USER MOD reduce.3.24.130724 H: found=0, std=0, add=1418, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1421 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 74 MET CE :methyl -139:sc= -4.87! (180deg=-7.14!) USER MOD Set 1.2: B 81 THR OG1 : rot 94:sc= 1.12 USER MOD Set 2.1: B 57 MET CE :methyl 141:sc= -4.77! (180deg=-5.73!) USER MOD Set 2.2: B 68 CYS SG : rot 170:sc= -1.87 USER MOD Set 3.1: B 17 TYR OH : rot -140:sc= -1.44 USER MOD Set 3.2: B 38 ASN : amide:sc= -0.0459 K(o=-1.5,f=-4.5!) USER MOD Set 4.1: A 81 THR OG1 : rot 109:sc= 1.18 USER MOD Set 4.2: B 74 MET CE :methyl -136:sc= -4.47! (180deg=-7.33!) USER MOD Set 5.1: A 57 MET CE :methyl 143:sc= -4.78! (180deg=-5.79!) USER MOD Set 5.2: A 68 CYS SG : rot 170:sc= -1.79 USER MOD Set 6.1: A 17 TYR OH : rot 180:sc= -1.39 USER MOD Set 6.2: A 38 ASN : amide:sc= -0.0512 K(o=-1.4,f=-4.5!) USER MOD Single : A 1 SER N :NH3+ -144:sc= 0.00698 (180deg=0) USER MOD Single : A 1 SER OG : rot 58:sc= 0.387 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 MET CE :methyl -135:sc= -1.93 (180deg=-5.57!) USER MOD Single : A 15 HIS : no HD1:sc= -0.158 X(o=-0.16,f=-0.012) USER MOD Single : A 16 GLN : amide:sc= 0.151 K(o=0.15,f=-0.41) USER MOD Single : A 18 SER OG : rot 80:sc= 1.47 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -2.61 K(o=-2.6,f=-0.014) USER MOD Single : A 26 LYS NZ :NH3+ 152:sc= 0.0204 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 169:sc= 0.0287 (180deg=0.015) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 160:sc= -0.185 (180deg=-0.517) USER MOD Single : A 37 ASN : amide:sc= -0.198 K(o=-0.2,f=-1.7) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc=-0.00568 X(o=-0.0057,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot -26:sc= -1.88 USER MOD Single : A 62 ASN : amide:sc= -0.29 X(o=-0.29,f=-0.05) USER MOD Single : A 71 GLN : amide:sc= -1.8 K(o=-1.8,f=-11!) USER MOD Single : A 79 MET CE :methyl -165:sc= -0.633 (180deg=-1.19) USER MOD Single : A 82 THR OG1 : rot 5:sc= 0.539 USER MOD Single : A 84 CYS SG : rot -17:sc= 0.18 USER MOD Single : A 85 HIS : no HE2:sc= -5.57! C(o=-5.6!,f=-7.1!) USER MOD Single : B 1 SER N :NH3+ -150:sc= 0.00655 (180deg=0) USER MOD Single : B 1 SER OG : rot 60:sc= 0.429 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 MET CE :methyl -136:sc= -1.38 (180deg=-4.56!) USER MOD Single : B 15 HIS : no HD1:sc= -0.166 X(o=-0.17,f=-0.01) USER MOD Single : B 16 GLN : amide:sc= 0.0491 X(o=0.049,f=-0.41) USER MOD Single : B 18 SER OG : rot 81:sc= 1.55 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 HIS : no HD1:sc= -2.7 K(o=-2.7,f=-0.11) USER MOD Single : B 26 LYS NZ :NH3+ 152:sc= 0.0215 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ 168:sc= 0.0305 (180deg=0.0146) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ 162:sc= -0.234 (180deg=-0.516) USER MOD Single : B 37 ASN : amide:sc= -0.199 K(o=-0.2,f=-1.8) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 GLN : amide:sc=-0.00911 X(o=-0.0091,f=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot -23:sc= -2.03 USER MOD Single : B 62 ASN : amide:sc= -0.212 X(o=-0.21,f=-0.039) USER MOD Single : B 71 GLN : amide:sc= -2.36 K(o=-2.4,f=-11!) USER MOD Single : B 79 MET CE :methyl -166:sc= -0.662 (180deg=-1.23) USER MOD Single : B 82 THR OG1 : rot 3:sc= 0.561 USER MOD Single : B 84 CYS SG : rot -16:sc= 0.0828 USER MOD Single : B 85 HIS : no HE2:sc= -5.26! C(o=-5.3!,f=-6.9!) USER MOD Single : C 3 THR OG1 : rot -80:sc= 0.649 USER MOD Single : C 4 LYS NZ :NH3+ -166:sc= 1.24 (180deg=0.493) USER MOD Single : C 8 ASN : amide:sc= -0.0154 X(o=-0.015,f=-0.053) USER MOD Single : C 9 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00282) USER MOD Single : C 12 SER OG : rot -62:sc= 1.25 USER MOD Single : D 1 THR N :NH3+ -169:sc= -0.0484 (180deg=-0.159) USER MOD Single : D 1 THR OG1 : rot 180:sc= 0 USER MOD Single : D 3 THR OG1 : rot -79:sc= 0.572 USER MOD Single : D 4 LYS NZ :NH3+ -165:sc= 1.28 (180deg=0.572) USER MOD Single : D 8 ASN : amide:sc= -0.0203 X(o=-0.02,f=-0.058) USER MOD Single : D 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 12 SER OG : rot -59:sc= 1.16 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -10.624 -5.173 -11.716 1.00 0.00 N ATOM 2 CA SER A 1 -9.979 -5.411 -10.399 1.00 0.00 C ATOM 3 C SER A 1 -8.604 -4.754 -10.329 1.00 0.00 C ATOM 4 O SER A 1 -7.579 -5.435 -10.278 1.00 0.00 O ATOM 5 CB SER A 1 -9.856 -6.921 -10.183 1.00 0.00 C ATOM 6 OG SER A 1 -9.075 -7.521 -11.203 1.00 0.00 O ATOM 0 H1 SER A 1 -11.648 -5.052 -11.584 1.00 0.00 H new ATOM 0 H2 SER A 1 -10.226 -4.314 -12.147 1.00 0.00 H new ATOM 0 H3 SER A 1 -10.449 -5.986 -12.340 1.00 0.00 H new ATOM 0 HA SER A 1 -10.593 -4.967 -9.615 1.00 0.00 H new ATOM 0 HB2 SER A 1 -9.403 -7.117 -9.211 1.00 0.00 H new ATOM 0 HB3 SER A 1 -10.849 -7.371 -10.168 1.00 0.00 H new ATOM 0 HG SER A 1 -8.187 -7.106 -11.222 1.00 0.00 H new ATOM 14 N GLU A 2 -8.589 -3.425 -10.329 1.00 0.00 N ATOM 15 CA GLU A 2 -7.340 -2.675 -10.265 1.00 0.00 C ATOM 16 C GLU A 2 -6.565 -3.008 -8.994 1.00 0.00 C ATOM 17 O GLU A 2 -5.345 -2.857 -8.941 1.00 0.00 O ATOM 18 CB GLU A 2 -7.618 -1.172 -10.329 1.00 0.00 C ATOM 19 CG GLU A 2 -7.575 -0.604 -11.738 1.00 0.00 C ATOM 20 CD GLU A 2 -7.705 0.905 -11.763 1.00 0.00 C ATOM 21 OE1 GLU A 2 -8.830 1.408 -11.559 1.00 0.00 O ATOM 22 OE2 GLU A 2 -6.681 1.586 -11.986 1.00 0.00 O ATOM 0 H GLU A 2 -9.427 -2.846 -10.373 1.00 0.00 H new ATOM 0 HA GLU A 2 -6.732 -2.962 -11.123 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -8.599 -0.974 -9.896 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -6.886 -0.649 -9.713 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -6.637 -0.892 -12.213 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -8.379 -1.044 -12.328 1.00 0.00 H new ATOM 29 N LEU A 3 -7.282 -3.464 -7.973 1.00 0.00 N ATOM 30 CA LEU A 3 -6.664 -3.819 -6.701 1.00 0.00 C ATOM 31 C LEU A 3 -5.632 -4.926 -6.890 1.00 0.00 C ATOM 32 O LEU A 3 -4.537 -4.870 -6.330 1.00 0.00 O ATOM 33 CB LEU A 3 -7.732 -4.265 -5.699 1.00 0.00 C ATOM 34 CG LEU A 3 -8.247 -3.162 -4.768 1.00 0.00 C ATOM 35 CD1 LEU A 3 -9.741 -2.946 -4.963 1.00 0.00 C ATOM 36 CD2 LEU A 3 -7.940 -3.501 -3.317 1.00 0.00 C ATOM 0 H LEU A 3 -8.293 -3.597 -8.002 1.00 0.00 H new ATOM 0 HA LEU A 3 -6.157 -2.937 -6.311 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.577 -4.678 -6.251 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -7.324 -5.072 -5.091 1.00 0.00 H new ATOM 0 HG LEU A 3 -7.733 -2.235 -5.021 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -10.085 -2.159 -4.292 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -9.935 -2.654 -5.995 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -10.274 -3.870 -4.741 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -8.313 -2.706 -2.671 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -8.424 -4.441 -3.053 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -6.862 -3.599 -3.186 1.00 0.00 H new ATOM 48 N GLU A 4 -5.988 -5.932 -7.682 1.00 0.00 N ATOM 49 CA GLU A 4 -5.091 -7.053 -7.944 1.00 0.00 C ATOM 50 C GLU A 4 -3.960 -6.638 -8.878 1.00 0.00 C ATOM 51 O GLU A 4 -2.837 -7.129 -8.765 1.00 0.00 O ATOM 52 CB GLU A 4 -5.869 -8.222 -8.551 1.00 0.00 C ATOM 53 CG GLU A 4 -6.370 -9.220 -7.520 1.00 0.00 C ATOM 54 CD GLU A 4 -7.621 -8.744 -6.808 1.00 0.00 C ATOM 55 OE1 GLU A 4 -7.602 -7.620 -6.261 1.00 0.00 O ATOM 56 OE2 GLU A 4 -8.620 -9.494 -6.796 1.00 0.00 O ATOM 0 H GLU A 4 -6.890 -5.995 -8.153 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.655 -7.369 -6.996 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.720 -7.831 -9.109 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -5.230 -8.741 -9.266 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -6.575 -10.171 -8.011 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.586 -9.403 -6.786 1.00 0.00 H new ATOM 63 N LYS A 5 -4.263 -5.730 -9.800 1.00 0.00 N ATOM 64 CA LYS A 5 -3.270 -5.248 -10.753 1.00 0.00 C ATOM 65 C LYS A 5 -2.193 -4.430 -10.050 1.00 0.00 C ATOM 66 O LYS A 5 -1.004 -4.728 -10.154 1.00 0.00 O ATOM 67 CB LYS A 5 -3.940 -4.405 -11.840 1.00 0.00 C ATOM 68 CG LYS A 5 -4.523 -5.230 -12.977 1.00 0.00 C ATOM 69 CD LYS A 5 -6.020 -5.004 -13.121 1.00 0.00 C ATOM 70 CE LYS A 5 -6.321 -3.778 -13.969 1.00 0.00 C ATOM 71 NZ LYS A 5 -7.471 -4.005 -14.887 1.00 0.00 N ATOM 0 H LYS A 5 -5.188 -5.313 -9.907 1.00 0.00 H new ATOM 0 HA LYS A 5 -2.798 -6.115 -11.216 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -4.735 -3.810 -11.389 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -3.210 -3.705 -12.247 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -4.023 -4.969 -13.910 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -4.330 -6.287 -12.797 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -6.479 -5.882 -13.574 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -6.467 -4.884 -12.134 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -6.538 -2.931 -13.318 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -5.438 -3.514 -14.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -7.643 -3.146 -15.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -7.254 -4.797 -15.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -8.320 -4.232 -14.331 1.00 0.00 H new ATOM 85 N ALA A 6 -2.620 -3.394 -9.333 1.00 0.00 N ATOM 86 CA ALA A 6 -1.694 -2.532 -8.610 1.00 0.00 C ATOM 87 C ALA A 6 -0.884 -3.327 -7.593 1.00 0.00 C ATOM 88 O ALA A 6 0.319 -3.114 -7.438 1.00 0.00 O ATOM 89 CB ALA A 6 -2.450 -1.406 -7.921 1.00 0.00 C ATOM 0 H ALA A 6 -3.601 -3.132 -9.238 1.00 0.00 H new ATOM 0 HA ALA A 6 -1.000 -2.101 -9.331 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.746 -0.770 -7.385 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.979 -0.813 -8.667 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.168 -1.827 -7.217 1.00 0.00 H new ATOM 95 N MET A 7 -1.550 -4.245 -6.901 1.00 0.00 N ATOM 96 CA MET A 7 -0.891 -5.073 -5.898 1.00 0.00 C ATOM 97 C MET A 7 0.256 -5.865 -6.517 1.00 0.00 C ATOM 98 O MET A 7 1.388 -5.819 -6.032 1.00 0.00 O ATOM 99 CB MET A 7 -1.898 -6.030 -5.254 1.00 0.00 C ATOM 100 CG MET A 7 -2.480 -5.512 -3.948 1.00 0.00 C ATOM 101 SD MET A 7 -3.271 -6.808 -2.977 1.00 0.00 S ATOM 102 CE MET A 7 -4.973 -6.249 -2.987 1.00 0.00 C ATOM 0 H MET A 7 -2.546 -4.434 -7.016 1.00 0.00 H new ATOM 0 HA MET A 7 -0.483 -4.416 -5.130 1.00 0.00 H new ATOM 0 HB2 MET A 7 -2.711 -6.215 -5.956 1.00 0.00 H new ATOM 0 HB3 MET A 7 -1.411 -6.988 -5.071 1.00 0.00 H new ATOM 0 HG2 MET A 7 -1.686 -5.054 -3.357 1.00 0.00 H new ATOM 0 HG3 MET A 7 -3.208 -4.730 -4.164 1.00 0.00 H new ATOM 0 HE1 MET A 7 -5.389 -6.331 -1.983 1.00 0.00 H new ATOM 0 HE2 MET A 7 -5.013 -5.210 -3.313 1.00 0.00 H new ATOM 0 HE3 MET A 7 -5.555 -6.866 -3.672 1.00 0.00 H new ATOM 112 N VAL A 8 -0.042 -6.593 -7.588 1.00 0.00 N ATOM 113 CA VAL A 8 0.967 -7.394 -8.268 1.00 0.00 C ATOM 114 C VAL A 8 1.943 -6.513 -9.040 1.00 0.00 C ATOM 115 O VAL A 8 3.095 -6.893 -9.252 1.00 0.00 O ATOM 116 CB VAL A 8 0.332 -8.414 -9.231 1.00 0.00 C ATOM 117 CG1 VAL A 8 1.391 -9.347 -9.797 1.00 0.00 C ATOM 118 CG2 VAL A 8 -0.763 -9.203 -8.528 1.00 0.00 C ATOM 0 H VAL A 8 -0.973 -6.644 -8.003 1.00 0.00 H new ATOM 0 HA VAL A 8 1.509 -7.936 -7.493 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.119 -7.869 -10.060 1.00 0.00 H new ATOM 0 HG11 VAL A 8 0.923 -10.060 -10.475 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.136 -8.765 -10.340 1.00 0.00 H new ATOM 0 HG13 VAL A 8 1.875 -9.885 -8.982 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -1.200 -9.919 -9.224 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.338 -9.737 -7.678 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -1.536 -8.519 -8.178 1.00 0.00 H new ATOM 128 N ALA A 9 1.491 -5.332 -9.443 1.00 0.00 N ATOM 129 CA ALA A 9 2.349 -4.410 -10.170 1.00 0.00 C ATOM 130 C ALA A 9 3.512 -3.979 -9.285 1.00 0.00 C ATOM 131 O ALA A 9 4.650 -3.843 -9.745 1.00 0.00 O ATOM 132 CB ALA A 9 1.555 -3.199 -10.637 1.00 0.00 C ATOM 0 H ALA A 9 0.543 -4.994 -9.280 1.00 0.00 H new ATOM 0 HA ALA A 9 2.746 -4.916 -11.050 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.213 -2.520 -11.179 1.00 0.00 H new ATOM 0 HB2 ALA A 9 0.748 -3.524 -11.294 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.134 -2.684 -9.773 1.00 0.00 H new ATOM 138 N LEU A 10 3.218 -3.791 -8.003 1.00 0.00 N ATOM 139 CA LEU A 10 4.237 -3.399 -7.040 1.00 0.00 C ATOM 140 C LEU A 10 5.240 -4.526 -6.870 1.00 0.00 C ATOM 141 O LEU A 10 6.447 -4.300 -6.811 1.00 0.00 O ATOM 142 CB LEU A 10 3.600 -3.056 -5.690 1.00 0.00 C ATOM 143 CG LEU A 10 2.744 -1.788 -5.676 1.00 0.00 C ATOM 144 CD1 LEU A 10 1.529 -1.975 -4.782 1.00 0.00 C ATOM 145 CD2 LEU A 10 3.567 -0.593 -5.216 1.00 0.00 C ATOM 0 H LEU A 10 2.284 -3.904 -7.609 1.00 0.00 H new ATOM 0 HA LEU A 10 4.749 -2.512 -7.414 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.981 -3.896 -5.375 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.393 -2.948 -4.950 1.00 0.00 H new ATOM 0 HG LEU A 10 2.397 -1.596 -6.691 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.932 -1.063 -4.784 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.927 -2.804 -5.155 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.856 -2.192 -3.765 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.942 0.300 -5.212 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.944 -0.776 -4.210 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.406 -0.446 -5.896 1.00 0.00 H new ATOM 157 N ILE A 11 4.722 -5.744 -6.806 1.00 0.00 N ATOM 158 CA ILE A 11 5.566 -6.924 -6.655 1.00 0.00 C ATOM 159 C ILE A 11 6.340 -7.190 -7.937 1.00 0.00 C ATOM 160 O ILE A 11 7.518 -7.541 -7.896 1.00 0.00 O ATOM 161 CB ILE A 11 4.766 -8.198 -6.282 1.00 0.00 C ATOM 162 CG1 ILE A 11 3.278 -7.910 -6.148 1.00 0.00 C ATOM 163 CG2 ILE A 11 5.278 -8.780 -4.988 1.00 0.00 C ATOM 164 CD1 ILE A 11 2.458 -9.122 -5.755 1.00 0.00 C ATOM 0 H ILE A 11 3.723 -5.943 -6.856 1.00 0.00 H new ATOM 0 HA ILE A 11 6.248 -6.705 -5.833 1.00 0.00 H new ATOM 0 HB ILE A 11 4.906 -8.915 -7.091 1.00 0.00 H new ATOM 0 HG12 ILE A 11 3.134 -7.127 -5.403 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.905 -7.521 -7.096 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.706 -9.674 -4.740 1.00 0.00 H new ATOM 0 HG22 ILE A 11 6.330 -9.041 -5.098 1.00 0.00 H new ATOM 0 HG23 ILE A 11 5.168 -8.046 -4.190 1.00 0.00 H new ATOM 0 HD11 ILE A 11 1.408 -8.841 -5.678 1.00 0.00 H new ATOM 0 HD12 ILE A 11 2.572 -9.899 -6.511 1.00 0.00 H new ATOM 0 HD13 ILE A 11 2.804 -9.499 -4.792 1.00 0.00 H new ATOM 176 N ASP A 12 5.677 -7.011 -9.076 1.00 0.00 N ATOM 177 CA ASP A 12 6.319 -7.222 -10.368 1.00 0.00 C ATOM 178 C ASP A 12 7.671 -6.522 -10.399 1.00 0.00 C ATOM 179 O ASP A 12 8.643 -7.039 -10.951 1.00 0.00 O ATOM 180 CB ASP A 12 5.427 -6.700 -11.499 1.00 0.00 C ATOM 181 CG ASP A 12 5.369 -7.653 -12.676 1.00 0.00 C ATOM 182 OD1 ASP A 12 5.319 -8.881 -12.446 1.00 0.00 O ATOM 183 OD2 ASP A 12 5.373 -7.173 -13.829 1.00 0.00 O ATOM 0 H ASP A 12 4.700 -6.722 -9.130 1.00 0.00 H new ATOM 0 HA ASP A 12 6.471 -8.292 -10.512 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.419 -6.537 -11.117 1.00 0.00 H new ATOM 0 HB3 ASP A 12 5.801 -5.733 -11.836 1.00 0.00 H new ATOM 188 N VAL A 13 7.723 -5.346 -9.784 1.00 0.00 N ATOM 189 CA VAL A 13 8.955 -4.571 -9.721 1.00 0.00 C ATOM 190 C VAL A 13 9.929 -5.167 -8.705 1.00 0.00 C ATOM 191 O VAL A 13 11.120 -5.304 -8.982 1.00 0.00 O ATOM 192 CB VAL A 13 8.684 -3.099 -9.353 1.00 0.00 C ATOM 193 CG1 VAL A 13 9.857 -2.226 -9.764 1.00 0.00 C ATOM 194 CG2 VAL A 13 7.396 -2.608 -10.000 1.00 0.00 C ATOM 0 H VAL A 13 6.926 -4.909 -9.322 1.00 0.00 H new ATOM 0 HA VAL A 13 9.399 -4.609 -10.716 1.00 0.00 H new ATOM 0 HB VAL A 13 8.566 -3.032 -8.272 1.00 0.00 H new ATOM 0 HG11 VAL A 13 9.650 -1.190 -9.497 1.00 0.00 H new ATOM 0 HG12 VAL A 13 10.758 -2.560 -9.249 1.00 0.00 H new ATOM 0 HG13 VAL A 13 10.006 -2.301 -10.841 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.225 -1.567 -9.726 1.00 0.00 H new ATOM 0 HG22 VAL A 13 7.479 -2.689 -11.084 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.560 -3.216 -9.654 1.00 0.00 H new ATOM 204 N PHE A 14 9.416 -5.524 -7.528 1.00 0.00 N ATOM 205 CA PHE A 14 10.246 -6.109 -6.475 1.00 0.00 C ATOM 206 C PHE A 14 10.748 -7.491 -6.892 