USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1027 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 105 ASN : amide:sc= 1.16 K(o=2,f=0.29) USER MOD Set 1.2: A 108 THR OG1 : rot -67:sc= 0.827 USER MOD Set 2.1: A 73 THR OG1 : rot 93:sc= 1.35 USER MOD Set 2.2: A 75 THR OG1 : rot 128:sc= 2.34 USER MOD Set 2.3: A 96 LYS NZ :NH3+ -137:sc= -0.806! (180deg=-4.11!) USER MOD Set 3.1: A 2 ASN : amide:sc= -0.385 K(o=-2.4,f=-3.5) USER MOD Set 3.2: A 43 HIS : +bothHN:sc= -1.98! C(o=-2.4!,f=-8.1!) USER MOD Set 4.1: A 12 GLN : amide:sc= -2.29 K(o=-1,f=-1.9) USER MOD Set 4.2: A 36 LYS NZ :NH3+ 150:sc= 1.25 (180deg=1.03) USER MOD Set 5.1: A 8 GLN :FLIP amide:sc= 0.114 F(o=-1.7,f=-0.37) USER MOD Set 5.2: A 10 GLN : amide:sc= -0.486 K(o=-0.37,f=-1.8) USER MOD Single : A 1 MET CE :methyl -162:sc= -0.209 (180deg=-0.624) USER MOD Single : A 1 MET N :NH3+ -167:sc=-0.00409 (180deg=-0.169) USER MOD Single : A 4 SER OG : rot 180:sc= 0.29 USER MOD Single : A 6 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0492) USER MOD Single : A 7 TYR OH : rot 5:sc= 0.065 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -1.66 K(o=-1.7,f=-3.3!) USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 161:sc= 1.31 (180deg=1.17) USER MOD Single : A 22 MET CE :methyl -159:sc= -0.113 (180deg=-0.588) USER MOD Single : A 30 GLN :FLIP amide:sc= 0 F(o=-0.68,f=0) USER MOD Single : A 31 LYS NZ :NH3+ -152:sc= 1.05 (180deg=-0.165!) USER MOD Single : A 33 LYS NZ :NH3+ 146:sc= 1.26 (180deg=0.49) USER MOD Single : A 39 SER OG : rot 180:sc= -1.69! USER MOD Single : A 46 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.03) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -174:sc= 1.24 (180deg=1.1) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 74:sc= 0.193 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ -133:sc= 0.655 (180deg=0.00646) USER MOD Single : A 60 HIS : no HD1:sc= 0.0127 K(o=0.013,f=-2.9!) USER MOD Single : A 61 ASN : amide:sc= 0.374 K(o=0.37,f=-7.2!) USER MOD Single : A 64 THR OG1 : rot 177:sc= 0 USER MOD Single : A 69 CYS SG : rot -66:sc= -4.25! USER MOD Single : A 74 MET CE :methyl -174:sc=-0.00503 (180deg=-0.0752) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 173:sc= 0 (180deg=-0.0811) USER MOD Single : A 89 ASN : amide:sc= 0.765 K(o=0.77,f=-1.8!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= -0.0247 (180deg=-0.0247) USER MOD Single : A 91 MET CE :methyl -107:sc= -1.19 (180deg=-4.22!) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0.00151 USER MOD Single : A 99 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0254) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 76:sc= 1.04 USER MOD Single : A 110 THR OG1 : rot 180:sc= -0.268 USER MOD Single : A 111 ASN : amide:sc= -0.101 K(o=-0.1,f=-4.8!) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 MET CE :methyl -169:sc=-0.00966 (180deg=-0.236) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot 153:sc= -0.55 USER MOD Single : A 121 LYS NZ :NH3+ 161:sc= -0.0266 (180deg=-0.333) USER MOD Single : A 124 SER OG : rot 180:sc= -0.948 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.300 -18.122 5.110 1.00 0.00 N ATOM 2 CA MET A 1 8.335 -17.189 5.607 1.00 0.00 C ATOM 3 C MET A 1 7.691 -15.882 6.043 1.00 0.00 C ATOM 4 O MET A 1 7.012 -15.210 5.264 1.00 0.00 O ATOM 5 CB MET A 1 9.384 -16.930 4.525 1.00 0.00 C ATOM 6 CG MET A 1 10.188 -18.165 4.155 1.00 0.00 C ATOM 7 SD MET A 1 11.414 -17.841 2.872 1.00 0.00 S ATOM 8 CE MET A 1 10.359 -17.377 1.499 1.00 0.00 C ATOM 0 H1 MET A 1 7.705 -19.076 5.023 1.00 0.00 H new ATOM 0 H2 MET A 1 6.503 -18.144 5.778 1.00 0.00 H new ATOM 0 H3 MET A 1 6.963 -17.803 4.179 1.00 0.00 H new ATOM 0 HA MET A 1 8.831 -17.641 6.466 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.888 -16.548 3.633 1.00 0.00 H new ATOM 0 HB3 MET A 1 10.065 -16.152 4.869 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.691 -18.546 5.044 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.509 -18.946 3.814 1.00 0.00 H new ATOM 0 HE1 MET A 1 10.918 -17.457 0.567 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.496 -18.042 1.462 1.00 0.00 H new ATOM 0 HE3 MET A 1 10.020 -16.350 1.632 1.00 0.00 H new ATOM 20 N ASN A 2 7.904 -15.523 7.295 1.00 0.00 N ATOM 21 CA ASN A 2 7.242 -14.374 7.882 1.00 0.00 C ATOM 22 C ASN A 2 8.167 -13.170 7.906 1.00 0.00 C ATOM 23 O ASN A 2 9.148 -13.141 8.645 1.00 0.00 O ATOM 24 CB ASN A 2 6.762 -14.707 9.295 1.00 0.00 C ATOM 25 CG ASN A 2 5.738 -15.828 9.302 1.00 0.00 C ATOM 26 OD1 ASN A 2 4.976 -16.000 8.347 1.00 0.00 O ATOM 27 ND2 ASN A 2 5.714 -16.602 10.370 1.00 0.00 N ATOM 0 H ASN A 2 8.535 -16.014 7.928 1.00 0.00 H new ATOM 0 HA ASN A 2 6.378 -14.124 7.267 1.00 0.00 H new ATOM 0 HB2 ASN A 2 7.616 -14.993 9.909 1.00 0.00 H new ATOM 0 HB3 ASN A 2 6.327 -13.817 9.749 1.00 0.00 H new ATOM 0 HD21 ASN A 2 5.050 -17.374 10.426 1.00 0.00 H new ATOM 0 HD22 ASN A 2 6.360 -16.429 11.140 1.00 0.00 H new ATOM 34 N PHE A 3 7.844 -12.182 7.086 1.00 0.00 N ATOM 35 CA PHE A 3 8.646 -10.973 6.984 1.00 0.00 C ATOM 36 C PHE A 3 7.991 -9.839 7.767 1.00 0.00 C ATOM 37 O PHE A 3 7.856 -8.721 7.275 1.00 0.00 O ATOM 38 CB PHE A 3 8.800 -10.572 5.517 1.00 0.00 C ATOM 39 CG PHE A 3 9.313 -11.677 4.636 1.00 0.00 C ATOM 40 CD1 PHE A 3 10.644 -12.059 4.681 1.00 0.00 C ATOM 41 CD2 PHE A 3 8.463 -12.329 3.756 1.00 0.00 C ATOM 42 CE1 PHE A 3 11.118 -13.070 3.866 1.00 0.00 C ATOM 43 CE2 PHE A 3 8.929 -13.340 2.940 1.00 0.00 C ATOM 44 CZ PHE A 3 10.260 -13.710 2.995 1.00 0.00 C ATOM 0 H PHE A 3 7.026 -12.195 6.477 1.00 0.00 H new ATOM 0 HA PHE A 3 9.632 -11.168 7.406 1.00 0.00 H new ATOM 0 HB2 PHE A 3 7.834 -10.237 5.138 1.00 0.00 H new ATOM 0 HB3 PHE A 3 9.480 -9.723 5.452 1.00 0.00 H new ATOM 0 HD1 PHE A 3 11.319 -11.561 5.361 1.00 0.00 H new ATOM 0 HD2 PHE A 3 7.423 -12.042 3.708 1.00 0.00 H new ATOM 0 HE1 PHE A 3 12.158 -13.358 3.911 1.00 0.00 H new ATOM 0 HE2 PHE A 3 8.256 -13.841 2.260 1.00 0.00 H new ATOM 0 HZ PHE A 3 10.628 -14.500 2.357 1.00 0.00 H new ATOM 54 N SER A 4 7.542 -10.160 8.970 1.00 0.00 N ATOM 55 CA SER A 4 6.909 -9.199 9.839 1.00 0.00 C ATOM 56 C SER A 4 7.913 -8.164 10.362 1.00 0.00 C ATOM 57 O SER A 4 8.951 -8.506 10.930 1.00 0.00 O ATOM 58 CB SER A 4 6.239 -9.941 10.988 1.00 0.00 C ATOM 59 OG SER A 4 5.643 -11.144 10.521 1.00 0.00 O ATOM 0 H SER A 4 7.610 -11.098 9.366 1.00 0.00 H new ATOM 0 HA SER A 4 6.158 -8.649 9.273 1.00 0.00 H new ATOM 0 HB2 SER A 4 6.974 -10.168 11.760 1.00 0.00 H new ATOM 0 HB3 SER A 4 5.481 -9.306 11.446 1.00 0.00 H new ATOM 0 HG SER A 4 5.218 -11.611 11.270 1.00 0.00 H new ATOM 65 N GLY A 5 7.572 -6.903 10.149 1.00 0.00 N ATOM 66 CA GLY A 5 8.398 -5.790 10.556 1.00 0.00 C ATOM 67 C GLY A 5 7.797 -4.492 10.061 1.00 0.00 C ATOM 68 O GLY A 5 6.759 -4.508 9.402 1.00 0.00 O ATOM 0 H GLY A 5 6.707 -6.627 9.685 1.00 0.00 H new ATOM 0 HA2 GLY A 5 8.485 -5.769 11.642 1.00 0.00 H new ATOM 0 HA3 GLY A 5 9.406 -5.909 10.158 1.00 0.00 H new ATOM 72 N LYS A 6 8.422 -3.371 10.366 1.00 0.00 N ATOM 73 CA LYS A 6 7.911 -2.085 9.912 1.00 0.00 C ATOM 74 C LYS A 6 8.683 -1.637 8.673 1.00 0.00 C ATOM 75 O LYS A 6 9.907 -1.777 8.606 1.00 0.00 O ATOM 76 CB LYS A 6 8.041 -1.033 11.016 1.00 0.00 C ATOM 77 CG LYS A 6 7.194 0.207 10.805 1.00 0.00 C ATOM 78 CD LYS A 6 5.926 0.173 11.630 1.00 0.00 C ATOM 79 CE LYS A 6 5.867 1.347 12.578 1.00 0.00 C ATOM 80 NZ LYS A 6 6.926 1.280 13.618 1.00 0.00 N ATOM 0 H LYS A 6 9.276 -3.320 10.921 1.00 0.00 H new ATOM 0 HA LYS A 6 6.855 -2.195 9.663 1.00 0.00 H new ATOM 0 HB2 LYS A 6 7.766 -1.488 11.968 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.086 -0.735 11.095 1.00 0.00 H new ATOM 0 HG2 LYS A 6 7.774 1.092 11.068 1.00 0.00 H new ATOM 0 HG3 LYS A 6 6.938 0.296 9.749 1.00 0.00 H new ATOM 0 HD2 LYS A 6 5.058 0.189 10.971 1.00 0.00 H new ATOM 0 HD3 LYS A 6 5.880 -0.758 12.195 1.00 0.00 H new ATOM 0 HE2 LYS A 6 5.972 2.274 12.014 1.00 0.00 H new ATOM 0 HE3 LYS A 6 4.889 1.375 13.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 6.720 1.970 14.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 6.952 0.324 14.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 7.848 1.499 13.189 1.00 0.00 H new ATOM 94 N TYR A 7 7.968 -1.104 7.700 1.00 0.00 N ATOM 95 CA TYR A 7 8.571 -0.616 6.472 1.00 0.00 C ATOM 96 C TYR A 7 8.145 0.824 6.220 1.00 0.00 C ATOM 97 O TYR A 7 6.960 1.110 6.054 1.00 0.00 O ATOM 98 CB TYR A 7 8.151 -1.477 5.281 1.00 0.00 C ATOM 99 CG TYR A 7 8.597 -2.919 5.356 1.00 0.00 C ATOM 100 CD1 TYR A 7 7.933 -3.826 6.164 1.00 0.00 C ATOM 101 CD2 TYR A 7 9.660 -3.376 4.592 1.00 0.00 C ATOM 102 CE1 TYR A 7 8.315 -5.153 6.217 1.00 0.00 C ATOM 103 CE2 TYR A 7 10.052 -4.698 4.642 1.00 0.00 C ATOM 104 CZ TYR A 7 9.376 -5.583 5.451 1.00 0.00 C ATOM 105 OH TYR A 7 9.757 -6.904 5.488 1.00 0.00 O ATOM 0 H TYR A 7 6.954 -0.997 7.738 1.00 0.00 H new ATOM 0 HA TYR A 7 9.654 -0.668 6.583 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.065 -1.451 5.196 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.553 -1.034 4.370 1.00 0.00 H new ATOM 0 HD1 TYR A 7 7.101 -3.490 6.764 1.00 0.00 H new ATOM 0 HD2 TYR A 7 10.188 -2.688 3.949 1.00 0.00 H new ATOM 0 HE1 TYR A 7 7.786 -5.847 6.854 1.00 0.00 H new ATOM 0 HE2 TYR A 7 10.887 -5.038 4.048 1.00 0.00 H new ATOM 0 HH TYR A 7 9.126 -7.411 6.040 1.00 0.00 H new ATOM 115 N GLN A 8 9.103 1.729 6.197 1.00 0.00 N ATOM 116 CA GLN A 8 8.804 3.122 5.943 1.00 0.00 C ATOM 117 C GLN A 8 9.059 3.424 4.465 1.00 0.00 C ATOM 118 O GLN A 8 10.132 3.136 3.934 1.00 0.00 O ATOM 119 CB GLN A 8 9.627 4.014 6.886 1.00 0.00 C ATOM 120 CG GLN A 8 11.020 4.361 6.395 1.00 0.00 C ATOM 121 CD GLN A 8 11.680 5.459 7.215 1.00 0.00 C ATOM 122 OE1 GLN A 8 11.288 5.585 8.472 1.00 0.00 O flip ATOM 123 NE2 GLN A 8 12.520 6.207 6.713 1.00 0.00 N flip ATOM 0 H GLN A 8 10.091 1.525 6.350 1.00 0.00 H new ATOM 0 HA GLN A 8 7.755 3.335 6.147 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.078 4.940 7.056 1.00 0.00 H new ATOM 0 HB3 GLN A 8 9.713 3.513 7.850 1.00 0.00 H new ATOM 0 HG2 GLN A 8 11.643 3.467 6.425 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.965 4.676 5.353 1.00 0.00 H new ATOM 0 HE21 GLN A 8 12.799 6.081 5.740 1.00 0.00 H new ATOM 0 HE22 GLN A 8 12.937 6.953 7.270 1.00 0.00 H new ATOM 132 N VAL A 9 8.043 3.930 3.782 1.00 0.00 N ATOM 133 CA VAL A 9 8.141 4.169 2.348 1.00 0.00 C ATOM 134 C VAL A 9 9.181 5.229 2.045 1.00 0.00 C ATOM 135 O VAL A 9 9.239 6.269 2.699 1.00 0.00 O ATOM 136 CB VAL A 9 6.800 4.593 1.737 1.00 0.00 C ATOM 137 CG1 VAL A 9 6.896 4.630 0.217 1.00 0.00 C ATOM 138 CG2 VAL A 9 5.691 3.670 2.187 1.00 0.00 C ATOM 0 H VAL A 9 7.145 4.182 4.194 1.00 0.00 H new ATOM 0 HA VAL A 9 8.439 3.222 1.898 1.00 0.00 H new ATOM 0 HB VAL A 9 6.563 5.597 2.088 1.00 0.00 H new ATOM 0 HG11 VAL A 9 5.936 4.933 -0.201 1.00 0.00 H new ATOM 0 HG12 VAL A 9 7.663 5.344 -0.082 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.158 3.640 -0.155 1.00 0.00 H new ATOM 0 HG21 VAL A 9 4.749 3.989 1.742 1.00 0.00 H new ATOM 0 HG22 VAL A 9 5.915 2.651 1.871 1.00 0.00 H new ATOM 0 HG23 VAL A 9 5.608 3.703 3.273 1.00 0.00 H new ATOM 148 N GLN A 10 9.999 4.953 1.050 1.00 0.00 N ATOM 149 CA GLN A 10 11.011 5.886 0.626 1.00 0.00 C ATOM 150 C GLN A 10 10.641 6.452 -0.723 1.00 0.00 C ATOM 151 O GLN A 10 10.238 7.595 -0.832 1.00 0.00 O ATOM 152 CB GLN A 10 12.379 5.215 0.561 1.00 0.00 C ATOM 153 CG GLN A 10 12.908 4.757 1.891 1.00 0.00 C ATOM 154 CD GLN A 10 13.148 5.897 2.859 1.00 0.00 C ATOM 155 OE1 GLN A 10 12.264 6.291 3.614 1.00 0.00 O ATOM 156 NE2 GLN A 10 14.356 6.431 2.843 1.00 0.00 N ATOM 0 H GLN A 10 9.978 4.082 0.519 1.00 0.00 H new ATOM 0 HA GLN A 10 11.069 6.695 1.355 1.00 0.00 H new ATOM 0 HB2 GLN A 10 12.318 4.356 -0.108 1.00 0.00 H new ATOM 0 HB3 GLN A 10 13.092 5.912 0.120 1.00 0.00 H new ATOM 0 HG2 GLN A 10 12.202 4.055 2.334 1.00 0.00 H new ATOM 0 HG3 GLN A 10 13.842 4.216 1.737 1.00 0.00 H new ATOM 0 HE21 GLN A 10 15.063 6.074 2.200 1.00 0.00 H new ATOM 0 HE22 GLN A 10 14.582 7.200 3.474 1.00 0.00 H new ATOM 165 N SER A 11 10.713 5.635 -1.744 1.00 0.00 N ATOM 166 CA SER A 11 10.464 6.110 -3.078 1.00 0.00 C ATOM 167 C SER A 11 8.997 5.973 -3.392 1.00 0.00 C ATOM 168 O SER A 11 8.322 5.120 -2.835 1.00 0.00 O ATOM 169 CB SER A 11 11.276 5.336 -4.086 1.00 0.00 C ATOM 170 OG SER A 11 11.717 6.171 -5.142 1.00 0.00 O ATOM 0 H SER A 11 10.941 4.643 -1.676 1.00 0.00 H new ATOM 0 HA SER A 11 10.758 7.158 -3.135 1.00 0.00 H new ATOM 0 HB2 SER A 11 12.137 4.884 -3.593 1.00 0.00 H new ATOM 0 HB3 SER A 11 10.676 4.521 -4.490 1.00 0.00 H new ATOM 0 HG SER A 11 12.242 5.643 -5.779 1.00 0.00 H new ATOM 176 N GLN A 12 8.488 6.842 -4.229 1.00 0.00 N ATOM 177 CA GLN A 12 7.147 6.681 -4.763 1.00 0.00 C ATOM 178 C GLN A 12 7.081 7.303 -6.149 1.00 0.00 C ATOM 179 O GLN A 12 7.887 8.171 -6.484 1.00 0.00 O ATOM 180 CB GLN A 12 6.055 7.320 -3.879 1.00 0.00 C ATOM 181 CG GLN A 12 6.372 7.448 -2.398 1.00 0.00 C ATOM 182 CD GLN A 12 7.027 8.787 -2.090 1.00 0.00 C ATOM 183 OE1 GLN A 12 8.249 8.932 -2.144 1.00 0.00 O ATOM 184 NE2 GLN A 12 6.210 9.781 -1.774 1.00 0.00 N ATOM 0 H GLN A 12 8.979 7.673 -4.560 1.00 0.00 H new ATOM 0 HA GLN A 12 6.949 5.610 -4.796 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.839 8.315 -4.269 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.144 6.731 -3.983 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.455 7.346 -1.817 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.034 6.637 -2.094 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.203 9.622 -1.740 1.00 0.00 H new ATOM 0 HE22 GLN A 12 6.588 10.705 -1.565 1.00 0.00 H new ATOM 193 N GLU A 13 6.131 6.852 -6.947 1.00 0.00 N ATOM 194 CA GLU A 13 5.882 7.438 -8.251 1.00 0.00 C ATOM 195 C GLU A 13 4.468 7.939 -8.340 1.00 0.00 C ATOM 196 O GLU A 13 3.558 7.362 -7.738 1.00 0.00 O ATOM 197 CB GLU A 13 6.058 6.444 -9.378 1.00 0.00 C ATOM 198 CG GLU A 13 7.487 6.213 -9.797 1.00 0.00 C ATOM 199 CD GLU A 13 8.075 7.389 -10.548 1.00 0.00 C ATOM 200 OE1 GLU A 13 7.851 7.485 -11.773 1.00 0.00 O ATOM 201 OE2 GLU A 13 8.771 8.217 -9.930 1.00 0.00 O ATOM 0 H GLU A 13 5.514 6.075 -6.712 1.00 0.00 H new ATOM 0 HA GLU A 13 6.607 8.245 -8.356 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.624 5.491 -9.075 1.00 0.00 H new ATOM 0 HB3 GLU A 13 5.492 6.791 -10.242 1.00 0.00 H new ATOM 0 HG2 GLU A 13 8.092 6.013 -8.913 1.00 0.00 H new ATOM 0 HG3 GLU A 13 7.537 5.324 -10.426 1.00 0.00 H new ATOM 208 N ASN A 14 4.303 9.001 -9.106 1.00 0.00 N ATOM 209 CA ASN A 14 3.000 9.479 -9.506 1.00 0.00 C ATOM 210 C ASN A 14 2.096 9.726 -8.307 1.00 0.00 C ATOM 211 O ASN A 14 0.906 9.416 -8.328 1.00 0.00 O ATOM 212 CB ASN A 14 2.362 8.502 -10.489 1.00 0.00 C ATOM 213 CG ASN A 14 2.667 8.857 -11.930 1.00 0.00 C ATOM 214 OD1 ASN A 14 2.845 10.025 -12.271 1.00 0.00 O ATOM 215 ND2 ASN A 14 2.734 7.855 -12.789 1.00 0.00 N ATOM 0 H ASN A 14 5.077 9.558 -9.469 1.00 0.00 H new ATOM 0 HA ASN A 14 3.131 10.439 -10.005 1.00 0.00 H new ATOM 0 HB2 ASN A 14 2.721 7.494 -10.281 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.282 8.493 -10.340 1.00 0.00 H new ATOM 0 HD21 ASN A 14 2.939 8.038 -13.771 1.00 0.00 H new ATOM 0 HD22 ASN A 14 2.581 6.898 -12.470 1.00 0.00 H new ATOM 222 N PHE A 15 2.675 10.297 -7.264 1.00 0.00 N ATOM 223 CA PHE A 15 1.926 10.633 -6.065 1.00 0.00 C