USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1080 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 65 THR OG1 : rot -170:sc= 0.327 USER MOD Set 1.2: A 67 THR OG1 : rot 180:sc= 0.00162 USER MOD Set 2.1: A 48 MET CE :methyl 141:sc= -2.62! (180deg=-6.41!) USER MOD Set 2.2: A 50 MET CE :methyl -123:sc= -0.69 (180deg=-1.35) USER MOD Set 3.1: A 11 TYR OH : rot 130:sc= 0.126 USER MOD Set 3.2: A 13 GLN : amide:sc= 0.33 K(o=1.9,f=-1.1) USER MOD Set 3.3: A 102 LYS NZ :NH3+ 129:sc= 1.49 (180deg=0.681) USER MOD Set 4.1: A 8 LYS NZ :NH3+ -126:sc= 1.16 (180deg=0.206) USER MOD Set 4.2: A 39 LYS NZ :NH3+ 159:sc= 2.97 (180deg=0.101) USER MOD Set 4.3: A 43 ASN : amide:sc= 1.38 K(o=5.7,f=-11!) USER MOD Set 4.4: A 127 GLN : amide:sc= 0.208 K(o=5.7,f=-7.2!) USER MOD Single : A 1 GLY N :NH3+ -167:sc= 1.31 (180deg=1.18) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -1.2 K(o=-1.2,f=0) USER MOD Single : A 28 LYS NZ :NH3+ 159:sc= 1.25 (180deg=1.15) USER MOD Single : A 34 ASN : amide:sc= -5.74! C(o=-5.7!,f=-3.4!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= 0.703 K(o=0.7,f=-0.057) USER MOD Single : A 45 LYS NZ :NH3+ -164:sc= -0.0234 (180deg=-0.192) USER MOD Single : A 54 GLN : amide:sc= -0.508 X(o=-0.51,f=-0.24) USER MOD Single : A 57 LYS NZ :NH3+ 179:sc= 1.27 (180deg=1.26) USER MOD Single : A 59 CYS SG : rot 31:sc= -0.523 USER MOD Single : A 61 ASN : amide:sc= -2.6! C(o=-2.6!,f=-11!) USER MOD Single : A 62 HIS : no HE2:sc= -4.95 K(o=-5,f=-9.4!) USER MOD Single : A 66 THR OG1 : rot -96:sc= 1.41 USER MOD Single : A 68 MET CE :methyl -106:sc= -0.652 (180deg=-1.87) USER MOD Single : A 69 ASN : amide:sc= -0.327 X(o=-0.33,f=0) USER MOD Single : A 71 LYS NZ :NH3+ 158:sc= -0.0897 (180deg=-0.513) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot -169:sc= 1.91 USER MOD Single : A 81 MET CE :methyl -150:sc= 0 (180deg=-0.36) USER MOD Single : A 85 SER OG : rot 180:sc= 0.0742 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ -168:sc= 1.18 (180deg=1) USER MOD Single : A 96 GLN : amide:sc= -1.64! C(o=-1.6!,f=-3.7!) USER MOD Single : A 100 LYS NZ :NH3+ 176:sc= -0.336 (180deg=-0.364) USER MOD Single : A 103 THR OG1 : rot -160:sc= -0.636 USER MOD Single : A 111 LYS NZ :NH3+ 160:sc= 1.25 (180deg=0.648) USER MOD Single : A 112 GLN : amide:sc= -0.0162 X(o=-0.016,f=-0.016) USER MOD Single : A 113 LYS NZ :NH3+ 161:sc= 1.26 (180deg=1.23) USER MOD Single : A 117 CYS SG : rot 81:sc= 0.448 USER MOD Single : A 118 GLN : amide:sc= -3.13! C(o=-3.1!,f=-3.1!) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.167 -10.428 -3.743 1.00 0.00 N ATOM 2 CA GLY A 1 -11.693 -11.633 -4.359 1.00 0.00 C ATOM 3 C GLY A 1 -12.837 -11.295 -5.268 1.00 0.00 C ATOM 4 O GLY A 1 -13.426 -10.226 -5.128 1.00 0.00 O ATOM 0 H1 GLY A 1 -10.252 -10.638 -3.296 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.038 -9.695 -4.469 1.00 0.00 H new ATOM 0 H3 GLY A 1 -11.834 -10.087 -3.022 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.907 -12.134 -4.923 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -12.025 -12.329 -3.588 1.00 0.00 H new ATOM 10 N SER A 2 -13.147 -12.202 -6.201 1.00 0.00 N ATOM 11 CA SER A 2 -14.224 -12.045 -7.192 1.00 0.00 C ATOM 12 C SER A 2 -13.960 -10.878 -8.169 1.00 0.00 C ATOM 13 O SER A 2 -13.457 -11.089 -9.282 1.00 0.00 O ATOM 14 CB SER A 2 -15.593 -11.905 -6.505 1.00 0.00 C ATOM 15 OG SER A 2 -15.795 -12.957 -5.570 1.00 0.00 O ATOM 0 H SER A 2 -12.647 -13.086 -6.292 1.00 0.00 H new ATOM 0 HA SER A 2 -14.239 -12.955 -7.792 1.00 0.00 H new ATOM 0 HB2 SER A 2 -15.654 -10.943 -5.996 1.00 0.00 H new ATOM 0 HB3 SER A 2 -16.385 -11.920 -7.254 1.00 0.00 H new ATOM 0 HG SER A 2 -16.670 -12.850 -5.142 1.00 0.00 H new ATOM 21 N GLY A 3 -14.234 -9.663 -7.731 1.00 0.00 N ATOM 22 CA GLY A 3 -14.062 -8.509 -8.558 1.00 0.00 C ATOM 23 C GLY A 3 -12.659 -8.002 -8.453 1.00 0.00 C ATOM 24 O GLY A 3 -12.366 -7.116 -7.659 1.00 0.00 O ATOM 0 H GLY A 3 -14.580 -9.461 -6.793 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -14.290 -8.758 -9.594 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -14.762 -7.729 -8.257 1.00 0.00 H new ATOM 28 N GLU A 4 -11.798 -8.578 -9.222 1.00 0.00 N ATOM 29 CA GLU A 4 -10.395 -8.246 -9.202 1.00 0.00 C ATOM 30 C GLU A 4 -10.018 -7.351 -10.383 1.00 0.00 C ATOM 31 O GLU A 4 -8.981 -7.553 -11.026 1.00 0.00 O ATOM 32 CB GLU A 4 -9.540 -9.525 -9.179 1.00 0.00 C ATOM 33 CG GLU A 4 -9.719 -10.381 -7.920 1.00 0.00 C ATOM 34 CD GLU A 4 -9.373 -9.636 -6.643 1.00 0.00 C ATOM 35 OE1 GLU A 4 -8.169 -9.479 -6.324 1.00 0.00 O ATOM 36 OE2 GLU A 4 -10.286 -9.178 -5.941 1.00 0.00 O ATOM 0 H GLU A 4 -12.042 -9.304 -9.895 1.00 0.00 H new ATOM 0 HA GLU A 4 -10.193 -7.683 -8.291 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -9.787 -10.129 -10.053 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -8.490 -9.248 -9.269 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -10.752 -10.725 -7.865 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.091 -11.268 -7.998 1.00 0.00 H new ATOM 43 N GLU A 5 -10.846 -6.377 -10.654 1.00 0.00 N ATOM 44 CA GLU A 5 -10.637 -5.411 -11.612 1.00 0.00 C ATOM 45 C GLU A 5 -11.169 -4.160 -11.013 1.00 0.00 C ATOM 46 O GLU A 5 -11.561 -4.163 -9.829 1.00 0.00 O ATOM 47 CB GLU A 5 -11.311 -5.756 -12.957 1.00 0.00 C ATOM 48 CG GLU A 5 -12.789 -5.516 -12.966 1.00 0.00 C ATOM 49 CD GLU A 5 -13.588 -6.463 -12.111 1.00 0.00 C ATOM 50 OE1 GLU A 5 -13.703 -6.241 -10.894 1.00 0.00 O ATOM 51 OE2 GLU A 5 -14.144 -7.432 -12.647 1.00 0.00 O ATOM 0 H GLU A 5 -11.731 -6.261 -10.160 1.00 0.00 H new ATOM 0 HA GLU A 5 -9.581 -5.318 -11.866 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -10.850 -5.163 -13.747 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -11.120 -6.803 -13.191 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -12.979 -4.497 -12.630 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -13.148 -5.585 -13.993 1.00 0.00 H new ATOM 58 N ASP A 6 -11.150 -3.140 -11.805 1.00 0.00 N ATOM 59 CA ASP A 6 -11.636 -1.774 -11.477 1.00 0.00 C ATOM 60 C ASP A 6 -10.571 -0.921 -10.846 1.00 0.00 C ATOM 61 O ASP A 6 -10.766 0.251 -10.593 1.00 0.00 O ATOM 62 CB ASP A 6 -12.926 -1.866 -10.656 1.00 0.00 C ATOM 63 CG ASP A 6 -13.535 -0.571 -10.123 1.00 0.00 C ATOM 64 OD1 ASP A 6 -13.127 -0.083 -9.026 1.00 0.00 O ATOM 65 OD2 ASP A 6 -14.508 -0.079 -10.739 1.00 0.00 O ATOM 0 H ASP A 6 -10.783 -3.204 -12.755 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.880 -1.255 -12.404 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -13.678 -2.359 -11.272 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.733 -2.519 -9.805 1.00 0.00 H new ATOM 70 N GLU A 7 -9.439 -1.464 -10.675 1.00 0.00 N ATOM 71 CA GLU A 7 -8.387 -0.740 -10.145 1.00 0.00 C ATOM 72 C GLU A 7 -7.362 -0.590 -11.173 1.00 0.00 C ATOM 73 O GLU A 7 -7.072 -1.499 -11.955 1.00 0.00 O ATOM 74 CB GLU A 7 -7.878 -1.292 -8.799 1.00 0.00 C ATOM 75 CG GLU A 7 -7.243 -2.674 -8.840 1.00 0.00 C ATOM 76 CD GLU A 7 -8.179 -3.769 -9.172 1.00 0.00 C ATOM 77 OE1 GLU A 7 -8.869 -4.269 -8.250 1.00 0.00 O ATOM 78 OE2 GLU A 7 -8.219 -4.167 -10.330 1.00 0.00 O ATOM 0 H GLU A 7 -9.222 -2.434 -10.904 1.00 0.00 H new ATOM 0 HA GLU A 7 -8.734 0.256 -9.871 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -7.148 -0.591 -8.395 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -8.715 -1.319 -8.101 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -6.436 -2.668 -9.573 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -6.791 -2.881 -7.870 1.00 0.00 H new ATOM 85 N LYS A 8 -6.836 0.548 -11.171 1.00 0.00 N ATOM 86 CA LYS A 8 -5.965 0.949 -12.185 1.00 0.00 C ATOM 87 C LYS A 8 -4.615 1.368 -11.645 1.00 0.00 C ATOM 88 O LYS A 8 -4.484 1.676 -10.456 1.00 0.00 O ATOM 89 CB LYS A 8 -6.605 2.044 -13.030 1.00 0.00 C ATOM 90 CG LYS A 8 -7.098 3.231 -12.224 1.00 0.00 C ATOM 91 CD LYS A 8 -7.796 4.231 -13.106 1.00 0.00 C ATOM 92 CE LYS A 8 -8.340 5.391 -12.303 1.00 0.00 C ATOM 93 NZ LYS A 8 -9.006 6.383 -13.161 1.00 0.00 N ATOM 0 H LYS A 8 -6.998 1.251 -10.450 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.780 0.088 -12.828 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -5.880 2.392 -13.766 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -7.443 1.620 -13.584 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -7.780 2.888 -11.446 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -6.257 3.709 -11.722 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -7.100 4.602 -13.859 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.611 3.742 -13.639 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -9.046 5.020 -11.560 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -7.526 5.869 -11.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.594 7.323 -12.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -8.873 6.124 -14.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -10.022 6.405 -12.942 1.00 0.00 H new ATOM 107 N VAL A 9 -3.636 1.401 -12.525 1.00 0.00 N ATOM 108 CA VAL A 9 -2.285 1.720 -12.190 1.00 0.00 C ATOM 109 C VAL A 9 -2.162 3.179 -11.855 1.00 0.00 C ATOM 110 O VAL A 9 -2.504 4.068 -12.658 1.00 0.00 O ATOM 111 CB VAL A 9 -1.300 1.372 -13.343 1.00 0.00 C ATOM 112 CG1 VAL A 9 0.144 1.686 -12.951 1.00 0.00 C ATOM 113 CG2 VAL A 9 -1.432 -0.088 -13.746 1.00 0.00 C ATOM 0 H VAL A 9 -3.773 1.200 -13.516 1.00 0.00 H new ATOM 0 HA VAL A 9 -2.019 1.116 -11.323 1.00 0.00 H new ATOM 0 HB VAL A 9 -1.563 1.993 -14.199 1.00 0.00 H new ATOM 0 HG11 VAL A 9 0.809 1.432 -13.777 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.237 2.748 -12.724 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.418 1.102 -12.072 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -0.733 -0.307 -14.554 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -1.207 -0.724 -12.889 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -2.450 -0.281 -14.084 1.00 0.00 H new ATOM 123 N LEU A 10 -1.752 3.399 -10.670 1.00 0.00 N ATOM 124 CA LEU A 10 -1.464 4.718 -10.173 1.00 0.00 C ATOM 125 C LEU A 10 0.019 4.997 -10.415 1.00 0.00 C ATOM 126 O LEU A 10 0.383 5.842 -11.227 1.00 0.00 O ATOM 127 CB LEU A 10 -1.835 4.798 -8.667 1.00 0.00 C ATOM 128 CG LEU A 10 -1.991 6.199 -8.012 1.00 0.00 C ATOM 129 CD1 LEU A 10 -2.499 6.044 -6.594 1.00 0.00 C ATOM 130 CD2 LEU A 10 -0.685 6.986 -7.988 1.00 0.00 C ATOM 0 H LEU A 10 -1.597 2.659 -9.985 1.00 0.00 H new ATOM 0 HA LEU A 10 -2.053 5.475 -10.690 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.774 4.262 -8.529 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.072 4.255 -8.109 1.00 0.00 H new ATOM 0 HG LEU A 10 -2.703 6.758 -8.620 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -2.608 7.028 -6.137 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.466 5.541 -6.607 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -1.790 5.452 -6.016 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.853 7.956 -7.520 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.063 6.433 -7.419 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -0.330 7.132 -9.008 1.00 0.00 H new ATOM 142 N TYR A 11 0.852 4.246 -9.746 1.00 0.00 N ATOM 143 CA TYR A 11 2.299 4.393 -9.858 1.00 0.00 C ATOM 144 C TYR A 11 2.968 3.035 -9.737 1.00 0.00 C ATOM 145 O TYR A 11 2.503 2.180 -8.972 1.00 0.00 O ATOM 146 CB TYR A 11 2.830 5.367 -8.790 1.00 0.00 C ATOM 147 CG TYR A 11 4.312 5.679 -8.887 1.00 0.00 C ATOM 148 CD1 TYR A 11 4.765 6.691 -9.722 1.00 0.00 C ATOM 149 CD2 TYR A 11 5.253 4.963 -8.153 1.00 0.00 C ATOM 150 CE1 TYR A 11 6.107 6.980 -9.829 1.00 0.00 C ATOM 151 CE2 TYR A 11 6.598 5.249 -8.252 1.00 0.00 C ATOM 152 CZ TYR A 11 7.019 6.260 -9.092 1.00 0.00 C ATOM 153 OH TYR A 11 8.366 6.537 -9.212 1.00 0.00 O ATOM 0 H TYR A 11 0.557 3.510 -9.104 1.00 0.00 H new ATOM 0 HA TYR A 11 2.537 4.810 -10.836 1.00 0.00 H new ATOM 0 HB2 TYR A 11 2.272 6.301 -8.862 1.00 0.00 H new ATOM 0 HB3 TYR A 11 2.626 4.948 -7.804 1.00 0.00 H new ATOM 0 HD1 TYR A 11 4.052 7.262 -10.298 1.00 0.00 H new ATOM 0 HD2 TYR A 11 4.925 4.171 -7.496 1.00 0.00 H new ATOM 0 HE1 TYR A 11 6.442 7.768 -10.488 1.00 0.00 H new ATOM 0 HE2 TYR A 11 7.317 4.686 -7.676 1.00 0.00 H new ATOM 0 HH TYR A 11 8.757 6.651 -8.321 1.00 0.00 H new ATOM 163 N SER A 12 3.991 2.830 -10.537 1.00 0.00 N ATOM 164 CA SER A 12 4.749 1.631 -10.589 1.00 0.00 C ATOM 165 C SER A 12 6.288 1.874 -10.523 1.00 0.00 C ATOM 166 O SER A 12 6.821 2.705 -11.280 1.00 0.00 O ATOM 167 CB SER A 12 4.355 0.938 -11.864 1.00 0.00 C ATOM 168 OG SER A 12 4.253 1.837 -12.968 1.00 0.00 O ATOM 0 H SER A 12 4.320 3.537 -11.194 1.00 0.00 H new ATOM 0 HA SER A 12 4.532 1.017 -9.715 1.00 0.00 H new ATOM 0 HB2 SER A 12 5.089 0.166 -12.095 1.00 0.00 H new ATOM 0 HB3 SER A 12 3.399 0.436 -11.720 1.00 0.00 H new ATOM 0 HG SER A 12 3.997 1.339 -13.772 1.00 0.00 H new ATOM 174 N GLN A 13 6.986 1.195 -9.593 1.00 0.00 N ATOM 175 CA GLN A 13 8.465 1.269 -9.523 1.00 0.00 C ATOM 176 C GLN A 13 9.071 -0.020 -8.974 1.00 0.00 C ATOM 177 O GLN A 13 8.438 -0.722 -8.242 1.00 0.00 O ATOM 178 CB GLN A 13 8.957 2.489 -8.732 1.00 0.00 C ATOM 179 CG GLN A 13 10.406 2.868 -9.005 1.00 0.00 C ATOM 180 CD GLN A 13 10.983 3.828 -7.997 1.00 0.00 C ATOM 181 OE1 GLN A 13 11.601 3.411 -7.018 1.00 0.00 O ATOM 182 NE2 GLN A 13 10.764 5.097 -8.193 1.00 0.00 N ATOM 0 H GLN A 13 6.560 0.595 -8.886 1.00 0.00 H new ATOM 0 HA GLN A 13 8.812 1.392 -10.549 1.00 0.00 H new ATOM 0 HB2 GLN A 13 8.320 3.341 -8.968 1.00 0.00 H new ATOM 0 HB3 GLN A 13 8.840 2.288 -7.667 1.00 0.00 H new ATOM 0 HG2 GLN A 13 11.012 1.962 -9.019 1.00 0.00 H new ATOM 0 HG3 GLN A 13 10.475 3.313 -9.998 1.00 0.00 H new ATOM 0 HE21 GLN A 13 10.247 5.404 -9.017 1.00 0.00 H new ATOM 0 HE22 GLN A 13 11.109 5.784 -7.522 1.00 0.00 H new ATOM 191 N ARG A 14 10.328 -0.276 -9.292 1.00 0.00 N ATOM 192 CA ARG A 14 11.008 -1.461 -8.831 1.00 0.00 C ATOM 193 C ARG A 14 11.420 -1.317 -7.382 1.00 0.00 C ATOM 194 O ARG A 14 12.084 -0.357 -6.984 1.00 0.00 O ATOM 195 CB ARG A 14 12.222 -1.797 -9.706 1.00 0.00 C ATOM 196 CG ARG A 14 11.864 -2.335 -11.081 1.00 0.00 C ATOM 197 CD ARG A 14 13.097 -2.527 -11.964 1.00 0.00 C ATOM 198 NE ARG A 14 14.134 -3.378 -11.353 1.00 0.00 N ATOM 199 CZ ARG A 14 14.773 -4.390 -11.977 1.00 0.00 C ATOM 200 NH1 ARG A 14 14.341 -4.847 -13.140 1.00 0.00 N ATOM 201 NH2 ARG A 14 15.820 -4.969 -11.406 1.00 0.00 N ATOM 0 H ARG A 14 10.900 0.334 -9.876 1.00 0.00 H new ATOM 0 HA ARG A 14 10.305 -2.290 -8.911 1.00 0.00 H new ATOM 0 HB2 ARG A 14 12.830 -0.900 -9.825 1.00 0.00 H new ATOM 0 HB3 ARG A 14 12.837 -2.533 -9.188 1.00 0.00 H new ATOM 0 HG2 ARG A 14 11.345 -3.287 -10.973 1.00 0.00 H new ATOM 0 HG3 ARG A 14 11.173 -1.648 -11.569 1.00 0.00 H new ATOM 0 HD2 ARG A 14 12.789 -2.968 -12.912 1.00 0.00 H new ATOM 0 HD3 ARG A 14 13.527 -1.551 -12.191 1.00 0.00 H new ATOM 0 HE ARG A 14 14.388 -3.187 -10.384 1.00 0.00 H new ATOM 0 HH11 ARG A 14 13.516 -4.434 -13.576 1.00 0.00 H new ATOM 0 HH12 ARG A 14 14.833 -5.612 -13.602 1.00 0.00 H new ATOM 0 HH21 ARG A 14 16.144 -4.650 -10.493 1.00 0.00 H new ATOM 0 HH22 ARG A 14 16.301 -5.734 -11.880 1.00 0.00 H new ATOM 215 N VAL A 15 11.000 -2.273 -6.641 1.00 0.00 N ATOM 216 CA VAL A 15 11.172 -2.372 -5.232 1.00 0.00 C ATOM 217 C VAL A 15 11.731 -3.777 -4.936 1.00 0.00 C ATOM 218 O VAL A 15 11.884 -4.599 -5.866 1.00 0.00 O ATOM 219 CB VAL A 15 9.770 -2.222 -4.548 1.00 0.00 C ATOM 220 CG1 VAL A 15 8.914 -3.488 -4.705 1.00 0.00 C ATOM 221 CG2 VAL A 15 9.881 -1.795 -3.100 1.00 0.00 C ATOM 0 H VAL A 15 10.489 -3.067 -7.027 1.00 0.00 H new ATOM 0 HA VAL A 15 11.846 -1.601 -4.859 1.00 0.00 H new ATOM 0 HB VAL A 15 9.253 -1.419 -5.074 1.00 0.00 H new ATOM 0 HG11 VAL A 15 7.951 -3.339 -4.216 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.755 -3.691 -5.764 1.00 0.00 H new ATOM 0 HG13 VAL A 15 9.427 -4.333 -4.246 1.00 0.00 H new ATOM 0 HG21 VAL A 15 8.884 -1.705 -2.670 1.00 0.00 H new ATOM 0 HG22 VAL A 15 10.450 -2.540 -2.544 1.00 0.00 H new ATOM 0 HG23 VAL A 15 10.389 -0.833 -3.042 1.00 0.00 H new ATOM 231 N LYS A 16 12.063 -4.033 -3.703 1.00 0.00 N ATOM 232 CA LYS A 16 12.455 -5.349 -3.265 1.00 0.00 C ATOM 233 C LYS A 16 11.366 -5.806 -2.327 1.00 0.00 C ATOM 234 O LYS A 16 10.955 -5.016 -1.462 1.00 0.00 O ATOM 235 CB LYS A 16 13.776 -5.286 -2.498 1.00 0.00 C ATOM 236 CG LYS A 16 14.905 -4.614 -3.253 1.00 0.00 C ATOM 237 CD LYS A 16 16.202 -4.603 -2.457 1.00 0.00 C ATOM 238 CE LYS A 16 16.752 -6.007 -2.226 1.00 0.00 C ATOM 239 NZ LYS A 16 18.050 -5.985 -1.525 1.00 0.00 N ATOM 0 H LYS A 16 12.070 -3.330 -2.964 1.00 0.00 H new ATOM 0 HA LYS A 16 12.589 -6.022 -4.112 1.00 0.00 H new ATOM 0 HB2 LYS A 16 13.613 -4.753 -1.561 1.00 0.00 H new ATOM 0 HB3 LYS A 16 14.081 -6.300 -2.239 1.00 0.00 H new ATOM 0 HG2 LYS A 16 15.066 -5.131 -4.199 1.00 0.00 H new ATOM 0 HG3 LYS A 16 14.620 -3.590 -3.494 1.00 0.00 H new ATOM 0 HD2 LYS A 16 16.945 -4.007 -2.986 1.00 0.00 H new ATOM 0 HD3 LYS A 16 16.031 -4.119 -1.495 1.00 0.00 H new ATOM 0 HE2 LYS A 16 16.035 -6.586 -1.643 1.00 0.00 H new ATOM 0 HE3 LYS A 16 16.866 -6.514 -3.