USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1166 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 83 HIS : +bothHN:sc= 1.19 K(o=-0.97,f=-7.1!) USER MOD Set 1.2: A 86 THR OG1 : rot -168:sc= -2.16! USER MOD Set 2.1: A 25 CYS SG : rot 88:sc= 1.96 USER MOD Set 2.2: A 81 HIS : +bothHN:sc= 1.4 K(o=3.4,f=-10!) USER MOD Set 3.1: A 1 MET CE :methyl 149:sc= -0.632 (180deg=-2.35!) USER MOD Set 3.2: A 3 THR OG1 : rot -171:sc= -0.122 USER MOD Single : A 1 MET N :NH3+ -175:sc= 0.757 (180deg=0.715) USER MOD Single : A 5 THR OG1 : rot 180:sc= -3.34! USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ -147:sc= 1.24 (180deg=-0.51) USER MOD Single : A 8 GLN : amide:sc= -0.476 K(o=-0.48,f=-5.1!) USER MOD Single : A 9 MET CE :methyl -162:sc= -0.12 (180deg=-0.772) USER MOD Single : A 12 MET CE :methyl 174:sc= -2.03 (180deg=-2.18!) USER MOD Single : A 15 HIS : no HD1:sc= -3.87! C(o=-3.9!,f=-6.5!) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 43 TYR OH : rot -77:sc= 1.2 USER MOD Single : A 46 ASN : amide:sc= -0.123 K(o=-0.12,f=-1.7) USER MOD Single : A 47 ASN : amide:sc= 0.724 K(o=0.72,f=-3.8!) USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 51 SER OG : rot 135:sc= 1.27 USER MOD Single : A 54 HIS : no HD1:sc= -0.345 X(o=-0.34,f=0) USER MOD Single : A 56 SER OG : rot 119:sc= 1.21 USER MOD Single : A 57 MET CE :methyl -158:sc= -0.203 (180deg=-0.875) USER MOD Single : A 62 GLN :FLIP amide:sc= -0.66 F(o=-1.7!,f=-0.66) USER MOD Single : A 64 THR OG1 : rot 71:sc= 1.12 USER MOD Single : A 67 LYS NZ :NH3+ -168:sc= -0.0211 (180deg=-0.152) USER MOD Single : A 69 MET CE :methyl 158:sc= -0.655 (180deg=-2.28!) USER MOD Single : A 71 LYS NZ :NH3+ 136:sc= 1.09 (180deg=-0.273) USER MOD Single : A 72 ASN : amide:sc= -0.0533 X(o=-0.053,f=0) USER MOD Single : A 76 MET CE :methyl 164:sc= -0.0529 (180deg=-0.426) USER MOD Single : A 79 ASN : amide:sc= -0.158 K(o=-0.16,f=-2.4!) USER MOD Single : A 82 SER OG : rot 31:sc= 0.122 USER MOD Single : A 91 SER OG : rot -87:sc= 1.27 USER MOD Single : A 95 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0901) USER MOD Single : A 102 SER OG : rot 70:sc= 1.32 USER MOD Single : A 104 SER OG : rot 76:sc= 0.315 USER MOD Single : A 105 TYR OH : rot -15:sc= 1.05 USER MOD Single : A 109 SER OG : rot 180:sc= -0.0085 USER MOD Single : A 114 GLN : amide:sc= 0.453 X(o=0.45,f=-0.013) USER MOD Single : A 115 LYS NZ :NH3+ -132:sc= -0.613 (180deg=-2.67!) USER MOD Single : A 118 CYS SG : rot 47:sc= -0.22 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 1.21 (180deg=1.21) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 124 LYS NZ :NH3+ 175:sc= 1.06 (180deg=1.03) USER MOD Single : A 125 LYS NZ :NH3+ 160:sc= -0.0944 (180deg=-0.529) USER MOD Single : A 136 LYS NZ :NH3+ 166:sc= 1.12 (180deg=0.926) USER MOD Single : A 141 HIS : no HD1:sc= 0 X(o=0,f=-0.0088) USER MOD Single : A 142 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 143 HIS : no HD1:sc= 0.806 K(o=0.81,f=-5.1!) USER MOD Single : A 144 HIS : no HD1:sc= -0.0838 X(o=-0.084,f=-0.033) USER MOD Single : A 145 HIS : +bothHN:sc= 0.416 K(o=0.42,f=-4.7!) USER MOD Single : A 146 HIS : no HE2:sc= -0.065 K(o=-0.065,f=-3.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.803 -2.218 5.078 1.00 0.00 N ATOM 2 CA MET A 1 -13.433 -2.472 3.670 1.00 0.00 C ATOM 3 C MET A 1 -12.327 -1.510 3.262 1.00 0.00 C ATOM 4 O MET A 1 -12.056 -0.543 3.972 1.00 0.00 O ATOM 5 CB MET A 1 -14.655 -2.294 2.754 1.00 0.00 C ATOM 6 CG MET A 1 -14.873 -0.863 2.273 1.00 0.00 C ATOM 7 SD MET A 1 -15.025 0.331 3.618 1.00 0.00 S ATOM 8 CE MET A 1 -14.889 1.867 2.703 1.00 0.00 C ATOM 0 H1 MET A 1 -14.498 -2.927 5.388 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.955 -2.280 5.676 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.217 -1.268 5.162 1.00 0.00 H new ATOM 0 HA MET A 1 -13.078 -3.498 3.571 1.00 0.00 H new ATOM 0 HB2 MET A 1 -14.542 -2.944 1.886 1.00 0.00 H new ATOM 0 HB3 MET A 1 -15.546 -2.626 3.287 1.00 0.00 H new ATOM 0 HG2 MET A 1 -14.041 -0.573 1.632 1.00 0.00 H new ATOM 0 HG3 MET A 1 -15.774 -0.827 1.661 1.00 0.00 H new ATOM 0 HE1 MET A 1 -15.474 2.640 3.201 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.844 2.174 2.660 1.00 0.00 H new ATOM 0 HE3 MET A 1 -15.266 1.722 1.691 1.00 0.00 H new ATOM 20 N ILE A 2 -11.687 -1.767 2.132 1.00 0.00 N ATOM 21 CA ILE A 2 -10.694 -0.846 1.611 1.00 0.00 C ATOM 22 C ILE A 2 -11.121 -0.343 0.235 1.00 0.00 C ATOM 23 O ILE A 2 -11.424 -1.129 -0.662 1.00 0.00 O ATOM 24 CB ILE A 2 -9.279 -1.482 1.552 1.00 0.00 C ATOM 25 CG1 ILE A 2 -8.265 -0.494 0.969 1.00 0.00 C ATOM 26 CG2 ILE A 2 -9.289 -2.777 0.753 1.00 0.00 C ATOM 27 CD1 ILE A 2 -6.845 -1.020 0.950 1.00 0.00 C ATOM 0 H ILE A 2 -11.837 -2.600 1.563 1.00 0.00 H new ATOM 0 HA ILE A 2 -10.632 -0.001 2.297 1.00 0.00 H new ATOM 0 HB ILE A 2 -8.978 -1.722 2.572 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -8.562 -0.239 -0.048 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -8.294 0.428 1.550 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -8.284 -3.198 0.730 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -9.970 -3.488 1.221 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -9.621 -2.574 -0.265 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -6.183 -0.266 0.524 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -6.528 -1.248 1.968 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.800 -1.925 0.345 1.00 0.00 H new ATOM 39 N THR A 3 -11.187 0.967 0.086 1.00 0.00 N ATOM 40 CA THR A 3 -11.621 1.564 -1.163 1.00 0.00 C ATOM 41 C THR A 3 -10.517 2.416 -1.778 1.00 0.00 C ATOM 42 O THR A 3 -9.956 3.298 -1.120 1.00 0.00 O ATOM 43 CB THR A 3 -12.883 2.427 -0.954 1.00 0.00 C ATOM 44 OG1 THR A 3 -13.915 1.632 -0.357 1.00 0.00 O ATOM 45 CG2 THR A 3 -13.384 3.004 -2.273 1.00 0.00 C ATOM 0 H THR A 3 -10.945 1.638 0.815 1.00 0.00 H new ATOM 0 HA THR A 3 -11.858 0.749 -1.847 1.00 0.00 H new ATOM 0 HB THR A 3 -12.623 3.256 -0.296 1.00 0.00 H new ATOM 0 HG1 THR A 3 -14.756 2.136 -0.355 1.00 0.00 H new ATOM 0 HG21 THR A 3 -14.274 3.607 -2.092 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.607 3.628 -2.716 1.00 0.00 H new ATOM 0 HG23 THR A 3 -13.630 2.191 -2.956 1.00 0.00 H new ATOM 53 N LEU A 4 -10.205 2.135 -3.034 1.00 0.00 N ATOM 54 CA LEU A 4 -9.229 2.909 -3.778 1.00 0.00 C ATOM 55 C LEU A 4 -9.656 3.010 -5.230 1.00 0.00 C ATOM 56 O LEU A 4 -10.519 2.264 -5.687 1.00 0.00 O ATOM 57 CB LEU A 4 -7.823 2.305 -3.655 1.00 0.00 C ATOM 58 CG LEU A 4 -7.693 0.809 -3.972 1.00 0.00 C ATOM 59 CD1 LEU A 4 -7.456 0.586 -5.457 1.00 0.00 C ATOM 60 CD2 LEU A 4 -6.571 0.189 -3.155 1.00 0.00 C ATOM 0 H LEU A 4 -10.620 1.367 -3.562 1.00 0.00 H new ATOM 0 HA LEU A 4 -9.184 3.912 -3.353 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.156 2.854 -4.319 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -7.468 2.471 -2.638 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.630 0.322 -3.702 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -7.367 -0.482 -5.655 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -8.294 0.992 -6.024 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -6.537 1.088 -5.758 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -6.492 -0.872 -3.392 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.630 0.685 -3.394 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.785 0.309 -2.093 1.00 0.00 H new ATOM 72 N THR A 5 -9.060 3.934 -5.949 1.00 0.00 N ATOM 73 CA THR A 5 -9.454 4.175 -7.322 1.00 0.00 C ATOM 74 C THR A 5 -8.546 3.417 -8.286 1.00 0.00 C ATOM 75 O THR A 5 -7.507 2.880 -7.889 1.00 0.00 O ATOM 76 CB THR A 5 -9.410 5.678 -7.665 1.00 0.00 C ATOM 77 OG1 THR A 5 -8.054 6.129 -7.743 1.00 0.00 O ATOM 78 CG2 THR A 5 -10.150 6.493 -6.615 1.00 0.00 C ATOM 0 H THR A 5 -8.304 4.529 -5.610 1.00 0.00 H new ATOM 0 HA THR A 5 -10.479 3.819 -7.429 1.00 0.00 H new ATOM 0 HB THR A 5 -9.897 5.817 -8.630 1.00 0.00 H new ATOM 0 HG1 THR A 5 -8.039 7.084 -7.963 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.106 7.550 -6.877 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.191 6.173 -6.573 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.684 6.341 -5.641 1.00 0.00 H new ATOM 86 N LYS A 6 -8.947 3.375 -9.552 1.00 0.00 N ATOM 87 CA LYS A 6 -8.121 2.803 -10.608 1.00 0.00 C ATOM 88 C LYS A 6 -6.782 3.533 -10.662 1.00 0.00 C ATOM 89 O LYS A 6 -5.733 2.927 -10.876 1.00 0.00 O ATOM 90 CB LYS A 6 -8.845 2.925 -11.952 1.00 0.00 C ATOM 91 CG LYS A 6 -9.012 1.610 -12.697 1.00 0.00 C ATOM 92 CD LYS A 6 -7.697 1.103 -13.268 1.00 0.00 C ATOM 93 CE LYS A 6 -7.909 -0.162 -14.084 1.00 0.00 C ATOM 94 NZ LYS A 6 -6.669 -0.605 -14.773 1.00 0.00 N ATOM 0 H LYS A 6 -9.846 3.733 -9.873 1.00 0.00 H new ATOM 0 HA LYS A 6 -7.941 1.748 -10.399 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.830 3.360 -11.782 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.294 3.620 -12.586 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -9.425 0.861 -12.021 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -9.731 1.741 -13.506 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -7.248 1.873 -13.895 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -6.997 0.904 -12.457 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -8.262 -0.959 -13.429 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -8.690 0.013 -14.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -6.864 -1.470 -15.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -6.344 0.143 -15.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -5.930 -0.798 -14.067 1.00 0.00 H new ATOM 108 N LYS A 7 -6.839 4.840 -10.428 1.00 0.00 N ATOM 109 CA LYS A 7 -5.662 5.686 -10.422 1.00 0.00 C ATOM 110 C LYS A 7 -4.738 5.309 -9.264 1.00 0.00 C ATOM 111 O LYS A 7 -3.523 5.256 -9.428 1.00 0.00 O ATOM 112 CB LYS A 7 -6.113 7.146 -10.316 1.00 0.00 C ATOM 113 CG LYS A 7 -5.145 8.162 -10.895 1.00 0.00 C ATOM 114 CD LYS A 7 -3.962 8.413 -9.978 1.00 0.00 C ATOM 115 CE LYS A 7 -3.087 9.540 -10.499 1.00 0.00 C ATOM 116 NZ LYS A 7 -1.961 9.841 -9.578 1.00 0.00 N ATOM 0 H LYS A 7 -7.708 5.339 -10.237 1.00 0.00 H new ATOM 0 HA LYS A 7 -5.099 5.548 -11.345 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.072 7.251 -10.822 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -6.279 7.383 -9.265 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -4.785 7.809 -11.861 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -5.670 9.101 -11.074 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -4.320 8.661 -8.979 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -3.370 7.502 -9.888 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -2.692 9.269 -11.478 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -3.693 10.436 -10.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -1.744 10.857 -9.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -2.227 9.580 -8.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -1.123 9.297 -9.865 1.00 0.00 H new ATOM 130 N GLN A 8 -5.319 5.030 -8.097 1.00 0.00 N ATOM 131 CA GLN A 8 -4.536 4.615 -6.933 1.00 0.00 C ATOM 132 C GLN A 8 -3.868 3.270 -7.200 1.00 0.00 C ATOM 133 O GLN A 8 -2.713 3.056 -6.834 1.00 0.00 O ATOM 134 CB GLN A 8 -5.418 4.507 -5.684 1.00 0.00 C ATOM 135 CG GLN A 8 -6.274 5.733 -5.418 1.00 0.00 C ATOM 136 CD GLN A 8 -5.471 7.008 -5.298 1.00 0.00 C ATOM 137 OE1 GLN A 8 -5.223 7.691 -6.289 1.00 0.00 O ATOM 138 NE2 GLN A 8 -5.076 7.346 -4.083 1.00 0.00 N ATOM 0 H GLN A 8 -6.324 5.083 -7.933 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.773 5.373 -6.756 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -6.069 3.639 -5.787 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.781 4.327 -4.818 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.999 5.843 -6.224 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.840 5.580 -4.499 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -5.304 6.749 -3.288 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -4.543 8.204 -3.940 1.00 0.00 H new ATOM 147 N MET A 9 -4.603 2.367 -7.840 1.00 0.00 N ATOM 148 CA MET A 9 -4.050 1.079 -8.228 1.00 0.00 C ATOM 149 C MET A 9 -2.893 1.283 -9.196 1.00 0.00 C ATOM 150 O MET A 9 -1.850 0.649 -9.071 1.00 0.00 O ATOM 151 CB MET A 9 -5.131 0.206 -8.868 1.00 0.00 C ATOM 152 CG MET A 9 -4.624 -1.150 -9.336 1.00 0.00 C ATOM 153 SD MET A 9 -5.922 -2.159 -10.077 1.00 0.00 S ATOM 154 CE MET A 9 -6.994 -2.418 -8.663 1.00 0.00 C ATOM 0 H MET A 9 -5.580 2.504 -8.099 1.00 0.00 H new ATOM 0 HA MET A 9 -3.680 0.571 -7.337 1.00 0.00 H new ATOM 0 HB2 MET A 9 -5.936 0.055 -8.149 1.00 0.00 H new ATOM 0 HB3 MET A 9 -5.559 0.737 -9.718 1.00 0.00 H new ATOM 0 HG2 MET A 9 -3.824 -1.004 -10.062 1.00 0.00 H new ATOM 0 HG3 MET A 9 -4.193 -1.684 -8.489 1.00 0.00 H new ATOM 0 HE1 MET A 9 -7.654 -3.263 -8.857 1.00 0.00 H new ATOM 0 HE2 MET A 9 -6.389 -2.626 -7.781 1.00 0.00 H new ATOM 0 HE3 MET A 9 -7.592 -1.523 -8.491 1.00 0.00 H new ATOM 164 N GLU A 10 -3.085 2.183 -10.149 1.00 0.00 N ATOM 165 CA GLU A 10 -2.057 2.533 -11.096 1.00 0.00 C ATOM 166 C GLU A 10 -0.874 3.214 -10.420 1.00 0.00 C ATOM 167 O GLU A 10 0.260 3.015 -10.831 1.00 0.00 O ATOM 168 CB GLU A 10 -2.656 3.422 -12.169 1.00 0.00 C ATOM 169 CG GLU A 10 -3.349 2.634 -13.264 1.00 0.00 C ATOM 170 CD GLU A 10 -2.393 1.710 -13.993 1.00 0.00 C ATOM 171 OE1 GLU A 10 -1.465 2.210 -14.662 1.00 0.00 O ATOM 172 OE2 GLU A 10 -2.554 0.473 -13.897 1.00 0.00 O ATOM 0 H GLU A 10 -3.962 2.687 -10.281 1.00 0.00 H new ATOM 0 HA GLU A 10 -1.674 1.620 -11.551 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.371 4.105 -11.711 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -1.868 4.033 -12.610 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.160 2.048 -12.831 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -3.800 3.324 -13.977 1.00 0.00 H new ATOM 179 N GLU A 11 -1.133 4.004 -9.385 1.00 0.00 N ATOM 180 CA GLU A 11 -0.069 4.615 -8.603 1.00 0.00 C ATOM 181 C GLU A 11 0.817 3.545 -7.970 1.00 0.00 C ATOM 182 O GLU A 11 2.045 3.670 -7.942 1.00 0.00 O ATOM 183 CB GLU A 11 -0.673 5.530 -7.534 1.00 0.00 C ATOM 184 CG GLU A 11 -0.862 6.962 -8.006 1.00 0.00 C ATOM 185 CD GLU A 11 -1.448 7.882 -6.946 1.00 0.00 C ATOM 186 OE1 GLU A 11 -0.938 7.908 -5.806 1.00 0.00 O ATOM 187 OE2 GLU A 11 -2.409 8.608 -7.259 1.00 0.00 O ATOM 0 H GLU A 11 -2.074 4.236 -9.068 1.00 0.00 H new ATOM 0 HA GLU A 11 0.557 5.216 -9.263 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.637 5.127 -7.223 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -0.028 5.526 -6.656 1.00 0.00 H new ATOM 0 HG2 GLU A 11 0.101 7.359 -8.328 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.515 6.965 -8.878 1.00 0.00 H new ATOM 194 N MET A 12 0.189 2.485 -7.480 1.00 0.00 N ATOM 195 CA MET A 12 0.920 1.351 -6.925 1.00 0.00 C ATOM 196 C MET A 12 1.634 0.583 -8.035 1.00 0.00 C ATOM 197 O MET A 12 2.834 0.314 -7.950 1.00 0.00 O ATOM 198 CB MET A 12 -0.028 0.415 -6.170 1.00 0.00 C ATOM 199 CG MET A 12 -0.651 1.044 -4.933 1.00 0.00 C ATOM 200 SD MET A 12 -1.635 -0.121 -3.968 1.00 0.00 S ATOM 201 CE MET A 12 -2.874 -0.609 -5.165 1.00 0.00 C ATOM 0 H MET A 12 -0.826 2.385 -7.455 1.00 0.00 H new ATOM 0 HA MET A 12 1.663 1.735 -6.226 1.00 0.00 H new ATOM 0 HB2 MET A 12 -0.823 0.096 -6.844 1.00 0.00 H new ATOM 0 HB3 MET A 12 0.518 -0.481 -5.875 1.00 0.00 H new ATOM 0 HG2 MET A 12 0.139 1.453 -4.303 1.00 0.00 H new ATOM 0 HG3 MET A 12 -1.282 1.880 -5.236 1.00 0.00 H new ATOM 0 HE1 MET A 12 -3.490 -1.406 -4.747 1.00 0.00 H new ATOM 0 HE2 MET A 12 -3.504 0.247 -5.407 1.00 0.00 H new ATOM 0 HE3 MET A 12 -2.384 -0.966 -6.071 1.00 0.00 H new ATOM 211 N LEU A 13 0.888 0.258 -9.086 1.00 0.00 N ATOM 212 CA LEU A 13 1.413 -0.526 -10.200 1.00 0.00 C ATOM 213 C LEU A 13 2.540 0.199 -10.929 1.00 0.00 C ATOM 214 O LEU A 13 3.530 -0.418 -11.312 1.00 0.00 O ATOM 215 CB LEU A 13 0.291 -0.866 -11.184 1.00 0.00 C ATOM 216 CG LEU A 13 -0.734 -1.885 -10.675 1.00 0.00 C ATOM 217 CD1 LEU A 13 -1.772 -2.178 -11.747 1.00 0.00 C ATOM 218 CD2 LEU A 13 -0.040 -3.166 -10.234 1.00 0.00 C ATOM 0 H LEU A 13 -0.090 0.528 -9.190 1.00 0.00 H new ATOM 0 HA LEU A 13 1.825 -1.445 -9.784 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.233 0.053 -11.445 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.737 -1.250 -12.101 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.245 -1.459 -9.812 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.492 -2.904 -11.368 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.291 -1.257 -12.012 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.278 -2.584 -12.630 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -0.784 -3.878 -9.876 1.00 0.00 H new ATOM 0 HD22 LEU A 13 0.498 -3.597 -11.078 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.663 -2.941 -9.432 1.00 0.00 H new ATOM 230 N ALA A 14 2.386 1.502 -11.125 1.00 0.00 N ATOM 231 CA ALA A 14 3.407 2.306 -11.786 1.00 0.00 C ATOM 232 C ALA A 14 4.711 2.249 -11.015 1.00 0.00 C ATOM 233 O ALA A 14 5.785 2.155 -11.605 1.00 0.00 O ATOM 234 CB ALA A 14 2.947 3.749 -11.946 1.00 0.00 C ATOM 0 H ALA A 14 1.561 2.027 -10.835 1.00 0.00 H new ATOM 0 HA ALA A 14 3.572 1.890 -12.780 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.727 4.327 -12.442 1.00 0.00 H new ATOM 0 HB2 ALA A 14 2.038 3.777 -12.547 1.00 0.00 H new ATOM 0 HB3 ALA A 14 2.746 4.178 -10.964 1.00 0.00 H new ATOM 240 N HIS A 15 4.612 2.289 -9.692 1.00 0.00 N ATOM 241 CA HIS A 15 5.786 2.162 -8.841 1.00 0.00 C ATOM 242 C HIS A 15 6.467 0.824 -9.075 1.00 0.00 C ATOM 243 O HIS A 15 7.689 0.749 -9.133 1.00 0.00 O ATOM 244 CB HIS A 15 5.416 2.297 -7.367 1.00 0.00 C ATOM 245 CG