ATOM 224 C PHE A 15 1.020 11.821 -6.340 1.00 0.00 C ATOM 225 O PHE A 15 -0.133 11.850 -5.904 1.00 0.00 O ATOM 226 CB PHE A 15 2.876 10.946 -4.900 1.00 0.00 C ATOM 227 CG PHE A 15 2.180 11.442 -3.657 1.00 0.00 C ATOM 228 CD1 PHE A 15 1.793 12.769 -3.539 1.00 0.00 C ATOM 229 CD2 PHE A 15 1.906 10.579 -2.610 1.00 0.00 C ATOM 230 CE1 PHE A 15 1.149 13.222 -2.407 1.00 0.00 C ATOM 231 CE2 PHE A 15 1.261 11.026 -1.473 1.00 0.00 C ATOM 232 CZ PHE A 15 0.881 12.350 -1.371 1.00 0.00 C ATOM 0 H PHE A 15 3.665 10.538 -7.224 1.00 0.00 H new ATOM 0 HA PHE A 15 1.315 9.775 -5.784 1.00 0.00 H new ATOM 0 HB2 PHE A 15 3.441 10.047 -4.654 1.00 0.00 H new ATOM 0 HB3 PHE A 15 3.597 11.696 -5.224 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.999 13.457 -4.345 1.00 0.00 H new ATOM 0 HD2 PHE A 15 2.200 9.542 -2.683 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.854 14.258 -2.331 1.00 0.00 H new ATOM 0 HE2 PHE A 15 1.054 10.341 -0.664 1.00 0.00 H new ATOM 0 HZ PHE A 15 0.376 12.702 -0.484 1.00 0.00 H new ATOM 242 N GLU A 16 1.548 12.796 -7.078 1.00 0.00 N ATOM 243 CA GLU A 16 0.791 13.995 -7.398 1.00 0.00 C ATOM 244 C GLU A 16 -0.485 13.633 -8.113 1.00 0.00 C ATOM 245 O GLU A 16 -1.554 13.927 -7.631 1.00 0.00 O ATOM 246 CB GLU A 16 1.574 14.956 -8.286 1.00 0.00 C ATOM 247 CG GLU A 16 3.070 14.825 -8.186 1.00 0.00 C ATOM 248 CD GLU A 16 3.776 16.098 -8.619 1.00 0.00 C ATOM 249 OE1 GLU A 16 3.477 16.591 -9.727 1.00 0.00 O ATOM 250 OE2 GLU A 16 4.605 16.628 -7.851 1.00 0.00 O ATOM 0 H GLU A 16 2.493 12.776 -7.462 1.00 0.00 H new ATOM 0 HA GLU A 16 0.579 14.488 -6.449 1.00 0.00 H new ATOM 0 HB2 GLU A 16 1.277 14.796 -9.322 1.00 0.00 H new ATOM 0 HB3 GLU A 16 1.294 15.977 -8.029 1.00 0.00 H new ATOM 0 HG2 GLU A 16 3.347 14.587 -7.159 1.00 0.00 H new ATOM 0 HG3 GLU A 16 3.405 13.994 -8.807 1.00 0.00 H new ATOM 257 N PRO A 17 -0.394 12.960 -9.262 1.00 0.00 N ATOM 258 CA PRO A 17 -1.566 12.668 -10.075 1.00 0.00 C ATOM 259 C PRO A 17 -2.621 11.893 -9.294 1.00 0.00 C ATOM 260 O PRO A 17 -3.817 12.012 -9.562 1.00 0.00 O ATOM 261 CB PRO A 17 -1.030 11.845 -11.231 1.00 0.00 C ATOM 262 CG PRO A 17 0.311 11.373 -10.800 1.00 0.00 C ATOM 263 CD PRO A 17 0.831 12.390 -9.833 1.00 0.00 C ATOM 0 HA PRO A 17 -2.065 13.579 -10.406 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -1.688 11.005 -11.452 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -0.961 12.444 -12.139 1.00 0.00 H new ATOM 0 HG2 PRO A 17 0.244 10.391 -10.331 1.00 0.00 H new ATOM 0 HG3 PRO A 17 0.980 11.273 -11.655 1.00 0.00 H new ATOM 0 HD2 PRO A 17 1.459 11.935 -9.067 1.00 0.00 H new ATOM 0 HD3 PRO A 17 1.435 13.149 -10.331 1.00 0.00 H new ATOM 271 N PHE A 18 -2.173 11.122 -8.307 1.00 0.00 N ATOM 272 CA PHE A 18 -3.084 10.360 -7.472 1.00 0.00 C ATOM 273 C PHE A 18 -3.836 11.288 -6.519 1.00 0.00 C ATOM 274 O PHE A 18 -5.061 11.278 -6.483 1.00 0.00 O ATOM 275 CB PHE A 18 -2.316 9.299 -6.677 1.00 0.00 C ATOM 276 CG PHE A 18 -3.213 8.372 -5.911 1.00 0.00 C ATOM 277 CD1 PHE A 18 -4.124 7.583 -6.583 1.00 0.00 C ATOM 278 CD2 PHE A 18 -3.159 8.301 -4.528 1.00 0.00 C ATOM 279 CE1 PHE A 18 -4.967 6.734 -5.904 1.00 0.00 C ATOM 280 CE2 PHE A 18 -4.002 7.451 -3.835 1.00 0.00 C ATOM 281 CZ PHE A 18 -4.909 6.667 -4.524 1.00 0.00 C ATOM 0 H PHE A 18 -1.187 11.011 -8.070 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.807 9.860 -8.117 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -1.701 8.716 -7.362 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -1.638 9.795 -5.982 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -4.176 7.633 -7.661 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.453 8.914 -3.987 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.672 6.122 -6.447 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -3.952 7.400 -2.757 1.00 0.00 H new ATOM 0 HZ PHE A 18 -5.570 6.004 -3.986 1.00 0.00 H new ATOM 291 N MET A 19 -3.102 12.116 -5.778 1.00 0.00 N ATOM 292 CA MET A 19 -3.721 13.099 -4.884 1.00 0.00 C ATOM 293 C MET A 19 -4.414 14.184 -5.683 1.00 0.00 C ATOM 294 O MET A 19 -5.415 14.735 -5.247 1.00 0.00 O ATOM 295 CB MET A 19 -2.695 13.729 -3.941 1.00 0.00 C ATOM 296 CG MET A 19 -2.718 13.147 -2.538 1.00 0.00 C ATOM 297 SD MET A 19 -2.490 11.359 -2.520 1.00 0.00 S ATOM 298 CE MET A 19 -2.650 11.018 -0.768 1.00 0.00 C ATOM 0 H MET A 19 -2.082 12.128 -5.777 1.00 0.00 H new ATOM 0 HA MET A 19 -4.458 12.569 -4.281 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.698 13.598 -4.363 1.00 0.00 H new ATOM 0 HB3 MET A 19 -2.878 14.802 -3.883 1.00 0.00 H new ATOM 0 HG2 MET A 19 -1.934 13.615 -1.943 1.00 0.00 H new ATOM 0 HG3 MET A 19 -3.668 13.392 -2.063 1.00 0.00 H new ATOM 0 HE1 MET A 19 -2.533 9.949 -0.593 1.00 0.00 H new ATOM 0 HE2 MET A 19 -1.881 11.562 -0.220 1.00 0.00 H new ATOM 0 HE3 MET A 19 -3.634 11.336 -0.424 1.00 0.00 H new ATOM 308 N LYS A 20 -3.876 14.487 -6.849 1.00 0.00 N ATOM 309 CA LYS A 20 -4.458 15.482 -7.724 1.00 0.00 C ATOM 310 C LYS A 20 -5.864 15.069 -8.086 1.00 0.00 C ATOM 311 O LYS A 20 -6.812 15.832 -7.899 1.00 0.00 O ATOM 312 CB LYS A 20 -3.616 15.621 -8.975 1.00 0.00 C ATOM 313 CG LYS A 20 -2.677 16.798 -8.921 1.00 0.00 C ATOM 314 CD LYS A 20 -1.472 16.571 -9.789 1.00 0.00 C ATOM 315 CE LYS A 20 -0.674 17.836 -9.914 1.00 0.00 C ATOM 316 NZ LYS A 20 0.644 17.635 -10.583 1.00 0.00 N ATOM 0 H LYS A 20 -3.028 14.052 -7.213 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.488 16.444 -7.213 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -3.039 14.708 -9.122 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -4.272 15.725 -9.839 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -3.199 17.698 -9.246 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -2.361 16.967 -7.892 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -0.852 15.782 -9.363 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -1.785 16.232 -10.776 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -1.252 18.569 -10.477 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -0.510 18.254 -8.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 1.001 18.549 -10.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 1.321 17.233 -9.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 0.530 16.983 -11.385 1.00 0.00 H new ATOM 330 N ALA A 21 -5.992 13.803 -8.485 1.00 0.00 N ATOM 331 CA ALA A 21 -7.281 13.221 -8.812 1.00 0.00 C ATOM 332 C ALA A 21 -8.098 13.026 -7.548 1.00 0.00 C ATOM 333 O ALA A 21 -9.328 12.935 -7.570 1.00 0.00 O ATOM 334 CB ALA A 21 -7.101 11.915 -9.547 1.00 0.00 C ATOM 0 H ALA A 21 -5.206 13.161 -8.588 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.820 13.903 -9.469 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.078 11.493 -9.784 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -6.548 12.090 -10.470 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -6.547 11.217 -8.919 1.00 0.00 H new ATOM 340 N MET A 22 -7.378 12.986 -6.446 1.00 0.00 N ATOM 341 CA MET A 22 -7.963 12.866 -5.118 1.00 0.00 C ATOM 342 C MET A 22 -8.478 14.221 -4.642 1.00 0.00 C ATOM 343 O MET A 22 -9.045 14.345 -3.555 1.00 0.00 O ATOM 344 CB MET A 22 -6.917 12.298 -4.154 1.00 0.00 C ATOM 345 CG MET A 22 -6.887 10.783 -4.128 1.00 0.00 C ATOM 346 SD MET A 22 -8.374 10.062 -3.402 1.00 0.00 S ATOM 347 CE MET A 22 -8.220 10.609 -1.703 1.00 0.00 C ATOM 0 H MET A 22 -6.359 13.036 -6.442 1.00 0.00 H new ATOM 0 HA MET A 22 -8.813 12.184 -5.151 1.00 0.00 H new ATOM 0 HB2 MET A 22 -5.932 12.669 -4.437 1.00 0.00 H new ATOM 0 HB3 MET A 22 -7.120 12.668 -3.149 1.00 0.00 H new ATOM 0 HG2 MET A 22 -6.768 10.410 -5.145 1.00 0.00 H new ATOM 0 HG3 MET A 22 -6.016 10.452 -3.563 1.00 0.00 H new ATOM 0 HE1 MET A 22 -8.821 9.968 -1.058 1.00 0.00 H new ATOM 0 HE2 MET A 22 -7.175 10.555 -1.397 1.00 0.00 H new ATOM 0 HE3 MET A 22 -8.570 11.638 -1.619 1.00 0.00 H new ATOM 357 N GLY A 23 -8.257 15.232 -5.472 1.00 0.00 N ATOM 358 CA GLY A 23 -8.807 16.552 -5.232 1.00 0.00 C ATOM 359 C GLY A 23 -7.767 17.530 -4.736 1.00 0.00 C ATOM 360 O GLY A 23 -8.090 18.658 -4.364 1.00 0.00 O ATOM 0 H GLY A 23 -7.697 15.158 -6.321 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -9.248 16.932 -6.154 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -9.611 16.480 -4.500 1.00 0.00 H new ATOM 364 N LEU A 24 -6.516 17.108 -4.738 1.00 0.00 N ATOM 365 CA LEU A 24 -5.448 17.916 -4.167 1.00 0.00 C ATOM 366 C LEU A 24 -4.846 18.842 -5.210 1.00 0.00 C ATOM 367 O LEU A 24 -4.512 18.429 -6.320 1.00 0.00 O ATOM 368 CB LEU A 24 -4.364 17.032 -3.551 1.00 0.00 C ATOM 369 CG LEU A 24 -3.453 17.737 -2.557 1.00 0.00 C ATOM 370 CD1 LEU A 24 -4.201 18.027 -1.272 1.00 0.00 C ATOM 371 CD2 LEU A 24 -2.206 16.925 -2.283 1.00 0.00 C ATOM 0 H LEU A 24 -6.213 16.215 -5.126 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.883 18.528 -3.377 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -4.843 16.191 -3.050 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.752 16.619 -4.353 1.00 0.00 H new ATOM 0 HG LEU A 24 -3.139 18.683 -2.997 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.537 18.531 -0.570 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.057 18.667 -1.486 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -4.548 17.091 -0.834 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.576 17.456 -1.569 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.486 15.956 -1.870 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.656 16.777 -3.213 1.00 0.00 H new ATOM 383 N PRO A 25 -4.731 20.116 -4.848 1.00 0.00 N ATOM 384 CA PRO A 25 -4.064 21.121 -5.666 1.00 0.00 C ATOM 385 C PRO A 25 -2.572 20.852 -5.735 1.00 0.00 C ATOM 386 O PRO A 25 -1.970 20.422 -4.756 1.00 0.00 O ATOM 387 CB PRO A 25 -4.322 22.435 -4.933 1.00 0.00 C ATOM 388 CG PRO A 25 -4.862 22.086 -3.593 1.00 0.00 C ATOM 389 CD PRO A 25 -5.249 20.651 -3.592 1.00 0.00 C ATOM 0 HA PRO A 25 -4.431 21.127 -6.692 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -3.402 23.012 -4.840 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -5.030 23.052 -5.486 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -4.114 22.276 -2.823 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -5.725 22.710 -3.359 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -4.823 20.128 -2.736 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -6.331 20.535 -3.530 1.00 0.00 H new ATOM 397 N GLU A 26 -1.990 21.108 -6.907 1.00 0.00 N ATOM 398 CA GLU A 26 -0.592 20.816 -7.173 1.00 0.00 C ATOM 399 C GLU A 26 0.341 21.432 -6.133 1.00 0.00 C ATOM 400 O GLU A 26 1.395 20.879 -5.844 1.00 0.00 O ATOM 401 CB GLU A 26 -0.214 21.286 -8.571 1.00 0.00 C ATOM 402 CG GLU A 26 1.201 20.917 -8.956 1.00 0.00 C ATOM 403 CD GLU A 26 1.478 21.133 -10.423 1.00 0.00 C ATOM 404 OE1 GLU A 26 1.848 22.262 -10.803 1.00 0.00 O ATOM 405 OE2 GLU A 26 1.313 20.177 -11.208 1.00 0.00 O ATOM 0 H GLU A 26 -2.482 21.525 -7.697 1.00 0.00 H new ATOM 0 HA GLU A 26 -0.470 19.735 -7.109 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -0.906 20.853 -9.293 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -0.330 22.368 -8.628 1.00 0.00 H new ATOM 0 HG2 GLU A 26 1.900 21.510 -8.367 1.00 0.00 H new ATOM 0 HG3 GLU A 26 1.381 19.871 -8.706 1.00 0.00 H new ATOM 412 N ASP A 27 -0.037 22.575 -5.578 1.00 0.00 N ATOM 413 CA ASP A 27 0.761 23.200 -4.529 1.00 0.00 C ATOM 414 C ASP A 27 0.784 22.321 -3.285 1.00 0.00 C ATOM 415 O ASP A 27 1.844 22.053 -2.724 1.00 0.00 O ATOM 416 CB ASP A 27 0.218 24.585 -4.186 1.00 0.00 C ATOM 417 CG ASP A 27 1.049 25.291 -3.132 1.00 0.00 C ATOM 418 OD1 ASP A 27 0.997 24.887 -1.951 1.00 0.00 O ATOM 419 OD2 ASP A 27 1.772 26.244 -3.480 1.00 0.00 O ATOM 0 H ASP A 27 -0.883 23.085 -5.832 1.00 0.00 H new ATOM 0 HA ASP A 27 1.780 23.313 -4.899 1.00 0.00 H new ATOM 0 HB2 ASP A 27 0.189 25.194 -5.089 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -0.809 24.492 -3.832 1.00 0.00 H new ATOM 424 N LEU A 28 -0.382 21.822 -2.893 1.00 0.00 N ATOM 425 CA LEU A 28 -0.476 20.928 -1.743 1.00 0.00 C ATOM 426 C LEU A 28 0.119 19.583 -2.105 1.00 0.00 C ATOM 427 O LEU A 28 0.675 18.877 -1.266 1.00 0.00 O ATOM 428 CB LEU A 28 -1.921 20.756 -1.302 1.00 0.00 C ATOM 429 CG LEU A 28 -2.482 21.917 -0.500 1.00 0.00 C ATOM 430 CD1 LEU A 28 -3.931 21.668 -0.161 1.00 0.00 C ATOM 431 CD2 LEU A 28 -1.665 22.137 0.760 1.00 0.00 C ATOM 0 H LEU A 28 -1.272 22.019 -3.351 1.00 0.00 H new ATOM 0 HA LEU A 28 0.079 21.366 -0.913 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.541 20.609 -2.186 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.999 19.848 -0.704 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.421 22.821 -1.107 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.320 22.508 0.414 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -4.506 21.560 -1.080 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -4.015 20.755 0.429 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.081 22.973 1.322 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.693 21.237 1.374 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.633 22.360 0.490 1.00 0.00 H new ATOM 443 N ILE A 29 -0.010 19.257 -3.373 1.00 0.00 N ATOM 444 CA ILE A 29 0.582 18.084 -3.955 1.00 0.00 C ATOM 445 C ILE A 29 2.091 18.078 -3.777 1.00 0.00 C ATOM 446 O ILE A 29 2.662 17.085 -3.356 1.00 0.00 O ATOM 447 CB ILE A 29 0.234 18.070 -5.449 1.00 0.00 C ATOM 448 CG1 ILE A 29 -1.126 17.430 -5.653 1.00 0.00 C ATOM 449 CG2 ILE A 29 1.278 17.360 -6.254 1.00 0.00 C ATOM 450 CD1 ILE A 29 -1.112 15.934 -5.559 1.00 0.00 C ATOM 0 H ILE A 29 -0.543 19.817 -4.039 1.00 0.00 H new ATOM 0 HA ILE A 29 0.191 17.197 -3.456 1.00 0.00 H new ATOM 0 HB ILE A 29 0.202 19.101 -5.800 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.818 17.825 -4.909 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -1.510 17.720 -6.631 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.996 17.371 -7.307 1.00 0.00 H new ATOM 0 HG22 ILE A 29 2.237 17.863 -6.130 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.362 16.328 -5.912 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -2.120 15.550 -5.716 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -0.447 15.528 -6.321 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -0.759 15.635 -4.572 1.00 0.00 H new ATOM 462 N GLN A 30 2.729 19.195 -4.081 1.00 0.00 N ATOM 463 CA GLN A 30 4.176 19.281 -4.001 1.00 0.00 C ATOM 464 C GLN A 30 4.667 19.181 -2.557 1.00 0.00 C ATOM 465 O GLN A 30 5.805 18.792 -2.303 1.00 0.00 O ATOM 466 CB GLN A 30 4.659 20.572 -4.666 1.00 0.00 C ATOM 467 CG GLN A 30 4.410 20.597 -6.158 1.00 0.00 C ATOM 468 CD GLN A 30 5.055 21.775 -6.859 1.00 0.00 C ATOM 469 OE1 GLN A 30 5.243 22.873 -6.145 1.00 0.00 O flip ATOM 470 NE2 GLN A 30 5.394 21.692 -8.039 1.00 0.00 N flip ATOM 0 H GLN A 30 2.269 20.053 -4.385 1.00 0.00 H new ATOM 0 HA GLN A 30 4.601 18.433 -4.538 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.156 21.422 -4.205 1.00 0.00 H new ATOM 0 HB3 GLN A 30 5.726 20.693 -4.479 1.00 0.00 H new ATOM 0 HG2 GLN A 30 4.786 19.673 -6.597 1.00 0.00 H new ATOM 0 HG3 GLN A 30 3.335 20.621 -6.339 1.00 0.00 H new ATOM 0 HE21 GLN A 30 5.232 20.828 -8.557 1.00 0.00 H new ATOM 0 HE22 GLN A 30 5.837 22.487 -8.500 1.00 0.00 H new ATOM 479 N LYS A 31 3.802 19.537 -1.620 1.00 0.00 N ATOM 480 CA LYS A 31 4.075 19.394 -0.207 1.00 0.00 C ATOM 481 C LYS A 31 3.882 17.960 0.216 1.00 0.00 C ATOM 482 O LYS A 31 4.806 17.291 0.686 1.00 0.00 O ATOM 483 CB LYS A 31 3.119 20.282 0.574 1.00 0.00 C ATOM 484 CG LYS A 31 3.757 21.550 1.022 1.00 0.00 C ATOM 485 CD LYS A 31 3.192 22.752 0.298 1.00 0.00 C ATOM 486 CE LYS A 31 3.960 23.025 -0.975 1.00 0.00 C ATOM 487 NZ LYS A 31 3.580 24.323 -1.590 1.00 0.00 N ATOM 0 H LYS A 31 2.886 19.936 -1.825 1.00 0.00 H new ATOM 0 HA LYS A 31 5.106 19.687 -0.008 1.00 0.00 H new ATOM 0 HB2 LYS A 31 2.254 20.514 -0.047 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.750 19.737 1.443 1.00 0.00 H new ATOM 0 HG2 LYS A 31 3.610 21.671 2.095 1.00 0.00 H new ATOM 0 HG3 LYS A 31 4.832 21.496 0.851 1.00 0.00 H new ATOM 0 HD2 LYS A 31 2.141 22.580 0.064 1.00 0.00 H new ATOM 0 HD3 LYS A 31 3.235 23.626 0.948 1.00 0.00 H new ATOM 0 HE2 LYS A 31 5.029 23.025 -0.760 1.00 0.00 H new ATOM 0 HE3 LYS A 31 3.778 22.220 -1.