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 18.387 -6.959 -1.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 18.742 -5.455 -2.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 17.937 -5.525 -0.599 1.00 0.00 H new ATOM 253 N LEU A 17 10.878 -7.034 -2.452 1.00 0.00 N ATOM 254 CA LEU A 17 9.836 -7.447 -1.596 1.00 0.00 C ATOM 255 C LEU A 17 10.451 -8.369 -0.603 1.00 0.00 C ATOM 256 O LEU A 17 11.437 -9.033 -0.904 1.00 0.00 O ATOM 257 CB LEU A 17 8.697 -8.128 -2.382 1.00 0.00 C ATOM 258 CG LEU A 17 7.507 -8.629 -1.580 1.00 0.00 C ATOM 259 CD1 LEU A 17 6.792 -7.466 -0.901 1.00 0.00 C ATOM 260 CD2 LEU A 17 6.567 -9.427 -2.482 1.00 0.00 C ATOM 0 H LEU A 17 11.195 -7.728 -3.129 1.00 0.00 H new ATOM 0 HA LEU A 17 9.377 -6.594 -1.097 1.00 0.00 H new ATOM 0 HB2 LEU A 17 8.330 -7.422 -3.127 1.00 0.00 H new ATOM 0 HB3 LEU A 17 9.119 -8.973 -2.925 1.00 0.00 H new ATOM 0 HG LEU A 17 7.859 -9.296 -0.793 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.943 -7.844 -0.331 1.00 0.00 H new ATOM 0 HD12 LEU A 17 7.483 -6.957 -0.229 1.00 0.00 H new ATOM 0 HD13 LEU A 17 6.439 -6.765 -1.657 1.00 0.00 H new ATOM 0 HD21 LEU A 17 5.717 -9.782 -1.899 1.00 0.00 H new ATOM 0 HD22 LEU A 17 6.211 -8.789 -3.291 1.00 0.00 H new ATOM 0 HD23 LEU A 17 7.101 -10.280 -2.901 1.00 0.00 H new ATOM 272 N PHE A 18 9.931 -8.372 0.550 1.00 0.00 N ATOM 273 CA PHE A 18 10.414 -9.173 1.640 1.00 0.00 C ATOM 274 C PHE A 18 9.247 -9.767 2.376 1.00 0.00 C ATOM 275 O PHE A 18 8.217 -9.189 2.396 1.00 0.00 O ATOM 276 CB PHE A 18 11.187 -8.303 2.630 1.00 0.00 C ATOM 277 CG PHE A 18 12.554 -7.818 2.221 1.00 0.00 C ATOM 278 CD1 PHE A 18 12.706 -6.717 1.392 1.00 0.00 C ATOM 279 CD2 PHE A 18 13.691 -8.446 2.702 1.00 0.00 C ATOM 280 CE1 PHE A 18 13.962 -6.262 1.047 1.00 0.00 C ATOM 281 CE2 PHE A 18 14.950 -7.996 2.357 1.00 0.00 C ATOM 282 CZ PHE A 18 15.086 -6.902 1.527 1.00 0.00 C ATOM 0 H PHE A 18 9.122 -7.800 0.794 1.00 0.00 H new ATOM 0 HA PHE A 18 11.061 -9.952 1.236 1.00 0.00 H new ATOM 0 HB2 PHE A 18 10.576 -7.429 2.857 1.00 0.00 H new ATOM 0 HB3 PHE A 18 11.295 -8.866 3.557 1.00 0.00 H new ATOM 0 HD1 PHE A 18 11.831 -6.210 1.012 1.00 0.00 H new ATOM 0 HD2 PHE A 18 13.591 -9.300 3.356 1.00 0.00 H new ATOM 0 HE1 PHE A 18 14.065 -5.403 0.400 1.00 0.00 H new ATOM 0 HE2 PHE A 18 15.827 -8.499 2.736 1.00 0.00 H new ATOM 0 HZ PHE A 18 16.069 -6.548 1.254 1.00 0.00 H new ATOM 292 N ARG A 19 9.440 -10.910 2.961 1.00 0.00 N ATOM 293 CA ARG A 19 8.540 -11.551 3.790 1.00 0.00 C ATOM 294 C ARG A 19 9.075 -11.637 5.140 1.00 0.00 C ATOM 295 O ARG A 19 10.269 -11.729 5.359 1.00 0.00 O ATOM 296 CB ARG A 19 8.256 -12.946 3.360 1.00 0.00 C ATOM 297 CG ARG A 19 9.458 -13.773 2.895 1.00 0.00 C ATOM 298 CD ARG A 19 9.124 -15.253 2.794 1.00 0.00 C ATOM 299 NE ARG A 19 9.096 -15.911 4.111 1.00 0.00 N ATOM 300 CZ ARG A 19 8.051 -16.572 4.648 1.00 0.00 C ATOM 301 NH1 ARG A 19 6.827 -16.459 4.141 1.00 0.00 N ATOM 302 NH2 ARG A 19 8.250 -17.322 5.711 1.00 0.00 N ATOM 0 H ARG A 19 10.306 -11.436 2.844 1.00 0.00 H new ATOM 0 HA ARG A 19 7.624 -10.962 3.747 1.00 0.00 H new ATOM 0 HB2 ARG A 19 7.782 -13.470 4.190 1.00 0.00 H new ATOM 0 HB3 ARG A 19 7.530 -12.912 2.548 1.00 0.00 H new ATOM 0 HG2 ARG A 19 9.794 -13.410 1.924 1.00 0.00 H new ATOM 0 HG3 ARG A 19 10.285 -13.634 3.591 1.00 0.00 H new ATOM 0 HD2 ARG A 19 8.155 -15.372 2.310 1.00 0.00 H new ATOM 0 HD3 ARG A 19 9.860 -15.747 2.159 1.00 0.00 H new ATOM 0 HE ARG A 19 9.948 -15.862 4.670 1.00 0.00 H new ATOM 0 HH11 ARG A 19 6.664 -15.863 3.330 1.00 0.00 H new ATOM 0 HH12 ARG A 19 6.051 -16.968 4.564 1.00 0.00 H new ATOM 0 HH21 ARG A 19 9.183 -17.396 6.115 1.00 0.00 H new ATOM 0 HH22 ARG A 19 7.471 -17.829 6.130 1.00 0.00 H new ATOM 316 N PHE A 20 8.203 -11.587 5.998 1.00 0.00 N ATOM 317 CA PHE A 20 8.445 -11.724 7.363 1.00 0.00 C ATOM 318 C PHE A 20 8.388 -13.181 7.576 1.00 0.00 C ATOM 319 O PHE A 20 7.416 -13.845 7.179 1.00 0.00 O ATOM 320 CB PHE A 20 7.332 -11.106 8.187 1.00 0.00 C ATOM 321 CG PHE A 20 7.683 -10.813 9.621 1.00 0.00 C ATOM 322 CD1 PHE A 20 8.400 -9.677 9.955 1.00 0.00 C ATOM 323 CD2 PHE A 20 7.291 -11.675 10.635 1.00 0.00 C ATOM 324 CE1 PHE A 20 8.719 -9.405 11.272 1.00 0.00 C ATOM 325 CE2 PHE A 20 7.605 -11.408 11.949 1.00 0.00 C ATOM 326 CZ PHE A 20 8.320 -10.272 12.268 1.00 0.00 C ATOM 0 H PHE A 20 7.219 -11.439 5.776 1.00 0.00 H new ATOM 0 HA PHE A 20 9.381 -11.246 7.652 1.00 0.00 H new ATOM 0 HB2 PHE A 20 7.020 -10.177 7.709 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.473 -11.777 8.170 1.00 0.00 H new ATOM 0 HD1 PHE A 20 8.714 -8.996 9.178 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.733 -12.567 10.391 1.00 0.00 H new ATOM 0 HE1 PHE A 20 9.279 -8.516 11.521 1.00 0.00 H new ATOM 0 HE2 PHE A 20 7.292 -12.087 12.729 1.00 0.00 H new ATOM 0 HZ PHE A 20 8.567 -10.061 13.298 1.00 0.00 H new ATOM 336 N ASP A 21 9.381 -13.683 8.101 1.00 0.00 N ATOM 337 CA ASP A 21 9.402 -15.060 8.392 1.00 0.00 C ATOM 338 C ASP A 21 8.850 -15.260 9.708 1.00 0.00 C ATOM 339 O ASP A 21 9.267 -14.679 10.630 1.00 0.00 O ATOM 340 CB ASP A 21 10.759 -15.696 8.344 1.00 0.00 C ATOM 341 CG ASP A 21 10.616 -17.047 7.734 1.00 0.00 C ATOM 342 OD1 ASP A 21 10.285 -17.983 8.450 1.00 0.00 O ATOM 343 OD2 ASP A 21 10.817 -17.184 6.507 1.00 0.00 O ATOM 0 H ASP A 21 10.226 -13.172 8.356 1.00 0.00 H new ATOM 0 HA ASP A 21 8.814 -15.541 7.610 1.00 0.00 H new ATOM 0 HB2 ASP A 21 11.445 -15.085 7.758 1.00 0.00 H new ATOM 0 HB3 ASP A 21 11.178 -15.774 9.347 1.00 0.00 H new ATOM 348 N ALA A 22 7.862 -15.970 9.739 1.00 0.00 N ATOM 349 CA ALA A 22 7.201 -16.356 10.961 1.00 0.00 C ATOM 350 C ALA A 22 8.081 -17.312 11.731 1.00 0.00 C ATOM 351 O ALA A 22 8.147 -17.276 12.966 1.00 0.00 O ATOM 352 CB ALA A 22 5.854 -16.966 10.687 1.00 0.00 C ATOM 0 H ALA A 22 7.423 -16.349 8.900 1.00 0.00 H new ATOM 0 HA ALA A 22 7.033 -15.463 11.563 1.00 0.00 H new ATOM 0 HB1 ALA A 22 5.383 -17.246 11.629 1.00 0.00 H new ATOM 0 HB2 ALA A 22 5.226 -16.242 10.168 1.00 0.00 H new ATOM 0 HB3 ALA A 22 5.976 -17.853 10.065 1.00 0.00 H new ATOM 358 N GLU A 23 8.786 -18.151 10.987 1.00 0.00 N ATOM 359 CA GLU A 23 9.663 -19.110 11.569 1.00 0.00 C ATOM 360 C GLU A 23 10.970 -18.470 11.939 1.00 0.00 C ATOM 361 O GLU A 23 11.582 -18.834 12.926 1.00 0.00 O ATOM 362 CB GLU A 23 9.906 -20.276 10.634 1.00 0.00 C ATOM 363 CG GLU A 23 8.655 -21.046 10.298 1.00 0.00 C ATOM 364 CD GLU A 23 7.857 -21.421 11.522 1.00 0.00 C ATOM 365 OE1 GLU A 23 8.380 -22.141 12.393 1.00 0.00 O ATOM 366 OE2 GLU A 23 6.700 -20.964 11.654 1.00 0.00 O ATOM 0 H GLU A 23 8.755 -18.173 9.968 1.00 0.00 H new ATOM 0 HA GLU A 23 9.183 -19.491 12.470 1.00 0.00 H new ATOM 0 HB2 GLU A 23 10.354 -19.905 9.712 1.00 0.00 H new ATOM 0 HB3 GLU A 23 10.629 -20.953 11.090 1.00 0.00 H new ATOM 0 HG2 GLU A 23 8.033 -20.448 9.633 1.00 0.00 H new ATOM 0 HG3 GLU A 23 8.925 -21.951 9.754 1.00 0.00 H new ATOM 373 N VAL A 24 11.383 -17.461 11.180 1.00 0.00 N ATOM 374 CA VAL A 24 12.675 -16.820 11.491 1.00 0.00 C ATOM 375 C VAL A 24 12.455 -15.591 12.290 1.00 0.00 C ATOM 376 O VAL A 24 13.389 -14.997 12.849 1.00 0.00 O ATOM 377 CB VAL A 24 13.525 -16.442 10.247 1.00 0.00 C ATOM 378 CG1 VAL A 24 14.987 -16.192 10.589 1.00 0.00 C ATOM 379 CG2 VAL A 24 13.405 -17.472 9.230 1.00 0.00 C ATOM 0 H VAL A 24 10.878 -17.077 10.381 1.00 0.00 H new ATOM 0 HA VAL A 24 13.236 -17.571 12.047 1.00 0.00 H new ATOM 0 HB VAL A 24 13.131 -15.503 9.859 1.00 0.00 H new ATOM 0 HG11 VAL A 24 15.533 -15.932 9.682 1.00 0.00 H new ATOM 0 HG12 VAL A 24 15.058 -15.372 11.304 1.00 0.00 H new ATOM 0 HG13 VAL A 24 15.418 -17.093 11.026 1.00 0.00 H new ATOM 0 HG21 VAL A 24 14.004 -17.198 8.362 1.00 0.00 H new ATOM 0 HG22 VAL A 24 13.760 -18.422 9.630 1.00 0.00 H new ATOM 0 HG23 VAL A 24 12.361 -17.570 8.933 1.00 0.00 H new ATOM 389 N SER A 25 11.196 -15.244 12.381 1.00 0.00 N ATOM 390 CA SER A 25 10.755 -13.973 12.878 1.00 0.00 C ATOM 391 C SER A 25 11.442 -12.898 12.144 1.00 0.00 C ATOM 392 O SER A 25 11.665 -11.797 12.693 1.00 0.00 O ATOM 393 CB SER A 25 11.005 -13.895 14.322 1.00 0.00 C ATOM 394 OG SER A 25 9.963 -14.497 15.074 1.00 0.00 O ATOM 0 H SER A 25 10.431 -15.858 12.102 1.00 0.00 H new ATOM 0 HA SER A 25 9.683 -13.856 12.721 1.00 0.00 H new ATOM 0 HB2 SER A 25 11.950 -14.386 14.554 1.00 0.00 H new ATOM 0 HB3 SER A 25 11.108 -12.851 14.616 1.00 0.00 H new ATOM 0 HG SER A 25 10.167 -14.426 16.030 1.00 0.00 H new ATOM 400 N GLN A 26 11.731 -13.133 10.861 1.00 0.00 N ATOM 401 CA GLN A 26 12.587 -12.166 10.307 1.00 0.00 C ATOM 402 C GLN A 26 12.333 -11.883 8.826 1.00 0.00 C ATOM 403 O GLN A 26 11.829 -12.721 8.116 1.00 0.00 O ATOM 404 CB GLN A 26 14.031 -12.582 10.550 1.00 0.00 C ATOM 405 CG GLN A 26 15.086 -11.539 10.228 1.00 0.00 C ATOM 406 CD GLN A 26 16.475 -11.956 10.662 1.00 0.00 C ATOM 407 OE1 GLN A 26 17.311 -11.117 11.005 1.00 0.00 O ATOM 408 NE2 GLN A 26 16.749 -13.233 10.634 1.00 0.00 N ATOM 0 H GLN A 26 11.413 -13.900 10.269 1.00 0.00 H new ATOM 0 HA GLN A 26 12.376 -11.223 10.811 1.00 0.00 H new ATOM 0 HB2 GLN A 26 14.136 -12.865 11.597 1.00 0.00 H new ATOM 0 HB3 GLN A 26 14.236 -13.473 9.957 1.00 0.00 H new ATOM 0 HG2 GLN A 26 15.087 -11.350 9.155 1.00 0.00 H new ATOM 0 HG3 GLN A 26 14.824 -10.601 10.717 1.00 0.00 H new ATOM 0 HE21 GLN A 26 16.035 -13.902 10.345 1.00 0.00 H new ATOM 0 HE22 GLN A 26 17.677 -13.561 10.901 1.00 0.00 H new ATOM 417 N TRP A 27 12.734 -10.713 8.389 1.00 0.00 N ATOM 418 CA TRP A 27 12.637 -10.266 7.064 1.00 0.00 C ATOM 419 C TRP A 27 13.553 -11.071 6.118 1.00 0.00 C ATOM 420 O TRP A 27 14.765 -11.180 6.319 1.00 0.00 O ATOM 421 CB TRP A 27 12.957 -8.769 7.058 1.00 0.00 C ATOM 422 CG TRP A 27 14.114 -8.363 7.949 1.00 0.00 C ATOM 423 CD1 TRP A 27 14.048 -8.075 9.282 1.00 0.00 C ATOM 424 CD2 TRP A 27 15.490 -8.181 7.572 1.00 0.00 C ATOM 425 NE1 TRP A 27 15.283 -7.765 9.761 1.00 0.00 N ATOM 426 CE2 TRP A 27 16.190 -7.810 8.736 1.00 0.00 C ATOM 427 CE3 TRP A 27 16.198 -8.304 6.369 1.00 0.00 C ATOM 428 CZ2 TRP A 27 17.561 -7.564 8.735 1.00 0.00 C ATOM 429 CZ3 TRP A 27 17.556 -8.055 6.371 1.00 0.00 C ATOM 430 CH2 TRP A 27 18.226 -7.689 7.546 1.00 0.00 C ATOM 0 H TRP A 27 13.160 -10.022 9.006 1.00 0.00 H new ATOM 0 HA TRP A 27 11.628 -10.425 6.684 1.00 0.00 H new ATOM 0 HB2 TRP A 27 13.179 -8.463 6.036 1.00 0.00 H new ATOM 0 HB3 TRP A 27 12.068 -8.220 7.368 1.00 0.00 H new ATOM 0 HD1 TRP A 27 13.144 -8.091 9.872 1.00 0.00 H new ATOM 0 HE1 TRP A 27 15.499 -7.535 10.731 1.00 0.00 H new ATOM 0 HE3 TRP A 27 15.691 -8.588 5.458 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 18.080 -7.285 9.640 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 18.112 -8.144 5.450 1.00 0.00 H new ATOM 0 HH2 TRP A 27 19.289 -7.502 7.512 1.00 0.00 H new ATOM 441 N LYS A 28 12.935 -11.663 5.148 1.00 0.00 N ATOM 442 CA LYS A 28 13.572 -12.470 4.109 1.00 0.00 C ATOM 443 C LYS A 28 13.034 -12.002 2.797 1.00 0.00 C ATOM 444 O LYS A 28 11.868 -11.740 2.704 1.00 0.00 O ATOM 445 CB LYS A 28 13.222 -13.946 4.368 1.00 0.00 C ATOM 446 CG LYS A 28 13.676 -14.950 3.316 1.00 0.00 C ATOM 447 CD LYS A 28 13.110 -16.342 3.614 1.00 0.00 C ATOM 448 CE LYS A 28 13.667 -16.928 4.908 1.00 0.00 C ATOM 449 NZ LYS A 28 12.986 -18.187 5.280 1.00 0.00 N ATOM 0 H LYS A 28 11.923 -11.606 5.036 1.00 0.00 H new ATOM 0 HA LYS A 28 14.657 -12.371 4.108 1.00 0.00 H new ATOM 0 HB2 LYS A 28 13.656 -14.236 5.325 1.00 0.00 H new ATOM 0 HB3 LYS A 28 12.140 -14.026 4.471 1.00 0.00 H new ATOM 0 HG2 LYS A 28 13.349 -14.623 2.329 1.00 0.00 H new ATOM 0 HG3 LYS A 28 14.765 -14.992 3.293 1.00 0.00 H new ATOM 0 HD2 LYS A 28 12.024 -16.283 3.682 1.00 0.00 H new ATOM 0 HD3 LYS A 28 13.342 -17.011 2.785 1.00 0.00 H new ATOM 0 HE2 LYS A 28 14.735 -17.113 4.793 1.00 0.00 H new ATOM 0 HE3 LYS A 28 13.554 -16.202 5.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 13.592 -18.731 5.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 12.085 -17.968 5.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 12.802 -18.748 4.424 1.00 0.00 H new ATOM 463 N GLU A 29 13.857 -11.891 1.788 1.00 0.00 N ATOM 464 CA GLU A 29 13.426 -11.347 0.610 1.00 0.00 C ATOM 465 C GLU A 29 12.531 -12.251 -0.181 1.00 0.00 C ATOM 466 O GLU A 29 12.675 -13.473 -0.206 1.00 0.00 O ATOM 467 CB GLU A 29 14.510 -10.563 -0.180 1.00 0.00 C ATOM 468 CG GLU A 29 15.882 -11.221 -0.307 1.00 0.00 C ATOM 469 CD GLU A 29 15.931 -12.372 -1.265 1.00 0.00 C ATOM 470 OE1 GLU A 29 15.625 -13.511 -0.870 1.00 0.00 O ATOM 471 OE2 GLU A 29 16.321 -12.160 -2.429 1.00 0.00 O ATOM 0 H GLU A 29 14.834 -12.185 1.798 1.00 0.00 H new ATOM 0 HA GLU A 29 12.751 -10.540 0.894 1.00 0.00 H new ATOM 0 HB2 GLU A 29 14.129 -10.376 -1.184 1.00 0.00 H new ATOM 0 HB3 GLU A 29 14.642 -9.592 0.297 1.00 0.00 H new ATOM 0 HG2 GLU A 29 16.604 -10.469 -0.625 1.00 0.00 H new ATOM 0 HG3 GLU A 29 16.197 -11.569 0.677 1.00 0.00 H new ATOM 478 N ARG A 30 11.574 -11.639 -0.742 1.00 0.00 N ATOM 479 CA ARG A 30 10.550 -12.312 -1.510 1.00 0.00 C ATOM 480 C ARG A 30 10.927 -12.267 -2.959 1.00 0.00 C ATOM 481 O ARG A 30 10.546 -13.126 -3.748 1.00 0.00 O ATOM 482 CB ARG A 30 9.188 -11.627 -1.363 1.00 0.00 C ATOM 483 CG ARG A 30 8.299 -12.064 -0.201 1.00 0.00 C ATOM 484 CD ARG A 30 7.719 -13.463 -0.423 1.00 0.00 C ATOM 485 NE ARG A 30 6.691 -13.830 0.590 1.00 0.00 N ATOM 486 CZ ARG A 30 6.198 -15.075 0.764 1.00 0.00 C ATOM 487 NH1 ARG A 30 6.682 -16.090 0.052 1.00 0.00 N ATOM 488 NH2 ARG A 30 5.244 -15.309 1.675 1.00 0.00 N ATOM 0 H ARG A 30 11.453 -10.627 -0.695 1.00 0.00 H new ATOM 0 HA ARG A 30 10.473 -13.335 -1.141 1.00 0.00 H new ATOM 0 HB2 ARG A 30 9.360 -10.555 -1.270 1.00 0.00 H new ATOM 0 HB3 ARG A 30 8.632 -11.782 -2.288 1.00 0.00 H new ATOM 0 HG2 ARG A 30 8.877 -12.053 0.723 1.00 0.00 H new ATOM 0 HG3 ARG A 30 7.486 -11.349 -0.077 1.00 0.00 H new ATOM 0 HD2 ARG A 30 7.276 -13.514 -1.418 1.00 0.00 H new ATOM 0 HD3 ARG A 30 8.527 -14.195 -0.396 1.00 0.00 H new ATOM 0 HE ARG A 30 6.335 -13.090 1.194 1.00 0.00 H new ATOM 0 HH11 ARG A 30 7.426 -15.928 -0.626 1.00 0.00 H new ATOM 0 HH12 ARG A 30 6.309 -17.030 0.185 1.00 0.00 H new ATOM 0 HH21 ARG A 30 4.884 -14.543 2.244 1.00 0.00 H new ATOM 0 HH22 ARG A 30 4.878 -16.253 1.799 1.00 0.00 H new ATOM 502 N GLY A 31 11.637 -11.229 -3.313 1.00 0.00 N ATOM 503 CA GLY A 31 12.045 -11.041 -4.637 1.00 0.00 C ATOM 504 C GLY A 31 12.307 -9.596 -4.905 1.00 0.00 C ATOM 505 O GLY A 31 12.533 -8.808 -3.979 1.00 0.00 O ATOM 0 H GLY A 31 11.939 -10.498 -2.669 1.00 0.00 H new ATOM 0 HA2 GLY A 31 12.947 -11.622 -4.832 1.00 0.00 H new ATOM 0 HA3 GLY A 31 11.276 -11.409 -5.316 1.00 0.00 H new ATOM 509 N LEU A 32 12.190 -9.258 -6.129 1.00 0.00 N ATOM 510 CA LEU A 32 12.477 -7.951 -6.678 1.00 0.00 C ATOM 511 C LEU A 32 11.427 -7.688 -7.735 1.00 0.00 C ATOM 512 O LEU A 32 10.960 -8.639 -8.383 1.00 0.00 O ATOM 513 CB LEU A 32 13.846 -7.980 -7.392 1.00 0.00 C ATOM 514 CG LEU A 32 15.068 -8.414 -6.573 1.00 0.00 C ATOM 