HIS A 15 6.600 2.241 -6.445 1.00 0.00 C ATOM 246 ND1 HIS A 15 7.668 3.104 -6.543 1.00 0.00 N ATOM 247 CD2 HIS A 15 6.875 1.428 -5.400 1.00 0.00 C ATOM 248 CE1 HIS A 15 8.547 2.824 -5.601 1.00 0.00 C ATOM 249 NE2 HIS A 15 8.091 1.810 -4.888 1.00 0.00 N ATOM 0 H HIS A 15 3.734 2.408 -9.187 1.00 0.00 H new ATOM 0 HA HIS A 15 6.473 2.968 -9.101 1.00 0.00 H new ATOM 0 HB2 HIS A 15 4.893 3.241 -7.217 1.00 0.00 H new ATOM 0 HB3 HIS A 15 4.720 1.501 -7.101 1.00 0.00 H new ATOM 0 HD2 HIS A 15 6.252 0.625 -5.035 1.00 0.00 H new ATOM 0 HE1 HIS A 15 9.483 3.338 -5.439 1.00 0.00 H new ATOM 0 HE2 HIS A 15 8.563 1.382 -4.091 1.00 0.00 H new ATOM 258 N ALA A 16 5.667 -0.224 -9.194 1.00 0.00 N ATOM 259 CA ALA A 16 6.188 -1.557 -9.473 1.00 0.00 C ATOM 260 C ALA A 16 6.871 -1.590 -10.835 1.00 0.00 C ATOM 261 O ALA A 16 7.978 -2.104 -10.966 1.00 0.00 O ATOM 262 CB ALA A 16 5.073 -2.591 -9.402 1.00 0.00 C ATOM 0 H ALA A 16 4.652 -0.179 -9.102 1.00 0.00 H new ATOM 0 HA ALA A 16 6.931 -1.804 -8.714 1.00 0.00 H new ATOM 0 HB1 ALA A 16 5.480 -3.580 -9.613 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.634 -2.584 -8.404 1.00 0.00 H new ATOM 0 HB3 ALA A 16 4.306 -2.350 -10.138 1.00 0.00 H new ATOM 268 N ARG A 17 6.216 -1.011 -11.838 1.00 0.00 N ATOM 269 CA ARG A 17 6.761 -0.956 -13.194 1.00 0.00 C ATOM 270 C ARG A 17 8.069 -0.168 -13.225 1.00 0.00 C ATOM 271 O ARG A 17 9.016 -0.539 -13.916 1.00 0.00 O ATOM 272 CB ARG A 17 5.752 -0.310 -14.154 1.00 0.00 C ATOM 273 CG ARG A 17 4.418 -1.040 -14.242 1.00 0.00 C ATOM 274 CD ARG A 17 3.407 -0.249 -15.062 1.00 0.00 C ATOM 275 NE ARG A 17 2.078 -0.868 -15.060 1.00 0.00 N ATOM 276 CZ ARG A 17 0.950 -0.208 -14.782 1.00 0.00 C ATOM 277 NH1 ARG A 17 0.979 1.087 -14.504 1.00 0.00 N ATOM 278 NH2 ARG A 17 -0.217 -0.838 -14.806 1.00 0.00 N ATOM 0 H ARG A 17 5.302 -0.570 -11.737 1.00 0.00 H new ATOM 0 HA ARG A 17 6.958 -1.979 -13.514 1.00 0.00 H new ATOM 0 HB2 ARG A 17 5.571 0.717 -13.836 1.00 0.00 H new ATOM 0 HB3 ARG A 17 6.194 -0.262 -15.149 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.567 -2.021 -14.693 1.00 0.00 H new ATOM 0 HG3 ARG A 17 4.025 -1.206 -13.239 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.334 0.763 -14.665 1.00 0.00 H new ATOM 0 HD3 ARG A 17 3.763 -0.164 -16.089 1.00 0.00 H new ATOM 0 HE ARG A 17 2.011 -1.861 -15.284 1.00 0.00 H new ATOM 0 HH11 ARG A 17 1.867 1.588 -14.501 1.00 0.00 H new ATOM 0 HH12 ARG A 17 0.113 1.583 -14.293 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -0.256 -1.831 -15.037 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -1.075 -0.330 -14.593 1.00 0.00 H new ATOM 292 N GLN A 18 8.104 0.927 -12.480 1.00 0.00 N ATOM 293 CA GLN A 18 9.276 1.790 -12.423 1.00 0.00 C ATOM 294 C GLN A 18 10.411 1.140 -11.636 1.00 0.00 C ATOM 295 O GLN A 18 11.582 1.258 -11.998 1.00 0.00 O ATOM 296 CB GLN A 18 8.893 3.115 -11.770 1.00 0.00 C ATOM 297 CG GLN A 18 9.991 4.161 -11.808 1.00 0.00 C ATOM 298 CD GLN A 18 9.678 5.353 -10.933 1.00 0.00 C ATOM 299 OE1 GLN A 18 10.031 5.378 -9.754 1.00 0.00 O ATOM 300 NE2 GLN A 18 9.008 6.346 -11.493 1.00 0.00 N ATOM 0 H GLN A 18 7.326 1.242 -11.901 1.00 0.00 H new ATOM 0 HA GLN A 18 9.627 1.959 -13.441 1.00 0.00 H new ATOM 0 HB2 GLN A 18 8.009 3.512 -12.269 1.00 0.00 H new ATOM 0 HB3 GLN A 18 8.617 2.930 -10.732 1.00 0.00 H new ATOM 0 HG2 GLN A 18 10.929 3.711 -11.484 1.00 0.00 H new ATOM 0 HG3 GLN A 18 10.136 4.495 -12.835 1.00 0.00 H new ATOM 0 HE21 GLN A 18 8.734 6.287 -12.474 1.00 0.00 H new ATOM 0 HE22 GLN A 18 8.766 7.171 -10.944 1.00 0.00 H new ATOM 309 N ALA A 19 10.056 0.453 -10.563 1.00 0.00 N ATOM 310 CA ALA A 19 11.045 -0.122 -9.661 1.00 0.00 C ATOM 311 C ALA A 19 11.456 -1.530 -10.082 1.00 0.00 C ATOM 312 O ALA A 19 12.150 -2.219 -9.339 1.00 0.00 O ATOM 313 CB ALA A 19 10.520 -0.124 -8.234 1.00 0.00 C ATOM 0 H ALA A 19 9.088 0.279 -10.293 1.00 0.00 H new ATOM 0 HA ALA A 19 11.936 0.503 -9.712 1.00 0.00 H new ATOM 0 HB1 ALA A 19 11.270 -0.556 -7.571 1.00 0.00 H new ATOM 0 HB2 ALA A 19 10.307 0.899 -7.923 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.606 -0.716 -8.183 1.00 0.00 H new ATOM 319 N LEU A 20 11.028 -1.961 -11.264 1.00 0.00 N ATOM 320 CA LEU A 20 11.452 -3.251 -11.791 1.00 0.00 C ATOM 321 C LEU A 20 12.975 -3.300 -11.886 1.00 0.00 C ATOM 322 O LEU A 20 13.617 -2.291 -12.195 1.00 0.00 O ATOM 323 CB LEU A 20 10.829 -3.504 -13.165 1.00 0.00 C ATOM 324 CG LEU A 20 9.328 -3.797 -13.165 1.00 0.00 C ATOM 325 CD1 LEU A 20 8.823 -3.968 -14.590 1.00 0.00 C ATOM 326 CD2 LEU A 20 9.026 -5.040 -12.335 1.00 0.00 C ATOM 0 H LEU A 20 10.393 -1.441 -11.870 1.00 0.00 H new ATOM 0 HA LEU A 20 11.112 -4.032 -11.111 1.00 0.00 H new ATOM 0 HB2 LEU A 20 11.011 -2.632 -13.793 1.00 0.00 H new ATOM 0 HB3 LEU A 20 11.345 -4.344 -13.629 1.00 0.00 H new ATOM 0 HG LEU A 20 8.809 -2.951 -12.714 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.753 -4.176 -14.574 1.00 0.00 H new ATOM 0 HD12 LEU A 20 9.007 -3.053 -15.153 1.00 0.00 H new ATOM 0 HD13 LEU A 20 9.347 -4.798 -15.065 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.953 -5.233 -12.346 1.00 0.00 H new ATOM 0 HD22 LEU A 20 9.553 -5.896 -12.756 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.355 -4.881 -11.308 1.00 0.00 H new ATOM 338 N PRO A 21 13.580 -4.466 -11.626 1.00 0.00 N ATOM 339 CA PRO A 21 12.872 -5.700 -11.314 1.00 0.00 C ATOM 340 C PRO A 21 12.778 -5.991 -9.811 1.00 0.00 C ATOM 341 O PRO A 21 12.810 -7.151 -9.398 1.00 0.00 O ATOM 342 CB PRO A 21 13.766 -6.729 -11.994 1.00 0.00 C ATOM 343 CG PRO A 21 15.156 -6.184 -11.855 1.00 0.00 C ATOM 344 CD PRO A 21 15.032 -4.690 -11.643 1.00 0.00 C ATOM 0 HA PRO A 21 11.833 -5.682 -11.642 1.00 0.00 H new ATOM 0 HB2 PRO A 21 13.675 -7.706 -11.520 1.00 0.00 H new ATOM 0 HB3 PRO A 21 13.495 -6.857 -13.042 1.00 0.00 H new ATOM 0 HG2 PRO A 21 15.670 -6.650 -11.015 1.00 0.00 H new ATOM 0 HG3 PRO A 21 15.744 -6.398 -12.747 1.00 0.00 H new ATOM 0 HD2 PRO A 21 15.497 -4.377 -10.708 1.00 0.00 H new ATOM 0 HD3 PRO A 21 15.515 -4.129 -12.443 1.00 0.00 H new ATOM 352 N ASN A 22 12.653 -4.948 -9.003 1.00 0.00 N ATOM 353 CA ASN A 22 12.559 -5.116 -7.556 1.00 0.00 C ATOM 354 C ASN A 22 11.125 -5.446 -7.148 1.00 0.00 C ATOM 355 O ASN A 22 10.257 -5.648 -8.001 1.00 0.00 O ATOM 356 CB ASN A 22 13.029 -3.852 -6.823 1.00 0.00 C ATOM 357 CG ASN A 22 14.457 -3.464 -7.156 1.00 0.00 C ATOM 358 OD1 ASN A 22 15.284 -4.303 -7.509 1.00 0.00 O ATOM 359 ND2 ASN A 22 14.758 -2.179 -7.040 1.00 0.00 N ATOM 0 H ASN A 22 12.614 -3.980 -9.321 1.00 0.00 H new ATOM 0 HA ASN A 22 13.210 -5.943 -7.274 1.00 0.00 H new ATOM 0 HB2 ASN A 22 12.366 -3.025 -7.077 1.00 0.00 H new ATOM 0 HB3 ASN A 22 12.944 -4.010 -5.748 1.00 0.00 H new ATOM 0 HD21 ASN A 22 15.703 -1.856 -7.246 1.00 0.00 H new ATOM 0 HD22 ASN A 22 14.045 -1.513 -6.744 1.00 0.00 H new ATOM 366 N GLU A 23 10.884 -5.496 -5.847 1.00 0.00 N ATOM 367 CA GLU A 23 9.567 -5.831 -5.321 1.00 0.00 C ATOM 368 C GLU A 23 8.686 -4.592 -5.187 1.00 0.00 C ATOM 369 O GLU A 23 7.458 -4.685 -5.200 1.00 0.00 O ATOM 370 CB GLU A 23 9.708 -6.570 -3.983 1.00 0.00 C ATOM 371 CG GLU A 23 10.886 -6.109 -3.134 1.00 0.00 C ATOM 372 CD GLU A 23 10.788 -4.656 -2.740 1.00 0.00 C ATOM 373 OE1 GLU A 23 10.022 -4.354 -1.806 1.00 0.00 O ATOM 374 OE2 GLU A 23 11.454 -3.815 -3.380 1.00 0.00 O ATOM 0 H GLU A 23 11.586 -5.308 -5.132 1.00 0.00 H new ATOM 0 HA GLU A 23 9.072 -6.495 -6.030 1.00 0.00 H new ATOM 0 HB2 GLU A 23 8.790 -6.440 -3.411 1.00 0.00 H new ATOM 0 HB3 GLU A 23 9.812 -7.637 -4.180 1.00 0.00 H new ATOM 0 HG2 GLU A 23 10.942 -6.722 -2.234 1.00 0.00 H new ATOM 0 HG3 GLU A 23 11.812 -6.269 -3.687 1.00 0.00 H new ATOM 381 N ALA A 24 9.338 -3.444 -5.052 1.00 0.00 N ATOM 382 CA ALA A 24 8.678 -2.139 -5.022 1.00 0.00 C ATOM 383 C ALA A 24 7.774 -1.958 -3.799 1.00 0.00 C ATOM 384 O ALA A 24 6.644 -2.448 -3.760 1.00 0.00 O ATOM 385 CB ALA A 24 7.892 -1.908 -6.305 1.00 0.00 C ATOM 0 H ALA A 24 10.352 -3.389 -4.959 1.00 0.00 H new ATOM 0 HA ALA A 24 9.466 -1.390 -4.944 1.00 0.00 H new ATOM 0 HB1 ALA A 24 7.408 -0.932 -6.264 1.00 0.00 H new ATOM 0 HB2 ALA A 24 8.570 -1.942 -7.158 1.00 0.00 H new ATOM 0 HB3 ALA A 24 7.135 -2.685 -6.413 1.00 0.00 H new ATOM 391 N CYS A 25 8.271 -1.226 -2.808 1.00 0.00 N ATOM 392 CA CYS A 25 7.475 -0.890 -1.634 1.00 0.00 C ATOM 393 C CYS A 25 7.243 0.612 -1.534 1.00 0.00 C ATOM 394 O CYS A 25 7.881 1.406 -2.232 1.00 0.00 O ATOM 395 CB CYS A 25 8.149 -1.382 -0.353 1.00 0.00 C ATOM 396 SG CYS A 25 8.120 -3.172 -0.138 1.00 0.00 S ATOM 0 H CYS A 25 9.221 -0.854 -2.795 1.00 0.00 H new ATOM 0 HA CYS A 25 6.513 -1.390 -1.747 1.00 0.00 H new ATOM 0 HB2 CYS A 25 9.185 -1.044 -0.349 1.00 0.00 H new ATOM 0 HB3 CYS A 25 7.659 -0.917 0.503 1.00 0.00 H new ATOM 0 HG CYS A 25 9.161 -3.695 -0.715 1.00 0.00 H new ATOM 402 N GLY A 26 6.317 0.984 -0.665 1.00 0.00 N ATOM 403 CA GLY A 26 5.990 2.377 -0.427 1.00 0.00 C ATOM 404 C GLY A 26 5.018 2.496 0.724 1.00 0.00 C ATOM 405 O GLY A 26 4.883 1.557 1.505 1.00 0.00 O ATOM 0 H GLY A 26 5.772 0.328 -0.106 1.00 0.00 H new ATOM 0 HA2 GLY A 26 6.898 2.938 -0.205 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.556 2.815 -1.326 1.00 0.00 H new ATOM 409 N LEU A 27 4.322 3.618 0.830 1.00 0.00 N ATOM 410 CA LEU A 27 3.348 3.792 1.899 1.00 0.00 C ATOM 411 C LEU A 27 1.975 4.126 1.332 1.00 0.00 C ATOM 412 O LEU A 27 1.858 4.680 0.236 1.00 0.00 O ATOM 413 CB LEU A 27 3.793 4.889 2.872 1.00 0.00 C ATOM 414 CG LEU A 27 5.029 4.563 3.713 1.00 0.00 C ATOM 415 CD1 LEU A 27 5.353 5.722 4.642 1.00 0.00 C ATOM 416 CD2 LEU A 27 4.811 3.289 4.515 1.00 0.00 C ATOM 0 H LEU A 27 4.411 4.413 0.198 1.00 0.00 H new ATOM 0 HA LEU A 27 3.282 2.850 2.443 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.992 5.797 2.302 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.965 5.111 3.545 1.00 0.00 H new ATOM 0 HG LEU A 27 5.872 4.405 3.040 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.234 5.478 5.235 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.549 6.617 4.052 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.508 5.903 5.306 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.701 3.074 5.106 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.957 3.419 5.179 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.619 2.459 3.835 1.00 0.00 H new ATOM 428 N LEU A 28 0.941 3.785 2.086 1.00 0.00 N ATOM 429 CA LEU A 28 -0.429 4.051 1.683 1.00 0.00 C ATOM 430 C LEU A 28 -1.098 4.961 2.695 1.00 0.00 C ATOM 431 O LEU A 28 -1.047 4.708 3.902 1.00 0.00 O ATOM 432 CB LEU A 28 -1.213 2.744 1.560 1.00 0.00 C ATOM 433 CG LEU A 28 -0.763 1.818 0.431 1.00 0.00 C ATOM 434 CD1 LEU A 28 -1.539 0.515 0.479 1.00 0.00 C ATOM 435 CD2 LEU A 28 -0.945 2.497 -0.917 1.00 0.00 C ATOM 0 H LEU A 28 1.028 3.319 2.989 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.417 4.544 0.711 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.137 2.203 2.503 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.266 2.983 1.414 1.00 0.00 H new ATOM 0 HG LEU A 28 0.296 1.596 0.564 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.208 -0.135 -0.331 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.363 0.022 1.435 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.603 0.721 0.367 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.620 1.824 -1.710 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.997 2.745 -1.060 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.349 3.409 -0.948 1.00 0.00 H new ATOM 447 N GLY A 29 -1.736 6.008 2.205 1.00 0.00 N ATOM 448 CA GLY A 29 -2.342 6.970 3.089 1.00 0.00 C ATOM 449 C GLY A 29 -3.820 7.143 2.837 1.00 0.00 C ATOM 450 O GLY A 29 -4.331 6.766 1.778 1.00 0.00 O ATOM 0 H GLY A 29 -1.844 6.208 1.211 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.188 6.656 4.121 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.842 7.931 2.970 1.00 0.00 H new ATOM 454 N GLY A 30 -4.505 7.708 3.813 1.00 0.00 N ATOM 455 CA GLY A 30 -5.927 7.915 3.707 1.00 0.00 C ATOM 456 C GLY A 30 -6.558 8.096 5.064 1.00 0.00 C ATOM 457 O GLY A 30 -5.901 8.550 6.004 1.00 0.00 O ATOM 0 H GLY A 30 -4.093 8.031 4.689 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.124 8.793 3.092 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.384 7.064 3.202 1.00 0.00 H new ATOM 461 N ARG A 31 -7.816 7.714 5.180 1.00 0.00 N ATOM 462 CA ARG A 31 -8.553 7.882 6.420 1.00 0.00 C ATOM 463 C ARG A 31 -9.353 6.634 6.766 1.00 0.00 C ATOM 464 O ARG A 31 -9.782 5.887 5.885 1.00 0.00 O ATOM 465 CB ARG A 31 -9.476 9.097 6.322 1.00 0.00 C ATOM 466 CG ARG A 31 -8.752 10.416 6.534 1.00 0.00 C ATOM 467 CD ARG A 31 -9.662 11.608 6.292 1.00 0.00 C ATOM 468 NE ARG A 31 -9.584 12.095 4.918 1.00 0.00 N ATOM 469 CZ ARG A 31 -9.650 13.381 4.584 1.00 0.00 C ATOM 470 NH1 ARG A 31 -9.874 14.300 5.520 1.00 0.00 N ATOM 471 NH2 ARG A 31 -9.507 13.747 3.317 1.00 0.00 N ATOM 0 H ARG A 31 -8.352 7.283 4.427 1.00 0.00 H new ATOM 0 HA ARG A 31 -7.832 8.045 7.221 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -9.953 9.105 5.342 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -10.270 9.003 7.062 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -8.363 10.457 7.551 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -7.895 10.472 5.863 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -10.691 11.328 6.518 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -9.393 12.413 6.976 1.00 0.00 H new ATOM 0 HE ARG A 31 -9.472 11.410 4.171 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -9.995 14.018 6.493 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -9.925 15.286 5.265 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -9.346 13.042 2.598 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -9.558 14.733 3.062 1.00 0.00 H new ATOM 485 N ARG A 32 -9.504 6.394 8.061 1.00 0.00 N ATOM 486 CA ARG A 32 -10.344 5.318 8.564 1.00 0.00 C ATOM 487 C ARG A 32 -11.451 5.904 9.433 1.00 0.00 C ATOM 488 O ARG A 32 -11.180 6.619 10.395 1.00 0.00 O ATOM 489 CB ARG A 32 -9.517 4.267 9.332 1.00 0.00 C ATOM 490 CG ARG A 32 -8.268 4.797 10.044 1.00 0.00 C ATOM 491 CD ARG A 32 -8.587 5.575 11.312 1.00 0.00 C ATOM 492 NE ARG A 32 -8.333 7.012 11.160 1.00 0.00 N ATOM 493 CZ ARG A 32 -8.812 7.944 11.985 1.00 0.00 C ATOM 494 NH1 ARG A 32 -9.499 7.594 13.067 1.00 0.00 N ATOM 495 NH2 ARG A 32 -8.578 9.227 11.743 1.00 0.00 N ATOM 0 H ARG A 32 -9.047 6.940 8.792 1.00 0.00 H new ATOM 0 HA ARG A 32 -10.797 4.800 7.719 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -10.162 3.794 10.073 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -9.212 3.489 8.632 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -7.617 3.959 10.293 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -7.713 5.440 9.361 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -9.632 5.419 11.579 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -7.987 5.187 12.135 1.00 0.00 H new ATOM 0 HE ARG A 32 -7.755 7.316 10.376 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -9.663 6.608 13.270 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -9.863 8.311 13.694 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -8.032 9.501 10.926 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -8.944 9.940 12.374 1.00 0.00 H new ATOM 509 N ASP A 33 -12.698 5.628 9.094 1.00 0.00 N ATOM 510 CA ASP A 33 -13.801 6.302 9.779 1.00 0.00 C ATOM 511 C ASP A 33 -14.805 5.309 10.356 1.00 0.00 C ATOM 512 O ASP A 33 -16.004 5.574 10.417 1.00 0.00 O ATOM 513 CB ASP A 33 -14.487 7.278 8.823 1.00 0.00 C ATOM 514 CG ASP A 33 -15.356 8.288 9.541 1.00 0.00 C ATOM 515 OD1 ASP A 33 -14.807 9.124 10.295 1.00 0.00 O ATOM 516 OD2 ASP A 33 -16.589 8.260 9.353 1.00 0.00 O ATOM 0 H ASP A 33 -12.974 4.963 8.371 1.00 0.00 H new ATOM 0 HA ASP A 33 -13.386 6.858 10.620 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -13.729 7.805 8.243 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -15.098 6.718 8.115 1.00 0.00 H new ATOM 521 N GLY A 34 -14.307 4.177 10.817 1.00 0.00 N ATOM 522 CA GLY A 34 -15.174 3.184 11.411 1.00 0.00 C ATOM 523 C GLY A 34 -15.154 1.890 10.647 1.00 0.00 C ATOM 524 O GLY A 34 -16.179 1.445 10.131 1.00 0.00 O ATOM 0 H GLY A 34 -13.319 3.926 10.791 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -14.865 3.002 12.440 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -16.194 3.568 11.447 1.00 0.00 H new ATOM 528 N ASP A 35 -13.972 1.302 10.590 1.00 0.00 N ATOM 529 CA ASP A 35 -13.698 0.076 9.839 1.00 0.00 C ATOM 530 C ASP A 35 -13.613 0.363 8.341 1.00 0.00 C ATOM 531 O ASP A 35 -13.046 -0.428 7.578 1.00 0.00 O ATOM 532 CB ASP A 35 -14.731 -1.014 10.130 1.00 0.00 C ATOM 533 CG ASP A 35 -14.284 -2.374 9.632 1.00 0.00 C ATOM 534 OD1 ASP A 35 -13.410 -2.986 10.281 1.00 0.00 O ATOM 535 OD2 ASP A 35 -14.803 -2.839 8.595 1.00 0.00 O ATOM 0 H ASP A 35 -13.152 1.668 11.074 1.00 0.00 H new ATOM 0 HA ASP A 35 -12.730 -0.299 10.172 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -14.912 -1.064 11.204 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -15.678 -0.750 9.659 1.00 0.00 H new ATOM 540 N ASP A 36 -14.166 1.498 7.912 1.00 0.00 N ATOM 541 CA ASP A 36 -13.953 1.956 6.551 1.00 0.00 C ATOM 542 C ASP A 36 -12.546 2.501 6.431 1.00 0.00 C ATOM 543 O ASP A 36 -12.075 3.271 7.268 1.00 0.00 O ATOM 544 CB ASP A 36 -14.920 3.052 6.120 1.00 0.00 C ATOM 545 CG ASP A 36 -16.386 2.705 6.307 1.00 0.00 C ATOM 546 OD1 ASP A 36 -16.892 2.827 7.440 1.00 0.00 O ATOM 547 OD2 ASP A 36 -17.053 2.348 5.306 1.00 0.00 O ATOM 0 H ASP A 36 -14.755 2.105 8.482 1.00 0.00 H new ATOM 0 HA ASP A 36 -14.120 1.096 5.903 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.699 3.957 6.685 