1.00 0.00 C ATOM 207 O PHE A 14 11.799 -7.944 -6.440 1.00 0.00 O ATOM 208 CB PHE A 14 9.459 -6.167 -5.146 1.00 0.00 C ATOM 209 CG PHE A 14 9.402 -7.521 -4.483 1.00 0.00 C ATOM 210 CD1 PHE A 14 8.816 -8.603 -5.124 1.00 0.00 C ATOM 211 CD2 PHE A 14 9.933 -7.707 -3.216 1.00 0.00 C ATOM 212 CE1 PHE A 14 8.764 -9.841 -4.515 1.00 0.00 C ATOM 213 CE2 PHE A 14 9.884 -8.944 -2.606 1.00 0.00 C ATOM 214 CZ PHE A 14 9.298 -10.013 -3.255 1.00 0.00 C ATOM 0 H PHE A 14 8.432 -5.419 -7.280 1.00 0.00 H new ATOM 0 HA PHE A 14 11.120 -5.476 -6.320 1.00 0.00 H new ATOM 0 HB2 PHE A 14 9.906 -5.459 -4.448 1.00 0.00 H new ATOM 0 HB3 PHE A 14 8.439 -5.830 -5.333 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.396 -8.475 -6.111 1.00 0.00 H new ATOM 0 HD2 PHE A 14 10.390 -6.875 -2.701 1.00 0.00 H new ATOM 0 HE1 PHE A 14 8.305 -10.675 -5.025 1.00 0.00 H new ATOM 0 HE2 PHE A 14 10.304 -9.076 -1.620 1.00 0.00 H new ATOM 0 HZ PHE A 14 9.258 -10.981 -2.777 1.00 0.00 H new ATOM 224 N HIS A 15 9.989 -8.156 -7.758 1.00 0.00 N ATOM 225 CA HIS A 15 10.352 -9.484 -8.238 1.00 0.00 C ATOM 226 C HIS A 15 11.368 -9.399 -9.372 1.00 0.00 C ATOM 227 O HIS A 15 12.101 -10.355 -9.632 1.00 0.00 O ATOM 228 CB HIS A 15 9.106 -10.237 -8.708 1.00 0.00 C ATOM 229 CG HIS A 15 9.295 -11.721 -8.781 1.00 0.00 C ATOM 230 ND1 HIS A 15 8.706 -12.599 -7.896 1.00 0.00 N ATOM 231 CD2 HIS A 15 10.012 -12.482 -9.640 1.00 0.00 C ATOM 232 CE1 HIS A 15 9.052 -13.835 -8.208 1.00 0.00 C ATOM 233 NE2 HIS A 15 9.843 -13.792 -9.263 1.00 0.00 N ATOM 0 H HIS A 15 9.116 -7.795 -8.142 1.00 0.00 H new ATOM 0 HA HIS A 15 10.807 -10.028 -7.410 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.281 -10.017 -8.030 1.00 0.00 H new ATOM 0 HB3 HIS A 15 8.817 -9.867 -9.692 1.00 0.00 H new ATOM 0 HD2 HIS A 15 10.607 -12.126 -10.468 1.00 0.00 H new ATOM 0 HE1 HIS A 15 8.740 -14.729 -7.688 1.00 0.00 H new ATOM 0 HE2 HIS A 15 10.261 -14.600 -9.724 1.00 0.00 H new ATOM 242 N GLN A 16 11.415 -8.251 -10.041 1.00 0.00 N ATOM 243 CA GLN A 16 12.349 -8.049 -11.138 1.00 0.00 C ATOM 244 C GLN A 16 13.738 -7.756 -10.592 1.00 0.00 C ATOM 245 O GLN A 16 14.739 -8.253 -11.108 1.00 0.00 O ATOM 246 CB GLN A 16 11.883 -6.901 -12.035 1.00 0.00 C ATOM 247 CG GLN A 16 10.908 -7.332 -13.119 1.00 0.00 C ATOM 248 CD GLN A 16 10.105 -6.172 -13.674 1.00 0.00 C ATOM 249 OE1 GLN A 16 10.645 -5.295 -14.349 1.00 0.00 O ATOM 250 NE2 GLN A 16 8.808 -6.161 -13.391 1.00 0.00 N ATOM 0 H GLN A 16 10.817 -7.449 -9.841 1.00 0.00 H new ATOM 0 HA GLN A 16 12.387 -8.960 -11.735 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.412 -6.137 -11.417 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.753 -6.441 -12.503 1.00 0.00 H new ATOM 0 HG2 GLN A 16 11.459 -7.809 -13.930 1.00 0.00 H new ATOM 0 HG3 GLN A 16 10.227 -8.080 -12.714 1.00 0.00 H new ATOM 0 HE21 GLN A 16 8.403 -6.909 -12.828 1.00 0.00 H new ATOM 0 HE22 GLN A 16 8.217 -5.405 -13.737 1.00 0.00 H new ATOM 259 N TYR A 17 13.788 -6.948 -9.539 1.00 0.00 N ATOM 260 CA TYR A 17 15.052 -6.592 -8.915 1.00 0.00 C ATOM 261 C TYR A 17 15.499 -7.673 -7.938 1.00 0.00 C ATOM 262 O TYR A 17 16.572 -8.256 -8.090 1.00 0.00 O ATOM 263 CB TYR A 17 14.933 -5.252 -8.189 1.00 0.00 C ATOM 264 CG TYR A 17 15.454 -4.085 -8.996 1.00 0.00 C ATOM 265 CD1 TYR A 17 14.772 -3.633 -10.119 1.00 0.00 C ATOM 266 CD2 TYR A 17 16.628 -3.435 -8.636 1.00 0.00 C ATOM 267 CE1 TYR A 17 15.247 -2.568 -10.862 1.00 0.00 C ATOM 268 CE2 TYR A 17 17.108 -2.369 -9.374 1.00 0.00 C ATOM 269 CZ TYR A 17 16.414 -1.940 -10.484 1.00 0.00 C ATOM 270 OH TYR A 17 16.890 -0.879 -11.222 1.00 0.00 O ATOM 0 H TYR A 17 12.967 -6.529 -9.102 1.00 0.00 H new ATOM 0 HA TYR A 17 15.801 -6.503 -9.702 1.00 0.00 H new ATOM 0 HB2 TYR A 17 13.887 -5.074 -7.939 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.480 -5.307 -7.248 1.00 0.00 H new ATOM 0 HD1 TYR A 17 13.856 -4.122 -10.416 1.00 0.00 H new ATOM 0 HD2 TYR A 17 17.174 -3.768 -7.766 1.00 0.00 H new ATOM 0 HE1 TYR A 17 14.706 -2.230 -11.734 1.00 0.00 H new ATOM 0 HE2 TYR A 17 18.023 -1.875 -9.082 1.00 0.00 H new ATOM 0 HH TYR A 17 17.721 -0.549 -10.821 1.00 0.00 H new ATOM 280 N SER A 18 14.669 -7.934 -6.935 1.00 0.00 N ATOM 281 CA SER A 18 14.980 -8.943 -5.932 1.00 0.00 C ATOM 282 C SER A 18 14.896 -10.346 -6.526 1.00 0.00 C ATOM 283 O SER A 18 13.841 -10.768 -6.998 1.00 0.00 O ATOM 284 CB SER A 18 14.027 -8.826 -4.741 1.00 0.00 C ATOM 285 OG SER A 18 14.445 -9.654 -3.671 1.00 0.00 O ATOM 0 H SER A 18 13.776 -7.461 -6.795 1.00 0.00 H new ATOM 0 HA SER A 18 16.000 -8.771 -5.589 1.00 0.00 H new ATOM 0 HB2 SER A 18 13.983 -7.789 -4.407 1.00 0.00 H new ATOM 0 HB3 SER A 18 13.019 -9.105 -5.049 1.00 0.00 H new ATOM 0 HG SER A 18 15.167 -9.212 -3.178 1.00 0.00 H new ATOM 291 N GLY A 19 16.013 -11.065 -6.496 1.00 0.00 N ATOM 292 CA GLY A 19 16.042 -12.413 -7.032 1.00 0.00 C ATOM 293 C GLY A 19 17.423 -12.821 -7.508 1.00 0.00 C ATOM 294 O GLY A 19 17.964 -13.834 -7.065 1.00 0.00 O ATOM 0 H GLY A 19 16.899 -10.738 -6.110 1.00 0.00 H new ATOM 0 HA2 GLY A 19 15.704 -13.112 -6.267 1.00 0.00 H new ATOM 0 HA3 GLY A 19 15.339 -12.485 -7.862 1.00 0.00 H new ATOM 355 N LYS A 24 16.473 -13.503 -2.580 1.00 0.00 N ATOM 356 CA LYS A 24 15.217 -13.103 -3.203 1.00 0.00 C ATOM 357 C LYS A 24 14.222 -12.607 -2.156 1.00 0.00 C ATOM 358 O LYS A 24 14.372 -12.878 -0.965 1.00 0.00 O ATOM 359 CB LYS A 24 14.614 -14.272 -3.986 1.00 0.00 C ATOM 360 CG LYS A 24 13.323 -13.920 -4.707 1.00 0.00 C ATOM 361 CD LYS A 24 12.900 -15.025 -5.663 1.00 0.00 C ATOM 362 CE LYS A 24 11.810 -15.895 -5.059 1.00 0.00 C ATOM 363 NZ LYS A 24 11.099 -16.695 -6.096 1.00 0.00 N ATOM 0 HA LYS A 24 15.428 -12.285 -3.892 1.00 0.00 H new ATOM 0 HB2 LYS A 24 15.343 -14.624 -4.715 1.00 0.00 H new ATOM 0 HB3 LYS A 24 14.424 -15.098 -3.301 1.00 0.00 H new ATOM 0 HG2 LYS A 24 12.533 -13.747 -3.977 1.00 0.00 H new ATOM 0 HG3 LYS A 24 13.456 -12.990 -5.260 1.00 0.00 H new ATOM 0 HD2 LYS A 24 12.542 -14.585 -6.594 1.00 0.00 H new ATOM 0 HD3 LYS A 24 13.763 -15.642 -5.913 1.00 0.00 H new ATOM 0 HE2 LYS A 24 12.249 -16.566 -4.320 1.00 0.00 H new ATOM 0 HE3 LYS A 24 11.093 -15.265 -4.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 10.364 -17.275 -5.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 10.659 -16.055 -6.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 11.778 -17.315 -6.582 1.00 0.00 H new ATOM 377 N HIS A 25 13.208 -11.876 -2.611 1.00 0.00 N ATOM 378 CA HIS A 25 12.188 -11.338 -1.716 1.00 0.00 C ATOM 379 C HIS A 25 12.796 -10.342 -0.731 1.00 0.00 C ATOM 380 O HIS A 25 12.613 -10.457 0.480 1.00 0.00 O ATOM 381 CB HIS A 25 11.492 -12.467 -0.957 1.00 0.00 C ATOM 382 CG HIS A 25 10.124 -12.100 -0.479 1.00 0.00 C ATOM 383 ND1 HIS A 25 9.089 -13.006 -0.385 1.00 0.00 N ATOM 384 CD2 HIS A 25 9.618 -10.911 -0.073 1.00 0.00 C ATOM 385 CE1 HIS A 25 8.007 -12.391 0.056 1.00 0.00 C ATOM 386 NE2 HIS A 25 8.301 -11.120 0.254 1.00 0.00 N ATOM 0 H HIS A 25 13.071 -11.643 -3.594 1.00 0.00 H new ATOM 0 HA HIS A 25 11.450 -10.814 -2.324 1.00 0.00 H new ATOM 0 HB2 HIS A 25 11.421 -13.341 -1.604 1.00 0.00 H new ATOM 0 HB3 HIS A 25 12.104 -12.752 -0.102 1.00 0.00 H new ATOM 0 HD2 HIS A 25 10.151 -9.973 -0.017 1.00 0.00 H new ATOM 0 HE1 HIS A 25 7.044 -12.850 0.226 1.00 0.00 H new ATOM 0 HE2 HIS A 25 7.655 -10.408 0.595 1.00 0.00 H new ATOM 395 N LYS A 26 13.523 -9.370 -1.268 1.00 0.00 N ATOM 396 CA LYS A 26 14.171 -8.346 -0.461 1.00 0.00 C ATOM 397 C LYS A 26 14.857 -7.319 -1.358 1.00 0.00 C ATOM 398 O LYS A 26 15.186 -7.620 -2.503 1.00 0.00 O ATOM 399 CB LYS A 26 15.182 -8.992 0.480 1.00 0.00 C ATOM 400 CG LYS A 26 15.614 -8.090 1.620 1.00 0.00 C ATOM 401 CD LYS A 26 15.449 -8.777 2.965 1.00 0.00 C ATOM 402 CE LYS A 26 13.987 -8.851 3.369 1.00 0.00 C ATOM 403 NZ LYS A 26 13.544 -10.253 3.606 1.00 0.00 N ATOM 0 H LYS A 26 13.679 -9.270 -2.271 1.00 0.00 H new ATOM 0 HA LYS A 26 13.415 -7.832 0.133 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.750 -9.904 0.893 1.00 0.00 H new ATOM 0 HB3 LYS A 26 16.062 -9.287 -0.092 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.656 -7.802 1.483 1.00 0.00 H new ATOM 0 HG3 LYS A 26 15.025 -7.173 1.604 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.867 -9.783 2.916 1.00 0.00 H new ATOM 0 HD3 LYS A 26 16.012 -8.235 3.725 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.831 -8.264 4.274 1.00 0.00 H new ATOM 0 HE3 LYS A 26 13.372 -8.404 2.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 12.766 -10.259 4.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 13.216 -10.669 2.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 14.340 -10.811 3.976 1.00 0.00 H new ATOM 417 N LEU A 27 15.082 -6.115 -0.837 1.00 0.00 N ATOM 418 CA LEU A 27 15.742 -5.064 -1.614 1.00 0.00 C ATOM 419 C LEU A 27 16.811 -4.372 -0.780 1.00 0.00 C ATOM 420 O LEU A 27 16.596 -4.063 0.392 1.00 0.00 O ATOM 421 CB LEU A 27 14.741 -4.016 -2.125 1.00 0.00 C ATOM 422 CG LEU A 27 13.718 -4.481 -3.183 1.00 0.00 C ATOM 423 CD1 LEU A 27 14.376 -5.343 -4.250 1.00 0.00 C ATOM 424 CD2 LEU A 27 12.545 -5.216 -2.537 1.00 0.00 C ATOM 0 H LEU A 27 14.821 -5.843 0.111 1.00 0.00 H new ATOM 0 HA LEU A 27 16.204 -5.547 -2.475 1.00 0.00 H new ATOM 0 HB2 LEU A 27 14.190 -3.628 -1.268 1.00 0.00 H new ATOM 0 HB3 LEU A 27 15.306 -3.183 -2.544 1.00 0.00 H new ATOM 0 HG LEU A 27 13.326 -3.588 -3.670 1.00 0.00 H new ATOM 0 HD11 LEU A 27 13.628 -5.654 -4.979 1.00 0.00 H new ATOM 0 HD12 LEU A 27 15.155 -4.769 -4.752 1.00 0.00 H new ATOM 0 HD13 LEU A 27 14.817 -6.225 -3.785 1.00 0.00 H new ATOM 0 HD21 LEU A 27 11.843 -5.530 -3.309 1.00 0.00 H new ATOM 0 HD22 LEU A 27 12.914 -6.092 -2.004 1.00 0.00 H new ATOM 0 HD23 LEU A 27 12.040 -4.551 -1.836 1.00 0.00 H new ATOM 436 N LYS A 28 17.963 -4.132 -1.392 1.00 0.00 N ATOM 437 CA LYS A 28 19.077 -3.480 -0.708 1.00 0.00 C ATOM 438 C LYS A 28 19.425 -2.143 -1.355 1.00 0.00 C ATOM 439 O LYS A 28 18.748 -1.693 -2.278 1.00 0.00 O ATOM 440 CB LYS A 28 20.304 -4.395 -0.704 1.00 0.00 C ATOM 441 CG LYS A 28 20.778 -4.784 -2.095 1.00 0.00 C ATOM 442 CD LYS A 28 21.142 -6.258 -2.171 1.00 0.00 C ATOM 443 CE LYS A 28 22.258 -6.505 -3.172 1.00 0.00 C ATOM 444 NZ LYS A 28 22.068 -7.784 -3.911 1.00 0.00 N ATOM 0 H LYS A 28 18.153 -4.379 -2.363 1.00 0.00 H new ATOM 0 HA LYS A 28 18.769 -3.286 0.319 1.00 0.00 H new ATOM 0 HB2 LYS A 28 21.118 -3.895 -0.179 1.00 0.00 H new ATOM 0 HB3 LYS A 28 20.070 -5.300 -0.143 1.00 0.00 H new ATOM 0 HG2 LYS A 28 19.996 -4.564 -2.821 1.00 0.00 H new ATOM 0 HG3 LYS A 28 21.644 -4.180 -2.367 1.00 0.00 H new ATOM 0 HD2 LYS A 28 21.451 -6.609 -1.186 1.00 0.00 H new ATOM 0 HD3 LYS A 28 20.263 -6.837 -2.454 1.00 0.00 H new ATOM 0 HE2 LYS A 28 22.299 -5.678 -3.881 1.00 0.00 H new ATOM 0 HE3 LYS A 28 23.215 -6.525 -2.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 22.737 -7.828 -4.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 22.239 -8.584 -3.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 21.095 -7.834 -4.274 1.00 0.00 H new ATOM 458 N LYS A 29 20.488 -1.513 -0.860 1.00 0.00 N ATOM 459 CA LYS A 29 20.933 -0.227 -1.387 1.00 0.00 C ATOM 460 C LYS A 29 21.243 -0.329 -2.877 1.00 0.00 C ATOM 461 O LYS A 29 21.104 0.642 -3.619 1.00 0.00 O ATOM 462 CB LYS A 29 22.173 0.259 -0.634 1.00 0.00 C ATOM 463 CG LYS A 29 22.079 0.089 0.874 1.00 0.00 C ATOM 464 CD LYS A 29 22.510 1.350 1.606 1.00 0.00 C ATOM 465 CE LYS A 29 21.808 1.483 2.948 1.00 0.00 C ATOM 466 NZ LYS A 29 22.611 0.895 4.055 1.00 0.00 N ATOM 0 H LYS A 29 21.057 -1.873 -0.094 1.00 0.00 H new ATOM 0 HA LYS A 29 20.125 0.491 -1.246 1.00 0.00 H new ATOM 0 HB2 LYS A 29 23.045 -0.285 -0.998 1.00 0.00 H new ATOM 0 HB3 LYS A 29 22.336 1.312 -0.862 1.00 0.00 H new ATOM 0 HG2 LYS A 29 21.054 -0.160 1.150 1.00 0.00 H new ATOM 0 HG3 LYS A 29 22.706 -0.746 1.187 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.589 1.332 1.759 1.00 0.00 H new ATOM 0 HD3 LYS A 29 22.289 2.222 0.991 1.00 0.00 H new ATOM 0 HE2 LYS A 29 21.619 2.536 3.156 1.00 0.00 H new ATOM 0 HE3 LYS A 29 20.838 0.988 2.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 22.098 1.006 4.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 22.770 -0.116 3.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 23.527 1.384 4.117 1.00 0.00 H new ATOM 480 N SER A 30 21.669 -1.511 -3.306 1.00 0.00 N ATOM 481 CA SER A 30 22.000 -1.737 -4.706 1.00 0.00 C ATOM 482 C SER A 30 20.736 -1.856 -5.551 1.00 0.00 C ATOM 483 O SER A 30 20.572 -1.143 -6.539 1.00 0.00 O ATOM 484 CB SER A 30 22.850 -3.001 -4.854 1.00 0.00 C ATOM 485 OG SER A 30 23.896 -2.807 -5.789 1.00 0.00 O ATOM 0 H SER A 30 21.793 -2.326 -2.705 1.00 0.00 H new ATOM 0 HA SER A 30 22.573 -0.880 -5.061 1.00 0.00 H new ATOM 0 HB2 SER A 30 23.270 -3.276 -3.886 1.00 0.00 H new ATOM 0 HB3 SER A 30 22.220 -3.831 -5.175 1.00 0.00 H new ATOM 0 HG SER A 30 24.425 -3.629 -5.863 1.00 0.00 H new ATOM 491 N GLU A 31 19.848 -2.762 -5.158 1.00 0.00 N ATOM 492 CA GLU A 31 18.602 -2.977 -5.885 1.00 0.00 C ATOM 493 C GLU A 31 17.601 -1.857 -5.616 1.00 0.00 C ATOM 494 O GLU A 31 17.173 -1.160 -6.535 1.00 0.00 O ATOM 495 CB GLU A 31 17.991 -4.325 -5.497 1.00 0.00 C ATOM 496 CG GLU A 31 18.515 -5.487 -6.324 1.00 0.00 C ATOM 497 CD GLU A 31 18.614 -6.772 -5.526 1.00 0.00 C ATOM 498 OE1 GLU A 31 19.079 -6.718 -4.368 1.00 0.00 O ATOM 499 OE2 GLU A 31 18.226 -7.833 -6.058 1.00 0.00 O ATOM 0 H GLU A 31 19.968 -3.360 -4.340 1.00 0.00 H new ATOM 0 HA GLU A 31 18.833 -2.977 -6.950 1.00 0.00 H new ATOM 0 HB2 GLU A 31 18.195 -4.518 -4.444 1.00 0.00 H new ATOM 0 HB3 GLU A 31 16.908 -4.270 -5.607 1.00 0.00 H new ATOM 0 HG2 GLU A 31 17.858 -5.645 -7.180 1.00 0.00 H new ATOM 0 HG3 GLU A 31 19.498 -5.232 -6.720 1.00 0.00 H new ATOM 506 N LEU A 32 17.224 -1.696 -4.349 1.00 0.00 N ATOM 507 CA LEU A 32 16.263 -0.668 -3.949 1.00 0.00 C ATOM 508 C LEU A 32 16.554 0.676 -4.619 1.00 0.00 C ATOM 509 O LEU A 32 15.775 1.147 -5.448 1.00 0.00 O ATOM 510 CB LEU A 32 16.274 -0.505 -2.427 1.00 0.00 C ATOM 511 CG LEU A 32 15.076 0.249 -1.843 1.00 0.00 C ATOM 512 CD1 LEU A 32 15.151 1.727 -2.194 1.00 0.00 C ATOM 513 CD2 LEU A 32 13.771 -0.354 -2.340 1.00 0.00 C ATOM 0 H LEU A 32 17.571 -2.267 -3.578 1.00 0.00 H new ATOM 0 HA LEU A 32 15.276 -0.994 -4.276 1.00 0.00 H new ATOM 0 HB2 LEU A 32 16.317 -1.495 -1.972 1.00 0.00 H new ATOM 0 HB3 LEU A 32 17.187 0.018 -2.140 1.00 0.00 H new ATOM 0 HG LEU A 32 15.106 0.153 -0.758 1.00 0.00 H new ATOM 0 HD11 LEU A 32 14.291 2.246 -1.770 1.00 0.00 H new ATOM 0 HD12 LEU A 32 16.068 2.152 -1.786 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.148 1.844 -3.278 1.00 0.00 H new ATOM 0 HD21 LEU A 32 12.931 0.195 -1.914 1.00 0.00 H new ATOM 0 HD22 LEU A 32 13.732 -0.291 -3.427 1.00 0.00 H new ATOM 0 HD23 LEU A 32 13.713 -1.399 -2.035 1.00 0.00 H new ATOM 525 N LYS A 33 17.674 1.291 -4.251 1.00 0.00 N ATOM 526 CA LYS A 33 18.061 2.584 -4.812 1.00 0.00 C ATOM 527 C LYS A 33 18.033 2.563 -6.339 1.00 0.00 C ATOM 528 O LYS A 33 17.332 3.358 -6.969 1.00 0.00 O ATOM 529 CB LYS A 33 19.452 2.980 -4.320 1.00 0.00 C ATOM 530 CG LYS A 33 19.599 2.912 -2.809 1.00 0.00 C ATOM 531 CD LYS A 33 20.824 3.673 -2.333 1.00 0.00 C ATOM 532 CE LYS A 33 20.821 3.842 -0.823 1.00 0.00 C ATOM 533 NZ LYS A 33 21.917 4.738 -0.361 1.00 0.00 N ATOM 0 H LYS A 33 18.331 0.916 -3.567 1.00 0.00 H new ATOM 0 HA LYS A 33 17.335 3.323 -4.472 1.00 0.00 H new ATOM 0 HB2 LYS A 33 20.192 2.325 -4.780 1.00 0.00 H new ATOM 0 HB3 LYS A 33 19.673 3.994 -4.654 1.00 0.00 H new ATOM 0 HG2 LYS A 33 18.707 3.324 -2.337 1.00 0.00 H new ATOM 0 HG3 LYS A 33 19.672 1.870 -2.496 1.00 0.00 H new ATOM 0 HD2 LYS A 33 21.725 3.142 -2.639 1.00 0.00 H new ATOM 0 HD3 LYS A 33 20.853 4.653 -2.810 1.00 0.00 H new ATOM 0 HE2 LYS A 33 19.861 4.249 -0.505 1.00 0.00 H new ATOM 0 HE3 LYS A 33 20.926 2.866 -0.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 21.694 5.099 0.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 22.810 4.206 -0.