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 3.727 24.276 -2.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.578 24.521 -1.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 4.168 25.082 -1.190 1.00 0.00 H new ATOM 501 N GLY A 32 2.662 17.509 0.025 1.00 0.00 N ATOM 502 CA GLY A 32 2.282 16.161 0.367 1.00 0.00 C ATOM 503 C GLY A 32 3.113 15.114 -0.343 1.00 0.00 C ATOM 504 O GLY A 32 3.248 13.998 0.152 1.00 0.00 O ATOM 0 H GLY A 32 1.907 18.068 -0.372 1.00 0.00 H new ATOM 0 HA2 GLY A 32 2.378 16.024 1.444 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.231 16.012 0.120 1.00 0.00 H new ATOM 508 N LYS A 33 3.677 15.465 -1.499 1.00 0.00 N ATOM 509 CA LYS A 33 4.426 14.486 -2.293 1.00 0.00 C ATOM 510 C LYS A 33 5.680 13.980 -1.578 1.00 0.00 C ATOM 511 O LYS A 33 6.300 13.010 -2.017 1.00 0.00 O ATOM 512 CB LYS A 33 4.784 15.008 -3.680 1.00 0.00 C ATOM 513 CG LYS A 33 5.959 15.930 -3.769 1.00 0.00 C ATOM 514 CD LYS A 33 6.111 16.249 -5.225 1.00 0.00 C ATOM 515 CE LYS A 33 6.907 17.505 -5.482 1.00 0.00 C ATOM 516 NZ LYS A 33 6.946 17.816 -6.935 1.00 0.00 N ATOM 0 H LYS A 33 3.633 16.401 -1.902 1.00 0.00 H new ATOM 0 HA LYS A 33 3.749 13.641 -2.416 1.00 0.00 H new ATOM 0 HB2 LYS A 33 4.974 14.152 -4.327 1.00 0.00 H new ATOM 0 HB3 LYS A 33 3.914 15.526 -4.084 1.00 0.00 H new ATOM 0 HG2 LYS A 33 5.792 16.835 -3.185 1.00 0.00 H new ATOM 0 HG3 LYS A 33 6.859 15.457 -3.375 1.00 0.00 H new ATOM 0 HD2 LYS A 33 6.597 15.411 -5.724 1.00 0.00 H new ATOM 0 HD3 LYS A 33 5.122 16.356 -5.671 1.00 0.00 H new ATOM 0 HE2 LYS A 33 6.464 18.340 -4.938 1.00 0.00 H new ATOM 0 HE3 LYS A 33 7.922 17.382 -5.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 6.949 18.847 -7.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 7.807 17.409 -7.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 6.109 17.409 -7.400 1.00 0.00 H new ATOM 530 N ASP A 34 6.044 14.619 -0.472 1.00 0.00 N ATOM 531 CA ASP A 34 7.238 14.218 0.259 1.00 0.00 C ATOM 532 C ASP A 34 6.842 13.285 1.387 1.00 0.00 C ATOM 533 O ASP A 34 7.676 12.770 2.121 1.00 0.00 O ATOM 534 CB ASP A 34 7.990 15.431 0.814 1.00 0.00 C ATOM 535 CG ASP A 34 9.397 15.071 1.268 1.00 0.00 C ATOM 536 OD1 ASP A 34 10.303 15.013 0.407 1.00 0.00 O ATOM 537 OD2 ASP A 34 9.608 14.840 2.478 1.00 0.00 O ATOM 0 H ASP A 34 5.537 15.406 -0.067 1.00 0.00 H new ATOM 0 HA ASP A 34 7.909 13.703 -0.429 1.00 0.00 H new ATOM 0 HB2 ASP A 34 8.043 16.206 0.049 1.00 0.00 H new ATOM 0 HB3 ASP A 34 7.434 15.849 1.653 1.00 0.00 H new ATOM 542 N ILE A 35 5.547 13.109 1.545 1.00 0.00 N ATOM 543 CA ILE A 35 5.009 12.186 2.498 1.00 0.00 C ATOM 544 C ILE A 35 4.863 10.797 1.884 1.00 0.00 C ATOM 545 O ILE A 35 4.431 10.649 0.740 1.00 0.00 O ATOM 546 CB ILE A 35 3.646 12.690 3.026 1.00 0.00 C ATOM 547 CG1 ILE A 35 3.843 13.898 3.942 1.00 0.00 C ATOM 548 CG2 ILE A 35 2.894 11.598 3.742 1.00 0.00 C ATOM 549 CD1 ILE A 35 4.246 15.163 3.235 1.00 0.00 C ATOM 0 H ILE A 35 4.840 13.611 1.007 1.00 0.00 H new ATOM 0 HA ILE A 35 5.703 12.117 3.336 1.00 0.00 H new ATOM 0 HB ILE A 35 3.047 12.995 2.168 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.915 14.081 4.485 1.00 0.00 H new ATOM 0 HG13 ILE A 35 4.603 13.654 4.684 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.941 11.987 4.100 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.714 10.770 3.056 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.483 11.246 4.589 1.00 0.00 H new ATOM 0 HD11 ILE A 35 4.363 15.966 3.963 1.00 0.00 H new ATOM 0 HD12 ILE A 35 5.191 15.004 2.715 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.477 15.437 2.513 1.00 0.00 H new ATOM 561 N LYS A 36 5.239 9.790 2.652 1.00 0.00 N ATOM 562 CA LYS A 36 5.097 8.405 2.224 1.00 0.00 C ATOM 563 C LYS A 36 4.362 7.625 3.285 1.00 0.00 C ATOM 564 O LYS A 36 3.566 6.726 2.998 1.00 0.00 O ATOM 565 CB LYS A 36 6.454 7.736 1.978 1.00 0.00 C ATOM 566 CG LYS A 36 7.412 8.525 1.111 1.00 0.00 C ATOM 567 CD LYS A 36 8.270 9.459 1.950 1.00 0.00 C ATOM 568 CE LYS A 36 9.004 10.472 1.095 1.00 0.00 C ATOM 569 NZ LYS A 36 10.165 9.892 0.381 1.00 0.00 N ATOM 0 H LYS A 36 5.647 9.904 3.580 1.00 0.00 H new ATOM 0 HA LYS A 36 4.542 8.408 1.286 1.00 0.00 H new ATOM 0 HB2 LYS A 36 6.929 7.550 2.941 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.284 6.765 1.513 1.00 0.00 H new ATOM 0 HG2 LYS A 36 8.052 7.840 0.555 1.00 0.00 H new ATOM 0 HG3 LYS A 36 6.851 9.103 0.377 1.00 0.00 H new ATOM 0 HD2 LYS A 36 7.641 9.981 2.671 1.00 0.00 H new ATOM 0 HD3 LYS A 36 8.992 8.875 2.521 1.00 0.00 H new ATOM 0 HE2 LYS A 36 8.311 10.896 0.368 1.00 0.00 H new ATOM 0 HE3 LYS A 36 9.345 11.293 1.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 10.313 10.402 -0.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 11.015 9.978 0.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 9.983 8.888 0.181 1.00 0.00 H new ATOM 583 N GLY A 37 4.645 7.998 4.514 1.00 0.00 N ATOM 584 CA GLY A 37 4.039 7.364 5.656 1.00 0.00 C ATOM 585 C GLY A 37 4.798 6.139 6.111 1.00 0.00 C ATOM 586 O GLY A 37 5.631 5.601 5.379 1.00 0.00 O ATOM 0 H GLY A 37 5.299 8.746 4.745 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.984 8.079 6.477 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.015 7.082 5.410 1.00 0.00 H new ATOM 590 N VAL A 38 4.509 5.692 7.322 1.00 0.00 N ATOM 591 CA VAL A 38 5.145 4.508 7.862 1.00 0.00 C ATOM 592 C VAL A 38 4.174 3.338 7.835 1.00 0.00 C ATOM 593 O VAL A 38 3.019 3.468 8.248 1.00 0.00 O ATOM 594 CB VAL A 38 5.642 4.740 9.298 1.00 0.00 C ATOM 595 CG1 VAL A 38 6.398 3.528 9.816 1.00 0.00 C ATOM 596 CG2 VAL A 38 6.516 5.974 9.321 1.00 0.00 C ATOM 0 H VAL A 38 3.836 6.134 7.949 1.00 0.00 H new ATOM 0 HA VAL A 38 6.010 4.280 7.239 1.00 0.00 H new ATOM 0 HB VAL A 38 4.786 4.891 9.956 1.00 0.00 H new ATOM 0 HG11 VAL A 38 6.738 3.719 10.834 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.740 2.659 9.811 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.259 3.335 9.176 1.00 0.00 H new ATOM 0 HG21 VAL A 38 6.874 6.147 10.336 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.367 5.829 8.656 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.938 6.836 8.988 1.00 0.00 H new ATOM 606 N SER A 39 4.633 2.206 7.327 1.00 0.00 N ATOM 607 CA SER A 39 3.785 1.033 7.202 1.00 0.00 C ATOM 608 C SER A 39 4.378 -0.127 7.984 1.00 0.00 C ATOM 609 O SER A 39 5.586 -0.221 8.133 1.00 0.00 O ATOM 610 CB SER A 39 3.626 0.655 5.737 1.00 0.00 C ATOM 611 OG SER A 39 3.394 1.807 4.942 1.00 0.00 O ATOM 0 H SER A 39 5.588 2.075 6.995 1.00 0.00 H new ATOM 0 HA SER A 39 2.802 1.264 7.612 1.00 0.00 H new ATOM 0 HB2 SER A 39 4.523 0.142 5.390 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.796 -0.043 5.625 1.00 0.00 H new ATOM 0 HG SER A 39 3.296 1.543 4.003 1.00 0.00 H new ATOM 617 N GLU A 40 3.533 -0.984 8.514 1.00 0.00 N ATOM 618 CA GLU A 40 4.001 -2.147 9.240 1.00 0.00 C ATOM 619 C GLU A 40 3.384 -3.408 8.662 1.00 0.00 C ATOM 620 O GLU A 40 2.182 -3.453 8.392 1.00 0.00 O ATOM 621 CB GLU A 40 3.669 -2.034 10.725 1.00 0.00 C ATOM 622 CG GLU A 40 4.441 -3.026 11.567 1.00 0.00 C ATOM 623 CD GLU A 40 4.047 -3.008 13.029 1.00 0.00 C ATOM 624 OE1 GLU A 40 4.061 -1.921 13.643 1.00 0.00 O ATOM 625 OE2 GLU A 40 3.758 -4.090 13.581 1.00 0.00 O ATOM 0 H GLU A 40 2.518 -0.899 8.457 1.00 0.00 H new ATOM 0 HA GLU A 40 5.085 -2.200 9.135 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.889 -1.023 11.067 1.00 0.00 H new ATOM 0 HB3 GLU A 40 2.600 -2.194 10.869 1.00 0.00 H new ATOM 0 HG2 GLU A 40 4.285 -4.029 11.169 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.506 -2.812 11.483 1.00 0.00 H new ATOM 632 N ILE A 41 4.217 -4.419 8.476 1.00 0.00 N ATOM 633 CA ILE A 41 3.810 -5.654 7.830 1.00 0.00 C ATOM 634 C ILE A 41 4.098 -6.839 8.740 1.00 0.00 C ATOM 635 O ILE A 41 5.244 -7.104 9.038 1.00 0.00 O ATOM 636 CB ILE A 41 4.600 -5.852 6.516 1.00 0.00 C ATOM 637 CG1 ILE A 41 4.594 -4.571 5.682 1.00 0.00 C ATOM 638 CG2 ILE A 41 4.043 -7.013 5.718 1.00 0.00 C ATOM 639 CD1 ILE A 41 3.216 -4.149 5.250 1.00 0.00 C ATOM 0 H ILE A 41 5.194 -4.406 8.769 1.00 0.00 H new ATOM 0 HA ILE A 41 2.742 -5.593 7.620 1.00 0.00 H new ATOM 0 HB ILE A 41 5.632 -6.086 6.776 1.00 0.00 H new ATOM 0 HG12 ILE A 41 5.048 -3.767 6.261 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.215 -4.718 4.798 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.616 -7.131 4.799 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.112 -7.927 6.308 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.999 -6.818 5.472 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.283 -3.234 4.662 1.00 0.00 H new ATOM 0 HD12 ILE A 41 2.767 -4.937 4.645 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.598 -3.971 6.130 1.00 0.00 H new ATOM 651 N VAL A 42 3.074 -7.542 9.188 1.00 0.00 N ATOM 652 CA VAL A 42 3.275 -8.755 9.981 1.00 0.00 C ATOM 653 C VAL A 42 2.577 -9.920 9.300 1.00 0.00 C ATOM 654 O VAL A 42 1.357 -9.984 9.266 1.00 0.00 O ATOM 655 CB VAL A 42 2.701 -8.603 11.406 1.00 0.00 C ATOM 656 CG1 VAL A 42 3.057 -9.811 12.253 1.00 0.00 C ATOM 657 CG2 VAL A 42 3.184 -7.321 12.063 1.00 0.00 C ATOM 0 H VAL A 42 2.097 -7.301 9.021 1.00 0.00 H new ATOM 0 HA VAL A 42 4.348 -8.933 10.055 1.00 0.00 H new ATOM 0 HB VAL A 42 1.616 -8.544 11.327 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.645 -9.687 13.254 1.00 0.00 H new ATOM 0 HG12 VAL A 42 2.641 -10.710 11.798 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.141 -9.904 12.316 1.00 0.00 H new ATOM 0 HG21 VAL A 42 2.762 -7.244 13.065 1.00 0.00 H new ATOM 0 HG22 VAL A 42 4.272 -7.333 12.128 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.865 -6.465 11.468 1.00 0.00 H new ATOM 667 N HIS A 43 3.344 -10.851 8.785 1.00 0.00 N ATOM 668 CA HIS A 43 2.771 -11.947 8.021 1.00 0.00 C ATOM 669 C HIS A 43 2.726 -13.207 8.864 1.00 0.00 C ATOM 670 O HIS A 43 3.752 -13.696 9.315 1.00 0.00 O ATOM 671 CB HIS A 43 3.556 -12.154 6.712 1.00 0.00 C ATOM 672 CG HIS A 43 3.328 -13.476 6.026 1.00 0.00 C ATOM 673 ND1 HIS A 43 4.351 -14.226 5.484 1.00 0.00 N ATOM 674 CD2 HIS A 43 2.190 -14.161 5.761 1.00 0.00 C ATOM 675 CE1 HIS A 43 3.851 -15.306 4.920 1.00 0.00 C ATOM 676 NE2 HIS A 43 2.545 -15.292 5.073 1.00 0.00 N ATOM 0 H HIS A 43 4.360 -10.877 8.877 1.00 0.00 H new ATOM 0 HA HIS A 43 1.745 -11.699 7.749 1.00 0.00 H new ATOM 0 HB2 HIS A 43 3.293 -11.354 6.020 1.00 0.00 H new ATOM 0 HB3 HIS A 43 4.620 -12.053 6.926 1.00 0.00 H new ATOM 0 HD1 HIS A 43 5.341 -13.982 5.515 1.00 0.00 H new ATOM 0 HD2 HIS A 43 1.188 -13.870 6.040 1.00 0.00 H new ATOM 0 HE1 HIS A 43 4.419 -16.074 4.416 1.00 0.00 H new ATOM 0 HE2 HIS A 43 1.901 -16.007 4.735 1.00 0.00 H new ATOM 685 N GLU A 44 1.521 -13.695 9.098 1.00 0.00 N ATOM 686 CA GLU A 44 1.318 -14.931 9.833 1.00 0.00 C ATOM 687 C GLU A 44 0.561 -15.952 8.974 1.00 0.00 C ATOM 688 O GLU A 44 -0.627 -15.774 8.670 1.00 0.00 O ATOM 689 CB GLU A 44 0.567 -14.637 11.130 1.00 0.00 C ATOM 690 CG GLU A 44 0.147 -15.874 11.901 1.00 0.00 C ATOM 691 CD GLU A 44 1.315 -16.748 12.322 1.00 0.00 C ATOM 692 OE1 GLU A 44 2.077 -16.346 13.224 1.00 0.00 O ATOM 693 OE2 GLU A 44 1.459 -17.858 11.772 1.00 0.00 O ATOM 0 H GLU A 44 0.659 -13.248 8.786 1.00 0.00 H new ATOM 0 HA GLU A 44 2.287 -15.364 10.082 1.00 0.00 H new ATOM 0 HB2 GLU A 44 1.198 -14.021 11.770 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -0.321 -14.049 10.897 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -0.407 -15.569 12.789 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -0.534 -16.462 11.286 1.00 0.00 H new ATOM 700 N GLY A 45 1.259 -17.014 8.580 1.00 0.00 N ATOM 701 CA GLY A 45 0.658 -18.051 7.756 1.00 0.00 C ATOM 702 C GLY A 45 0.357 -17.565 6.355 1.00 0.00 C ATOM 703 O GLY A 45 1.248 -17.479 5.514 1.00 0.00 O ATOM 0 H GLY A 45 2.237 -17.176 8.819 1.00 0.00 H new ATOM 0 HA2 GLY A 45 1.330 -18.907 7.705 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.263 -18.397 8.225 1.00 0.00 H new ATOM 707 N LYS A 46 -0.904 -17.273 6.099 1.00 0.00 N ATOM 708 CA LYS A 46 -1.322 -16.649 4.860 1.00 0.00 C ATOM 709 C LYS A 46 -1.595 -15.176 5.068 1.00 0.00 C ATOM 710 O LYS A 46 -1.207 -14.341 4.259 1.00 0.00 O ATOM 711 CB LYS A 46 -2.571 -17.309 4.335 1.00 0.00 C ATOM 712 CG LYS A 46 -2.299 -18.309 3.234 1.00 0.00 C ATOM 713 CD LYS A 46 -1.586 -19.554 3.739 1.00 0.00 C ATOM 714 CE LYS A 46 -1.513 -20.635 2.666 1.00 0.00 C ATOM 715 NZ LYS A 46 -0.797 -20.182 1.441 1.00 0.00 N ATOM 0 H LYS A 46 -1.669 -17.463 6.747 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.514 -16.767 4.138 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -3.081 -17.813 5.156 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -3.250 -16.542 3.961 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -3.242 -18.598 2.769 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -1.694 -17.837 2.460 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -0.578 -19.291 4.060 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.108 -19.943 4.613 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -1.009 -21.512 3.073 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -2.523 -20.944 2.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -0.702 -20.979 0.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -1.336 -19.417 0.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 0.148 -19.833 1.700 1.00 0.00 H new ATOM 729 N LYS A 47 -2.247 -14.860 6.164 1.00 0.00 N ATOM 730 CA LYS A 47 -2.663 -13.496 6.414 1.00 0.00 C ATOM 731 C LYS A 47 -1.481 -12.631 6.777 1.00 0.00 C ATOM 732 O LYS A 47 -0.597 -13.027 7.535 1.00 0.00 O ATOM 733 CB LYS A 47 -3.672 -13.429 7.545 1.00 0.00 C ATOM 734 CG LYS A 47 -4.622 -14.597 7.583 1.00 0.00 C ATOM 735 CD LYS A 47 -5.821 -14.285 8.441 1.00 0.00 C ATOM 736 CE LYS A 47 -5.417 -13.821 9.831 1.00 0.00 C ATOM 737 NZ LYS A 47 -6.597 -13.487 10.671 1.00 0.00 N ATOM 0 H LYS A 47 -2.501 -15.525 6.895 1.00 0.00 H new ATOM 0 HA LYS A 47 -3.121 -13.129 5.495 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -3.137 -13.377 8.493 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -4.247 -12.508 7.452 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.947 -14.840 6.571 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.109 -15.476 7.973 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -6.420 -13.512 7.960 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -6.450 -15.172 8.523 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -4.834 -14.602 10.319 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -4.772 -12.946 9.