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -14.745 3.281 5.069 1.00 0.00 H new ATOM 552 N ARG A 37 -11.906 2.082 5.383 1.00 0.00 N ATOM 553 CA ARG A 37 -10.520 2.382 5.111 1.00 0.00 C ATOM 554 C ARG A 37 -10.380 2.872 3.672 1.00 0.00 C ATOM 555 O ARG A 37 -10.594 2.109 2.728 1.00 0.00 O ATOM 556 CB ARG A 37 -9.721 1.100 5.344 1.00 0.00 C ATOM 557 CG ARG A 37 -8.220 1.259 5.434 1.00 0.00 C ATOM 558 CD ARG A 37 -7.569 1.426 4.070 1.00 0.00 C ATOM 559 NE ARG A 37 -6.142 1.095 4.103 1.00 0.00 N ATOM 560 CZ ARG A 37 -5.203 1.762 3.431 1.00 0.00 C ATOM 561 NH1 ARG A 37 -5.515 2.881 2.782 1.00 0.00 N ATOM 562 NH2 ARG A 37 -3.944 1.331 3.447 1.00 0.00 N ATOM 0 H ARG A 37 -12.342 1.502 4.666 1.00 0.00 H new ATOM 0 HA ARG A 37 -10.145 3.170 5.764 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -10.073 0.639 6.267 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -9.944 0.405 4.535 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -7.986 2.125 6.053 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -7.795 0.387 5.932 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -8.074 0.786 3.346 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -7.696 2.454 3.730 1.00 0.00 H new ATOM 0 HE ARG A 37 -5.848 0.304 4.676 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -6.473 3.230 2.798 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -4.796 3.390 2.268 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -3.699 0.492 3.973 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -3.224 1.840 2.934 1.00 0.00 H new ATOM 576 N TRP A 38 -10.028 4.130 3.494 1.00 0.00 N ATOM 577 CA TRP A 38 -9.903 4.683 2.151 1.00 0.00 C ATOM 578 C TRP A 38 -8.441 4.909 1.787 1.00 0.00 C ATOM 579 O TRP A 38 -7.608 5.183 2.654 1.00 0.00 O ATOM 580 CB TRP A 38 -10.680 5.994 2.031 1.00 0.00 C ATOM 581 CG TRP A 38 -12.152 5.845 2.266 1.00 0.00 C ATOM 582 CD1 TRP A 38 -13.082 5.338 1.400 1.00 0.00 C ATOM 583 CD2 TRP A 38 -12.864 6.215 3.448 1.00 0.00 C ATOM 584 NE1 TRP A 38 -14.328 5.372 1.979 1.00 0.00 N ATOM 585 CE2 TRP A 38 -14.219 5.907 3.235 1.00 0.00 C ATOM 586 CE3 TRP A 38 -12.485 6.773 4.671 1.00 0.00 C ATOM 587 CZ2 TRP A 38 -15.196 6.146 4.196 1.00 0.00 C ATOM 588 CZ3 TRP A 38 -13.454 7.010 5.623 1.00 0.00 C ATOM 589 CH2 TRP A 38 -14.798 6.696 5.381 1.00 0.00 C ATOM 0 H TRP A 38 -9.825 4.785 4.249 1.00 0.00 H new ATOM 0 HA TRP A 38 -10.325 3.959 1.454 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -10.278 6.711 2.746 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -10.520 6.411 1.037 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -12.869 4.966 0.409 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -15.193 5.051 1.544 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -11.451 7.015 4.868 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -16.233 5.905 4.012 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -13.172 7.445 6.571 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -15.534 6.893 6.147 1.00 0.00 H new ATOM 600 N VAL A 39 -8.126 4.750 0.510 1.00 0.00 N ATOM 601 CA VAL A 39 -6.793 5.052 0.008 1.00 0.00 C ATOM 602 C VAL A 39 -6.831 6.348 -0.790 1.00 0.00 C ATOM 603 O VAL A 39 -7.036 6.339 -2.005 1.00 0.00 O ATOM 604 CB VAL A 39 -6.234 3.925 -0.888 1.00 0.00 C ATOM 605 CG1 VAL A 39 -4.766 4.172 -1.208 1.00 0.00 C ATOM 606 CG2 VAL A 39 -6.427 2.563 -0.241 1.00 0.00 C ATOM 0 H VAL A 39 -8.777 4.413 -0.199 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.135 5.150 0.872 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.793 3.930 -1.824 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.391 3.367 -1.840 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.663 5.123 -1.731 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.192 4.203 -0.282 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -6.024 1.789 -0.895 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.906 2.538 0.716 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.490 2.384 -0.080 1.00 0.00 H new ATOM 616 N GLU A 40 -6.653 7.459 -0.097 1.00 0.00 N ATOM 617 CA GLU A 40 -6.763 8.768 -0.718 1.00 0.00 C ATOM 618 C GLU A 40 -5.471 9.152 -1.419 1.00 0.00 C ATOM 619 O GLU A 40 -5.470 9.993 -2.317 1.00 0.00 O ATOM 620 CB GLU A 40 -7.136 9.816 0.327 1.00 0.00 C ATOM 621 CG GLU A 40 -8.532 9.627 0.899 1.00 0.00 C ATOM 622 CD GLU A 40 -8.845 10.629 1.981 1.00 0.00 C ATOM 623 OE1 GLU A 40 -8.889 11.840 1.680 1.00 0.00 O ATOM 624 OE2 GLU A 40 -9.037 10.216 3.140 1.00 0.00 O ATOM 0 H GLU A 40 -6.431 7.481 0.898 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.551 8.723 -1.470 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.411 9.782 1.140 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -7.066 10.807 -0.122 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -9.266 9.718 0.098 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.624 8.619 1.302 1.00 0.00 H new ATOM 631 N ARG A 41 -4.371 8.530 -1.016 1.00 0.00 N ATOM 632 CA ARG A 41 -3.085 8.773 -1.652 1.00 0.00 C ATOM 633 C ARG A 41 -2.184 7.560 -1.564 1.00 0.00 C ATOM 634 O ARG A 41 -2.240 6.787 -0.605 1.00 0.00 O ATOM 635 CB ARG A 41 -2.371 9.966 -1.024 1.00 0.00 C ATOM 636 CG ARG A 41 -2.549 11.277 -1.775 1.00 0.00 C ATOM 637 CD ARG A 41 -1.767 11.321 -3.091 1.00 0.00 C ATOM 638 NE ARG A 41 -2.382 10.538 -4.170 1.00 0.00 N ATOM 639 CZ ARG A 41 -3.516 10.879 -4.793 1.00 0.00 C ATOM 640 NH1 ARG A 41 -4.218 11.932 -4.386 1.00 0.00 N ATOM 641 NH2 ARG A 41 -3.947 10.168 -5.826 1.00 0.00 N ATOM 0 H ARG A 41 -4.344 7.854 -0.252 1.00 0.00 H new ATOM 0 HA ARG A 41 -3.292 8.988 -2.700 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -2.734 10.094 -0.004 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -1.306 9.742 -0.958 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -3.608 11.430 -1.982 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -2.226 12.101 -1.139 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -1.675 12.358 -3.414 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -0.757 10.951 -2.916 1.00 0.00 H new ATOM 0 HE ARG A 41 -1.915 9.680 -4.463 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -3.893 12.486 -3.594 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -5.081 12.186 -4.866 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -3.414 9.360 -6.147 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -4.812 10.429 -6.300 1.00 0.00 H new ATOM 655 N VAL A 42 -1.357 7.410 -2.577 1.00 0.00 N ATOM 656 CA VAL A 42 -0.328 6.392 -2.594 1.00 0.00 C ATOM 657 C VAL A 42 1.023 7.083 -2.676 1.00 0.00 C ATOM 658 O VAL A 42 1.212 7.974 -3.503 1.00 0.00 O ATOM 659 CB VAL A 42 -0.490 5.432 -3.796 1.00 0.00 C ATOM 660 CG1 VAL A 42 0.594 4.361 -3.792 1.00 0.00 C ATOM 661 CG2 VAL A 42 -1.870 4.792 -3.796 1.00 0.00 C ATOM 0 H VAL A 42 -1.380 7.992 -3.414 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.409 5.796 -1.685 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.383 6.020 -4.708 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.456 3.700 -4.648 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.574 4.835 -3.854 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.529 3.781 -2.871 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -1.960 4.121 -4.650 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -2.009 4.226 -2.875 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.631 5.569 -3.863 1.00 0.00 H new ATOM 671 N TYR A 43 1.946 6.716 -1.808 1.00 0.00 N ATOM 672 CA TYR A 43 3.248 7.355 -1.801 1.00 0.00 C ATOM 673 C TYR A 43 4.364 6.357 -2.043 1.00 0.00 C ATOM 674 O TYR A 43 4.893 5.743 -1.111 1.00 0.00 O ATOM 675 CB TYR A 43 3.471 8.161 -0.521 1.00 0.00 C ATOM 676 CG TYR A 43 2.712 9.468 -0.543 1.00 0.00 C ATOM 677 CD1 TYR A 43 2.849 10.336 -1.618 1.00 0.00 C ATOM 678 CD2 TYR A 43 1.843 9.821 0.479 1.00 0.00 C ATOM 679 CE1 TYR A 43 2.147 11.519 -1.671 1.00 0.00 C ATOM 680 CE2 TYR A 43 1.131 11.005 0.427 1.00 0.00 C ATOM 681 CZ TYR A 43 1.292 11.850 -0.650 1.00 0.00 C ATOM 682 OH TYR A 43 0.580 13.023 -0.717 1.00 0.00 O ATOM 0 H TYR A 43 1.821 5.987 -1.106 1.00 0.00 H new ATOM 0 HA TYR A 43 3.268 8.061 -2.632 1.00 0.00 H new ATOM 0 HB2 TYR A 43 3.155 7.571 0.340 1.00 0.00 H new ATOM 0 HB3 TYR A 43 4.535 8.361 -0.398 1.00 0.00 H new ATOM 0 HD1 TYR A 43 3.518 10.079 -2.426 1.00 0.00 H new ATOM 0 HD2 TYR A 43 1.721 9.162 1.326 1.00 0.00 H new ATOM 0 HE1 TYR A 43 2.269 12.184 -2.513 1.00 0.00 H new ATOM 0 HE2 TYR A 43 0.453 11.266 1.226 1.00 0.00 H new ATOM 0 HH TYR A 43 1.166 13.775 -0.490 1.00 0.00 H new ATOM 692 N PRO A 44 4.679 6.136 -3.326 1.00 0.00 N ATOM 693 CA PRO A 44 5.775 5.270 -3.742 1.00 0.00 C ATOM 694 C PRO A 44 7.127 5.841 -3.331 1.00 0.00 C ATOM 695 O PRO A 44 7.660 6.737 -3.987 1.00 0.00 O ATOM 696 CB PRO A 44 5.654 5.232 -5.273 1.00 0.00 C ATOM 697 CG PRO A 44 4.297 5.765 -5.579 1.00 0.00 C ATOM 698 CD PRO A 44 3.992 6.734 -4.481 1.00 0.00 C ATOM 0 HA PRO A 44 5.716 4.284 -3.281 1.00 0.00 H new ATOM 0 HB2 PRO A 44 6.429 5.838 -5.743 1.00 0.00 H new ATOM 0 HB3 PRO A 44 5.771 4.216 -5.651 1.00 0.00 H new ATOM 0 HG2 PRO A 44 4.278 6.256 -6.552 1.00 0.00 H new ATOM 0 HG3 PRO A 44 3.559 4.964 -5.612 1.00 0.00 H new ATOM 0 HD2 PRO A 44 4.369 7.732 -4.705 1.00 0.00 H new ATOM 0 HD3 PRO A 44 2.920 6.829 -4.310 1.00 0.00 H new ATOM 706 N LEU A 45 7.662 5.334 -2.231 1.00 0.00 N ATOM 707 CA LEU A 45 8.920 5.829 -1.696 1.00 0.00 C ATOM 708 C LEU A 45 10.098 5.058 -2.273 1.00 0.00 C ATOM 709 O LEU A 45 9.915 4.079 -3.005 1.00 0.00 O ATOM 710 CB LEU A 45 8.919 5.726 -0.169 1.00 0.00 C ATOM 711 CG LEU A 45 7.803 6.503 0.532 1.00 0.00 C ATOM 712 CD1 LEU A 45 7.861 6.274 2.033 1.00 0.00 C ATOM 713 CD2 LEU A 45 7.902 7.988 0.218 1.00 0.00 C ATOM 0 H LEU A 45 7.243 4.578 -1.690 1.00 0.00 H new ATOM 0 HA LEU A 45 9.025 6.875 -1.983 1.00 0.00 H new ATOM 0 HB2 LEU A 45 8.839 4.675 0.109 1.00 0.00 H new ATOM 0 HB3 LEU A 45 9.879 6.082 0.205 1.00 0.00 H new ATOM 0 HG LEU A 45 6.846 6.138 0.160 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.061 6.833 2.518 1.00 0.00 H new ATOM 0 HD12 LEU A 45 7.740 5.211 2.244 1.00 0.00 H new ATOM 0 HD13 LEU A 45 8.824 6.613 2.416 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.099 8.522 0.726 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.864 8.369 0.560 1.00 0.00 H new ATOM 0 HD23 LEU A 45 7.814 8.139 -0.858 1.00 0.00 H new ATOM 725 N ASN A 46 11.299 5.504 -1.939 1.00 0.00 N ATOM 726 CA ASN A 46 12.515 4.884 -2.440 1.00 0.00 C ATOM 727 C ASN A 46 12.885 3.658 -1.609 1.00 0.00 C ATOM 728 O ASN A 46 12.740 3.649 -0.384 1.00 0.00 O ATOM 729 CB ASN A 46 13.660 5.899 -2.435 1.00 0.00 C ATOM 730 CG ASN A 46 14.960 5.328 -2.964 1.00 0.00 C ATOM 731 OD1 ASN A 46 14.963 4.425 -3.800 1.00 0.00 O ATOM 732 ND2 ASN A 46 16.072 5.863 -2.491 1.00 0.00 N ATOM 0 H ASN A 46 11.458 6.298 -1.319 1.00 0.00 H new ATOM 0 HA ASN A 46 12.338 4.555 -3.464 1.00 0.00 H new ATOM 0 HB2 ASN A 46 13.376 6.761 -3.038 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.815 6.259 -1.418 1.00 0.00 H new ATOM 0 HD21 ASN A 46 16.978 5.529 -2.819 1.00 0.00 H new ATOM 0 HD22 ASN A 46 16.024 6.610 -1.798 1.00 0.00 H new ATOM 739 N ASN A 47 13.363 2.628 -2.288 1.00 0.00 N ATOM 740 CA ASN A 47 13.755 1.384 -1.641 1.00 0.00 C ATOM 741 C ASN A 47 15.227 1.115 -1.914 1.00 0.00 C ATOM 742 O ASN A 47 15.662 1.113 -3.063 1.00 0.00 O ATOM 743 CB ASN A 47 12.886 0.224 -2.141 1.00 0.00 C ATOM 744 CG ASN A 47 13.173 -1.089 -1.428 1.00 0.00 C ATOM 745 OD1 ASN A 47 12.657 -1.343 -0.341 1.00 0.00 O ATOM 746 ND2 ASN A 47 13.978 -1.941 -2.041 1.00 0.00 N ATOM 0 H ASN A 47 13.490 2.629 -3.300 1.00 0.00 H new ATOM 0 HA ASN A 47 13.606 1.473 -0.565 1.00 0.00 H new ATOM 0 HB2 ASN A 47 11.835 0.481 -2.007 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.048 0.092 -3.211 1.00 0.00 H new ATOM 0 HD21 ASN A 47 14.188 -2.842 -1.612 1.00 0.00 H new ATOM 0 HD22 ASN A 47 14.388 -1.697 -2.942 1.00 0.00 H new ATOM 753 N LEU A 48 15.985 0.894 -0.853 1.00 0.00 N ATOM 754 CA LEU A 48 17.437 0.794 -0.949 1.00 0.00 C ATOM 755 C LEU A 48 17.870 -0.543 -1.552 1.00 0.00 C ATOM 756 O LEU A 48 18.896 -0.622 -2.229 1.00 0.00 O ATOM 757 CB LEU A 48 18.063 0.974 0.435 1.00 0.00 C ATOM 758 CG LEU A 48 17.645 2.232 1.180 1.00 0.00 C ATOM 759 CD1 LEU A 48 18.306 2.287 2.547 1.00 0.00 C ATOM 760 CD2 LEU A 48 17.975 3.481 0.373 1.00 0.00 C ATOM 0 H LEU A 48 15.619 0.779 0.092 1.00 0.00 H new ATOM 0 HA LEU A 48 17.786 1.586 -1.612 1.00 0.00 H new ATOM 0 HB2 LEU A 48 17.808 0.108 1.046 1.00 0.00 H new ATOM 0 HB3 LEU A 48 19.148 0.979 0.327 1.00 0.00 H new ATOM 0 HG LEU A 48 16.565 2.198 1.320 1.00 0.00 H new ATOM 0 HD11 LEU A 48 17.995 3.194 3.065 1.00 0.00 H new ATOM 0 HD12 LEU A 48 18.008 1.416 3.130 1.00 0.00 H new ATOM 0 HD13 LEU A 48 19.389 2.291 2.427 1.00 0.00 H new ATOM 0 HD21 LEU A 48 17.665 4.366 0.929 1.00 0.00 H new ATOM 0 HD22 LEU A 48 19.049 3.524 0.192 1.00 0.00 H new ATOM 0 HD23 LEU A 48 17.447 3.448 -0.580 1.00 0.00 H new ATOM 772 N ASP A 49 17.085 -1.584 -1.308 1.00 0.00 N ATOM 773 CA ASP A 49 17.413 -2.917 -1.804 1.00 0.00 C ATOM 774 C ASP A 49 17.152 -3.018 -3.302 1.00 0.00 C ATOM 775 O ASP A 49 16.099 -2.604 -3.787 1.00 0.00 O ATOM 776 CB ASP A 49 16.593 -3.988 -1.080 1.00 0.00 C ATOM 777 CG ASP A 49 17.454 -4.947 -0.286 1.00 0.00 C ATOM 778 OD1 ASP A 49 18.025 -5.876 -0.889 1.00 0.00 O ATOM 779 OD2 ASP A 49 17.551 -4.785 0.951 1.00 0.00 O ATOM 0 H ASP A 49 16.219 -1.533 -0.772 1.00 0.00 H new ATOM 0 HA ASP A 49 18.472 -3.085 -1.610 1.00 0.00 H new ATOM 0 HB2 ASP A 49 15.883 -3.504 -0.410 1.00 0.00 H new ATOM 0 HB3 ASP A 49 16.010 -4.549 -1.811 1.00 0.00 H new ATOM 784 N GLN A 50 18.112 -3.562 -4.030 1.00 0.00 N ATOM 785 CA GLN A 50 17.936 -3.833 -5.452 1.00 0.00 C ATOM 786 C GLN A 50 17.606 -5.309 -5.627 1.00 0.00 C ATOM 787 O GLN A 50 18.111 -5.980 -6.530 1.00 0.00 O ATOM 788 CB GLN A 50 19.205 -3.476 -6.232 1.00 0.00 C ATOM 789 CG GLN A 50 19.625 -2.019 -6.093 1.00 0.00 C ATOM 790 CD GLN A 50 20.869 -1.690 -6.901 1.00 0.00 C ATOM 791 OE1 GLN A 50 21.727 -2.545 -7.125 1.00 0.00 O ATOM 792 NE2 GLN A 50 20.978 -0.445 -7.337 1.00 0.00 N ATOM 0 H GLN A 50 19.025 -3.827 -3.661 1.00 0.00 H new ATOM 0 HA GLN A 50 17.122 -3.221 -5.842 1.00 0.00 H new ATOM 0 HB2 GLN A 50 20.021 -4.113 -5.891 1.00 0.00 H new ATOM 0 HB3 GLN A 50 19.046 -3.699 -7.287 1.00 0.00 H new ATOM 0 HG2 GLN A 50 18.806 -1.376 -6.416 1.00 0.00 H new ATOM 0 HG3 GLN A 50 19.809 -1.797 -5.042 1.00 0.00 H new ATOM 0 HE21 GLN A 50 20.245 0.234 -7.130 1.00 0.00 H new ATOM 0 HE22 GLN A 50 21.795 -0.164 -7.880 1.00 0.00 H new ATOM 801 N SER A 51 16.751 -5.801 -4.744 1.00 0.00 N ATOM 802 CA SER A 51 16.424 -7.210 -4.690 1.00 0.00 C ATOM 803 C SER A 51 14.951 -7.432 -5.027 1.00 0.00 C ATOM 804 O SER A 51 14.102 -6.609 -4.696 1.00 0.00 O ATOM 805 CB SER A 51 16.736 -7.743 -3.292 1.00 0.00 C ATOM 806 OG SER A 51 18.072 -7.442 -2.919 1.00 0.00 O ATOM 0 H SER A 51 16.267 -5.233 -4.048 1.00 0.00 H new ATOM 0 HA SER A 51 17.023 -7.747 -5.426 1.00 0.00 H new ATOM 0 HB2 SER A 51 16.046 -7.306 -2.570 1.00 0.00 H new ATOM 0 HB3 SER A 51 16.582 -8.822 -3.268 1.00 0.00 H new ATOM 0 HG SER A 51 18.087 -7.109 -1.998 1.00 0.00 H new ATOM 812 N PRO A 52 14.634 -8.545 -5.701 1.00 0.00 N ATOM 813 CA PRO A 52 13.256 -8.873 -6.072 1.00 0.00 C ATOM 814 C PRO A 52 12.411 -9.343 -4.887 1.00 0.00 C ATOM 815 O PRO A 52 11.206 -9.106 -4.849 1.00 0.00 O ATOM 816 CB PRO A 52 13.427 -10.007 -7.083 1.00 0.00 C ATOM 817 CG PRO A 52 14.716 -10.653 -6.715 1.00 0.00 C ATOM 818 CD PRO A 52 15.595 -9.552 -6.187 1.00 0.00 C ATOM 0 HA PRO A 52 12.728 -8.002 -6.459 1.00 0.00 H new ATOM 0 HB2 PRO A 52 12.600 -10.715 -7.027 1.00 0.00 H new ATOM 0 HB3 PRO A 52 13.453 -9.626 -8.104 1.00 0.00 H new ATOM 0 HG2 PRO A 52 14.564 -11.426 -5.962 1.00 0.00 H new ATOM 0 HG3 PRO A 52 15.172 -11.135 -7.580 1.00 0.00 H new ATOM 0 HD2 PRO A 52 16.244 -9.906 -5.386 1.00 0.00 H new ATOM 0 HD3 PRO A 52 16.241 -9.147 -6.965 1.00 0.00 H new ATOM 826 N GLU A 53 13.038 -10.008 -3.923 1.00 0.00 N ATOM 827 CA GLU A 53 12.298 -10.578 -2.805 1.00 0.00 C ATOM 828 C GLU A 53 12.670 -9.899 -1.488 1.00 0.00 C ATOM 829 O GLU A 53 12.132 -10.236 -0.433 1.00 0.00 O ATOM 830 CB GLU A 53 12.566 -12.084 -2.698 1.00 0.00 C ATOM 831 CG GLU A 53 12.330 -12.855 -3.992 1.00 0.00 C ATOM 832 CD GLU A 53 10.909 -12.738 -4.517 1.00 0.00 C ATOM 833 OE1 GLU A 53 9.991 -13.332 -3.910 1.00 0.00 O ATOM 834 OE2 GLU A 53 10.712 -12.080 -5.556 1.00 0.00 O ATOM 0 H GLU A 53 14.046 -10.164 -3.893 1.00 0.00 H new ATOM 0 HA GLU A 53 11.238 -10.410 -2.993 1.00 0.00 H new ATOM 0 HB2 GLU A 53 13.598 -12.236 -2.381 1.00 0.00 H new ATOM 0 HB3 GLU A 53 11.928 -12.501 -1.919 1.00 0.00 H new ATOM 0 HG2 GLU A 53 13.021 -12.492 -4.753 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.562 -13.907 -3.826 1.00 0.00 H new ATOM 841 N HIS A 54 13.595 -8.945 -1.544 1.00 0.00 N ATOM 842 CA HIS A 54 14.056 -8.259 -0.337 1.00 0.00 C ATOM 843 C HIS A 54 13.738 -6.776 -0.420 1.00 0.00 C ATOM 844 O HIS A 54 13.831 -6.182 -1.491 1.00 0.00 O ATOM 845 CB HIS A 54 15.566 -8.422 -0.138 1.00 0.00 C ATOM 846 CG HIS A 54 16.025 -9.824 0.118 1.00 0.00 C ATOM 847 ND1 HIS A 54 17.344 -10.145 0.349 1.00 0.00 N ATOM 848 CD2 HIS A 54 15.345 -10.991 0.170 1.00 0.00 C ATOM 849 CE1 HIS A 54 17.454 -11.446 0.534 1.00 0.00 C ATOM 850 NE2 HIS A 54 16.254 -11.982 0.431 1.00 0.00 N ATOM 0 H HIS A 54 14.039 -8.629 -2.406 1.00 0.00 H new ATOM 0 HA HIS A 54 13.536 -8.711 0.508 1.00 0.00 H new ATOM 0 HB2 HIS A 54 16.076 -8.045 -1.024 1.00 0.00 H new ATOM 0 HB3 HIS A 54 15.876 -7.796 0.699 1.00 0.00 H new ATOM 0 HD2 HIS A 54 14.282 -11.119 0.031 