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 22.014 5.536 -1.020 1.00 0.00 H new ATOM 547 N GLU A 34 18.795 1.650 -6.935 1.00 0.00 N ATOM 548 CA GLU A 34 18.844 1.536 -8.390 1.00 0.00 C ATOM 549 C GLU A 34 17.438 1.400 -8.962 1.00 0.00 C ATOM 550 O GLU A 34 17.145 1.915 -10.040 1.00 0.00 O ATOM 551 CB GLU A 34 19.698 0.340 -8.811 1.00 0.00 C ATOM 552 CG GLU A 34 21.186 0.538 -8.565 1.00 0.00 C ATOM 553 CD GLU A 34 21.778 1.635 -9.426 1.00 0.00 C ATOM 554 OE1 GLU A 34 21.460 2.819 -9.183 1.00 0.00 O ATOM 555 OE2 GLU A 34 22.560 1.312 -10.345 1.00 0.00 O ATOM 0 H GLU A 34 19.384 0.982 -6.437 1.00 0.00 H new ATOM 0 HA GLU A 34 19.299 2.444 -8.786 1.00 0.00 H new ATOM 0 HB2 GLU A 34 19.363 -0.544 -8.268 1.00 0.00 H new ATOM 0 HB3 GLU A 34 19.536 0.144 -9.871 1.00 0.00 H new ATOM 0 HG2 GLU A 34 21.348 0.779 -7.514 1.00 0.00 H new ATOM 0 HG3 GLU A 34 21.711 -0.397 -8.762 1.00 0.00 H new ATOM 562 N LEU A 35 16.569 0.713 -8.227 1.00 0.00 N ATOM 563 CA LEU A 35 15.192 0.521 -8.660 1.00 0.00 C ATOM 564 C LEU A 35 14.484 1.862 -8.774 1.00 0.00 C ATOM 565 O LEU A 35 13.722 2.101 -9.709 1.00 0.00 O ATOM 566 CB LEU A 35 14.443 -0.394 -7.688 1.00 0.00 C ATOM 567 CG LEU A 35 13.207 -1.085 -8.266 1.00 0.00 C ATOM 568 CD1 LEU A 35 12.487 -1.880 -7.189 1.00 0.00 C ATOM 569 CD2 LEU A 35 12.274 -0.061 -8.894 1.00 0.00 C ATOM 0 H LEU A 35 16.795 0.281 -7.331 1.00 0.00 H new ATOM 0 HA LEU A 35 15.203 0.045 -9.641 1.00 0.00 H new ATOM 0 HB2 LEU A 35 15.132 -1.158 -7.329 1.00 0.00 H new ATOM 0 HB3 LEU A 35 14.139 0.194 -6.822 1.00 0.00 H new ATOM 0 HG LEU A 35 13.529 -1.779 -9.043 1.00 0.00 H new ATOM 0 HD11 LEU A 35 11.610 -2.364 -7.619 1.00 0.00 H new ATOM 0 HD12 LEU A 35 13.159 -2.638 -6.786 1.00 0.00 H new ATOM 0 HD13 LEU A 35 12.175 -1.209 -6.389 1.00 0.00 H new ATOM 0 HD21 LEU A 35 11.399 -0.568 -9.301 1.00 0.00 H new ATOM 0 HD22 LEU A 35 11.958 0.656 -8.136 1.00 0.00 H new ATOM 0 HD23 LEU A 35 12.795 0.463 -9.695 1.00 0.00 H new ATOM 581 N ILE A 36 14.756 2.734 -7.819 1.00 0.00 N ATOM 582 CA ILE A 36 14.164 4.067 -7.802 1.00 0.00 C ATOM 583 C ILE A 36 14.392 4.755 -9.140 1.00 0.00 C ATOM 584 O ILE A 36 13.454 4.979 -9.904 1.00 0.00 O ATOM 585 CB ILE A 36 14.753 4.929 -6.657 1.00 0.00 C ATOM 586 CG1 ILE A 36 14.383 4.308 -5.303 1.00 0.00 C ATOM 587 CG2 ILE A 36 14.270 6.378 -6.750 1.00 0.00 C ATOM 588 CD1 ILE A 36 14.348 5.294 -4.153 1.00 0.00 C ATOM 0 H ILE A 36 15.386 2.545 -7.040 1.00 0.00 H new ATOM 0 HA ILE A 36 13.093 3.959 -7.628 1.00 0.00 H new ATOM 0 HB ILE A 36 15.839 4.945 -6.753 1.00 0.00 H new ATOM 0 HG12 ILE A 36 13.405 3.834 -5.389 1.00 0.00 H new ATOM 0 HG13 ILE A 36 15.100 3.521 -5.070 1.00 0.00 H new ATOM 0 HG21 ILE A 36 14.700 6.958 -5.933 1.00 0.00 H new ATOM 0 HG22 ILE A 36 14.583 6.805 -7.703 1.00 0.00 H new ATOM 0 HG23 ILE A 36 13.183 6.404 -6.680 1.00 0.00 H new ATOM 0 HD11 ILE A 36 14.078 4.772 -3.235 1.00 0.00 H new ATOM 0 HD12 ILE A 36 15.330 5.751 -4.036 1.00 0.00 H new ATOM 0 HD13 ILE A 36 13.610 6.069 -4.360 1.00 0.00 H new ATOM 600 N ASN A 37 15.648 5.064 -9.432 1.00 0.00 N ATOM 601 CA ASN A 37 15.991 5.704 -10.696 1.00 0.00 C ATOM 602 C ASN A 37 15.536 4.840 -11.873 1.00 0.00 C ATOM 603 O ASN A 37 15.416 5.322 -12.999 1.00 0.00 O ATOM 604 CB ASN A 37 17.499 5.949 -10.777 1.00 0.00 C ATOM 605 CG ASN A 37 18.023 6.728 -9.587 1.00 0.00 C ATOM 606 OD1 ASN A 37 17.252 7.223 -8.765 1.00 0.00 O ATOM 607 ND2 ASN A 37 19.343 6.842 -9.489 1.00 0.00 N ATOM 0 H ASN A 37 16.441 4.884 -8.817 1.00 0.00 H new ATOM 0 HA ASN A 37 15.476 6.663 -10.747 1.00 0.00 H new ATOM 0 HB2 ASN A 37 18.017 4.992 -10.838 1.00 0.00 H new ATOM 0 HB3 ASN A 37 17.727 6.494 -11.693 1.00 0.00 H new ATOM 0 HD21 ASN A 37 19.754 7.356 -8.710 1.00 0.00 H new ATOM 0 HD22 ASN A 37 19.945 6.416 -10.193 1.00 0.00 H new ATOM 614 N ASN A 38 15.289 3.558 -11.602 1.00 0.00 N ATOM 615 CA ASN A 38 14.854 2.624 -12.630 1.00 0.00 C ATOM 616 C ASN A 38 13.355 2.736 -12.904 1.00 0.00 C ATOM 617 O ASN A 38 12.926 2.678 -14.057 1.00 0.00 O ATOM 618 CB ASN A 38 15.193 1.191 -12.218 1.00 0.00 C ATOM 619 CG ASN A 38 15.013 0.203 -13.354 1.00 0.00 C ATOM 620 OD1 ASN A 38 13.908 -0.282 -13.602 1.00 0.00 O ATOM 621 ND2 ASN A 38 16.100 -0.100 -14.052 1.00 0.00 N ATOM 0 H ASN A 38 15.385 3.146 -10.674 1.00 0.00 H new ATOM 0 HA ASN A 38 15.384 2.880 -13.547 1.00 0.00 H new ATOM 0 HB2 ASN A 38 16.224 1.152 -11.866 1.00 0.00 H new ATOM 0 HB3 ASN A 38 14.559 0.897 -11.381 1.00 0.00 H new ATOM 0 HD21 ASN A 38 16.040 -0.758 -14.829 1.00 0.00 H new ATOM 0 HD22 ASN A 38 16.995 0.325 -13.812 1.00 0.00 H new ATOM 628 N GLU A 39 12.552 2.878 -11.848 1.00 0.00 N ATOM 629 CA GLU A 39 11.103 2.970 -12.019 1.00 0.00 C ATOM 630 C GLU A 39 10.472 4.011 -11.094 1.00 0.00 C ATOM 631 O GLU A 39 9.494 3.723 -10.403 1.00 0.00 O ATOM 632 CB GLU A 39 10.460 1.603 -11.772 1.00 0.00 C ATOM 633 CG GLU A 39 10.974 0.512 -12.697 1.00 0.00 C ATOM 634 CD GLU A 39 9.865 -0.157 -13.487 1.00 0.00 C ATOM 635 OE1 GLU A 39 8.824 -0.489 -12.883 1.00 0.00 O ATOM 636 OE2 GLU A 39 10.039 -0.347 -14.709 1.00 0.00 O ATOM 0 H GLU A 39 12.874 2.931 -10.882 1.00 0.00 H new ATOM 0 HA GLU A 39 10.919 3.289 -13.045 1.00 0.00 H new ATOM 0 HB2 GLU A 39 10.642 1.307 -10.739 1.00 0.00 H new ATOM 0 HB3 GLU A 39 9.380 1.692 -11.893 1.00 0.00 H new ATOM 0 HG2 GLU A 39 11.700 0.940 -13.389 1.00 0.00 H new ATOM 0 HG3 GLU A 39 11.500 -0.240 -12.108 1.00 0.00 H new ATOM 643 N LEU A 40 11.014 5.224 -11.098 1.00 0.00 N ATOM 644 CA LEU A 40 10.475 6.298 -10.270 1.00 0.00 C ATOM 645 C LEU A 40 10.838 7.663 -10.845 1.00 0.00 C ATOM 646 O LEU A 40 11.968 8.129 -10.701 1.00 0.00 O ATOM 647 CB LEU A 40 10.977 6.182 -8.828 1.00 0.00 C ATOM 648 CG LEU A 40 10.420 4.991 -8.043 1.00 0.00 C ATOM 649 CD1 LEU A 40 11.058 4.907 -6.666 1.00 0.00 C ATOM 650 CD2 LEU A 40 8.907 5.097 -7.926 1.00 0.00 C ATOM 0 H LEU A 40 11.822 5.488 -11.662 1.00 0.00 H new ATOM 0 HA LEU A 40 9.389 6.201 -10.267 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.065 6.112 -8.842 1.00 0.00 H new ATOM 0 HB3 LEU A 40 10.724 7.099 -8.296 1.00 0.00 H new ATOM 0 HG LEU A 40 10.663 4.077 -8.585 1.00 0.00 H new ATOM 0 HD11 LEU A 40 10.647 4.054 -6.126 1.00 0.00 H new ATOM 0 HD12 LEU A 40 12.136 4.785 -6.771 1.00 0.00 H new ATOM 0 HD13 LEU A 40 10.849 5.822 -6.112 1.00 0.00 H new ATOM 0 HD21 LEU A 40 8.525 4.244 -7.366 1.00 0.00 H new ATOM 0 HD22 LEU A 40 8.646 6.019 -7.406 1.00 0.00 H new ATOM 0 HD23 LEU A 40 8.465 5.104 -8.922 1.00 0.00 H new ATOM 779 N LYS A 48 16.897 12.508 -3.945 1.00 0.00 N ATOM 780 CA LYS A 48 17.388 13.847 -3.622 1.00 0.00 C ATOM 781 C LYS A 48 18.900 13.858 -3.415 1.00 0.00 C ATOM 782 O LYS A 48 19.561 14.866 -3.664 1.00 0.00 O ATOM 783 CB LYS A 48 16.687 14.379 -2.371 1.00 0.00 C ATOM 784 CG LYS A 48 15.170 14.353 -2.464 1.00 0.00 C ATOM 785 CD LYS A 48 14.539 13.876 -1.165 1.00 0.00 C ATOM 786 CE LYS A 48 14.231 12.387 -1.208 1.00 0.00 C ATOM 787 NZ LYS A 48 12.767 12.123 -1.275 1.00 0.00 N ATOM 0 HA LYS A 48 17.161 14.495 -4.469 1.00 0.00 H new ATOM 0 HB2 LYS A 48 17.000 13.787 -1.511 1.00 0.00 H new ATOM 0 HB3 LYS A 48 17.014 15.403 -2.190 1.00 0.00 H new ATOM 0 HG2 LYS A 48 14.802 15.351 -2.703 1.00 0.00 H new ATOM 0 HG3 LYS A 48 14.866 13.697 -3.280 1.00 0.00 H new ATOM 0 HD2 LYS A 48 15.212 14.085 -0.334 1.00 0.00 H new ATOM 0 HD3 LYS A 48 13.621 14.433 -0.979 1.00 0.00 H new ATOM 0 HE2 LYS A 48 14.720 11.940 -2.074 1.00 0.00 H new ATOM 0 HE3 LYS A 48 14.646 11.905 -0.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 12.600 11.097 -1.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 12.303 12.527 -0.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 12.374 12.561 -2.133 1.00 0.00 H new ATOM 801 N GLU A 49 19.442 12.735 -2.958 1.00 0.00 N ATOM 802 CA GLU A 49 20.877 12.621 -2.716 1.00 0.00 C ATOM 803 C GLU A 49 21.222 11.233 -2.191 1.00 0.00 C ATOM 804 O GLU A 49 20.336 10.427 -1.924 1.00 0.00 O ATOM 805 CB GLU A 49 21.330 13.686 -1.713 1.00 0.00 C ATOM 806 CG GLU A 49 22.695 14.283 -2.023 1.00 0.00 C ATOM 807 CD GLU A 49 22.802 14.787 -3.450 1.00 0.00 C ATOM 808 OE1 GLU A 49 22.420 15.950 -3.700 1.00 0.00 O ATOM 809 OE2 GLU A 49 23.269 14.018 -4.316 1.00 0.00 O ATOM 0 H GLU A 49 18.910 11.890 -2.747 1.00 0.00 H new ATOM 0 HA GLU A 49 21.399 12.777 -3.660 1.00 0.00 H new ATOM 0 HB2 GLU A 49 20.591 14.487 -1.689 1.00 0.00 H new ATOM 0 HB3 GLU A 49 21.355 13.245 -0.716 1.00 0.00 H new ATOM 0 HG2 GLU A 49 22.892 15.106 -1.336 1.00 0.00 H new ATOM 0 HG3 GLU A 49 23.464 13.531 -1.849 1.00 0.00 H new ATOM 816 N GLN A 50 22.510 10.956 -2.039 1.00 0.00 N ATOM 817 CA GLN A 50 22.948 9.661 -1.538 1.00 0.00 C ATOM 818 C GLN A 50 22.587 9.503 -0.064 1.00 0.00 C ATOM 819 O GLN A 50 22.441 8.386 0.436 1.00 0.00 O ATOM 820 CB GLN A 50 24.457 9.497 -1.730 1.00 0.00 C ATOM 821 CG GLN A 50 24.906 9.647 -3.174 1.00 0.00 C ATOM 822 CD GLN A 50 26.413 9.729 -3.311 1.00 0.00 C ATOM 823 OE1 GLN A 50 26.944 10.660 -3.913 1.00 0.00 O ATOM 824 NE2 GLN A 50 27.111 8.748 -2.749 1.00 0.00 N ATOM 0 H GLN A 50 23.266 11.607 -2.254 1.00 0.00 H new ATOM 0 HA GLN A 50 22.435 8.885 -2.106 1.00 0.00 H new ATOM 0 HB2 GLN A 50 24.975 10.236 -1.119 1.00 0.00 H new ATOM 0 HB3 GLN A 50 24.757 8.515 -1.365 1.00 0.00 H new ATOM 0 HG2 GLN A 50 24.538 8.801 -3.755 1.00 0.00 H new ATOM 0 HG3 GLN A 50 24.457 10.545 -3.599 1.00 0.00 H new ATOM 0 HE21 GLN A 50 26.629 7.995 -2.259 1.00 0.00 H new ATOM 0 HE22 GLN A 50 28.129 8.748 -2.808 1.00 0.00 H new ATOM 833 N GLU A 51 22.443 10.630 0.627 1.00 0.00 N ATOM 834 CA GLU A 51 22.099 10.619 2.044 1.00 0.00 C ATOM 835 C GLU A 51 20.615 10.342 2.252 1.00 0.00 C ATOM 836 O GLU A 51 20.235 9.607 3.164 1.00 0.00 O ATOM 837 CB GLU A 51 22.473 11.952 2.697 1.00 0.00 C ATOM 838 CG GLU A 51 22.118 13.171 1.862 1.00 0.00 C ATOM 839 CD GLU A 51 22.143 14.455 2.667 1.00 0.00 C ATOM 840 OE1 GLU A 51 21.183 14.697 3.429 1.00 0.00 O ATOM 841 OE2 GLU A 51 23.122 15.220 2.537 1.00 0.00 O ATOM 0 H GLU A 51 22.559 11.562 0.228 1.00 0.00 H new ATOM 0 HA GLU A 51 22.667 9.817 2.515 1.00 0.00 H new ATOM 0 HB2 GLU A 51 21.970 12.026 3.661 1.00 0.00 H new ATOM 0 HB3 GLU A 51 23.545 11.960 2.895 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.818 13.254 1.031 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.126 13.036 1.431 1.00 0.00 H new ATOM 848 N VAL A 52 19.778 10.937 1.410 1.00 0.00 N ATOM 849 CA VAL A 52 18.336 10.750 1.520 1.00 0.00 C ATOM 850 C VAL A 52 17.953 9.290 1.293 1.00 0.00 C ATOM 851 O VAL A 52 17.136 8.733 2.026 1.00 0.00 O ATOM 852 CB VAL A 52 17.554 11.658 0.536 1.00 0.00 C ATOM 853 CG1 VAL A 52 18.145 13.059 0.522 1.00 0.00 C ATOM 854 CG2 VAL A 52 17.533 11.070 -0.870 1.00 0.00 C ATOM 0 H VAL A 52 20.070 11.549 0.648 1.00 0.00 H new ATOM 0 HA VAL A 52 18.060 11.037 2.535 1.00 0.00 H new ATOM 0 HB VAL A 52 16.523 11.717 0.884 1.00 0.00 H new ATOM 0 HG11 VAL A 52 17.584 13.683 -0.174 1.00 0.00 H new ATOM 0 HG12 VAL A 52 18.087 13.488 1.522 1.00 0.00 H new ATOM 0 HG13 VAL A 52 19.188 13.011 0.207 1.00 0.00 H new ATOM 0 HG21 VAL A 52 16.977 11.732 -1.533 1.00 0.00 H new ATOM 0 HG22 VAL A 52 18.554 10.965 -1.236 1.00 0.00 H new ATOM 0 HG23 VAL A 52 17.053 10.092 -0.848 1.00 0.00 H new ATOM 864 N VAL A 53 18.554 8.673 0.277 1.00 0.00 N ATOM 865 CA VAL A 53 18.270 7.274 -0.039 1.00 0.00 C ATOM 866 C VAL A 53 18.587 6.372 1.144 1.00 0.00 C ATOM 867 O VAL A 53 17.744 5.584 1.573 1.00 0.00 O ATOM 868 CB VAL A 53 19.050 6.756 -1.267 1.00 0.00 C ATOM 869 CG1 VAL A 53 18.218 5.724 -2.010 1.00 0.00 C ATOM 870 CG2 VAL A 53 19.461 7.890 -2.192 1.00 0.00 C ATOM 0 H VAL A 53 19.236 9.116 -0.338 1.00 0.00 H new ATOM 0 HA VAL A 53 17.206 7.241 -0.272 1.00 0.00 H new ATOM 0 HB VAL A 53 19.967 6.284 -0.913 1.00 0.00 H new ATOM 0 HG11 VAL A 53 18.774 5.363 -2.875 1.00 0.00 H new ATOM 0 HG12 VAL A 53 17.997 4.888 -1.346 1.00 0.00 H new ATOM 0 HG13 VAL A 53 17.285 6.180 -2.343 1.00 0.00 H new ATOM 0 HG21 VAL A 53 20.007 7.485 -3.044 1.00 0.00 H new ATOM 0 HG22 VAL A 53 18.572 8.411 -2.546 1.00 0.00 H new ATOM 0 HG23 VAL A 53 20.099 8.588 -1.650 1.00 0.00 H new ATOM 880 N ASP A 54 19.804 6.489 1.675 1.00 0.00 N ATOM 881 CA ASP A 54 20.212 5.677 2.816 1.00 0.00 C ATOM 882 C ASP A 54 19.134 5.709 3.888 1.00 0.00 C ATOM 883 O ASP A 54 18.849 4.700 4.534 1.00 0.00 O ATOM 884 CB ASP A 54 21.543 6.173 3.387 1.00 0.00 C ATOM 885 CG ASP A 54 22.190 5.156 4.306 1.00 0.00 C ATOM 886 OD1 ASP A 54 21.637 4.905 5.398 1.00 0.00 O ATOM 887 OD2 ASP A 54 23.250 4.610 3.935 1.00 0.00 O ATOM 0 H ASP A 54 20.518 7.133 1.335 1.00 0.00 H new ATOM 0 HA ASP A 54 20.348 4.649 2.479 1.00 0.00 H new ATOM 0 HB2 ASP A 54 22.224 6.404 2.568 1.00 0.00 H new ATOM 0 HB3 ASP A 54 21.378 7.101 3.935 1.00 0.00 H new ATOM 892 N LYS A 55 18.512 6.872 4.043 1.00 0.00 N ATOM 893 CA LYS A 55 17.437 7.033 4.999 1.00 0.00 C ATOM 894 C LYS A 55 16.159 6.469 4.399 1.00 0.00 C ATOM 895 O LYS A 55 15.364 5.842 5.093 1.00 0.00 O ATOM 896 CB LYS A 55 17.249 8.505 5.369 1.00 0.00 C ATOM 897 CG LYS A 55 17.350 8.774 6.862 1.00 0.00 C ATOM 898 CD LYS A 55 17.556 10.253 7.150 1.00 0.00 C ATOM 899 CE LYS A 55 18.621 10.472 8.211 1.00 0.00 C ATOM 900 NZ LYS A 55 18.485 11.801 8.869 1.00 0.00 N ATOM 0 H LYS A 55 18.738 7.715 3.515 1.00 0.00 H new ATOM 0 HA LYS A 55 17.685 6.493 5.913 1.00 0.00 H new ATOM 0 HB2 LYS A 55 18.000 9.101 4.849 1.00 0.00 H new ATOM 0 HB3 LYS A 55 16.274 8.839 5.013 1.00 0.00 H new ATOM 0 HG2 LYS A 55 16.442 8.429 7.357 1.00 0.00 H new ATOM 0 HG3 LYS A 55 18.178 8.202 7.280 1.00 0.00 H new ATOM 0 HD2 LYS A 55 17.844 10.766 6.233 1.00 0.00 H new ATOM 0 HD3 LYS A 55 16.616 10.695 7.480 1.00 0.00 H new ATOM 0 HE2 LYS A 55 18.551 9.686 8.963 1.00 0.00 H new ATOM 0 HE3 LYS A 55 19.608 10.391 7.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 19.230 11.911 9.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 18.577 12.552 8.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.553 11.869 9.325 1.00 0.00 H new ATOM 914 N VAL A 56 15.985 6.674 3.089 1.00 0.00 N ATOM 915 CA VAL A 56 14.816 6.159 2.383 1.00 0.00 C ATOM 916 C VAL A 56 14.694 4.660 2.620 1.00 0.00 C ATOM 917 O VAL A 56 13.666 4.180 3.098 1.00 0.00 O ATOM 918 CB VAL A 56 14.891 6.433 0.864 1.00 0.00 C ATOM 919 CG1 VAL A 56 13.790 5.686 0.121 1.00 0.00 C ATOM 920 CG2 VAL A 56 14.807 7.925 0.579 1.00 0.00 C ATOM 0 H VAL A 56 16.639 7.192 2.501 1.00 0.00 H new ATOM 0 HA VAL A 56 13.940 6.676 2.774 1.00 0.00 H new ATOM 0 HB VAL A 56 15.853 6.068 0.505 1.00 0.00 H new ATOM 0 HG11 VAL A 56 13.864 5.895 -0.946 1.00 0.00 H new ATOM 0 HG12 VAL A 56 13.900 4.615 0.289 1.00 0.00 H new ATOM 0 HG13 VAL A 56 12.817 6.013 0.488 1.00 0.00 H new ATOM 0 HG21 VAL A 56 14.862 8.094 -0.496 1.00 0.00 H new ATOM 0 HG22 VAL A 56 13.863 8.316 0.960 1.00 0.00 H new ATOM 0 HG23 VAL A 56 15.636 8.436 1.069 1.00 0.00 H new ATOM 930 N MET A 57 15.763 3.923 2.313 1.00 0.00 N ATOM 931 CA MET A 57 15.770 2.485 2.532 1.00 0.00 C ATOM 932 C MET A 57 15.480 2.210 4.004 1.00 0.00 C ATOM 933 O MET A 57 14.789 1.251 4.353 1.00 0.00 O ATOM 934 CB MET A 57 17.125 1.897 2.103 1.00 0.00 C ATOM 935 CG MET A 57 17.727 0.895 3.080 1.00 0.00 C ATOM 936 SD MET A 57 18.656 -0.407 2.249 1.00 0.00 S ATOM 937 CE MET A 57 17.361 -1.158 1.270 1.00 0.00 C ATOM 0 H MET A 57 16.625 4.298 1.916 1.00 0.00 H new ATOM 0 HA MET A 57 14.998 2.006 1.930 1.00 0.00 H new ATOM 0 HB2 MET A 57 17.004 1.411 1.135 1.00 0.00 H new ATOM 0 HB3 MET A 57 17.832 2.715 1.962 1.00 0.00 H new ATOM 0 HG2 MET A 57 18.384 1.419 3.774 1.00 0.00 H new ATOM 0 HG3 MET A 57 16.930 0.446 3.673 1.00 0.00 H new ATOM 0 HE1 MET A 57 17.765 -1.462 0.304 1.00 0.00 H new ATOM 0 HE2 MET A 57 16.971 -2.032 1.792 1.00 0.00 H new ATOM 0 HE3 MET A 57 16.557 -0.438 1.116 1.00 0.00 H new ATOM 947 N GLU A 58 16.005 3.083 4.856 1.00 0.00 N ATOM 948 CA GLU A 58 15.805 2.979 6.293 1.00 0.00 C ATOM 949 C GLU A 58 14.342 3.239 6.639 1.00 0.00 C ATOM 950 O GLU A 58 13.781 2.610 7.537 1.00 0.00 O ATOM 951 CB GLU A 58 16.708 3.981 7.020 1.00 0.00 C ATOM 952 CG GLU A 58 17.782 3.325 7.874 1.00 0.00 C ATOM 953 CD GLU A 58 17.574 3.559 9.357 1.00 0.00 C ATOM 954 OE1 GLU A 58 17.221 4.696 9.736 1.00 0.00 O ATOM 955 OE2 GLU A 58 17.764 2.605 10.142 1.00 0.00 O ATOM 0 H GLU A 58 16.578 3.877 4.571 1.00 0.00 H new ATOM 0 HA GLU A 58 16.066 1.971 6.616 1.00 0.00 H new ATOM 0 HB2 GLU A 58 17.186 4.627 6.284 1.00 0.00 H new ATOM 0 HB3 GLU A 58 16.092 4.620 7.653 1.00 0.00 H new ATOM 0 HG2 GLU A 58 17.792 2.253 7.677 1.00 0.00 H new ATOM 0 HG3 GLU A 58 18.759 3.712 7.583 1.00 0.00 H new ATOM 962 N THR A 59 13.729 4.167 5.908 1.00 0.00 N ATOM 963 CA THR A 59 12.328 4.512 6.116 1.00 0.00 C ATOM 964 C THR A 59 11.437 3.306 5.825 1.00 0.00 C ATOM 