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -6.277 -13.175 11.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -7.140 -12.724 10.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -7.200 -14.328 10.772 1.00 0.00 H new ATOM 751 N VAL A 48 -1.470 -11.455 6.206 1.00 0.00 N ATOM 752 CA VAL A 48 -0.444 -10.491 6.477 1.00 0.00 C ATOM 753 C VAL A 48 -1.088 -9.224 7.014 1.00 0.00 C ATOM 754 O VAL A 48 -2.113 -8.769 6.503 1.00 0.00 O ATOM 755 CB VAL A 48 0.369 -10.172 5.210 1.00 0.00 C ATOM 756 CG1 VAL A 48 1.527 -9.248 5.532 1.00 0.00 C ATOM 757 CG2 VAL A 48 0.865 -11.439 4.543 1.00 0.00 C ATOM 0 H VAL A 48 -2.175 -11.141 5.539 1.00 0.00 H new ATOM 0 HA VAL A 48 0.242 -10.905 7.216 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.293 -9.662 4.510 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.088 -9.036 4.621 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.144 -8.316 5.947 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.183 -9.727 6.259 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.436 -11.181 3.651 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.502 -11.989 5.235 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.014 -12.060 4.262 1.00 0.00 H new ATOM 767 N LYS A 49 -0.503 -8.675 8.054 1.00 0.00 N ATOM 768 CA LYS A 49 -1.002 -7.448 8.652 1.00 0.00 C ATOM 769 C LYS A 49 -0.395 -6.239 7.961 1.00 0.00 C ATOM 770 O LYS A 49 0.825 -6.082 7.942 1.00 0.00 O ATOM 771 CB LYS A 49 -0.649 -7.394 10.125 1.00 0.00 C ATOM 772 CG LYS A 49 -1.202 -8.540 10.952 1.00 0.00 C ATOM 773 CD LYS A 49 -0.586 -8.546 12.339 1.00 0.00 C ATOM 774 CE LYS A 49 -1.159 -9.656 13.209 1.00 0.00 C ATOM 775 NZ LYS A 49 -2.592 -9.430 13.544 1.00 0.00 N ATOM 0 H LYS A 49 0.325 -9.059 8.509 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.086 -7.434 8.535 1.00 0.00 H new ATOM 0 HB2 LYS A 49 0.436 -7.383 10.224 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.017 -6.455 10.539 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.285 -8.449 11.030 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.997 -9.487 10.453 1.00 0.00 H new ATOM 0 HD2 LYS A 49 0.494 -8.670 12.256 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.760 -7.583 12.818 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.055 -10.610 12.692 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.580 -9.728 14.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.909 -10.155 14.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.705 -8.488 13.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -3.164 -9.489 12.678 1.00 0.00 H new ATOM 789 N LEU A 50 -1.243 -5.398 7.391 1.00 0.00 N ATOM 790 CA LEU A 50 -0.797 -4.178 6.743 1.00 0.00 C ATOM 791 C LEU A 50 -1.325 -2.971 7.493 1.00 0.00 C ATOM 792 O LEU A 50 -2.519 -2.666 7.458 1.00 0.00 O ATOM 793 CB LEU A 50 -1.255 -4.132 5.282 1.00 0.00 C ATOM 794 CG LEU A 50 -0.215 -4.563 4.240 1.00 0.00 C ATOM 795 CD1 LEU A 50 0.274 -5.982 4.491 1.00 0.00 C ATOM 796 CD2 LEU A 50 -0.792 -4.441 2.839 1.00 0.00 C ATOM 0 H LEU A 50 -2.253 -5.541 7.365 1.00 0.00 H new ATOM 0 HA LEU A 50 0.293 -4.162 6.757 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -2.133 -4.770 5.176 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.571 -3.114 5.052 1.00 0.00 H new ATOM 0 HG LEU A 50 0.643 -3.897 4.330 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.009 -6.253 3.733 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.732 -6.040 5.478 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.569 -6.671 4.441 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -0.044 -4.750 2.109 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.671 -5.080 2.750 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.076 -3.406 2.651 1.00 0.00 H new ATOM 808 N THR A 51 -0.438 -2.312 8.201 1.00 0.00 N ATOM 809 CA THR A 51 -0.767 -1.068 8.853 1.00 0.00 C ATOM 810 C THR A 51 -0.036 0.060 8.146 1.00 0.00 C ATOM 811 O THR A 51 1.185 0.108 8.156 1.00 0.00 O ATOM 812 CB THR A 51 -0.367 -1.099 10.339 1.00 0.00 C ATOM 813 OG1 THR A 51 -0.914 -2.266 10.971 1.00 0.00 O ATOM 814 CG2 THR A 51 -0.866 0.144 11.044 1.00 0.00 C ATOM 0 H THR A 51 0.524 -2.620 8.340 1.00 0.00 H new ATOM 0 HA THR A 51 -1.845 -0.913 8.800 1.00 0.00 H new ATOM 0 HB THR A 51 0.721 -1.131 10.406 1.00 0.00 H new ATOM 0 HG1 THR A 51 -0.653 -2.279 11.916 1.00 0.00 H new ATOM 0 HG21 THR A 51 -0.576 0.108 12.094 1.00 0.00 H new ATOM 0 HG22 THR A 51 -0.430 1.027 10.577 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.952 0.193 10.969 1.00 0.00 H new ATOM 822 N ILE A 52 -0.776 0.958 7.523 1.00 0.00 N ATOM 823 CA ILE A 52 -0.164 1.983 6.695 1.00 0.00 C ATOM 824 C ILE A 52 -0.628 3.367 7.125 1.00 0.00 C ATOM 825 O ILE A 52 -1.821 3.660 7.116 1.00 0.00 O ATOM 826 CB ILE A 52 -0.494 1.802 5.189 1.00 0.00 C ATOM 827 CG1 ILE A 52 -0.313 0.352 4.727 1.00 0.00 C ATOM 828 CG2 ILE A 52 0.373 2.717 4.348 1.00 0.00 C ATOM 829 CD1 ILE A 52 -1.551 -0.498 4.910 1.00 0.00 C ATOM 0 H ILE A 52 -1.794 1.000 7.573 1.00 0.00 H new ATOM 0 HA ILE A 52 0.913 1.883 6.830 1.00 0.00 H new ATOM 0 HB ILE A 52 -1.544 2.064 5.057 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -0.031 0.347 3.674 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.512 -0.097 5.280 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.131 2.580 3.294 1.00 0.00 H new ATOM 0 HG22 ILE A 52 0.189 3.754 4.631 1.00 0.00 H new ATOM 0 HG23 ILE A 52 1.423 2.477 4.514 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.351 -1.512 4.562 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -1.822 -0.523 5.965 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.373 -0.072 4.334 1.00 0.00 H new ATOM 841 N THR A 53 0.314 4.211 7.500 1.00 0.00 N ATOM 842 CA THR A 53 -0.002 5.581 7.863 1.00 0.00 C ATOM 843 C THR A 53 0.224 6.490 6.664 1.00 0.00 C ATOM 844 O THR A 53 1.349 6.635 6.203 1.00 0.00 O ATOM 845 CB THR A 53 0.884 6.073 9.024 1.00 0.00 C ATOM 846 OG1 THR A 53 1.033 5.032 10.005 1.00 0.00 O ATOM 847 CG2 THR A 53 0.284 7.308 9.680 1.00 0.00 C ATOM 0 H THR A 53 1.304 3.973 7.562 1.00 0.00 H new ATOM 0 HA THR A 53 -1.045 5.611 8.178 1.00 0.00 H new ATOM 0 HB THR A 53 1.861 6.334 8.618 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.645 4.347 9.665 1.00 0.00 H new ATOM 0 HG21 THR A 53 0.928 7.636 10.496 1.00 0.00 H new ATOM 0 HG22 THR A 53 0.198 8.106 8.943 1.00 0.00 H new ATOM 0 HG23 THR A 53 -0.705 7.068 10.072 1.00 0.00 H new ATOM 855 N TYR A 54 -0.835 7.084 6.143 1.00 0.00 N ATOM 856 CA TYR A 54 -0.693 8.039 5.062 1.00 0.00 C ATOM 857 C TYR A 54 -0.790 9.449 5.610 1.00 0.00 C ATOM 858 O TYR A 54 -1.886 9.972 5.828 1.00 0.00 O ATOM 859 CB TYR A 54 -1.768 7.822 3.994 1.00 0.00 C ATOM 860 CG TYR A 54 -1.477 6.672 3.059 1.00 0.00 C ATOM 861 CD1 TYR A 54 -0.445 6.758 2.138 1.00 0.00 C ATOM 862 CD2 TYR A 54 -2.245 5.518 3.078 1.00 0.00 C ATOM 863 CE1 TYR A 54 -0.180 5.724 1.262 1.00 0.00 C ATOM 864 CE2 TYR A 54 -1.984 4.474 2.210 1.00 0.00 C ATOM 865 CZ TYR A 54 -0.953 4.583 1.303 1.00 0.00 C ATOM 866 OH TYR A 54 -0.696 3.549 0.433 1.00 0.00 O ATOM 0 H TYR A 54 -1.795 6.923 6.449 1.00 0.00 H new ATOM 0 HA TYR A 54 0.283 7.893 4.599 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -2.724 7.645 4.486 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -1.875 8.735 3.409 1.00 0.00 H new ATOM 0 HD1 TYR A 54 0.163 7.650 2.105 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -3.060 5.433 3.782 1.00 0.00 H new ATOM 0 HE1 TYR A 54 0.627 5.808 0.550 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -2.585 3.578 2.243 1.00 0.00 H new ATOM 0 HH TYR A 54 -1.331 2.820 0.595 1.00 0.00 H new ATOM 876 N GLY A 55 0.368 10.056 5.823 1.00 0.00 N ATOM 877 CA GLY A 55 0.421 11.406 6.340 1.00 0.00 C ATOM 878 C GLY A 55 -0.089 11.484 7.765 1.00 0.00 C ATOM 879 O GLY A 55 0.678 11.302 8.713 1.00 0.00 O ATOM 0 H GLY A 55 1.279 9.633 5.645 1.00 0.00 H new ATOM 0 HA2 GLY A 55 1.448 11.770 6.301 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -0.174 12.062 5.705 1.00 0.00 H new ATOM 883 N SER A 56 -1.380 11.739 7.918 1.00 0.00 N ATOM 884 CA SER A 56 -1.984 11.852 9.234 1.00 0.00 C ATOM 885 C SER A 56 -3.000 10.737 9.512 1.00 0.00 C ATOM 886 O SER A 56 -3.313 10.456 10.670 1.00 0.00 O ATOM 887 CB SER A 56 -2.641 13.224 9.370 1.00 0.00 C ATOM 888 OG SER A 56 -3.389 13.548 8.206 1.00 0.00 O ATOM 0 H SER A 56 -2.030 11.872 7.143 1.00 0.00 H new ATOM 0 HA SER A 56 -1.194 11.743 9.977 1.00 0.00 H new ATOM 0 HB2 SER A 56 -3.296 13.233 10.241 1.00 0.00 H new ATOM 0 HB3 SER A 56 -1.876 13.982 9.538 1.00 0.00 H new ATOM 0 HG SER A 56 -3.802 14.430 8.317 1.00 0.00 H new ATOM 894 N LYS A 57 -3.521 10.105 8.462 1.00 0.00 N ATOM 895 CA LYS A 57 -4.505 9.041 8.640 1.00 0.00 C ATOM 896 C LYS A 57 -3.843 7.676 8.546 1.00 0.00 C ATOM 897 O LYS A 57 -2.792 7.523 7.929 1.00 0.00 O ATOM 898 CB LYS A 57 -5.625 9.127 7.616 1.00 0.00 C ATOM 899 CG LYS A 57 -6.236 10.510 7.499 1.00 0.00 C ATOM 900 CD LYS A 57 -7.736 10.446 7.436 1.00 0.00 C ATOM 901 CE LYS A 57 -8.184 9.921 6.097 1.00 0.00 C ATOM 902 NZ LYS A 57 -9.656 10.022 5.906 1.00 0.00 N ATOM 0 H LYS A 57 -3.282 10.308 7.491 1.00 0.00 H new ATOM 0 HA LYS A 57 -4.936 9.172 9.632 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -5.239 8.826 6.642 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -6.406 8.415 7.884 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -5.932 11.116 8.352 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -5.854 11.003 6.605 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -8.112 9.802 8.231 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -8.156 11.438 7.604 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -7.680 10.476 5.306 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -7.879 8.879 5.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -10.021 9.121 5.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -10.111 10.232 6.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -9.867 10.784 5.230 1.00 0.00 H new ATOM 916 N VAL A 58 -4.477 6.693 9.146 1.00 0.00 N ATOM 917 CA VAL A 58 -3.930 5.344 9.206 1.00 0.00 C ATOM 918 C VAL A 58 -4.907 4.321 8.640 1.00 0.00 C ATOM 919 O VAL A 58 -6.067 4.259 9.048 1.00 0.00 O ATOM 920 CB VAL A 58 -3.572 4.944 10.650 1.00 0.00 C ATOM 921 CG1 VAL A 58 -2.728 3.684 10.666 1.00 0.00 C ATOM 922 CG2 VAL A 58 -2.866 6.088 11.353 1.00 0.00 C ATOM 0 H VAL A 58 -5.381 6.799 9.605 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.024 5.350 8.600 1.00 0.00 H new ATOM 0 HB VAL A 58 -4.494 4.730 11.191 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -2.487 3.420 11.696 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.283 2.868 10.203 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -1.806 3.857 10.111 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -2.619 5.792 12.372 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -1.951 6.336 10.815 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -3.520 6.959 11.377 1.00 0.00 H new ATOM 932 N ILE A 59 -4.426 3.528 7.699 1.00 0.00 N ATOM 933 CA ILE A 59 -5.207 2.447 7.126 1.00 0.00 C ATOM 934 C ILE A 59 -4.699 1.108 7.651 1.00 0.00 C ATOM 935 O ILE A 59 -3.518 0.785 7.517 1.00 0.00 O ATOM 936 CB ILE A 59 -5.136 2.453 5.585 1.00 0.00 C ATOM 937 CG1 ILE A 59 -5.572 3.805 5.037 1.00 0.00 C ATOM 938 CG2 ILE A 59 -6.023 1.376 5.020 1.00 0.00 C ATOM 939 CD1 ILE A 59 -5.420 3.932 3.537 1.00 0.00 C ATOM 0 H ILE A 59 -3.486 3.615 7.312 1.00 0.00 H new ATOM 0 HA ILE A 59 -6.246 2.593 7.421 1.00 0.00 H new ATOM 0 HB ILE A 59 -4.104 2.264 5.290 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -6.615 3.975 5.303 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -4.988 4.588 5.520 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -5.964 1.390 3.932 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -5.695 0.404 5.388 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.053 1.553 5.330 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -5.750 4.921 3.220 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -4.374 3.794 3.264 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -6.026 3.172 3.044 1.00 0.00 H new ATOM 951 N HIS A 60 -5.584 0.340 8.258 1.00 0.00 N ATOM 952 CA HIS A 60 -5.209 -0.939 8.848 1.00 0.00 C ATOM 953 C HIS A 60 -5.989 -2.060 8.175 1.00 0.00 C ATOM 954 O HIS A 60 -7.219 -2.087 8.232 1.00 0.00 O ATOM 955 CB HIS A 60 -5.489 -0.908 10.361 1.00 0.00 C ATOM 956 CG HIS A 60 -5.060 -2.132 11.134 1.00 0.00 C ATOM 957 ND1 HIS A 60 -5.033 -2.157 12.509 1.00 0.00 N ATOM 958 CD2 HIS A 60 -4.680 -3.372 10.735 1.00 0.00 C ATOM 959 CE1 HIS A 60 -4.662 -3.355 12.922 1.00 0.00 C ATOM 960 NE2 HIS A 60 -4.443 -4.118 11.866 1.00 0.00 N ATOM 0 H HIS A 60 -6.571 0.577 8.358 1.00 0.00 H new ATOM 0 HA HIS A 60 -4.145 -1.119 8.696 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -4.988 -0.039 10.786 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -6.559 -0.764 10.510 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -4.582 -3.712 9.715 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -4.555 -3.661 13.952 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -4.148 -5.094 11.886 1.00 0.00 H new ATOM 969 N ASN A 61 -5.277 -2.991 7.550 1.00 0.00 N ATOM 970 CA ASN A 61 -5.916 -4.118 6.891 1.00 0.00 C ATOM 971 C ASN A 61 -5.096 -5.368 7.093 1.00 0.00 C ATOM 972 O ASN A 61 -3.873 -5.335 7.015 1.00 0.00 O ATOM 973 CB ASN A 61 -6.093 -3.868 5.390 1.00 0.00 C ATOM 974 CG ASN A 61 -7.239 -2.929 5.079 1.00 0.00 C ATOM 975 OD1 ASN A 61 -8.390 -3.354 4.987 1.00 0.00 O ATOM 976 ND2 ASN A 61 -6.936 -1.656 4.894 1.00 0.00 N ATOM 0 H ASN A 61 -4.259 -2.986 7.487 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.903 -4.243 7.337 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -5.170 -3.453 4.985 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -6.263 -4.819 4.886 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -7.670 -0.985 4.666 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -5.969 -1.344 4.980 1.00 0.00 H new ATOM 983 N GLU A 62 -5.765 -6.457 7.377 1.00 0.00 N ATOM 984 CA GLU A 62 -5.111 -7.736 7.486 1.00 0.00 C ATOM 985 C GLU A 62 -5.760 -8.701 6.515 1.00 0.00 C ATOM 986 O GLU A 62 -6.961 -8.969 6.598 1.00 0.00 O ATOM 987 CB GLU A 62 -5.182 -8.239 8.921 1.00 0.00 C ATOM 988 CG GLU A 62 -4.402 -7.357 9.879 1.00 0.00 C ATOM 989 CD GLU A 62 -4.660 -7.675 11.331 1.00 0.00 C ATOM 990 OE1 GLU A 62 -4.462 -8.838 11.740 1.00 0.00 O ATOM 991 OE2 GLU A 62 -5.056 -6.751 12.071 1.00 0.00 O ATOM 0 H GLU A 62 -6.772 -6.482 7.538 1.00 0.00 H new ATOM 0 HA GLU A 62 -4.056 -7.646 7.229 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.224 -8.283 9.237 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.792 -9.256 8.967 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.337 -7.465 9.675 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.659 -6.314 9.692 1.00 0.00 H new ATOM 998 N PHE A 63 -4.967 -9.220 5.598 1.00 0.00 N ATOM 999 CA PHE A 63 -5.506 -9.967 4.477 1.00 0.00 C ATOM 1000 C PHE A 63 -4.911 -11.348 4.412 1.00 0.00 C ATOM 1001 O PHE A 63 -3.749 -11.549 4.742 1.00 0.00 O ATOM 1002 CB PHE A 63 -5.321 -9.223 3.134 1.00 0.00 C ATOM 1003 CG PHE A 63 -3.912 -8.842 2.716 1.00 0.00 C ATOM 1004 