515 CD1 LEU A 32 16.275 -8.571 -7.479 1.00 0.00 C ATOM 516 CD2 LEU A 32 15.367 -7.408 -5.481 1.00 0.00 C ATOM 0 H LEU A 32 11.871 -9.916 -6.840 1.00 0.00 H new ATOM 0 HA LEU A 32 12.483 -7.197 -5.891 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.763 -8.647 -8.250 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.042 -6.981 -7.783 1.00 0.00 H new ATOM 0 HG LEU A 32 14.845 -9.374 -6.107 1.00 0.00 H new ATOM 0 HD11 LEU A 32 17.137 -8.879 -6.887 1.00 0.00 H new ATOM 0 HD12 LEU A 32 16.066 -9.327 -8.236 1.00 0.00 H new ATOM 0 HD13 LEU A 32 16.491 -7.620 -7.966 1.00 0.00 H new ATOM 0 HD21 LEU A 32 16.237 -7.736 -4.913 1.00 0.00 H new ATOM 0 HD22 LEU A 32 15.571 -6.435 -5.928 1.00 0.00 H new ATOM 0 HD23 LEU A 32 14.508 -7.328 -4.815 1.00 0.00 H new ATOM 528 N GLY A 33 11.031 -6.460 -7.920 1.00 0.00 N ATOM 529 CA GLY A 33 10.101 -6.208 -8.967 1.00 0.00 C ATOM 530 C GLY A 33 9.435 -4.884 -8.886 1.00 0.00 C ATOM 531 O GLY A 33 9.718 -4.102 -8.022 1.00 0.00 O ATOM 0 H GLY A 33 11.328 -5.649 -7.378 1.00 0.00 H new ATOM 0 HA2 GLY A 33 10.619 -6.283 -9.923 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.338 -6.987 -8.955 1.00 0.00 H new ATOM 535 N ASN A 34 8.538 -4.671 -9.786 1.00 0.00 N ATOM 536 CA ASN A 34 7.796 -3.455 -9.926 1.00 0.00 C ATOM 537 C ASN A 34 6.622 -3.494 -9.065 1.00 0.00 C ATOM 538 O ASN A 34 5.752 -4.387 -9.140 1.00 0.00 O ATOM 539 CB ASN A 34 7.376 -3.245 -11.343 1.00 0.00 C ATOM 540 CG ASN A 34 6.647 -1.933 -11.552 1.00 0.00 C ATOM 541 OD1 ASN A 34 7.257 -0.904 -11.830 1.00 0.00 O ATOM 542 ND2 ASN A 34 5.348 -1.969 -11.461 1.00 0.00 N ATOM 0 H ASN A 34 8.286 -5.373 -10.482 1.00 0.00 H new ATOM 0 HA ASN A 34 8.438 -2.625 -9.632 1.00 0.00 H new ATOM 0 HB2 ASN A 34 8.256 -3.273 -11.986 1.00 0.00 H new ATOM 0 HB3 ASN A 34 6.730 -4.067 -11.651 1.00 0.00 H new ATOM 0 HD21 ASN A 34 4.802 -1.123 -11.623 1.00 0.00 H new ATOM 0 HD22 ASN A 34 4.877 -2.843 -11.228 1.00 0.00 H new ATOM 549 N LEU A 35 6.637 -2.572 -8.237 1.00 0.00 N ATOM 550 CA LEU A 35 5.641 -2.312 -7.341 1.00 0.00 C ATOM 551 C LEU A 35 4.687 -1.398 -8.001 1.00 0.00 C ATOM 552 O LEU A 35 5.066 -0.321 -8.417 1.00 0.00 O ATOM 553 CB LEU A 35 6.238 -1.690 -6.059 1.00 0.00 C ATOM 554 CG LEU A 35 5.339 -1.327 -4.840 1.00 0.00 C ATOM 555 CD1 LEU A 35 6.234 -0.868 -3.714 1.00 0.00 C ATOM 556 CD2 LEU A 35 4.335 -0.213 -5.133 1.00 0.00 C ATOM 0 H LEU A 35 7.418 -1.920 -8.162 1.00 0.00 H new ATOM 0 HA LEU A 35 5.125 -3.224 -7.041 1.00 0.00 H new ATOM 0 HB2 LEU A 35 7.001 -2.380 -5.697 1.00 0.00 H new ATOM 0 HB3 LEU A 35 6.751 -0.776 -6.359 1.00 0.00 H new ATOM 0 HG LEU A 35 4.767 -2.219 -4.585 1.00 0.00 H new ATOM 0 HD11 LEU A 35 5.625 -0.608 -2.848 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.922 -1.670 -3.446 1.00 0.00 H new ATOM 0 HD13 LEU A 35 6.802 0.006 -4.034 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.743 -0.013 -4.240 1.00 0.00 H new ATOM 0 HD22 LEU A 35 4.870 0.691 -5.424 1.00 0.00 H new ATOM 0 HD23 LEU A 35 3.675 -0.522 -5.944 1.00 0.00 H new ATOM 568 N LYS A 36 3.493 -1.803 -8.118 1.00 0.00 N ATOM 569 CA LYS A 36 2.533 -0.950 -8.616 1.00 0.00 C ATOM 570 C LYS A 36 1.377 -0.850 -7.663 1.00 0.00 C ATOM 571 O LYS A 36 1.062 -1.786 -6.927 1.00 0.00 O ATOM 572 CB LYS A 36 2.096 -1.303 -10.041 1.00 0.00 C ATOM 573 CG LYS A 36 1.404 -2.641 -10.212 1.00 0.00 C ATOM 574 CD LYS A 36 1.009 -2.860 -11.667 1.00 0.00 C ATOM 575 CE LYS A 36 0.416 -4.243 -11.895 1.00 0.00 C ATOM 576 NZ LYS A 36 0.071 -4.488 -13.310 1.00 0.00 N ATOM 0 H LYS A 36 3.164 -2.736 -7.869 1.00 0.00 H new ATOM 0 HA LYS A 36 2.985 0.038 -8.699 1.00 0.00 H new ATOM 0 HB2 LYS A 36 1.426 -0.521 -10.398 1.00 0.00 H new ATOM 0 HB3 LYS A 36 2.976 -1.287 -10.684 1.00 0.00 H new ATOM 0 HG2 LYS A 36 2.066 -3.443 -9.885 1.00 0.00 H new ATOM 0 HG3 LYS A 36 0.517 -2.681 -9.579 1.00 0.00 H new ATOM 0 HD2 LYS A 36 0.285 -2.102 -11.964 1.00 0.00 H new ATOM 0 HD3 LYS A 36 1.884 -2.731 -12.304 1.00 0.00 H new ATOM 0 HE2 LYS A 36 1.128 -4.999 -11.563 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -0.478 -4.356 -11.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -0.328 -5.443 -13.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -0.629 -3.786 -13.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 0.927 -4.408 -13.895 1.00 0.00 H new ATOM 590 N ILE A 37 0.748 0.249 -7.693 1.00 0.00 N ATOM 591 CA ILE A 37 -0.391 0.484 -6.898 1.00 0.00 C ATOM 592 C ILE A 37 -1.538 0.506 -7.810 1.00 0.00 C ATOM 593 O ILE A 37 -1.509 1.179 -8.864 1.00 0.00 O ATOM 594 CB ILE A 37 -0.301 1.874 -6.194 1.00 0.00 C ATOM 595 CG1 ILE A 37 0.679 1.837 -5.014 1.00 0.00 C ATOM 596 CG2 ILE A 37 -1.691 2.400 -5.752 1.00 0.00 C ATOM 597 CD1 ILE A 37 0.092 1.285 -3.708 1.00 0.00 C ATOM 0 H ILE A 37 1.013 1.036 -8.285 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.478 -0.286 -6.131 1.00 0.00 H new ATOM 0 HB ILE A 37 0.085 2.578 -6.932 1.00 0.00 H new ATOM 0 HG12 ILE A 37 1.540 1.230 -5.294 1.00 0.00 H new ATOM 0 HG13 ILE A 37 1.046 2.847 -4.833 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.576 3.370 -5.267 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.335 2.505 -6.625 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.141 1.696 -5.052 1.00 0.00 H new ATOM 0 HD11 ILE A 37 0.857 1.297 -2.932 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.750 1.903 -3.398 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.248 0.262 -3.866 1.00 0.00 H new ATOM 609 N LEU A 38 -2.517 -0.248 -7.468 1.00 0.00 N ATOM 610 CA LEU A 38 -3.706 -0.195 -8.202 1.00 0.00 C ATOM 611 C LEU A 38 -4.705 0.453 -7.302 1.00 0.00 C ATOM 612 O LEU A 38 -4.854 0.091 -6.132 1.00 0.00 O ATOM 613 CB LEU A 38 -4.187 -1.598 -8.619 1.00 0.00 C ATOM 614 CG LEU A 38 -3.220 -2.451 -9.462 1.00 0.00 C ATOM 615 CD1 LEU A 38 -3.838 -3.800 -9.783 1.00 0.00 C ATOM 616 CD2 LEU A 38 -2.838 -1.739 -10.742 1.00 0.00 C ATOM 0 H LEU A 38 -2.510 -0.903 -6.686 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.564 0.361 -9.129 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.428 -2.155 -7.714 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.115 -1.484 -9.180 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.316 -2.607 -8.873 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.140 -4.388 -10.379 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -4.058 -4.329 -8.856 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.760 -3.653 -10.345 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -2.155 -2.365 -11.316 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.734 -1.544 -11.331 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.350 -0.795 -10.501 1.00 0.00 H new ATOM 628 N LYS A 39 -5.365 1.392 -7.831 1.00 0.00 N ATOM 629 CA LYS A 39 -6.325 2.140 -7.111 1.00 0.00 C ATOM 630 C LYS A 39 -7.628 1.966 -7.808 1.00 0.00 C ATOM 631 O LYS A 39 -7.690 2.141 -9.028 1.00 0.00 O ATOM 632 CB LYS A 39 -5.938 3.617 -7.148 1.00 0.00 C ATOM 633 CG LYS A 39 -6.738 4.491 -6.206 1.00 0.00 C ATOM 634 CD LYS A 39 -6.493 5.971 -6.450 1.00 0.00 C ATOM 635 CE LYS A 39 -7.155 6.454 -7.729 1.00 0.00 C ATOM 636 NZ LYS A 39 -8.630 6.287 -7.676 1.00 0.00 N ATOM 0 H LYS A 39 -5.258 1.679 -8.804 1.00 0.00 H new ATOM 0 HA LYS A 39 -6.384 1.808 -6.075 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.880 3.710 -6.902 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.063 3.989 -8.165 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -7.800 4.275 -6.326 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -6.478 4.246 -5.176 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -6.874 6.546 -5.605 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -5.420 6.157 -6.504 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -6.912 7.504 -7.891 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -6.755 5.900 -8.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -9.076 6.923 -8.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -8.876 5.302 -7.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -8.972 6.519 -6.721 1.00 0.00 H new ATOM 650 N ASN A 40 -8.659 1.628 -7.078 1.00 0.00 N ATOM 651 CA ASN A 40 -9.971 1.464 -7.690 1.00 0.00 C ATOM 652 C ASN A 40 -10.504 2.733 -8.275 1.00 0.00 C ATOM 653 O ASN A 40 -10.206 3.849 -7.802 1.00 0.00 O ATOM 654 CB ASN A 40 -11.026 0.828 -6.772 1.00 0.00 C ATOM 655 CG ASN A 40 -10.824 -0.655 -6.605 1.00 0.00 C ATOM 656 OD1 ASN A 40 -10.148 -1.101 -5.712 1.00 0.00 O ATOM 657 ND2 ASN A 40 -11.417 -1.418 -7.470 1.00 0.00 N ATOM 0 H ASN A 40 -8.628 1.461 -6.072 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.787 0.757 -8.499 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -10.990 1.309 -5.795 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -12.019 1.013 -7.182 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -11.319 -2.431 -7.408 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -11.981 -1.005 -8.212 1.00 0.00 H new ATOM 664 N GLU A 41 -11.220 2.558 -9.342 1.00 0.00 N ATOM 665 CA GLU A 41 -11.899 3.565 -10.075 1.00 0.00 C ATOM 666 C GLU A 41 -12.982 4.169 -9.182 1.00 0.00 C ATOM 667 O GLU A 41 -13.292 5.362 -9.249 1.00 0.00 O ATOM 668 CB GLU A 41 -12.520 2.847 -11.257 1.00 0.00 C ATOM 669 CG GLU A 41 -12.022 3.266 -12.613 1.00 0.00 C ATOM 670 CD GLU A 41 -12.444 4.670 -12.971 1.00 0.00 C ATOM 671 OE1 GLU A 41 -13.603 4.862 -13.381 1.00 0.00 O ATOM 672 OE2 GLU A 41 -11.630 5.609 -12.839 1.00 0.00 O ATOM 0 H GLU A 41 -11.351 1.632 -9.749 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.244 4.372 -10.404 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.345 1.777 -11.141 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -13.599 2.999 -11.224 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -10.934 3.200 -12.634 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -12.398 2.573 -13.366 1.00 0.00 H new ATOM 679 N VAL A 42 -13.511 3.319 -8.317 1.00 0.00 N ATOM 680 CA VAL A 42 -14.472 3.636 -7.343 1.00 0.00 C ATOM 681 C VAL A 42 -13.769 4.310 -6.160 1.00 0.00 C ATOM 682 O VAL A 42 -14.367 5.052 -5.383 1.00 0.00 O ATOM 683 CB VAL A 42 -15.078 2.288 -6.935 1.00 0.00 C ATOM 684 CG1 VAL A 42 -15.806 2.363 -5.648 1.00 0.00 C ATOM 685 CG2 VAL A 42 -15.965 1.756 -8.043 1.00 0.00 C ATOM 0 H VAL A 42 -13.246 2.334 -8.298 1.00 0.00 H new ATOM 0 HA VAL A 42 -15.242 4.321 -7.698 1.00 0.00 H new ATOM 0 HB VAL A 42 -14.256 1.590 -6.781 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -16.216 1.383 -5.404 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -15.121 2.676 -4.860 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -16.618 3.085 -5.731 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -16.389 0.798 -7.741 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -16.770 2.465 -8.237 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -15.374 1.622 -8.949 1.00 0.00 H new ATOM 695 N ASN A 43 -12.465 4.050 -6.097 1.00 0.00 N ATOM 696 CA ASN A 43 -11.556 4.484 -5.068 1.00 0.00 C ATOM 697 C ASN A 43 -12.060 3.934 -3.745 1.00 0.00 C ATOM 698 O ASN A 43 -11.994 4.565 -2.695 1.00 0.00 O ATOM 699 CB ASN A 43 -11.495 5.994 -5.102 1.00 0.00 C ATOM 700 CG ASN A 43 -10.291 6.609 -4.394 1.00 0.00 C ATOM 701 OD1 ASN A 43 -9.267 6.853 -5.049 1.00 0.00 O ATOM 702 ND2 ASN A 43 -10.373 6.844 -3.109 1.00 0.00 N ATOM 0 H ASN A 43 -11.997 3.495 -6.814 1.00 0.00 H new ATOM 0 HA ASN A 43 -10.541 4.115 -5.215 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -11.490 6.319 -6.143 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -12.404 6.389 -4.649 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -9.576 7.242 -2.611 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -11.234 6.629 -2.605 1.00 0.00 H new ATOM 709 N GLY A 44 -12.571 2.718 -3.832 1.00 0.00 N ATOM 710 CA GLY A 44 -13.119 2.060 -2.669 1.00 0.00 C ATOM 711 C GLY A 44 -12.060 1.302 -1.924 1.00 0.00 C ATOM 712 O GLY A 44 -12.006 1.321 -0.694 1.00 0.00 O ATOM 0 H GLY A 44 -12.616 2.173 -4.693 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -13.572 2.800 -2.009 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -13.912 1.377 -2.974 1.00 0.00 H new ATOM 716 N LYS A 45 -11.233 0.623 -2.666 1.00 0.00 N ATOM 717 CA LYS A 45 -10.148 -0.111 -2.122 1.00 0.00 C ATOM 718 C LYS A 45 -8.907 0.274 -2.917 1.00 0.00 C ATOM 719 O LYS A 45 -9.019 0.757 -4.062 1.00 0.00 O ATOM 720 CB LYS A 45 -10.463 -1.589 -2.285 1.00 0.00 C ATOM 721 CG LYS A 45 -9.735 -2.542 -1.334 1.00 0.00 C ATOM 722 CD LYS A 45 -10.012 -2.188 0.123 1.00 0.00 C ATOM 723 CE LYS A 45 -9.572 -3.289 1.083 1.00 0.00 C ATOM 724 NZ LYS A 45 -10.395 -4.519 0.937 1.00 0.00 N ATOM 0 H LYS A 45 -11.303 0.569 -3.682 1.00 0.00 H new ATOM 0 HA LYS A 45 -9.984 0.100 -1.065 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -11.536 -1.727 -2.154 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -10.227 -1.879 -3.309 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -10.053 -3.566 -1.528 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -8.662 -2.499 -1.523 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -9.494 -1.262 0.374 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -11.078 -2.002 0.252 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -8.525 -3.530 0.902 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -9.643 -2.925 2.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -10.255 -5.131 1.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -11.399 -4.258 0.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -10.107 -5.029 0.078 1.00 0.00 H new ATOM 738 N LEU A 46 -7.756 0.165 -2.316 1.00 0.00 N ATOM 739 CA LEU A 46 -6.558 0.437 -2.957 1.00 0.00 C ATOM 740 C LEU A 46 -5.676 -0.763 -2.709 1.00 0.00 C ATOM 741 O LEU A 46 -5.802 -1.409 -1.669 1.00 0.00 O ATOM 742 CB LEU A 46 -5.841 1.603 -2.305 1.00 0.00 C ATOM 743 CG LEU A 46 -6.630 2.818 -1.684 1.00 0.00 C ATOM 744 CD1 LEU A 46 -7.644 3.436 -2.632 1.00 0.00 C ATOM 745 CD2 LEU A 46 -7.249 2.491 -0.320 1.00 0.00 C ATOM 0 H LEU A 46 -7.652 -0.124 -1.343 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.749 0.658 -4.007 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -5.222 1.188 -1.509 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -5.164 2.015 -3.053 1.00 0.00 H new ATOM 0 HG LEU A 46 -5.873 3.584 -1.514 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -8.148 4.266 -2.136 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.133 3.802 -3.523 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -8.379 2.684 -2.919 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.779 3.365 0.058 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -7.947 1.661 -0.427 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.461 2.214 0.380 1.00 0.00 H new ATOM 757 N ARG A 47 -4.798 -1.045 -3.603 1.00 0.00 N ATOM 758 CA ARG A 47 -3.833 -2.138 -3.412 1.00 0.00 C ATOM 759 C ARG A 47 -2.480 -1.659 -3.794 1.00 0.00 C ATOM 760 O ARG A 47 -2.315 -0.750 -4.597 1.00 0.00 O ATOM 761 CB ARG A 47 -4.008 -3.338 -4.320 1.00 0.00 C ATOM 762 CG ARG A 47 -5.347 -3.529 -4.994 1.00 0.00 C ATOM 763 CD ARG A 47 -5.274 -4.757 -5.875 1.00 0.00 C ATOM 764 NE ARG A 47 -6.546 -5.138 -6.457 1.00 0.00 N ATOM 765 CZ ARG A 47 -7.007 -6.387 -6.544 1.00 0.00 C ATOM 766 NH1 ARG A 47 -6.329 -7.414 -6.023 1.00 0.00 N ATOM 767 NH2 ARG A 47 -8.140 -6.612 -7.161 1.00 0.00 N ATOM 0 H ARG A 47 -4.704 -0.548 -4.489 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.980 -2.427 -2.371 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.247 -3.281 -5.099 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -3.798 -4.233 -3.734 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -6.133 -3.645 -4.248 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -5.600 -2.651 -5.589 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -4.558 -4.575 -6.677 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -4.890 -5.591 -5.288 1.00 0.00 H new ATOM 0 HE ARG A 47 -7.135 -4.393 -6.829 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -5.441 -7.251 -5.548 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -6.699 -8.361 -6.100 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -8.661 -5.836 -7.569 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -8.501 -7.563 -7.233 1.00 0.00 H new ATOM 781 N MET A 48 -1.573 -2.315 -3.268 1.00 0.00 N ATOM 782 CA MET A 48 -0.212 -2.208 -3.504 1.00 0.00 C ATOM 783 C MET A 48 0.212 -3.616 -3.854 1.00 0.00 C ATOM 784 O MET A 48 0.043 -4.527 -3.060 1.00 0.00 O ATOM 785 CB MET A 48 0.415 -1.862 -2.162 1.00 0.00 C ATOM 786 CG MET A 48 1.840 -1.447 -2.189 1.00 0.00 C ATOM 787 SD MET A 48 2.608 -1.650 -0.587 1.00 0.00 S ATOM 788 CE MET A 48 4.194 -0.937 -0.915 1.00 0.00 C ATOM 0 H MET A 48 -1.779 -3.033 -2.573 1.00 0.00 H new ATOM 0 HA MET A 48 0.058 -1.480 -4.269 1.00 0.00 H new ATOM 0 HB2 MET A 48 -0.167 -1.059 -1.710 1.00 0.00 H new ATOM 0 HB3 MET A 48 0.324 -2.729 -1.508 1.00 0.00 H new ATOM 0 HG2 MET A 48 2.379 -2.038 -2.930 1.00 0.00 H new ATOM 0 HG3 MET A 48 1.911 -0.404 -2.499 1.00 0.00 H new ATOM 0 HE1 MET A 48 4.519 -0.360 -0.050 1.00 0.00 H new ATOM 0 HE2 MET A 48 4.915 -1.730 -1.114 1.00 0.00 H new ATOM 0 HE3 MET A 48 4.126 -0.282 -1.783 1.00 0.00 H new ATOM 798 N LEU A 49 0.695 -3.806 -5.000 1.00 0.00 N ATOM 799 CA LEU A 49 1.248 -5.087 -5.352 1.00 0.00 C ATOM 800 C LEU A 49 2.572 -4.958 -5.991 1.00 0.00 C ATOM 801 O LEU A 49 2.884 -3.957 -6.616 1.00 0.00 O ATOM 802 CB LEU A 49 0.369 -5.923 -6.238 1.00 0.00 C ATOM 803 CG LEU A 49 -0.014 -5.404 -7.643 1.00 0.00 C ATOM 804 CD1 LEU A 49 1.036 -5.759 -8.689 1.00 0.00 C ATOM 805 CD2 LEU A 49 -1.378 -5.928 -8.049 1.00 0.00 C ATOM 0 H LEU A 49 0.732 -3.102 -5.737 1.00 0.00 H new ATOM 0 HA LEU A 49 1.337 -5.604 -4.397 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.861 -6.887 -6.369 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.558 -6.109 -5.695 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.058 -4.316 -7.589 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.726 -5.375 -9.661 1.00 0.00 H new ATOM 0 HD12 LEU A 49 1.991 -5.314 -8.411 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.143 -6.842 -8.744 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.632 -5.553 -9.040 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.358 -7.018 -8.067 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.126 -5.591 -7.331 1.00 0.00 H new ATOM 817 N MET A 50 3.339 -5.946 -5.852 1.00 0.00 N ATOM 818 CA MET A 50 4.542 -6.019 -6.395 1.00 0.00 C ATOM 819 C MET A 50 4.644 -7.323 -7.060 1.00 0.00 C ATOM 820 O MET A 50 4.350 -8.397 -6.512 1.00 0.00 O ATOM 821 CB MET A 50 5.622 -5.838 -5.407 1.00 0.00 C ATOM 822 CG MET A 50 5.370 -6.548 -4.104 1.00 0.00 C ATOM 823 SD MET A 50 4.353 -5.635 -2.917 1.00 0.00 S ATOM 824 CE MET A 50 5.429 -4.270 -2.508 1.00 0.00 C ATOM 0 H MET A 50 3.089 -6.770 -5.306 1.00 0.00 H new ATOM 0 HA MET A 50 4.666 -5.207 -7.112 1.00 0.00 H new ATOM 0 HB2 MET A 50 6.558 -6.199 -5.833 1.00 0.00 H new ATOM 0 HB3 MET A 50 5.751 -4.773 -5.212 1.00 0.00 H new ATOM 0 HG2 MET A 50 4.887 -7.502 -4.315 1.00 0.00 H new ATOM 0 HG3 MET A 50 6.330 -6.773 -3.639 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.599 -4.251 -1.431 1.00 0.00 H new ATOM 0 HE2 MET A 50 6.382 -4.391 -3.024 1.00 0.00 H new ATOM 0 HE3 MET A 50 4.964 -3.334 -2.819 1.00 0.00 H new ATOM 834 N ARG A 51 4.968 -7.185 -8.185 1.00 0.00 N ATOM 835 CA ARG A 51 5.165 -8.209 -9.159 1.00 0.00 C ATOM 836 C ARG A 51 6.634 -8.343 -9.371 1.00 0.00 C ATOM 837 O ARG A 51 7.364 -7.373 -9.325 1.00 0.00 O ATOM 838 CB ARG A 51 4.411 -7.768 -10.415 1.00 0.00 C ATOM 839 CG ARG A 51 4.443 -8.586 -11.688 1.00 0.00 C ATOM 840 CD ARG A 51 5.616 -8.201 -12.572 1.00 0.00 C ATOM 841 NE ARG A 51 5.585 -6.803 -13.016 1.00 0.00 N ATOM 842 CZ ARG A 51 6.609 -6.184 -13.630 1.00 0.00 C ATOM 843 NH1 ARG A 51 7.724 -6.837 -13.873 1.00 0.00 N ATOM 844 NH2 ARG A 51 6.498 -4.933 -14.020 1.00 0.00 N ATOM 0 H ARG A 51 5.144 -6.258 -8.572 1.00 0.00 H new ATOM 0 HA ARG A 51 4.786 -9.186 -8.860 1.00 0.00 H new ATOM 0 HB2 ARG A 51 3.363 -7.662 -10.134 1.00 0.00 H new ATOM 0 HB3 ARG A 51 4.775 -6.773 -10.669 1.00 0.00 H new ATOM 0 HG2 ARG A 51 4.507 -9.645 -11.439 1.00 0.00 H new ATOM 0 HG3 ARG A 51 3.512 -8.443 -12.236 1.00 0.00 H new ATOM 0 HD2 ARG A 51 6.544 -8.380 -12.028 1.00 0.00 H new ATOM 0 HD3 ARG A 51 5.629 -8.851 -13.447 1.00 0.00 H new ATOM 0 HE ARG A 51 4.734 -6.267 -12.849 1.00 0.00 H new ATOM 0 HH11 ARG A 51 7.813 -7.815 -13.596 1.00 0.00 H new ATOM 0 HH12 ARG A 51 8.500 -6.366 -14.339 1.00 0.00 H new ATOM 0 HH21 ARG A 51 5.630 -4.423 -13.858 1.00 0.00 H new ATOM 0 HH22 ARG A 51 7.280 -4.472 -14.485 1.00 0.00 H new ATOM 858 N ARG A 52 7.039 -9.526 -9.617 1.00 0.00 N ATOM 859 CA ARG A 52 8.385 -9.850 -9.790 1.00 0.00 C ATOM 860 C ARG A 52 8.740 -9.518 -11.169 1.00 0.00 C ATOM 861 O ARG A 52 8.073 -9.911 -12.104 1.00 0.00 O ATOM 862 CB ARG A 52 8.686 -11.289 -9.431 1.00 0.00 C ATOM 863 CG ARG A 52 8.682 -11.666 -7.951 1.00 0.00 C ATOM 864 CD ARG A 52 8.953 -13.171 -7.840 1.00 0.00 C ATOM 865 NE ARG A 52 9.206 -13.670 -6.482 1.00 0.00 N ATOM 866 CZ ARG A 52 9.108 -14.975 -6.121 1.00 0.00 C ATOM 867 NH1 ARG A 52 8.519 -15.867 -6.928 1.00 0.00 N ATOM 868 NH2 ARG A 52 9.544 -15.357 -4.939 1.00 0.00 N ATOM 0 H ARG A 52 6.410 -10.324 -9.706 1.00 0.00 H new ATOM 0 HA ARG A 52 9.002 -9.270 -9.104 1.00 0.00 H new ATOM 0 HB2 ARG A 52 7.959 -11.921 -9.940 1.00 0.00 H new ATOM 0 HB3 ARG A 52 9.666 -11.539 -9.838 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.444 -11.102 -7.413 1.00 0.00 H new ATOM 0 HG3 ARG A 52 7.722 -11.418 -7.498 1.00 0.00 H new ATOM 0 HD2 ARG A 52 8.098 -13.708 -8.252 1.00 0.00 H new ATOM 0 HD3 ARG A 52 9.813 -13.414 -8.464 1.00 0.00 H new ATOM 0 HE ARG A 52 9.472 -12.994 -5.766 1.00 0.00 H new ATOM 0 HH11 ARG A 52 8.138 -15.569 -7.826 1.00 0.00 H new ATOM 0 HH12 ARG A 52 8.452 -16.845 -6.645 1.00 0.00 H new ATOM 0 HH21 ARG A 52 9.952 -14.674 -4.301 1.00 0.00 H new ATOM 0 HH22 ARG A 52 9.473 -16.336 -4.661 1.00 0.00 H new ATOM 882 N GLU A 53 9.738 -8.745 -11.254 1.00 0.00 N ATOM 883 CA GLU A 53 10.244 -8.128 -12.479 1.00 0.00 C ATOM 884 C GLU A 53 10.352 -9.025 -13.632 1.00 0.00 C ATOM 885 O GLU A 53 9.488 -8.988 -14.511 1.00 0.00 O ATOM 886 CB GLU A 53 11.491 -7.306 -12.219 1.00 0.00 C ATOM 887 CG GLU A 53 11.287 -5.817 -12.419 1.00 0.00 C ATOM 888 CD GLU A 53 11.097 -5.444 -13.868 1.00 0.00 C ATOM 889 OE1 GLU A 53 10.078 -5.800 -14.449 1.00 0.00 O ATOM 890 OE2 GLU A 53 11.995 -4.802 -14.442 1.00 0.00 O ATOM 0 H GLU A 53 10.286 -8.485 -10.434 1.00 0.00 H new ATOM 0 HA GLU A 53 9.466 -7.432 -12.793 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.828 -7.485 -11.198 1.00 0.00 H new ATOM 0 HB3 GLU A 53 12.286 -7.648 -12.881 1.00 0.00 H new ATOM 0 HG2 GLU A 53 10.417 -5.494 -11.848 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.147 -5.280 -12.020 1.00 0.00 H new ATOM 897 N GLN A 54 11.312 -9.838 -13.670 1.00 0.00 N ATOM 898 CA GLN A 54 11.416 -10.645 -14.827 1.00 0.00 C ATOM 899 C GLN A 54 10.487 -11.857 -14.739 1.00 0.00 C ATOM 900 O GLN A 54 10.286 -12.579 -15.705 1.00 0.00 O ATOM 901 CB GLN A 54 12.854 -11.007 -15.178 1.00 0.00 C ATOM 902 CG GLN A 54 13.732 -9.795 -15.470 1.00 0.00 C ATOM 903 CD GLN A 54 13.231 -8.975 -16.646 1.00 0.00 C ATOM 904 OE1 GLN A 54 13.609 -9.214 -17.790 1.00 0.00 O ATOM 905 NE2 GLN A 54 12.380 -8.012 -16.381 1.00 0.00 N ATOM 0 H GLN A 54 12.022 -9.973 -12.950 1.00 0.00 H new ATOM 0 HA GLN A 54 11.073 -10.045 -15.670 1.00 0.00 H new ATOM 0 HB2 GLN A 54 13.290 -11.571 -14.354 1.00 0.00 H new ATOM 0 HB3 GLN A 54 12.853 -11.663 -16.048 1.00 0.00 H new ATOM 0 HG2 GLN A 54 13.776 -9.162 -14.584 1.00 0.00 H new ATOM 0 HG3 GLN A 54 14.749 -10.130 -15.673 1.00 0.00 H new ATOM 0 HE21 GLN A 54 12.087 -7.841 -15.419 1.00 0.00 H new ATOM 0 HE22 GLN A 54 12.011 -7.435 -17.137 1.00 0.00 H new ATOM 914 N VAL A 55 9.898 -12.021 -13.577 1.00 0.00 N ATOM 915 CA VAL A 55 9.059 -13.134 -13.267 1.00 0.00 C ATOM 916 C VAL A 55 7.561 -12.869 -13.626 1.00 0.00 C ATOM 917 O VAL A 55 6.732 -13.782 -13.586 1.00 0.00 O ATOM 918 CB VAL A 55 9.238 -13.312 -11.735 1.00 0.00 C ATOM 919 CG1 VAL A 55 8.193 -14.199 -11.113 1.00 0.00 C ATOM 920 CG2 VAL A 55 10.628 -13.852 -11.428 1.00 0.00 C ATOM 0 H VAL A 55 9.998 -11.360 -12.806 1.00 0.00 H new ATOM 0 HA VAL A 55 9.330 -14.020 -13.841 1.00 0.00 H new ATOM 0 HB VAL A 55 9.115 -12.324 -11.292 1.00 0.00 H new ATOM 0 HG11 VAL A 55 8.376 -14.281 -10.042 1.00 0.00 H new ATOM 0 HG12 VAL A 55 7.205 -13.770 -11.280 1.00 0.00 H new ATOM 0 HG13 VAL A 55 8.240 -15.189 -11.566 1.00 0.00 H new ATOM 0 HG21 VAL A 55 10.742 -13.973 -10.351 1.00 0.00 H new ATOM 0 HG22 VAL A 55 10.760 -14.817 -11.917 1.00 0.00 H new ATOM 0 HG23 VAL A 55 11.379 -13.153 -11.796 1.00 0.00 H new ATOM 930 N LEU A 56 7.265 -11.637 -14.061 1.00 0.00 N ATOM 931 CA LEU A 56 5.987 -11.133 -14.502 1.00 0.00 C ATOM 932 C LEU A 56 4.806 -11.390 -13.508 1.00 0.00 C ATOM 933 O LEU A 56 3.646 -11.046 -13.760 1.00 0.00 O ATOM 934 CB LEU A 56 5.751 -11.910 -15.721 1.00 0.00 C ATOM 935 CG LEU A 56 4.419 -11.769 -16.316 1.00 0.00 C ATOM 936 CD1 LEU A 56 4.205 -10.402 -16.973 1.00 0.00 C ATOM 937 CD2 LEU A 56 4.004 -12.940 -17.166 1.00 0.00 C ATOM 0 H LEU A 56 7.986 -10.917 -14.112 1.00 0.00 H new ATOM 0 HA LEU A 56 6.018 -10.049 -14.615 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.494 -11.620 -16.464 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.919 -12.963 -15.497 1.00 0.00 H new ATOM 0 HG LEU A 56 3.718 -11.795 -15.481 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.202 -10.355 -17.396 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.321 -9.617 -16.226 1.00 0.00 H new ATOM 0 HD13 LEU A 56 4.940 -10.260 -17.765 1.00 0.00 H new ATOM 0 HD21 LEU A 56 3.008 -12.761 -17.571 1.00 0.00 H new ATOM 0 HD22 LEU A 56 4.712 -13.064 -17.986 1.00 0.00 H new ATOM 0 HD23 LEU A 56 3.991 -13.845 -16.558 1.00 0.00 H new ATOM 949 N LYS A 57 5.112 -11.811 -12.372 1.00 0.00 N ATOM 950 CA LYS A 57 4.071 -12.159 -11.467 1.00 0.00 C ATOM 951 C LYS A 57 4.048 -11.495 -10.082 1.00 0.00 C ATOM 952 O LYS A 57 4.951 -11.695 -9.259 1.00 0.00 O ATOM 953 CB LYS A 57 3.994 -13.639 -11.411 1.00 0.00 C ATOM 954 CG LYS A 57 2.771 -14.181 -10.687 1.00 0.00 C ATOM 955 CD LYS A 57 2.725 -15.697 -10.721 1.00 0.00 C ATOM 956 CE LYS A 57 1.484 -16.207 -10.019 1.00 0.00 C ATOM 957 NZ LYS A 57 1.375 -17.679 -10.054 1.00 0.00 N ATOM 0 H LYS A 57 6.063 -11.932 -12.022 1.00 0.00 H new ATOM 0 HA LYS A 57 3.163 -11.721 -11.881 1.00 0.00 H new ATOM 0 HB2 LYS A 57 4.000 -14.029 -12.429 1.00 0.00 H new ATOM 0 HB3 LYS A 57 4.889 -14.018 -10.919 1.00 0.00 H new ATOM 0 HG2 LYS A 57 2.780 -13.840 -9.652 1.00 0.00 H new ATOM 0 HG3 LYS A 57 1.868 -13.779 -11.147 1.00 0.00 H new ATOM 0 HD2 LYS A 57 2.734 -16.044 -11.754 1.00 0.00 H new ATOM 0 HD3 LYS A 57 3.615 -16.104 -10.241 1.00 0.00 H new ATOM 0 HE2 LYS A 57 1.494 -15.872 -8.982 1.00 0.00 H new ATOM 0 HE3 LYS A 57 0.602 -15.770 -10.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 0.518 -17.976 -9.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 1.320 -18.000 -11.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 2.210 -18.100 -9.599 1.00 0.00 H new ATOM 971 N VAL A 58 3.113 -10.569 -9.936 1.00 0.00 N ATOM 972 CA VAL A 58 2.547 -10.134 -8.643 1.00 0.00 C ATOM 973 C VAL A 58 2.569 -11.240 -7.578 1.00 0.00 C ATOM 974 O VAL A 58 2.042 -12.333 -7.766 1.00 0.00 O ATOM 975 CB VAL A 58 1.077 -9.629 -8.854 1.00 0.00 C ATOM 976 CG1 VAL A 58 0.200 -10.666 -9.561 1.00 0.00 C ATOM 977 CG2 VAL A 58 0.459 -9.229 -7.536 1.00 0.00 C ATOM 0 H VAL A 58 2.706 -10.077 -10.731 1.00 0.00 H new ATOM 0 HA VAL A 58 3.177 -9.325 -8.274 1.00 0.00 H new ATOM 0 HB VAL A 58 1.131 -8.755 -9.503 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.807 -10.268 -9.683 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.622 -10.892 -10.540 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.160 -11.577 -8.964 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.561 -8.881 -7.703 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.444 -10.088 -6.865 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.046 -8.428 -7.087 1.00 0.00 H new ATOM 987 N CYS A 59 3.215 -10.950 -6.489 1.00 0.00 N ATOM 988 CA CYS A 59 3.299 -11.882 -5.404 1.00 0.00 C ATOM 989 C CYS A 59 2.510 -11.387 -4.212 1.00 0.00 C ATOM 990 O CYS A 59 1.818 -12.168 -3.562 1.00 0.00 O ATOM 991 CB CYS A 59 4.749 -12.109 -5.024 1.00 0.00 C ATOM 992 SG CYS A 59 5.765 -12.670 -6.405 1.00 0.00 S ATOM 0 H CYS A 59 3.697 -10.066 -6.327 1.00 0.00 H new ATOM 0 HA CYS A 59 2.868 -12.830 -5.726 1.00 0.00 H new ATOM 0 HB2 CYS A 59 5.164 -11.182 -4.629 1.00 0.00 H new ATOM 0 HB3 CYS A 59 4.797 -12.846 -4.223 1.00 0.00 H new ATOM 0 HG CYS A 59 5.296 -12.182 -7.515 1.00 0.00 H new ATOM 998 N ALA A 60 2.503 -10.074 -4.001 1.00 0.00 N ATOM 999 CA ALA A 60 1.925 -9.537 -2.879 1.00 0.00 C ATOM 1000 C ALA A 60 0.962 -8.599 -3.290 1.00 0.00 C ATOM 1001 O ALA A 60 1.209 -7.807 -4.167 1.00 0.00 O ATOM 1002 CB ALA A 60 2.885 -8.833 -1.991 1.00 0.00 C ATOM 0 H ALA A 60 2.913 -9.390 -4.636 1.00 0.00 H new ATOM 0 HA ALA A 60 1.502 -10.366 -2.312 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.355 -8.435 -1.125 1.00 0.00 H new ATOM 0 HB2 ALA A 60 3.652 -9.532 -1.657 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.353 -8.014 -2.538 1.00 0.00 H new ATOM 1008 N ASN A 61 -0.118 -8.730 -2.735 1.00 0.00 N ATOM 1009 CA ASN A 61 -1.183 -7.828 -2.899 1.00 0.00 C ATOM 1010 C ASN A 61 -1.542 -7.307 -1.553 1.00 0.00 C ATOM 1011 O ASN A 61 -2.258 -7.944 -0.777 1.00 0.00 O ATOM 1012 CB ASN A 61 -2.349 -8.499 -3.512 1.00 0.00 C ATOM 1013 CG ASN A 61 -3.588 -7.620 -3.695 1.00 0.00 C ATOM 1014 OD1 ASN A 61 -3.804 -7.065 -4.758 1.00 0.00 O ATOM 1015 ND2 ASN A 61 -4.391 -7.466 -2.655 1.00 0.00 N ATOM 0 H ASN A 61 -0.332 -9.506 -2.108 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.886 -7.015 -3.561 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -2.053 -8.888 -4.486 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -2.620 -9.356 -2.895 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -5.216 -6.870 -2.731 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -4.186 -7.943 -1.777 1.00 0.00 H new ATOM 1022 N HIS A 62 -1.006 -6.221 -1.263 1.00 0.00 N ATOM 1023 CA HIS A 62 -1.222 -5.561 -0.008 1.00 0.00 C ATOM 1024 C HIS A 62 -2.163 -4.408 -0.228 1.00 0.00 C ATOM 1025 O HIS A 62 -1.938 -3.616 -1.072 1.00 0.00 O ATOM 1026 CB HIS A 62 0.100 -4.989 0.556 1.00 0.00 C ATOM 1027 CG HIS A 62 1.200 -5.967 0.765 1.00 0.00 C ATOM 1028 ND1 HIS A 62 2.481 -5.758 0.315 1.00 0.00 N ATOM 1029 CD2 HIS A 62 1.220 -7.145 1.389 1.00 0.00 C ATOM 1030 CE1 HIS A 62 3.225 -6.785 0.656 1.00 0.00 C ATOM 1031 NE2 HIS A 62 2.479 -7.641 1.309 1.00 0.00 N ATOM 0 H HIS A 62 -0.377 -5.720 -1.890 1.00 0.00 H new ATOM 0 HA HIS A 62 -1.629 -6.286 0.696 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.455 -4.213 -0.122 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.115 -4.505 1.509 1.00 0.00 H new ATOM 0 HD1 HIS A 62 2.802 -4.938 -0.200 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.380 -7.621 1.873 1.00 0.00 H new ATOM 0 HE1 HIS A 62 4.275 -6.904 0.435 1.00 0.00 H new ATOM 1039 N TRP A 63 -3.210 -4.336 0.489 1.00 0.00 N ATOM 1040 CA TRP A 63 -4.024 -3.170 0.454 1.00 0.00 C ATOM 1041 C TRP A 63 -3.417 -2.192 1.416 1.00 0.00 C ATOM 1042 O TRP A 63 -3.069 -2.541 2.550 1.00 0.00 O ATOM 1043 CB TRP A 63 -5.451 -3.470 0.889 1.00 0.00 C ATOM 1044 CG TRP A 63 -6.130 -4.554 0.103 1.00 0.00 C ATOM 1045 CD1 TRP A 63 -6.670 -4.449 -1.145 1.00 0.00 C ATOM 1046 CD2 TRP A 63 -6.360 -5.901 0.528 1.00 0.00 C ATOM 1047 NE1 TRP A 63 -7.226 -5.643 -1.520 1.00 0.00 N ATOM 1048 CE2 TRP A 63 -7.047 -6.555 -0.511 1.00 0.00 C ATOM 1049 CE3 TRP A 63 -6.051 -6.614 1.686 1.00 0.00 C ATOM 1050 CZ2 TRP A 63 -7.428 -7.892 -0.422 1.00 0.00 C ATOM 1051 CZ3 TRP A 63 -6.431 -7.935 1.772 1.00 0.00 C ATOM 