965 O THR A 59 10.320 3.209 6.331 1.00 0.00 O ATOM 966 CB THR A 59 11.934 5.689 5.216 1.00 0.00 C ATOM 967 OG1 THR A 59 13.070 6.438 4.839 1.00 0.00 O ATOM 968 CG2 THR A 59 10.956 6.648 5.861 1.00 0.00 C ATOM 0 H THR A 59 14.184 4.695 5.163 1.00 0.00 H new ATOM 0 HA THR A 59 12.191 4.804 7.157 1.00 0.00 H new ATOM 0 HB THR A 59 11.453 5.230 4.352 1.00 0.00 H new ATOM 0 HG1 THR A 59 13.772 6.329 5.514 1.00 0.00 H new ATOM 0 HG21 THR A 59 10.724 7.454 5.165 1.00 0.00 H new ATOM 0 HG22 THR A 59 10.040 6.116 6.118 1.00 0.00 H new ATOM 0 HG23 THR A 59 11.399 7.066 6.765 1.00 0.00 H new ATOM 976 N LEU A 60 11.947 2.389 5.005 1.00 0.00 N ATOM 977 CA LEU A 60 11.211 1.185 4.643 1.00 0.00 C ATOM 978 C LEU A 60 11.492 0.060 5.635 1.00 0.00 C ATOM 979 O LEU A 60 10.646 -0.802 5.868 1.00 0.00 O ATOM 980 CB LEU A 60 11.596 0.735 3.232 1.00 0.00 C ATOM 981 CG LEU A 60 10.760 1.345 2.103 1.00 0.00 C ATOM 982 CD1 LEU A 60 11.571 2.372 1.329 1.00 0.00 C ATOM 983 CD2 LEU A 60 10.251 0.255 1.172 1.00 0.00 C ATOM 0 H LEU A 60 12.871 2.460 4.579 1.00 0.00 H new ATOM 0 HA LEU A 60 10.146 1.417 4.670 1.00 0.00 H new ATOM 0 HB2 LEU A 60 12.644 0.983 3.062 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.513 -0.351 3.179 1.00 0.00 H new ATOM 0 HG LEU A 60 9.902 1.851 2.545 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.959 2.793 0.532 1.00 0.00 H new ATOM 0 HD12 LEU A 60 11.888 3.168 2.003 1.00 0.00 H new ATOM 0 HD13 LEU A 60 12.449 1.892 0.897 1.00 0.00 H new ATOM 0 HD21 LEU A 60 9.659 0.705 0.375 1.00 0.00 H new ATOM 0 HD22 LEU A 60 11.097 -0.278 0.739 1.00 0.00 H new ATOM 0 HD23 LEU A 60 9.632 -0.444 1.734 1.00 0.00 H new ATOM 995 N ASP A 61 12.692 0.075 6.214 1.00 0.00 N ATOM 996 CA ASP A 61 13.095 -0.943 7.179 1.00 0.00 C ATOM 997 C ASP A 61 12.032 -1.138 8.258 1.00 0.00 C ATOM 998 O ASP A 61 11.937 -0.350 9.199 1.00 0.00 O ATOM 999 CB ASP A 61 14.428 -0.563 7.827 1.00 0.00 C ATOM 1000 CG ASP A 61 15.619 -1.093 7.053 1.00 0.00 C ATOM 1001 OD1 ASP A 61 15.591 -1.037 5.806 1.00 0.00 O ATOM 1002 OD2 ASP A 61 16.582 -1.564 7.696 1.00 0.00 O ATOM 0 H ASP A 61 13.402 0.783 6.030 1.00 0.00 H new ATOM 0 HA ASP A 61 13.211 -1.883 6.640 1.00 0.00 H new ATOM 0 HB2 ASP A 61 14.498 0.522 7.898 1.00 0.00 H new ATOM 0 HB3 ASP A 61 14.458 -0.951 8.845 1.00 0.00 H new ATOM 1007 N ASN A 62 11.239 -2.194 8.113 1.00 0.00 N ATOM 1008 CA ASN A 62 10.185 -2.497 9.074 1.00 0.00 C ATOM 1009 C ASN A 62 10.376 -3.894 9.655 1.00 0.00 C ATOM 1010 O ASN A 62 10.166 -4.118 10.848 1.00 0.00 O ATOM 1011 CB ASN A 62 8.812 -2.388 8.410 1.00 0.00 C ATOM 1012 CG ASN A 62 7.729 -1.965 9.383 1.00 0.00 C ATOM 1013 OD1 ASN A 62 6.708 -2.638 9.524 1.00 0.00 O ATOM 1014 ND2 ASN A 62 7.946 -0.843 10.059 1.00 0.00 N ATOM 0 H ASN A 62 11.306 -2.855 7.339 1.00 0.00 H new ATOM 0 HA ASN A 62 10.242 -1.771 9.885 1.00 0.00 H new ATOM 0 HB2 ASN A 62 8.863 -1.668 7.593 1.00 0.00 H new ATOM 0 HB3 ASN A 62 8.547 -3.350 7.971 1.00 0.00 H new ATOM 0 HD21 ASN A 62 7.252 -0.508 10.727 1.00 0.00 H new ATOM 0 HD22 ASN A 62 8.807 -0.317 9.911 1.00 0.00 H new ATOM 1021 N ASP A 63 10.779 -4.828 8.801 1.00 0.00 N ATOM 1022 CA ASP A 63 11.006 -6.205 9.218 1.00 0.00 C ATOM 1023 C ASP A 63 11.639 -7.008 8.085 1.00 0.00 C ATOM 1024 O ASP A 63 11.267 -8.153 7.835 1.00 0.00 O ATOM 1025 CB ASP A 63 9.687 -6.851 9.656 1.00 0.00 C ATOM 1026 CG ASP A 63 9.727 -7.329 11.095 1.00 0.00 C ATOM 1027 OD1 ASP A 63 10.761 -7.897 11.503 1.00 0.00 O ATOM 1028 OD2 ASP A 63 8.724 -7.135 11.813 1.00 0.00 O ATOM 0 H ASP A 63 10.956 -4.655 7.812 1.00 0.00 H new ATOM 0 HA ASP A 63 11.692 -6.202 10.065 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.876 -6.132 9.537 1.00 0.00 H new ATOM 0 HB3 ASP A 63 9.464 -7.694 9.002 1.00 0.00 H new ATOM 1033 N GLY A 64 12.602 -6.394 7.402 1.00 0.00 N ATOM 1034 CA GLY A 64 13.274 -7.063 6.304 1.00 0.00 C ATOM 1035 C GLY A 64 14.636 -7.604 6.695 1.00 0.00 C ATOM 1036 O GLY A 64 15.375 -8.109 5.851 1.00 0.00 O ATOM 0 H GLY A 64 12.928 -5.446 7.590 1.00 0.00 H new ATOM 0 HA2 GLY A 64 12.651 -7.883 5.947 1.00 0.00 H new ATOM 0 HA3 GLY A 64 13.389 -6.365 5.474 1.00 0.00 H new ATOM 1040 N ASP A 65 14.969 -7.497 7.977 1.00 0.00 N ATOM 1041 CA ASP A 65 16.254 -7.977 8.478 1.00 0.00 C ATOM 1042 C ASP A 65 17.390 -7.074 8.012 1.00 0.00 C ATOM 1043 O ASP A 65 18.542 -7.500 7.935 1.00 0.00 O ATOM 1044 CB ASP A 65 16.508 -9.417 8.021 1.00 0.00 C ATOM 1045 CG ASP A 65 17.245 -10.232 9.065 1.00 0.00 C ATOM 1046 OD1 ASP A 65 18.148 -9.676 9.725 1.00 0.00 O ATOM 1047 OD2 ASP A 65 16.920 -11.428 9.222 1.00 0.00 O ATOM 0 H ASP A 65 14.368 -7.082 8.689 1.00 0.00 H new ATOM 0 HA ASP A 65 16.218 -7.955 9.567 1.00 0.00 H new ATOM 0 HB2 ASP A 65 15.556 -9.897 7.795 1.00 0.00 H new ATOM 0 HB3 ASP A 65 17.087 -9.406 7.097 1.00 0.00 H new ATOM 1052 N GLY A 66 17.057 -5.824 7.706 1.00 0.00 N ATOM 1053 CA GLY A 66 18.061 -4.881 7.257 1.00 0.00 C ATOM 1054 C GLY A 66 17.759 -4.311 5.886 1.00 0.00 C ATOM 1055 O GLY A 66 18.066 -3.151 5.612 1.00 0.00 O ATOM 0 H GLY A 66 16.110 -5.449 7.761 1.00 0.00 H new ATOM 0 HA2 GLY A 66 18.135 -4.065 7.976 1.00 0.00 H new ATOM 0 HA3 GLY A 66 19.032 -5.375 7.234 1.00 0.00 H new ATOM 1059 N GLU A 67 17.154 -5.120 5.022 1.00 0.00 N ATOM 1060 CA GLU A 67 16.816 -4.679 3.682 1.00 0.00 C ATOM 1061 C GLU A 67 15.324 -4.429 3.564 1.00 0.00 C ATOM 1062 O GLU A 67 14.583 -4.548 4.541 1.00 0.00 O ATOM 1063 CB GLU A 67 17.259 -5.713 2.650 1.00 0.00 C ATOM 1064 CG GLU A 67 18.467 -5.273 1.849 1.00 0.00 C ATOM 1065 CD GLU A 67 19.752 -5.923 2.322 1.00 0.00 C ATOM 1066 OE1 GLU A 67 19.968 -7.113 2.006 1.00 0.00 O ATOM 1067 OE2 GLU A 67 20.543 -5.243 3.008 1.00 0.00 O ATOM 0 H GLU A 67 16.890 -6.083 5.230 1.00 0.00 H new ATOM 0 HA GLU A 67 17.342 -3.745 3.488 1.00 0.00 H new ATOM 0 HB2 GLU A 67 17.489 -6.649 3.158 1.00 0.00 H new ATOM 0 HB3 GLU A 67 16.432 -5.915 1.969 1.00 0.00 H new ATOM 0 HG2 GLU A 67 18.308 -5.514 0.798 1.00 0.00 H new ATOM 0 HG3 GLU A 67 18.567 -4.190 1.916 1.00 0.00 H new ATOM 1074 N CYS A 68 14.886 -4.078 2.366 1.00 0.00 N ATOM 1075 CA CYS A 68 13.474 -3.806 2.131 1.00 0.00 C ATOM 1076 C CYS A 68 12.860 -4.819 1.180 1.00 0.00 C ATOM 1077 O CYS A 68 13.181 -4.839 0.001 1.00 0.00 O ATOM 1078 CB CYS A 68 13.286 -2.400 1.560 1.00 0.00 C ATOM 1079 SG CYS A 68 14.219 -1.118 2.428 1.00 0.00 S ATOM 0 H CYS A 68 15.482 -3.975 1.545 1.00 0.00 H new ATOM 0 HA CYS A 68 12.967 -3.882 3.093 1.00 0.00 H new ATOM 0 HB2 CYS A 68 13.583 -2.403 0.511 1.00 0.00 H new ATOM 0 HB3 CYS A 68 12.226 -2.146 1.590 1.00 0.00 H new ATOM 0 HG CYS A 68 14.167 -0.010 1.751 1.00 0.00 H new ATOM 1085 N ASP A 69 11.951 -5.638 1.687 1.00 0.00 N ATOM 1086 CA ASP A 69 11.277 -6.621 0.853 1.00 0.00 C ATOM 1087 C ASP A 69 9.891 -6.101 0.482 1.00 0.00 C ATOM 1088 O ASP A 69 9.556 -4.955 0.783 1.00 0.00 O ATOM 1089 CB ASP A 69 11.174 -7.981 1.551 1.00 0.00 C ATOM 1090 CG ASP A 69 11.041 -7.876 3.061 1.00 0.00 C ATOM 1091 OD1 ASP A 69 11.857 -7.166 3.685 1.00 0.00 O ATOM 1092 OD2 ASP A 69 10.121 -8.510 3.619 1.00 0.00 O ATOM 0 H ASP A 69 11.664 -5.642 2.666 1.00 0.00 H new ATOM 0 HA ASP A 69 11.867 -6.769 -0.052 1.00 0.00 H new ATOM 0 HB2 ASP A 69 10.314 -8.520 1.155 1.00 0.00 H new ATOM 0 HB3 ASP A 69 12.058 -8.572 1.312 1.00 0.00 H new ATOM 1097 N PHE A 70 9.087 -6.931 -0.170 1.00 0.00 N ATOM 1098 CA PHE A 70 7.744 -6.529 -0.572 1.00 0.00 C ATOM 1099 C PHE A 70 6.949 -5.980 0.609 1.00 0.00 C ATOM 1100 O PHE A 70 6.101 -5.098 0.452 1.00 0.00 O ATOM 1101 CB PHE A 70 7.002 -7.712 -1.186 1.00 0.00 C ATOM 1102 CG PHE A 70 5.703 -7.322 -1.822 1.00 0.00 C ATOM 1103 CD1 PHE A 70 5.693 -6.584 -2.989 1.00 0.00 C ATOM 1104 CD2 PHE A 70 4.498 -7.687 -1.249 1.00 0.00 C ATOM 1105 CE1 PHE A 70 4.501 -6.214 -3.579 1.00 0.00 C ATOM 1106 CE2 PHE A 70 3.301 -7.322 -1.833 1.00 0.00 C ATOM 1107 CZ PHE A 70 3.302 -6.584 -3.001 1.00 0.00 C ATOM 0 H PHE A 70 9.340 -7.884 -0.431 1.00 0.00 H new ATOM 0 HA PHE A 70 7.843 -5.737 -1.314 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.639 -8.185 -1.934 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.812 -8.456 -0.412 1.00 0.00 H new ATOM 0 HD1 PHE A 70 6.628 -6.293 -3.445 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.493 -8.263 -0.336 1.00 0.00 H new ATOM 0 HE1 PHE A 70 4.506 -5.636 -4.491 1.00 0.00 H new ATOM 0 HE2 PHE A 70 2.366 -7.613 -1.378 1.00 0.00 H new ATOM 0 HZ PHE A 70 2.368 -6.297 -3.461 1.00 0.00 H new ATOM 1117 N GLN A 71 7.226 -6.510 1.793 1.00 0.00 N ATOM 1118 CA GLN A 71 6.533 -6.076 3.002 1.00 0.00 C ATOM 1119 C GLN A 71 6.710 -4.576 3.221 1.00 0.00 C ATOM 1120 O GLN A 71 5.780 -3.881 3.635 1.00 0.00 O ATOM 1121 CB GLN A 71 7.044 -6.855 4.221 1.00 0.00 C ATOM 1122 CG GLN A 71 8.383 -6.367 4.753 1.00 0.00 C ATOM 1123 CD GLN A 71 8.779 -7.052 6.047 1.00 0.00 C ATOM 1124 OE1 GLN A 71 8.828 -6.423 7.104 1.00 0.00 O ATOM 1125 NE2 GLN A 71 9.064 -8.345 5.970 1.00 0.00 N ATOM 0 H GLN A 71 7.923 -7.239 1.944 1.00 0.00 H new ATOM 0 HA GLN A 71 5.470 -6.281 2.876 1.00 0.00 H new ATOM 0 HB2 GLN A 71 6.303 -6.789 5.018 1.00 0.00 H new ATOM 0 HB3 GLN A 71 7.133 -7.908 3.955 1.00 0.00 H new ATOM 0 HG2 GLN A 71 9.154 -6.542 4.003 1.00 0.00 H new ATOM 0 HG3 GLN A 71 8.335 -5.290 4.916 1.00 0.00 H new ATOM 0 HE21 GLN A 71 9.010 -8.827 5.072 1.00 0.00 H new ATOM 0 HE22 GLN A 71 9.337 -8.858 6.808 1.00 0.00 H new ATOM 1134 N GLU A 72 7.910 -4.085 2.934 1.00 0.00 N ATOM 1135 CA GLU A 72 8.210 -2.669 3.094 1.00 0.00 C ATOM 1136 C GLU A 72 7.583 -1.860 1.968 1.00 0.00 C ATOM 1137 O GLU A 72 7.264 -0.683 2.139 1.00 0.00 O ATOM 1138 CB GLU A 72 9.721 -2.441 3.132 1.00 0.00 C ATOM 1139 CG GLU A 72 10.478 -3.482 3.941 1.00 0.00 C ATOM 1140 CD GLU A 72 10.031 -3.550 5.390 1.00 0.00 C ATOM 1141 OE1 GLU A 72 8.865 -3.206 5.673 1.00 0.00 O ATOM 1142 OE2 GLU A 72 10.850 -3.949 6.243 1.00 0.00 O ATOM 0 H GLU A 72 8.689 -4.646 2.590 1.00 0.00 H new ATOM 0 HA GLU A 72 7.785 -2.335 4.040 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.104 -2.438 2.112 1.00 0.00 H new ATOM 0 HB3 GLU A 72 9.920 -1.454 3.550 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.344 -4.460 3.479 1.00 0.00 H new ATOM 0 HG3 GLU A 72 11.544 -3.256 3.906 1.00 0.00 H new ATOM 1149 N PHE A 73 7.393 -2.503 0.818 1.00 0.00 N ATOM 1150 CA PHE A 73 6.781 -1.845 -0.333 1.00 0.00 C ATOM 1151 C PHE A 73 5.479 -1.186 0.084 1.00 0.00 C ATOM 1152 O PHE A 73 5.275 0.008 -0.124 1.00 0.00 O ATOM 1153 CB PHE A 73 6.515 -2.867 -1.443 1.00 0.00 C ATOM 1154 CG PHE A 73 7.123 -2.521 -2.775 1.00 0.00 C ATOM 1155 CD1 PHE A 73 7.348 -1.204 -3.147 1.00 0.00 C ATOM 1156 CD2 PHE A 73 7.460 -3.528 -3.661 1.00 0.00 C ATOM 1157 CE1 PHE A 73 7.902 -0.904 -4.378 1.00 0.00 C ATOM 1158 CE2 PHE A 73 8.012 -3.237 -4.891 1.00 0.00 C ATOM 1159 CZ PHE A 73 8.233 -1.922 -5.252 1.00 0.00 C ATOM 0 H PHE A 73 7.653 -3.476 0.659 1.00 0.00 H new ATOM 0 HA PHE A 73 7.463 -1.083 -0.710 1.00 0.00 H new ATOM 0 HB2 PHE A 73 6.898 -3.837 -1.125 1.00 0.00 H new ATOM 0 HB3 PHE A 73 5.438 -2.975 -1.568 1.00 0.00 H new ATOM 0 HD1 PHE A 73 7.088 -0.405 -2.469 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.288 -4.558 -3.386 1.00 0.00 H new ATOM 0 HE1 PHE A 73 8.076 0.125 -4.656 1.00 0.00 H new ATOM 0 HE2 PHE A 73 8.271 -4.036 -5.570 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.663 -1.690 -6.215 1.00 0.00 H new ATOM 1169 N MET A 74 4.607 -1.978 0.695 1.00 0.00 N ATOM 1170 CA MET A 74 3.328 -1.473 1.165 1.00 0.00 C ATOM 1171 C MET A 74 3.547 -0.391 2.211 1.00 0.00 C ATOM 1172 O MET A 74 3.029 0.717 2.086 1.00 0.00 O ATOM 1173 CB MET A 74 2.491 -2.610 1.746 1.00 0.00 C ATOM 1174 CG MET A 74 2.289 -3.763 0.780 1.00 0.00 C ATOM 1175 SD MET A 74 1.501 -3.245 -0.758 1.00 0.00 S ATOM 1176 CE MET A 74 1.141 -4.829 -1.508 1.00 0.00 C ATOM 0 H MET A 74 4.763 -2.970 0.875 1.00 0.00 H new ATOM 0 HA MET A 74 2.789 -1.042 0.321 1.00 0.00 H new ATOM 0 HB2 MET A 74 2.974 -2.983 2.649 1.00 0.00 H new ATOM 0 HB3 MET A 74 1.518 -2.220 2.043 1.00 0.00 H new ATOM 0 HG2 MET A 74 3.254 -4.218 0.555 1.00 0.00 H new ATOM 0 HG3 MET A 74 1.679 -4.530 1.257 1.00 0.00 H new ATOM 0 HE1 MET A 74 1.354 -4.783 -2.576 1.00 0.00 H new ATOM 0 HE2 MET A 74 1.760 -5.599 -1.047 1.00 0.00 H new ATOM 0 HE3 MET A 74 0.089 -5.072 -1.358 1.00 0.00 H new ATOM 1186 N ALA A 75 4.336 -0.712 3.234 1.00 0.00 N ATOM 1187 CA ALA A 75 4.640 0.244 4.292 1.00 0.00 C ATOM 1188 C ALA A 75 5.122 1.564 3.703 1.00 0.00 C ATOM 1189 O ALA A 75 4.776 2.641 4.188 1.00 0.00 O ATOM 1190 CB ALA A 75 5.691 -0.328 5.231 1.00 0.00 C ATOM 0 H ALA A 75 4.775 -1.625 3.351 1.00 0.00 H new ATOM 0 HA ALA A 75 3.727 0.433 4.857 1.00 0.00 H new ATOM 0 HB1 ALA A 75 5.909 0.395 6.017 1.00 0.00 H new ATOM 0 HB2 ALA A 75 5.316 -1.248 5.679 1.00 0.00 H new ATOM 0 HB3 ALA A 75 6.602 -0.542 4.671 1.00 0.00 H new ATOM 1196 N PHE A 76 5.918 1.469 2.644 1.00 0.00 N ATOM 1197 CA PHE A 76 6.449 2.647 1.974 1.00 0.00 C ATOM 1198 C PHE A 76 5.331 3.439 1.309 1.00 0.00 C ATOM 1199 O PHE A 76 4.954 4.512 1.777 1.00 0.00 O ATOM 1200 CB PHE A 76 7.479 2.237 0.927 1.00 0.00 C ATOM 1201 CG PHE A 76 8.239 3.390 0.346 1.00 0.00 C ATOM 1202 CD1 PHE A 76 9.149 4.097 1.114 1.00 0.00 C ATOM 1203 CD2 PHE A 76 8.041 3.765 -0.970 1.00 0.00 C ATOM 1204 CE1 PHE A 76 9.849 5.160 0.578 1.00 0.00 C ATOM 1205 CE2 PHE A 76 8.738 4.827 -1.514 1.00 0.00 C ATOM 1206 CZ PHE A 76 9.644 5.526 -0.739 1.00 0.00 C ATOM 0 H PHE A 76 6.210 0.583 2.231 1.00 0.00 H new ATOM 0 HA PHE A 76 6.928 3.278 2.723 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.184 1.539 1.378 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.973 1.704 0.122 1.00 0.00 H new ATOM 0 HD1 PHE A 76 9.313 3.814 2.143 1.00 0.00 H new ATOM 0 HD2 PHE A 76 7.334 3.222 -1.579 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.555 5.704 1.187 1.00 0.00 H new ATOM 0 HE2 PHE A 76 8.575 5.110 -2.543 1.00 0.00 H new ATOM 0 HZ PHE A 76 10.191 6.356 -1.161 1.00 0.00 H new ATOM 1216 N VAL A 77 4.803 2.901 0.212 1.00 0.00 N ATOM 1217 CA VAL A 77 3.723 3.562 -0.514 1.00 0.00 C ATOM 1218 C VAL A 77 2.568 3.917 0.418 1.00 0.00 C ATOM 1219 O VAL A 77 1.808 4.849 0.154 1.00 0.00 O ATOM 1220 CB VAL A 77 3.181 2.680 -1.655 1.00 0.00 C ATOM 1221 CG1 VAL A 77 4.049 2.818 -2.897 1.00 0.00 C ATOM 1222 CG2 VAL A 77 3.087 1.224 -1.217 1.00 0.00 C ATOM 0 H VAL A 77 5.104 2.014 -0.191 1.00 0.00 H new ATOM 0 HA VAL A 77 4.147 4.473 -0.936 1.00 0.00 H new ATOM 0 HB VAL A 77 2.176 3.022 -1.902 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.650 2.188 -3.692 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.052 3.857 -3.225 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.068 2.508 -2.665 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.702 0.621 -2.039 1.00 0.00 H new ATOM 0 HG22 VAL A 77 4.077 0.864 -0.935 1.00 0.00 H new ATOM 0 HG23 VAL A 77 2.415 1.144 -0.362 1.00 0.00 H new ATOM 1232 N ALA A 78 2.439 3.162 1.501 1.00 0.00 N ATOM 1233 CA ALA A 78 1.368 3.389 2.469 1.00 0.00 C ATOM 1234 C ALA A 78 1.707 4.516 3.439 1.00 0.00 C ATOM 1235 O ALA A 78 0.918 5.443 3.626 1.00 0.00 O ATOM 1236 CB ALA A 78 1.065 2.112 3.236 1.00 0.00 C ATOM 0 H ALA A 78 3.061 2.387 1.733 1.00 0.00 H new ATOM 0 HA ALA A 78 0.483 3.689 1.909 1.00 0.00 H new ATOM 0 HB1 ALA A 78 0.265 2.299 3.953 1.00 0.00 H new ATOM 0 HB2 ALA A 78 0.753 1.334 2.539 1.00 0.00 H new ATOM 0 HB3 ALA A 78 1.959 1.786 3.767 1.00 0.00 H new ATOM 1242 N MET A 79 2.880 4.435 4.058 1.00 0.00 N ATOM 1243 CA MET A 79 3.306 5.455 5.009 1.00 0.00 C ATOM 1244 C MET A 79 3.505 6.785 4.298 1.00 0.00 C ATOM 1245 O MET A 79 3.040 7.830 4.758 1.00 0.00 O ATOM 1246 CB MET A 79 4.600 5.028 5.705 1.00 0.00 C ATOM 1247 CG MET A 79 4.402 3.933 6.742 1.00 0.00 C ATOM 1248 SD MET A 79 5.881 3.638 7.729 1.00 0.00 S ATOM 1249 CE MET A 79 7.106 3.411 6.443 1.00 0.00 C ATOM 0 H MET A 79 3.549 3.678 3.919 1.00 0.00 H new ATOM 0 HA MET A 79 2.529 5.573 5.764 1.00 0.00 H new ATOM 0 HB2 MET A 79 5.309 4.681 4.954 1.00 0.00 H new ATOM 0 HB3 MET A 79 5.047 5.897 6.188 1.00 0.00 H new ATOM 0 HG2 MET A 79 3.578 4.207 7.401 1.00 0.00 H new ATOM 0 HG3 MET A 79 4.115 3.009 6.239 1.00 0.00 H new ATOM 0 HE1 MET A 79 8.003 2.963 6.870 1.00 0.00 H new ATOM 0 HE2 MET A 79 6.705 2.755 5.670 1.00 0.00 H new ATOM 0 HE3 MET A 79 7.357 4.377 6.005 1.00 0.00 H new ATOM 1259 N VAL A 80 4.189 6.731 3.164 1.00 0.00 N