CD1 PHE A 63 -2.811 -9.142 3.488 1.00 0.00 C ATOM 1005 CD2 PHE A 63 -3.708 -8.153 1.529 1.00 0.00 C ATOM 1006 CE1 PHE A 63 -1.539 -8.766 3.094 1.00 0.00 C ATOM 1007 CE2 PHE A 63 -2.444 -7.782 1.127 1.00 0.00 C ATOM 1008 CZ PHE A 63 -1.358 -8.086 1.912 1.00 0.00 C ATOM 0 H PHE A 63 -3.950 -9.139 5.606 1.00 0.00 H new ATOM 0 HA PHE A 63 -6.579 -10.062 4.645 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -5.746 -9.846 2.347 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.915 -8.310 3.174 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.943 -9.679 4.416 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -4.556 -7.903 0.909 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.688 -9.006 3.714 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -2.307 -7.253 0.196 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.366 -7.792 1.602 1.00 0.00 H new ATOM 1018 N THR A 64 -5.710 -12.292 3.973 1.00 0.00 N ATOM 1019 CA THR A 64 -5.301 -13.670 3.945 1.00 0.00 C ATOM 1020 C THR A 64 -4.830 -14.030 2.546 1.00 0.00 C ATOM 1021 O THR A 64 -5.543 -13.831 1.564 1.00 0.00 O ATOM 1022 CB THR A 64 -6.460 -14.591 4.332 1.00 0.00 C ATOM 1023 OG1 THR A 64 -7.143 -14.085 5.489 1.00 0.00 O ATOM 1024 CG2 THR A 64 -5.966 -15.992 4.613 1.00 0.00 C ATOM 0 H THR A 64 -6.655 -12.125 3.628 1.00 0.00 H new ATOM 0 HA THR A 64 -4.491 -13.802 4.662 1.00 0.00 H new ATOM 0 HB THR A 64 -7.153 -14.623 3.491 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.907 -14.663 5.697 1.00 0.00 H new ATOM 0 HG21 THR A 64 -6.809 -16.627 4.886 1.00 0.00 H new ATOM 0 HG22 THR A 64 -5.483 -16.393 3.722 1.00 0.00 H new ATOM 0 HG23 THR A 64 -5.250 -15.967 5.434 1.00 0.00 H new ATOM 1032 N LEU A 65 -3.625 -14.545 2.467 1.00 0.00 N ATOM 1033 CA LEU A 65 -3.027 -14.920 1.211 1.00 0.00 C ATOM 1034 C LEU A 65 -3.837 -16.007 0.500 1.00 0.00 C ATOM 1035 O LEU A 65 -3.994 -17.111 1.015 1.00 0.00 O ATOM 1036 CB LEU A 65 -1.640 -15.442 1.488 1.00 0.00 C ATOM 1037 CG LEU A 65 -0.509 -14.439 1.312 1.00 0.00 C ATOM 1038 CD1 LEU A 65 0.338 -14.897 0.177 1.00 0.00 C ATOM 1039 CD2 LEU A 65 -1.041 -13.048 1.023 1.00 0.00 C ATOM 0 H LEU A 65 -3.030 -14.716 3.278 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.000 -14.045 0.561 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.611 -15.818 2.511 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.453 -16.291 0.830 1.00 0.00 H new ATOM 0 HG LEU A 65 0.069 -14.384 2.234 1.00 0.00 H new ATOM 0 HD11 LEU A 65 1.158 -14.195 0.029 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.742 -15.885 0.400 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -0.265 -14.948 -0.730 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -0.207 -12.357 0.903 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.631 -13.067 0.107 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.668 -12.719 1.851 1.00 0.00 H new ATOM 1051 N GLY A 66 -4.358 -15.688 -0.671 1.00 0.00 N ATOM 1052 CA GLY A 66 -5.097 -16.659 -1.458 1.00 0.00 C ATOM 1053 C GLY A 66 -6.508 -16.829 -0.965 1.00 0.00 C ATOM 1054 O GLY A 66 -7.262 -17.661 -1.472 1.00 0.00 O ATOM 0 H GLY A 66 -4.283 -14.765 -1.098 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -5.113 -16.343 -2.501 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.583 -17.620 -1.424 1.00 0.00 H new ATOM 1058 N GLU A 67 -6.861 -16.045 0.029 1.00 0.00 N ATOM 1059 CA GLU A 67 -8.149 -16.157 0.656 1.00 0.00 C ATOM 1060 C GLU A 67 -8.844 -14.800 0.648 1.00 0.00 C ATOM 1061 O GLU A 67 -8.192 -13.765 0.743 1.00 0.00 O ATOM 1062 CB GLU A 67 -8.005 -16.706 2.079 1.00 0.00 C ATOM 1063 CG GLU A 67 -9.317 -16.798 2.830 1.00 0.00 C ATOM 1064 CD GLU A 67 -9.178 -17.404 4.209 1.00 0.00 C ATOM 1065 OE1 GLU A 67 -8.961 -18.628 4.313 1.00 0.00 O ATOM 1066 OE2 GLU A 67 -9.306 -16.659 5.197 1.00 0.00 O ATOM 0 H GLU A 67 -6.263 -15.317 0.420 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.765 -16.859 0.095 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.552 -17.696 2.033 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.320 -16.068 2.638 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.746 -15.800 2.921 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -10.019 -17.395 2.248 1.00 0.00 H new ATOM 1073 N GLU A 68 -10.159 -14.805 0.498 1.00 0.00 N ATOM 1074 CA GLU A 68 -10.910 -13.569 0.376 1.00 0.00 C ATOM 1075 C GLU A 68 -10.940 -12.810 1.702 1.00 0.00 C ATOM 1076 O GLU A 68 -11.364 -13.334 2.735 1.00 0.00 O ATOM 1077 CB GLU A 68 -12.322 -13.859 -0.102 1.00 0.00 C ATOM 1078 CG GLU A 68 -13.029 -12.632 -0.623 1.00 0.00 C ATOM 1079 CD GLU A 68 -14.336 -12.960 -1.307 1.00 0.00 C ATOM 1080 OE1 GLU A 68 -15.321 -13.282 -0.607 1.00 0.00 O ATOM 1081 OE2 GLU A 68 -14.387 -12.893 -2.555 1.00 0.00 O ATOM 0 H GLU A 68 -10.727 -15.651 0.458 1.00 0.00 H new ATOM 0 HA GLU A 68 -10.411 -12.938 -0.360 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -12.286 -14.613 -0.888 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -12.899 -14.283 0.720 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -13.218 -11.948 0.204 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.377 -12.112 -1.325 1.00 0.00 H new ATOM 1088 N CYS A 69 -10.467 -11.577 1.648 1.00 0.00 N ATOM 1089 CA CYS A 69 -10.352 -10.706 2.801 1.00 0.00 C ATOM 1090 C CYS A 69 -10.893 -9.341 2.454 1.00 0.00 C ATOM 1091 O CYS A 69 -10.846 -8.934 1.304 1.00 0.00 O ATOM 1092 CB CYS A 69 -8.891 -10.584 3.195 1.00 0.00 C ATOM 1093 SG CYS A 69 -7.769 -10.696 1.781 1.00 0.00 S ATOM 0 H CYS A 69 -10.146 -11.146 0.781 1.00 0.00 H new ATOM 0 HA CYS A 69 -10.921 -11.123 3.632 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -8.735 -9.632 3.702 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -8.646 -11.369 3.910 1.00 0.00 H new ATOM 0 HG CYS A 69 -7.838 -11.888 1.266 1.00 0.00 H new ATOM 1099 N GLU A 70 -11.377 -8.616 3.430 1.00 0.00 N ATOM 1100 CA GLU A 70 -11.983 -7.343 3.148 1.00 0.00 C ATOM 1101 C GLU A 70 -10.964 -6.217 3.248 1.00 0.00 C ATOM 1102 O GLU A 70 -10.257 -6.087 4.248 1.00 0.00 O ATOM 1103 CB GLU A 70 -13.151 -7.083 4.082 1.00 0.00 C ATOM 1104 CG GLU A 70 -14.368 -7.913 3.776 1.00 0.00 C ATOM 1105 CD GLU A 70 -14.480 -9.144 4.656 1.00 0.00 C ATOM 1106 OE1 GLU A 70 -14.479 -8.998 5.894 1.00 0.00 O ATOM 1107 OE2 GLU A 70 -14.585 -10.261 4.111 1.00 0.00 O ATOM 0 H GLU A 70 -11.364 -8.882 4.415 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.358 -7.373 2.125 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.836 -7.280 5.107 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.419 -6.028 4.029 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -15.261 -7.300 3.902 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -14.338 -8.221 2.731 1.00 0.00 H new ATOM 1114 N LEU A 71 -10.899 -5.415 2.198 1.00 0.00 N ATOM 1115 CA LEU A 71 -9.962 -4.316 2.113 1.00 0.00 C ATOM 1116 C LEU A 71 -10.677 -2.994 2.347 1.00 0.00 C ATOM 1117 O LEU A 71 -11.617 -2.658 1.635 1.00 0.00 O ATOM 1118 CB LEU A 71 -9.342 -4.307 0.730 1.00 0.00 C ATOM 1119 CG LEU A 71 -7.813 -4.269 0.681 1.00 0.00 C ATOM 1120 CD1 LEU A 71 -7.290 -3.012 1.352 1.00 0.00 C ATOM 1121 CD2 LEU A 71 -7.225 -5.511 1.338 1.00 0.00 C ATOM 0 H LEU A 71 -11.499 -5.512 1.379 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.192 -4.441 2.874 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.681 -5.195 0.196 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.725 -3.443 0.187 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.503 -4.255 -0.364 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.201 -3.002 1.308 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.682 -2.135 0.837 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.611 -2.995 2.394 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.137 -5.466 1.293 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.544 -5.557 2.379 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.573 -6.400 0.812 1.00 0.00 H new ATOM 1133 N GLU A 72 -10.210 -2.253 3.327 1.00 0.00 N ATOM 1134 CA GLU A 72 -10.830 -0.993 3.715 1.00 0.00 C ATOM 1135 C GLU A 72 -9.926 0.179 3.353 1.00 0.00 C ATOM 1136 O GLU A 72 -8.743 0.191 3.700 1.00 0.00 O ATOM 1137 CB GLU A 72 -11.102 -0.989 5.220 1.00 0.00 C ATOM 1138 CG GLU A 72 -11.775 0.278 5.721 1.00 0.00 C ATOM 1139 CD GLU A 72 -11.975 0.260 7.219 1.00 0.00 C ATOM 1140 OE1 GLU A 72 -13.013 -0.252 7.677 1.00 0.00 O ATOM 1141 OE2 GLU A 72 -11.086 0.747 7.953 1.00 0.00 O ATOM 0 H GLU A 72 -9.390 -2.501 3.881 1.00 0.00 H new ATOM 0 HA GLU A 72 -11.772 -0.889 3.177 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -11.730 -1.845 5.468 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -10.159 -1.122 5.750 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -11.170 1.142 5.447 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.740 0.395 5.228 1.00 0.00 H new ATOM 1148 N THR A 73 -10.478 1.153 2.653 1.00 0.00 N ATOM 1149 CA THR A 73 -9.745 2.349 2.297 1.00 0.00 C ATOM 1150 C THR A 73 -9.878 3.424 3.372 1.00 0.00 C ATOM 1151 O THR A 73 -10.738 3.343 4.247 1.00 0.00 O ATOM 1152 CB THR A 73 -10.258 2.903 0.951 1.00 0.00 C ATOM 1153 OG1 THR A 73 -11.686 3.056 0.991 1.00 0.00 O ATOM 1154 CG2 THR A 73 -9.888 1.963 -0.175 1.00 0.00 C ATOM 0 H THR A 73 -11.441 1.136 2.318 1.00 0.00 H new ATOM 0 HA THR A 73 -8.693 2.080 2.208 1.00 0.00 H new ATOM 0 HB THR A 73 -9.795 3.874 0.778 1.00 0.00 H new ATOM 0 HG1 THR A 73 -11.910 3.969 1.268 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.255 2.364 -1.120 1.00 0.00 H new ATOM 0 HG22 THR A 73 -8.804 1.860 -0.222 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.338 0.986 0.004 1.00 0.00 H new ATOM 1162 N MET A 74 -9.020 4.441 3.278 1.00 0.00 N ATOM 1163 CA MET A 74 -9.017 5.575 4.210 1.00 0.00 C ATOM 1164 C MET A 74 -10.303 6.389 4.099 1.00 0.00 C ATOM 1165 O MET A 74 -10.496 7.369 4.817 1.00 0.00 O ATOM 1166 CB MET A 74 -7.805 6.475 3.935 1.00 0.00 C ATOM 1167 CG MET A 74 -7.785 7.067 2.531 1.00 0.00 C ATOM 1168 SD MET A 74 -6.190 7.791 2.093 1.00 0.00 S ATOM 1169 CE MET A 74 -6.065 9.121 3.285 1.00 0.00 C ATOM 0 H MET A 74 -8.305 4.504 2.553 1.00 0.00 H new ATOM 0 HA MET A 74 -8.954 5.178 5.223 1.00 0.00 H new ATOM 0 HB2 MET A 74 -7.795 7.287 4.662 1.00 0.00 H new ATOM 0 HB3 MET A 74 -6.893 5.898 4.089 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.034 6.288 1.811 1.00 0.00 H new ATOM 0 HG3 MET A 74 -8.558 7.831 2.454 1.00 0.00 H new ATOM 0 HE1 MET A 74 -5.182 9.722 3.068 1.00 0.00 H new ATOM 0 HE2 MET A 74 -6.955 9.748 3.225 1.00 0.00 H new ATOM 0 HE3 MET A 74 -5.982 8.704 4.288 1.00 0.00 H new ATOM 1179 N THR A 75 -11.165 5.977 3.184 1.00 0.00 N ATOM 1180 CA THR A 75 -12.410 6.664 2.929 1.00 0.00 C ATOM 1181 C THR A 75 -13.525 5.988 3.720 1.00 0.00 C ATOM 1182 O THR A 75 -14.562 6.587 4.012 1.00 0.00 O ATOM 1183 CB THR A 75 -12.744 6.631 1.427 1.00 0.00 C ATOM 1184 OG1 THR A 75 -13.063 5.292 1.027 1.00 0.00 O ATOM 1185 CG2 THR A 75 -11.569 7.125 0.599 1.00 0.00 C ATOM 0 H THR A 75 -11.016 5.155 2.599 1.00 0.00 H new ATOM 0 HA THR A 75 -12.314 7.704 3.240 1.00 0.00 H new ATOM 0 HB THR A 75 -13.599 7.286 1.258 1.00 0.00 H new ATOM 0 HG1 THR A 75 -13.923 5.287 0.556 1.00 0.00 H new ATOM 0 HG21 THR A 75 -11.830 7.092 -0.459 1.00 0.00 H new ATOM 0 HG22 THR A 75 -11.330 8.150 0.882 1.00 0.00 H new ATOM 0 HG23 THR A 75 -10.703 6.488 0.779 1.00 0.00 H new ATOM 1193 N GLY A 76 -13.284 4.730 4.071 1.00 0.00 N ATOM 1194 CA GLY A 76 -14.226 3.977 4.864 1.00 0.00 C ATOM 1195 C GLY A 76 -14.789 2.774 4.133 1.00 0.00 C ATOM 1196 O GLY A 76 -15.339 1.869 4.758 1.00 0.00 O ATOM 0 H GLY A 76 -12.441 4.217 3.815 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -13.737 3.643 5.779 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -15.046 4.631 5.162 1.00 0.00 H new ATOM 1200 N GLU A 77 -14.662 2.754 2.812 1.00 0.00 N ATOM 1201 CA GLU A 77 -15.198 1.649 2.029 1.00 0.00 C ATOM 1202 C GLU A 77 -14.306 0.449 2.065 1.00 0.00 C ATOM 1203 O GLU A 77 -13.132 0.493 1.690 1.00 0.00 O ATOM 1204 CB GLU A 77 -15.466 2.033 0.590 1.00 0.00 C ATOM 1205 CG GLU A 77 -16.650 2.947 0.432 1.00 0.00 C ATOM 1206 CD GLU A 77 -16.277 4.404 0.592 1.00 0.00 C ATOM 1207 OE1 GLU A 77 -15.351 4.860 -0.117 1.00 0.00 O ATOM 1208 OE2 GLU A 77 -16.886 5.094 1.431 1.00 0.00 O ATOM 0 H GLU A 77 -14.199 3.481 2.266 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.148 1.395 2.499 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -14.581 2.520 0.180 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -15.632 1.129 0.004 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -17.095 2.794 -0.551 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -17.409 2.686 1.170 1.00 0.00 H new ATOM 1215 N LYS A 78 -14.893 -0.609 2.540 1.00 0.00 N ATOM 1216 CA LYS A 78 -14.240 -1.884 2.617 1.00 0.00 C ATOM 1217 C LYS A 78 -14.882 -2.874 1.652 1.00 0.00 C ATOM 1218 O LYS A 78 -16.107 -2.965 1.563 1.00 0.00 O ATOM 1219 CB LYS A 78 -14.330 -2.395 4.032 1.00 0.00 C ATOM 1220 CG LYS A 78 -13.654 -3.732 4.225 1.00 0.00 C ATOM 1221 CD LYS A 78 -13.937 -4.309 5.598 1.00 0.00 C ATOM 1222 CE LYS A 78 -13.505 -3.356 6.697 1.00 0.00 C ATOM 1223 NZ LYS A 78 -14.087 -3.713 8.015 1.00 0.00 N ATOM 0 H LYS A 78 -15.851 -0.612 2.890 1.00 0.00 H new ATOM 0 HA LYS A 78 -13.193 -1.772 2.335 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -13.878 -1.666 4.704 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -15.379 -2.481 4.314 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -13.998 -4.428 3.460 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.578 -3.619 4.092 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -15.002 -4.519 5.694 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -13.414 -5.258 5.711 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -12.417 -3.359 6.770 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -13.804 -2.342 6.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -13.763 -3.034 8.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -15.125 -3.685 7.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -13.781 -4.671 8.282 1.00 0.00 H new ATOM 1237 N VAL A 79 -14.058 -3.611 0.936 1.00 0.00 N ATOM 1238 CA VAL A 79 -14.543 -4.614 0.008 1.00 0.00 C ATOM 1239 C VAL A 79 -13.784 -5.930 0.174 1.00 0.00 C ATOM 1240 O VAL A 79 -12.557 -5.963 0.104 1.00 0.00 O ATOM 1241 CB VAL A 79 -14.441 -4.118 -1.447 1.00 0.00 C ATOM 1242 CG1 VAL A 79 -13.028 -3.713 -1.797 1.00 0.00 C ATOM 1243 CG2 VAL A 79 -14.938 -5.180 -2.387 1.00 0.00 C ATOM 0 H VAL A 79 -13.042 -3.534 0.979 1.00 0.00 H new ATOM 0 HA VAL A 79 -15.594 -4.793 0.237 1.00 0.00 H new ATOM 0 HB VAL A 79 -15.068 -3.232 -1.549 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -12.994 -3.369 -2.831 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -12.706 -2.909 -1.136 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -12.364 -4.569 -1.678 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -14.863 -4.822 -3.414 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -14.334 -6.080 -2.272 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -15.979 -5.410 -2.159 1.00 0.00 H new ATOM 1253 N LYS A 80 -14.521 -7.005 0.448 1.00 0.00 N ATOM 1254 CA LYS A 80 -13.934 -8.341 0.474 1.00 0.00 C ATOM 1255 C LYS A 80 -13.409 -8.741 -0.905 1.00 0.00 C ATOM 1256 O LYS A 80 -14.151 -8.847 -1.884 1.00 0.00 O ATOM 1257 CB LYS A 80 -14.952 -9.367 0.977 1.00 0.00 C ATOM 1258 CG LYS A 80 -16.175 -9.480 0.111 1.00 0.00 C ATOM 1259 CD LYS A 80 -17.413 -9.821 0.922 1.00 0.00 C ATOM 1260 CE LYS A 80 -17.863 -8.649 1.783 1.00 0.00 C ATOM 1261 NZ LYS A 80 -19.057 -8.983 2.607 1.00 0.00 N ATOM 0 H LYS A 80 -15.520 -6.977 0.654 1.00 0.00 H new ATOM 0 HA LYS A 80 -13.090 -8.322 1.163 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -14.470 -10.343 1.039 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -15.257 -9.097 1.988 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -16.334 -8.540 -0.417 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -16.014 -10.247 -0.646 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -18.221 -10.109 0.249 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -17.206 -10.681 1.558 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -17.045 -8.346 2.437 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -18.092 -7.797 1.