1052 CH2 TRP A 63 -7.112 -8.562 0.724 1.00 0.00 C ATOM 0 H TRP A 63 -3.535 -5.072 1.116 1.00 0.00 H new ATOM 0 HA TRP A 63 -4.066 -2.780 -0.563 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -5.444 -3.753 1.942 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -6.041 -2.557 0.808 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -6.661 -3.554 -1.750 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -7.697 -5.825 -2.406 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -5.524 -6.139 2.500 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.954 -8.380 -1.230 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -6.199 -8.497 2.665 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -7.394 -9.600 0.824 1.00 0.00 H new ATOM 1063 N ILE A 64 -3.266 -1.001 0.966 1.00 0.00 N ATOM 1064 CA ILE A 64 -2.661 0.012 1.700 1.00 0.00 C ATOM 1065 C ILE A 64 -3.785 0.701 2.496 1.00 0.00 C ATOM 1066 O ILE A 64 -4.672 1.332 1.928 1.00 0.00 O ATOM 1067 CB ILE A 64 -1.799 0.944 0.700 1.00 0.00 C ATOM 1068 CG1 ILE A 64 -1.296 2.248 1.344 1.00 0.00 C ATOM 1069 CG2 ILE A 64 -2.546 1.229 -0.607 1.00 0.00 C ATOM 1070 CD1 ILE A 64 -2.364 3.277 1.503 1.00 0.00 C ATOM 0 H ILE A 64 -3.577 -0.709 0.040 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.928 -0.330 2.431 1.00 0.00 H new ATOM 0 HB ILE A 64 -0.910 0.359 0.464 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -0.871 2.022 2.322 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -0.492 2.660 0.734 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -1.929 1.859 -1.249 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.759 0.289 -1.117 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -3.482 1.742 -0.387 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -1.942 4.171 1.963 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.773 3.531 0.525 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.158 2.883 2.137 1.00 0.00 H new ATOM 1082 N THR A 65 -3.812 0.445 3.783 1.00 0.00 N ATOM 1083 CA THR A 65 -4.854 0.951 4.637 1.00 0.00 C ATOM 1084 C THR A 65 -4.330 1.344 5.989 1.00 0.00 C ATOM 1085 O THR A 65 -3.289 0.862 6.432 1.00 0.00 O ATOM 1086 CB THR A 65 -5.984 -0.098 4.813 1.00 0.00 C ATOM 1087 OG1 THR A 65 -6.963 0.345 5.761 1.00 0.00 O ATOM 1088 CG2 THR A 65 -5.433 -1.458 5.223 1.00 0.00 C ATOM 0 H THR A 65 -3.112 -0.119 4.264 1.00 0.00 H new ATOM 0 HA THR A 65 -5.254 1.840 4.150 1.00 0.00 H new ATOM 0 HB THR A 65 -6.467 -0.208 3.842 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.573 -0.393 5.970 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.255 -2.165 5.336 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.747 -1.819 4.456 1.00 0.00 H new ATOM 0 HG23 THR A 65 -4.902 -1.365 6.170 1.00 0.00 H new ATOM 1096 N THR A 66 -5.091 2.183 6.644 1.00 0.00 N ATOM 1097 CA THR A 66 -4.851 2.628 7.991 1.00 0.00 C ATOM 1098 C THR A 66 -5.247 1.540 9.006 1.00 0.00 C ATOM 1099 O THR A 66 -5.024 1.679 10.212 1.00 0.00 O ATOM 1100 CB THR A 66 -5.635 3.893 8.268 1.00 0.00 C ATOM 1101 OG1 THR A 66 -6.598 4.118 7.207 1.00 0.00 O ATOM 1102 CG2 THR A 66 -4.730 5.086 8.432 1.00 0.00 C ATOM 0 H THR A 66 -5.931 2.592 6.234 1.00 0.00 H new ATOM 0 HA THR A 66 -3.786 2.832 8.097 1.00 0.00 H new ATOM 0 HB THR A 66 -6.167 3.763 9.210 1.00 0.00 H new ATOM 0 HG1 THR A 66 -6.219 4.736 6.547 1.00 0.00 H new ATOM 0 HG21 THR A 66 -5.331 5.974 8.629 1.00 0.00 H new ATOM 0 HG22 THR A 66 -4.050 4.915 9.267 1.00 0.00 H new ATOM 0 HG23 THR A 66 -4.153 5.234 7.519 1.00 0.00 H new ATOM 1110 N THR A 67 -5.808 0.454 8.495 1.00 0.00 N ATOM 1111 CA THR A 67 -6.246 -0.675 9.294 1.00 0.00 C ATOM 1112 C THR A 67 -5.020 -1.551 9.589 1.00 0.00 C ATOM 1113 O THR A 67 -5.013 -2.419 10.463 1.00 0.00 O ATOM 1114 CB THR A 67 -7.305 -1.477 8.466 1.00 0.00 C ATOM 1115 OG1 THR A 67 -8.435 -0.632 8.177 1.00 0.00 O ATOM 1116 CG2 THR A 67 -7.780 -2.734 9.180 1.00 0.00 C ATOM 0 H THR A 67 -5.973 0.333 7.496 1.00 0.00 H new ATOM 0 HA THR A 67 -6.695 -0.352 10.234 1.00 0.00 H new ATOM 0 HB THR A 67 -6.819 -1.793 7.543 1.00 0.00 H new ATOM 0 HG1 THR A 67 -9.096 -1.136 7.657 1.00 0.00 H new ATOM 0 HG21 THR A 67 -8.513 -3.250 8.560 1.00 0.00 H new ATOM 0 HG22 THR A 67 -6.930 -3.392 9.361 1.00 0.00 H new ATOM 0 HG23 THR A 67 -8.237 -2.461 10.131 1.00 0.00 H new ATOM 1124 N MET A 68 -3.971 -1.235 8.904 1.00 0.00 N ATOM 1125 CA MET A 68 -2.778 -1.872 8.979 1.00 0.00 C ATOM 1126 C MET A 68 -1.753 -0.832 9.348 1.00 0.00 C ATOM 1127 O MET A 68 -2.003 0.374 9.275 1.00 0.00 O ATOM 1128 CB MET A 68 -2.530 -2.511 7.631 1.00 0.00 C ATOM 1129 CG MET A 68 -1.127 -2.982 7.356 1.00 0.00 C ATOM 1130 SD MET A 68 -0.144 -1.707 6.551 1.00 0.00 S ATOM 1131 CE MET A 68 -0.960 -1.584 4.960 1.00 0.00 C ATOM 0 H MET A 68 -3.967 -0.461 8.239 1.00 0.00 H new ATOM 0 HA MET A 68 -2.739 -2.662 9.729 1.00 0.00 H new ATOM 0 HB2 MET A 68 -3.202 -3.364 7.529 1.00 0.00 H new ATOM 0 HB3 MET A 68 -2.806 -1.794 6.858 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.650 -3.272 8.292 1.00 0.00 H new ATOM 0 HG3 MET A 68 -1.158 -3.870 6.725 1.00 0.00 H new ATOM 0 HE1 MET A 68 -0.339 -2.052 4.196 1.00 0.00 H new ATOM 0 HE2 MET A 68 -1.924 -2.091 5.005 1.00 0.00 H new ATOM 0 HE3 MET A 68 -1.114 -0.534 4.710 1.00 0.00 H new ATOM 1141 N ASN A 69 -0.694 -1.296 9.778 1.00 0.00 N ATOM 1142 CA ASN A 69 0.402 -0.517 10.274 1.00 0.00 C ATOM 1143 C ASN A 69 1.715 -1.006 9.679 1.00 0.00 C ATOM 1144 O ASN A 69 1.911 -2.217 9.488 1.00 0.00 O ATOM 1145 CB ASN A 69 0.452 -0.715 11.773 1.00 0.00 C ATOM 1146 CG ASN A 69 1.550 0.070 12.486 1.00 0.00 C ATOM 1147 OD1 ASN A 69 2.132 -0.405 13.455 1.00 0.00 O ATOM 1148 ND2 ASN A 69 1.794 1.286 12.063 1.00 0.00 N ATOM 0 H ASN A 69 -0.514 -2.299 9.814 1.00 0.00 H new ATOM 0 HA ASN A 69 0.264 0.531 10.007 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -0.512 -0.430 12.195 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.590 -1.776 11.981 1.00 0.00 H new ATOM 0 HD21 ASN A 69 2.484 1.864 12.543 1.00 0.00 H new ATOM 0 HD22 ASN A 69 1.294 1.654 11.254 1.00 0.00 H new ATOM 1155 N LEU A 70 2.576 -0.070 9.367 1.00 0.00 N ATOM 1156 CA LEU A 70 3.853 -0.287 8.955 1.00 0.00 C ATOM 1157 C LEU A 70 4.829 -0.131 10.111 1.00 0.00 C ATOM 1158 O LEU A 70 4.700 0.743 10.974 1.00 0.00 O ATOM 1159 CB LEU A 70 4.175 0.526 7.715 1.00 0.00 C ATOM 1160 CG LEU A 70 3.862 2.023 7.653 1.00 0.00 C ATOM 1161 CD1 LEU A 70 4.487 2.752 8.787 1.00 0.00 C ATOM 1162 CD2 LEU A 70 4.447 2.507 6.382 1.00 0.00 C ATOM 0 H LEU A 70 2.340 0.921 9.413 1.00 0.00 H new ATOM 0 HA LEU A 70 3.964 -1.323 8.636 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.243 0.415 7.528 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.655 0.056 6.880 1.00 0.00 H new ATOM 0 HG LEU A 70 2.787 2.192 7.711 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.246 3.813 8.715 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.105 2.357 9.728 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.569 2.622 8.751 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.257 3.575 6.277 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.522 2.329 6.385 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.993 1.974 5.546 1.00 0.00 H new ATOM 1174 N LYS A 71 5.688 -1.018 10.163 1.00 0.00 N ATOM 1175 CA LYS A 71 6.690 -1.113 11.214 1.00 0.00 C ATOM 1176 C LYS A 71 8.058 -1.271 10.557 1.00 0.00 C ATOM 1177 O LYS A 71 8.138 -1.879 9.512 1.00 0.00 O ATOM 1178 CB LYS A 71 6.381 -2.339 12.091 1.00 0.00 C ATOM 1179 CG LYS A 71 7.222 -2.443 13.346 1.00 0.00 C ATOM 1180 CD LYS A 71 6.906 -3.693 14.132 1.00 0.00 C ATOM 1181 CE LYS A 71 7.567 -3.659 15.497 1.00 0.00 C ATOM 1182 NZ LYS A 71 7.047 -2.549 16.339 1.00 0.00 N ATOM 0 H LYS A 71 5.761 -1.759 9.466 1.00 0.00 H new ATOM 0 HA LYS A 71 6.682 -0.219 11.838 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.329 -2.310 12.375 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.526 -3.241 11.496 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.278 -2.440 13.077 1.00 0.00 H new ATOM 0 HG3 LYS A 71 7.050 -1.567 13.972 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.827 -3.790 14.249 1.00 0.00 H new ATOM 0 HD3 LYS A 71 7.247 -4.569 13.581 1.00 0.00 H new ATOM 0 HE2 LYS A 71 7.399 -4.609 16.005 1.00 0.00 H new ATOM 0 HE3 LYS A 71 8.645 -3.548 15.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 7.220 -2.764 17.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 7.532 -1.665 16.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 6.025 -2.441 16.179 1.00 0.00 H new ATOM 1196 N PRO A 72 9.132 -0.679 11.107 1.00 0.00 N ATOM 1197 CA PRO A 72 10.461 -0.819 10.539 1.00 0.00 C ATOM 1198 C PRO A 72 11.214 -2.041 11.091 1.00 0.00 C ATOM 1199 O PRO A 72 11.088 -2.394 12.279 1.00 0.00 O ATOM 1200 CB PRO A 72 11.146 0.470 10.968 1.00 0.00 C ATOM 1201 CG PRO A 72 10.520 0.817 12.284 1.00 0.00 C ATOM 1202 CD PRO A 72 9.141 0.200 12.299 1.00 0.00 C ATOM 0 HA PRO A 72 10.435 -0.975 9.460 1.00 0.00 H new ATOM 0 HB2 PRO A 72 12.223 0.332 11.066 1.00 0.00 H new ATOM 0 HB3 PRO A 72 10.992 1.262 10.236 1.00 0.00 H new ATOM 0 HG2 PRO A 72 11.121 0.435 13.109 1.00 0.00 H new ATOM 0 HG3 PRO A 72 10.459 1.898 12.408 1.00 0.00 H new ATOM 0 HD2 PRO A 72 8.966 -0.366 13.214 1.00 0.00 H new ATOM 0 HD3 PRO A 72 8.362 0.960 12.241 1.00 0.00 H new ATOM 1210 N LEU A 73 11.972 -2.685 10.233 1.00 0.00 N ATOM 1211 CA LEU A 73 12.764 -3.803 10.575 1.00 0.00 C ATOM 1212 C LEU A 73 14.130 -3.372 11.078 1.00 0.00 C ATOM 1213 O LEU A 73 14.505 -2.191 10.973 1.00 0.00 O ATOM 1214 CB LEU A 73 12.963 -4.678 9.342 1.00 0.00 C ATOM 1215 CG LEU A 73 12.981 -4.004 7.956 1.00 0.00 C ATOM 1216 CD1 LEU A 73 13.964 -4.712 7.041 1.00 0.00 C ATOM 1217 CD2 LEU A 73 11.607 -4.071 7.318 1.00 0.00 C ATOM 0 H LEU A 73 12.044 -2.422 9.250 1.00 0.00 H new ATOM 0 HA LEU A 73 12.250 -4.353 11.363 1.00 0.00 H new ATOM 0 HB2 LEU A 73 13.906 -5.212 9.463 1.00 0.00 H new ATOM 0 HB3 LEU A 73 12.171 -5.427 9.336 1.00 0.00 H new ATOM 0 HG LEU A 73 13.278 -2.964 8.092 1.00 0.00 H new ATOM 0 HD11 LEU A 73 13.967 -4.226 6.065 1.00 0.00 H new ATOM 0 HD12 LEU A 73 14.963 -4.664 7.474 1.00 0.00 H new ATOM 0 HD13 LEU A 73 13.668 -5.755 6.926 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.636 -3.591 6.340 1.00 0.00 H new ATOM 0 HD22 LEU A 73 11.310 -5.113 7.202 1.00 0.00 H new ATOM 0 HD23 LEU A 73 10.885 -3.557 7.953 1.00 0.00 H new ATOM 1229 N SER A 74 14.874 -4.322 11.605 1.00 0.00 N ATOM 1230 CA SER A 74 16.239 -4.091 11.995 1.00 0.00 C ATOM 1231 C SER A 74 17.085 -3.932 10.793 1.00 0.00 C ATOM 1232 O SER A 74 16.815 -4.537 9.757 1.00 0.00 O ATOM 1233 CB SER A 74 16.796 -5.273 12.719 1.00 0.00 C ATOM 1234 OG SER A 74 16.188 -5.461 13.989 1.00 0.00 O ATOM 0 H SER A 74 14.545 -5.273 11.773 1.00 0.00 H new ATOM 0 HA SER A 74 16.243 -3.202 12.626 1.00 0.00 H new ATOM 0 HB2 SER A 74 16.653 -6.168 12.114 1.00 0.00 H new ATOM 0 HB3 SER A 74 17.871 -5.144 12.848 1.00 0.00 H new ATOM 0 HG SER A 74 16.581 -6.245 14.427 1.00 0.00 H new ATOM 1240 N GLY A 75 18.081 -3.104 10.897 1.00 0.00 N ATOM 1241 CA GLY A 75 19.024 -3.008 9.847 1.00 0.00 C ATOM 1242 C GLY A 75 18.523 -2.164 8.681 1.00 0.00 C ATOM 1243 O GLY A 75 19.252 -1.881 7.744 1.00 0.00 O ATOM 0 H GLY A 75 18.253 -2.493 11.696 1.00 0.00 H new ATOM 0 HA2 GLY A 75 19.948 -2.576 10.232 1.00 0.00 H new ATOM 0 HA3 GLY A 75 19.265 -4.009 9.488 1.00 0.00 H new ATOM 1247 N SER A 76 17.276 -1.780 8.769 1.00 0.00 N ATOM 1248 CA SER A 76 16.609 -0.945 7.830 1.00 0.00 C ATOM 1249 C SER A 76 16.968 0.471 8.045 1.00 0.00 C ATOM 1250 O SER A 76 17.417 0.891 9.125 1.00 0.00 O ATOM 1251 CB SER A 76 15.125 -1.147 8.026 1.00 0.00 C ATOM 1252 OG SER A 76 14.369 -0.347 7.168 1.00 0.00 O ATOM 0 H SER A 76 16.675 -2.062 9.543 1.00 0.00 H new ATOM 0 HA SER A 76 16.903 -1.204 6.813 1.00 0.00 H new ATOM 0 HB2 SER A 76 14.877 -2.195 7.857 1.00 0.00 H new ATOM 0 HB3 SER A 76 14.862 -0.920 9.059 1.00 0.00 H new ATOM 0 HG SER A 76 13.427 -0.376 7.438 1.00 0.00 H new ATOM 1258 N ASP A 77 16.807 1.173 7.005 1.00 0.00 N ATOM 1259 CA ASP A 77 16.981 2.524 6.937 1.00 0.00 C ATOM 1260 C ASP A 77 15.626 3.090 6.903 1.00 0.00 C ATOM 1261 O ASP A 77 15.204 3.781 7.815 1.00 0.00 O ATOM 1262 CB ASP A 77 17.792 2.931 5.684 1.00 0.00 C ATOM 1263 CG ASP A 77 17.634 2.006 4.468 1.00 0.00 C ATOM 1264 OD1 ASP A 77 16.499 1.580 4.128 1.00 0.00 O ATOM 1265 OD2 ASP A 77 18.653 1.675 3.844 1.00 0.00 O ATOM 0 H ASP A 77 16.526 0.766 6.113 1.00 0.00 H new ATOM 0 HA ASP A 77 17.552 2.896 7.788 1.00 0.00 H new ATOM 0 HB2 ASP A 77 17.497 3.939 5.393 1.00 0.00 H new ATOM 0 HB3 ASP A 77 18.847 2.973 5.953 1.00 0.00 H new ATOM 1270 N ARG A 78 14.911 2.689 5.892 1.00 0.00 N ATOM 1271 CA ARG A 78 13.565 3.128 5.640 1.00 0.00 C ATOM 1272 C ARG A 78 12.748 2.089 4.867 1.00 0.00 C ATOM 1273 O ARG A 78 11.879 2.400 4.044 1.00 0.00 O ATOM 1274 CB ARG A 78 13.464 4.524 5.015 1.00 0.00 C ATOM 1275 CG ARG A 78 13.431 5.714 6.002 1.00 0.00 C ATOM 1276 CD ARG A 78 14.804 6.288 6.300 1.00 0.00 C ATOM 1277 NE ARG A 78 14.745 7.462 7.175 1.00 0.00 N ATOM 1278 CZ ARG A 78 15.655 7.789 8.094 1.00 0.00 C ATOM 1279 NH1 ARG A 78 16.679 6.978 8.357 1.00 0.00 N ATOM 1280 NH2 ARG A 78 15.533 8.927 8.755 1.00 0.00 N ATOM 0 H ARG A 78 15.257 2.027 5.198 1.00 0.00 H new ATOM 0 HA ARG A 78 13.114 3.226 6.628 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.311 4.660 4.343 1.00 0.00 H new ATOM 0 HB3 ARG A 78 12.562 4.561 4.404 1.00 0.00 H new ATOM 0 HG2 ARG A 78 12.798 6.500 5.591 1.00 0.00 H new ATOM 0 HG3 ARG A 78 12.970 5.390 6.935 1.00 0.00 H new ATOM 0 HD2 ARG A 78 15.421 5.521 6.768 1.00 0.00 H new ATOM 0 HD3 ARG A 78 15.291 6.561 5.364 1.00 0.00 H new ATOM 0 HE ARG A 78 13.941 8.081 7.073 1.00 0.00 H new ATOM 0 HH11 ARG A 78 16.773 6.096 7.853 1.00 0.00 H new ATOM 0 HH12 ARG A 78 17.368 7.239 9.062 1.00 0.00 H new ATOM 0 HH21 ARG A 78 14.747 9.548 8.561 1.00 0.00 H new ATOM 0 HH22 ARG A 78 16.224 9.184 9.459 1.00 0.00 H new ATOM 1294 N ALA A 79 12.962 0.884 5.214 1.00 0.00 N ATOM 1295 CA ALA A 79 12.219 -0.234 4.706 1.00 0.00 C ATOM 1296 C ALA A 79 11.310 -0.669 5.868 1.00 0.00 C ATOM 1297 O ALA A 79 11.764 -0.737 7.015 1.00 0.00 O ATOM 1298 CB ALA A 79 13.181 -1.369 4.394 1.00 0.00 C ATOM 0 H ALA A 79 13.684 0.620 5.885 1.00 0.00 H new ATOM 0 HA ALA A 79 11.661 0.016 3.804 1.00 0.00 H new ATOM 0 HB1 ALA A 79 12.624 -2.222 4.007 1.00 0.00 H new ATOM 0 HB2 ALA A 79 13.903 -1.039 3.647 1.00 0.00 H new ATOM 0 HB3 ALA A 79 13.707 -1.661 5.303 1.00 0.00 H new ATOM 1304 N TRP A 80 10.061 -0.928 5.598 1.00 0.00 N ATOM 1305 CA TRP A 80 9.090 -1.199 6.635 1.00 0.00 C ATOM 1306 C TRP A 80 8.289 -2.384 6.174 1.00 0.00 C ATOM 1307 O TRP A 80 8.320 -2.707 4.967 1.00 0.00 O ATOM 1308 CB TRP A 80 8.122 0.010 6.873 1.00 0.00 C ATOM 1309 CG TRP A 80 8.762 1.355 7.237 1.00 0.00 C ATOM 1310 CD1 TRP A 80 9.635 2.089 6.490 1.00 0.00 C ATOM 1311 CD2 TRP A 80 8.515 2.144 8.416 1.00 0.00 C ATOM 1312 NE1 TRP A 80 9.950 3.254 7.124 1.00 0.00 N ATOM 1313 CE2 TRP A 80 9.285 3.315 8.303 1.00 0.00 C ATOM 1314 CE3 TRP A 80 7.732 1.976 9.551 1.00 0.00 C ATOM 1315 CZ2 TRP A 80 9.290 4.308 9.280 1.00 0.00 C ATOM 1316 CZ3 TRP A 80 7.737 2.964 10.519 1.00 0.00 C ATOM 1317 CH2 TRP A 80 8.511 4.114 10.377 1.00 0.00 C ATOM 0 H TRP A 80 9.681 -0.958 4.652 1.00 0.00 H new ATOM 0 HA TRP A 80 9.608 -1.383 7.576 1.00 0.00 H new ATOM 0 HB2 TRP A 80 7.528 0.151 5.970 1.00 0.00 H new ATOM 0 HB3 TRP A 80 7.430 -0.262 7.670 1.00 0.00 H new ATOM 0 HD1 TRP A 80 10.024 1.789 5.528 1.00 0.00 H new ATOM 0 HE1 TRP A 80 10.586 3.967 6.767 1.00 0.00 H new ATOM 0 HE3 TRP A 80 7.129 1.089 9.676 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 9.890 5.199 9.170 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 7.129 2.842 11.403 1.00 0.00 H new ATOM 0 HH2 TRP A 80 8.492 4.865 11.153 1.00 0.00 H new ATOM 1328 N MET A 81 7.612 -3.022 7.081 1.00 0.00 N ATOM 1329 CA MET A 81 6.808 -4.115 6.815 1.00 0.00 C ATOM 1330 C MET A 81 5.491 -3.824 7.337 1.00 