1.00 0.00 H new ATOM 0 HE1 HIS A 54 18.370 -11.981 0.735 1.00 0.00 H new ATOM 0 HE2 HIS A 54 16.037 -12.974 0.530 1.00 0.00 H new ATOM 859 N PHE A 55 13.389 -6.177 0.708 1.00 0.00 N ATOM 860 CA PHE A 55 13.067 -4.758 0.736 1.00 0.00 C ATOM 861 C PHE A 55 13.766 -4.068 1.902 1.00 0.00 C ATOM 862 O PHE A 55 14.010 -4.681 2.946 1.00 0.00 O ATOM 863 CB PHE A 55 11.547 -4.542 0.825 1.00 0.00 C ATOM 864 CG PHE A 55 11.006 -4.411 2.224 1.00 0.00 C ATOM 865 CD1 PHE A 55 10.799 -5.530 3.015 1.00 0.00 C ATOM 866 CD2 PHE A 55 10.698 -3.160 2.743 1.00 0.00 C ATOM 867 CE1 PHE A 55 10.301 -5.401 4.298 1.00 0.00 C ATOM 868 CE2 PHE A 55 10.201 -3.029 4.023 1.00 0.00 C ATOM 869 CZ PHE A 55 10.001 -4.151 4.802 1.00 0.00 C ATOM 0 H PHE A 55 13.322 -6.647 1.611 1.00 0.00 H new ATOM 0 HA PHE A 55 13.424 -4.316 -0.194 1.00 0.00 H new ATOM 0 HB2 PHE A 55 11.289 -3.643 0.266 1.00 0.00 H new ATOM 0 HB3 PHE A 55 11.047 -5.377 0.334 1.00 0.00 H new ATOM 0 HD1 PHE A 55 11.029 -6.511 2.626 1.00 0.00 H new ATOM 0 HD2 PHE A 55 10.850 -2.279 2.137 1.00 0.00 H new ATOM 0 HE1 PHE A 55 10.146 -6.279 4.907 1.00 0.00 H new ATOM 0 HE2 PHE A 55 9.969 -2.050 4.415 1.00 0.00 H new ATOM 0 HZ PHE A 55 9.611 -4.051 5.804 1.00 0.00 H new ATOM 879 N SER A 56 14.086 -2.797 1.707 1.00 0.00 N ATOM 880 CA SER A 56 14.669 -1.955 2.746 1.00 0.00 C ATOM 881 C SER A 56 14.351 -0.504 2.428 1.00 0.00 C ATOM 882 O SER A 56 14.762 0.017 1.393 1.00 0.00 O ATOM 883 CB SER A 56 16.186 -2.131 2.837 1.00 0.00 C ATOM 884 OG SER A 56 16.550 -3.492 3.011 1.00 0.00 O ATOM 0 H SER A 56 13.948 -2.316 0.818 1.00 0.00 H new ATOM 0 HA SER A 56 14.243 -2.248 3.706 1.00 0.00 H new ATOM 0 HB2 SER A 56 16.652 -1.743 1.931 1.00 0.00 H new ATOM 0 HB3 SER A 56 16.571 -1.543 3.670 1.00 0.00 H new ATOM 0 HG SER A 56 17.102 -3.782 2.255 1.00 0.00 H new ATOM 890 N MET A 57 13.627 0.142 3.313 1.00 0.00 N ATOM 891 CA MET A 57 13.135 1.486 3.052 1.00 0.00 C ATOM 892 C MET A 57 13.763 2.489 4.009 1.00 0.00 C ATOM 893 O MET A 57 14.035 2.170 5.166 1.00 0.00 O ATOM 894 CB MET A 57 11.604 1.518 3.152 1.00 0.00 C ATOM 895 CG MET A 57 11.060 1.100 4.511 1.00 0.00 C ATOM 896 SD MET A 57 9.275 0.826 4.499 1.00 0.00 S ATOM 897 CE MET A 57 8.672 2.394 3.873 1.00 0.00 C ATOM 0 H MET A 57 13.363 -0.237 4.222 1.00 0.00 H new ATOM 0 HA MET A 57 13.421 1.769 2.039 1.00 0.00 H new ATOM 0 HB2 MET A 57 11.257 2.527 2.929 1.00 0.00 H new ATOM 0 HB3 MET A 57 11.187 0.861 2.388 1.00 0.00 H new ATOM 0 HG2 MET A 57 11.561 0.186 4.832 1.00 0.00 H new ATOM 0 HG3 MET A 57 11.300 1.869 5.245 1.00 0.00 H new ATOM 0 HE1 MET A 57 7.631 2.528 4.168 1.00 0.00 H new ATOM 0 HE2 MET A 57 9.273 3.205 4.284 1.00 0.00 H new ATOM 0 HE3 MET A 57 8.745 2.404 2.785 1.00 0.00 H new ATOM 907 N ASP A 58 13.997 3.697 3.518 1.00 0.00 N ATOM 908 CA ASP A 58 14.679 4.723 4.300 1.00 0.00 C ATOM 909 C ASP A 58 13.682 5.508 5.161 1.00 0.00 C ATOM 910 O ASP A 58 12.559 5.784 4.730 1.00 0.00 O ATOM 911 CB ASP A 58 15.437 5.662 3.350 1.00 0.00 C ATOM 912 CG ASP A 58 16.097 6.821 4.062 1.00 0.00 C ATOM 913 OD1 ASP A 58 17.154 6.617 4.697 1.00 0.00 O ATOM 914 OD2 ASP A 58 15.555 7.938 3.986 1.00 0.00 O ATOM 0 H ASP A 58 13.725 3.993 2.581 1.00 0.00 H new ATOM 0 HA ASP A 58 15.389 4.245 4.975 1.00 0.00 H new ATOM 0 HB2 ASP A 58 16.197 5.092 2.815 1.00 0.00 H new ATOM 0 HB3 ASP A 58 14.744 6.049 2.603 1.00 0.00 H new ATOM 919 N PRO A 59 14.082 5.875 6.394 1.00 0.00 N ATOM 920 CA PRO A 59 13.226 6.618 7.328 1.00 0.00 C ATOM 921 C PRO A 59 12.944 8.051 6.879 1.00 0.00 C ATOM 922 O PRO A 59 11.916 8.623 7.238 1.00 0.00 O ATOM 923 CB PRO A 59 14.025 6.620 8.633 1.00 0.00 C ATOM 924 CG PRO A 59 15.438 6.426 8.214 1.00 0.00 C ATOM 925 CD PRO A 59 15.389 5.553 6.994 1.00 0.00 C ATOM 0 HA PRO A 59 12.243 6.155 7.410 1.00 0.00 H new ATOM 0 HB2 PRO A 59 13.898 7.558 9.173 1.00 0.00 H new ATOM 0 HB3 PRO A 59 13.697 5.822 9.299 1.00 0.00 H new ATOM 0 HG2 PRO A 59 15.914 7.381 7.992 1.00 0.00 H new ATOM 0 HG3 PRO A 59 16.020 5.956 9.007 1.00 0.00 H new ATOM 0 HD2 PRO A 59 16.209 5.772 6.311 1.00 0.00 H new ATOM 0 HD3 PRO A 59 15.463 4.497 7.253 1.00 0.00 H new ATOM 933 N ARG A 60 13.842 8.632 6.092 1.00 0.00 N ATOM 934 CA ARG A 60 13.646 9.992 5.613 1.00 0.00 C ATOM 935 C ARG A 60 12.598 10.013 4.514 1.00 0.00 C ATOM 936 O ARG A 60 11.838 10.977 4.383 1.00 0.00 O ATOM 937 CB ARG A 60 14.964 10.607 5.135 1.00 0.00 C ATOM 938 CG ARG A 60 15.921 10.907 6.274 1.00 0.00 C ATOM 939 CD ARG A 60 15.309 11.908 7.238 1.00 0.00 C ATOM 940 NE ARG A 60 16.128 12.109 8.429 1.00 0.00 N ATOM 941 CZ ARG A 60 16.154 13.246 9.122 1.00 0.00 C ATOM 942 NH1 ARG A 60 15.435 14.288 8.715 1.00 0.00 N ATOM 943 NH2 ARG A 60 16.899 13.345 10.214 1.00 0.00 N ATOM 0 H ARG A 60 14.704 8.187 5.776 1.00 0.00 H new ATOM 0 HA ARG A 60 13.287 10.601 6.443 1.00 0.00 H new ATOM 0 HB2 ARG A 60 15.444 9.925 4.433 1.00 0.00 H new ATOM 0 HB3 ARG A 60 14.754 11.528 4.591 1.00 0.00 H new ATOM 0 HG2 ARG A 60 16.164 9.986 6.804 1.00 0.00 H new ATOM 0 HG3 ARG A 60 16.856 11.302 5.876 1.00 0.00 H new ATOM 0 HD2 ARG A 60 15.174 12.862 6.729 1.00 0.00 H new ATOM 0 HD3 ARG A 60 14.319 11.562 7.536 1.00 0.00 H new ATOM 0 HE ARG A 60 16.713 11.336 8.748 1.00 0.00 H new ATOM 0 HH11 ARG A 60 14.864 14.216 7.873 1.00 0.00 H new ATOM 0 HH12 ARG A 60 15.454 15.159 9.245 1.00 0.00 H new ATOM 0 HH21 ARG A 60 17.455 12.549 10.526 1.00 0.00 H new ATOM 0 HH22 ARG A 60 16.916 14.217 10.742 1.00 0.00 H new ATOM 957 N GLU A 61 12.544 8.936 3.737 1.00 0.00 N ATOM 958 CA GLU A 61 11.462 8.758 2.778 1.00 0.00 C ATOM 959 C GLU A 61 10.136 8.660 3.526 1.00 0.00 C ATOM 960 O GLU A 61 9.151 9.307 3.163 1.00 0.00 O ATOM 961 CB GLU A 61 11.680 7.500 1.933 1.00 0.00 C ATOM 962 CG GLU A 61 12.958 7.526 1.111 1.00 0.00 C ATOM 963 CD GLU A 61 13.057 8.744 0.211 1.00 0.00 C ATOM 964 OE1 GLU A 61 12.263 8.856 -0.743 1.00 0.00 O ATOM 965 OE2 GLU A 61 13.945 9.590 0.451 1.00 0.00 O ATOM 0 H GLU A 61 13.230 8.181 3.752 1.00 0.00 H new ATOM 0 HA GLU A 61 11.444 9.617 2.107 1.00 0.00 H new ATOM 0 HB2 GLU A 61 11.700 6.631 2.591 1.00 0.00 H new ATOM 0 HB3 GLU A 61 10.830 7.373 1.262 1.00 0.00 H new ATOM 0 HG2 GLU A 61 13.816 7.506 1.783 1.00 0.00 H new ATOM 0 HG3 GLU A 61 13.010 6.624 0.501 1.00 0.00 H new ATOM 972 N GLN A 62 10.132 7.858 4.591 1.00 0.00 N ATOM 973 CA GLN A 62 8.956 7.713 5.448 1.00 0.00 C ATOM 974 C GLN A 62 8.536 9.060 6.017 1.00 0.00 C ATOM 975 O GLN A 62 7.372 9.440 5.935 1.00 0.00 O ATOM 976 CB GLN A 62 9.239 6.756 6.610 1.00 0.00 C ATOM 977 CG GLN A 62 9.483 5.316 6.196 1.00 0.00 C ATOM 978 CD GLN A 62 9.794 4.425 7.386 1.00 0.00 C ATOM 979 OE1 GLN A 62 10.568 3.378 7.160 1.00 0.00 O flip ATOM 980 NE2 GLN A 62 9.346 4.682 8.502 1.00 0.00 N flip ATOM 0 H GLN A 62 10.933 7.297 4.881 1.00 0.00 H new ATOM 0 HA GLN A 62 8.153 7.308 4.832 1.00 0.00 H new ATOM 0 HB2 GLN A 62 10.111 7.116 7.156 1.00 0.00 H new ATOM 0 HB3 GLN A 62 8.396 6.784 7.301 1.00 0.00 H new ATOM 0 HG2 GLN A 62 8.603 4.934 5.678 1.00 0.00 H new ATOM 0 HG3 GLN A 62 10.311 5.278 5.489 1.00 0.00 H new ATOM 0 HE21 GLN A 62 8.752 5.500 8.637 1.00 0.00 H new ATOM 0 HE22 GLN A 62 9.569 4.077 9.293 1.00 0.00 H new ATOM 989 N LEU A 63 9.505 9.781 6.576 1.00 0.00 N ATOM 990 CA LEU A 63 9.248 11.064 7.220 1.00 0.00 C ATOM 991 C LEU A 63 8.575 12.034 6.258 1.00 0.00 C ATOM 992 O LEU A 63 7.659 12.760 6.638 1.00 0.00 O ATOM 993 CB LEU A 63 10.556 11.666 7.742 1.00 0.00 C ATOM 994 CG LEU A 63 10.401 12.939 8.578 1.00 0.00 C ATOM 995 CD1 LEU A 63 9.598 12.653 9.838 1.00 0.00 C ATOM 996 CD2 LEU A 63 11.764 13.513 8.932 1.00 0.00 C ATOM 0 H LEU A 63 10.484 9.494 6.595 1.00 0.00 H new ATOM 0 HA LEU A 63 8.574 10.892 8.059 1.00 0.00 H new ATOM 0 HB2 LEU A 63 11.068 10.915 8.344 1.00 0.00 H new ATOM 0 HB3 LEU A 63 11.201 11.886 6.891 1.00 0.00 H new ATOM 0 HG LEU A 63 9.861 13.678 7.986 1.00 0.00 H new ATOM 0 HD11 LEU A 63 9.497 13.569 10.421 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.609 12.287 9.564 1.00 0.00 H new ATOM 0 HD13 LEU A 63 10.112 11.899 10.434 1.00 0.00 H new ATOM 0 HD21 LEU A 63 11.635 14.418 9.526 1.00 0.00 H new ATOM 0 HD22 LEU A 63 12.330 12.779 9.506 1.00 0.00 H new ATOM 0 HD23 LEU A 63 12.306 13.754 8.018 1.00 0.00 H new ATOM 1008 N THR A 64 9.023 12.027 5.011 1.00 0.00 N ATOM 1009 CA THR A 64 8.454 12.892 3.990 1.00 0.00 C ATOM 1010 C THR A 64 6.977 12.558 3.762 1.00 0.00 C ATOM 1011 O THR A 64 6.127 13.449 3.717 1.00 0.00 O ATOM 1012 CB THR A 64 9.224 12.756 2.660 1.00 0.00 C ATOM 1013 OG1 THR A 64 10.624 12.981 2.881 1.00 0.00 O ATOM 1014 CG2 THR A 64 8.713 13.745 1.624 1.00 0.00 C ATOM 0 H THR A 64 9.781 11.430 4.682 1.00 0.00 H new ATOM 0 HA THR A 64 8.539 13.920 4.342 1.00 0.00 H new ATOM 0 HB THR A 64 9.066 11.746 2.282 1.00 0.00 H new ATOM 0 HG1 THR A 64 11.003 12.223 3.373 1.00 0.00 H new ATOM 0 HG21 THR A 64 9.275 13.625 0.698 1.00 0.00 H new ATOM 0 HG22 THR A 64 7.656 13.559 1.434 1.00 0.00 H new ATOM 0 HG23 THR A 64 8.841 14.761 1.997 1.00 0.00 H new ATOM 1022 N ALA A 65 6.683 11.269 3.652 1.00 0.00 N ATOM 1023 CA ALA A 65 5.317 10.813 3.414 1.00 0.00 C ATOM 1024 C ALA A 65 4.430 11.066 4.630 1.00 0.00 C ATOM 1025 O ALA A 65 3.308 11.554 4.499 1.00 0.00 O ATOM 1026 CB ALA A 65 5.306 9.337 3.048 1.00 0.00 C ATOM 0 H ALA A 65 7.371 10.520 3.724 1.00 0.00 H new ATOM 0 HA ALA A 65 4.913 11.385 2.579 1.00 0.00 H new ATOM 0 HB1 ALA A 65 4.280 9.013 2.874 1.00 0.00 H new ATOM 0 HB2 ALA A 65 5.894 9.182 2.143 1.00 0.00 H new ATOM 0 HB3 ALA A 65 5.736 8.757 3.864 1.00 0.00 H new ATOM 1032 N VAL A 66 4.943 10.738 5.812 1.00 0.00 N ATOM 1033 CA VAL A 66 4.198 10.922 7.054 1.00 0.00 C ATOM 1034 C VAL A 66 3.914 12.403 7.307 1.00 0.00 C ATOM 1035 O VAL A 66 2.827 12.765 7.761 1.00 0.00 O ATOM 1036 CB VAL A 66 4.958 10.321 8.260 1.00 0.00 C ATOM 1037 CG1 VAL A 66 4.219 10.585 9.562 1.00 0.00 C ATOM 1038 CG2 VAL A 66 5.167 8.827 8.067 1.00 0.00 C ATOM 0 H VAL A 66 5.875 10.342 5.936 1.00 0.00 H new ATOM 0 HA VAL A 66 3.250 10.395 6.944 1.00 0.00 H new ATOM 0 HB VAL A 66 5.931 10.808 8.318 1.00 0.00 H new ATOM 0 HG11 VAL A 66 4.777 10.151 10.392 1.00 0.00 H new ATOM 0 HG12 VAL A 66 4.121 11.660 9.713 1.00 0.00 H new ATOM 0 HG13 VAL A 66 3.228 10.134 9.516 1.00 0.00 H new ATOM 0 HG21 VAL A 66 5.703 8.421 8.925 1.00 0.00 H new ATOM 0 HG22 VAL A 66 4.200 8.333 7.977 1.00 0.00 H new ATOM 0 HG23 VAL A 66 5.748 8.655 7.161 1.00 0.00 H new ATOM 1048 N LYS A 67 4.887 13.250 6.993 1.00 0.00 N ATOM 1049 CA LYS A 67 4.739 14.691 7.163 1.00 0.00 C ATOM 1050 C LYS A 67 3.582 15.214 6.321 1.00 0.00 C ATOM 1051 O LYS A 67 2.726 15.951 6.809 1.00 0.00 O ATOM 1052 CB LYS A 67 6.033 15.400 6.759 1.00 0.00 C ATOM 1053 CG LYS A 67 6.015 16.900 7.001 1.00 0.00 C ATOM 1054 CD LYS A 67 7.339 17.537 6.609 1.00 0.00 C ATOM 1055 CE LYS A 67 8.487 17.017 7.462 1.00 0.00 C ATOM 1056 NZ LYS A 67 8.321 17.367 8.898 1.00 0.00 N ATOM 0 H LYS A 67 5.791 12.962 6.618 1.00 0.00 H new ATOM 0 HA LYS A 67 4.528 14.895 8.213 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.864 14.963 7.313 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.222 15.215 5.702 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.207 17.354 6.428 1.00 0.00 H new ATOM 0 HG3 LYS A 67 5.810 17.099 8.053 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.544 17.333 5.558 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.268 18.619 6.715 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.553 15.934 7.359 1.00 0.00 H new ATOM 0 HE3 LYS A 67 9.427 17.430 7.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.208 17.177 9.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 8.081 18.375 8.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 7.557 16.793 9.309 1.00 0.00 H new ATOM 1070 N ASP A 68 3.553 14.801 5.062 1.00 0.00 N ATOM 1071 CA ASP A 68 2.513 15.225 4.129 1.00 0.00 C ATOM 1072 C ASP A 68 1.171 14.636 4.543 1.00 0.00 C ATOM 1073 O ASP A 68 0.130 15.295 4.477 1.00 0.00 O ATOM 1074 CB ASP A 68 2.877 14.767 2.714 1.00 0.00 C ATOM 1075 CG ASP A 68 2.001 15.381 1.636 1.00 0.00 C ATOM 1076 OD1 ASP A 68 1.376 16.429 1.883 1.00 0.00 O ATOM 1077 OD2 ASP A 68 1.953 14.825 0.522 1.00 0.00 O ATOM 0 H ASP A 68 4.243 14.167 4.658 1.00 0.00 H new ATOM 0 HA ASP A 68 2.436 16.312 4.144 1.00 0.00 H new ATOM 0 HB2 ASP A 68 3.918 15.022 2.514 1.00 0.00 H new ATOM 0 HB3 ASP A 68 2.799 13.681 2.660 1.00 0.00 H new ATOM 1082 N MET A 69 1.224 13.395 5.001 1.00 0.00 N ATOM 1083 CA MET A 69 0.031 12.662 5.406 1.00 0.00 C ATOM 1084 C MET A 69 -0.682 13.362 6.558 1.00 0.00 C ATOM 1085 O MET A 69 -1.875 13.654 6.480 1.00 0.00 O ATOM 1086 CB MET A 69 0.436 11.260 5.861 1.00 0.00 C ATOM 1087 CG MET A 69 -0.680 10.240 5.795 1.00 0.00 C ATOM 1088 SD MET A 69 -1.058 9.758 4.103 1.00 0.00 S ATOM 1089 CE MET A 69 0.511 9.054 3.604 1.00 0.00 C ATOM 0 H MET A 69 2.091 12.868 5.103 1.00 0.00 H new ATOM 0 HA MET A 69 -0.646 12.613 4.553 1.00 0.00 H new ATOM 0 HB2 MET A 69 1.265 10.915 5.243 1.00 0.00 H new ATOM 0 HB3 MET A 69 0.803 11.315 6.886 1.00 0.00 H new ATOM 0 HG2 MET A 69 -0.398 9.357 6.368 1.00 0.00 H new ATOM 0 HG3 MET A 69 -1.575 10.651 6.263 1.00 0.00 H new ATOM 0 HE1 MET A 69 0.355 8.376 2.765 1.00 0.00 H new ATOM 0 HE2 MET A 69 1.189 9.853 3.304 1.00 0.00 H new ATOM 0 HE3 MET A 69 0.945 8.504 4.439 1.00 0.00 H new ATOM 1099 N ARG A 70 0.075 13.679 7.600 1.00 0.00 N ATOM 1100 CA ARG A 70 -0.495 14.271 8.809 1.00 0.00 C ATOM 1101 C ARG A 70 -0.840 15.737 8.591 1.00 0.00 C ATOM 1102 O ARG A 70 -1.709 16.289 9.268 1.00 0.00 O ATOM 1103 CB ARG A 70 0.470 14.111 9.987 1.00 0.00 C ATOM 1104 CG ARG A 70 0.671 12.658 10.395 1.00 0.00 C ATOM 1105 CD ARG A 70 1.610 12.515 11.586 1.00 0.00 C ATOM 1106 NE ARG A 70 1.727 11.119 12.010 1.00 0.00 N ATOM 1107 CZ ARG A 70 2.473 10.698 13.032 1.00 0.00 C ATOM 1108 NH1 ARG A 70 3.216 11.556 13.728 1.00 0.00 N ATOM 1109 NH2 ARG A 70 2.482 9.409 13.344 1.00 0.00 N ATOM 0 H ARG A 70 1.085 13.537 7.635 1.00 0.00 H new ATOM 0 HA ARG A 70 -1.419 13.742 9.043 1.00 0.00 H new ATOM 0 HB2 ARG A 70 1.434 14.545 9.722 1.00 0.00 H new ATOM 0 HB3 ARG A 70 0.091 14.674 10.840 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -0.294 12.216 10.641 1.00 0.00 H new ATOM 0 HG3 ARG A 70 1.072 12.098 9.550 1.00 0.00 H new ATOM 0 HD2 ARG A 70 2.595 12.901 11.323 1.00 0.00 H new ATOM 0 HD3 ARG A 70 1.242 13.119 12.416 1.00 0.00 H new ATOM 0 HE ARG A 70 1.201 10.419 11.487 1.00 0.00 H new ATOM 0 HH11 ARG A 70 3.218 12.546 13.481 1.00 0.00 H new ATOM 0 HH12 ARG A 70 3.783 11.224 14.508 1.00 0.00 H new ATOM 0 HH21 ARG A 70 1.922 8.750 12.804 1.00 0.00 H new ATOM 0 HH22 ARG A 70 3.049 9.077 14.124 1.00 0.00 H new ATOM 1123 N LYS A 71 -0.158 16.352 7.636 1.00 0.00 N ATOM 1124 CA LYS A 71 -0.395 17.741 7.275 1.00 0.00 C ATOM 1125 C LYS A 71 -1.814 17.934 6.742 1.00 0.00 C ATOM 1126 O LYS A 71 -2.470 18.931 7.041 1.00 0.00 O ATOM 1127 CB LYS A 71 0.613 18.159 6.207 1.00 0.00 C ATOM 1128 CG LYS A 71 0.520 19.616 5.787 1.00 0.00 C ATOM 1129 CD LYS A 71 1.321 19.866 4.522 1.00 0.00 C ATOM 1130 CE LYS A 71 0.784 19.036 3.367 1.00 0.00 C ATOM 1131 NZ LYS A 71 1.630 19.149 2.153 1.00 0.00 N ATOM 0 H LYS A 71 0.576 15.901 7.089 1.00 0.00 H new ATOM 0 HA LYS A 71 -0.278 18.359 8.165 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.619 17.965 6.579 1.00 0.00 H new ATOM 0 HB3 LYS A 71 0.472 17.531 5.327 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -0.523 19.885 5.621 1.00 0.00 H new ATOM 0 HG3 LYS A 71 0.890 20.254 6.589 1.00 0.00 H new ATOM 0 HD2 LYS A 71 1.280 20.924 4.264 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.369 19.620 4.696 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.725 17.991 3.670 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -0.231 19.358 3.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 1.766 18.206 1.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.164 19.770 1.