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -19.328 -8.156 3.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -19.846 -9.247 1.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -18.832 -9.779 3.237 1.00 0.00 H new ATOM 1275 N ALA A 81 -12.110 -8.931 -0.951 1.00 0.00 N ATOM 1276 CA ALA A 81 -11.404 -9.315 -2.170 1.00 0.00 C ATOM 1277 C ALA A 81 -10.261 -10.285 -1.862 1.00 0.00 C ATOM 1278 O ALA A 81 -9.811 -10.393 -0.721 1.00 0.00 O ATOM 1279 CB ALA A 81 -10.868 -8.088 -2.881 1.00 0.00 C ATOM 0 H ALA A 81 -11.501 -8.824 -0.140 1.00 0.00 H new ATOM 0 HA ALA A 81 -12.115 -9.820 -2.824 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -10.345 -8.392 -3.787 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -11.696 -7.429 -3.144 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -10.178 -7.559 -2.224 1.00 0.00 H new ATOM 1285 N VAL A 82 -9.792 -10.989 -2.878 1.00 0.00 N ATOM 1286 CA VAL A 82 -8.768 -12.012 -2.693 1.00 0.00 C ATOM 1287 C VAL A 82 -7.383 -11.495 -3.085 1.00 0.00 C ATOM 1288 O VAL A 82 -7.188 -10.991 -4.192 1.00 0.00 O ATOM 1289 CB VAL A 82 -9.088 -13.272 -3.517 1.00 0.00 C ATOM 1290 CG1 VAL A 82 -8.049 -14.345 -3.282 1.00 0.00 C ATOM 1291 CG2 VAL A 82 -10.431 -13.815 -3.119 1.00 0.00 C ATOM 0 H VAL A 82 -10.103 -10.873 -3.843 1.00 0.00 H new ATOM 0 HA VAL A 82 -8.763 -12.266 -1.633 1.00 0.00 H new ATOM 0 HB VAL A 82 -9.089 -12.994 -4.571 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.295 -15.226 -3.874 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -7.068 -13.972 -3.577 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -8.033 -14.611 -2.225 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -10.651 -14.707 -3.706 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -10.420 -14.071 -2.060 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -11.197 -13.061 -3.302 1.00 0.00 H new ATOM 1301 N VAL A 83 -6.438 -11.600 -2.158 1.00 0.00 N ATOM 1302 CA VAL A 83 -5.057 -11.204 -2.406 1.00 0.00 C ATOM 1303 C VAL A 83 -4.131 -12.420 -2.396 1.00 0.00 C ATOM 1304 O VAL A 83 -4.152 -13.213 -1.461 1.00 0.00 O ATOM 1305 CB VAL A 83 -4.571 -10.195 -1.352 1.00 0.00 C ATOM 1306 CG1 VAL A 83 -4.563 -10.827 0.017 1.00 0.00 C ATOM 1307 CG2 VAL A 83 -3.201 -9.656 -1.714 1.00 0.00 C ATOM 0 H VAL A 83 -6.606 -11.960 -1.218 1.00 0.00 H new ATOM 0 HA VAL A 83 -5.028 -10.735 -3.389 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.264 -9.354 -1.333 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.217 -10.100 0.751 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.572 -11.150 0.274 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -3.895 -11.688 0.016 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -2.878 -8.944 -0.954 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -2.488 -10.479 -1.767 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -3.251 -9.156 -2.682 1.00 0.00 H new ATOM 1317 N LYS A 84 -3.356 -12.605 -3.446 1.00 0.00 N ATOM 1318 CA LYS A 84 -2.326 -13.627 -3.420 1.00 0.00 C ATOM 1319 C LYS A 84 -1.095 -13.189 -4.194 1.00 0.00 C ATOM 1320 O LYS A 84 -1.126 -12.193 -4.915 1.00 0.00 O ATOM 1321 CB LYS A 84 -2.787 -15.004 -3.861 1.00 0.00 C ATOM 1322 CG LYS A 84 -1.745 -16.011 -3.469 1.00 0.00 C ATOM 1323 CD LYS A 84 -2.213 -17.435 -3.433 1.00 0.00 C ATOM 1324 CE LYS A 84 -2.743 -17.915 -4.772 1.00 0.00 C ATOM 1325 NZ LYS A 84 -3.049 -19.370 -4.739 1.00 0.00 N ATOM 0 H LYS A 84 -3.416 -12.072 -4.314 1.00 0.00 H new ATOM 0 HA LYS A 84 -2.065 -13.737 -2.367 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -3.742 -15.249 -3.397 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -2.943 -15.022 -4.940 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -0.911 -15.937 -4.167 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -1.360 -15.747 -2.484 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -1.388 -18.076 -3.123 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -2.995 -17.537 -2.681 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -3.643 -17.357 -5.031 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -2.008 -17.713 -5.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -3.409 -19.670 -5.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -2.184 -19.902 -4.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -3.768 -19.557 -4.012 1.00 0.00 H new ATOM 1339 N MET A 85 -0.009 -13.938 -4.034 1.00 0.00 N ATOM 1340 CA MET A 85 1.301 -13.470 -4.442 1.00 0.00 C ATOM 1341 C MET A 85 1.479 -13.723 -5.917 1.00 0.00 C ATOM 1342 O MET A 85 1.180 -14.808 -6.415 1.00 0.00 O ATOM 1343 CB MET A 85 2.431 -14.174 -3.662 1.00 0.00 C ATOM 1344 CG MET A 85 2.022 -14.771 -2.335 1.00 0.00 C ATOM 1345 SD MET A 85 2.951 -16.258 -1.913 1.00 0.00 S ATOM 1346 CE MET A 85 4.631 -15.630 -1.914 1.00 0.00 C ATOM 0 H MET A 85 -0.015 -14.872 -3.624 1.00 0.00 H new ATOM 0 HA MET A 85 1.361 -12.403 -4.226 1.00 0.00 H new ATOM 0 HB2 MET A 85 2.843 -14.966 -4.287 1.00 0.00 H new ATOM 0 HB3 MET A 85 3.232 -13.456 -3.488 1.00 0.00 H new ATOM 0 HG2 MET A 85 2.162 -14.027 -1.550 1.00 0.00 H new ATOM 0 HG3 MET A 85 0.959 -15.009 -2.363 1.00 0.00 H new ATOM 0 HE1 MET A 85 5.308 -16.402 -1.549 1.00 0.00 H new ATOM 0 HE2 MET A 85 4.914 -15.349 -2.928 1.00 0.00 H new ATOM 0 HE3 MET A 85 4.693 -14.757 -1.265 1.00 0.00 H new ATOM 1356 N GLU A 86 1.964 -12.719 -6.609 1.00 0.00 N ATOM 1357 CA GLU A 86 2.171 -12.813 -8.028 1.00 0.00 C ATOM 1358 C GLU A 86 3.598 -13.236 -8.262 1.00 0.00 C ATOM 1359 O GLU A 86 4.473 -12.900 -7.463 1.00 0.00 O ATOM 1360 CB GLU A 86 1.877 -11.484 -8.696 1.00 0.00 C ATOM 1361 CG GLU A 86 1.634 -11.629 -10.180 1.00 0.00 C ATOM 1362 CD GLU A 86 1.229 -10.336 -10.844 1.00 0.00 C ATOM 1363 OE1 GLU A 86 2.116 -9.519 -11.156 1.00 0.00 O ATOM 1364 OE2 GLU A 86 0.016 -10.149 -11.075 1.00 0.00 O ATOM 0 H GLU A 86 2.224 -11.820 -6.203 1.00 0.00 H new ATOM 0 HA GLU A 86 1.494 -13.548 -8.463 1.00 0.00 H new ATOM 0 HB2 GLU A 86 1.002 -11.031 -8.229 1.00 0.00 H new ATOM 0 HB3 GLU A 86 2.713 -10.805 -8.532 1.00 0.00 H new ATOM 0 HG2 GLU A 86 2.540 -12.006 -10.655 1.00 0.00 H new ATOM 0 HG3 GLU A 86 0.855 -12.374 -10.343 1.00 0.00 H new ATOM 1371 N GLY A 87 3.809 -14.027 -9.308 1.00 0.00 N ATOM 1372 CA GLY A 87 5.092 -14.678 -9.517 1.00 0.00 C ATOM 1373 C GLY A 87 6.227 -13.727 -9.769 1.00 0.00 C ATOM 1374 O GLY A 87 6.666 -13.517 -10.901 1.00 0.00 O ATOM 0 H GLY A 87 3.109 -14.231 -10.021 1.00 0.00 H new ATOM 0 HA2 GLY A 87 5.327 -15.284 -8.642 1.00 0.00 H new ATOM 0 HA3 GLY A 87 5.008 -15.360 -10.363 1.00 0.00 H new ATOM 1378 N ASP A 88 6.676 -13.166 -8.690 1.00 0.00 N ATOM 1379 CA ASP A 88 7.807 -12.285 -8.659 1.00 0.00 C ATOM 1380 C ASP A 88 8.356 -12.226 -7.244 1.00 0.00 C ATOM 1381 O ASP A 88 9.400 -12.801 -6.951 1.00 0.00 O ATOM 1382 CB ASP A 88 7.403 -10.890 -9.121 1.00 0.00 C ATOM 1383 CG ASP A 88 8.584 -10.079 -9.617 1.00 0.00 C ATOM 1384 OD1 ASP A 88 9.412 -9.653 -8.793 1.00 0.00 O ATOM 1385 OD2 ASP A 88 8.686 -9.864 -10.844 1.00 0.00 O ATOM 0 H ASP A 88 6.252 -13.312 -7.774 1.00 0.00 H new ATOM 0 HA ASP A 88 8.576 -12.662 -9.333 1.00 0.00 H new ATOM 0 HB2 ASP A 88 6.664 -10.974 -9.918 1.00 0.00 H new ATOM 0 HB3 ASP A 88 6.924 -10.362 -8.296 1.00 0.00 H new ATOM 1390 N ASN A 89 7.619 -11.560 -6.358 1.00 0.00 N ATOM 1391 CA ASN A 89 8.124 -11.280 -5.010 1.00 0.00 C ATOM 1392 C ASN A 89 7.029 -11.114 -3.956 1.00 0.00 C ATOM 1393 O ASN A 89 7.242 -11.409 -2.787 1.00 0.00 O ATOM 1394 CB ASN A 89 9.023 -10.048 -5.036 1.00 0.00 C ATOM 1395 CG ASN A 89 10.470 -10.398 -5.348 1.00 0.00 C ATOM 1396 OD1 ASN A 89 10.962 -11.464 -4.973 1.00 0.00 O ATOM 1397 ND2 ASN A 89 11.156 -9.514 -6.047 1.00 0.00 N ATOM 0 H ASN A 89 6.680 -11.206 -6.543 1.00 0.00 H new ATOM 0 HA ASN A 89 8.695 -12.159 -4.711 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.652 -9.346 -5.782 1.00 0.00 H new ATOM 0 HB3 ASN A 89 8.973 -9.544 -4.071 1.00 0.00 H new ATOM 0 HD21 ASN A 89 12.127 -9.702 -6.294 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.715 -8.642 -6.340 1.00 0.00 H new ATOM 1404 N LYS A 90 5.914 -10.529 -4.347 1.00 0.00 N ATOM 1405 CA LYS A 90 4.808 -10.261 -3.434 1.00 0.00 C ATOM 1406 C LYS A 90 3.461 -10.267 -4.147 1.00 0.00 C ATOM 1407 O LYS A 90 3.377 -10.581 -5.334 1.00 0.00 O ATOM 1408 CB LYS A 90 5.003 -9.060 -2.524 1.00 0.00 C ATOM 1409 CG LYS A 90 5.316 -9.460 -1.101 1.00 0.00 C ATOM 1410 CD LYS A 90 5.322 -8.259 -0.173 1.00 0.00 C ATOM 1411 CE LYS A 90 5.925 -8.615 1.172 1.00 0.00 C ATOM 1412 NZ LYS A 90 6.095 -7.426 2.053 1.00 0.00 N ATOM 0 H LYS A 90 5.744 -10.224 -5.305 1.00 0.00 H new ATOM 0 HA LYS A 90 4.804 -11.104 -2.743 1.00 0.00 H new ATOM 0 HB2 LYS A 90 5.813 -8.442 -2.911 1.00 0.00 H new ATOM 0 HB3 LYS A 90 4.101 -8.448 -2.536 1.00 0.00 H new ATOM 0 HG2 LYS A 90 4.579 -10.184 -0.755 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.288 -9.953 -1.066 1.00 0.00 H new ATOM 0 HD2 LYS A 90 5.890 -7.447 -0.627 1.00 0.00 H new ATOM 0 HD3 LYS A 90 4.303 -7.897 -0.035 1.00 0.00 H new ATOM 0 HE2 LYS A 90 5.287 -9.345 1.671 1.00 0.00 H new ATOM 0 HE3 LYS A 90 6.894 -9.091 1.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 6.510 -7.722 2.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 6.725 -6.739 1.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 5.169 -6.985 2.224 1.00 0.00 H new ATOM 1426 N MET A 91 2.412 -9.946 -3.406 1.00 0.00 N ATOM 1427 CA MET A 91 1.047 -10.313 -3.761 1.00 0.00 C ATOM 1428 C MET A 91 0.298 -9.128 -4.342 1.00 0.00 C ATOM 1429 O MET A 91 0.560 -7.977 -4.002 1.00 0.00 O ATOM 1430 CB MET A 91 0.262 -10.746 -2.518 1.00 0.00 C ATOM 1431 CG MET A 91 0.898 -11.863 -1.722 1.00 0.00 C ATOM 1432 SD MET A 91 2.163 -11.284 -0.571 1.00 0.00 S ATOM 1433 CE MET A 91 1.204 -10.172 0.454 1.00 0.00 C ATOM 0 H MET A 91 2.483 -9.420 -2.535 1.00 0.00 H new ATOM 0 HA MET A 91 1.122 -11.123 -4.486 1.00 0.00 H new ATOM 0 HB2 MET A 91 0.135 -9.881 -1.866 1.00 0.00 H new ATOM 0 HB3 MET A 91 -0.735 -11.061 -2.827 1.00 0.00 H new ATOM 0 HG2 MET A 91 0.123 -12.391 -1.165 1.00 0.00 H new ATOM 0 HG3 MET A 91 1.343 -12.583 -2.409 1.00 0.00 H new ATOM 0 HE1 MET A 91 1.467 -9.141 0.217 1.00 0.00 H new ATOM 0 HE2 MET A 91 0.142 -10.328 0.265 1.00 0.00 H new ATOM 0 HE3 MET A 91 1.419 -10.369 1.504 1.00 0.00 H new ATOM 1443 N VAL A 92 -0.639 -9.434 -5.220 1.00 0.00 N ATOM 1444 CA VAL A 92 -1.460 -8.427 -5.863 1.00 0.00 C ATOM 1445 C VAL A 92 -2.915 -8.622 -5.454 1.00 0.00 C ATOM 1446 O VAL A 92 -3.396 -9.757 -5.368 1.00 0.00 O ATOM 1447 CB VAL A 92 -1.331 -8.506 -7.402 1.00 0.00 C ATOM 1448 CG1 VAL A 92 -2.301 -7.560 -8.092 1.00 0.00 C ATOM 1449 CG2 VAL A 92 0.089 -8.196 -7.830 1.00 0.00 C ATOM 0 H VAL A 92 -0.852 -10.389 -5.507 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.116 -7.443 -5.544 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.581 -9.524 -7.702 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.183 -7.642 -9.172 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.323 -7.823 -7.818 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.094 -6.536 -7.781 1.00 0.00 H new ATOM 0 HG21 VAL A 92 0.163 -8.256 -8.916 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.356 -7.191 -7.503 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.771 -8.918 -7.380 1.00 0.00 H new ATOM 1459 N THR A 93 -3.600 -7.528 -5.164 1.00 0.00 N ATOM 1460 CA THR A 93 -5.005 -7.594 -4.813 1.00 0.00 C ATOM 1461 C THR A 93 -5.776 -6.473 -5.505 1.00 0.00 C ATOM 1462 O THR A 93 -5.328 -5.324 -5.539 1.00 0.00 O ATOM 1463 CB THR A 93 -5.222 -7.527 -3.277 1.00 0.00 C ATOM 1464 OG1 THR A 93 -6.622 -7.579 -2.968 1.00 0.00 O ATOM 1465 CG2 THR A 93 -4.619 -6.259 -2.684 1.00 0.00 C ATOM 0 H THR A 93 -3.206 -6.587 -5.165 1.00 0.00 H new ATOM 0 HA THR A 93 -5.384 -8.556 -5.157 1.00 0.00 H new ATOM 0 HB THR A 93 -4.718 -8.388 -2.837 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.744 -7.538 -1.997 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.789 -6.244 -1.607 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.547 -6.238 -2.883 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.089 -5.386 -3.137 1.00 0.00 H new ATOM 1473 N THR A 94 -6.904 -6.821 -6.099 1.00 0.00 N ATOM 1474 CA THR A 94 -7.783 -5.830 -6.685 1.00 0.00 C ATOM 1475 C THR A 94 -8.967 -5.569 -5.774 1.00 0.00 C ATOM 1476 O THR A 94 -9.644 -6.497 -5.339 1.00 0.00 O ATOM 1477 CB THR A 94 -8.282 -6.239 -8.083 1.00 0.00 C ATOM 1478 OG1 THR A 94 -8.477 -7.658 -8.164 1.00 0.00 O ATOM 1479 CG2 THR A 94 -7.309 -5.782 -9.148 1.00 0.00 C ATOM 0 H THR A 94 -7.231 -7.783 -6.187 1.00 0.00 H new ATOM 0 HA THR A 94 -7.198 -4.917 -6.799 1.00 0.00 H new ATOM 0 HB THR A 94 -9.242 -5.752 -8.254 1.00 0.00 H new ATOM 0 HG1 THR A 94 -8.796 -7.894 -9.060 1.00 0.00 H new ATOM 0 HG21 THR A 94 -7.678 -6.080 -10.130 1.00 0.00 H new ATOM 0 HG22 THR A 94 -7.212 -4.697 -9.111 1.00 0.00 H new ATOM 0 HG23 THR A 94 -6.336 -6.240 -8.972 1.00 0.00 H new ATOM 1487 N PHE A 95 -9.222 -4.307 -5.500 1.00 0.00 N ATOM 1488 CA PHE A 95 -10.292 -3.935 -4.587 1.00 0.00 C ATOM 1489 C PHE A 95 -10.839 -2.564 -4.946 1.00 0.00 C ATOM 1490 O PHE A 95 -10.089 -1.672 -5.328 1.00 0.00 O ATOM 1491 CB PHE A 95 -9.809 -3.970 -3.130 1.00 0.00 C ATOM 1492 CG PHE A 95 -8.691 -3.018 -2.805 1.00 0.00 C ATOM 1493 CD1 PHE A 95 -7.368 -3.401 -2.954 1.00 0.00 C ATOM 1494 CD2 PHE A 95 -8.967 -1.745 -2.332 1.00 0.00 C ATOM 1495 CE1 PHE A 95 -6.341 -2.532 -2.642 1.00 0.00 C ATOM 1496 CE2 PHE A 95 -7.943 -0.872 -2.014 1.00 0.00 C ATOM 1497 CZ PHE A 95 -6.629 -1.266 -2.170 1.00 0.00 C ATOM 0 H PHE A 95 -8.706 -3.520 -5.894 1.00 0.00 H new ATOM 0 HA PHE A 95 -11.097 -4.663 -4.686 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -10.654 -3.749 -2.478 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -9.482 -4.983 -2.896 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -7.137 -4.391 -3.319 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -9.993 -1.431 -2.210 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -5.314 -2.842 -2.767 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -8.171 0.117 -1.644 1.00 0.00 H new ATOM 0 HZ PHE A 95 -5.827 -0.585 -1.923 1.00 0.00 H new ATOM 1507 N LYS A 96 -12.158 -2.421 -4.847 1.00 0.00 N ATOM 1508 CA LYS A 96 -12.852 -1.206 -5.258 1.00 0.00 C ATOM 1509 C LYS A 96 -12.576 -0.869 -6.722 1.00 0.00 C ATOM 1510 O LYS A 96 -12.701 0.281 -7.144 1.00 0.00 O ATOM 1511 CB LYS A 96 -12.470 -0.049 -4.361 1.00 0.00 C ATOM 1512 CG LYS A 96 -12.983 -0.247 -2.957 1.00 0.00 C ATOM 1513 CD LYS A 96 -12.751 0.973 -2.120 1.00 0.00 C ATOM 1514 CE LYS A 96 -13.699 2.102 -2.496 1.00 0.00 C ATOM 1515 NZ LYS A 96 -13.469 3.318 -1.669 1.00 0.00 N ATOM 0 H LYS A 96 -12.775 -3.145 -4.479 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.923 -1.385 -5.159 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.385 0.056 -4.342 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.872 0.878 -4.769 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.048 -0.475 -2.985 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -12.485 -1.104 -2.502 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -12.883 0.723 -1.067 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -11.721 1.307 -2.242 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -13.569 2.350 -3.550 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -14.729 1.768 -2.