0.00 C ATOM 1331 O MET A 81 5.327 -3.130 8.354 1.00 0.00 O ATOM 1332 CB MET A 81 7.294 -5.453 7.375 1.00 0.00 C ATOM 1333 CG MET A 81 7.542 -5.568 8.880 1.00 0.00 C ATOM 1334 SD MET A 81 9.053 -4.777 9.442 1.00 0.00 S ATOM 1335 CE MET A 81 9.033 -5.222 11.174 1.00 0.00 C ATOM 0 H MET A 81 7.625 -2.760 8.067 1.00 0.00 H new ATOM 0 HA MET A 81 6.821 -4.253 5.734 1.00 0.00 H new ATOM 0 HB2 MET A 81 6.562 -6.213 7.101 1.00 0.00 H new ATOM 0 HB3 MET A 81 8.223 -5.708 6.866 1.00 0.00 H new ATOM 0 HG2 MET A 81 6.697 -5.129 9.410 1.00 0.00 H new ATOM 0 HG3 MET A 81 7.575 -6.623 9.151 1.00 0.00 H new ATOM 0 HE1 MET A 81 9.529 -4.444 11.755 1.00 0.00 H new ATOM 0 HE2 MET A 81 8.002 -5.325 11.511 1.00 0.00 H new ATOM 0 HE3 MET A 81 9.556 -6.168 11.313 1.00 0.00 H new ATOM 1345 N TRP A 82 4.585 -4.313 6.679 1.00 0.00 N ATOM 1346 CA TRP A 82 3.248 -4.087 6.943 1.00 0.00 C ATOM 1347 C TRP A 82 2.550 -5.399 6.860 1.00 0.00 C ATOM 1348 O TRP A 82 2.996 -6.290 6.111 1.00 0.00 O ATOM 1349 CB TRP A 82 2.676 -3.050 5.974 1.00 0.00 C ATOM 1350 CG TRP A 82 3.171 -3.185 4.571 1.00 0.00 C ATOM 1351 CD1 TRP A 82 2.708 -4.017 3.597 1.00 0.00 C ATOM 1352 CD2 TRP A 82 4.245 -2.450 3.993 1.00 0.00 C ATOM 1353 NE1 TRP A 82 3.446 -3.850 2.456 1.00 0.00 N ATOM 1354 CE2 TRP A 82 4.394 -2.893 2.677 1.00 0.00 C ATOM 1355 CE3 TRP A 82 5.099 -1.457 4.473 1.00 0.00 C ATOM 1356 CZ2 TRP A 82 5.363 -2.384 1.835 1.00 0.00 C ATOM 1357 CZ3 TRP A 82 6.057 -0.949 3.634 1.00 0.00 C ATOM 1358 CH2 TRP A 82 6.183 -1.412 2.328 1.00 0.00 C ATOM 0 H TRP A 82 4.746 -4.928 5.881 1.00 0.00 H new ATOM 0 HA TRP A 82 3.106 -3.671 7.940 1.00 0.00 H new ATOM 0 HB2 TRP A 82 1.589 -3.131 5.973 1.00 0.00 H new ATOM 0 HB3 TRP A 82 2.922 -2.053 6.340 1.00 0.00 H new ATOM 0 HD1 TRP A 82 1.883 -4.705 3.708 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.310 -4.358 1.582 1.00 0.00 H new ATOM 0 HE3 TRP A 82 5.007 -1.095 5.486 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 5.468 -2.743 0.822 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 6.723 -0.178 3.992 1.00 0.00 H new ATOM 0 HH2 TRP A 82 6.947 -0.992 1.690 1.00 0.00 H new ATOM 1369 N LEU A 83 1.512 -5.579 7.589 1.00 0.00 N ATOM 1370 CA LEU A 83 0.875 -6.844 7.516 1.00 0.00 C ATOM 1371 C LEU A 83 -0.458 -6.753 6.790 1.00 0.00 C ATOM 1372 O LEU A 83 -1.313 -5.945 7.130 1.00 0.00 O ATOM 1373 CB LEU A 83 0.702 -7.536 8.875 1.00 0.00 C ATOM 1374 CG LEU A 83 -0.141 -6.801 9.939 1.00 0.00 C ATOM 1375 CD1 LEU A 83 -0.605 -7.788 10.992 1.00 0.00 C ATOM 1376 CD2 LEU A 83 0.668 -5.700 10.623 1.00 0.00 C ATOM 0 H LEU A 83 1.095 -4.896 8.222 1.00 0.00 H new ATOM 0 HA LEU A 83 1.553 -7.473 6.939 1.00 0.00 H new ATOM 0 HB2 LEU A 83 0.250 -8.513 8.702 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.693 -7.713 9.293 1.00 0.00 H new ATOM 0 HG LEU A 83 -0.996 -6.349 9.436 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -1.200 -7.267 11.742 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -1.211 -8.563 10.522 1.00 0.00 H new ATOM 0 HD13 LEU A 83 0.262 -8.245 11.470 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.047 -5.201 11.367 1.00 0.00 H new ATOM 0 HD22 LEU A 83 1.538 -6.138 11.112 1.00 0.00 H new ATOM 0 HD23 LEU A 83 0.997 -4.974 9.879 1.00 0.00 H new ATOM 1388 N ALA A 84 -0.633 -7.586 5.828 1.00 0.00 N ATOM 1389 CA ALA A 84 -1.827 -7.599 5.018 1.00 0.00 C ATOM 1390 C ALA A 84 -2.161 -8.996 4.670 1.00 0.00 C ATOM 1391 O ALA A 84 -1.315 -9.869 4.798 1.00 0.00 O ATOM 1392 CB ALA A 84 -1.624 -6.835 3.731 1.00 0.00 C ATOM 0 H ALA A 84 0.052 -8.295 5.566 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.628 -7.131 5.590 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.541 -6.863 3.143 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.370 -5.800 3.959 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -0.814 -7.290 3.162 1.00 0.00 H new ATOM 1398 N SER A 85 -3.355 -9.232 4.245 1.00 0.00 N ATOM 1399 CA SER A 85 -3.671 -10.460 3.692 1.00 0.00 C ATOM 1400 C SER A 85 -3.274 -10.424 2.284 1.00 0.00 C ATOM 1401 O SER A 85 -3.892 -9.827 1.405 1.00 0.00 O ATOM 1402 CB SER A 85 -5.081 -10.724 3.861 1.00 0.00 C ATOM 1403 OG SER A 85 -5.681 -9.710 4.684 1.00 0.00 O ATOM 0 H SER A 85 -4.125 -8.564 4.281 1.00 0.00 H new ATOM 0 HA SER A 85 -3.140 -11.273 4.188 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.572 -10.751 2.888 1.00 0.00 H new ATOM 0 HB3 SER A 85 -5.223 -11.704 4.317 1.00 0.00 H new ATOM 0 HG SER A 85 -6.637 -9.898 4.790 1.00 0.00 H new ATOM 1409 N ASP A 86 -2.193 -11.044 2.129 1.00 0.00 N ATOM 1410 CA ASP A 86 -1.434 -11.000 1.007 1.00 0.00 C ATOM 1411 C ASP A 86 -1.146 -12.346 0.368 1.00 0.00 C ATOM 1412 O ASP A 86 -0.740 -13.303 1.051 1.00 0.00 O ATOM 1413 CB ASP A 86 -0.164 -10.220 1.312 1.00 0.00 C ATOM 1414 CG ASP A 86 0.946 -10.432 0.398 1.00 0.00 C ATOM 1415 OD1 ASP A 86 0.687 -10.637 -0.767 1.00 0.00 O ATOM 1416 OD2 ASP A 86 2.096 -10.244 0.825 1.00 0.00 O ATOM 0 H ASP A 86 -1.797 -11.641 2.855 1.00 0.00 H new ATOM 0 HA ASP A 86 -2.019 -10.488 0.243 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -0.406 -9.157 1.319 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.165 -10.478 2.319 1.00 0.00 H new ATOM 1421 N PHE A 87 -1.541 -12.404 -0.918 1.00 0.00 N ATOM 1422 CA PHE A 87 -1.153 -13.300 -1.927 1.00 0.00 C ATOM 1423 C PHE A 87 -2.227 -13.303 -3.002 1.00 0.00 C ATOM 1424 O PHE A 87 -3.341 -13.750 -2.808 1.00 0.00 O ATOM 1425 CB PHE A 87 -0.831 -14.650 -1.472 1.00 0.00 C ATOM 1426 CG PHE A 87 0.624 -14.996 -1.684 1.00 0.00 C ATOM 1427 CD1 PHE A 87 1.095 -15.369 -2.933 1.00 0.00 C ATOM 1428 CD2 PHE A 87 1.526 -14.922 -0.634 1.00 0.00 C ATOM 1429 CE1 PHE A 87 2.429 -15.668 -3.127 1.00 0.00 C ATOM 1430 CE2 PHE A 87 2.858 -15.218 -0.823 1.00 0.00 C ATOM 1431 CZ PHE A 87 3.310 -15.592 -2.069 1.00 0.00 C ATOM 0 H PHE A 87 -2.218 -11.729 -1.274 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.205 -12.942 -2.328 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -1.073 -14.741 -0.413 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -1.454 -15.369 -2.005 1.00 0.00 H new ATOM 0 HD1 PHE A 87 0.410 -15.427 -3.766 1.00 0.00 H new ATOM 0 HD2 PHE A 87 1.180 -14.628 0.346 1.00 0.00 H new ATOM 0 HE1 PHE A 87 2.781 -15.961 -4.105 1.00 0.00 H new ATOM 0 HE2 PHE A 87 3.548 -15.157 0.006 1.00 0.00 H new ATOM 0 HZ PHE A 87 4.354 -15.826 -2.217 1.00 0.00 H new ATOM 1441 N SER A 88 -1.871 -12.752 -4.096 1.00 0.00 N ATOM 1442 CA SER A 88 -2.736 -12.475 -5.206 1.00 0.00 C ATOM 1443 C SER A 88 -3.127 -13.745 -5.871 1.00 0.00 C ATOM 1444 O SER A 88 -4.272 -13.940 -6.235 1.00 0.00 O ATOM 1445 CB SER A 88 -2.046 -11.514 -6.186 1.00 0.00 C ATOM 1446 OG SER A 88 -2.910 -11.093 -7.223 1.00 0.00 O ATOM 0 H SER A 88 -0.909 -12.458 -4.265 1.00 0.00 H new ATOM 0 HA SER A 88 -3.644 -11.989 -4.848 1.00 0.00 H new ATOM 0 HB2 SER A 88 -1.684 -10.642 -5.642 1.00 0.00 H new ATOM 0 HB3 SER A 88 -1.174 -12.004 -6.619 1.00 0.00 H new ATOM 0 HG SER A 88 -2.430 -10.483 -7.821 1.00 0.00 H new ATOM 1452 N ASP A 89 -2.182 -14.661 -5.941 1.00 0.00 N ATOM 1453 CA ASP A 89 -2.434 -15.885 -6.621 1.00 0.00 C ATOM 1454 C ASP A 89 -2.130 -17.026 -5.693 1.00 0.00 C ATOM 1455 O ASP A 89 -2.332 -18.203 -5.983 1.00 0.00 O ATOM 1456 CB ASP A 89 -1.659 -15.943 -7.951 1.00 0.00 C ATOM 1457 CG ASP A 89 -1.771 -17.261 -8.701 1.00 0.00 C ATOM 1458 OD1 ASP A 89 -2.750 -17.471 -9.434 1.00 0.00 O ATOM 1459 OD2 ASP A 89 -0.847 -18.086 -8.599 1.00 0.00 O ATOM 0 H ASP A 89 -1.250 -14.570 -5.537 1.00 0.00 H new ATOM 0 HA ASP A 89 -3.486 -15.960 -6.898 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -2.017 -15.142 -8.598 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -0.606 -15.744 -7.750 1.00 0.00 H new ATOM 1464 N GLY A 90 -1.713 -16.641 -4.530 1.00 0.00 N ATOM 1465 CA GLY A 90 -1.354 -17.543 -3.546 1.00 0.00 C ATOM 1466 C GLY A 90 -2.341 -17.515 -2.462 1.00 0.00 C ATOM 1467 O GLY A 90 -2.214 -18.247 -1.473 1.00 0.00 O ATOM 0 H GLY A 90 -1.619 -15.663 -4.256 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -1.290 -18.547 -3.966 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -0.366 -17.297 -3.157 1.00 0.00 H new ATOM 1471 N ASP A 91 -3.288 -16.585 -2.627 1.00 0.00 N ATOM 1472 CA ASP A 91 -4.487 -16.469 -1.765 1.00 0.00 C ATOM 1473 C ASP A 91 -4.238 -15.637 -0.527 1.00 0.00 C ATOM 1474 O ASP A 91 -3.244 -15.818 0.173 1.00 0.00 O ATOM 1475 CB ASP A 91 -5.090 -17.844 -1.494 1.00 0.00 C ATOM 1476 CG ASP A 91 -5.807 -17.998 -0.171 1.00 0.00 C ATOM 1477 OD1 ASP A 91 -6.877 -17.390 0.028 1.00 0.00 O ATOM 1478 OD2 ASP A 91 -5.331 -18.797 0.673 1.00 0.00 O ATOM 0 H ASP A 91 -3.251 -15.883 -3.366 1.00 0.00 H new ATOM 0 HA ASP A 91 -5.246 -15.906 -2.308 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -5.791 -18.077 -2.295 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -4.293 -18.586 -1.542 1.00 0.00 H new ATOM 1483 N ALA A 92 -5.151 -14.724 -0.273 1.00 0.00 N ATOM 1484 CA ALA A 92 -4.959 -13.698 0.720 1.00 0.00 C ATOM 1485 C ALA A 92 -5.089 -14.197 2.148 1.00 0.00 C ATOM 1486 O ALA A 92 -6.195 -14.398 2.676 1.00 0.00 O ATOM 1487 CB ALA A 92 -5.894 -12.532 0.461 1.00 0.00 C ATOM 0 H ALA A 92 -6.050 -14.675 -0.753 1.00 0.00 H new ATOM 0 HA ALA A 92 -3.927 -13.362 0.620 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -5.737 -11.765 1.219 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -5.691 -12.115 -0.525 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.927 -12.878 0.503 1.00 0.00 H new ATOM 1493 N LYS A 93 -3.948 -14.403 2.738 1.00 0.00 N ATOM 1494 CA LYS A 93 -3.754 -14.772 4.097 1.00 0.00 C ATOM 1495 C LYS A 93 -2.804 -13.745 4.630 1.00 0.00 C ATOM 1496 O LYS A 93 -2.036 -13.191 3.848 1.00 0.00 O ATOM 1497 CB LYS A 93 -3.118 -16.151 4.131 1.00 0.00 C ATOM 1498 CG LYS A 93 -4.060 -17.317 4.443 1.00 0.00 C ATOM 1499 CD LYS A 93 -5.300 -17.293 3.562 1.00 0.00 C ATOM 1500 CE LYS A 93 -6.170 -18.517 3.744 1.00 0.00 C ATOM 1501 NZ LYS A 93 -5.527 -19.715 3.190 1.00 0.00 N ATOM 0 H LYS A 93 -3.065 -14.308 2.236 1.00 0.00 H new ATOM 0 HA LYS A 93 -4.676 -14.810 4.678 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -2.649 -16.337 3.165 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -2.322 -16.144 4.875 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -3.531 -18.259 4.301 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -4.358 -17.273 5.491 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -5.884 -16.401 3.788 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -4.997 -17.220 2.517 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -6.372 -18.668 4.804 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -7.131 -18.359 3.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -6.219 -20.490 3.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -5.173 -19.509 2.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -4.733 -19.996 3.800 1.00 0.00 H new ATOM 1515 N LEU A 94 -2.832 -13.447 5.894 1.00 0.00 N ATOM 1516 CA LEU A 94 -2.012 -12.383 6.353 1.00 0.00 C ATOM 1517 C LEU A 94 -0.559 -12.762 6.511 1.00 0.00 C ATOM 1518 O LEU A 94 -0.196 -13.762 7.135 1.00 0.00 O ATOM 1519 CB LEU A 94 -2.642 -11.536 7.492 1.00 0.00 C ATOM 1520 CG LEU A 94 -2.927 -12.194 8.861 1.00 0.00 C ATOM 1521 CD1 LEU A 94 -1.654 -12.495 9.641 1.00 0.00 C ATOM 1522 CD2 LEU A 94 -3.847 -11.306 9.675 1.00 0.00 C ATOM 0 H LEU A 94 -3.398 -13.913 6.603 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.979 -11.661 5.537 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -1.984 -10.686 7.669 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.585 -11.137 7.119 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.413 -13.151 8.669 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.912 -12.956 10.594 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -1.027 -13.177 9.066 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -1.110 -11.568 9.822 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.045 -11.774 10.639 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -3.372 -10.337 9.832 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.786 -11.167 9.139 1.00 0.00 H new ATOM 1534 N GLU A 95 0.220 -11.964 5.900 1.00 0.00 N ATOM 1535 CA GLU A 95 1.570 -12.052 5.737 1.00 0.00 C ATOM 1536 C GLU A 95 2.029 -10.711 5.998 1.00 0.00 C ATOM 1537 O GLU A 95 1.306 -9.719 5.791 1.00 0.00 O ATOM 1538 CB GLU A 95 1.914 -12.430 4.294 1.00 0.00 C ATOM 1539 CG GLU A 95 1.774 -13.890 3.881 1.00 0.00 C ATOM 1540 CD GLU A 95 2.958 -14.730 4.309 1.00 0.00 C ATOM 1541 OE1 GLU A 95 4.124 -14.371 3.988 1.00 0.00 O ATOM 1542 OE2 GLU A 95 2.764 -15.773 4.980 1.00 0.00 O ATOM 0 H GLU A 95 -0.150 -11.127 5.450 1.00 0.00 H new ATOM 0 HA GLU A 95 2.021 -12.805 6.383 1.00 0.00 H new ATOM 0 HB2 GLU A 95 1.283 -11.835 3.634 1.00 0.00 H new ATOM 0 HB3 GLU A 95 2.945 -12.128 4.107 1.00 0.00 H new ATOM 0 HG2 GLU A 95 0.864 -14.302 4.317 1.00 0.00 H new ATOM 0 HG3 GLU A 95 1.663 -13.949 2.798 1.00 0.00 H new ATOM 1549 N GLN A 96 3.148 -10.652 6.449 1.00 0.00 N ATOM 1550 CA GLN A 96 3.707 -9.489 6.726 1.00 0.00 C ATOM 1551 C GLN A 96 4.868 -9.425 5.822 1.00 0.00 C ATOM 1552 O GLN A 96 5.755 -10.257 5.859 1.00 0.00 O ATOM 1553 CB GLN A 96 4.061 -9.405 8.191 1.00 0.00 C ATOM 1554 CG GLN A 96 4.590 -8.065 8.660 1.00 0.00 C ATOM 1555 CD GLN A 96 4.735 -8.003 10.173 1.00 0.00 C ATOM 1556 OE1 GLN A 96 5.599 -7.310 10.698 1.00 0.00 O ATOM 1557 NE2 GLN A 96 3.882 -8.702 10.885 1.00 0.00 N ATOM 0 H GLN A 96 3.732 -11.465 6.646 1.00 0.00 H new ATOM 0 HA GLN A 96 3.051 -8.633 6.565 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.174 -9.650 8.775 1.00 0.00 H new ATOM 0 HB3 GLN A 96 4.808 -10.168 8.410 1.00 0.00 H new ATOM 0 HG2 GLN A 96 5.558 -7.876 8.196 1.00 0.00 H new ATOM 0 HG3 GLN A 96 3.917 -7.274 8.328 1.00 0.00 H new ATOM 0 HE21 GLN A 96 3.174 -9.270 10.420 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.927 -8.677 11.904 1.00 0.00 H new ATOM 1566 N LEU A 97 4.806 -8.544 4.968 1.00 0.00 N ATOM 1567 CA LEU A 97 5.792 -8.367 4.021 1.00 0.00 C ATOM 1568 C LEU A 97 6.355 -6.981 4.096 1.00 0.00 C ATOM 1569 O LEU A 97 5.670 -6.040 4.496 1.00 0.00 O ATOM 1570 CB LEU A 97 5.250 -8.697 2.638 1.00 0.00 C ATOM 1571 CG LEU A 97 5.469 -10.150 2.118 1.00 0.00 C ATOM 1572 CD1 LEU A 97 4.704 -11.164 2.898 1.00 0.00 C ATOM 1573 CD2 LEU A 97 5.145 -10.277 0.662 1.00 0.00 C ATOM 0 H LEU A 97 4.032 -7.884 4.893 1.00 0.00 H new ATOM 0 HA LEU A 97 6.614 -9.053 4.224 1.00 0.00 H new ATOM 0 HB2 LEU A 97 4.179 -8.495 2.637 1.00 0.00 H new ATOM 0 HB3 LEU A 97 5.704 -8.010 1.924 1.00 0.00 H new ATOM 0 HG LEU A 97 6.530 -10.354 2.259 1.00 0.00 H new ATOM 0 HD11 LEU A 97 4.895 -12.157 2.491 1.00 0.00 H new ATOM 0 HD12 LEU A 97 5.018 -11.133 3.941 1.00 0.00 H new ATOM 0 HD13 LEU A 97 3.638 -10.945 2.833 1.00 0.00 H new ATOM 0 HD21 LEU A 97 5.311 -11.305 0.341 1.00 0.00 H new ATOM 0 HD22 LEU A 97 4.101 -10.009 0.497 1.00 0.00 H new ATOM 0 HD23 LEU A 97 5.786 -9.609 0.087 1.00 0.00 H new ATOM 1585 N ALA A 98 7.590 -6.874 3.740 1.00 0.00 N ATOM 1586 CA ALA A 98 8.307 -5.645 3.790 1.00 0.00 C ATOM 1587 C ALA A 98 8.717 -5.250 2.415 1.00 0.00 C ATOM 1588 O ALA A 98 8.769 -6.092 1.518 1.00 0.00 O ATOM 1589 CB ALA A 98 9.544 -5.769 4.678 1.00 0.00 C ATOM 0 H ALA A 98 8.143 -7.659 3.397 1.00 0.00 H new ATOM 0 HA ALA A 98 7.654 -4.882 4.214 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.074 -4.817 4.699 1.00 0.00 H new ATOM 0 HB2 ALA A 98 9.240 -6.038 5.690 1.00 0.00 H new ATOM 0 HB3 ALA A 98 10.202 -6.541 4.280 1.00 0.00 H new ATOM 1595 N ALA A 99 8.977 -4.000 2.226 1.00 0.00 N ATOM 1596 CA ALA A 99 9.495 -3.547 0.970 1.00 0.00 C ATOM 1597 C ALA A 99 10.506 -2.454 1.173 1.00 0.00 C ATOM 1598 O ALA A 99 10.250 -1.431 1.881 1.00 0.00 O ATOM 1599 CB ALA A 99 8.406 -3.133 -0.003 1.00 0.00 C ATOM 0 H ALA A 99 8.840 -3.269 2.924 1.00 0.00 H new ATOM 0 HA ALA A 99 10.000 -4.396 0.509 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.860 -2.799 -0.936 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.752 -3.983 -0.201 1.00 0.00 H new ATOM 0 HB3 ALA A 99 7.823 -2.319 0.428 1.00 0.00 H new ATOM 1605 N LYS A 100 11.631 -2.639 0.560 1.00 0.00 N ATOM 1606 CA LYS A 100 12.704 -1.779 0.645 1.00 0.00 C ATOM 1607 C LYS A 100 12.948 -1.269 -0.699 1.00 0.00 C ATOM 1608 O LYS A 100 12.772 -1.951 -1.700 1.00 0.00 O ATOM 1609 CB LYS A 100 13.964 -2.482 1.125 1.00 0.00 C ATOM 1610 CG LYS A 100 15.216 -1.598 1.211 1.00 0.00 C ATOM 1611 CD LYS A 100 16.476 -2.406 1.460 1.00 0.00 C ATOM 1612 CE LYS A 100 17.732 -1.523 1.420 1.00 0.00 C ATOM 1613 NZ LYS A 100 17.746 -0.494 2.487 1.00 0.00 N ATOM 0 H LYS A 100 11.807 -3.446 -0.039 1.00 0.00 H new ATOM 0 HA LYS A 100 12.471 -0.990 1.360 1.00 0.00 H new ATOM 0 HB2 LYS A 100 13.771 -2.906 2.110 1.00 0.00 H new ATOM 0 HB3 LYS A 100 14.173 -3.315 0.454 1.00 0.00 H new ATOM 0 HG2 LYS A 100 15.325 -1.036 0.284 1.00 0.00 H new ATOM 0 HG3 LYS A 100 15.090 -0.870 2.012 1.00 0.00 H new ATOM 0 HD2 LYS A 100 16.407 -2.898 2.430 1.00 0.00 H new ATOM 0 HD3 LYS A 100 16.559 -3.192 0.709 1.00 0.00 H new ATOM 0 HE2 LYS A 100 18.616 -2.153 1.517 1.00 0.00 H new ATOM 0 HE3 LYS A 100 17.795 -1.033 0.