ATOM 1260 CA VAL A 80 4.448 7.917 2.364 1.00 0.00 C ATOM 1261 C VAL A 80 3.138 8.549 1.903 1.00 0.00 C ATOM 1262 O VAL A 80 3.022 9.772 1.803 1.00 0.00 O ATOM 1263 CB VAL A 80 5.318 7.564 1.139 1.00 0.00 C ATOM 1264 CG1 VAL A 80 5.418 8.738 0.174 1.00 0.00 C ATOM 1265 CG2 VAL A 80 6.701 7.113 1.584 1.00 0.00 C ATOM 0 H VAL A 80 4.577 5.871 2.776 1.00 0.00 H new ATOM 0 HA VAL A 80 4.986 8.634 2.984 1.00 0.00 H new ATOM 0 HB VAL A 80 4.837 6.742 0.610 1.00 0.00 H new ATOM 0 HG11 VAL A 80 6.037 8.457 -0.678 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.421 9.008 -0.175 1.00 0.00 H new ATOM 0 HG13 VAL A 80 5.867 9.591 0.684 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.303 6.868 0.709 1.00 0.00 H new ATOM 0 HG22 VAL A 80 7.183 7.915 2.142 1.00 0.00 H new ATOM 0 HG23 VAL A 80 6.609 6.232 2.220 1.00 0.00 H new ATOM 1275 N THR A 81 2.155 7.700 1.625 1.00 0.00 N ATOM 1276 CA THR A 81 0.848 8.157 1.172 1.00 0.00 C ATOM 1277 C THR A 81 0.075 8.824 2.308 1.00 0.00 C ATOM 1278 O THR A 81 -0.341 9.978 2.197 1.00 0.00 O ATOM 1279 CB THR A 81 0.055 6.967 0.605 1.00 0.00 C ATOM 1280 OG1 THR A 81 0.433 6.713 -0.736 1.00 0.00 O ATOM 1281 CG2 THR A 81 -1.454 7.146 0.623 1.00 0.00 C ATOM 0 H THR A 81 2.240 6.687 1.706 1.00 0.00 H new ATOM 0 HA THR A 81 0.990 8.901 0.388 1.00 0.00 H new ATOM 0 HB THR A 81 0.301 6.136 1.266 1.00 0.00 H new ATOM 0 HG1 THR A 81 0.944 5.878 -0.779 1.00 0.00 H new ATOM 0 HG21 THR A 81 -1.931 6.259 0.205 1.00 0.00 H new ATOM 0 HG22 THR A 81 -1.791 7.290 1.650 1.00 0.00 H new ATOM 0 HG23 THR A 81 -1.724 8.018 0.027 1.00 0.00 H new ATOM 1289 N THR A 82 -0.130 8.079 3.389 1.00 0.00 N ATOM 1290 CA THR A 82 -0.875 8.573 4.544 1.00 0.00 C ATOM 1291 C THR A 82 -0.414 9.956 4.987 1.00 0.00 C ATOM 1292 O THR A 82 -1.182 10.703 5.593 1.00 0.00 O ATOM 1293 CB THR A 82 -0.760 7.591 5.710 1.00 0.00 C ATOM 1294 OG1 THR A 82 0.594 7.257 5.953 1.00 0.00 O ATOM 1295 CG2 THR A 82 -1.517 6.300 5.482 1.00 0.00 C ATOM 0 H THR A 82 0.212 7.123 3.490 1.00 0.00 H new ATOM 0 HA THR A 82 -1.917 8.659 4.236 1.00 0.00 H new ATOM 0 HB THR A 82 -1.199 8.105 6.565 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.172 7.788 5.367 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.394 5.648 6.347 1.00 0.00 H new ATOM 0 HG22 THR A 82 -2.575 6.519 5.341 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.128 5.802 4.594 1.00 0.00 H new ATOM 1303 N ALA A 83 0.833 10.300 4.700 1.00 0.00 N ATOM 1304 CA ALA A 83 1.352 11.601 5.094 1.00 0.00 C ATOM 1305 C ALA A 83 0.942 12.689 4.109 1.00 0.00 C ATOM 1306 O ALA A 83 0.110 13.540 4.422 1.00 0.00 O ATOM 1307 CB ALA A 83 2.865 11.566 5.227 1.00 0.00 C ATOM 0 H ALA A 83 1.496 9.706 4.203 1.00 0.00 H new ATOM 0 HA ALA A 83 0.919 11.839 6.065 1.00 0.00 H new ATOM 0 HB1 ALA A 83 3.227 12.551 5.522 1.00 0.00 H new ATOM 0 HB2 ALA A 83 3.147 10.834 5.984 1.00 0.00 H new ATOM 0 HB3 ALA A 83 3.308 11.288 4.271 1.00 0.00 H new ATOM 1313 N CYS A 84 1.547 12.667 2.928 1.00 0.00 N ATOM 1314 CA CYS A 84 1.257 13.670 1.908 1.00 0.00 C ATOM 1315 C CYS A 84 0.098 13.270 1.007 1.00 0.00 C ATOM 1316 O CYS A 84 -0.844 14.040 0.822 1.00 0.00 O ATOM 1317 CB CYS A 84 2.502 13.968 1.068 1.00 0.00 C ATOM 1318 SG CYS A 84 3.335 12.500 0.418 1.00 0.00 S ATOM 0 H CYS A 84 2.239 11.970 2.652 1.00 0.00 H new ATOM 0 HA CYS A 84 0.958 14.575 2.437 1.00 0.00 H new ATOM 0 HB2 CYS A 84 2.217 14.608 0.233 1.00 0.00 H new ATOM 0 HB3 CYS A 84 3.209 14.532 1.676 1.00 0.00 H new ATOM 0 HG CYS A 84 2.940 11.450 1.075 1.00 0.00 H new ATOM 1324 N HIS A 85 0.160 12.069 0.441 1.00 0.00 N ATOM 1325 CA HIS A 85 -0.902 11.603 -0.443 1.00 0.00 C ATOM 1326 C HIS A 85 -2.263 11.713 0.239 1.00 0.00 C ATOM 1327 O HIS A 85 -3.302 11.695 -0.421 1.00 0.00 O ATOM 1328 CB HIS A 85 -0.643 10.165 -0.887 1.00 0.00 C ATOM 1329 CG HIS A 85 -1.367 9.788 -2.141 1.00 0.00 C ATOM 1330 ND1 HIS A 85 -0.720 9.432 -3.307 1.00 0.00 N ATOM 1331 CD2 HIS A 85 -2.692 9.712 -2.411 1.00 0.00 C ATOM 1332 CE1 HIS A 85 -1.616 9.156 -4.239 1.00 0.00 C ATOM 1333 NE2 HIS A 85 -2.819 9.318 -3.720 1.00 0.00 N ATOM 0 H HIS A 85 0.925 11.408 0.576 1.00 0.00 H new ATOM 0 HA HIS A 85 -0.909 12.241 -1.327 1.00 0.00 H new ATOM 0 HB2 HIS A 85 0.427 10.027 -1.040 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -0.941 9.487 -0.087 1.00 0.00 H new ATOM 0 HD1 HIS A 85 0.292 9.389 -3.430 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -3.499 9.922 -1.724 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -1.401 8.850 -5.252 1.00 0.00 H new ATOM 1342 N GLU A 86 -2.247 11.833 1.566 1.00 0.00 N ATOM 1343 CA GLU A 86 -3.469 11.953 2.348 1.00 0.00 C ATOM 1344 C GLU A 86 -4.442 12.938 1.710 1.00 0.00 C ATOM 1345 O GLU A 86 -5.528 12.560 1.271 1.00 0.00 O ATOM 1346 CB GLU A 86 -3.124 12.408 3.768 1.00 0.00 C ATOM 1347 CG GLU A 86 -3.663 11.486 4.850 1.00 0.00 C ATOM 1348 CD GLU A 86 -5.159 11.634 5.048 1.00 0.00 C ATOM 1349 OE1 GLU A 86 -5.594 12.715 5.499 1.00 0.00 O ATOM 1350 OE2 GLU A 86 -5.895 10.671 4.751 1.00 0.00 O ATOM 0 H GLU A 86 -1.392 11.849 2.122 1.00 0.00 H new ATOM 0 HA GLU A 86 -3.953 10.977 2.380 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -2.040 12.475 3.866 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.521 13.411 3.926 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.435 10.453 4.589 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -3.153 11.697 5.790 1.00 0.00 H new ATOM 1357 N PHE A 87 -4.036 14.196 1.651 1.00 0.00 N ATOM 1358 CA PHE A 87 -4.859 15.238 1.056 1.00 0.00 C ATOM 1359 C PHE A 87 -4.112 15.905 -0.091 1.00 0.00 C ATOM 1360 O PHE A 87 -4.722 16.392 -1.044 1.00 0.00 O ATOM 1361 CB PHE A 87 -5.264 16.274 2.109 1.00 0.00 C ATOM 1362 CG PHE A 87 -6.753 16.467 2.222 1.00 0.00 C ATOM 1363 CD1 PHE A 87 -7.617 15.383 2.148 1.00 0.00 C ATOM 1364 CD2 PHE A 87 -7.286 17.733 2.401 1.00 0.00 C ATOM 1365 CE1 PHE A 87 -8.984 15.563 2.252 1.00 0.00 C ATOM 1366 CE2 PHE A 87 -8.652 17.917 2.504 1.00 0.00 C ATOM 1367 CZ PHE A 87 -9.501 16.831 2.431 1.00 0.00 C ATOM 0 H PHE A 87 -3.138 14.522 2.009 1.00 0.00 H new ATOM 0 HA PHE A 87 -5.767 14.781 0.663 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.871 15.967 3.078 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -4.800 17.229 1.864 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -7.218 14.389 2.008 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.627 18.586 2.461 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -9.647 14.712 2.193 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -9.055 18.910 2.641 1.00 0.00 H new ATOM 0 HZ PHE A 87 -10.568 16.973 2.514 1.00 0.00 H new ATOM 1377 N PHE A 88 -2.783 15.910 -0.003 1.00 0.00 N ATOM 1378 CA PHE A 88 -1.957 16.499 -1.044 1.00 0.00 C ATOM 1379 C PHE A 88 -1.869 15.565 -2.249 1.00 0.00 C ATOM 1380 O PHE A 88 -1.554 16.001 -3.355 1.00 0.00 O ATOM 1381 CB PHE A 88 -0.553 16.808 -0.511 1.00 0.00 C ATOM 1382 CG PHE A 88 -0.496 18.048 0.335 1.00 0.00 C ATOM 1383 CD1 PHE A 88 -0.859 18.009 1.672 1.00 0.00 C ATOM 1384 CD2 PHE A 88 -0.080 19.254 -0.209 1.00 0.00 C ATOM 1385 CE1 PHE A 88 -0.808 19.150 2.451 1.00 0.00 C ATOM 1386 CE2 PHE A 88 -0.029 20.397 0.565 1.00 0.00 C ATOM 1387 CZ PHE A 88 -0.392 20.345 1.897 1.00 0.00 C ATOM 0 H PHE A 88 -2.261 15.513 0.778 1.00 0.00 H new ATOM 0 HA PHE A 88 -2.421 17.434 -1.359 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -0.200 15.960 0.076 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.131 16.919 -1.353 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -1.185 17.077 2.110 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.207 19.300 -1.249 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -1.093 19.107 3.492 1.00 0.00 H new ATOM 0 HE2 PHE A 88 0.294 21.331 0.129 1.00 0.00 H new ATOM 0 HZ PHE A 88 -0.351 21.237 2.504 1.00 0.00 H new ATOM 1447 N SER B 1 7.443 2.765 -14.687 1.00 0.00 N ATOM 1448 CA SER B 1 7.127 3.242 -13.316 1.00 0.00 C ATOM 1449 C SER B 1 5.819 2.641 -12.810 1.00 0.00 C ATOM 1450 O SER B 1 4.825 3.347 -12.637 1.00 0.00 O ATOM 1451 CB SER B 1 7.034 4.769 -13.341 1.00 0.00 C ATOM 1452 OG SER B 1 6.023 5.203 -14.233 1.00 0.00 O ATOM 0 H1 SER B 1 8.475 2.739 -14.816 1.00 0.00 H new ATOM 0 H2 SER B 1 7.053 1.810 -14.821 1.00 0.00 H new ATOM 0 H3 SER B 1 7.023 3.411 -15.385 1.00 0.00 H new ATOM 0 HA SER B 1 7.917 2.925 -12.635 1.00 0.00 H new ATOM 0 HB2 SER B 1 6.823 5.140 -12.338 1.00 0.00 H new ATOM 0 HB3 SER B 1 7.994 5.190 -13.641 1.00 0.00 H new ATOM 0 HG SER B 1 5.159 4.838 -13.950 1.00 0.00 H new ATOM 1460 N GLU B 2 5.827 1.333 -12.573 1.00 0.00 N ATOM 1461 CA GLU B 2 4.641 0.637 -12.087 1.00 0.00 C ATOM 1462 C GLU B 2 4.187 1.203 -10.745 1.00 0.00 C ATOM 1463 O GLU B 2 3.017 1.091 -10.376 1.00 0.00 O ATOM 1464 CB GLU B 2 4.921 -0.862 -11.956 1.00 0.00 C ATOM 1465 CG GLU B 2 4.551 -1.659 -13.196 1.00 0.00 C ATOM 1466 CD GLU B 2 4.695 -3.155 -12.991 1.00 0.00 C ATOM 1467 OE1 GLU B 2 5.845 -3.645 -12.979 1.00 0.00 O ATOM 1468 OE2 GLU B 2 3.659 -3.835 -12.843 1.00 0.00 O ATOM 0 H GLU B 2 6.641 0.734 -12.710 1.00 0.00 H new ATOM 0 HA GLU B 2 3.840 0.787 -12.811 1.00 0.00 H new ATOM 0 HB2 GLU B 2 5.980 -1.008 -11.742 1.00 0.00 H new ATOM 0 HB3 GLU B 2 4.367 -1.254 -11.103 1.00 0.00 H new ATOM 0 HG2 GLU B 2 3.523 -1.432 -13.476 1.00 0.00 H new ATOM 0 HG3 GLU B 2 5.184 -1.347 -14.027 1.00 0.00 H new ATOM 1475 N LEU B 3 5.119 1.809 -10.018 1.00 0.00 N ATOM 1476 CA LEU B 3 4.815 2.394 -8.717 1.00 0.00 C ATOM 1477 C LEU B 3 3.749 3.477 -8.844 1.00 0.00 C ATOM 1478 O LEU B 3 2.819 3.543 -8.041 1.00 0.00 O ATOM 1479 CB LEU B 3 6.083 2.978 -8.089 1.00 0.00 C ATOM 1480 CG LEU B 3 6.825 2.039 -7.133 1.00 0.00 C ATOM 1481 CD1 LEU B 3 8.235 1.763 -7.635 1.00 0.00 C ATOM 1482 CD2 LEU B 3 6.862 2.627 -5.729 1.00 0.00 C ATOM 0 H LEU B 3 6.092 1.908 -10.308 1.00 0.00 H new ATOM 0 HA LEU B 3 4.429 1.605 -8.071 1.00 0.00 H new ATOM 0 HB2 LEU B 3 6.764 3.271 -8.888 1.00 0.00 H new ATOM 0 HB3 LEU B 3 5.817 3.886 -7.548 1.00 0.00 H new ATOM 0 HG LEU B 3 6.285 1.093 -7.096 1.00 0.00 H new ATOM 0 HD11 LEU B 3 8.744 1.094 -6.941 1.00 0.00 H new ATOM 0 HD12 LEU B 3 8.186 1.296 -8.619 1.00 0.00 H new ATOM 0 HD13 LEU B 3 8.786 2.701 -7.705 1.00 0.00 H new ATOM 0 HD21 LEU B 3 7.393 1.946 -5.063 1.00 0.00 H new ATOM 0 HD22 LEU B 3 7.376 3.588 -5.750 1.00 0.00 H new ATOM 0 HD23 LEU B 3 5.844 2.768 -5.367 1.00 0.00 H new ATOM 1494 N GLU B 4 3.891 4.323 -9.859 1.00 0.00 N ATOM 1495 CA GLU B 4 2.940 5.404 -10.091 1.00 0.00 C ATOM 1496 C GLU B 4 1.625 4.865 -10.644 1.00 0.00 C ATOM 1497 O GLU B 4 0.554 5.396 -10.355 1.00 0.00 O ATOM 1498 CB GLU B 4 3.531 6.432 -11.058 1.00 0.00 C ATOM 1499 CG GLU B 4 4.248 7.578 -10.364 1.00 0.00 C ATOM 1500 CD GLU B 4 5.640 7.199 -9.897 1.00 0.00 C ATOM 1501 OE1 GLU B 4 5.769 6.187 -9.176 1.00 0.00 O ATOM 1502 OE2 GLU B 4 6.600 7.914 -10.252 1.00 0.00 O ATOM 0 H GLU B 4 4.655 4.281 -10.534 1.00 0.00 H new ATOM 0 HA GLU B 4 2.739 5.888 -9.135 1.00 0.00 H new ATOM 0 HB2 GLU B 4 4.229 5.929 -11.727 1.00 0.00 H new ATOM 0 HB3 GLU B 4 2.731 6.837 -11.678 1.00 0.00 H new ATOM 0 HG2 GLU B 4 4.316 8.425 -11.046 1.00 0.00 H new ATOM 0 HG3 GLU B 4 3.658 7.905 -9.508 1.00 0.00 H new ATOM 1509 N LYS B 5 1.714 3.804 -11.441 1.00 0.00 N ATOM 1510 CA LYS B 5 0.530 3.192 -12.033 1.00 0.00 C ATOM 1511 C LYS B 5 -0.333 2.533 -10.963 1.00 0.00 C ATOM 1512 O LYS B 5 -1.518 2.842 -10.831 1.00 0.00 O ATOM 1513 CB LYS B 5 0.936 2.158 -13.085 1.00 0.00 C ATOM 1514 CG LYS B 5 1.219 2.761 -14.452 1.00 0.00 C ATOM 1515 CD LYS B 5 2.642 2.476 -14.907 1.00 0.00 C ATOM 1516 CE LYS B 5 2.751 1.116 -15.577 1.00 0.00 C ATOM 1517 NZ LYS B 5 3.647 1.153 -16.767 1.00 0.00 N ATOM 0 H LYS B 5 2.593 3.351 -11.691 1.00 0.00 H new ATOM 0 HA LYS B 5 -0.053 3.978 -12.513 1.00 0.00 H new ATOM 0 HB2 LYS B 5 1.824 1.629 -12.739 1.00 0.00 H new ATOM 0 HB3 LYS B 5 0.142 1.418 -13.181 1.00 0.00 H new ATOM 0 HG2 LYS B 5 0.516 2.358 -15.181 1.00 0.00 H new ATOM 0 HG3 LYS B 5 1.057 3.838 -14.415 1.00 0.00 H new ATOM 0 HD2 LYS B 5 2.965 3.252 -15.601 1.00 0.00 H new ATOM 0 HD3 LYS B 5 3.314 2.515 -14.050 1.00 0.00 H new ATOM 0 HE2 LYS B 5 3.130 0.387 -14.860 1.00 0.00 H new ATOM 0 HE3 LYS B 5 1.759 0.780 -15.880 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 3.695 0.206 -17.195 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 3.273 1.829 -17.463 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 4.600 1.449 -16.475 1.00 0.00 H new ATOM 1531 N ALA B 6 0.268 1.627 -10.200 1.00 0.00 N ATOM 1532 CA ALA B 6 -0.444 0.924 -9.141 1.00 0.00 C ATOM 1533 C ALA B 6 -1.002 1.903 -8.113 1.00 0.00 C ATOM 1534 O ALA B 6 -2.129 1.750 -7.644 1.00 0.00 O ATOM 1535 CB ALA B 6 0.474 -0.085 -8.468 1.00 0.00 C ATOM 0 H ALA B 6 1.248 1.362 -10.296 1.00 0.00 H new ATOM 0 HA ALA B 6 -1.282 0.392 -9.591 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -0.071 -0.603 -7.679 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.821 -0.809 -9.205 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.331 0.433 -8.037 1.00 0.00 H new ATOM 1541 N MET B 7 -0.204 2.908 -7.768 1.00 0.00 N ATOM 1542 CA MET B 7 -0.619 3.913 -6.797 1.00 0.00 C ATOM 1543 C MET B 7 -1.894 4.617 -7.252 1.00 0.00 C ATOM 1544 O MET B 7 -2.877 4.683 -6.512 1.00 0.00 O ATOM 1545 CB MET B 7 0.496 4.939 -6.585 1.00 0.00 C ATOM 1546 CG MET B 7 1.381 4.637 -5.386 1.00 0.00 C ATOM 1547 SD MET B 7 2.359 6.061 -4.869 1.00 0.00 S ATOM 1548 CE MET B 7 4.018 5.466 -5.187 1.00 0.00 C ATOM 0 H MET B 7 0.733 3.048 -8.146 1.00 0.00 H new ATOM 0 HA MET B 7 -0.822 3.407 -5.853 1.00 0.00 H new ATOM 0 HB2 MET B 7 1.115 4.981 -7.481 1.00 0.00 H new ATOM 0 HB3 MET B 7 0.051 5.926 -6.458 1.00 0.00 H new ATOM 0 HG2 MET B 7 0.759 4.307 -4.554 1.00 0.00 H new ATOM 0 HG3 MET B 7 2.049 3.812 -5.631 1.00 0.00 H new ATOM 0 HE1 MET B 7 4.664 5.724 -4.348 1.00 0.00 H new ATOM 0 HE2 MET B 7 3.999 4.383 -5.311 1.00 0.00 H new ATOM 0 HE3 MET B 7 4.402 5.928 -6.096 1.00 0.00 H new ATOM 1558 N VAL B 8 -1.871 5.142 -8.473 1.00 0.00 N ATOM 1559 CA VAL B 8 -3.026 5.841 -9.021 1.00 0.00 C ATOM 1560 C VAL B 8 -4.143 4.868 -9.376 1.00 0.00 C ATOM 1561 O VAL B 8 -5.318 5.234 -9.370 1.00 0.00 O ATOM 1562 CB VAL B 8 -2.655 6.665 -10.269 1.00 0.00 C ATOM 1563 CG1 VAL B 8 -3.834 7.514 -10.719 1.00 0.00 C ATOM 1564 CG2 VAL B 8 -1.438 7.534 -9.992 1.00 0.00 C ATOM 0 H VAL B 8 -1.067 5.096 -9.099 1.00 0.00 H new ATOM 0 HA VAL B 8 -3.376 6.521 -8.244 1.00 0.00 H new ATOM 0 HB VAL B 8 -2.405 5.976 -11.076 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -3.553 8.089 -11.601 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -4.677 6.867 -10.961 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -4.118 8.196 -9.917 1.00 0.00 H new ATOM 0 HG21 VAL B 8 -1.191 8.109 -10.884 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -1.657 8.216 -9.170 1.00 0.00 H new ATOM 0 HG23 VAL B 8 -0.593 6.901 -9.722 1.00 0.00 H new ATOM 1574 N ALA B 9 -3.781 3.624 -9.665 1.00 0.00 N ATOM 1575 CA ALA B 9 -4.773 2.612 -9.997 1.00 0.00 C ATOM 1576 C ALA B 9 -5.684 2.369 -8.801 1.00 0.00 C ATOM 1577 O ALA B 9 -6.896 2.186 -8.947 1.00 0.00 O ATOM 1578 CB ALA B 9 -4.094 1.320 -10.424 1.00 0.00 C ATOM 0 H ALA B 9 -2.816 3.295 -9.676 1.00 0.00 H new ATOM 0 HA ALA B 9 -5.376 2.969 -10.831 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -4.851 0.575 -10.668 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -3.473 1.508 -11.300 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -3.471 0.950 -9.610 1.00 0.00 H new ATOM 1584 N LEU B 10 -5.090 2.395 -7.612 1.00 0.00 N ATOM 1585 CA LEU B 10 -5.844 2.199 -6.383 1.00 0.00 C ATOM 1586 C LEU B 10 -6.795 3.364 -6.175 1.00 0.00 C ATOM 1587 O LEU B 10 -7.950 3.184 -5.794 1.00 0.00 O ATOM 1588 CB LEU B 10 -4.899 2.077 -5.184 1.00 0.00 C ATOM 1589 CG LEU B 10 -4.044 0.810 -5.156 1.00 0.00 C ATOM 1590 CD1 LEU B 10 -2.653 1.115 -4.621 1.00 0.00 C ATOM 1591 CD2 LEU B 10 -4.715 -0.268 -4.315 1.00 0.00 C ATOM 0 H LEU B 10 -4.091 2.550 -7.476 1.00 0.00 H new ATOM 0 HA LEU B 10 -6.416 1.275 -6.468 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -4.237 2.943 -5.174 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -5.491 2.117 -4.270 1.00 0.00 H new ATOM 0 HG LEU B 10 -3.946 0.440 -6.176 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -2.059 0.201 -4.609 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -2.170 