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -14.384 3.718 -1.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -12.917 3.064 -0.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -12.945 4.023 -2.226 1.00 0.00 H new ATOM 1529 N GLY A 97 -12.193 -1.886 -7.488 1.00 0.00 N ATOM 1530 CA GLY A 97 -11.867 -1.686 -8.885 1.00 0.00 C ATOM 1531 C GLY A 97 -10.435 -1.229 -9.091 1.00 0.00 C ATOM 1532 O GLY A 97 -10.003 -1.015 -10.224 1.00 0.00 O ATOM 0 H GLY A 97 -12.103 -2.848 -7.162 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -12.029 -2.617 -9.429 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -12.545 -0.946 -9.310 1.00 0.00 H new ATOM 1536 N ILE A 98 -9.702 -1.061 -7.998 1.00 0.00 N ATOM 1537 CA ILE A 98 -8.316 -0.634 -8.063 1.00 0.00 C ATOM 1538 C ILE A 98 -7.411 -1.852 -7.983 1.00 0.00 C ATOM 1539 O ILE A 98 -7.756 -2.852 -7.354 1.00 0.00 O ATOM 1540 CB ILE A 98 -7.960 0.394 -6.955 1.00 0.00 C ATOM 1541 CG1 ILE A 98 -7.447 -0.271 -5.671 1.00 0.00 C ATOM 1542 CG2 ILE A 98 -9.170 1.253 -6.631 1.00 0.00 C ATOM 1543 CD1 ILE A 98 -5.942 -0.330 -5.571 1.00 0.00 C ATOM 0 H ILE A 98 -10.050 -1.216 -7.052 1.00 0.00 H new ATOM 0 HA ILE A 98 -8.164 -0.125 -9.015 1.00 0.00 H new ATOM 0 HB ILE A 98 -7.153 1.012 -7.348 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -7.837 0.273 -4.811 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -7.845 -1.284 -5.614 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -8.909 1.970 -5.853 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -9.487 1.788 -7.526 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -9.984 0.618 -6.281 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -5.658 -0.814 -4.636 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -5.544 -0.900 -6.410 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -5.536 0.681 -5.594 1.00 0.00 H new ATOM 1555 N LYS A 99 -6.272 -1.776 -8.635 1.00 0.00 N ATOM 1556 CA LYS A 99 -5.381 -2.913 -8.726 1.00 0.00 C ATOM 1557 C LYS A 99 -4.089 -2.622 -7.971 1.00 0.00 C ATOM 1558 O LYS A 99 -3.335 -1.736 -8.352 1.00 0.00 O ATOM 1559 CB LYS A 99 -5.064 -3.232 -10.194 1.00 0.00 C ATOM 1560 CG LYS A 99 -6.253 -3.146 -11.142 1.00 0.00 C ATOM 1561 CD LYS A 99 -6.524 -1.715 -11.568 1.00 0.00 C ATOM 1562 CE LYS A 99 -7.796 -1.600 -12.393 1.00 0.00 C ATOM 1563 NZ LYS A 99 -7.707 -2.343 -13.677 1.00 0.00 N ATOM 0 H LYS A 99 -5.940 -0.937 -9.111 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.873 -3.777 -8.279 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -4.291 -2.546 -10.541 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.646 -4.237 -10.250 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -6.062 -3.759 -12.023 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -7.138 -3.555 -10.655 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -6.606 -1.083 -10.684 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -5.680 -1.343 -12.149 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -8.637 -1.980 -11.814 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -7.999 -0.549 -12.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -8.570 -2.179 -14.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -6.881 -2.011 -14.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -7.608 -3.360 -13.483 1.00 0.00 H new ATOM 1577 N SER A 100 -3.832 -3.361 -6.905 1.00 0.00 N ATOM 1578 CA SER A 100 -2.674 -3.092 -6.067 1.00 0.00 C ATOM 1579 C SER A 100 -1.684 -4.259 -6.094 1.00 0.00 C ATOM 1580 O SER A 100 -2.009 -5.366 -5.672 1.00 0.00 O ATOM 1581 CB SER A 100 -3.133 -2.827 -4.635 1.00 0.00 C ATOM 1582 OG SER A 100 -2.066 -2.372 -3.819 1.00 0.00 O ATOM 0 H SER A 100 -4.405 -4.148 -6.600 1.00 0.00 H new ATOM 0 HA SER A 100 -2.163 -2.212 -6.458 1.00 0.00 H new ATOM 0 HB2 SER A 100 -3.930 -2.084 -4.640 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.551 -3.740 -4.212 1.00 0.00 H new ATOM 0 HG SER A 100 -2.395 -2.211 -2.910 1.00 0.00 H new ATOM 1588 N VAL A 101 -0.483 -4.001 -6.592 1.00 0.00 N ATOM 1589 CA VAL A 101 0.584 -4.995 -6.612 1.00 0.00 C ATOM 1590 C VAL A 101 1.604 -4.690 -5.513 1.00 0.00 C ATOM 1591 O VAL A 101 1.937 -3.532 -5.256 1.00 0.00 O ATOM 1592 CB VAL A 101 1.276 -5.093 -8.001 1.00 0.00 C ATOM 1593 CG1 VAL A 101 0.622 -4.172 -9.006 1.00 0.00 C ATOM 1594 CG2 VAL A 101 2.766 -4.845 -7.903 1.00 0.00 C ATOM 0 H VAL A 101 -0.220 -3.101 -6.993 1.00 0.00 H new ATOM 0 HA VAL A 101 0.132 -5.968 -6.420 1.00 0.00 H new ATOM 0 HB VAL A 101 1.146 -6.114 -8.359 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.128 -4.264 -9.967 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -0.427 -4.445 -9.121 1.00 0.00 H new ATOM 0 HG13 VAL A 101 0.692 -3.142 -8.656 1.00 0.00 H new ATOM 0 HG21 VAL A 101 3.214 -4.922 -8.894 1.00 0.00 H new ATOM 0 HG22 VAL A 101 2.943 -3.847 -7.501 1.00 0.00 H new ATOM 0 HG23 VAL A 101 3.216 -5.587 -7.243 1.00 0.00 H new ATOM 1604 N THR A 102 2.059 -5.735 -4.851 1.00 0.00 N ATOM 1605 CA THR A 102 3.035 -5.629 -3.785 1.00 0.00 C ATOM 1606 C THR A 102 4.185 -6.545 -4.116 1.00 0.00 C ATOM 1607 O THR A 102 3.944 -7.644 -4.596 1.00 0.00 O ATOM 1608 CB THR A 102 2.463 -6.056 -2.423 1.00 0.00 C ATOM 1609 OG1 THR A 102 1.051 -5.819 -2.383 1.00 0.00 O ATOM 1610 CG2 THR A 102 3.132 -5.296 -1.289 1.00 0.00 C ATOM 0 H THR A 102 1.758 -6.691 -5.040 1.00 0.00 H new ATOM 0 HA THR A 102 3.342 -4.586 -3.709 1.00 0.00 H new ATOM 0 HB THR A 102 2.659 -7.121 -2.297 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.589 -6.505 -2.909 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.709 -5.617 -0.337 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.203 -5.499 -1.297 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.964 -4.227 -1.419 1.00 0.00 H new ATOM 1618 N GLU A 103 5.409 -6.091 -3.918 1.00 0.00 N ATOM 1619 CA GLU A 103 6.587 -6.886 -4.184 1.00 0.00 C ATOM 1620 C GLU A 103 7.507 -6.892 -2.964 1.00 0.00 C ATOM 1621 O GLU A 103 7.614 -5.885 -2.262 1.00 0.00 O ATOM 1622 CB GLU A 103 7.315 -6.268 -5.361 1.00 0.00 C ATOM 1623 CG GLU A 103 7.880 -7.264 -6.338 1.00 0.00 C ATOM 1624 CD GLU A 103 9.102 -6.733 -7.061 1.00 0.00 C ATOM 1625 OE1 GLU A 103 8.936 -5.969 -8.035 1.00 0.00 O ATOM 1626 OE2 GLU A 103 10.233 -7.067 -6.657 1.00 0.00 O ATOM 0 H GLU A 103 5.612 -5.155 -3.566 1.00 0.00 H new ATOM 0 HA GLU A 103 6.299 -7.913 -4.406 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.628 -5.608 -5.891 1.00 0.00 H new ATOM 0 HB3 GLU A 103 8.127 -5.647 -4.984 1.00 0.00 H new ATOM 0 HG2 GLU A 103 8.144 -8.179 -5.808 1.00 0.00 H new ATOM 0 HG3 GLU A 103 7.115 -7.527 -7.068 1.00 0.00 H new ATOM 1633 N PHE A 104 8.146 -8.023 -2.687 1.00 0.00 N ATOM 1634 CA PHE A 104 9.144 -8.066 -1.631 1.00 0.00 C ATOM 1635 C PHE A 104 10.549 -7.996 -2.203 1.00 0.00 C ATOM 1636 O PHE A 104 11.024 -8.912 -2.865 1.00 0.00 O ATOM 1637 CB PHE A 104 8.996 -9.306 -0.765 1.00 0.00 C ATOM 1638 CG PHE A 104 9.854 -9.262 0.459 1.00 0.00 C ATOM 1639 CD1 PHE A 104 11.150 -9.678 0.381 1.00 0.00 C ATOM 1640 CD2 PHE A 104 9.366 -8.798 1.669 1.00 0.00 C ATOM 1641 CE1 PHE A 104 11.980 -9.643 1.483 1.00 0.00 C ATOM 1642 CE2 PHE A 104 10.183 -8.758 2.782 1.00 0.00 C ATOM 1643 CZ PHE A 104 11.493 -9.181 2.690 1.00 0.00 C ATOM 0 H PHE A 104 7.993 -8.908 -3.171 1.00 0.00 H new ATOM 0 HA PHE A 104 8.977 -7.192 -1.001 1.00 0.00 H new ATOM 0 HB2 PHE A 104 7.953 -9.414 -0.468 1.00 0.00 H new ATOM 0 HB3 PHE A 104 9.254 -10.187 -1.353 1.00 0.00 H new ATOM 0 HD1 PHE A 104 11.534 -10.042 -0.561 1.00 0.00 H new ATOM 0 HD2 PHE A 104 8.341 -8.466 1.743 1.00 0.00 H new ATOM 0 HE1 PHE A 104 13.005 -9.975 1.402 1.00 0.00 H new ATOM 0 HE2 PHE A 104 9.797 -8.396 3.723 1.00 0.00 H new ATOM 0 HZ PHE A 104 12.135 -9.151 3.558 1.00 0.00 H new ATOM 1653 N ASN A 105 11.199 -6.898 -1.910 1.00 0.00 N ATOM 1654 CA ASN A 105 12.578 -6.669 -2.301 1.00 0.00 C ATOM 1655 C ASN A 105 13.430 -6.802 -1.044 1.00 0.00 C ATOM 1656 O ASN A 105 12.888 -6.732 0.055 1.00 0.00 O ATOM 1657 CB ASN A 105 12.720 -5.276 -2.934 1.00 0.00 C ATOM 1658 CG ASN A 105 14.047 -5.072 -3.646 1.00 0.00 C ATOM 1659 OD1 ASN A 105 14.185 -5.384 -4.827 1.00 0.00 O ATOM 1660 ND2 ASN A 105 15.020 -4.515 -2.948 1.00 0.00 N ATOM 0 H ASN A 105 10.786 -6.126 -1.387 1.00 0.00 H new ATOM 0 HA ASN A 105 12.905 -7.393 -3.047 1.00 0.00 H new ATOM 0 HB2 ASN A 105 11.907 -5.123 -3.644 1.00 0.00 H new ATOM 0 HB3 ASN A 105 12.612 -4.519 -2.157 1.00 0.00 H new ATOM 0 HD21 ASN A 105 15.922 -4.331 -3.387 1.00 0.00 H new ATOM 0 HD22 ASN A 105 14.870 -4.269 -1.970 1.00 0.00 H new ATOM 1667 N GLY A 106 14.725 -7.064 -1.195 1.00 0.00 N ATOM 1668 CA GLY A 106 15.598 -7.240 -0.036 1.00 0.00 C ATOM 1669 C GLY A 106 15.397 -6.183 1.041 1.00 0.00 C ATOM 1670 O GLY A 106 15.884 -5.057 0.918 1.00 0.00 O ATOM 0 H GLY A 106 15.190 -7.159 -2.098 1.00 0.00 H new ATOM 0 HA2 GLY A 106 15.422 -8.225 0.396 1.00 0.00 H new ATOM 0 HA3 GLY A 106 16.636 -7.218 -0.366 1.00 0.00 H new ATOM 1674 N ASP A 107 14.643 -6.559 2.079 1.00 0.00 N ATOM 1675 CA ASP A 107 14.325 -5.687 3.219 1.00 0.00 C ATOM 1676 C ASP A 107 13.551 -4.440 2.789 1.00 0.00 C ATOM 1677 O ASP A 107 13.459 -3.461 3.528 1.00 0.00 O ATOM 1678 CB ASP A 107 15.590 -5.291 3.976 1.00 0.00 C ATOM 1679 CG ASP A 107 16.308 -6.486 4.568 1.00 0.00 C ATOM 1680 OD1 ASP A 107 15.667 -7.270 5.298 1.00 0.00 O ATOM 1681 OD2 ASP A 107 17.523 -6.645 4.308 1.00 0.00 O ATOM 0 H ASP A 107 14.230 -7.489 2.154 1.00 0.00 H new ATOM 0 HA ASP A 107 13.683 -6.261 3.887 1.00 0.00 H new ATOM 0 HB2 ASP A 107 16.264 -4.764 3.301 1.00 0.00 H new ATOM 0 HB3 ASP A 107 15.330 -4.595 4.774 1.00 0.00 H new ATOM 1686 N THR A 108 13.003 -4.488 1.589 1.00 0.00 N ATOM 1687 CA THR A 108 12.264 -3.389 1.015 1.00 0.00 C ATOM 1688 C THR A 108 10.941 -3.882 0.403 1.00 0.00 C ATOM 1689 O THR A 108 10.791 -5.065 0.104 1.00 0.00 O ATOM 1690 CB THR A 108 13.123 -2.704 -0.056 1.00 0.00 C ATOM 1691 OG1 THR A 108 14.026 -3.654 -0.628 1.00 0.00 O ATOM 1692 CG2 THR A 108 13.911 -1.563 0.539 1.00 0.00 C ATOM 0 H THR A 108 13.062 -5.305 0.981 1.00 0.00 H new ATOM 0 HA THR A 108 12.025 -2.673 1.802 1.00 0.00 H new ATOM 0 HB THR A 108 12.462 -2.309 -0.827 1.00 0.00 H new ATOM 0 HG1 THR A 108 14.685 -3.925 0.045 1.00 0.00 H new ATOM 0 HG21 THR A 108 14.513 -1.092 -0.238 1.00 0.00 H new ATOM 0 HG22 THR A 108 13.225 -0.829 0.962 1.00 0.00 H new ATOM 0 HG23 THR A 108 14.565 -1.943 1.324 1.00 0.00 H new ATOM 1700 N ILE A 109 9.972 -2.996 0.248 1.00 0.00 N ATOM 1701 CA ILE A 109 8.711 -3.352 -0.392 1.00 0.00 C ATOM 1702 C ILE A 109 8.486 -2.506 -1.638 1.00 0.00 C ATOM 1703 O ILE A 109 8.690 -1.300 -1.619 1.00 0.00 O ATOM 1704 CB ILE A 109 7.505 -3.161 0.555 1.00 0.00 C ATOM 1705 CG1 ILE A 109 7.726 -3.937 1.851 1.00 0.00 C ATOM 1706 CG2 ILE A 109 6.210 -3.601 -0.121 1.00 0.00 C ATOM 1707 CD1 ILE A 109 6.479 -4.084 2.695 1.00 0.00 C ATOM 0 H ILE A 109 10.031 -2.025 0.555 1.00 0.00 H new ATOM 0 HA ILE A 109 8.783 -4.406 -0.659 1.00 0.00 H new ATOM 0 HB ILE A 109 7.417 -2.101 0.793 1.00 0.00 H new ATOM 0 HG12 ILE A 109 8.109 -4.929 1.609 1.00 0.00 H new ATOM 0 HG13 ILE A 109 8.494 -3.434 2.439 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.375 -3.457 0.564 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.048 -3.006 -1.020 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.280 -4.655 -0.391 1.00 0.00 H new ATOM 0 HD11 ILE A 109 6.715 -4.646 3.598 1.00 0.00 H new ATOM 0 HD12 ILE A 109 6.107 -3.097 2.969 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.715 -4.615 2.127 1.00 0.00 H new ATOM 1719 N THR A 110 8.065 -3.138 -2.713 1.00 0.00 N ATOM 1720 CA THR A 110 7.736 -2.422 -3.931 1.00 0.00 C ATOM 1721 C THR A 110 6.218 -2.437 -4.133 1.00 0.00 C ATOM 1722 O THR A 110 5.630 -3.477 -4.405 1.00 0.00 O ATOM 1723 CB THR A 110 8.435 -3.068 -5.141 1.00 0.00 C ATOM 1724 OG1 THR A 110 9.595 -3.798 -4.705 1.00 0.00 O ATOM 1725 CG2 THR A 110 8.867 -1.988 -6.101 1.00 0.00 C ATOM 0 H THR A 110 7.942 -4.149 -2.770 1.00 0.00 H new ATOM 0 HA THR A 110 8.082 -1.392 -3.844 1.00 0.00 H new ATOM 0 HB THR A 110 7.741 -3.750 -5.632 1.00 0.00 H new ATOM 0 HG1 THR A 110 10.034 -4.208 -5.480 1.00 0.00 H new ATOM 0 HG21 THR A 110 9.363 -2.441 -6.960 1.00 0.00 H new ATOM 0 HG22 THR A 110 7.993 -1.431 -6.439 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.558 -1.310 -5.599 1.00 0.00 H new ATOM 1733 N ASN A 111 5.597 -1.282 -3.979 1.00 0.00 N ATOM 1734 CA ASN A 111 4.142 -1.161 -4.044 1.00 0.00 C ATOM 1735 C ASN A 111 3.733 -0.534 -5.360 1.00 0.00 C ATOM 1736 O ASN A 111 4.077 0.615 -5.619 1.00 0.00 O ATOM 1737 CB ASN A 111 3.633 -0.240 -2.927 1.00 0.00 C ATOM 1738 CG ASN A 111 2.225 -0.569 -2.447 1.00 0.00 C ATOM 1739 OD1 ASN A 111 1.865 -0.252 -1.312 1.00 0.00 O ATOM 1740 ND2 ASN A 111 1.421 -1.204 -3.291 1.00 0.00 N ATOM 0 H ASN A 111 6.080 -0.401 -3.806 1.00 0.00 H new ATOM 0 HA ASN A 111 3.720 -2.160 -3.940 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.318 -0.299 -2.081 1.00 0.00 H new ATOM 0 HB3 ASN A 111 3.653 0.790 -3.282 1.00 0.00 H new ATOM 0 HD21 ASN A 111 0.471 -1.445 -3.007 1.00 0.00 H new ATOM 0 HD22 ASN A 111 1.753 -1.451 -4.223 1.00 0.00 H new ATOM 1747 N THR A 112 2.996 -1.249 -6.182 1.00 0.00 N ATOM 1748 CA THR A 112 2.459 -0.637 -7.374 1.00 0.00 C ATOM 1749 C THR A 112 0.941 -0.617 -7.282 1.00 0.00 C ATOM 1750 O THR A 112 0.290 -1.648 -7.348 1.00 0.00 O ATOM 1751 CB THR A 112 2.892 -1.401 -8.640 1.00 0.00 C ATOM 1752 OG1 THR A 112 4.308 -1.639 -8.616 1.00 0.00 O ATOM 1753 CG2 THR A 112 2.532 -0.615 -9.884 1.00 0.00 C ATOM 0 H THR A 112 2.760 -2.233 -6.051 1.00 0.00 H new ATOM 0 HA THR A 112 2.846 0.379 -7.446 1.00 0.00 H new ATOM 0 HB THR A 112 2.366 -2.356 -8.659 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.572 -2.126 -9.424 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.845 -1.170 -10.768 1.00 0.00 H new ATOM 0 HG22 THR A 112 1.454 -0.459 -9.917 1.00 0.00 H new ATOM 0 HG23 THR A 112 3.038 0.350 -9.863 1.00 0.00 H new ATOM 1761 N MET A 113 0.379 0.558 -7.125 1.00 0.00 N ATOM 1762 CA MET A 113 -1.063 0.703 -7.066 1.00 0.00 C ATOM 1763 C MET A 113 -1.590 1.266 -8.370 1.00 0.00 C ATOM 1764 O MET A 113 -0.972 2.128 -8.975 1.00 0.00 O ATOM 1765 CB MET A 113 -1.477 1.628 -5.928 1.00 0.00 C ATOM 1766 CG MET A 113 -2.976 1.829 -5.864 1.00 0.00 C ATOM 1767 SD MET A 113 -3.459 3.165 -4.752 1.00 0.00 