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 18.645 0.028 2.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 16.957 0.167 2.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 17.646 -0.954 3.414 1.00 0.00 H new ATOM 1627 N PHE A 101 13.309 -0.125 -0.680 1.00 0.00 N ATOM 1628 CA PHE A 101 13.702 0.615 -1.838 1.00 0.00 C ATOM 1629 C PHE A 101 15.198 0.797 -1.824 1.00 0.00 C ATOM 1630 O PHE A 101 15.815 0.665 -0.764 1.00 0.00 O ATOM 1631 CB PHE A 101 12.985 1.942 -1.894 1.00 0.00 C ATOM 1632 CG PHE A 101 11.574 1.855 -2.405 1.00 0.00 C ATOM 1633 CD1 PHE A 101 10.514 1.633 -1.549 1.00 0.00 C ATOM 1634 CD2 PHE A 101 11.318 2.011 -3.760 1.00 0.00 C ATOM 1635 CE1 PHE A 101 9.221 1.567 -2.035 1.00 0.00 C ATOM 1636 CE2 PHE A 101 10.031 1.945 -4.249 1.00 0.00 C ATOM 1637 CZ PHE A 101 8.982 1.724 -3.387 1.00 0.00 C ATOM 0 H PHE A 101 13.365 0.419 0.181 1.00 0.00 H new ATOM 0 HA PHE A 101 13.424 0.062 -2.735 1.00 0.00 H new ATOM 0 HB2 PHE A 101 12.972 2.379 -0.895 1.00 0.00 H new ATOM 0 HB3 PHE A 101 13.550 2.622 -2.532 1.00 0.00 H new ATOM 0 HD1 PHE A 101 10.696 1.510 -0.492 1.00 0.00 H new ATOM 0 HD2 PHE A 101 12.138 2.186 -4.440 1.00 0.00 H new ATOM 0 HE1 PHE A 101 8.398 1.393 -1.358 1.00 0.00 H new ATOM 0 HE2 PHE A 101 9.847 2.066 -5.306 1.00 0.00 H new ATOM 0 HZ PHE A 101 7.972 1.673 -3.767 1.00 0.00 H new ATOM 1647 N LYS A 102 15.756 1.092 -2.993 1.00 0.00 N ATOM 1648 CA LYS A 102 17.208 1.234 -3.214 1.00 0.00 C ATOM 1649 C LYS A 102 17.886 2.059 -2.134 1.00 0.00 C ATOM 1650 O LYS A 102 18.865 1.638 -1.539 1.00 0.00 O ATOM 1651 CB LYS A 102 17.536 1.904 -4.573 1.00 0.00 C ATOM 1652 CG LYS A 102 16.985 1.249 -5.844 1.00 0.00 C ATOM 1653 CD LYS A 102 15.548 1.646 -6.136 1.00 0.00 C ATOM 1654 CE LYS A 102 15.108 1.130 -7.478 1.00 0.00 C ATOM 1655 NZ LYS A 102 13.746 1.574 -7.821 1.00 0.00 N ATOM 0 H LYS A 102 15.207 1.244 -3.839 1.00 0.00 H new ATOM 0 HA LYS A 102 17.587 0.212 -3.196 1.00 0.00 H new ATOM 0 HB2 LYS A 102 17.168 2.929 -4.538 1.00 0.00 H new ATOM 0 HB3 LYS A 102 18.621 1.957 -4.667 1.00 0.00 H new ATOM 0 HG2 LYS A 102 17.613 1.526 -6.691 1.00 0.00 H new ATOM 0 HG3 LYS A 102 17.044 0.165 -5.744 1.00 0.00 H new ATOM 0 HD2 LYS A 102 14.893 1.252 -5.359 1.00 0.00 H new ATOM 0 HD3 LYS A 102 15.455 2.732 -6.112 1.00 0.00 H new ATOM 0 HE2 LYS A 102 15.804 1.472 -8.244 1.00 0.00 H new ATOM 0 HE3 LYS A 102 15.145 0.041 -7.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 13.748 1.997 -8.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.101 0.758 -7.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 13.426 2.280 -7.128 1.00 0.00 H new ATOM 1669 N THR A 103 17.347 3.210 -1.879 1.00 0.00 N ATOM 1670 CA THR A 103 17.939 4.150 -0.974 1.00 0.00 C ATOM 1671 C THR A 103 16.877 4.599 -0.006 1.00 0.00 C ATOM 1672 O THR A 103 15.689 4.421 -0.300 1.00 0.00 O ATOM 1673 CB THR A 103 18.397 5.385 -1.774 1.00 0.00 C ATOM 1674 OG1 THR A 103 17.261 5.899 -2.502 1.00 0.00 O ATOM 1675 CG2 THR A 103 19.504 5.036 -2.758 1.00 0.00 C ATOM 0 H THR A 103 16.473 3.529 -2.297 1.00 0.00 H new ATOM 0 HA THR A 103 18.782 3.695 -0.453 1.00 0.00 H new ATOM 0 HB THR A 103 18.789 6.127 -1.079 1.00 0.00 H new ATOM 0 HG1 THR A 103 17.573 6.462 -3.241 1.00 0.00 H new ATOM 0 HG21 THR A 103 19.801 5.931 -3.304 1.00 0.00 H new ATOM 0 HG22 THR A 103 20.362 4.641 -2.215 1.00 0.00 H new ATOM 0 HG23 THR A 103 19.143 4.286 -3.461 1.00 0.00 H new ATOM 1683 N PRO A 104 17.242 5.200 1.159 1.00 0.00 N ATOM 1684 CA PRO A 104 16.268 5.799 2.075 1.00 0.00 C ATOM 1685 C PRO A 104 15.505 6.934 1.448 1.00 0.00 C ATOM 1686 O PRO A 104 14.661 7.447 2.011 1.00 0.00 O ATOM 1687 CB PRO A 104 17.094 6.356 3.203 1.00 0.00 C ATOM 1688 CG PRO A 104 18.341 5.552 3.182 1.00 0.00 C ATOM 1689 CD PRO A 104 18.604 5.268 1.723 1.00 0.00 C ATOM 0 HA PRO A 104 15.533 5.054 2.379 1.00 0.00 H new ATOM 0 HB2 PRO A 104 17.302 7.416 3.057 1.00 0.00 H new ATOM 0 HB3 PRO A 104 16.577 6.262 4.158 1.00 0.00 H new ATOM 0 HG2 PRO A 104 19.170 6.099 3.632 1.00 0.00 H new ATOM 0 HG3 PRO A 104 18.223 4.628 3.748 1.00 0.00 H new ATOM 0 HD2 PRO A 104 19.197 6.055 1.257 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.148 4.334 1.583 1.00 0.00 H new ATOM 1697 N GLU A 105 15.885 7.333 0.318 1.00 0.00 N ATOM 1698 CA GLU A 105 15.176 8.333 -0.428 1.00 0.00 C ATOM 1699 C GLU A 105 13.885 7.729 -0.902 1.00 0.00 C ATOM 1700 O GLU A 105 12.796 8.226 -0.638 1.00 0.00 O ATOM 1701 CB GLU A 105 16.013 8.852 -1.605 1.00 0.00 C ATOM 1702 CG GLU A 105 15.257 9.790 -2.530 1.00 0.00 C ATOM 1703 CD GLU A 105 16.068 10.250 -3.710 1.00 0.00 C ATOM 1704 OE1 GLU A 105 16.212 9.490 -4.695 1.00 0.00 O ATOM 1705 OE2 GLU A 105 16.564 11.391 -3.687 1.00 0.00 O ATOM 0 H GLU A 105 16.719 6.980 -0.152 1.00 0.00 H new ATOM 0 HA GLU A 105 14.972 9.194 0.209 1.00 0.00 H new ATOM 0 HB2 GLU A 105 16.889 9.370 -1.215 1.00 0.00 H new ATOM 0 HB3 GLU A 105 16.376 8.002 -2.183 1.00 0.00 H new ATOM 0 HG2 GLU A 105 14.359 9.287 -2.890 1.00 0.00 H new ATOM 0 HG3 GLU A 105 14.929 10.661 -1.963 1.00 0.00 H new ATOM 1712 N LEU A 106 14.035 6.621 -1.571 1.00 0.00 N ATOM 1713 CA LEU A 106 12.947 5.917 -2.145 1.00 0.00 C ATOM 1714 C LEU A 106 12.211 5.196 -1.079 1.00 0.00 C ATOM 1715 O LEU A 106 10.988 5.150 -1.051 1.00 0.00 O ATOM 1716 CB LEU A 106 13.452 5.040 -3.274 1.00 0.00 C ATOM 1717 CG LEU A 106 13.938 5.823 -4.496 1.00 0.00 C ATOM 1718 CD1 LEU A 106 14.551 4.903 -5.510 1.00 0.00 C ATOM 1719 CD2 LEU A 106 12.790 6.609 -5.121 1.00 0.00 C ATOM 0 H LEU A 106 14.941 6.181 -1.730 1.00 0.00 H new ATOM 0 HA LEU A 106 12.225 6.596 -2.598 1.00 0.00 H new ATOM 0 HB2 LEU A 106 14.269 4.421 -2.903 1.00 0.00 H new ATOM 0 HB3 LEU A 106 12.654 4.364 -3.581 1.00 0.00 H new ATOM 0 HG LEU A 106 14.702 6.527 -4.164 1.00 0.00 H new ATOM 0 HD11 LEU A 106 14.889 5.482 -6.369 1.00 0.00 H new ATOM 0 HD12 LEU A 106 15.400 4.385 -5.065 1.00 0.00 H new ATOM 0 HD13 LEU A 106 13.810 4.172 -5.834 1.00 0.00 H new ATOM 0 HD21 LEU A 106 13.155 7.159 -5.988 1.00 0.00 H new ATOM 0 HD22 LEU A 106 12.005 5.920 -5.433 1.00 0.00 H new ATOM 0 HD23 LEU A 106 12.388 7.310 -4.389 1.00 0.00 H new ATOM 1731 N ALA A 107 12.977 4.680 -0.167 1.00 0.00 N ATOM 1732 CA ALA A 107 12.475 3.999 0.959 1.00 0.00 C ATOM 1733 C ALA A 107 11.755 4.975 1.851 1.00 0.00 C ATOM 1734 O ALA A 107 10.625 4.697 2.257 1.00 0.00 O ATOM 1735 CB ALA A 107 13.627 3.333 1.683 1.00 0.00 C ATOM 0 H ALA A 107 13.995 4.729 -0.198 1.00 0.00 H new ATOM 0 HA ALA A 107 11.765 3.229 0.658 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.249 2.802 2.557 1.00 0.00 H new ATOM 0 HB2 ALA A 107 14.118 2.626 1.014 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.344 4.090 2.000 1.00 0.00 H new ATOM 1741 N GLU A 108 12.361 6.134 2.134 1.00 0.00 N ATOM 1742 CA GLU A 108 11.684 7.039 3.078 1.00 0.00 C ATOM 1743 C GLU A 108 10.469 7.702 2.492 1.00 0.00 C ATOM 1744 O GLU A 108 9.378 7.565 3.038 1.00 0.00 O ATOM 1745 CB GLU A 108 12.620 8.068 3.731 1.00 0.00 C ATOM 1746 CG GLU A 108 11.919 8.950 4.748 1.00 0.00 C ATOM 1747 CD GLU A 108 12.845 9.836 5.500 1.00 0.00 C ATOM 1748 OE1 GLU A 108 13.322 10.836 4.939 1.00 0.00 O ATOM 1749 OE2 GLU A 108 13.112 9.550 6.683 1.00 0.00 O ATOM 0 H GLU A 108 13.253 6.455 1.757 1.00 0.00 H new ATOM 0 HA GLU A 108 11.340 6.384 3.878 1.00 0.00 H new ATOM 0 HB2 GLU A 108 13.442 7.544 4.219 1.00 0.00 H new ATOM 0 HB3 GLU A 108 13.058 8.696 2.955 1.00 0.00 H new ATOM 0 HG2 GLU A 108 11.177 9.563 4.236 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.379 8.319 5.454 1.00 0.00 H new ATOM 1756 N GLU A 109 10.623 8.302 1.344 1.00 0.00 N ATOM 1757 CA GLU A 109 9.543 9.069 0.750 1.00 0.00 C ATOM 1758 C GLU A 109 8.351 8.234 0.409 1.00 0.00 C ATOM 1759 O GLU A 109 7.220 8.676 0.601 1.00 0.00 O ATOM 1760 CB GLU A 109 9.996 9.890 -0.439 1.00 0.00 C ATOM 1761 CG GLU A 109 10.849 11.080 -0.052 1.00 0.00 C ATOM 1762 CD GLU A 109 10.107 12.018 0.878 1.00 0.00 C ATOM 1763 OE1 GLU A 109 9.196 12.734 0.415 1.00 0.00 O ATOM 1764 OE2 GLU A 109 10.412 12.066 2.088 1.00 0.00 O ATOM 0 H GLU A 109 11.482 8.280 0.795 1.00 0.00 H new ATOM 0 HA GLU A 109 9.228 9.768 1.525 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.561 9.252 -1.119 1.00 0.00 H new ATOM 0 HB3 GLU A 109 9.120 10.241 -0.985 1.00 0.00 H new ATOM 0 HG2 GLU A 109 11.761 10.732 0.433 1.00 0.00 H new ATOM 0 HG3 GLU A 109 11.151 11.620 -0.950 1.00 0.00 H new ATOM 1771 N PHE A 110 8.579 7.020 -0.051 1.00 0.00 N ATOM 1772 CA PHE A 110 7.472 6.170 -0.392 1.00 0.00 C ATOM 1773 C PHE A 110 6.755 5.747 0.869 1.00 0.00 C ATOM 1774 O PHE A 110 5.556 5.757 0.918 1.00 0.00 O ATOM 1775 CB PHE A 110 7.928 4.939 -1.143 1.00 0.00 C ATOM 1776 CG PHE A 110 6.824 4.277 -1.936 1.00 0.00 C ATOM 1777 CD1 PHE A 110 5.994 3.327 -1.357 1.00 0.00 C ATOM 1778 CD2 PHE A 110 6.619 4.618 -3.265 1.00 0.00 C ATOM 1779 CE1 PHE A 110 4.984 2.735 -2.087 1.00 0.00 C ATOM 1780 CE2 PHE A 110 5.610 4.027 -3.999 1.00 0.00 C ATOM 1781 CZ PHE A 110 4.791 3.085 -3.409 1.00 0.00 C ATOM 0 H PHE A 110 9.503 6.612 -0.193 1.00 0.00 H new ATOM 0 HA PHE A 110 6.800 6.735 -1.039 1.00 0.00 H new ATOM 0 HB2 PHE A 110 8.737 5.214 -1.820 1.00 0.00 H new ATOM 0 HB3 PHE A 110 8.337 4.220 -0.433 1.00 0.00 H new ATOM 0 HD1 PHE A 110 6.140 3.048 -0.324 1.00 0.00 H new ATOM 0 HD2 PHE A 110 7.256 5.355 -3.731 1.00 0.00 H new ATOM 0 HE1 PHE A 110 4.344 1.998 -1.625 1.00 0.00 H new ATOM 0 HE2 PHE A 110 5.462 4.301 -5.033 1.00 0.00 H new ATOM 0 HZ PHE A 110 4.000 2.622 -3.981 1.00 0.00 H new ATOM 1791 N LYS A 111 7.512 5.394 1.892 1.00 0.00 N ATOM 1792 CA LYS A 111 6.915 4.926 3.150 1.00 0.00 C ATOM 1793 C LYS A 111 6.185 5.999 3.940 1.00 0.00 C ATOM 1794 O LYS A 111 5.125 5.733 4.520 1.00 0.00 O ATOM 1795 CB LYS A 111 7.867 4.098 3.979 1.00 0.00 C ATOM 1796 CG LYS A 111 7.642 2.576 3.818 1.00 0.00 C ATOM 1797 CD LYS A 111 7.621 2.090 2.359 1.00 0.00 C ATOM 1798 CE LYS A 111 8.953 2.251 1.658 1.00 0.00 C ATOM 1799 NZ LYS A 111 10.028 1.464 2.297 1.00 0.00 N ATOM 0 H LYS A 111 8.532 5.418 1.887 1.00 0.00 H new ATOM 0 HA LYS A 111 6.120 4.245 2.846 1.00 0.00 H new ATOM 0 HB2 LYS A 111 8.891 4.340 3.696 1.00 0.00 H new ATOM 0 HB3 LYS A 111 7.754 4.367 5.029 1.00 0.00 H new ATOM 0 HG2 LYS A 111 8.429 2.046 4.354 1.00 0.00 H new ATOM 0 HG3 LYS A 111 6.697 2.308 4.292 1.00 0.00 H new ATOM 0 HD2 LYS A 111 7.331 1.040 2.337 1.00 0.00 H new ATOM 0 HD3 LYS A 111 6.859 2.643 1.809 1.00 0.00 H new ATOM 0 HE2 LYS A 111 8.852 1.943 0.617 1.00 0.00 H new ATOM 0 HE3 LYS A 111 9.232 3.305 1.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 10.807 1.328 1.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.379 1.972 3.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 9.655 0.537 2.586 1.00 0.00 H new ATOM 1813 N GLN A 112 6.748 7.186 3.978 1.00 0.00 N ATOM 1814 CA GLN A 112 6.077 8.348 4.590 1.00 0.00 C ATOM 1815 C GLN A 112 4.743 8.558 3.905 1.00 0.00 C ATOM 1816 O GLN A 112 3.691 8.675 4.536 1.00 0.00 O ATOM 1817 CB GLN A 112 6.850 9.592 4.308 1.00 0.00 C ATOM 1818 CG GLN A 112 8.263 9.662 4.877 1.00 0.00 C ATOM 1819 CD GLN A 112 8.318 9.466 6.372 1.00 0.00 C ATOM 1820 OE1 GLN A 112 8.484 8.344 6.863 1.00 0.00 O ATOM 1821 NE2 GLN A 112 8.159 10.532 7.113 1.00 0.00 N ATOM 0 H GLN A 112 7.672 7.389 3.595 1.00 0.00 H new ATOM 0 HA GLN A 112 5.984 8.161 5.660 1.00 0.00 H new ATOM 0 HB2 GLN A 112 6.912 9.717 3.227 1.00 0.00 H new ATOM 0 HB3 GLN A 112 6.284 10.440 4.695 1.00 0.00 H new ATOM 0 HG2 GLN A 112 8.878 8.902 4.396 1.00 0.00 H new ATOM 0 HG3 GLN A 112 8.699 10.630 4.629 1.00 0.00 H new ATOM 0 HE21 GLN A 112 8.024 11.443 6.674 1.00 0.00 H new ATOM 0 HE22 GLN A 112 8.170 10.453 8.130 1.00 0.00 H new ATOM 1830 N LYS A 113 4.812 8.578 2.578 1.00 0.00 N ATOM 1831 CA LYS A 113 3.673 8.795 1.741 1.00 0.00 C ATOM 1832 C LYS A 113 2.726 7.639 1.892 1.00 0.00 C ATOM 1833 O LYS A 113 1.538 7.790 1.755 1.00 0.00 O ATOM 1834 CB LYS A 113 4.127 8.868 0.290 1.00 0.00 C ATOM 1835 CG LYS A 113 3.651 10.100 -0.466 1.00 0.00 C ATOM 1836 CD LYS A 113 4.282 11.383 0.079 1.00 0.00 C ATOM 1837 CE LYS A 113 5.804 11.420 -0.137 1.00 0.00 C ATOM 1838 NZ LYS A 113 6.417 12.646 0.404 1.00 0.00 N ATOM 0 H LYS A 113 5.681 8.440 2.062 1.00 0.00 H new ATOM 0 HA LYS A 113 3.179 9.724 2.025 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.216 8.841 0.263 1.00 0.00 H new ATOM 0 HB3 LYS A 113 3.773 7.979 -0.232 1.00 0.00 H new ATOM 0 HG2 LYS A 113 3.897 9.995 -1.523 1.00 0.00 H new ATOM 0 HG3 LYS A 113 2.566 10.171 -0.397 1.00 0.00 H new ATOM 0 HD2 LYS A 113 3.827 12.245 -0.408 1.00 0.00 H new ATOM 0 HD3 LYS A 113 4.066 11.468 1.144 1.00 0.00 H new ATOM 0 HE2 LYS A 113 6.257 10.550 0.338 1.00 0.00 H new ATOM 0 HE3 LYS A 113 6.019 11.349 -1.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 7.438 12.496 0.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 6.262 13.433 -0.