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.555 19.550 2.410 1.00 0.00 H new ATOM 1145 N ASN A 72 -2.282 16.975 5.951 1.00 0.00 N ATOM 1146 CA ASN A 72 -3.612 17.068 5.356 1.00 0.00 C ATOM 1147 C ASN A 72 -4.669 16.475 6.285 1.00 0.00 C ATOM 1148 O ASN A 72 -5.854 16.794 6.176 1.00 0.00 O ATOM 1149 CB ASN A 72 -3.644 16.355 3.999 1.00 0.00 C ATOM 1150 CG ASN A 72 -4.935 16.613 3.234 1.00 0.00 C ATOM 1151 OD1 ASN A 72 -5.041 17.588 2.493 1.00 0.00 O ATOM 1152 ND2 ASN A 72 -5.917 15.739 3.398 1.00 0.00 N ATOM 0 H ASN A 72 -1.765 16.130 5.708 1.00 0.00 H new ATOM 0 HA ASN A 72 -3.840 18.123 5.205 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.797 16.687 3.398 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -3.525 15.283 4.153 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -6.799 15.863 2.900 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -5.791 14.942 4.022 1.00 0.00 H new ATOM 1159 N GLY A 73 -4.237 15.635 7.214 1.00 0.00 N ATOM 1160 CA GLY A 73 -5.167 15.021 8.142 1.00 0.00 C ATOM 1161 C GLY A 73 -5.325 13.534 7.902 1.00 0.00 C ATOM 1162 O GLY A 73 -6.194 12.887 8.492 1.00 0.00 O ATOM 0 H GLY A 73 -3.261 15.367 7.343 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -4.821 15.187 9.162 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -6.139 15.506 8.052 1.00 0.00 H new ATOM 1166 N TRP A 74 -4.483 12.991 7.034 1.00 0.00 N ATOM 1167 CA TRP A 74 -4.483 11.565 6.758 1.00 0.00 C ATOM 1168 C TRP A 74 -3.651 10.832 7.802 1.00 0.00 C ATOM 1169 O TRP A 74 -2.881 11.446 8.538 1.00 0.00 O ATOM 1170 CB TRP A 74 -3.902 11.266 5.374 1.00 0.00 C ATOM 1171 CG TRP A 74 -4.697 11.801 4.228 1.00 0.00 C ATOM 1172 CD1 TRP A 74 -6.043 11.697 4.042 1.00 0.00 C ATOM 1173 CD2 TRP A 74 -4.186 12.490 3.079 1.00 0.00 C ATOM 1174 NE1 TRP A 74 -6.403 12.293 2.859 1.00 0.00 N ATOM 1175 CE2 TRP A 74 -5.281 12.784 2.247 1.00 0.00 C ATOM 1176 CE3 TRP A 74 -2.908 12.890 2.677 1.00 0.00 C ATOM 1177 CZ2 TRP A 74 -5.137 13.459 1.035 1.00 0.00 C ATOM 1178 CZ3 TRP A 74 -2.767 13.560 1.477 1.00 0.00 C ATOM 1179 CH2 TRP A 74 -3.875 13.838 0.668 1.00 0.00 C ATOM 0 H TRP A 74 -3.789 13.521 6.508 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.518 11.224 6.790 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -2.895 11.679 5.322 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -3.810 10.186 5.260 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -6.727 11.216 4.726 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -7.353 12.359 2.495 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -2.047 12.679 3.293 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -5.991 13.674 0.409 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -1.785 13.875 1.157 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -3.730 14.362 -0.265 1.00 0.00 H new ATOM 1190 N VAL A 75 -3.803 9.521 7.852 1.00 0.00 N ATOM 1191 CA VAL A 75 -3.000 8.691 8.736 1.00 0.00 C ATOM 1192 C VAL A 75 -2.373 7.558 7.940 1.00 0.00 C ATOM 1193 O VAL A 75 -2.910 7.153 6.905 1.00 0.00 O ATOM 1194 CB VAL A 75 -3.829 8.115 9.908 1.00 0.00 C ATOM 1195 CG1 VAL A 75 -4.222 9.223 10.878 1.00 0.00 C ATOM 1196 CG2 VAL A 75 -5.064 7.391 9.385 1.00 0.00 C ATOM 0 H VAL A 75 -4.478 9.005 7.288 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.222 9.321 9.167 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.214 7.393 10.445 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -4.805 8.800 11.696 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -3.323 9.693 11.277 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -4.820 9.970 10.355 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -5.635 6.993 10.224 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.684 8.089 8.823 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -4.757 6.573 8.733 1.00 0.00 H new ATOM 1206 N MET A 76 -1.226 7.072 8.396 1.00 0.00 N ATOM 1207 CA MET A 76 -0.553 5.968 7.724 1.00 0.00 C ATOM 1208 C MET A 76 -1.330 4.681 7.954 1.00 0.00 C ATOM 1209 O MET A 76 -1.317 4.121 9.050 1.00 0.00 O ATOM 1210 CB MET A 76 0.892 5.826 8.218 1.00 0.00 C ATOM 1211 CG MET A 76 1.683 4.738 7.501 1.00 0.00 C ATOM 1212 SD MET A 76 3.417 4.686 8.000 1.00 0.00 S ATOM 1213 CE MET A 76 3.273 4.307 9.745 1.00 0.00 C ATOM 0 H MET A 76 -0.744 7.422 9.224 1.00 0.00 H new ATOM 0 HA MET A 76 -0.518 6.175 6.654 1.00 0.00 H new ATOM 0 HB2 MET A 76 1.405 6.779 8.090 1.00 0.00 H new ATOM 0 HB3 MET A 76 0.881 5.610 9.286 1.00 0.00 H new ATOM 0 HG2 MET A 76 1.223 3.770 7.701 1.00 0.00 H new ATOM 0 HG3 MET A 76 1.625 4.902 6.425 1.00 0.00 H new ATOM 0 HE1 MET A 76 4.237 3.966 10.124 1.00 0.00 H new ATOM 0 HE2 MET A 76 2.965 5.201 10.287 1.00 0.00 H new ATOM 0 HE3 MET A 76 2.530 3.523 9.887 1.00 0.00 H new ATOM 1223 N LEU A 77 -2.015 4.229 6.914 1.00 0.00 N ATOM 1224 CA LEU A 77 -2.915 3.091 7.029 1.00 0.00 C ATOM 1225 C LEU A 77 -2.239 1.794 6.616 1.00 0.00 C ATOM 1226 O LEU A 77 -2.856 0.729 6.638 1.00 0.00 O ATOM 1227 CB LEU A 77 -4.157 3.317 6.173 1.00 0.00 C ATOM 1228 CG LEU A 77 -5.072 4.452 6.628 1.00 0.00 C ATOM 1229 CD1 LEU A 77 -6.223 4.633 5.653 1.00 0.00 C ATOM 1230 CD2 LEU A 77 -5.608 4.172 8.019 1.00 0.00 C ATOM 0 H LEU A 77 -1.965 4.634 5.979 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.201 3.003 8.077 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.840 3.517 5.150 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -4.736 2.393 6.152 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.489 5.373 6.654 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.864 5.446 5.994 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.829 4.871 4.665 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.803 3.712 5.600 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.258 4.990 8.330 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.175 3.241 8.010 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -4.777 4.084 8.718 1.00 0.00 H new ATOM 1242 N GLY A 78 -0.985 1.880 6.220 1.00 0.00 N ATOM 1243 CA GLY A 78 -0.251 0.692 5.853 1.00 0.00 C ATOM 1244 C GLY A 78 0.674 0.928 4.686 1.00 0.00 C ATOM 1245 O GLY A 78 1.046 2.070 4.403 1.00 0.00 O ATOM 0 H GLY A 78 -0.460 2.751 6.145 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.329 0.347 6.709 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -0.953 -0.103 5.602 1.00 0.00 H new ATOM 1249 N ASN A 79 1.030 -0.143 3.999 1.00 0.00 N ATOM 1250 CA ASN A 79 1.963 -0.070 2.885 1.00 0.00 C ATOM 1251 C ASN A 79 1.605 -1.098 1.825 1.00 0.00 C ATOM 1252 O ASN A 79 0.649 -1.860 1.983 1.00 0.00 O ATOM 1253 CB ASN A 79 3.400 -0.303 3.369 1.00 0.00 C ATOM 1254 CG ASN A 79 3.634 -1.699 3.930 1.00 0.00 C ATOM 1255 OD1 ASN A 79 2.728 -2.329 4.471 1.00 0.00 O ATOM 1256 ND2 ASN A 79 4.858 -2.188 3.804 1.00 0.00 N ATOM 0 H ASN A 79 0.684 -1.082 4.194 1.00 0.00 H new ATOM 0 HA ASN A 79 1.895 0.927 2.450 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.086 -0.134 2.539 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.640 0.433 4.136 1.00 0.00 H new ATOM 0 HD21 ASN A 79 5.075 -3.118 4.162 1.00 0.00 H new ATOM 0 HD22 ASN A 79 5.584 -1.635 3.349 1.00 0.00 H new ATOM 1263 N PHE A 80 2.368 -1.115 0.750 1.00 0.00 N ATOM 1264 CA PHE A 80 2.150 -2.075 -0.315 1.00 0.00 C ATOM 1265 C PHE A 80 3.461 -2.747 -0.689 1.00 0.00 C ATOM 1266 O PHE A 80 4.519 -2.113 -0.686 1.00 0.00 O ATOM 1267 CB PHE A 80 1.499 -1.416 -1.543 1.00 0.00 C ATOM 1268 CG PHE A 80 2.307 -0.309 -2.168 1.00 0.00 C ATOM 1269 CD1 PHE A 80 2.229 0.985 -1.678 1.00 0.00 C ATOM 1270 CD2 PHE A 80 3.135 -0.562 -3.250 1.00 0.00 C ATOM 1271 CE1 PHE A 80 2.961 2.003 -2.252 1.00 0.00 C ATOM 1272 CE2 PHE A 80 3.872 0.454 -3.829 1.00 0.00 C ATOM 1273 CZ PHE A 80 3.783 1.738 -3.330 1.00 0.00 C ATOM 0 H PHE A 80 3.145 -0.474 0.590 1.00 0.00 H new ATOM 0 HA PHE A 80 1.459 -2.835 0.049 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.316 -2.183 -2.296 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.527 -1.018 -1.252 1.00 0.00 H new ATOM 0 HD1 PHE A 80 1.587 1.199 -0.836 1.00 0.00 H new ATOM 0 HD2 PHE A 80 3.205 -1.565 -3.645 1.00 0.00 H new ATOM 0 HE1 PHE A 80 2.892 3.007 -1.859 1.00 0.00 H new ATOM 0 HE2 PHE A 80 4.516 0.244 -4.670 1.00 0.00 H new ATOM 0 HZ PHE A 80 4.355 2.535 -3.782 1.00 0.00 H new ATOM 1283 N HIS A 81 3.384 -4.033 -0.982 1.00 0.00 N ATOM 1284 CA HIS A 81 4.554 -4.821 -1.327 1.00 0.00 C ATOM 1285 C HIS A 81 4.188 -5.815 -2.414 1.00 0.00 C ATOM 1286 O HIS A 81 3.226 -6.573 -2.289 1.00 0.00 O ATOM 1287 CB HIS A 81 5.083 -5.534 -0.078 1.00 0.00 C ATOM 1288 CG HIS A 81 6.224 -6.488 -0.302 1.00 0.00 C ATOM 1289 ND1 HIS A 81 7.496 -6.096 -0.658 1.00 0.00 N ATOM 1290 CD2 HIS A 81 6.277 -7.832 -0.162 1.00 0.00 C ATOM 1291 CE1 HIS A 81 8.279 -7.157 -0.724 1.00 0.00 C ATOM 1292 NE2 HIS A 81 7.565 -8.230 -0.423 1.00 0.00 N ATOM 0 H HIS A 81 2.511 -4.560 -0.988 1.00 0.00 H new ATOM 0 HA HIS A 81 5.343 -4.171 -1.705 1.00 0.00 H new ATOM 0 HB2 HIS A 81 5.401 -4.779 0.641 1.00 0.00 H new ATOM 0 HB3 HIS A 81 4.260 -6.083 0.380 1.00 0.00 H new ATOM 0 HD1 HIS A 81 7.787 -5.136 -0.842 1.00 0.00 H new ATOM 0 HD2 HIS A 81 5.454 -8.477 0.107 1.00 0.00 H new ATOM 0 HE1 HIS A 81 9.328 -7.150 -0.981 1.00 0.00 H new ATOM 0 HE2 HIS A 81 7.912 -9.189 -0.390 1.00 0.00 H new ATOM 1301 N SER A 82 4.964 -5.813 -3.468 1.00 0.00 N ATOM 1302 CA SER A 82 4.668 -6.617 -4.637 1.00 0.00 C ATOM 1303 C SER A 82 5.726 -7.694 -4.817 1.00 0.00 C ATOM 1304 O SER A 82 6.830 -7.583 -4.291 1.00 0.00 O ATOM 1305 CB SER A 82 4.597 -5.723 -5.884 1.00 0.00 C ATOM 1306 OG SER A 82 4.270 -6.469 -7.046 1.00 0.00 O ATOM 0 H SER A 82 5.816 -5.258 -3.545 1.00 0.00 H new ATOM 0 HA SER A 82 3.702 -7.102 -4.497 1.00 0.00 H new ATOM 0 HB2 SER A 82 3.851 -4.943 -5.731 1.00 0.00 H new ATOM 0 HB3 SER A 82 5.555 -5.224 -6.029 1.00 0.00 H new ATOM 0 HG SER A 82 3.696 -7.224 -6.799 1.00 0.00 H new ATOM 1312 N HIS A 83 5.368 -8.760 -5.507 1.00 0.00 N ATOM 1313 CA HIS A 83 6.344 -9.756 -5.907 1.00 0.00 C ATOM 1314 C HIS A 83 6.483 -9.724 -7.423 1.00 0.00 C ATOM 1315 O HIS A 83 5.485 -9.565 -8.127 1.00 0.00 O ATOM 1316 CB HIS A 83 5.913 -11.152 -5.452 1.00 0.00 C ATOM 1317 CG HIS A 83 5.991 -11.385 -3.973 1.00 0.00 C ATOM 1318 ND1 HIS A 83 4.979 -11.990 -3.261 1.00 0.00 N ATOM 1319 CD2 HIS A 83 6.975 -11.126 -3.076 1.00 0.00 C ATOM 1320 CE1 HIS A 83 5.330 -12.089 -1.994 1.00 0.00 C ATOM 1321 NE2 HIS A 83 6.537 -11.575 -1.849 1.00 0.00 N ATOM 0 H HIS A 83 4.412 -8.958 -5.802 1.00 0.00 H new ATOM 0 HA HIS A 83 7.302 -9.529 -5.438 1.00 0.00 H new ATOM 0 HB2 HIS A 83 4.888 -11.324 -5.779 1.00 0.00 H new ATOM 0 HB3 HIS A 83 6.537 -11.891 -5.955 1.00 0.00 H new ATOM 0 HD1 HIS A 83 4.094 -12.312 -3.653 1.00 0.00 H new ATOM 0 HD2 HIS A 83 7.925 -10.656 -3.285 1.00 0.00 H new ATOM 0 HE1 HIS A 83 4.730 -12.519 -1.206 1.00 0.00 H new ATOM 0 HE2 HIS A 83 7.059 -11.519 -0.974 1.00 0.00 H new ATOM 1330 N PRO A 84 7.708 -9.875 -7.951 1.00 0.00 N ATOM 1331 CA PRO A 84 7.961 -9.841 -9.388 1.00 0.00 C ATOM 1332 C PRO A 84 7.804 -11.207 -10.054 1.00 0.00 C ATOM 1333 O PRO A 84 7.013 -11.370 -10.981 1.00 0.00 O ATOM 1334 CB PRO A 84 9.424 -9.372 -9.483 1.00 0.00 C ATOM 1335 CG PRO A 84 9.941 -9.296 -8.074 1.00 0.00 C ATOM 1336 CD PRO A 84 8.956 -10.030 -7.205 1.00 0.00 C ATOM 0 HA PRO A 84 7.250 -9.195 -9.902 1.00 0.00 H new ATOM 0 HB2 PRO A 84 10.017 -10.068 -10.076 1.00 0.00 H new ATOM 0 HB3 PRO A 84 9.489 -8.400 -9.973 1.00 0.00 H new ATOM 0 HG2 PRO A 84 10.931 -9.747 -8.001 1.00 0.00 H new ATOM 0 HG3 PRO A 84 10.039 -8.259 -7.754 1.00 0.00 H new ATOM 0 HD2 PRO A 84 9.227 -11.078 -7.079 1.00 0.00 H new ATOM 0 HD3 PRO A 84 8.890 -9.595 -6.208 1.00 0.00 H new ATOM 1344 N ALA A 85 8.547 -12.190 -9.567 1.00 0.00 N ATOM 1345 CA ALA A 85 8.520 -13.525 -10.139 1.00 0.00 C ATOM 1346 C ALA A 85 7.899 -14.500 -9.153 1.00 0.00 C ATOM 1347 O ALA A 85 8.113 -15.710 -9.225 1.00 0.00 O ATOM 1348 CB ALA A 85 9.928 -13.961 -10.517 1.00 0.00 C ATOM 0 H ALA A 85 9.179 -12.086 -8.773 1.00 0.00 H new ATOM 0 HA ALA A 85 7.911 -13.515 -11.043 1.00 0.00 H new ATOM 0 HB1 ALA A 85 9.896 -14.963 -10.945 1.00 0.00 H new ATOM 0 HB2 ALA A 85 10.340 -13.267 -11.250 1.00 0.00 H new ATOM 0 HB3 ALA A 85 10.558 -13.966 -9.628 1.00 0.00 H new ATOM 1354 N THR A 86 7.111 -13.961 -8.242 1.00 0.00 N ATOM 1355 CA THR A 86 6.472 -14.756 -7.211 1.00 0.00 C ATOM 1356 C THR A 86 5.005 -14.348 -7.067 1.00 0.00 C ATOM 1357 O THR A 86 4.632 -13.235 -7.447 1.00 0.00 O ATOM 1358 CB THR A 86 7.219 -14.607 -5.868 1.00 0.00 C ATOM 1359 OG1 THR A 86 7.862 -13.327 -5.800 1.00 0.00 O ATOM 1360 CG2 THR A 86 8.254 -15.707 -5.695 1.00 0.00 C ATOM 0 H THR A 86 6.897 -12.965 -8.196 1.00 0.00 H new ATOM 0 HA THR A 86 6.512 -15.806 -7.502 1.00 0.00 H new ATOM 0 HB THR A 86 6.487 -14.689 -5.064 1.00 0.00 H new ATOM 0 HG1 THR A 86 8.488 -13.315 -5.046 1.00 0.00 H new ATOM 0 HG21 THR A 86 8.766 -15.578 -4.741 1.00 0.00 H new ATOM 0 HG22 THR A 86 7.759 -16.678 -5.714 1.00 0.00 H new ATOM 0 HG23 THR A 86 8.980 -15.654 -6.506 1.00 0.00 H new ATOM 1368 N PRO A 87 4.150 -15.245 -6.544 1.00 0.00 N ATOM 1369 CA PRO A 87 2.706 -15.002 -6.447 1.00 0.00 C ATOM 1370 C PRO A 87 2.323 -14.054 -5.310 1.00 0.00 C ATOM 1371 O PRO A 87 3.184 -13.504 -4.616 1.00 0.00 O ATOM 1372 CB PRO A 87 2.139 -16.397 -6.189 1.00 0.00 C ATOM 1373 CG PRO A 87 3.226 -17.117 -5.470 1.00 0.00 C ATOM 1374 CD PRO A 87 4.521 -16.572 -6.012 1.00 0.00 C ATOM 0 HA PRO A 87 2.322 -14.516 -7.344 1.00 0.00 H new ATOM 0 HB2 PRO A 87 1.230 -16.351 -5.589 1.00 0.00 H new ATOM 0 HB3 PRO A 87 1.881 -16.899 -7.122 1.00 0.00 H new ATOM 0 HG2 PRO A 87 3.155 -16.955 -4.394 1.00 0.00 H new ATOM 0 HG3 PRO A 87 3.157 -18.192 -5.635 1.00 0.00 H new ATOM 0 HD2 PRO A 87 5.279 -16.493 -5.233 1.00 0.00 H new ATOM 0 HD3 PRO A 87 4.931 -17.215 -6.791 1.00 0.00 H new ATOM 1382 N ALA A 88 1.021 -13.876 -5.120 1.00 0.00 N ATOM 1383 CA ALA A 88 0.511 -13.001 -4.077 1.00 0.00 C ATOM 1384 C ALA A 88 0.594 -13.677 -2.711 1.00 0.00 C ATOM 1385 O ALA A 88 1.055 -14.819 -2.607 1.00 0.00 O ATOM 1386 CB ALA A 88 -0.923 -12.591 -4.383 1.00 0.00 C ATOM 0 H ALA A 88 0.298 -14.329 -5.679 1.00 0.00 H new ATOM 0 HA ALA A 88 1.131 -12.105 -4.050 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -1.291 -11.936 -3.593 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -0.955 -12.063 -5.336 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -1.551 -13.480 -4.439 1.00 0.00 H new ATOM 1392 N ARG A 89 0.127 -12.964 -1.684 1.00 0.00 N ATOM 1393 CA ARG A 89 0.226 -13.396 -0.286 1.00 0.00 C ATOM 1394 C ARG A 89 1.679 -13.303 0.192 1.00 0.00 C ATOM 1395 O ARG A 89 2.613 -13.576 -0.564 1.00 0.00 O ATOM 1396 CB ARG A 89 -0.311 -14.830 -0.106 1.00 0.00 C ATOM 1397 CG ARG A 89 -0.448 -15.264 1.345 1.00 0.00 C ATOM 1398 CD ARG A 89 -0.760 -16.747 1.465 1.00 0.00 C ATOM 1399 NE ARG A 89 -1.954 -17.128 0.709 1.00 0.00 N ATOM 1400 CZ ARG A 89 -2.791 -18.100 1.072 1.00 0.00 C ATOM 1401 NH1 ARG A 89 -2.610 -18.757 2.212 1.00 0.00 N ATOM 1402 NH2 ARG A 89 -3.818 -18.407 0.295 1.00 0.00 N ATOM 0 H ARG A 89 -0.335 -12.062 -1.799 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.389 -12.731 0.320 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -1.285 -14.905 -0.590 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.355 -15.523 -0.620 1.00 0.00 H new ATOM 0 HG2 ARG A 89 0.476 -15.043 1.879 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -1.239 -14.687 1.824 1.00 0.00 H new ATOM 0 HD2 ARG A 89 0.093 -17.325 1.108 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -0.901 -17.002 2.515 1.00 0.00 H new ATOM 0 HE ARG A 89 -2.159 -16.617 -0.150 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -1.825 -18.519 2.819 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -3.256 -19.499 2.481 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -3.967 -17.900 -0.578 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -4.461 -19.150 0.569 1.00 0.00 H new ATOM 1416 N PRO A 90 1.894 -12.897 1.449 1.00 0.00 N ATOM 1417 CA PRO A 90 3.233 -12.860 2.037 1.00 0.00 C ATOM 1418 C PRO A 90 3.776 -14.259 2.325 1.00 0.00 C ATOM 1419 O PRO A 90 3.035 -15.144 2.763 1.00 0.00 O ATOM 1420 CB PRO A 90 3.025 -12.086 3.342 1.00 0.00 C ATOM 1421 CG PRO A 90 1.597 -12.311 3.692 1.00 0.00 C ATOM 1422 CD PRO A 90 0.863 -12.408 2.384 1.00 0.00 C ATOM 0 HA PRO A 90 3.962 -12.404 1.368 1.00 0.00 H new ATOM 0 HB2 PRO A 90 3.687 -12.450 4.128 1.00 0.00 H new ATOM 0 HB3 PRO A 90 3.238 -11.025 3.211 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.477 -13.224 4.276 1.00 0.00 H new ATOM 0 HG3 PRO A 90 1.209 -11.492 4.298 1.00 0.00 H new ATOM 0 HD2 PRO A 90 0.019 -13.095 2.447 1.00 0.00 H new ATOM 0 HD3 PRO A 90 0.465 -11.442 2.074 1.00 0.00 H new ATOM 1430 N SER A 91 5.061 -14.461 2.058 1.00 0.00 N ATOM 1431 CA SER A 91 5.720 -15.713 2.398 1.00 0.00 C ATOM 1432 C SER A 91 6.074 -15.717 3.884 1.00 0.00 C ATOM 1433 O SER A 91 5.681 -14.807 4.618 1.00 0.00 O ATOM 1434 CB SER A 91 6.979 -15.899 1.541 1.00 0.00 C ATOM 1435 OG SER A 91 7.905 -14.840 1.737 1.00 0.00 O ATOM 0 H SER A 91 5.665 -13.774 1.608 1.00 0.00 H new ATOM 0 HA SER A 91 5.044 -16.544 2.194 1.00 0.00 H new ATOM 0 HB2 SER A 91 7.453 -16.848 1.790 1.00 0.00 H new ATOM 0 HB3 SER A 91 6.700 -15.949 0.489 1.00 0.00 H new ATOM 0 HG SER A 91 7.697 -14.105 1.123 1.00 0.00 H new ATOM 1441 N ALA A 92 6.813 -16.729 4.322 1.00 0.00 N ATOM 1442 CA ALA A 92 7.219 -16.824 5.718 1.00 0.00 C ATOM 1443 C ALA A 92 7.994 -15.580 6.141 1.00 0.00 C ATOM 1444 O ALA A 92 7.727 -14.993 7.191 1.00 0.00 O ATOM 1445 CB ALA A 92 8.055 -18.077 5.941 1.00 0.00 C ATOM 0 H ALA A 92 7.142 -17.493 3.732 1.00 0.00 H new ATOM 0 HA ALA A 92 6.322 -16.891 6.334 1.00 0.00 H new ATOM 0 HB1 ALA A 92 8.351 -18.135 6.988 1.00 0.00 H new ATOM 0 HB2 ALA A 92 7.467 -18.957 5.681 1.00 0.00 H new ATOM 0 HB3 ALA A 92 8.945 -18.037 5.314 1.00 0.00 H new ATOM 1451 N GLU A 93 8.939 -15.168 5.307 1.00 0.00 N ATOM 1452 CA GLU A 93 9.745 -13.992 5.589 1.00 0.00 C ATOM 1453 C GLU A 93 8.942 -12.708 5.405 1.00 0.00 C ATOM 1454 O GLU A 93 9.068 -11.788 6.208 1.00 0.00 O ATOM 1455 CB GLU A 93 10.994 -13.988 4.714 1.00 0.00 C ATOM 1456 CG GLU A 93 11.956 -15.110 5.064 1.00 0.00 C ATOM 1457 CD GLU A 93 13.071 -15.250 4.060 1.00 0.00 C ATOM 1458 OE1 GLU A 93 14.116 -14.596 4.233 1.00 0.00 O ATOM 1459 OE2 GLU A 93 12.902 -16.015 3.086 1.00 0.00 O ATOM 0 H GLU A 93 9.165 -15.633 4.428 1.00 0.00 H new ATOM 0 HA GLU A 93 10.053 -14.033 6.634 1.00 0.00 H new ATOM 0 HB2 GLU A 93 10.701 -14.079 3.668 1.00 0.00 H new ATOM 0 HB3 GLU A 93 11.504 -13.031 4.820 1.00 0.00 H new ATOM 0 HG2 GLU A 93 12.381 -14.925 6.050 1.00 0.00 H new ATOM 0 HG3 GLU A 93 11.406 -16.049 5.125 1.00 0.00 H new ATOM 1466 N ASP A 94 8.094 -12.653 4.372 1.00 0.00 N ATOM 1467 CA ASP A 94 7.252 -11.471 4.143 1.00 0.00 C ATOM 1468 C ASP A 94 6.363 -11.209 5.357 1.00 0.00 C ATOM 1469 O ASP A 94 6.131 -10.062 5.733 1.00 0.00 O ATOM 1470 CB ASP A 94 6.348 -11.625 2.907 1.00 0.00 C ATOM 1471 CG ASP A 94 7.067 -11.563 1.570 1.00 0.00 C ATOM 1472 OD1 ASP A 94 7.587 -10.487 1.206 1.00 0.00 O ATOM 1473 OD2 ASP A 94 7.065 -12.587 0.852 1.00 0.00 O ATOM 0 H ASP A 94 7.972 -13.401 3.689 1.00 0.00 H new ATOM 0 HA ASP A 94 7.932 -10.636 3.975 1.00 0.00 H new ATOM 0 HB2 ASP A 94 5.824 -12.578 2.976 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.590 -10.842 2.931 1.00 0.00 H new ATOM 1478 N LYS A 95 5.870 -12.284 5.968 1.00 0.00 N ATOM 1479 CA LYS A 95 4.979 -12.171 7.117 1.00 0.00 C ATOM 1480 C LYS A 95 5.738 -11.670 8.345 1.00 0.00 C ATOM 1481 O LYS A 95 5.179 -10.978 9.194 1.00 0.00 O ATOM 1482 CB LYS A 95 4.303 -13.518 7.404 1.00 0.00 C ATOM 1483 CG LYS A 95 3.117 -13.419 8.353 1.00 0.00 C ATOM 1484 CD LYS A 95 2.257 -14.674 8.319 1.00 0.00 C ATOM 1485 CE LYS A 95 2.931 -15.860 8.993 1.00 0.00 C ATOM 1486 NZ LYS A 95 3.008 -15.691 10.467 1.00 0.00 N ATOM 0 H LYS A 95 6.073 -13.243 5.685 1.00 0.00 H new ATOM 0 HA LYS A 95 4.204 -11.442 6.881 1.00 0.00 H new ATOM 0 HB2 LYS A 95 3.968 -13.954 6.463 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.040 -14.201 7.827 1.00 0.00 H new ATOM 0 HG2 LYS A 95 3.477 -13.253 9.368 1.00 0.00 H new ATOM 0 HG3 LYS A 95 2.509 -12.555 8.085 1.00 0.00 H new ATOM 0 HD2 LYS A 95 1.306 -14.472 8.812 1.00 0.00 H new ATOM 0 HD3 LYS A 95 2.032 -14.928 7.283 1.00 0.00 H new ATOM 0 HE2 LYS A 95 2.379 -16.771 8.761 1.00 0.00 H new ATOM 0 HE3 LYS A 95 3.936 -15.984 8.