S ATOM 1768 CE MET A 113 -2.804 2.564 -3.196 1.00 0.00 C ATOM 0 H MET A 113 0.897 1.432 -7.035 1.00 0.00 H new ATOM 0 HA MET A 113 -1.485 -0.287 -6.892 1.00 0.00 H new ATOM 0 HB2 MET A 113 -1.128 1.214 -4.982 1.00 0.00 H new ATOM 0 HB3 MET A 113 -0.989 2.594 -6.053 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.352 2.042 -6.865 1.00 0.00 H new ATOM 0 HG3 MET A 113 -3.448 0.903 -5.537 1.00 0.00 H new ATOM 0 HE1 MET A 113 -3.187 3.176 -2.379 1.00 0.00 H new ATOM 0 HE2 MET A 113 -3.111 1.529 -3.048 1.00 0.00 H new ATOM 0 HE3 MET A 113 -1.716 2.621 -3.213 1.00 0.00 H new ATOM 1778 N THR A 114 -2.707 0.746 -8.820 1.00 0.00 N ATOM 1779 CA THR A 114 -3.351 1.262 -10.010 1.00 0.00 C ATOM 1780 C THR A 114 -4.819 1.592 -9.746 1.00 0.00 C ATOM 1781 O THR A 114 -5.607 0.700 -9.436 1.00 0.00 O ATOM 1782 CB THR A 114 -3.271 0.246 -11.148 1.00 0.00 C ATOM 1783 OG1 THR A 114 -1.967 -0.358 -11.182 1.00 0.00 O ATOM 1784 CG2 THR A 114 -3.548 0.931 -12.462 1.00 0.00 C ATOM 0 H THR A 114 -3.192 -0.036 -8.380 1.00 0.00 H new ATOM 0 HA THR A 114 -2.826 2.174 -10.293 1.00 0.00 H new ATOM 0 HB THR A 114 -4.017 -0.531 -10.981 1.00 0.00 H new ATOM 0 HG1 THR A 114 -1.927 -1.009 -11.914 1.00 0.00 H new ATOM 0 HG21 THR A 114 -3.490 0.203 -13.271 1.00 0.00 H new ATOM 0 HG22 THR A 114 -4.545 1.370 -12.440 1.00 0.00 H new ATOM 0 HG23 THR A 114 -2.809 1.716 -12.626 1.00 0.00 H new ATOM 1792 N LEU A 115 -5.192 2.856 -9.862 1.00 0.00 N ATOM 1793 CA LEU A 115 -6.597 3.219 -9.809 1.00 0.00 C ATOM 1794 C LEU A 115 -7.039 3.644 -11.198 1.00 0.00 C ATOM 1795 O LEU A 115 -6.767 4.761 -11.614 1.00 0.00 O ATOM 1796 CB LEU A 115 -6.827 4.373 -8.834 1.00 0.00 C ATOM 1797 CG LEU A 115 -8.157 4.336 -8.071 1.00 0.00 C ATOM 1798 CD1 LEU A 115 -8.501 5.711 -7.555 1.00 0.00 C ATOM 1799 CD2 LEU A 115 -9.278 3.820 -8.946 1.00 0.00 C ATOM 0 H LEU A 115 -4.550 3.638 -9.992 1.00 0.00 H new ATOM 0 HA LEU A 115 -7.173 2.359 -9.466 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.012 4.382 -8.110 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.771 5.310 -9.388 1.00 0.00 H new ATOM 0 HG LEU A 115 -8.040 3.654 -7.229 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -9.447 5.671 -7.015 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -7.714 6.055 -6.883 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -8.590 6.402 -8.393 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.207 3.806 -8.376 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.393 4.472 -9.812 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -9.042 2.810 -9.281 1.00 0.00 H new ATOM 1811 N GLY A 116 -7.785 2.771 -11.866 1.00 0.00 N ATOM 1812 CA GLY A 116 -8.259 3.039 -13.215 1.00 0.00 C ATOM 1813 C GLY A 116 -7.197 3.625 -14.140 1.00 0.00 C ATOM 1814 O GLY A 116 -6.430 2.894 -14.770 1.00 0.00 O ATOM 0 H GLY A 116 -8.075 1.868 -11.491 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.633 2.111 -13.649 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -9.102 3.729 -13.163 1.00 0.00 H new ATOM 1818 N ASP A 117 -7.158 4.951 -14.206 1.00 0.00 N ATOM 1819 CA ASP A 117 -6.257 5.665 -15.102 1.00 0.00 C ATOM 1820 C ASP A 117 -4.959 6.042 -14.394 1.00 0.00 C ATOM 1821 O ASP A 117 -3.894 6.102 -15.012 1.00 0.00 O ATOM 1822 CB ASP A 117 -6.940 6.936 -15.599 1.00 0.00 C ATOM 1823 CG ASP A 117 -6.486 7.353 -16.980 1.00 0.00 C ATOM 1824 OD1 ASP A 117 -5.472 8.069 -17.100 1.00 0.00 O ATOM 1825 OD2 ASP A 117 -7.165 6.980 -17.958 1.00 0.00 O ATOM 0 H ASP A 117 -7.749 5.560 -13.641 1.00 0.00 H new ATOM 0 HA ASP A 117 -6.018 5.009 -15.939 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -8.019 6.781 -15.609 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -6.741 7.746 -14.898 1.00 0.00 H new ATOM 1830 N ILE A 118 -5.047 6.290 -13.094 1.00 0.00 N ATOM 1831 CA ILE A 118 -3.899 6.753 -12.328 1.00 0.00 C ATOM 1832 C ILE A 118 -3.103 5.588 -11.761 1.00 0.00 C ATOM 1833 O ILE A 118 -3.671 4.630 -11.237 1.00 0.00 O ATOM 1834 CB ILE A 118 -4.307 7.683 -11.178 1.00 0.00 C ATOM 1835 CG1 ILE A 118 -5.371 7.022 -10.342 1.00 0.00 C ATOM 1836 CG2 ILE A 118 -4.826 8.977 -11.722 1.00 0.00 C ATOM 1837 CD1 ILE A 118 -5.896 7.877 -9.250 1.00 0.00 C ATOM 0 H ILE A 118 -5.902 6.178 -12.548 1.00 0.00 H new ATOM 0 HA ILE A 118 -3.277 7.313 -13.026 1.00 0.00 H new ATOM 0 HB ILE A 118 -3.433 7.883 -10.559 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -6.197 6.728 -10.989 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -4.964 6.108 -9.910 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -5.113 9.630 -10.897 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -4.049 9.461 -12.314 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -5.695 8.785 -12.351 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -6.658 7.330 -8.694 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -5.082 8.150 -8.578 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -6.335 8.780 -9.674 1.00 0.00 H new ATOM 1849 N VAL A 119 -1.794 5.655 -11.875 1.00 0.00 N ATOM 1850 CA VAL A 119 -0.950 4.656 -11.258 1.00 0.00 C ATOM 1851 C VAL A 119 -0.189 5.299 -10.103 1.00 0.00 C ATOM 1852 O VAL A 119 0.202 6.462 -10.180 1.00 0.00 O ATOM 1853 CB VAL A 119 0.018 4.006 -12.276 1.00 0.00 C ATOM 1854 CG1 VAL A 119 1.289 4.815 -12.442 1.00 0.00 C ATOM 1855 CG2 VAL A 119 0.326 2.569 -11.883 1.00 0.00 C ATOM 0 H VAL A 119 -1.295 6.384 -12.385 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.579 3.851 -10.878 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.481 3.995 -13.245 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.941 4.324 -13.165 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.040 5.815 -12.798 1.00 0.00 H new ATOM 0 HG13 VAL A 119 1.801 4.889 -11.483 1.00 0.00 H new ATOM 0 HG21 VAL A 119 1.008 2.131 -12.612 1.00 0.00 H new ATOM 0 HG22 VAL A 119 0.790 2.553 -10.897 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -0.599 1.992 -11.859 1.00 0.00 H new ATOM 1865 N TYR A 120 -0.021 4.556 -9.028 1.00 0.00 N ATOM 1866 CA TYR A 120 0.612 5.071 -7.826 1.00 0.00 C ATOM 1867 C TYR A 120 1.599 4.049 -7.278 1.00 0.00 C ATOM 1868 O TYR A 120 1.214 2.975 -6.843 1.00 0.00 O ATOM 1869 CB TYR A 120 -0.453 5.391 -6.769 1.00 0.00 C ATOM 1870 CG TYR A 120 0.125 5.946 -5.490 1.00 0.00 C ATOM 1871 CD1 TYR A 120 0.868 7.115 -5.503 1.00 0.00 C ATOM 1872 CD2 TYR A 120 -0.062 5.298 -4.275 1.00 0.00 C ATOM 1873 CE1 TYR A 120 1.411 7.628 -4.347 1.00 0.00 C ATOM 1874 CE2 TYR A 120 0.474 5.807 -3.109 1.00 0.00 C ATOM 1875 CZ TYR A 120 1.212 6.971 -3.150 1.00 0.00 C ATOM 1876 OH TYR A 120 1.757 7.474 -1.991 1.00 0.00 O ATOM 0 H TYR A 120 -0.317 3.582 -8.960 1.00 0.00 H new ATOM 0 HA TYR A 120 1.151 5.985 -8.074 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -1.161 6.110 -7.182 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -1.015 4.485 -6.543 1.00 0.00 H new ATOM 0 HD1 TYR A 120 1.024 7.633 -6.437 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -0.635 4.383 -4.242 1.00 0.00 H new ATOM 0 HE1 TYR A 120 1.990 8.540 -4.377 1.00 0.00 H new ATOM 0 HE2 TYR A 120 0.316 5.297 -2.170 1.00 0.00 H new ATOM 0 HH TYR A 120 1.216 7.189 -1.225 1.00 0.00 H new ATOM 1886 N LYS A 121 2.868 4.387 -7.285 1.00 0.00 N ATOM 1887 CA LYS A 121 3.897 3.446 -6.875 1.00 0.00 C ATOM 1888 C LYS A 121 4.576 3.941 -5.613 1.00 0.00 C ATOM 1889 O LYS A 121 4.759 5.135 -5.447 1.00 0.00 O ATOM 1890 CB LYS A 121 4.934 3.300 -7.987 1.00 0.00 C ATOM 1891 CG LYS A 121 5.454 1.891 -8.176 1.00 0.00 C ATOM 1892 CD LYS A 121 6.641 1.610 -7.284 1.00 0.00 C ATOM 1893 CE LYS A 121 7.315 0.310 -7.671 1.00 0.00 C ATOM 1894 NZ LYS A 121 7.977 0.395 -8.997 1.00 0.00 N ATOM 0 H LYS A 121 3.217 5.303 -7.568 1.00 0.00 H new ATOM 0 HA LYS A 121 3.436 2.478 -6.679 1.00 0.00 H new ATOM 0 HB2 LYS A 121 4.494 3.641 -8.924 1.00 0.00 H new ATOM 0 HB3 LYS A 121 5.775 3.959 -7.772 1.00 0.00 H new ATOM 0 HG2 LYS A 121 4.659 1.177 -7.960 1.00 0.00 H new ATOM 0 HG3 LYS A 121 5.739 1.745 -9.218 1.00 0.00 H new ATOM 0 HD2 LYS A 121 7.356 2.430 -7.355 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.316 1.560 -6.245 1.00 0.00 H new ATOM 0 HE2 LYS A 121 8.054 0.046 -6.914 1.00 0.00 H new ATOM 0 HE3 LYS A 121 6.575 -0.490 -7.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 8.678 -0.368 -9.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 7.264 0.298 -9.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 8.453 1.315 -9.089 1.00 0.00 H new ATOM 1908 N ARG A 122 4.909 3.034 -4.711 1.00 0.00 N ATOM 1909 CA ARG A 122 5.755 3.370 -3.579 1.00 0.00 C ATOM 1910 C ARG A 122 6.765 2.265 -3.342 1.00 0.00 C ATOM 1911 O ARG A 122 6.476 1.099 -3.563 1.00 0.00 O ATOM 1912 CB ARG A 122 4.969 3.593 -2.287 1.00 0.00 C ATOM 1913 CG ARG A 122 3.859 4.612 -2.367 1.00 0.00 C ATOM 1914 CD ARG A 122 3.037 4.615 -1.086 1.00 0.00 C ATOM 1915 NE ARG A 122 2.589 3.267 -0.715 1.00 0.00 N ATOM 1916 CZ ARG A 122 2.386 2.865 0.543 1.00 0.00 C ATOM 1917 NH1 ARG A 122 2.551 3.714 1.553 1.00 0.00 N ATOM 1918 NH2 ARG A 122 2.012 1.613 0.792 1.00 0.00 N ATOM 0 H ARG A 122 4.607 2.060 -4.740 1.00 0.00 H new ATOM 0 HA ARG A 122 6.250 4.307 -3.835 1.00 0.00 H new ATOM 0 HB2 ARG A 122 4.542 2.640 -1.974 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.666 3.901 -1.508 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.280 5.603 -2.537 1.00 0.00 H new ATOM 0 HG3 ARG A 122 3.215 4.389 -3.218 1.00 0.00 H new ATOM 0 HD2 ARG A 122 3.632 5.035 -0.275 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.170 5.263 -1.214 1.00 0.00 H new ATOM 0 HE ARG A 122 2.422 2.595 -1.464 1.00 0.00 H new ATOM 0 HH11 ARG A 122 2.834 4.677 1.369 1.00 0.00 H new ATOM 0 HH12 ARG A 122 2.395 3.403 2.512 1.00 0.00 H new ATOM 0 HH21 ARG A 122 1.880 0.958 0.022 1.00 0.00 H new ATOM 0 HH22 ARG A 122 1.858 1.308 1.753 1.00 0.00 H new ATOM 1932 N VAL A 123 7.946 2.633 -2.909 1.00 0.00 N ATOM 1933 CA VAL A 123 8.949 1.671 -2.516 1.00 0.00 C ATOM 1934 C VAL A 123 9.249 1.862 -1.037 1.00 0.00 C ATOM 1935 O VAL A 123 9.725 2.921 -0.634 1.00 0.00 O ATOM 1936 CB VAL A 123 10.237 1.857 -3.329 1.00 0.00 C ATOM 1937 CG1 VAL A 123 11.242 0.759 -3.013 1.00 0.00 C ATOM 1938 CG2 VAL A 123 9.902 1.889 -4.811 1.00 0.00 C ATOM 0 H VAL A 123 8.240 3.606 -2.819 1.00 0.00 H new ATOM 0 HA VAL A 123 8.572 0.666 -2.704 1.00 0.00 H new ATOM 0 HB VAL A 123 10.698 2.806 -3.055 1.00 0.00 H new ATOM 0 HG11 VAL A 123 12.146 0.913 -3.602 1.00 0.00 H new ATOM 0 HG12 VAL A 123 11.490 0.788 -1.952 1.00 0.00 H new ATOM 0 HG13 VAL A 123 10.810 -0.211 -3.259 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.817 2.021 -5.388 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.425 0.951 -5.097 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.223 2.718 -5.013 1.00 0.00 H new ATOM 1948 N SER A 124 8.973 0.857 -0.235 1.00 0.00 N ATOM 1949 CA SER A 124 9.126 0.976 1.202 1.00 0.00 C ATOM 1950 C SER A 124 10.436 0.356 1.648 1.00 0.00 C ATOM 1951 O SER A 124 10.833 -0.691 1.156 1.00 0.00 O ATOM 1952 CB SER A 124 7.952 0.299 1.907 1.00 0.00 C ATOM 1953 OG SER A 124 6.728 0.646 1.283 1.00 0.00 O ATOM 0 H SER A 124 8.641 -0.054 -0.552 1.00 0.00 H new ATOM 0 HA SER A 124 9.137 2.033 1.468 1.00 0.00 H new ATOM 0 HB2 SER A 124 8.083 -0.783 1.886 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.929 0.597 2.955 1.00 0.00 H new ATOM 0 HG SER A 124 5.987 0.202 1.746 1.00 0.00 H new ATOM 1959 N LYS A 125 11.104 1.012 2.568 1.00 0.00 N ATOM 1960 CA LYS A 125 12.374 0.540 3.068 1.00 0.00 C ATOM 1961 C LYS A 125 12.290 0.362 4.571 1.00 0.00 C ATOM 1962 O LYS A 125 11.613 1.110 5.272 1.00 0.00 O ATOM 1963 CB LYS A 125 13.475 1.525 2.655 1.00 0.00 C ATOM 1964 CG LYS A 125 14.849 1.177 3.141 1.00 0.00 C ATOM 1965 CD LYS A 125 15.188 1.908 4.425 1.00 0.00 C ATOM 1966 CE LYS A 125 15.386 3.398 4.186 1.00 0.00 C ATOM 1967 NZ LYS A 125 15.755 4.119 5.431 1.00 0.00 N ATOM 0 H LYS A 125 10.784 1.884 2.989 1.00 0.00 H new ATOM 0 HA LYS A 125 12.622 -0.431 2.639 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.496 1.589 1.567 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.214 2.516 3.027 1.00 0.00 H new ATOM 0 HG2 LYS A 125 14.916 0.102 3.305 1.00 0.00 H new ATOM 0 HG3 LYS A 125 15.582 1.429 2.374 1.00 0.00 H new ATOM 0 HD2 LYS A 125 14.389 1.758 5.151 1.00 0.00 H new ATOM 0 HD3 LYS A 125 16.095 1.485 4.857 1.00 0.00 H new ATOM 0 HE2 LYS A 125 16.165 3.544 3.438 1.00 0.00 H new ATOM 0 HE3 LYS A 125 14.469 3.824 3.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 15.880 5.130 5.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 15.000 4.002 6.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 16.644 3.731 5.807 1.00 0.00 H new ATOM 1981 N ARG A 126 12.976 -0.653 5.040 1.00 0.00 N ATOM 1982 CA ARG A 126 12.868 -1.105 6.409 1.00 0.00 C ATOM 1983 C ARG A 126 13.437 -0.096 7.383 1.00 0.00 C ATOM 1984 O ARG A 126 14.410 0.594 7.085 1.00 0.00 O ATOM 1985 CB ARG A 126 13.622 -2.409 6.541 1.00 0.00 C ATOM 1986 CG ARG A 126 12.808 -3.535 7.126 1.00 0.00 C ATOM 1987 CD ARG A 126 13.524 -4.840 6.900 1.00 0.00 C ATOM 1988 NE ARG A 126 14.862 -4.834 7.493 1.00 0.00 N ATOM 1989 CZ ARG A 126 15.397 -5.867 8.136 1.00 0.00 C ATOM 1990 NH1 ARG A 126 14.725 -7.006 8.240 1.00 0.00 N ATOM 1991 NH2 ARG A 126 16.611 -5.766 8.662 1.00 0.00 N ATOM 0 H ARG A 126 13.632 -1.195 4.477 1.00 0.00 H new ATOM 0 HA ARG A 126 11.813 -1.235 6.649 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.982 -2.709 5.557 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.500 -2.247 7.166 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.655 -3.372 8.193 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.822 -3.564 6.663 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.940 -5.654 7.329 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.601 -5.032 5.830 1.00 0.00 H new ATOM 0 HE ARG A 126 15.419 -3.984 7.407 1.00 0.00 H new ATOM 0 HH11 ARG A 126 13.796 -7.090 7.826 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.137 -7.798 8.734 1.00 0.00 H new ATOM 0 HH21 ARG A 126 17.134 -4.895 8.573 1.00 0.00 H new ATOM 0 HH22 ARG A 126 17.021 -6.559 9.155 1.00 0.00 H new ATOM 2005 N ILE A 127 12.835 -0.017 8.549 1.00 0.00 N ATOM 2006 CA ILE A 127 13.362 0.814 9.602 1.00 0.00 C ATOM 2007 C ILE A 127 14.156 -0.039 10.580 1.00 0.00 C ATOM 2008 O ILE A 127 13.531 -0.706 11.430 1.00 0.00 O ATOM 2009 CB ILE A 127 12.258 1.586 10.357 1.00 0.00 C ATOM 2010 CG1 ILE A 127 10.914 0.873 10.238 1.00 0.00 C ATOM 2011 CG2 ILE A 127 12.178 3.018 9.872 1.00 0.00 C ATOM 2012 CD1 ILE A 127 10.000 1.508 9.245 1.00 0.00 C ATOM 2013 OXT ILE A 127 15.399 -0.067 10.466 1.00 0.00 O ATOM 0 H ILE A 127 11.980 -0.519 8.789 1.00 0.00 H new ATOM 0 HA ILE A 127 14.011 1.555 9.136 1.00 0.00 H new ATOM 0 HB ILE A 127 12.519 1.611 11.415 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.084 -0.165 9.954 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.428 0.861 11.214 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.394 3.544 10.417 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.134 3.514 10.043 1.00 0.00 H new ATOM 0 HG23 ILE A 127 11.949 3.029 8.806 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.062 0.954 9.208 1.00 0.00 H new ATOM 0 HD12 ILE A 127 9.802 2.538 9.540 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.468 1.496 8.260 1.00 0.00 H new TER 2025 ILE A 127