1.853 -5.262 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -2.731 1.510 -3.608 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -4.092 -1.163 -4.306 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -4.844 0.094 -3.295 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -5.689 -0.508 -4.741 1.00 0.00 H new ATOM 1603 N ILE B 11 -6.297 4.562 -6.448 1.00 0.00 N ATOM 1604 CA ILE B 11 -7.100 5.772 -6.307 1.00 0.00 C ATOM 1605 C ILE B 11 -8.162 5.834 -7.393 1.00 0.00 C ATOM 1606 O ILE B 11 -9.301 6.219 -7.136 1.00 0.00 O ATOM 1607 CB ILE B 11 -6.254 7.069 -6.358 1.00 0.00 C ATOM 1608 CG1 ILE B 11 -4.773 6.769 -6.530 1.00 0.00 C ATOM 1609 CG2 ILE B 11 -6.454 7.878 -5.101 1.00 0.00 C ATOM 1610 CD1 ILE B 11 -3.900 8.010 -6.557 1.00 0.00 C ATOM 0 H ILE B 11 -5.342 4.724 -6.768 1.00 0.00 H new ATOM 0 HA ILE B 11 -7.564 5.715 -5.322 1.00 0.00 H new ATOM 0 HB ILE B 11 -6.593 7.640 -7.222 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -4.445 6.122 -5.716 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -4.629 6.213 -7.457 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -5.853 8.786 -5.153 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -7.506 8.145 -5.004 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -6.148 7.289 -4.237 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -2.857 7.719 -6.682 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -4.201 8.648 -7.388 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -4.014 8.556 -5.620 1.00 0.00 H new ATOM 1622 N ASP B 12 -7.786 5.445 -8.609 1.00 0.00 N ATOM 1623 CA ASP B 12 -8.719 5.450 -9.729 1.00 0.00 C ATOM 1624 C ASP B 12 -10.030 4.789 -9.317 1.00 0.00 C ATOM 1625 O ASP B 12 -11.113 5.228 -9.704 1.00 0.00 O ATOM 1626 CB ASP B 12 -8.115 4.719 -10.931 1.00 0.00 C ATOM 1627 CG ASP B 12 -8.356 5.454 -12.235 1.00 0.00 C ATOM 1628 OD1 ASP B 12 -8.272 6.701 -12.237 1.00 0.00 O ATOM 1629 OD2 ASP B 12 -8.626 4.784 -13.253 1.00 0.00 O ATOM 0 H ASP B 12 -6.846 5.124 -8.842 1.00 0.00 H new ATOM 0 HA ASP B 12 -8.917 6.483 -10.015 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -7.043 4.598 -10.778 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -8.542 3.718 -10.997 1.00 0.00 H new ATOM 1634 N VAL B 13 -9.915 3.736 -8.513 1.00 0.00 N ATOM 1635 CA VAL B 13 -11.084 3.015 -8.028 1.00 0.00 C ATOM 1636 C VAL B 13 -11.797 3.802 -6.929 1.00 0.00 C ATOM 1637 O VAL B 13 -13.022 3.920 -6.935 1.00 0.00 O ATOM 1638 CB VAL B 13 -10.708 1.622 -7.487 1.00 0.00 C ATOM 1639 CG1 VAL B 13 -11.932 0.722 -7.450 1.00 0.00 C ATOM 1640 CG2 VAL B 13 -9.603 0.995 -8.326 1.00 0.00 C ATOM 0 H VAL B 13 -9.024 3.364 -8.185 1.00 0.00 H new ATOM 0 HA VAL B 13 -11.754 2.893 -8.879 1.00 0.00 H new ATOM 0 HB VAL B 13 -10.333 1.738 -6.470 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -11.651 -0.259 -7.066 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -12.688 1.163 -6.801 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -12.336 0.615 -8.457 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -9.355 0.012 -7.925 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -9.943 0.891 -9.356 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.719 1.632 -8.298 1.00 0.00 H new ATOM 1650 N PHE B 14 -11.024 4.342 -5.986 1.00 0.00 N ATOM 1651 CA PHE B 14 -11.589 5.119 -4.884 1.00 0.00 C ATOM 1652 C PHE B 14 -12.199 6.422 -5.401 1.00 0.00 C ATOM 1653 O PHE B 14 -13.119 6.971 -4.798 1.00 0.00 O ATOM 1654 CB PHE B 14 -10.509 5.383 -3.810 1.00 0.00 C ATOM 1655 CG PHE B 14 -10.317 6.828 -3.424 1.00 0.00 C ATOM 1656 CD1 PHE B 14 -9.919 7.769 -4.361 1.00 0.00 C ATOM 1657 CD2 PHE B 14 -10.535 7.243 -2.118 1.00 0.00 C ATOM 1658 CE1 PHE B 14 -9.743 9.092 -4.005 1.00 0.00 C ATOM 1659 CE2 PHE B 14 -10.361 8.563 -1.759 1.00 0.00 C ATOM 1660 CZ PHE B 14 -9.965 9.489 -2.703 1.00 0.00 C ATOM 0 H PHE B 14 -10.008 4.256 -5.964 1.00 0.00 H new ATOM 0 HA PHE B 14 -12.391 4.545 -4.420 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -10.766 4.817 -2.915 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -9.558 4.992 -4.172 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.744 7.464 -5.382 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -10.845 6.524 -1.374 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -9.432 9.814 -4.745 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -10.535 8.872 -0.739 1.00 0.00 H new ATOM 0 HZ PHE B 14 -9.829 10.523 -2.422 1.00 0.00 H new ATOM 1670 N HIS B 15 -11.677 6.909 -6.524 1.00 0.00 N ATOM 1671 CA HIS B 15 -12.166 8.146 -7.124 1.00 0.00 C ATOM 1672 C HIS B 15 -13.422 7.894 -7.953 1.00 0.00 C ATOM 1673 O HIS B 15 -14.210 8.808 -8.192 1.00 0.00 O ATOM 1674 CB HIS B 15 -11.081 8.774 -7.999 1.00 0.00 C ATOM 1675 CG HIS B 15 -11.305 10.228 -8.280 1.00 0.00 C ATOM 1676 ND1 HIS B 15 -10.536 11.229 -7.725 1.00 0.00 N ATOM 1677 CD2 HIS B 15 -12.219 10.849 -9.063 1.00 0.00 C ATOM 1678 CE1 HIS B 15 -10.967 12.402 -8.154 1.00 0.00 C ATOM 1679 NE2 HIS B 15 -11.986 12.199 -8.968 1.00 0.00 N ATOM 0 H HIS B 15 -10.915 6.465 -7.037 1.00 0.00 H new ATOM 0 HA HIS B 15 -12.420 8.835 -6.318 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -10.115 8.652 -7.509 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -11.030 8.233 -8.944 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -12.988 10.371 -9.652 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -10.555 13.363 -7.884 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -12.515 12.927 -9.449 1.00 0.00 H new ATOM 1688 N GLN B 16 -13.608 6.649 -8.384 1.00 0.00 N ATOM 1689 CA GLN B 16 -14.773 6.287 -9.176 1.00 0.00 C ATOM 1690 C GLN B 16 -15.988 6.127 -8.274 1.00 0.00 C ATOM 1691 O GLN B 16 -17.090 6.554 -8.614 1.00 0.00 O ATOM 1692 CB GLN B 16 -14.515 4.989 -9.945 1.00 0.00 C ATOM 1693 CG GLN B 16 -13.835 5.204 -11.286 1.00 0.00 C ATOM 1694 CD GLN B 16 -13.168 3.946 -11.808 1.00 0.00 C ATOM 1695 OE1 GLN B 16 -13.839 2.980 -12.174 1.00 0.00 O ATOM 1696 NE2 GLN B 16 -11.841 3.950 -11.844 1.00 0.00 N ATOM 0 H GLN B 16 -12.967 5.878 -8.197 1.00 0.00 H new ATOM 0 HA GLN B 16 -14.967 7.084 -9.894 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -13.897 4.331 -9.334 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -15.464 4.477 -10.106 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -14.571 5.549 -12.012 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -13.089 5.993 -11.189 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -11.325 4.772 -11.531 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -11.338 3.131 -12.185 1.00 0.00 H new ATOM 1705 N TYR B 17 -15.772 5.513 -7.115 1.00 0.00 N ATOM 1706 CA TYR B 17 -16.844 5.303 -6.157 1.00 0.00 C ATOM 1707 C TYR B 17 -17.063 6.546 -5.304 1.00 0.00 C ATOM 1708 O TYR B 17 -18.152 7.121 -5.294 1.00 0.00 O ATOM 1709 CB TYR B 17 -16.535 4.104 -5.260 1.00 0.00 C ATOM 1710 CG TYR B 17 -17.213 2.829 -5.706 1.00 0.00 C ATOM 1711 CD1 TYR B 17 -16.812 2.174 -6.864 1.00 0.00 C ATOM 1712 CD2 TYR B 17 -18.258 2.281 -4.973 1.00 0.00 C ATOM 1713 CE1 TYR B 17 -17.431 1.010 -7.278 1.00 0.00 C ATOM 1714 CE2 TYR B 17 -18.882 1.116 -5.379 1.00 0.00 C ATOM 1715 CZ TYR B 17 -18.465 0.486 -6.532 1.00 0.00 C ATOM 1716 OH TYR B 17 -19.085 -0.674 -6.940 1.00 0.00 O ATOM 0 H TYR B 17 -14.864 5.154 -6.820 1.00 0.00 H new ATOM 0 HA TYR B 17 -17.758 5.101 -6.716 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -15.457 3.945 -5.238 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -16.844 4.333 -4.240 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -16.002 2.582 -7.451 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -18.589 2.773 -4.070 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -17.107 0.514 -8.181 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -19.691 0.702 -4.796 1.00 0.00 H new ATOM 0 HH TYR B 17 -20.050 -0.599 -6.790 1.00 0.00 H new ATOM 1726 N SER B 18 -16.022 6.953 -4.587 1.00 0.00 N ATOM 1727 CA SER B 18 -16.102 8.126 -3.728 1.00 0.00 C ATOM 1728 C SER B 18 -16.185 9.404 -4.557 1.00 0.00 C ATOM 1729 O SER B 18 -15.279 9.713 -5.331 1.00 0.00 O ATOM 1730 CB SER B 18 -14.891 8.189 -2.796 1.00 0.00 C ATOM 1731 OG SER B 18 -15.053 9.198 -1.816 1.00 0.00 O ATOM 0 H SER B 18 -15.114 6.488 -4.584 1.00 0.00 H new ATOM 0 HA SER B 18 -17.008 8.042 -3.129 1.00 0.00 H new ATOM 0 HB2 SER B 18 -14.753 7.224 -2.309 1.00 0.00 H new ATOM 0 HB3 SER B 18 -13.990 8.384 -3.378 1.00 0.00 H new ATOM 0 HG SER B 18 -15.617 8.861 -1.089 1.00 0.00 H new ATOM 1737 N GLY B 19 -17.274 10.145 -4.387 1.00 0.00 N ATOM 1738 CA GLY B 19 -17.452 11.382 -5.126 1.00 0.00 C ATOM 1739 C GLY B 19 -18.912 11.738 -5.323 1.00 0.00 C ATOM 1740 O GLY B 19 -19.349 12.826 -4.947 1.00 0.00 O ATOM 0 H GLY B 19 -18.037 9.912 -3.751 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -16.952 12.193 -4.596 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -16.969 11.292 -6.099 1.00 0.00 H new ATOM 1801 N LYS B 24 -16.827 13.230 -0.955 1.00 0.00 N ATOM 1802 CA LYS B 24 -15.748 12.697 -1.780 1.00 0.00 C ATOM 1803 C LYS B 24 -14.526 12.361 -0.931 1.00 0.00 C ATOM 1804 O LYS B 24 -14.391 12.837 0.197 1.00 0.00 O ATOM 1805 CB LYS B 24 -15.369 13.698 -2.872 1.00 0.00 C ATOM 1806 CG LYS B 24 -14.282 13.195 -3.808 1.00 0.00 C ATOM 1807 CD LYS B 24 -14.116 14.109 -5.013 1.00 0.00 C ATOM 1808 CE LYS B 24 -12.927 15.042 -4.845 1.00 0.00 C ATOM 1809 NZ LYS B 24 -12.497 15.633 -6.143 1.00 0.00 N ATOM 0 HA LYS B 24 -16.103 11.779 -2.248 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -16.257 13.939 -3.456 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -15.034 14.624 -2.404 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -13.338 13.128 -3.268 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -14.528 12.188 -4.145 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -13.983 13.507 -5.912 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -15.024 14.696 -5.153 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -13.188 15.841 -4.151 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -12.095 14.494 -4.402 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -11.684 16.263 -5.986 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -12.224 14.872 -6.797 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -13.282 16.177 -6.554 1.00 0.00 H new ATOM 1823 N HIS B 25 -13.638 11.537 -1.480 1.00 0.00 N ATOM 1824 CA HIS B 25 -12.425 11.133 -0.774 1.00 0.00 C ATOM 1825 C HIS B 25 -12.764 10.338 0.483 1.00 0.00 C ATOM 1826 O HIS B 25 -12.301 10.654 1.579 1.00 0.00 O ATOM 1827 CB HIS B 25 -11.584 12.356 -0.410 1.00 0.00 C ATOM 1828 CG HIS B 25 -10.137 12.038 -0.211 1.00 0.00 C ATOM 1829 ND1 HIS B 25 -9.122 12.920 -0.514 1.00 0.00 N ATOM 1830 CD2 HIS B 25 -9.536 10.919 0.259 1.00 0.00 C ATOM 1831 CE1 HIS B 25 -7.958 12.359 -0.240 1.00 0.00 C ATOM 1832 NE2 HIS B 25 -8.181 11.145 0.231 1.00 0.00 N ATOM 0 H HIS B 25 -13.735 11.135 -2.413 1.00 0.00 H new ATOM 0 HA HIS B 25 -11.847 10.493 -1.440 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -11.680 13.103 -1.198 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -11.980 12.803 0.502 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -10.029 10.018 0.593 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -6.989 12.815 -0.378 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -7.464 10.483 0.526 1.00 0.00 H new ATOM 1841 N LYS B 26 -13.583 9.308 0.311 1.00 0.00 N ATOM 1842 CA LYS B 26 -14.003 8.454 1.413 1.00 0.00 C ATOM 1843 C LYS B 26 -14.866 7.307 0.896 1.00 0.00 C ATOM 1844 O LYS B 26 -15.464 7.416 -0.173 1.00 0.00 O ATOM 1845 CB LYS B 26 -14.771 9.276 2.441 1.00 0.00 C ATOM 1846 CG LYS B 26 -14.903 8.595 3.788 1.00 0.00 C ATOM 1847 CD LYS B 26 -14.435 9.499 4.917 1.00 0.00 C ATOM 1848 CE LYS B 26 -12.921 9.602 4.944 1.00 0.00 C ATOM 1849 NZ LYS B 26 -12.456 11.012 4.823 1.00 0.00 N ATOM 0 H LYS B 26 -13.973 9.042 -0.593 1.00 0.00 H new ATOM 0 HA LYS B 26 -13.119 8.031 1.890 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -14.269 10.234 2.576 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -15.767 9.489 2.052 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -15.943 8.312 3.954 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -14.318 7.675 3.791 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -14.868 10.492 4.795 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -14.793 9.110 5.870 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -12.545 9.175 5.874 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -12.503 9.011 4.129 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -11.537 11.116 5.298 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -12.357 11.260 3.818 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -13.150 11.646 5.269 1.00 0.00 H new ATOM 1863 N LEU B 27 -14.941 6.215 1.654 1.00 0.00 N ATOM 1864 CA LEU B 27 -15.751 5.064 1.250 1.00 0.00 C ATOM 1865 C LEU B 27 -16.578 4.553 2.421 1.00 0.00 C ATOM 1866 O LEU B 27 -16.085 4.444 3.543 1.00 0.00 O ATOM 1867 CB LEU B 27 -14.884 3.917 0.704 1.00 0.00 C ATOM 1868 CG LEU B 27 -14.153 4.166 -0.630 1.00 0.00 C ATOM 1869 CD1 LEU B 27 -15.060 4.850 -1.642 1.00 0.00 C ATOM 1870 CD2 LEU B 27 -12.870 4.968 -0.420 1.00 0.00 C ATOM 0 H LEU B 27 -14.456 6.101 2.544 1.00 0.00 H new ATOM 0 HA LEU B 27 -16.413 5.405 0.454 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -14.137 3.668 1.458 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -15.520 3.040 0.583 1.00 0.00 H new ATOM 0 HG LEU B 27 -13.877 3.192 -1.035 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -14.513 5.010 -2.571 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -15.928 4.220 -1.836 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -15.390 5.810 -1.245 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -12.379 5.126 -1.380 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -13.113 5.932 0.027 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -12.202 4.419 0.243 1.00 0.00 H new ATOM 1882 N LYS B 28 -17.841 4.243 2.151 1.00 0.00 N ATOM 1883 CA LYS B 28 -18.747 3.745 3.182 1.00 0.00 C ATOM 1884 C LYS B 28 -19.218 2.327 2.875 1.00 0.00 C ATOM 1885 O LYS B 28 -18.774 1.709 1.909 1.00 0.00 O ATOM 1886 CB LYS B 28 -19.953 4.679 3.319 1.00 0.00 C ATOM 1887 CG LYS B 28 -20.751 4.835 2.035 1.00 0.00 C ATOM 1888 CD LYS B 28 -21.147 6.284 1.795 1.00 0.00 C ATOM 1889 CE LYS B 28 -22.473 6.385 1.059 1.00 0.00 C ATOM 1890 NZ LYS B 28 -22.485 7.513 0.087 1.00 0.00 N ATOM 0 H LYS B 28 -18.262 4.328 1.226 1.00 0.00 H new ATOM 0 HA LYS B 28 -18.199 3.720 4.124 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -20.610 4.298 4.101 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -19.607 5.660 3.643 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -20.161 4.474 1.193 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -21.647 4.216 2.085 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -21.219 6.805 2.750 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -20.370 6.784 1.217 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -22.668 5.451 0.533 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -23.279 6.519 1.780 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -23.315 7.428 -0.533 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -22.529 8.415 0.603 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -21.619 7.485 -0.488 1.00 0.00 H new ATOM 1904 N LYS B 29 -20.123 1.818 3.710 1.00 0.00 N ATOM 1905 CA LYS B 29 -20.659 0.473 3.533 1.00 0.00 C ATOM 1906 C LYS B 29 -21.317 0.326 2.166 1.00 0.00 C ATOM 1907 O LYS B 29 -21.341 -0.761 1.589 1.00 0.00 O ATOM 1908 CB LYS B 29 -21.676 0.155 4.632 1.00 0.00 C ATOM 1909 CG LYS B 29 -21.228 0.578 6.022 1.00 0.00 C ATOM 1910 CD LYS B 29 -21.452 -0.527 7.042 1.00 0.00 C ATOM 1911 CE LYS B 29 -20.449 -0.447 8.180 1.00 0.00 C ATOM 1912 NZ LYS B 29 -20.973 0.343 9.328 1.00 0.00 N ATOM 0 H LYS B 29 -20.499 2.318 4.515 1.00 0.00 H new ATOM 0 HA LYS B 29 -19.829 -0.231 3.599 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -22.618 0.651 4.397 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -21.872 -0.917 4.634 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -20.171 0.844 5.999 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -21.775 1.471 6.325 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -22.464 -0.455 7.442 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -21.371 -1.497 6.552 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -20.200 -1.454 8.516 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -19.526 0.006 7.819 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -20.259 0.374 10.083 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -21.187 1.311 9.014 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -21.840 -0.103 9.690 1.00 0.00 H new ATOM 1926 N SER B 30 -21.852 1.427 1.653 1.00 0.00 N ATOM 1927 CA SER B 30 -22.511 1.419 0.354 1.00 0.00 C ATOM 1928 C SER B 30 -21.487 1.358 -0.774 1.00 0.00 C ATOM 1929 O SER B 30 -21.552 0.483 -1.635 1.00 0.00 O ATOM 1930 CB SER B 30 -23.391 2.660 0.196 1.00 0.00 C ATOM 1931 OG SER B 30 -24.627 2.336 -0.417 1.00 0.00 O ATOM 0 H SER B 30 -21.842 2.336 2.116 1.00 0.00 H new ATOM 0 HA SER B 30 -23.139 0.530 0.298 1.00 0.00 H new ATOM 0 HB2 SER B 30 -23.573 3.107 1.173 1.00 0.00 H new ATOM 0 HB3 SER B 30 -22.869 3.406 -0.404 1.00 0.00 H new ATOM 0 HG SER B 30 -25.171 3.146 -0.505 1.00 0.00 H new ATOM 1937 N GLU B 31 -20.545 2.296 -0.765 1.00 0.00 N ATOM 1938 CA GLU B 31 -19.512 2.351 -1.793 1.00 0.00 C ATOM 1939 C GLU B 31 -18.457 1.267 -1.581 1.00 0.00 C ATOM 1940 O GLU B 31 -18.251 0.413 -2.441 1.00 0.00 O ATOM 1941 CB GLU B 31 -18.848 3.729 -1.800 1.00 0.00 C ATOM 1942 CG GLU B 31 -19.572 4.746 -2.667 1.00 0.00 C ATOM 1943 CD GLU B 31 -19.498 6.151 -2.102 1.00 0.00 C ATOM 1944 OE1 GLU B 31 -19.674 6.306 -0.875 1.00 0.00 O ATOM 1945 OE2 GLU B 31 -19.265 7.094 -2.886 1.00 0.00 O ATOM 0 H GLU B 31 -20.476 3.028 -0.058 1.00 0.00 H new ATOM 0 HA GLU B 31 -19.990 2.175 -2.757 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -18.798 4.105 -0.778 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -17.822 3.627 -2.153 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -19.140 4.738 -3.668 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -20.617 4.453 -2.768 1.00 0.00 H new ATOM 1952 N LEU B 32 -17.787 1.315 -0.432 1.00 0.00 N ATOM 1953 CA LEU B 32 -16.743 0.348 -0.100 1.00 0.00 C ATOM 1954 C LEU B 32 -17.163 -1.083 -0.440 1.00 0.00 C ATOM 1955 O LEU B 32 -16.596 -1.708 -1.337 1.00 0.00 O ATOM 1956 CB LEU B 32 -16.387 0.448 1.386 1.00 0.00 C ATOM 1957 CG LEU B 32 -15.073 -0.224 1.789 1.00 0.00 C ATOM 1958 CD1 LEU B 32 -15.205 -1.738 1.727 1.00 0.00 C ATOM 1959 CD2 LEU B 32 -13.934 0.251 0.900 1.00 0.00 C ATOM 0 H LEU B 32 -17.950 2.018 0.289 1.00 0.00 H new ATOM 0 HA LEU B 32 -15.867 0.589 -0.703 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -16.337 1.502 1.661 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -17.196 0.005 1.967 1.00 0.00 H new ATOM 0 HG LEU B 32 -14.845 0.058 2.817 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -14.260 -2.198 2.017 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -15.991 -2.063 2.409 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -15.458 -2.040 0.711 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -13.008 -0.238 1.202 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -14.154 0.001 -0.138 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -13.822 1.331 0.998 1.00 0.00 H new ATOM 1971 N LYS B 33 -18.153 -1.597 0.284 1.00 0.00 N ATOM 1972 CA LYS B 33 -18.641 -2.957 0.062 1.00 0.00 C ATOM 1973 C LYS B 33 -18.978 -3.198 -1.408 1.00 0.00 C ATOM 1974 O LYS B 33 -18.434 -4.107 -2.039 1.00 0.00 O ATOM 1975 CB LYS B 33 -19.868 -3.227 0.932 1.00 0.00 C ATOM 1976 CG LYS B 33 -19.651 -2.897 2.399 1.00 0.00 C ATOM 1977 CD LYS B 33 -20.716 -3.534 3.276 1.00 0.00 C ATOM 1978 CE LYS B 33 -20.350 -3.442 4.748 1.00 0.00 C ATOM 1979 NZ LYS B 33 -21.290 -4.217 5.604 1.00 0.00 N ATOM 0 H LYS B 33 -18.634 -1.094 1.030 1.00 0.00 H new ATOM 0 HA LYS B 33 -17.844 -3.646 0.341 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -20.707 -2.642 0.556 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -20.145 -4.277 0.840 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -18.666 -3.245 2.710 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -19.664 -1.816 2.536 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -21.673 -3.040 3.106 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -20.843 -4.580 2.996 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -19.336 -3.814 4.894 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -20.354 -2.397 5.058 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -20.854 -4.386 6.533 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -22.171 -3.678 5.728 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -21.502 -5.128 5.150 1.00 0.00 H new ATOM 1993 N GLU B 34 -19.874 -2.380 -1.954 1.00 0.00 N ATOM 1994 CA GLU B 34 -20.270 -2.516 -3.352 1.00 0.00 C ATOM 1995 C GLU B 34 -19.044 -2.516 -4.257 1.00 0.00 C ATOM 1996 O GLU B 34 -19.008 -3.215 -5.270 1.00 0.00 O ATOM 1997 CB GLU B 34 -21.219 -1.388 -3.758 1.00 0.00 C ATOM 1998 CG GLU B 34 -22.602 -1.504 -3.136 1.00 0.00 C ATOM 1999 CD GLU B 34 -23.364 -2.717 -3.630 1.00 0.00 C ATOM 2000 OE1 GLU B 34 -22.978 -3.849 -3.269 1.00 0.00 O ATOM 2001 OE2 GLU B 34 -24.348 -2.536 -4.378 1.00 0.00 O ATOM 0 H GLU B 34 -20.337 -1.621 -1.453 1.00 0.00 H new ATOM 0 HA GLU B 34 -20.791 -3.467 -3.465 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -20.779 -0.433 -3.471 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -21.317 -1.380 -4.844 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -22.505 -1.557 -2.052 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -23.174 -0.604 -3.361 1.00 0.00 H new ATOM 2008 N LEU B 35 -18.035 -1.736 -3.879 1.00 0.00 N ATOM 2009 CA LEU B 35 -16.805 -1.657 -4.653 1.00 0.00 C ATOM 2010 C LEU B 35 -16.123 -3.015 -4.699 1.00 0.00 C ATOM 2011 O LEU B 35 -15.602 -3.430 -5.732 1.00 0.00 O ATOM 2012 CB LEU B 35 -15.861 -0.608 -4.059 1.00 0.00 C ATOM 2013 CG LEU B 35 -14.810 -0.059 -5.026 1.00 0.00 C ATOM 2014 CD1 LEU B 35 -13.865 0.890 -4.303 1.00 0.00 C ATOM 2015 CD2 LEU B 35 -14.037 -1.199 -5.671 1.00 0.00 C ATOM 0 H LEU B 35 -18.047 -1.152 -3.043 1.00 0.00 H new ATOM 0 HA LEU B 35 -17.057 -1.357 -5.670 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -16.457 0.224 -3.684 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -15.350 -1.046 -3.202 1.00 0.00 H new ATOM 0 HG LEU B 35 -15.319 0.499 -5.812 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -13.124 1.271 -5.006 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -14.433 1.722 -3.888 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -13.360 0.357 -3.497 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -13.293 -0.792 -6.356 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -13.537 -1.783 -4.898 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -14.726 -1.840 -6.222 1.00 0.00 H new ATOM 2027 N ILE B 36 -16.145 -3.703 -3.571 1.00 0.00 N ATOM 2028 CA ILE B 36 -15.545 -5.028 -3.465 1.00 0.00 C ATOM 2029 C ILE B 36 -16.075 -5.929 -4.572 1.00 0.00 C ATOM 2030 O ILE B 36 -15.342 -6.304 -5.487 1.00 0.00 O ATOM 2031 CB ILE B 36 -15.830 -5.666 -2.084 1.00 0.00 C ATOM 2032 CG1 ILE B 36 -15.158 -4.832 -0.983 1.00 0.00 C ATOM 2033 CG2 ILE B 36 -15.361 -7.121 -2.037 1.00 0.00 C ATOM 2034 CD1 ILE B 36 -14.835 -5.608 0.278 1.00 0.00 C ATOM 0 H ILE B 36 -16.574 -3.366 -2.709 1.00 0.00 H new ATOM 0 HA ILE B 36 -14.466 -4.919 -3.571 1.00 0.00 H new ATOM 0 HB ILE B 36 -16.907 -5.670 -1.916 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -14.237 -4.405 -1.379 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -15.811 -3.998 -0.725 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -15.575 -7.541 -1.054 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -15.885 -7.697 -2.800 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -14.288 -7.164 -2.224 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -14.363 -4.945 1.003 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -15.754 -6.013 0.701 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -14.155 -6.425 0.038 1.00 0.00 H new ATOM 2046 N ASN B 37 -17.358 -6.252 -4.500 1.00 0.00 N ATOM 2047 CA ASN B 37 -17.982 -7.089 -5.516 1.00 0.00 C ATOM 2048 C ASN B 37 -17.834 -6.452 -6.898 1.00 0.00 C ATOM 2049 O ASN B 37 -17.980 -7.122 -7.920 1.00 0.00 O ATOM 2050 CB ASN B 37 -19.462 -7.306 -5.194 1.00 0.00 C ATOM 2051 CG ASN B 37 -19.675 -7.857 -3.797 1.00 0.00 C ATOM 2052 OD1 ASN B 37 -18.722 -8.223 -3.110 1.00 0.00 O ATOM 2053 ND2 ASN B 37 -20.931 -7.917 -3.370 1.00 0.00 N ATOM 0 H ASN B 37 -17.985 -5.950 -3.754 1.00 0.00 H new ATOM 0 HA ASN B 37 -17.479 -8.056 -5.521 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -19.995 -6.361 -5.294 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -19.893 -7.993 -5.922 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -21.136 -8.278 -2.438 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -21.691 -7.602 -3.974 1.00 0.00 H new ATOM 2060 N ASN B 38 -17.551 -5.150 -6.918 1.00 0.00 N ATOM 2061 CA ASN B 38 -17.388 -4.417 -8.166 1.00 0.00 C ATOM 2062 C ASN B 38 -15.996 -4.613 -8.764 1.00 0.00 C ATOM 2063 O ASN B 38 -15.857 -4.764 -9.978 1.00 0.00 O ATOM 2064 CB ASN B 38 -17.643 -2.925 -7.938 1.00 0.00 C ATOM 2065 CG ASN B 38 -17.754 -2.153 -9.239 1.00 0.00 C ATOM 2066 OD1 ASN B 38 -16.749 -1.747 -9.822 1.00 0.00 O ATOM 2067 ND2 ASN B 38 -18.982 -1.946 -9.700 1.00 0.00 N ATOM 0 H ASN B 38 -17.430 -4.582 -6.079 1.00 0.00 H new ATOM 0 HA ASN B 38 -18.117 -4.812 -8.874 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -18.561 -2.799 -7.364 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -16.833 -2.508 -7.339 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -19.120 -1.432 -10.570 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -19.787 -2.301 -9.184 1.00 0.00 H new ATOM 2074 N GLU B 39 -14.963 -4.592 -7.921 1.00 0.00 N ATOM 2075 CA GLU B 39 -13.595 -4.749 -8.413 1.00 0.00 C ATOM 2076 C GLU B 39 -12.745 -5.632 -7.500 1.00 0.00 C ATOM 2077 O GLU B 39 -11.635 -5.256 -7.122 1.00 0.00 O ATOM 2078 CB GLU B 39 -12.933 -3.378 -8.565 1.00 0.00 C ATOM 2079 CG GLU B 39 -13.671 -2.448 -9.515 1.00 0.00 C ATOM 2080 CD GLU B 39 -12.794 -1.954 -10.649 1.00 0.00 C ATOM 2081 OE1 GLU B 39 -11.643 -1.549 -10.376 1.00 0.00 O ATOM 2082 OE2 GLU B 39 -13.256 -1.971 -11.809 1.00 0.00 O ATOM 0 H GLU B 39 -15.044 -4.470 -6.912 1.00 0.00 H new ATOM 0 HA GLU B 39 -13.657 -5.243 -9.382 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -12.867 -2.905 -7.585 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -11.912 -3.514 -8.923 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -14.534 -2.969 -9.929 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -14.052 -1.593 -8.957 1.00 0.00 H new ATOM 2089 N LEU B 40 -13.254 -6.814 -7.165 1.00 0.00 N ATOM 2090 CA LEU B 40 -12.515 -7.744 -6.316 1.00 0.00 C ATOM 2091 C LEU B 40 -12.983 -9.177 -6.545 1.00 0.00 C ATOM 2092 O LEU B 40 -14.038 -9.582 -6.058 1.00 0.00 O ATOM 2093 CB LEU B 40 -12.663 -7.369 -4.838 1.00 0.00 C ATOM 2094 CG LEU B 40 -11.949 -6.080 -4.424 1.00 0.00 C ATOM 2095 CD1 LEU B 40 -12.245 -5.743 -2.972 1.00 0.00 C ATOM 2096 CD2 LEU B 40 -10.450 -6.210 -4.648 1.00 0.00 C ATOM 0 H LEU B 40 -14.169 -7.149 -7.466 1.00 0.00 H new ATOM 0 HA LEU B 40 -11.461 -7.677 -6.586 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -13.724 -7.269 -4.608 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -12.281 -8.189 -4.230 1.00 0.00 H new ATOM 0 HG LEU B 40 -12.323 -5.266 -5.044 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -11.727 -4.823 -2.699 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -13.319 -5.608 -2.841 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -11.901 -6.556 -2.332 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -9.956 -5.286 -4.349 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.063 -7.037 -4.052 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -10.255 -6.401 -5.703 1.00 0.00 H new ATOM 2225 N LYS B 48 -17.144 -12.611 2.326 1.00 0.00 N ATOM 2226 CA LYS B 48 -17.522 -13.862 2.982 1.00 0.00 C ATOM 2227 C LYS B 48 -18.941 -13.799 3.541 1.00 0.00 C ATOM 2228 O LYS B 48 -19.625 -14.818 3.637 1.00 0.00 O ATOM 2229 CB LYS B 48 -16.535 -14.190 4.105 1.00 0.00 C ATOM 2230 CG LYS B 48 -15.085 -14.220 3.651 1.00 0.00 C ATOM 2231 CD LYS B 48 -14.169 -13.543 4.659 1.00 0.00 C ATOM 2232 CE LYS B 48 -13.905 -12.092 4.289 1.00 0.00 C ATOM 2233 NZ LYS B 48 -12.503 -11.882 3.831 1.00 0.00 N ATOM 0 HA LYS B 48 -17.492 -14.650 2.230 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -16.643 -13.452 4.899 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -16.793 -15.159 4.533 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -14.769 -15.253 3.508 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -14.995 -13.723 2.685 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -14.620 -13.590 5.650 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -13.224 -14.083 4.713 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -14.594 -11.787 3.501 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -14.105 -11.455 5.151 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -12.363 -10.880 3.588 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -11.846 -12.149 4.592 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -12.320 -12.470 2.993 1.00 0.00 H new ATOM 2247 N GLU B 49 -19.376 -12.600 3.912 1.00 0.00 N ATOM 2248 CA GLU B 49 -20.714 -12.410 4.465 1.00 0.00 C ATOM 2249 C GLU B 49 -20.947 -10.944 4.810 1.00 0.00 C ATOM 2250 O GLU B 49 -20.036 -10.128 4.717 1.00 0.00 O ATOM 2251 CB GLU B 49 -20.898 -13.276 5.716 1.00 0.00 C ATOM 2252 CG GLU B 49 -22.287 -13.882 5.845 1.00 0.00 C ATOM 2253 CD GLU B 49 -22.722 -14.620 4.594 1.00 0.00 C ATOM 2254 OE1 GLU B 49 -22.392 -15.817 4.464 1.00 0.00 O ATOM 2255 OE2 GLU B 49 -23.395 -13.999 3.743 1.00 0.00 O ATOM 0 H GLU B 49 -18.823 -11.746 3.840 1.00 0.00 H new ATOM 0 HA GLU B 49 -21.443 -12.712 3.713 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -20.161 -14.079 5.702 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -20.693 -12.671 6.599 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -22.302 -14.569 6.691 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -23.005 -13.092 6.064 1.00 0.00 H new ATOM 2262 N GLN B 50 -22.165 -10.613 5.212 1.00 0.00 N ATOM 2263 CA GLN B 50 -22.493 -9.239 5.572 1.00 0.00 C ATOM 2264 C GLN B 50 -21.793 -8.841 6.868 1.00 0.00 C ATOM 2265 O GLN B 50 -21.550 -7.660 7.119 1.00 0.00 O ATOM 2266 CB GLN B 50 -24.006 -9.072 5.719 1.00 0.00 C ATOM 2267 CG GLN B 50 -24.784 -9.456 4.471 1.00 0.00 C ATOM 2268 CD GLN B 50 -26.279 -9.521 4.713 1.00 0.00 C ATOM 2269 OE1 GLN B 50 -26.923 -10.529 4.423 1.00 0.00 O ATOM 2270 NE2 GLN B 50 -26.838 -8.441 5.246 1.00 0.00 N ATOM 0 H GLN B 50 -22.939 -11.271 5.297 1.00 0.00 H new ATOM 0 HA GLN B 50 -22.144 -8.585 4.773 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -24.351 -9.682 6.554 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -24.226 -8.034 5.969 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -24.579 -8.732 3.682 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -24.435 -10.425 4.114 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -26.264 -7.628 5.470 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -27.841 -8.424 5.431 1.00 0.00 H new ATOM 2279 N GLU B 51 -21.470 -9.836 7.689 1.00 0.00 N ATOM 2280 CA GLU B 51 -20.799 -9.592 8.961 1.00 0.00 C ATOM 2281 C GLU B 51 -19.313 -9.321 8.760 1.00 0.00 C ATOM 2282 O GLU B 51 -18.739 -8.451 9.414 1.00 0.00 O ATOM 2283 CB GLU B 51 -20.984 -10.783 9.905 1.00 0.00 C ATOM 2284 CG GLU B 51 -20.819 -12.136 9.232 1.00 0.00 C ATOM 2285 CD GLU B 51 -20.630 -13.262 10.228 1.00 0.00 C ATOM 2286 OE1 GLU B 51 -19.513 -13.394 10.770 1.00 0.00 O ATOM 2287 OE2 GLU B 51 -21.600 -14.013 10.468 1.00 0.00 O ATOM 0 H GLU B 51 -21.662 -10.819 7.496 1.00 0.00 H new ATOM 0 HA GLU B 51 -21.253 -8.708 9.407 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -20.264 -10.703 10.719 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -21.977 -10.729 10.351 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -21.696 -12.342 8.618 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -19.961 -12.102 8.561 1.00 0.00 H new ATOM 2294 N VAL B 52 -18.690 -10.073 7.858 1.00 0.00 N ATOM 2295 CA VAL B 52 -17.266 -9.907 7.589 1.00 0.00 C ATOM 