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 3.316 -16.584 10.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 3.691 -14.941 10.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 2.071 -15.430 10.836 1.00 0.00 H new ATOM 1500 N ARG A 96 7.020 -12.007 8.425 1.00 0.00 N ATOM 1501 CA ARG A 96 7.869 -11.537 9.518 1.00 0.00 C ATOM 1502 C ARG A 96 8.239 -10.069 9.325 1.00 0.00 C ATOM 1503 O ARG A 96 8.666 -9.396 10.263 1.00 0.00 O ATOM 1504 CB ARG A 96 9.141 -12.380 9.632 1.00 0.00 C ATOM 1505 CG ARG A 96 8.896 -13.802 10.107 1.00 0.00 C ATOM 1506 CD ARG A 96 10.203 -14.548 10.318 1.00 0.00 C ATOM 1507 NE ARG A 96 11.051 -13.901 11.322 1.00 0.00 N ATOM 1508 CZ ARG A 96 12.325 -14.228 11.545 1.00 0.00 C ATOM 1509 NH1 ARG A 96 12.903 -15.195 10.843 1.00 0.00 N ATOM 1510 NH2 ARG A 96 13.027 -13.585 12.471 1.00 0.00 N ATOM 0 H ARG A 96 7.496 -12.603 7.748 1.00 0.00 H new ATOM 0 HA ARG A 96 7.300 -11.640 10.442 1.00 0.00 H new ATOM 0 HB2 ARG A 96 9.633 -12.412 8.660 1.00 0.00 H new ATOM 0 HB3 ARG A 96 9.829 -11.891 10.321 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.331 -13.784 11.039 1.00 0.00 H new ATOM 0 HG3 ARG A 96 8.287 -14.332 9.375 1.00 0.00 H new ATOM 0 HD2 ARG A 96 9.990 -15.571 10.629 1.00 0.00 H new ATOM 0 HD3 ARG A 96 10.742 -14.608 9.373 1.00 0.00 H new ATOM 0 HE ARG A 96 10.642 -13.155 11.885 1.00 0.00 H new ATOM 0 HH11 ARG A 96 12.373 -15.693 10.128 1.00 0.00 H new ATOM 0 HH12 ARG A 96 13.877 -15.440 11.019 1.00 0.00 H new ATOM 0 HH21 ARG A 96 12.592 -12.839 13.014 1.00 0.00 H new ATOM 0 HH22 ARG A 96 14.001 -13.837 12.639 1.00 0.00 H new ATOM 1524 N LEU A 97 8.084 -9.584 8.101 1.00 0.00 N ATOM 1525 CA LEU A 97 8.381 -8.198 7.774 1.00 0.00 C ATOM 1526 C LEU A 97 7.210 -7.295 8.157 1.00 0.00 C ATOM 1527 O LEU A 97 7.314 -6.068 8.121 1.00 0.00 O ATOM 1528 CB LEU A 97 8.684 -8.076 6.278 1.00 0.00 C ATOM 1529 CG LEU A 97 9.878 -8.903 5.790 1.00 0.00 C ATOM 1530 CD1 LEU A 97 9.989 -8.851 4.274 1.00 0.00 C ATOM 1531 CD2 LEU A 97 11.162 -8.408 6.435 1.00 0.00 C ATOM 0 H LEU A 97 7.751 -10.137 7.311 1.00 0.00 H new ATOM 0 HA LEU A 97 9.255 -7.879 8.341 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.799 -8.377 5.718 1.00 0.00 H new ATOM 0 HB3 LEU A 97 8.868 -7.027 6.044 1.00 0.00 H new ATOM 0 HG LEU A 97 9.718 -9.941 6.083 1.00 0.00 H new ATOM 0 HD11 LEU A 97 10.844 -9.445 3.951 1.00 0.00 H new ATOM 0 HD12 LEU A 97 9.079 -9.253 3.829 1.00 0.00 H new ATOM 0 HD13 LEU A 97 10.124 -7.818 3.954 1.00 0.00 H new ATOM 0 HD21 LEU A 97 12.002 -9.005 6.079 1.00 0.00 H new ATOM 0 HD22 LEU A 97 11.322 -7.363 6.171 1.00 0.00 H new ATOM 0 HD23 LEU A 97 11.084 -8.501 7.518 1.00 0.00 H new ATOM 1543 N ALA A 98 6.100 -7.913 8.525 1.00 0.00 N ATOM 1544 CA ALA A 98 4.932 -7.178 8.975 1.00 0.00 C ATOM 1545 C ALA A 98 5.007 -6.957 10.478 1.00 0.00 C ATOM 1546 O ALA A 98 4.600 -7.810 11.268 1.00 0.00 O ATOM 1547 CB ALA A 98 3.657 -7.916 8.600 1.00 0.00 C ATOM 0 H ALA A 98 5.984 -8.926 8.520 1.00 0.00 H new ATOM 0 HA ALA A 98 4.915 -6.207 8.480 1.00 0.00 H new ATOM 0 HB1 ALA A 98 2.793 -7.349 8.946 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.607 -8.029 7.517 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.656 -8.901 9.068 1.00 0.00 H new ATOM 1553 N PHE A 99 5.553 -5.817 10.867 1.00 0.00 N ATOM 1554 CA PHE A 99 5.795 -5.525 12.273 1.00 0.00 C ATOM 1555 C PHE A 99 4.559 -4.947 12.958 1.00 0.00 C ATOM 1556 O PHE A 99 4.405 -5.070 14.174 1.00 0.00 O ATOM 1557 CB PHE A 99 6.970 -4.557 12.417 1.00 0.00 C ATOM 1558 CG PHE A 99 8.233 -5.052 11.771 1.00 0.00 C ATOM 1559 CD1 PHE A 99 8.893 -6.165 12.269 1.00 0.00 C ATOM 1560 CD2 PHE A 99 8.763 -4.403 10.667 1.00 0.00 C ATOM 1561 CE1 PHE A 99 10.058 -6.619 11.681 1.00 0.00 C ATOM 1562 CE2 PHE A 99 9.927 -4.853 10.074 1.00 0.00 C ATOM 1563 CZ PHE A 99 10.575 -5.962 10.579 1.00 0.00 C ATOM 0 H PHE A 99 5.838 -5.075 10.228 1.00 0.00 H new ATOM 0 HA PHE A 99 6.036 -6.468 12.764 1.00 0.00 H new ATOM 0 HB2 PHE A 99 6.697 -3.598 11.977 1.00 0.00 H new ATOM 0 HB3 PHE A 99 7.158 -4.380 13.476 1.00 0.00 H new ATOM 0 HD1 PHE A 99 8.492 -6.683 13.127 1.00 0.00 H new ATOM 0 HD2 PHE A 99 8.260 -3.535 10.266 1.00 0.00 H new ATOM 0 HE1 PHE A 99 10.564 -7.485 12.081 1.00 0.00 H new ATOM 0 HE2 PHE A 99 10.330 -4.337 9.215 1.00 0.00 H new ATOM 0 HZ PHE A 99 11.484 -6.316 10.115 1.00 0.00 H new ATOM 1573 N ASP A 100 3.682 -4.323 12.186 1.00 0.00 N ATOM 1574 CA ASP A 100 2.505 -3.665 12.752 1.00 0.00 C ATOM 1575 C ASP A 100 1.212 -4.249 12.180 1.00 0.00 C ATOM 1576 O ASP A 100 0.721 -3.800 11.145 1.00 0.00 O ATOM 1577 CB ASP A 100 2.555 -2.155 12.522 1.00 0.00 C ATOM 1578 CG ASP A 100 1.556 -1.414 13.389 1.00 0.00 C ATOM 1579 OD1 ASP A 100 1.774 -1.345 14.618 1.00 0.00 O ATOM 1580 OD2 ASP A 100 0.553 -0.902 12.856 1.00 0.00 O ATOM 0 H ASP A 100 3.758 -4.256 11.171 1.00 0.00 H new ATOM 0 HA ASP A 100 2.514 -3.849 13.826 1.00 0.00 H new ATOM 0 HB2 ASP A 100 3.560 -1.789 12.734 1.00 0.00 H new ATOM 0 HB3 ASP A 100 2.353 -1.941 11.472 1.00 0.00 H new ATOM 1585 N PRO A 101 0.674 -5.292 12.832 1.00 0.00 N ATOM 1586 CA PRO A 101 -0.519 -6.031 12.364 1.00 0.00 C ATOM 1587 C PRO A 101 -1.792 -5.177 12.262 1.00 0.00 C ATOM 1588 O PRO A 101 -2.839 -5.659 11.823 1.00 0.00 O ATOM 1589 CB PRO A 101 -0.708 -7.116 13.434 1.00 0.00 C ATOM 1590 CG PRO A 101 0.014 -6.610 14.629 1.00 0.00 C ATOM 1591 CD PRO A 101 1.185 -5.838 14.101 1.00 0.00 C ATOM 0 HA PRO A 101 -0.364 -6.404 11.352 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -1.764 -7.277 13.650 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -0.301 -8.072 13.103 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -0.631 -5.975 15.236 1.00 0.00 H new ATOM 0 HG3 PRO A 101 0.342 -7.432 15.265 1.00 0.00 H new ATOM 0 HD2 PRO A 101 1.490 -5.048 14.787 1.00 0.00 H new ATOM 0 HD3 PRO A 101 2.054 -6.478 13.945 1.00 0.00 H new ATOM 1599 N SER A 102 -1.707 -3.923 12.675 1.00 0.00 N ATOM 1600 CA SER A 102 -2.864 -3.041 12.671 1.00 0.00 C ATOM 1601 C SER A 102 -2.971 -2.266 11.357 1.00 0.00 C ATOM 1602 O SER A 102 -3.937 -1.531 11.132 1.00 0.00 O ATOM 1603 CB SER A 102 -2.781 -2.089 13.864 1.00 0.00 C ATOM 1604 OG SER A 102 -1.435 -1.926 14.290 1.00 0.00 O ATOM 0 H SER A 102 -0.848 -3.492 13.018 1.00 0.00 H new ATOM 0 HA SER A 102 -3.766 -3.647 12.759 1.00 0.00 H new ATOM 0 HB2 SER A 102 -3.200 -1.120 13.591 1.00 0.00 H new ATOM 0 HB3 SER A 102 -3.383 -2.477 14.686 1.00 0.00 H new ATOM 0 HG SER A 102 -0.939 -1.412 13.619 1.00 0.00 H new ATOM 1610 N LEU A 103 -1.984 -2.450 10.493 1.00 0.00 N ATOM 1611 CA LEU A 103 -1.935 -1.753 9.215 1.00 0.00 C ATOM 1612 C LEU A 103 -2.488 -2.625 8.092 1.00 0.00 C ATOM 1613 O LEU A 103 -2.670 -3.829 8.261 1.00 0.00 O ATOM 1614 CB LEU A 103 -0.494 -1.358 8.889 1.00 0.00 C ATOM 1615 CG LEU A 103 0.132 -0.316 9.817 1.00 0.00 C ATOM 1616 CD1 LEU A 103 1.560 -0.016 9.389 1.00 0.00 C ATOM 1617 CD2 LEU A 103 -0.696 0.958 9.830 1.00 0.00 C ATOM 0 H LEU A 103 -1.200 -3.082 10.655 1.00 0.00 H new ATOM 0 HA LEU A 103 -2.552 -0.858 9.296 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.124 -2.256 8.911 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.463 -0.975 7.869 1.00 0.00 H new ATOM 0 HG LEU A 103 0.149 -0.723 10.828 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.992 0.727 10.059 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.152 -0.930 9.431 1.00 0.00 H new ATOM 0 HD13 LEU A 103 1.561 0.370 8.370 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.233 1.686 10.496 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.746 1.369 8.822 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.703 0.734 10.181 1.00 0.00 H new ATOM 1629 N SER A 104 -2.756 -2.005 6.948 1.00 0.00 N ATOM 1630 CA SER A 104 -3.201 -2.731 5.767 1.00 0.00 C ATOM 1631 C SER A 104 -2.006 -3.056 4.879 1.00 0.00 C ATOM 1632 O SER A 104 -1.349 -2.149 4.363 1.00 0.00 O ATOM 1633 CB SER A 104 -4.208 -1.893 4.974 1.00 0.00 C ATOM 1634 OG SER A 104 -5.175 -1.308 5.826 1.00 0.00 O ATOM 0 H SER A 104 -2.672 -0.997 6.815 1.00 0.00 H new ATOM 0 HA SER A 104 -3.681 -3.655 6.088 1.00 0.00 H new ATOM 0 HB2 SER A 104 -3.682 -1.111 4.426 1.00 0.00 H new ATOM 0 HB3 SER A 104 -4.704 -2.521 4.234 1.00 0.00 H new ATOM 0 HG SER A 104 -4.775 -0.552 6.304 1.00 0.00 H new ATOM 1640 N TYR A 105 -1.719 -4.339 4.716 1.00 0.00 N ATOM 1641 CA TYR A 105 -0.611 -4.772 3.879 1.00 0.00 C ATOM 1642 C TYR A 105 -1.130 -5.270 2.540 1.00 0.00 C ATOM 1643 O TYR A 105 -1.656 -6.379 2.436 1.00 0.00 O ATOM 1644 CB TYR A 105 0.195 -5.873 4.574 1.00 0.00 C ATOM 1645 CG TYR A 105 0.895 -5.410 5.833 1.00 0.00 C ATOM 1646 CD1 TYR A 105 0.188 -5.216 7.014 1.00 0.00 C ATOM 1647 CD2 TYR A 105 2.261 -5.160 5.839 1.00 0.00 C ATOM 1648 CE1 TYR A 105 0.820 -4.786 8.162 1.00 0.00 C ATOM 1649 CE2 TYR A 105 2.903 -4.730 6.987 1.00 0.00 C ATOM 1650 CZ TYR A 105 2.177 -4.547 8.146 1.00 0.00 C ATOM 1651 OH TYR A 105 2.802 -4.116 9.295 1.00 0.00 O ATOM 0 H TYR A 105 -2.239 -5.099 5.153 1.00 0.00 H new ATOM 0 HA TYR A 105 0.046 -3.919 3.710 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -0.472 -6.698 4.822 1.00 0.00 H new ATOM 0 HB3 TYR A 105 0.938 -6.262 3.878 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -0.875 -5.405 7.033 1.00 0.00 H new ATOM 0 HD2 TYR A 105 2.831 -5.303 4.933 1.00 0.00 H new ATOM 0 HE1 TYR A 105 0.254 -4.637 9.070 1.00 0.00 H new ATOM 0 HE2 TYR A 105 3.966 -4.539 6.976 1.00 0.00 H new ATOM 0 HH TYR A 105 2.129 -3.806 9.937 1.00 0.00 H new ATOM 1661 N LEU A 106 -1.007 -4.436 1.525 1.00 0.00 N ATOM 1662 CA LEU A 106 -1.458 -4.803 0.195 1.00 0.00 C ATOM 1663 C LEU A 106 -0.354 -5.535 -0.549 1.00 0.00 C ATOM 1664 O LEU A 106 0.769 -5.040 -0.664 1.00 0.00 O ATOM 1665 CB LEU A 106 -1.911 -3.571 -0.599 1.00 0.00 C ATOM 1666 CG LEU A 106 -3.313 -3.046 -0.261 1.00 0.00 C ATOM 1667 CD1 LEU A 106 -3.375 -2.506 1.158 1.00 0.00 C ATOM 1668 CD2 LEU A 106 -3.735 -1.977 -1.257 1.00 0.00 C ATOM 0 H LEU A 106 -0.600 -3.503 1.595 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.316 -5.467 0.300 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -1.192 -2.769 -0.433 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.879 -3.813 -1.661 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.008 -3.883 -0.330 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.381 -2.142 1.365 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.124 -3.301 1.861 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.664 -1.687 1.267 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.731 -1.616 -1.003 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -3.028 -1.148 -1.222 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.748 -2.400 -2.261 1.00 0.00 H new ATOM 1680 N ILE A 107 -0.677 -6.718 -1.043 1.00 0.00 N ATOM 1681 CA ILE A 107 0.292 -7.542 -1.741 1.00 0.00 C ATOM 1682 C ILE A 107 -0.078 -7.644 -3.214 1.00 0.00 C ATOM 1683 O ILE A 107 -1.185 -8.063 -3.562 1.00 0.00 O ATOM 1684 CB ILE A 107 0.382 -8.963 -1.134 1.00 0.00 C ATOM 1685 CG1 ILE A 107 0.743 -8.898 0.358 1.00 0.00 C ATOM 1686 CG2 ILE A 107 1.398 -9.808 -1.892 1.00 0.00 C ATOM 1687 CD1 ILE A 107 2.098 -8.282 0.643 1.00 0.00 C ATOM 0 H ILE A 107 -1.607 -7.130 -0.973 1.00 0.00 H new ATOM 0 HA ILE A 107 1.266 -7.065 -1.633 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.597 -9.434 -1.228 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -0.022 -8.324 0.881 1.00 0.00 H new ATOM 0 HG13 ILE A 107 0.721 -9.907 0.770 1.00 0.00 H new ATOM 0 HG21 ILE A 107 1.446 -10.803 -1.450 1.00 0.00 H new ATOM 0 HG22 ILE A 107 1.097 -9.889 -2.936 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.379 -9.337 -1.833 1.00 0.00 H new ATOM 0 HD11 ILE A 107 2.275 -8.274 1.718 1.00 0.00 H new ATOM 0 HD12 ILE A 107 2.875 -8.868 0.152 1.00 0.00 H new ATOM 0 HD13 ILE A 107 2.120 -7.260 0.264 1.00 0.00 H new ATOM 1699 N ILE A 108 0.846 -7.240 -4.067 1.00 0.00 N ATOM 1700 CA ILE A 108 0.627 -7.262 -5.504 1.00 0.00 C ATOM 1701 C ILE A 108 1.394 -8.418 -6.138 1.00 0.00 C ATOM 1702 O ILE A 108 2.530 -8.710 -5.754 1.00 0.00 O ATOM 1703 CB ILE A 108 1.056 -5.927 -6.157 1.00 0.00 C ATOM 1704 CG1 ILE A 108 0.365 -4.749 -5.461 1.00 0.00 C ATOM 1705 CG2 ILE A 108 0.726 -5.933 -7.645 1.00 0.00 C ATOM 1706 CD1 ILE A 108 0.803 -3.396 -5.976 1.00 0.00 C ATOM 0 H ILE A 108 1.762 -6.890 -3.788 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.440 -7.400 -5.677 1.00 0.00 H new ATOM 0 HB ILE A 108 2.134 -5.815 -6.043 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -0.713 -4.845 -5.589 1.00 0.00 H new ATOM 0 HG13 ILE A 108 0.565 -4.803 -4.391 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.034 -4.987 -8.090 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.255 -6.752 -8.132 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.348 -6.064 -7.779 1.00 0.00 H new ATOM 0 HD11 ILE A 108 0.272 -2.612 -5.437 1.00 0.00 H new ATOM 0 HD12 ILE A 108 1.876 -3.278 -5.823 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.578 -3.321 -7.040 1.00 0.00 H new ATOM 1718 N SER A 109 0.756 -9.093 -7.079 1.00 0.00 N ATOM 1719 CA SER A 109 1.391 -10.182 -7.796 1.00 0.00 C ATOM 1720 C SER A 109 1.707 -9.752 -9.227 1.00 0.00 C ATOM 1721 O SER A 109 0.811 -9.669 -10.072 1.00 0.00 O ATOM 1722 CB SER A 109 0.473 -11.412 -7.796 1.00 0.00 C ATOM 1723 OG SER A 109 1.108 -12.537 -8.381 1.00 0.00 O ATOM 0 H SER A 109 -0.205 -8.904 -7.364 1.00 0.00 H new ATOM 0 HA SER A 109 2.325 -10.442 -7.298 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.181 -11.649 -6.773 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.442 -11.184 -8.343 1.00 0.00 H new ATOM 0 HG SER A 109 0.497 -13.303 -8.364 1.00 0.00 H new ATOM 1729 N LEU A 110 2.980 -9.475 -9.491 1.00 0.00 N ATOM 1730 CA LEU A 110 3.417 -9.072 -10.825 1.00 0.00 C ATOM 1731 C LEU A 110 3.799 -10.297 -11.645 1.00 0.00 C ATOM 1732 O LEU A 110 4.287 -10.182 -12.770 1.00 0.00 O ATOM 1733 CB LEU A 110 4.600 -8.097 -10.736 1.00 0.00 C ATOM 1734 CG LEU A 110 4.390 -6.740 -11.421 1.00 0.00 C ATOM 1735 CD1 LEU A 110 4.161 -6.916 -12.917 1.00 0.00 C ATOM 1736 CD2 LEU A 110 3.223 -5.995 -10.789 1.00 0.00 C ATOM 0 H LEU A 110 3.728 -9.522 -8.799 1.00 0.00 H new ATOM 0 HA LEU A 110 2.591 -8.562 -11.320 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.826 -7.922 -9.684 1.00 0.00 H new ATOM 0 HB3 LEU A 110 5.476 -8.575 -11.175 1.00 0.00 H new ATOM 0 HG LEU A 110 5.295 -6.148 -11.282 1.00 0.00 H new ATOM 0 HD11 LEU A 110 4.015 -5.940 -13.380 1.00 0.00 H new ATOM 0 HD12 LEU A 110 5.028 -7.403 -13.363 1.00 0.00 H new ATOM 0 HD13 LEU A 110 3.276 -7.531 -13.080 1.00 0.00 H new ATOM 0 HD21 LEU A 110 3.090 -5.035 -11.289 1.00 0.00 H new ATOM 0 HD22 LEU A 110 2.314 -6.587 -10.894 1.00 0.00 H new ATOM 0 HD23 LEU A 110 3.428 -5.828 -9.731 1.00 0.00 H new ATOM 1748 N ALA A 111 3.560 -11.474 -11.069 1.00 0.00 N ATOM 1749 CA ALA A 111 3.797 -12.737 -11.758 1.00 0.00 C ATOM 1750 C ALA A 111 2.959 -12.821 -13.034 1.00 0.00 C ATOM 1751 O ALA A 111 3.299 -13.537 -13.977 1.00 0.00 O ATOM 1752 CB ALA A 111 3.478 -13.903 -10.836 1.00 0.00 C ATOM 0 H ALA A 111 3.200 -11.577 -10.120 1.00 0.00 H new ATOM 0 HA ALA A 111 4.849 -12.788 -12.037 1.00 0.00 H new ATOM 0 HB1 ALA A 111 3.658 -14.841 -11.360 1.00 0.00 H new ATOM 0 HB2 ALA A 111 4.114 -13.853 -9.952 1.00 0.00 H new ATOM 0 HB3 ALA A 111 2.432 -13.852 -10.533 1.00 0.00 H new ATOM 1758 N GLU A 112 1.858 -12.080 -13.047 1.00 0.00 N ATOM 1759 CA GLU A 112 0.999 -11.986 -14.213 1.00 0.00 C ATOM 1760 C GLU A 112 0.854 -10.520 -14.618 1.00 0.00 C ATOM 1761 O GLU A 112 -0.067 -9.838 -14.176 1.00 0.00 O ATOM 1762 CB GLU A 112 -0.376 -12.602 -13.925 1.00 0.00 C ATOM 1763 CG GLU A 112 -1.295 -12.643 -15.136 1.00 0.00 C ATOM 1764 CD GLU A 112 -0.753 -13.513 -16.250 1.00 0.00 C ATOM 1765 OE1 GLU A 112 0.177 -13.072 -16.960 1.00 0.00 O ATOM 1766 OE2 GLU A 112 -1.258 -14.641 -16.426 1.00 0.00 O ATOM 0 H GLU A 112 1.539 -11.530 -12.250 1.00 0.00 H new ATOM 0 HA GLU A 112 1.450 -12.543 -15.034 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -0.238 -13.616 -13.550 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -0.860 -12.032 -13.132 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -2.273 -13.016 -14.832 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -1.442 -11.630 -15.510 1.00 0.00 H new ATOM 1773 N PRO A 113 1.791 -10.006 -15.431 1.00 0.00 N ATOM 1774 CA PRO A 113 1.818 -8.594 -15.827 1.00 0.00 C ATOM 1775 C PRO A 113 0.675 -8.203 -16.755 1.00 0.00 C ATOM 1776 O PRO A 113 0.505 -7.029 -17.089 1.00 0.00 O ATOM 1777 CB PRO A 113 3.166 -8.432 -16.544 1.00 0.00 C ATOM 1778 CG PRO A 113 3.935 -9.679 -16.244 1.00 0.00 C ATOM 1779 CD