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 5.984 12.875 1.321 1.00 0.00 H new ATOM 1852 N PHE A 114 3.280 6.505 2.214 1.00 0.00 N ATOM 1853 CA PHE A 114 2.514 5.258 2.335 1.00 0.00 C ATOM 1854 C PHE A 114 1.553 5.333 3.505 1.00 0.00 C ATOM 1855 O PHE A 114 0.354 5.098 3.343 1.00 0.00 O ATOM 1856 CB PHE A 114 3.446 4.041 2.475 1.00 0.00 C ATOM 1857 CG PHE A 114 2.753 2.704 2.522 1.00 0.00 C ATOM 1858 CD1 PHE A 114 2.503 2.006 1.364 1.00 0.00 C ATOM 1859 CD2 PHE A 114 2.369 2.143 3.727 1.00 0.00 C ATOM 1860 CE1 PHE A 114 1.885 0.777 1.406 1.00 0.00 C ATOM 1861 CE2 PHE A 114 1.748 0.916 3.776 1.00 0.00 C ATOM 1862 CZ PHE A 114 1.507 0.229 2.612 1.00 0.00 C ATOM 0 H PHE A 114 4.277 6.399 2.404 1.00 0.00 H new ATOM 0 HA PHE A 114 1.936 5.131 1.420 1.00 0.00 H new ATOM 0 HB2 PHE A 114 4.145 4.041 1.639 1.00 0.00 H new ATOM 0 HB3 PHE A 114 4.036 4.158 3.384 1.00 0.00 H new ATOM 0 HD1 PHE A 114 2.794 2.426 0.413 1.00 0.00 H new ATOM 0 HD2 PHE A 114 2.560 2.678 4.646 1.00 0.00 H new ATOM 0 HE1 PHE A 114 1.695 0.239 0.489 1.00 0.00 H new ATOM 0 HE2 PHE A 114 1.452 0.495 4.726 1.00 0.00 H new ATOM 0 HZ PHE A 114 1.023 -0.736 2.642 1.00 0.00 H new ATOM 1872 N GLU A 115 2.062 5.682 4.681 1.00 0.00 N ATOM 1873 CA GLU A 115 1.199 5.822 5.834 1.00 0.00 C ATOM 1874 C GLU A 115 0.271 7.011 5.646 1.00 0.00 C ATOM 1875 O GLU A 115 -0.867 6.983 6.099 1.00 0.00 O ATOM 1876 CB GLU A 115 1.973 5.948 7.144 1.00 0.00 C ATOM 1877 CG GLU A 115 2.896 7.139 7.242 1.00 0.00 C ATOM 1878 CD GLU A 115 3.340 7.360 8.649 1.00 0.00 C ATOM 1879 OE1 GLU A 115 4.277 6.690 9.099 1.00 0.00 O ATOM 1880 OE2 GLU A 115 2.727 8.202 9.356 1.00 0.00 O ATOM 0 H GLU A 115 3.050 5.869 4.854 1.00 0.00 H new ATOM 0 HA GLU A 115 0.612 4.907 5.908 1.00 0.00 H new ATOM 0 HB2 GLU A 115 1.258 5.996 7.965 1.00 0.00 H new ATOM 0 HB3 GLU A 115 2.561 5.042 7.287 1.00 0.00 H new ATOM 0 HG2 GLU A 115 3.765 6.983 6.603 1.00 0.00 H new ATOM 0 HG3 GLU A 115 2.386 8.029 6.874 1.00 0.00 H new ATOM 1887 N GLU A 116 0.751 8.059 4.956 1.00 0.00 N ATOM 1888 CA GLU A 116 -0.074 9.197 4.671 1.00 0.00 C ATOM 1889 C GLU A 116 -1.260 8.768 3.838 1.00 0.00 C ATOM 1890 O GLU A 116 -2.386 9.085 4.159 1.00 0.00 O ATOM 1891 CB GLU A 116 0.675 10.313 3.957 1.00 0.00 C ATOM 1892 CG GLU A 116 -0.141 11.603 3.872 1.00 0.00 C ATOM 1893 CD GLU A 116 -0.354 12.235 5.246 1.00 0.00 C ATOM 1894 OE1 GLU A 116 -1.117 11.699 6.073 1.00 0.00 O ATOM 1895 OE2 GLU A 116 0.291 13.251 5.541 1.00 0.00 O ATOM 0 H GLU A 116 1.703 8.122 4.596 1.00 0.00 H new ATOM 0 HA GLU A 116 -0.404 9.598 5.629 1.00 0.00 H new ATOM 0 HB2 GLU A 116 1.610 10.512 4.481 1.00 0.00 H new ATOM 0 HB3 GLU A 116 0.937 9.985 2.951 1.00 0.00 H new ATOM 0 HG2 GLU A 116 0.369 12.313 3.221 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -1.108 11.391 3.416 1.00 0.00 H new ATOM 1902 N CYS A 117 -0.986 7.990 2.799 1.00 0.00 N ATOM 1903 CA CYS A 117 -1.942 7.438 1.956 1.00 0.00 C ATOM 1904 C CYS A 117 -2.906 6.559 2.710 1.00 0.00 C ATOM 1905 O CYS A 117 -4.061 6.485 2.354 1.00 0.00 O ATOM 1906 CB CYS A 117 -1.263 6.725 0.863 1.00 0.00 C ATOM 1907 SG CYS A 117 -0.445 7.804 -0.334 1.00 0.00 S ATOM 0 H CYS A 117 -0.032 7.737 2.541 1.00 0.00 H new ATOM 0 HA CYS A 117 -2.548 8.234 1.523 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -0.522 6.049 1.291 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -1.993 6.108 0.339 1.00 0.00 H new ATOM 0 HG CYS A 117 0.703 8.186 0.140 1.00 0.00 H new ATOM 1913 N GLN A 118 -2.425 5.893 3.754 1.00 0.00 N ATOM 1914 CA GLN A 118 -3.295 5.091 4.591 1.00 0.00 C ATOM 1915 C GLN A 118 -4.426 5.965 5.099 1.00 0.00 C ATOM 1916 O GLN A 118 -5.567 5.544 5.099 1.00 0.00 O ATOM 1917 CB GLN A 118 -2.540 4.548 5.796 1.00 0.00 C ATOM 1918 CG GLN A 118 -1.556 3.448 5.522 1.00 0.00 C ATOM 1919 CD GLN A 118 -0.722 3.123 6.749 1.00 0.00 C ATOM 1920 OE1 GLN A 118 -1.160 3.312 7.891 1.00 0.00 O ATOM 1921 NE2 GLN A 118 0.469 2.629 6.540 1.00 0.00 N ATOM 0 H GLN A 118 -1.445 5.895 4.035 1.00 0.00 H new ATOM 0 HA GLN A 118 -3.673 4.258 3.999 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -2.008 5.374 6.267 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -3.268 4.183 6.521 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -2.090 2.555 5.197 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -0.900 3.742 4.703 1.00 0.00 H new ATOM 0 HE21 GLN A 118 0.801 2.485 5.586 1.00 0.00 H new ATOM 0 HE22 GLN A 118 1.067 2.387 7.330 1.00 0.00 H new ATOM 1930 N ARG A 119 -4.097 7.145 5.617 1.00 0.00 N ATOM 1931 CA ARG A 119 -5.147 8.088 6.007 1.00 0.00 C ATOM 1932 C ARG A 119 -5.843 8.743 4.827 1.00 0.00 C ATOM 1933 O ARG A 119 -7.051 8.825 4.741 1.00 0.00 O ATOM 1934 CB ARG A 119 -4.669 9.187 6.983 1.00 0.00 C ATOM 1935 CG ARG A 119 -4.194 8.736 8.363 1.00 0.00 C ATOM 1936 CD ARG A 119 -2.769 8.196 8.355 1.00 0.00 C ATOM 1937 NE ARG A 119 -1.782 9.229 7.981 1.00 0.00 N ATOM 1938 CZ ARG A 119 -0.466 9.192 8.275 1.00 0.00 C ATOM 1939 NH1 ARG A 119 0.050 8.184 8.978 1.00 0.00 N ATOM 1940 NH2 ARG A 119 0.324 10.165 7.841 1.00 0.00 N ATOM 0 H ARG A 119 -3.142 7.467 5.774 1.00 0.00 H new ATOM 0 HA ARG A 119 -5.866 7.457 6.529 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -3.854 9.731 6.506 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -5.486 9.895 7.122 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -4.254 9.576 9.055 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -4.867 7.965 8.739 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -2.525 7.804 9.343 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -2.702 7.362 7.656 1.00 0.00 H new ATOM 0 HE ARG A 119 -2.123 10.036 7.458 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -0.552 7.427 9.301 1.00 0.00 H new ATOM 0 HH12 ARG A 119 1.047 8.170 9.193 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -0.065 10.931 7.291 1.00 0.00 H new ATOM 0 HH22 ARG A 119 1.321 10.147 8.057 1.00 0.00 H new ATOM 1954 N LEU A 120 -5.055 9.206 3.986 1.00 0.00 N ATOM 1955 CA LEU A 120 -5.452 10.056 2.892 1.00 0.00 C ATOM 1956 C LEU A 120 -6.123 9.435 1.695 1.00 0.00 C ATOM 1957 O LEU A 120 -7.246 9.830 1.385 1.00 0.00 O ATOM 1958 CB LEU A 120 -4.336 11.035 2.472 1.00 0.00 C ATOM 1959 CG LEU A 120 -4.289 12.391 3.180 1.00 0.00 C ATOM 1960 CD1 LEU A 120 -3.985 12.243 4.650 1.00 0.00 C ATOM 1961 CD2 LEU A 120 -3.283 13.308 2.504 1.00 0.00 C ATOM 0 H LEU A 120 -4.053 9.017 4.006 1.00 0.00 H new ATOM 0 HA LEU A 120 -6.276 10.603 3.350 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -3.377 10.540 2.627 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -4.432 11.217 1.401 1.00 0.00 H new ATOM 0 HG LEU A 120 -5.278 12.843 3.100 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -3.960 13.227 5.117 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -4.758 11.637 5.122 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -3.017 11.758 4.774 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.262 14.268 3.020 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -2.293 12.853 2.543 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.572 13.461 1.464 1.00 0.00 H new ATOM 1973 N LEU A 121 -5.555 8.349 1.158 1.00 0.00 N ATOM 1974 CA LEU A 121 -5.884 7.802 -0.221 1.00 0.00 C ATOM 1975 C LEU A 121 -7.344 7.402 -0.293 1.00 0.00 C ATOM 1976 O LEU A 121 -7.976 7.321 -1.350 1.00 0.00 O ATOM 1977 CB LEU A 121 -4.946 6.621 -0.577 1.00 0.00 C ATOM 1978 CG LEU A 121 -4.390 6.558 -2.022 1.00 0.00 C ATOM 1979 CD1 LEU A 121 -3.460 5.367 -2.189 1.00 0.00 C ATOM 1980 CD2 LEU A 121 -5.495 6.502 -3.056 1.00 0.00 C ATOM 0 H LEU A 121 -4.847 7.802 1.647 1.00 0.00 H new ATOM 0 HA LEU A 121 -5.718 8.584 -0.961 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.099 6.646 0.108 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -5.485 5.694 -0.383 1.00 0.00 H new ATOM 0 HG LEU A 121 -3.828 7.477 -2.187 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -3.081 5.342 -3.211 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -2.625 5.457 -1.494 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -4.006 4.447 -1.982 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -5.058 6.459 -4.054 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -6.105 5.615 -2.889 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -6.118 7.392 -2.971 1.00 0.00 H new ATOM 1992 N LEU A 122 -7.834 7.224 0.852 1.00 0.00 N ATOM 1993 CA LEU A 122 -9.148 6.830 1.150 1.00 0.00 C ATOM 1994 C LEU A 122 -10.201 7.835 0.700 1.00 0.00 C ATOM 1995 O LEU A 122 -11.252 7.466 0.176 1.00 0.00 O ATOM 1996 CB LEU A 122 -9.165 6.978 2.616 1.00 0.00 C ATOM 1997 CG LEU A 122 -8.378 5.953 3.451 1.00 0.00 C ATOM 1998 CD1 LEU A 122 -8.692 6.133 4.922 1.00 0.00 C ATOM 1999 CD2 LEU A 122 -8.683 4.520 3.019 1.00 0.00 C ATOM 0 H LEU A 122 -7.276 7.362 1.695 1.00 0.00 H new ATOM 0 HA LEU A 122 -9.365 5.863 0.697 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -8.783 7.970 2.857 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -10.204 6.949 2.943 1.00 0.00 H new ATOM 0 HG LEU A 122 -7.316 6.130 3.283 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -8.131 5.403 5.506 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.412 7.139 5.233 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -9.759 5.986 5.087 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -8.109 3.825 3.632 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -9.747 4.321 3.145 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -8.411 4.390 1.971 1.00 0.00 H new ATOM 2011 N ASP A 123 -9.915 9.079 0.900 1.00 0.00 N ATOM 2012 CA ASP A 123 -10.898 10.118 0.688 1.00 0.00 C ATOM 2013 C ASP A 123 -10.536 10.956 -0.490 1.00 0.00 C ATOM 2014 O ASP A 123 -11.392 11.356 -1.290 1.00 0.00 O ATOM 2015 CB ASP A 123 -10.953 11.016 1.931 1.00 0.00 C ATOM 2016 CG ASP A 123 -12.051 12.049 1.872 1.00 0.00 C ATOM 2017 OD1 ASP A 123 -13.215 11.703 2.135 1.00 0.00 O ATOM 2018 OD2 ASP A 123 -11.777 13.223 1.570 1.00 0.00 O ATOM 0 H ASP A 123 -9.004 9.414 1.213 1.00 0.00 H new ATOM 0 HA ASP A 123 -11.866 9.650 0.507 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -11.096 10.394 2.814 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -9.994 11.521 2.049 1.00 0.00 H new ATOM 2023 N ILE A 124 -9.276 11.181 -0.612 1.00 0.00 N ATOM 2024 CA ILE A 124 -8.741 12.099 -1.557 1.00 0.00 C ATOM 2025 C ILE A 124 -8.616 11.527 -2.972 1.00 0.00 C ATOM 2026 O ILE A 124 -8.096 10.432 -3.175 1.00 0.00 O ATOM 2027 CB ILE A 124 -7.404 12.699 -1.025 1.00 0.00 C ATOM 2028 CG1 ILE A 124 -6.376 11.610 -0.602 1.00 0.00 C ATOM 2029 CG2 ILE A 124 -7.685 13.621 0.148 1.00 0.00 C ATOM 2030 CD1 ILE A 124 -5.577 10.982 -1.720 1.00 0.00 C ATOM 0 H ILE A 124 -8.568 10.719 -0.042 1.00 0.00 H new ATOM 0 HA ILE A 124 -9.461 12.910 -1.662 1.00 0.00 H new ATOM 0 HB ILE A 124 -6.957 13.257 -1.848 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -5.680 12.053 0.110 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -6.911 10.819 -0.076 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.747 14.038 0.516 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -8.340 14.430 -0.174 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -8.170 13.058 0.946 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -4.895 10.239 -1.307 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -6.254 10.500 -2.425 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -5.005 11.753 -2.236 1.00 0.00 H new ATOM 2042 N PRO A 125 -9.200 12.196 -3.967 1.00 0.00 N ATOM 2043 CA PRO A 125 -8.983 11.821 -5.341 1.00 0.00 C ATOM 2044 C PRO A 125 -7.552 12.164 -5.780 1.00 0.00 C ATOM 2045 O PRO A 125 -7.081 13.296 -5.585 1.00 0.00 O ATOM 2046 CB PRO A 125 -9.995 12.675 -6.130 1.00 0.00 C ATOM 2047 CG PRO A 125 -10.940 13.205 -5.109 1.00 0.00 C ATOM 2048 CD PRO A 125 -10.164 13.298 -3.835 1.00 0.00 C ATOM 0 HA PRO A 125 -9.112 10.751 -5.502 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -9.496 13.485 -6.662 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -10.517 12.077 -6.877 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -11.324 14.182 -5.403 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -11.800 12.545 -4.994 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -9.666 14.262 -3.733 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -10.803 13.175 -2.961 1.00 0.00 H new ATOM 2056 N LEU A 126 -6.891 11.210 -6.395 1.00 0.00 N ATOM 2057 CA LEU A 126 -5.546 11.404 -6.955 1.00 0.00 C ATOM 2058 C LEU A 126 -5.642 11.460 -8.457 1.00 0.00 C ATOM 2059 O LEU A 126 -4.697 11.189 -9.184 1.00 0.00 O ATOM 2060 CB LEU A 126 -4.592 10.291 -6.506 1.00 0.00 C ATOM 2061 CG LEU A 126 -4.174 10.321 -5.032 1.00 0.00 C ATOM 2062 CD1 LEU A 126 -3.288 9.136 -4.706 1.00 0.00 C ATOM 2063 CD2 LEU A 126 -3.444 11.621 -4.711 1.00 0.00 C ATOM 0 H LEU A 126 -7.261 10.269 -6.529 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.138 12.344 -6.585 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.064 9.330 -6.710 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -3.693 10.341 -7.120 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.075 10.263 -4.421 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.001 9.174 -3.655 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.831 8.211 -4.900 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -2.393 9.169 -5.328 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -3.154 11.626 -3.660 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -2.553 11.701 -5.333 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -4.102 12.467 -4.910 1.00 0.00 H new ATOM 2075 N GLN A 127 -6.811 11.811 -8.890 1.00 0.00 N ATOM 2076 CA GLN A 127 -7.144 11.986 -10.268 1.00 0.00 C ATOM 2077 C GLN A 127 -7.760 13.346 -10.351 1.00 0.00 C ATOM 2078 O GLN A 127 -8.309 13.820 -9.336 1.00 0.00 O ATOM 2079 CB GLN A 127 -8.231 10.996 -10.663 1.00 0.00 C ATOM 2080 CG GLN A 127 -7.955 9.554 -10.315 1.00 0.00 C ATOM 2081 CD GLN A 127 -9.134 8.648 -10.628 1.00 0.00 C ATOM 2082 OE1 GLN A 127 -9.345 7.632 -9.949 1.00 0.00 O ATOM 2083 NE2 GLN A 127 -9.895 8.978 -11.656 1.00 0.00 N ATOM 0 H GLN A 127 -7.595 11.992 -8.264 1.00 0.00 H new ATOM 0 HA GLN A 127 -6.269 11.852 -10.905 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -9.163 11.295 -10.183 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -8.390 11.068 -11.739 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -7.080 9.211 -10.867 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -7.713 9.479 -9.255 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -9.691 9.822 -12.192 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -10.687 8.389 -11.914 1.00 0.00 H new ATOM 2092 N THR A 128 -7.668 13.995 -11.466 1.00 0.00 N ATOM 2093 CA THR A 128 -8.386 15.211 -11.623 1.00 0.00 C ATOM 2094 C THR A 128 -9.808 14.826 -12.062 1.00 0.00 C ATOM 2095 O THR A 128 -9.991 14.174 -13.106 1.00 0.00 O ATOM 2096 CB THR A 128 -7.694 16.107 -12.661 1.00 0.00 C ATOM 2097 OG1 THR A 128 -6.323 16.293 -12.263 1.00 0.00 O ATOM 2098 CG2 THR A 128 -8.379 17.458 -12.752 1.00 0.00 C ATOM 0 H THR A 128 -7.110 13.707 -12.270 1.00 0.00 H new ATOM 0 HA THR A 128 -8.420 15.781 -10.695 1.00 0.00 H new ATOM 0 HB THR A 128 -7.749 15.629 -13.639 1.00 0.00 H new ATOM 0 HG1 THR A 128 -5.867 16.862 -12.917 1.00 0.00 H new ATOM 0 HG21 THR A 128 -7.871 18.074 -13.494 1.00 0.00 H new ATOM 0 HG22 THR A 128 -9.419 17.319 -13.047 1.00 0.00 H new ATOM 0 HG23 THR A 128 -8.340 17.952 -11.781 1.00 0.00 H new ATOM 2106 N PRO A 129 -10.816 15.199 -11.269 1.00 0.00 N ATOM 2107 CA PRO A 129 -12.190 14.769 -11.479 1.00 0.00 C ATOM 2108 C PRO A 129 -12.883 15.398 -12.681 1.00 0.00 C ATOM 2109 O PRO A 129 -12.854 16.617 -12.873 1.00 0.00 O ATOM 2110 CB PRO A 129 -12.878 15.182 -10.194 1.00 0.00 C ATOM 2111 CG PRO A 129 -12.147 16.380 -9.787 1.00 0.00 C ATOM 2112 CD PRO A 129 -10.711 16.102 -10.107 1.00 0.00 C ATOM 0 HA PRO A 129 -12.228 13.702 -11.700 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -13.936 15.392 -10.354 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -12.819 14.399 -9.438 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -12.505 17.259 -10.323 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -12.281 16.579 -8.724 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -10.165 17.014 -10.349 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -10.192 15.631 -9.272 1.00 0.00 H new ATOM 2120 N LYS A 130 -13.477 14.562 -13.471 1.00 0.00 N ATOM 2121 CA LYS A 130 -14.319 14.936 -14.570 1.00 0.00 C ATOM 2122 C LYS A 130 -15.363 13.846 -14.720 1.00 0.00 C ATOM 2123 O LYS A 130 -15.189 12.932 -15.550 1.00 0.00 O ATOM 2124 CB LYS A 130 -13.554 15.129 -15.900 1.00 0.00 C ATOM 2125 CG LYS A 130 -12.582 16.314 -15.947 1.00 0.00 C ATOM 2126 CD LYS A 130 -12.084 16.601 -17.365 1.00 0.00 C ATOM 2127 CE LYS A 130 -11.368 15.413 -17.990 1.00 0.00 C ATOM 2128 NZ LYS A 130 -10.909 15.710 -19.366 1.00 0.00 N ATOM 2129 OXT LYS A 130 -16.334 13.848 -13.933 1.00 0.00 O ATOM 0 H LYS A 130 -13.386 13.552 -13.365 1.00 0.00 H new ATOM 0 HA LYS A 130 -14.766 15.906 -14.351 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -12.995 14.217 -16.111 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -14.283 15.249 -16.702 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -13.075 17.202 -15.551 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -11.730 16.108 -15.300 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -12.930 16.881 -17.993 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -11.408 17.456 -17.342 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -10.513 15.138 -17.373 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -12.038 14.553 -18.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -10.426 14.877 -19.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -11.728 15.948 -19.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -10.250 16.515 -19.346 1.00 0.00 H new TER 2143 LYS A 130