1.00 0.00 C ATOM 2199 O GLY A 142 7.230 1.039 -22.889 1.00 0.00 O ATOM 0 H GLY A 142 10.732 1.377 -24.583 1.00 0.00 H new ATOM 0 HA2 GLY A 142 9.858 -0.020 -22.684 1.00 0.00 H new ATOM 0 HA3 GLY A 142 9.560 1.497 -21.858 1.00 0.00 H new TER 2203 GLY A 142