PRO A 113 2.913 -10.751 -16.016 1.00 0.00 C ATOM 0 HA PRO A 113 1.700 -7.947 -14.958 1.00 0.00 H new ATOM 0 HB2 PRO A 113 3.026 -8.307 -17.618 1.00 0.00 H new ATOM 0 HB3 PRO A 113 3.696 -7.549 -16.187 1.00 0.00 H new ATOM 0 HG2 PRO A 113 4.595 -9.939 -17.072 1.00 0.00 H new ATOM 0 HG3 PRO A 113 4.564 -9.547 -15.364 1.00 0.00 H new ATOM 0 HD2 PRO A 113 2.630 -11.246 -16.945 1.00 0.00 H new ATOM 0 HD3 PRO A 113 3.281 -11.525 -15.342 1.00 0.00 H new ATOM 1787 N GLN A 114 -0.095 -9.187 -17.177 1.00 0.00 N ATOM 1788 CA GLN A 114 -1.284 -8.932 -17.973 1.00 0.00 C ATOM 1789 C GLN A 114 -2.375 -8.357 -17.080 1.00 0.00 C ATOM 1790 O GLN A 114 -3.081 -7.420 -17.457 1.00 0.00 O ATOM 1791 CB GLN A 114 -1.767 -10.222 -18.635 1.00 0.00 C ATOM 1792 CG GLN A 114 -0.710 -10.884 -19.503 1.00 0.00 C ATOM 1793 CD GLN A 114 -1.189 -12.171 -20.145 1.00 0.00 C ATOM 1794 OE1 GLN A 114 -1.717 -12.166 -21.257 1.00 0.00 O ATOM 1795 NE2 GLN A 114 -1.010 -13.281 -19.447 1.00 0.00 N ATOM 0 H GLN A 114 0.080 -10.173 -16.982 1.00 0.00 H new ATOM 0 HA GLN A 114 -1.044 -8.214 -18.757 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -2.083 -10.922 -17.862 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -2.643 -10.003 -19.245 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -0.401 -10.188 -20.283 1.00 0.00 H new ATOM 0 HG3 GLN A 114 0.171 -11.093 -18.896 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -0.568 -13.240 -18.529 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -1.314 -14.177 -19.827 1.00 0.00 H new ATOM 1804 N LYS A 115 -2.471 -8.913 -15.877 1.00 0.00 N ATOM 1805 CA LYS A 115 -3.472 -8.521 -14.900 1.00 0.00 C ATOM 1806 C LYS A 115 -2.934 -8.763 -13.493 1.00 0.00 C ATOM 1807 O LYS A 115 -3.210 -9.800 -12.885 1.00 0.00 O ATOM 1808 CB LYS A 115 -4.772 -9.309 -15.107 1.00 0.00 C ATOM 1809 CG LYS A 115 -5.554 -8.896 -16.347 1.00 0.00 C ATOM 1810 CD LYS A 115 -6.768 -9.788 -16.598 1.00 0.00 C ATOM 1811 CE LYS A 115 -7.939 -9.465 -15.678 1.00 0.00 C ATOM 1812 NZ LYS A 115 -7.746 -9.977 -14.296 1.00 0.00 N ATOM 0 H LYS A 115 -1.850 -9.654 -15.553 1.00 0.00 H new ATOM 0 HA LYS A 115 -3.691 -7.461 -15.029 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -4.535 -10.371 -15.176 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -5.406 -9.181 -14.230 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -5.883 -7.863 -16.237 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -4.896 -8.931 -17.215 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -7.086 -9.678 -17.635 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -6.481 -10.831 -16.461 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -8.080 -8.385 -15.644 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -8.851 -9.893 -16.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -8.604 -10.477 -13.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -6.938 -10.632 -14.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -7.560 -9.181 -13.653 1.00 0.00 H new ATOM 1826 N PRO A 116 -2.127 -7.825 -12.973 1.00 0.00 N ATOM 1827 CA PRO A 116 -1.485 -7.967 -11.662 1.00 0.00 C ATOM 1828 C PRO A 116 -2.501 -8.018 -10.529 1.00 0.00 C ATOM 1829 O PRO A 116 -3.201 -7.039 -10.259 1.00 0.00 O ATOM 1830 CB PRO A 116 -0.609 -6.715 -11.538 1.00 0.00 C ATOM 1831 CG PRO A 116 -0.502 -6.171 -12.921 1.00 0.00 C ATOM 1832 CD PRO A 116 -1.777 -6.551 -13.614 1.00 0.00 C ATOM 0 HA PRO A 116 -0.921 -8.897 -11.589 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -1.058 -5.987 -10.863 1.00 0.00 H new ATOM 0 HB3 PRO A 116 0.373 -6.961 -11.135 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -0.374 -5.089 -12.906 1.00 0.00 H new ATOM 0 HG3 PRO A 116 0.362 -6.587 -13.438 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -2.554 -5.800 -13.472 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -1.635 -6.664 -14.689 1.00 0.00 H new ATOM 1840 N VAL A 117 -2.585 -9.167 -9.875 1.00 0.00 N ATOM 1841 CA VAL A 117 -3.545 -9.353 -8.799 1.00 0.00 C ATOM 1842 C VAL A 117 -3.126 -8.548 -7.574 1.00 0.00 C ATOM 1843 O VAL A 117 -2.032 -8.737 -7.039 1.00 0.00 O ATOM 1844 CB VAL A 117 -3.674 -10.843 -8.409 1.00 0.00 C ATOM 1845 CG1 VAL A 117 -4.735 -11.033 -7.339 1.00 0.00 C ATOM 1846 CG2 VAL A 117 -3.980 -11.694 -9.628 1.00 0.00 C ATOM 0 H VAL A 117 -2.002 -9.981 -10.070 1.00 0.00 H new ATOM 0 HA VAL A 117 -4.513 -9.003 -9.158 1.00 0.00 H new ATOM 0 HB VAL A 117 -2.718 -11.169 -7.998 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -4.807 -12.090 -7.082 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -4.463 -10.461 -6.452 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.697 -10.685 -7.715 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -4.066 -12.739 -9.330 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -4.918 -11.365 -10.075 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -3.175 -11.590 -10.356 1.00 0.00 H new ATOM 1856 N CYS A 118 -3.995 -7.646 -7.151 1.00 0.00 N ATOM 1857 CA CYS A 118 -3.744 -6.822 -5.983 1.00 0.00 C ATOM 1858 C CYS A 118 -4.783 -7.114 -4.907 1.00 0.00 C ATOM 1859 O CYS A 118 -5.979 -6.927 -5.134 1.00 0.00 O ATOM 1860 CB CYS A 118 -3.792 -5.345 -6.371 1.00 0.00 C ATOM 1861 SG CYS A 118 -2.774 -4.923 -7.809 1.00 0.00 S ATOM 0 H CYS A 118 -4.890 -7.465 -7.606 1.00 0.00 H new ATOM 0 HA CYS A 118 -2.754 -7.054 -5.589 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -4.826 -5.068 -6.578 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -3.466 -4.746 -5.520 1.00 0.00 H new ATOM 0 HG CYS A 118 -2.992 -5.780 -8.762 1.00 0.00 H new ATOM 1867 N LYS A 119 -4.345 -7.579 -3.747 1.00 0.00 N ATOM 1868 CA LYS A 119 -5.266 -7.816 -2.642 1.00 0.00 C ATOM 1869 C LYS A 119 -4.765 -7.143 -1.378 1.00 0.00 C ATOM 1870 O LYS A 119 -3.579 -6.841 -1.249 1.00 0.00 O ATOM 1871 CB LYS A 119 -5.460 -9.311 -2.372 1.00 0.00 C ATOM 1872 CG LYS A 119 -6.087 -10.082 -3.525 1.00 0.00 C ATOM 1873 CD LYS A 119 -7.511 -9.616 -3.805 1.00 0.00 C ATOM 1874 CE LYS A 119 -8.449 -9.881 -2.629 1.00 0.00 C ATOM 1875 NZ LYS A 119 -8.645 -11.335 -2.377 1.00 0.00 N ATOM 0 H LYS A 119 -3.369 -7.798 -3.546 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.227 -7.390 -2.931 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -4.492 -9.754 -2.138 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -6.087 -9.430 -1.488 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -5.479 -9.955 -4.421 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -6.092 -11.147 -3.291 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -7.505 -8.549 -4.029 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -7.890 -10.125 -4.691 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -8.045 -9.411 -1.732 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -9.415 -9.416 -2.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -9.289 -11.464 -1.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -9.055 -11.782 -3.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -7.728 -11.777 -2.162 1.00 0.00 H new ATOM 1889 N SER A 120 -5.675 -6.938 -0.447 1.00 0.00 N ATOM 1890 CA SER A 120 -5.352 -6.320 0.826 1.00 0.00 C ATOM 1891 C SER A 120 -5.353 -7.384 1.910 1.00 0.00 C ATOM 1892 O SER A 120 -6.350 -8.083 2.102 1.00 0.00 O ATOM 1893 CB SER A 120 -6.371 -5.228 1.162 1.00 0.00 C ATOM 1894 OG SER A 120 -6.000 -4.508 2.327 1.00 0.00 O ATOM 0 H SER A 120 -6.657 -7.194 -0.550 1.00 0.00 H new ATOM 0 HA SER A 120 -4.365 -5.861 0.764 1.00 0.00 H new ATOM 0 HB2 SER A 120 -6.459 -4.540 0.321 1.00 0.00 H new ATOM 0 HB3 SER A 120 -7.353 -5.678 1.309 1.00 0.00 H new ATOM 0 HG SER A 120 -6.671 -3.818 2.512 1.00 0.00 H new ATOM 1900 N PHE A 121 -4.240 -7.517 2.601 1.00 0.00 N ATOM 1901 CA PHE A 121 -4.106 -8.528 3.631 1.00 0.00 C ATOM 1902 C PHE A 121 -3.827 -7.891 4.982 1.00 0.00 C ATOM 1903 O PHE A 121 -2.965 -7.024 5.113 1.00 0.00 O ATOM 1904 CB PHE A 121 -2.980 -9.504 3.287 1.00 0.00 C ATOM 1905 CG PHE A 121 -3.211 -10.288 2.026 1.00 0.00 C ATOM 1906 CD1 PHE A 121 -4.018 -11.414 2.035 1.00 0.00 C ATOM 1907 CD2 PHE A 121 -2.611 -9.908 0.838 1.00 0.00 C ATOM 1908 CE1 PHE A 121 -4.222 -12.146 0.883 1.00 0.00 C ATOM 1909 CE2 PHE A 121 -2.813 -10.633 -0.320 1.00 0.00 C ATOM 1910 CZ PHE A 121 -3.619 -11.755 -0.297 1.00 0.00 C ATOM 0 H PHE A 121 -3.412 -6.936 2.468 1.00 0.00 H new ATOM 0 HA PHE A 121 -5.048 -9.073 3.684 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -2.048 -8.947 3.190 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -2.851 -10.200 4.116 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -4.493 -11.723 2.954 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -1.977 -9.034 0.816 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -4.852 -13.023 0.904 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -2.342 -10.324 -1.241 1.00 0.00 H new ATOM 0 HZ PHE A 121 -3.777 -12.326 -1.200 1.00 0.00 H new ATOM 1920 N LEU A 122 -4.580 -8.311 5.976 1.00 0.00 N ATOM 1921 CA LEU A 122 -4.314 -7.929 7.344 1.00 0.00 C ATOM 1922 C LEU A 122 -3.448 -9.004 7.977 1.00 0.00 C ATOM 1923 O LEU A 122 -3.915 -10.116 8.249 1.00 0.00 O ATOM 1924 CB LEU A 122 -5.624 -7.768 8.126 1.00 0.00 C ATOM 1925 CG LEU A 122 -6.603 -6.736 7.558 1.00 0.00 C ATOM 1926 CD1 LEU A 122 -7.895 -6.722 8.361 1.00 0.00 C ATOM 1927 CD2 LEU A 122 -5.974 -5.352 7.547 1.00 0.00 C ATOM 0 H LEU A 122 -5.388 -8.922 5.859 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.797 -6.970 7.366 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -6.125 -8.735 8.167 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -5.384 -7.490 9.152 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.837 -7.019 6.532 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -8.576 -5.982 7.941 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.359 -7.707 8.320 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -7.676 -6.466 9.398 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.685 -4.633 7.140 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.709 -5.065 8.565 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.077 -5.365 6.928 1.00 0.00 H new ATOM 1939 N ILE A 123 -2.183 -8.684 8.184 1.00 0.00 N ATOM 1940 CA ILE A 123 -1.241 -9.649 8.719 1.00 0.00 C ATOM 1941 C ILE A 123 -1.289 -9.621 10.231 1.00 0.00 C ATOM 1942 O ILE A 123 -0.825 -8.671 10.854 1.00 0.00 O ATOM 1943 CB ILE A 123 0.200 -9.367 8.246 1.00 0.00 C ATOM 1944 CG1 ILE A 123 0.251 -9.232 6.719 1.00 0.00 C ATOM 1945 CG2 ILE A 123 1.136 -10.471 8.717 1.00 0.00 C ATOM 1946 CD1 ILE A 123 -0.260 -10.449 5.979 1.00 0.00 C ATOM 0 H ILE A 123 -1.785 -7.765 7.990 1.00 0.00 H new ATOM 0 HA ILE A 123 -1.529 -10.634 8.351 1.00 0.00 H new ATOM 0 HB ILE A 123 0.529 -8.424 8.682 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -0.337 -8.364 6.421 1.00 0.00 H new ATOM 0 HG13 ILE A 123 1.280 -9.040 6.415 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.149 -10.259 8.376 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.122 -10.520 9.806 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.808 -11.426 8.307 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.192 -10.277 4.905 1.00 0.00 H new ATOM 0 HD12 ILE A 123 0.343 -11.317 6.246 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -1.299 -10.631 6.252 1.00 0.00 H new ATOM 1958 N LYS A 124 -1.852 -10.659 10.816 1.00 0.00 N ATOM 1959 CA LYS A 124 -2.045 -10.697 12.249 1.00 0.00 C ATOM 1960 C LYS A 124 -1.066 -11.648 12.913 1.00 0.00 C ATOM 1961 O LYS A 124 -0.265 -12.316 12.254 1.00 0.00 O ATOM 1962 CB LYS A 124 -3.471 -11.130 12.588 1.00 0.00 C ATOM 1963 CG LYS A 124 -4.542 -10.165 12.119 1.00 0.00 C ATOM 1964 CD LYS A 124 -5.923 -10.699 12.450 1.00 0.00 C ATOM 1965 CE LYS A 124 -7.016 -9.732 12.037 1.00 0.00 C ATOM 1966 NZ LYS A 124 -8.368 -10.307 12.257 1.00 0.00 N ATOM 0 H LYS A 124 -2.183 -11.487 10.320 1.00 0.00 H new ATOM 0 HA LYS A 124 -1.869 -9.690 12.627 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -3.658 -12.107 12.142 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -3.555 -11.251 13.668 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -4.398 -9.194 12.594 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -4.454 -10.010 11.044 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -6.074 -11.654 11.946 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -5.992 -10.889 13.521 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -6.917 -8.807 12.604 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -6.896 -9.475 10.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -9.090 -9.589 12.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -8.502 -11.128 11.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -8.461 -10.607 13.248 1.00 0.00 H new ATOM 1980 N LYS A 125 -1.151 -11.688 14.232 1.00 0.00 N ATOM 1981 CA LYS A 125 -0.392 -12.625 15.039 1.00 0.00 C ATOM 1982 C LYS A 125 -0.803 -14.043 14.676 1.00 0.00 C ATOM 1983 O LYS A 125 0.030 -14.891 14.351 1.00 0.00 O ATOM 1984 CB LYS A 125 -0.683 -12.352 16.514 1.00 0.00 C ATOM 1985 CG LYS A 125 0.233 -13.078 17.479 1.00 0.00 C ATOM 1986 CD LYS A 125 -0.128 -12.758 18.921 1.00 0.00 C ATOM 1987 CE LYS A 125 0.886 -13.334 19.893 1.00 0.00 C ATOM 1988 NZ LYS A 125 2.258 -12.836 19.619 1.00 0.00 N ATOM 0 H LYS A 125 -1.752 -11.068 14.775 1.00 0.00 H new ATOM 0 HA LYS A 125 0.676 -12.508 14.854 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -0.604 -11.280 16.695 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -1.713 -12.636 16.727 1.00 0.00 H new ATOM 0 HG2 LYS A 125 0.163 -14.153 17.313 1.00 0.00 H new ATOM 0 HG3 LYS A 125 1.268 -12.793 17.288 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -0.184 -11.677 19.051 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -1.117 -13.158 19.146 1.00 0.00 H new ATOM 0 HE2 LYS A 125 0.601 -13.073 20.912 1.00 0.00 H new ATOM 0 HE3 LYS A 125 0.875 -14.422 19.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 2.848 -12.962 20.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 2.670 -13.370 18.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 2.218 -11.827 19.372 1.00 0.00 H new ATOM 2002 N ASP A 126 -2.105 -14.270 14.744 1.00 0.00 N ATOM 2003 CA ASP A 126 -2.704 -15.552 14.398 1.00 0.00 C ATOM 2004 C ASP A 126 -2.410 -15.913 12.943 1.00 0.00 C ATOM 2005 O ASP A 126 -1.537 -16.733 12.656 1.00 0.00 O ATOM 2006 CB ASP A 126 -4.221 -15.496 14.607 1.00 0.00 C ATOM 2007 CG ASP A 126 -4.612 -14.985 15.979 1.00 0.00 C ATOM 2008 OD1 ASP A 126 -4.577 -13.753 16.190 1.00 0.00 O ATOM 2009 OD2 ASP A 126 -4.966 -15.808 16.849 1.00 0.00 O ATOM 0 H ASP A 126 -2.781 -13.567 15.042 1.00 0.00 H new ATOM 0 HA ASP A 126 -2.271 -16.314 15.046 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -4.663 -14.853 13.846 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -4.639 -16.493 14.464 1.00 0.00 H new ATOM 2014 N GLY A 127 -3.123 -15.268 12.030 1.00 0.00 N ATOM 2015 CA GLY A 127 -2.978 -15.568 10.620 1.00 0.00 C ATOM 2016 C GLY A 127 -3.196 -14.352 9.751 1.00 0.00 C ATOM 2017 O GLY A 127 -2.824 -13.239 10.125 1.00 0.00 O ATOM 0 H GLY A 127 -3.803 -14.538 12.243 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -1.981 -15.969 10.437 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -3.690 -16.344 10.341 1.00 0.00 H new ATOM 2021 N VAL A 128 -3.806 -14.558 8.595 1.00 0.00 N ATOM 2022 CA VAL A 128 -4.024 -13.478 7.644 1.00 0.00 C ATOM 2023 C VAL A 128 -5.500 -13.356 7.278 1.00 0.00 C ATOM 2024 O VAL A 128 -6.122 -14.323 6.828 1.00 0.00 O ATOM 2025 CB VAL A 128 -3.206 -13.692 6.351 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -3.402 -12.533 5.387 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -1.729 -13.883 6.666 1.00 0.00 C ATOM 0 H VAL A 128 -4.160 -15.465 8.291 1.00 0.00 H new ATOM 0 HA VAL A 128 -3.693 -12.560 8.130 1.00 0.00 H new ATOM 0 HB VAL A 128 -3.571 -14.600 5.871 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -2.816 -12.707 4.485 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -4.457 -12.452 5.125 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -3.074 -11.607 5.860 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -1.176 -14.032 5.739 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -1.349 -12.999 7.178 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -1.604 -14.755 7.307 1.00 0.00 H new ATOM 2037 N ASP A 129 -6.049 -12.167 7.473 1.00 0.00 N ATOM 2038 CA ASP A 129 -7.418 -11.864 7.060 1.00 0.00 C ATOM 2039 C ASP A 129 -7.389 -10.899 5.881 1.00 0.00 C ATOM 2040 O ASP A 129 -6.679 -9.899 5.921 1.00 0.00 O ATOM 2041 CB ASP A 129 -8.218 -11.235 8.211 1.00 0.00 C ATOM 2042 CG ASP A 129 -8.568 -12.217 9.317 1.00 0.00 C ATOM 2043 OD1 ASP A 129 -9.575 -12.940 9.181 1.00 0.00 O ATOM 2044 OD2 ASP A 129 -7.853 -12.248 10.340 1.00 0.00 O ATOM 0 H ASP A 129 -5.565 -11.387 7.918 1.00 0.00 H new ATOM 0 HA ASP A 129 -7.903 -12.796 6.772 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -7.642 -10.413 8.636 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -9.138 -10.807 7.812 1.00 0.00 H new ATOM 2049 N GLU A 130 -8.139 -11.188 4.829 1.00 0.00 N ATOM 2050 CA GLU A 130 -8.132 -10.336 3.659 1.00 0.00 C ATOM 2051 C GLU A 130 -9.253 -9.307 3.723 1.00 0.00 C ATOM 2052 O GLU A 130 -10.361 -9.596 4.182 1.00 0.00 O ATOM 2053 CB GLU A 130 -8.239 -11.173 2.386 1.00 0.00 C ATOM 2054 CG GLU A 130 -9.535 -11.953 2.247 1.00 0.00 C ATOM 2055 CD GLU A 130 -9.631 -12.657 0.911 1.00 0.00 C ATOM 2056 OE1 GLU A 130 -10.031 -12.012 -0.081 1.00 0.00 O ATOM 2057 OE2 GLU A 130 -9.293 -13.858 0.839 1.00 0.00 O ATOM 0 H GLU A 130 -8.754 -11.999 4.765 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.185 -9.797 3.639 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.133 -10.514 1.524 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.404 -11.873 2.356 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -9.604 -12.687 3.050 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -10.381 -11.275 2.361 1.00 0.00 H new ATOM 2064 N GLU A 131 -8.945 -8.103 3.272 1.00 0.00 N ATOM 2065 CA GLU A 131 -9.909 -7.017 3.247 1.00 0.00 C ATOM 2066 C GLU A 131 -10.423 -6.822 1.822 1.00 0.00 C ATOM 2067 O GLU A 131 -9.642 -6.842 0.867 1.00 0.00 O ATOM 2068 CB GLU A 131 -9.260 -5.731 3.775 1.00 0.00 C ATOM 2069 CG GLU A 131 -10.189 -4.525 3.810 1.00 0.00 C ATOM 2070 CD GLU A 131 -11.381 -4.710 4.730 1.00 0.00 C ATOM 2071 OE1 GLU A 131 -12.257 -5.545 4.417 1.00 0.00 O ATOM 2072 OE2 GLU A 131 -11.477 -3.981 5.745 1.00 0.00 O ATOM 0 H GLU A 131 -8.023 -7.852 2.914 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.754 -7.263 3.891 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.885 -5.915 4.782 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -8.398 -5.492 3.153 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -9.624 -3.650 4.131 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -10.546 -4.321 2.801 1.00 0.00 H new ATOM 2079 N GLU A 132 -11.731 -6.647 1.687 1.00 0.00 N ATOM 2080 CA GLU A 132 -12.359 -6.505 0.384 1.00 0.00 C ATOM 2081 C GLU A 132 -12.073 -5.132 -0.215 1.00 0.00 C ATOM 2082 O GLU A 132 -12.106 -4.112 0.483 1.00 0.00 O ATOM 2083 CB GLU A 132 -13.863 -6.738 0.508 1.00 0.00 C ATOM 2084 CG GLU A 132 -14.547 -5.795 1.479 1.00 0.00 C ATOM 2085 CD GLU A 132 -15.978 -6.191 1.766 1.00 0.00 C ATOM 2086 OE1 GLU A 132 -16.197 -7.040 2.659 1.00 0.00 O ATOM 2087 OE2 GLU A 132 -16.891 -5.664 1.100 1.00 0.00 O ATOM 0 H GLU A 132 -12.380 -6.600 2.472 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.939 -7.253 -0.289 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -14.321 -6.629 -0.475 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -14.038 -7.765 0.828 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.986 -5.772 2.413 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -14.529 -4.784 1.072 1.00 0.00 H new ATOM 2094 N ILE A 133 -11.803 -5.117 -1.510 1.00 0.00 N ATOM 2095 CA ILE A 133 -11.398 -3.902 -2.203 1.00 0.00 C ATOM 2096 C ILE A 133 -12.505 -3.386 -3.113 1.00 0.00 C ATOM 2097 O ILE A 133 -13.044 -4.121 -3.942 1.00 0.00 O ATOM 2098 CB ILE A 133 -10.121 -4.134 -3.044 1.00 0.00 C ATOM 2099 CG1 ILE A 133 -9.009 -4.733 -2.176 1.00 0.00 C ATOM 2100 CG2 ILE A 133 -9.657 -2.826 -3.676 1.00 0.00 C ATOM 2101 CD1 ILE A 133 -7.728 -5.022 -2.932 1.00 0.00 C ATOM 0 H ILE A 133 -11.857 -5.941 -2.109 1.00 0.00 H new ATOM 0 HA ILE A 133 -11.191 -3.157 -1.435 1.00 0.00 H new ATOM 0 HB ILE A 133 -10.355 -4.840 -3.841 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -8.790 -4.046 -1.359 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -9.371 -5.658 -1.727 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -8.757 -3.005 -4.265 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -10.442 -2.436 -4.323 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -9.439 -2.100 -2.892 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -6.990 -5.444 -2.250 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -7.931 -5.734 -3.732 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -7.341 -4.097 -3.359 1.00 0.00 H new ATOM 2113 N ILE A 134 -12.846 -2.119 -2.939 1.00 0.00 N ATOM 2114 CA ILE A 134 -13.823 -1.458 -3.791 1.00 0.00 C ATOM 2115 C ILE A 134 -13.105 -0.458 -4.690 1.00 0.00 C ATOM 2116 O ILE A 134 -12.281 0.326 -4.212 1.00 0.00 O ATOM 2117 CB ILE A 134 -14.926 -0.728 -2.970 1.00 0.00 C ATOM 2118 CG1 ILE A 134 -15.809 -1.726 -2.200 1.00 0.00 C ATOM 2119 CG2 ILE A 134 -15.792 0.136 -3.877 1.00 0.00 C ATOM 2120 CD1 ILE A 134 -15.139 -2.360 -0.998 1.00 0.00 C ATOM 0 H ILE A 134 -12.457 -1.523 -2.209 1.00 0.00 H new ATOM 0 HA ILE A 134 -14.318 -2.224 -4.388 1.00 0.00 H new ATOM 0 HB ILE A 134 -14.421 -0.088 -2.246 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -16.711 -1.213 -1.868 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -16.124 -2.515 -2.883 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -16.556 0.636 -3.282 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -15.170 0.882 -4.371 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -16.271 -0.492 -4.628 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -15.833 -3.049 -0.516 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -14.252 -2.905 -1.321 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -14.849 -1.583 -0.291 1.00 0.00 H new ATOM 2132 N LEU A 135 -13.403 -0.500 -5.983 1.00 0.00 N ATOM 2133 CA LEU A 135 -12.729 0.357 -6.948 1.00 0.00 C ATOM 2134 C LEU A 135 -13.625 1.503 -7.401 1.00 0.00 C ATOM 2135 O LEU A 135 -14.842 1.471 -7.208 1.00 0.00 O ATOM 2136 CB LEU A 135 -12.277 -0.461 -8.161 1.00 0.00 C ATOM 2137 CG LEU A 135 -11.238 -1.544 -7.867 1.00 0.00 C ATOM 2138 CD1 LEU A 135 -10.781 -2.204 -9.158 1.00 0.00 C ATOM 2139 CD2 LEU A 135 -10.051 -0.956 -7.123 1.00 0.00 C ATOM 0 H LEU A 135 -14.107 -1.118 -6.386 1.00 0.00 H new ATOM 0 HA LEU A 135 -11.856 0.785 -6.455 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -13.153 -0.932 -8.608 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -11.867 0.221 -8.906 1.00 0.00 H new ATOM 0 HG LEU A 135 -11.700 -2.302 -7.234 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -10.042 -2.972 -8.932 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.637 -2.659 -9.657 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.336 -1.454 -9.812 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -9.322 -1.741 -6.922 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -9.589 -0.179 -7.732 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -10.389 -0.526 -6.180 1.00 0.00 H new ATOM 2151 N LYS A 136 -13.006 2.516 -7.996 1.00 0.00 N ATOM 2152 CA LYS A 136 -13.723 3.671 -8.520 1.00 0.00 C ATOM 2153 C LYS A 136 -12.773 4.488 -9.394 1.00 0.00 C ATOM 2154 O LYS A 136 -11.562 4.295 -9.325 1.00 0.00 O ATOM 2155 CB LYS A 136 -14.272 4.515 -7.360 1.00 0.00 C ATOM 2156 CG LYS A 136 -15.396 5.466 -7.754 1.00 0.00 C ATOM 2157 CD LYS A 136 -16.306 5.788 -6.573 1.00 0.00 C ATOM 2158 CE LYS A 136 -15.539 6.413 -5.417 1.00 0.00 C ATOM 2159 NZ LYS A 136 -16.400 6.639 -4.227 1.00 0.00 N ATOM 0 H LYS A 136 -11.996 2.559 -8.128 1.00 0.00 H new ATOM 0 HA LYS A 136 -14.568 3.345 -9.126 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -14.634 3.846 -6.579 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -13.455 5.095 -6.929 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -14.970 6.389 -8.147 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -15.985 5.020 -8.556 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -17.093 6.469 -6.897 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -16.795 4.875 -6.232 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -14.707 5.765 -5.143 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -15.111 7.362 -5.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -15.803 6.839 -3.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -17.030 7.448 -4.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -16.971 5.789 -4.045 1.00 0.00 H new ATOM 2173 N GLU A 137 -13.303 5.375 -10.228 1.00 0.00 N ATOM 2174 CA GLU A 137 -12.453 6.199 -11.086 1.00 0.00 C ATOM 2175 C GLU A 137 -11.905 7.405 -10.338 1.00 0.00 C ATOM 2176 O GLU A 137 -10.847 7.930 -10.679 1.00 0.00 O ATOM 2177 CB GLU A 137 -13.216 6.661 -12.329 1.00 0.00 C ATOM 2178 CG GLU A 137 -13.102 5.717 -13.519 1.00 0.00 C ATOM 2179 CD GLU A 137 -13.638 4.329 -13.239 1.00 0.00 C ATOM 2180 OE1 GLU A 137 -14.870 4.171 -13.133 1.00 0.00 O ATOM 2181 OE2 GLU A 137 -12.833 3.383 -13.128 1.00 0.00 O ATOM 0 H GLU A 137 -14.304 5.543 -10.330 1.00 0.00 H new ATOM 0 HA GLU A 137 -11.612 5.579 -11.397 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -14.269 6.778 -12.072 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -12.848 7.644 -12.623 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -13.642 6.143 -14.364 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -12.056 5.642 -13.815 1.00 0.00 H new ATOM 2188 N GLU A 138 -12.623 7.818 -9.310 1.00 0.00 N ATOM 2189 CA GLU A 138 -12.265 8.998 -8.532 1.00 0.00 C ATOM 2190 C GLU A 138 -12.747 8.854 -7.097 1.00 0.00 C ATOM 2191 O GLU A 138 -13.230 7.795 -6.699 1.00 0.00 O ATOM 2192 CB GLU A 138 -12.880 10.257 -9.152 1.00 0.00 C ATOM 2193 CG GLU A 138 -11.931 11.030 -10.054 1.00 0.00 C ATOM 2194 CD GLU A 138 -10.782 11.657 -9.286 1.00 0.00 C ATOM 2195 OE1 GLU A 138 -11.012 12.676 -8.597 1.00 0.00 O ATOM 2196 OE2 GLU A 138 -9.646 11.149 -9.386 1.00 0.00 O ATOM 0 H GLU A 138 -13.470 7.349 -8.988 1.00 0.00 H new ATOM 0 HA GLU A 138 -11.179 9.091 -8.538 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -13.761 9.973 -9.728 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -13.220 10.914 -8.352 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -11.532 10.360 -10.816 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -12.485 11.811 -10.575 1.00 0.00 H new ATOM 2203 N LEU A 139 -12.599 9.918 -6.324 1.00 0.00 N ATOM 2204 CA LEU A 139 -13.116 9.957 -4.966 1.00 0.00 C ATOM 2205 C LEU A 139 -14.570 10.415 -4.989 1.00 0.00 C ATOM 2206 O LEU A 139 -15.231 10.347 -6.026 1.00 0.00 O ATOM 2207 CB LEU A 139 -12.277 10.909 -4.108 1.00 0.00 C ATOM 2208 CG LEU A 139 -10.798 10.537 -3.970 1.00 0.00 C ATOM 2209 CD1 LEU A 139 -10.060 11.591 -3.159 1.00 0.00 C ATOM 2210 CD2 LEU A 139 -10.648 9.168 -3.321 1.00 0.00 C ATOM 0 H LEU A 139 -12.122 10.771 -6.617 1.00 0.00 H new ATOM 0 HA LEU A 139 -13.060 8.959 -4.532 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -12.344 11.910 -4.534 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -12.717 10.956 -3.112 1.00 0.00 H new ATOM 0 HG LEU A 139 -10.360 10.495 -4.967 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -9.010 11.312 -3.070 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -10.138 12.556 -3.660 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -10.502 11.661 -2.165 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -9.590 8.922 -3.232 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -11.102 9.183 -2.330 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -11.145 8.417 -3.936 1.00 0.00 H new ATOM 2222 N GLU A 140 -15.078 10.864 -3.851 1.00 0.00 N ATOM 2223 CA GLU A 140 -16.411 11.438 -3.809 1.00 0.00 C ATOM 2224 C GLU A 140 -16.366 12.879 -4.291 1.00 0.00 C ATOM 2225 O GLU A 140 -15.291 13.478 -4.356 1.00 0.00 O ATOM 2226 CB GLU A 140 -17.011 11.347 -2.406 1.00 0.00 C ATOM 2227 CG GLU A 140 -17.510 9.952 -2.066 1.00 0.00 C ATOM 2228 CD GLU A 140 -18.517 9.437 -3.078 1.00 0.00 C ATOM 2229 OE1 GLU A 140 -19.593 10.054 -3.221 1.00 0.00 O ATOM 2230 OE2 GLU A 140 -18.237 8.417 -3.741 1.00 0.00 O ATOM 0 H GLU A 140 -14.592 10.842 -2.954 1.00 0.00 H new ATOM 0 HA GLU A 140 -17.057 10.865 -4.474 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -16.260 11.647 -1.675 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -17.837 12.053 -2.323 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -16.663 9.267 -2.019 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -17.966 9.963 -1.076 1.00 0.00 H new ATOM 2237 N HIS A 141 -17.538 13.424 -4.613 1.00 0.00 N ATOM 2238 CA HIS A 141 -17.652 14.720 -5.273 1.00 0.00 C ATOM 2239 C HIS A 141 -17.077 14.638 -6.677 1.00 0.00 C ATOM 2240 O HIS A 141 -15.876 14.814 -6.873 1.00 0.00 O ATOM 2241 CB HIS A 141 -16.938 15.846 -4.508 1.00 0.00 C ATOM 2242 CG HIS A 141 -17.489 16.138 -3.150 1.00 0.00 C ATOM 2243 ND1 HIS A 141 -18.798 16.492 -2.922 1.00 0.00 N ATOM 2244 CD2 HIS A 141 -16.880 16.160 -1.942 1.00 0.00 C ATOM 2245 CE1 HIS A 141 -18.969 16.727 -1.634 1.00 0.00 C ATOM 2246 NE2 HIS A 141 -17.819 16.533 -1.015 1.00 0.00 N ATOM 0 H HIS A 141 -18.435 12.978 -4.423 1.00 0.00 H new ATOM 0 HA HIS A 141 -18.714 14.962 -5.303 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -15.885 15.584 -4.407 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -16.985 16.756 -5.106 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -15.844 15.927 -1.744 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -19.894 17.028 -1.165 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -17.656 16.642 -0.014 1.00 0.00 H new ATOM 2255 N HIS A 142 -17.924 14.322 -7.646 1.00 0.00 N ATOM 2256 CA HIS A 142 -17.511 14.348 -9.040 1.00 0.00 C ATOM 2257 C HIS A 142 -17.082 15.761 -9.403 1.00 0.00 C ATOM 2258 O HIS A 142 -17.910 16.656 -9.571 1.00 0.00 O ATOM 2259 CB HIS A 142 -18.629 13.857 -9.966 1.00 0.00 C ATOM 2260 CG HIS A 142 -18.683 12.364 -10.095 1.00 0.00 C ATOM 2261 ND1 HIS A 142 -18.161 11.688 -11.177 1.00 0.00 N ATOM 2262 CD2 HIS A 142 -19.198 11.415 -9.277 1.00 0.00 C ATOM 2263 CE1 HIS A 142 -18.354 10.393 -11.021 1.00 0.00 C ATOM 2264 NE2 HIS A 142 -18.979 10.199 -9.876 1.00 0.00 N ATOM 0 H HIS A 142 -18.894 14.047 -7.494 1.00 0.00 H new ATOM 0 HA HIS A 142 -16.669 13.668 -9.173 1.00 0.00 H new ATOM 0 HB2 HIS A 142 -19.587 14.217 -9.589 1.00 0.00 H new ATOM 0 HB3 HIS A 142 -18.490 14.295 -10.955 1.00 0.00 H new ATOM 0 HD2 HIS A 142 -19.689 11.583 -8.330 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -18.051 9.622 -11.714 1.00 0.00 H new ATOM 0 HE2 HIS A 142 -19.255 9.293 -9.497 1.00 0.00 H new ATOM 2273 N HIS A 143 -15.777 15.950 -9.482 1.00 0.00 N ATOM 2274 CA HIS A 143 -15.193 17.274 -9.609 1.00 0.00 C ATOM 2275 C HIS A 143 -14.293 17.365 -10.828 1.00 0.00 C ATOM 2276 O HIS A 143 -14.022 16.358 -11.485 1.00 0.00 O ATOM 2277 CB HIS A 143 -14.389 17.622 -8.342 1.00 0.00 C ATOM 2278 CG HIS A 143 -13.422 16.550 -7.901 1.00 0.00 C ATOM 2279 ND1 HIS A 143 -13.268 16.170 -6.588 1.00 0.00 N ATOM 2280 CD2 HIS A 143 -12.572 15.769 -8.611 1.00 0.00 C ATOM 2281 CE1 HIS A 143 -12.374 15.205 -6.509 1.00 0.00 C ATOM 2282 NE2 HIS A 143 -11.934 14.938 -7.724 1.00 0.00 N ATOM 0 H HIS A 143 -15.094 15.193 -9.460 1.00 0.00 H new ATOM 0 HA HIS A 143 -16.007 17.988 -9.731 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -13.834 18.543 -8.520 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -15.086 17.822 -7.528 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -12.424 15.796 -9.680 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -12.055 14.715 -5.601 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -11.237 14.233 -7.964 1.00 0.00 H new ATOM 2291 N HIS A 144 -13.839 18.573 -11.121 1.00 0.00 N ATOM 2292 CA HIS A 144 -12.838 18.777 -12.156 1.00 0.00 C ATOM 2293 C HIS A 144 -11.538 18.099 -11.739 1.00 0.00 C ATOM 2294 O HIS A 144 -11.062 18.289 -10.616 1.00 0.00 O ATOM 2295 CB HIS A 144 -12.619 20.276 -12.426 1.00 0.00 C ATOM 2296 CG HIS A 144 -12.065 21.052 -11.268 1.00 0.00 C ATOM 2297 ND1 HIS A 144 -10.741 21.424 -11.174 1.00 0.00 N ATOM 2298 CD2 HIS A 144 -12.666 21.536 -10.157 1.00 0.00 C ATOM 2299 CE1 HIS A 144 -10.553 22.099 -10.055 1.00 0.00 C ATOM 2300 NE2 HIS A 144 -11.706 22.181 -9.422 1.00 0.00 N ATOM 0 H HIS A 144 -14.148 19.427 -10.657 1.00 0.00 H new ATOM 0 HA HIS A 144 -13.190 18.330 -13.086 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -11.942 20.382 -13.273 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -13.570 20.720 -12.720 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -13.709 21.433 -9.897 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -9.615 22.513 -9.716 1.00 0.00 H new ATOM 0 HE2 HIS A 144 -11.859 22.649 -8.529 1.00 0.00 H new ATOM 2309 N HIS A 145 -10.986 17.287 -12.624 1.00 0.00 N ATOM 2310 CA HIS A 145 -9.818 16.489 -12.286 1.00 0.00 C ATOM 2311 C HIS A 145 -8.543 17.303 -12.417 1.00 0.00 C ATOM 2312 O HIS A 145 -8.315 17.954 -13.434 1.00 0.00 O ATOM 2313 CB HIS A 145 -9.722 15.257 -13.187 1.00 0.00 C ATOM 2314 CG HIS A 145 -9.017 14.106 -12.541 1.00 0.00 C ATOM 2315 ND1 HIS A 145 -7.652 14.045 -12.357 1.00 0.00 N ATOM 2316 CD2 HIS A 145 -9.515 12.977 -11.995 1.00 0.00 C ATOM 2317 CE1 HIS A 145 -7.347 12.927 -11.724 1.00 0.00 C ATOM 2318 NE2 HIS A 145 -8.463 12.260 -11.488 1.00 0.00 N ATOM 0 H HIS A 145 -11.325 17.162 -13.578 1.00 0.00 H new ATOM 0 HA HIS A 145 -9.931 16.170 -11.250 1.00 0.00 H new ATOM 0 HB2 HIS A 145 -10.727 14.945 -13.473 1.00 0.00 H new ATOM 0 HB3 HIS A 145 -9.199 15.526 -14.105 1.00 0.00 H new ATOM 0 HD1 HIS A 145 -6.983 14.752 -12.662 1.00 0.00 H new ATOM 0 HD2 HIS A 145 -10.556 12.690 -11.963 1.00 0.00 H new ATOM 0 HE1 HIS A 145 -6.352 12.611 -11.446 1.00 0.00 H new ATOM 0 HE2 HIS A 145 -8.530 11.362 -11.009 1.00 0.00 H new ATOM 2327 N HIS A 146 -7.718 17.269 -11.385 1.00 0.00 N ATOM 2328 CA HIS A 146 -6.394 17.863 -11.457 1.00 0.00 C ATOM 2329 C HIS A 146 -5.342 16.756 -11.380 1.00 0.00 C ATOM 2330 O HIS A 146 -4.484 16.780 -10.477 1.00 0.00 O ATOM 2331 CB HIS A 146 -6.190 18.935 -10.363 1.00 0.00 C ATOM 2332 CG HIS A 146 -6.410 18.468 -8.951 1.00 0.00 C ATOM 2333 ND1 HIS A 146 -5.522 17.662 -8.282 1.00 0.00 N ATOM 2334 CD2 HIS A 146 -7.412 18.723 -8.077 1.00 0.00 C ATOM 2335 CE1 HIS A 146 -5.960 17.437 -7.062 1.00 0.00 C ATOM 2336 NE2 HIS A 146 -7.107 18.069 -6.906 1.00 0.00 N ATOM 2337 OXT HIS A 146 -5.418 15.831 -12.216 1.00 0.00 O ATOM 0 H HIS A 146 -7.941 16.837 -10.488 1.00 0.00 H new ATOM 0 HA HIS A 146 -6.286 18.381 -12.410 1.00 0.00 H new ATOM 0 HB2 HIS A 146 -5.175 19.324 -10.445 1.00 0.00 H new ATOM 0 HB3 HIS A 146 -6.867 19.766 -10.562 1.00 0.00 H new ATOM 0 HD1 HIS A 146 -4.654 17.294 -8.672 1.00 0.00 H new ATOM 0 HD2 HIS A 146 -8.287 19.327 -8.264 1.00 0.00 H new ATOM 0 HE1 HIS A 146 -5.464 16.836 -6.314 1.00 0.00 H new TER 2346 HIS A 146