2296 C VAL B 52 -16.974 -8.517 7.029 1.00 0.00 C ATOM 2297 O VAL B 52 -16.014 -7.864 7.439 1.00 0.00 O ATOM 2298 CB VAL B 52 -16.728 -10.989 6.618 1.00 0.00 C ATOM 2299 CG1 VAL B 52 -17.283 -12.356 6.988 1.00 0.00 C ATOM 2300 CG2 VAL B 52 -17.053 -10.652 5.170 1.00 0.00 C ATOM 0 H VAL B 52 -19.145 -10.799 7.304 1.00 0.00 H new ATOM 0 HA VAL B 52 -16.750 -10.023 8.542 1.00 0.00 H new ATOM 0 HB VAL B 52 -15.643 -11.013 6.714 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -16.896 -13.105 6.297 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -16.980 -12.609 8.004 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -18.371 -12.335 6.928 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -16.661 -11.432 4.518 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -18.134 -10.585 5.046 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -16.598 -9.697 4.908 1.00 0.00 H new ATOM 2310 N VAL B 53 -17.809 -8.068 6.094 1.00 0.00 N ATOM 2311 CA VAL B 53 -17.631 -6.752 5.484 1.00 0.00 C ATOM 2312 C VAL B 53 -17.671 -5.653 6.534 1.00 0.00 C ATOM 2313 O VAL B 53 -16.764 -4.825 6.608 1.00 0.00 O ATOM 2314 CB VAL B 53 -18.690 -6.433 4.405 1.00 0.00 C ATOM 2315 CG1 VAL B 53 -18.076 -5.565 3.319 1.00 0.00 C ATOM 2316 CG2 VAL B 53 -19.291 -7.698 3.814 1.00 0.00 C ATOM 0 H VAL B 53 -18.611 -8.592 5.744 1.00 0.00 H new ATOM 0 HA VAL B 53 -16.653 -6.786 5.003 1.00 0.00 H new ATOM 0 HB VAL B 53 -19.504 -5.885 4.880 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -18.828 -5.344 2.561 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -17.717 -4.634 3.757 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -17.242 -6.094 2.858 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -20.031 -7.431 3.059 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -18.503 -8.295 3.354 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -19.770 -8.276 4.604 1.00 0.00 H new ATOM 2326 N ASP B 54 -18.724 -5.647 7.351 1.00 0.00 N ATOM 2327 CA ASP B 54 -18.862 -4.641 8.399 1.00 0.00 C ATOM 2328 C ASP B 54 -17.560 -4.517 9.174 1.00 0.00 C ATOM 2329 O ASP B 54 -17.145 -3.420 9.549 1.00 0.00 O ATOM 2330 CB ASP B 54 -20.010 -4.997 9.345 1.00 0.00 C ATOM 2331 CG ASP B 54 -20.437 -3.822 10.203 1.00 0.00 C ATOM 2332 OD1 ASP B 54 -19.644 -3.403 11.071 1.00 0.00 O ATOM 2333 OD2 ASP B 54 -21.564 -3.322 10.005 1.00 0.00 O ATOM 0 H ASP B 54 -19.487 -6.322 7.307 1.00 0.00 H new ATOM 0 HA ASP B 54 -19.090 -3.683 7.932 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -20.862 -5.347 8.762 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -19.704 -5.822 9.989 1.00 0.00 H new ATOM 2338 N LYS B 55 -16.900 -5.651 9.374 1.00 0.00 N ATOM 2339 CA LYS B 55 -15.624 -5.674 10.060 1.00 0.00 C ATOM 2340 C LYS B 55 -14.535 -5.254 9.085 1.00 0.00 C ATOM 2341 O LYS B 55 -13.608 -4.539 9.451 1.00 0.00 O ATOM 2342 CB LYS B 55 -15.331 -7.065 10.623 1.00 0.00 C ATOM 2343 CG LYS B 55 -15.069 -7.071 12.120 1.00 0.00 C ATOM 2344 CD LYS B 55 -15.175 -8.473 12.699 1.00 0.00 C ATOM 2345 CE LYS B 55 -15.954 -8.480 14.005 1.00 0.00 C ATOM 2346 NZ LYS B 55 -15.643 -9.679 14.832 1.00 0.00 N ATOM 0 H LYS B 55 -17.232 -6.566 9.068 1.00 0.00 H new ATOM 0 HA LYS B 55 -15.654 -4.979 10.899 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -16.175 -7.721 10.407 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -14.465 -7.481 10.109 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -14.076 -6.669 12.318 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -15.783 -6.416 12.618 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -15.664 -9.129 11.979 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -14.176 -8.874 12.868 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -15.721 -7.578 14.571 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -17.022 -8.454 13.790 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -16.194 -9.645 15.713 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -15.889 -10.539 14.302 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -14.628 -9.690 15.059 1.00 0.00 H new ATOM 2360 N VAL B 56 -14.676 -5.684 7.827 1.00 0.00 N ATOM 2361 CA VAL B 56 -13.718 -5.328 6.786 1.00 0.00 C ATOM 2362 C VAL B 56 -13.566 -3.814 6.725 1.00 0.00 C ATOM 2363 O VAL B 56 -12.462 -3.286 6.855 1.00 0.00 O ATOM 2364 CB VAL B 56 -14.147 -5.856 5.399 1.00 0.00 C ATOM 2365 CG1 VAL B 56 -13.268 -5.276 4.298 1.00 0.00 C ATOM 2366 CG2 VAL B 56 -14.111 -7.378 5.364 1.00 0.00 C ATOM 0 H VAL B 56 -15.443 -6.277 7.510 1.00 0.00 H new ATOM 0 HA VAL B 56 -12.766 -5.794 7.042 1.00 0.00 H new ATOM 0 HB VAL B 56 -15.173 -5.533 5.221 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -13.591 -5.664 3.332 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -13.353 -4.189 4.299 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -12.230 -5.559 4.474 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -14.417 -7.727 4.378 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -13.098 -7.723 5.573 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -14.792 -7.775 6.117 1.00 0.00 H new ATOM 2376 N MET B 57 -14.690 -3.113 6.559 1.00 0.00 N ATOM 2377 CA MET B 57 -14.668 -1.659 6.521 1.00 0.00 C ATOM 2378 C MET B 57 -14.039 -1.144 7.813 1.00 0.00 C ATOM 2379 O MET B 57 -13.301 -0.158 7.817 1.00 0.00 O ATOM 2380 CB MET B 57 -16.097 -1.118 6.332 1.00 0.00 C ATOM 2381 CG MET B 57 -16.463 0.052 7.236 1.00 0.00 C ATOM 2382 SD MET B 57 -17.585 1.214 6.438 1.00 0.00 S ATOM 2383 CE MET B 57 -16.573 1.754 5.065 1.00 0.00 C ATOM 0 H MET B 57 -15.615 -3.528 6.450 1.00 0.00 H new ATOM 0 HA MET B 57 -14.071 -1.310 5.678 1.00 0.00 H new ATOM 0 HB2 MET B 57 -16.219 -0.809 5.294 1.00 0.00 H new ATOM 0 HB3 MET B 57 -16.804 -1.929 6.508 1.00 0.00 H new ATOM 0 HG2 MET B 57 -16.926 -0.328 8.147 1.00 0.00 H new ATOM 0 HG3 MET B 57 -15.554 0.575 7.534 1.00 0.00 H new ATOM 0 HE1 MET B 57 -17.194 1.864 4.176 1.00 0.00 H new ATOM 0 HE2 MET B 57 -16.113 2.712 5.307 1.00 0.00 H new ATOM 0 HE3 MET B 57 -15.794 1.015 4.874 1.00 0.00 H new ATOM 2393 N GLU B 58 -14.333 -1.844 8.902 1.00 0.00 N ATOM 2394 CA GLU B 58 -13.797 -1.501 10.211 1.00 0.00 C ATOM 2395 C GLU B 58 -12.290 -1.736 10.240 1.00 0.00 C ATOM 2396 O GLU B 58 -11.542 -0.978 10.856 1.00 0.00 O ATOM 2397 CB GLU B 58 -14.486 -2.340 11.293 1.00 0.00 C ATOM 2398 CG GLU B 58 -15.335 -1.520 12.251 1.00 0.00 C ATOM 2399 CD GLU B 58 -14.775 -1.502 13.661 1.00 0.00 C ATOM 2400 OE1 GLU B 58 -14.325 -2.566 14.134 1.00 0.00 O ATOM 2401 OE2 GLU B 58 -14.789 -0.424 14.290 1.00 0.00 O ATOM 0 H GLU B 58 -14.945 -2.660 8.902 1.00 0.00 H new ATOM 0 HA GLU B 58 -13.988 -0.446 10.407 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -15.116 -3.090 10.814 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -13.727 -2.877 11.862 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -15.409 -0.498 11.881 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -16.347 -1.925 12.271 1.00 0.00 H new ATOM 2408 N THR B 59 -11.854 -2.790 9.554 1.00 0.00 N ATOM 2409 CA THR B 59 -10.438 -3.131 9.480 1.00 0.00 C ATOM 2410 C THR B 59 -9.662 -2.017 8.782 1.00 0.00 C ATOM 2411 O THR B 59 -8.458 -1.863 8.985 1.00 0.00 O ATOM 2412 CB THR B 59 -10.251 -4.455 8.729 1.00 0.00 C ATOM 2413 OG1 THR B 59 -11.432 -5.229 8.769 1.00 0.00 O ATOM 2414 CG2 THR B 59 -9.132 -5.313 9.278 1.00 0.00 C ATOM 0 H THR B 59 -12.465 -3.424 9.040 1.00 0.00 H new ATOM 0 HA THR B 59 -10.053 -3.244 10.493 1.00 0.00 H new ATOM 0 HB THR B 59 -9.998 -4.164 7.710 1.00 0.00 H new ATOM 0 HG1 THR B 59 -11.978 -4.953 9.535 1.00 0.00 H new ATOM 0 HG21 THR B 59 -9.060 -6.232 8.697 1.00 0.00 H new ATOM 0 HG22 THR B 59 -8.190 -4.768 9.213 1.00 0.00 H new ATOM 0 HG23 THR B 59 -9.339 -5.558 10.320 1.00 0.00 H new ATOM 2422 N LEU B 60 -10.368 -1.241 7.962 1.00 0.00 N ATOM 2423 CA LEU B 60 -9.758 -0.135 7.234 1.00 0.00 C ATOM 2424 C LEU B 60 -9.813 1.150 8.056 1.00 0.00 C ATOM 2425 O LEU B 60 -8.950 2.017 7.928 1.00 0.00 O ATOM 2426 CB LEU B 60 -10.476 0.075 5.899 1.00 0.00 C ATOM 2427 CG LEU B 60 -9.923 -0.739 4.726 1.00 0.00 C ATOM 2428 CD1 LEU B 60 -10.879 -1.863 4.355 1.00 0.00 C ATOM 2429 CD2 LEU B 60 -9.668 0.162 3.527 1.00 0.00 C ATOM 0 H LEU B 60 -11.366 -1.360 7.786 1.00 0.00 H new ATOM 0 HA LEU B 60 -8.714 -0.384 7.047 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -11.529 -0.174 6.028 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -10.427 1.133 5.641 1.00 0.00 H new ATOM 0 HG LEU B 60 -8.976 -1.183 5.032 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -10.468 -2.429 3.519 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -11.013 -2.524 5.211 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -11.842 -1.441 4.068 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -9.275 -0.432 2.702 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -10.602 0.634 3.222 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -8.944 0.931 3.797 1.00 0.00 H new ATOM 2441 N ASP B 61 -10.840 1.265 8.895 1.00 0.00 N ATOM 2442 CA ASP B 61 -11.018 2.445 9.737 1.00 0.00 C ATOM 2443 C ASP B 61 -9.732 2.793 10.483 1.00 0.00 C ATOM 2444 O ASP B 61 -9.402 2.177 11.495 1.00 0.00 O ATOM 2445 CB ASP B 61 -12.151 2.214 10.739 1.00 0.00 C ATOM 2446 CG ASP B 61 -13.500 2.635 10.192 1.00 0.00 C ATOM 2447 OD1 ASP B 61 -13.769 2.366 9.003 1.00 0.00 O ATOM 2448 OD2 ASP B 61 -14.289 3.234 10.953 1.00 0.00 O ATOM 0 H ASP B 61 -11.562 0.554 9.010 1.00 0.00 H new ATOM 0 HA ASP B 61 -11.274 3.282 9.088 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -12.185 1.158 11.009 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -11.943 2.770 11.653 1.00 0.00 H new ATOM 2453 N ASN B 62 -9.014 3.788 9.974 1.00 0.00 N ATOM 2454 CA ASN B 62 -7.766 4.224 10.591 1.00 0.00 C ATOM 2455 C ASN B 62 -7.836 5.704 10.951 1.00 0.00 C ATOM 2456 O ASN B 62 -7.351 6.124 12.002 1.00 0.00 O ATOM 2457 CB ASN B 62 -6.590 3.969 9.648 1.00 0.00 C ATOM 2458 CG ASN B 62 -5.299 3.691 10.395 1.00 0.00 C ATOM 2459 OD1 ASN B 62 -4.285 4.353 10.172 1.00 0.00 O ATOM 2460 ND2 ASN B 62 -5.331 2.708 11.286 1.00 0.00 N ATOM 0 H ASN B 62 -9.274 4.308 9.136 1.00 0.00 H new ATOM 0 HA ASN B 62 -7.616 3.650 11.505 1.00 0.00 H new ATOM 0 HB2 ASN B 62 -6.823 3.122 9.002 1.00 0.00 H new ATOM 0 HB3 ASN B 62 -6.453 4.835 9.001 1.00 0.00 H new ATOM 0 HD21 ASN B 62 -4.493 2.475 11.819 1.00 0.00 H new ATOM 0 HD22 ASN B 62 -6.194 2.186 11.438 1.00 0.00 H new ATOM 2467 N ASP B 63 -8.445 6.488 10.070 1.00 0.00 N ATOM 2468 CA ASP B 63 -8.588 7.922 10.284 1.00 0.00 C ATOM 2469 C ASP B 63 -9.486 8.535 9.213 1.00 0.00 C ATOM 2470 O ASP B 63 -9.203 9.611 8.688 1.00 0.00 O ATOM 2471 CB ASP B 63 -7.214 8.599 10.278 1.00 0.00 C ATOM 2472 CG ASP B 63 -6.917 9.318 11.580 1.00 0.00 C ATOM 2473 OD1 ASP B 63 -7.834 9.973 12.118 1.00 0.00 O ATOM 2474 OD2 ASP B 63 -5.769 9.224 12.061 1.00 0.00 O ATOM 0 H ASP B 63 -8.850 6.152 9.196 1.00 0.00 H new ATOM 0 HA ASP B 63 -9.052 8.083 11.257 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -6.444 7.850 10.096 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -7.167 9.311 9.454 1.00 0.00 H new ATOM 2479 N GLY B 64 -10.574 7.837 8.894 1.00 0.00 N ATOM 2480 CA GLY B 64 -11.499 8.326 7.889 1.00 0.00 C ATOM 2481 C GLY B 64 -12.737 8.961 8.493 1.00 0.00 C ATOM 2482 O GLY B 64 -13.666 9.333 7.775 1.00 0.00 O ATOM 0 H GLY B 64 -10.830 6.943 9.314 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -10.992 9.056 7.259 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -11.797 7.500 7.243 1.00 0.00 H new ATOM 2486 N ASP B 65 -12.754 9.084 9.816 1.00 0.00 N ATOM 2487 CA ASP B 65 -13.890 9.676 10.517 1.00 0.00 C ATOM 2488 C ASP B 65 -15.088 8.736 10.497 1.00 0.00 C ATOM 2489 O ASP B 65 -16.234 9.171 10.624 1.00 0.00 O ATOM 2490 CB ASP B 65 -14.270 11.021 9.892 1.00 0.00 C ATOM 2491 CG ASP B 65 -14.750 12.024 10.924 1.00 0.00 C ATOM 2492 OD1 ASP B 65 -15.459 11.612 11.866 1.00 0.00 O ATOM 2493 OD2 ASP B 65 -14.415 13.219 10.791 1.00 0.00 O ATOM 0 H ASP B 65 -11.994 8.782 10.426 1.00 0.00 H new ATOM 0 HA ASP B 65 -13.595 9.842 11.553 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -13.408 11.430 9.365 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -15.053 10.865 9.149 1.00 0.00 H new ATOM 2498 N GLY B 66 -14.819 7.444 10.341 1.00 0.00 N ATOM 2499 CA GLY B 66 -15.884 6.464 10.313 1.00 0.00 C ATOM 2500 C GLY B 66 -15.909 5.659 9.030 1.00 0.00 C ATOM 2501 O GLY B 66 -16.255 4.477 9.039 1.00 0.00 O ATOM 0 H GLY B 66 -13.880 7.060 10.233 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -15.770 5.786 11.159 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -16.841 6.971 10.437 1.00 0.00 H new ATOM 2505 N GLU B 67 -15.541 6.293 7.920 1.00 0.00 N ATOM 2506 CA GLU B 67 -15.524 5.620 6.635 1.00 0.00 C ATOM 2507 C GLU B 67 -14.099 5.315 6.210 1.00 0.00 C ATOM 2508 O GLU B 67 -13.150 5.581 6.947 1.00 0.00 O ATOM 2509 CB GLU B 67 -16.218 6.472 5.575 1.00 0.00 C ATOM 2510 CG GLU B 67 -17.574 5.932 5.172 1.00 0.00 C ATOM 2511 CD GLU B 67 -18.720 6.687 5.817 1.00 0.00 C ATOM 2512 OE1 GLU B 67 -19.023 7.810 5.361 1.00 0.00 O ATOM 2513 OE2 GLU B 67 -19.314 6.155 6.779 1.00 0.00 O ATOM 0 H GLU B 67 -15.252 7.271 7.890 1.00 0.00 H new ATOM 0 HA GLU B 67 -16.065 4.679 6.736 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -16.336 7.487 5.954 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -15.581 6.533 4.693 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -17.674 5.985 4.088 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -17.638 4.879 5.447 1.00 0.00 H new ATOM 2520 N CYS B 68 -13.954 4.753 5.022 1.00 0.00 N ATOM 2521 CA CYS B 68 -12.635 4.409 4.509 1.00 0.00 C ATOM 2522 C CYS B 68 -12.282 5.227 3.279 1.00 0.00 C ATOM 2523 O CYS B 68 -12.875 5.054 2.226 1.00 0.00 O ATOM 2524 CB CYS B 68 -12.566 2.922 4.161 1.00 0.00 C ATOM 2525 SG CYS B 68 -13.246 1.832 5.432 1.00 0.00 S ATOM 0 H CYS B 68 -14.727 4.526 4.396 1.00 0.00 H new ATOM 0 HA CYS B 68 -11.915 4.636 5.295 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -13.104 2.753 3.228 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -11.526 2.650 3.983 1.00 0.00 H new ATOM 0 HG CYS B 68 -13.339 0.623 4.963 1.00 0.00 H new ATOM 2531 N ASP B 69 -11.291 6.098 3.407 1.00 0.00 N ATOM 2532 CA ASP B 69 -10.852 6.906 2.280 1.00 0.00 C ATOM 2533 C ASP B 69 -9.586 6.295 1.686 1.00 0.00 C ATOM 2534 O ASP B 69 -9.170 5.210 2.092 1.00 0.00 O ATOM 2535 CB ASP B 69 -10.606 8.362 2.689 1.00 0.00 C ATOM 2536 CG ASP B 69 -10.117 8.515 4.118 1.00 0.00 C ATOM 2537 OD1 ASP B 69 -10.750 7.942 5.031 1.00 0.00 O ATOM 2538 OD2 ASP B 69 -9.101 9.212 4.324 1.00 0.00 O ATOM 0 H ASP B 69 -10.779 6.262 4.274 1.00 0.00 H new ATOM 0 HA ASP B 69 -11.643 6.912 1.530 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -9.873 8.802 2.013 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -11.530 8.926 2.567 1.00 0.00 H new ATOM 2543 N PHE B 70 -8.975 6.980 0.728 1.00 0.00 N ATOM 2544 CA PHE B 70 -7.759 6.480 0.095 1.00 0.00 C ATOM 2545 C PHE B 70 -6.696 6.123 1.130 1.00 0.00 C ATOM 2546 O PHE B 70 -5.896 5.206 0.928 1.00 0.00 O ATOM 2547 CB PHE B 70 -7.204 7.521 -0.874 1.00 0.00 C ATOM 2548 CG PHE B 70 -6.086 6.995 -1.718 1.00 0.00 C ATOM 2549 CD1 PHE B 70 -6.340 6.073 -2.714 1.00 0.00 C ATOM 2550 CD2 PHE B 70 -4.785 7.415 -1.511 1.00 0.00 C ATOM 2551 CE1 PHE B 70 -5.316 5.575 -3.495 1.00 0.00 C ATOM 2552 CE2 PHE B 70 -3.753 6.924 -2.288 1.00 0.00 C ATOM 2553 CZ PHE B 70 -4.019 6.002 -3.282 1.00 0.00 C ATOM 0 H PHE B 70 -9.299 7.880 0.373 1.00 0.00 H new ATOM 0 HA PHE B 70 -8.019 5.574 -0.452 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -8.007 7.871 -1.522 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -6.851 8.384 -0.309 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -7.352 5.737 -2.884 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -4.573 8.134 -0.734 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -5.528 4.854 -4.270 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -2.741 7.260 -2.119 1.00 0.00 H new ATOM 0 HZ PHE B 70 -3.215 5.616 -3.891 1.00 0.00 H new ATOM 2563 N GLN B 71 -6.693 6.853 2.236 1.00 0.00 N ATOM 2564 CA GLN B 71 -5.725 6.615 3.302 1.00 0.00 C ATOM 2565 C GLN B 71 -5.821 5.179 3.812 1.00 0.00 C ATOM 2566 O GLN B 71 -4.809 4.541 4.108 1.00 0.00 O ATOM 2567 CB GLN B 71 -5.942 7.604 4.453 1.00 0.00 C ATOM 2568 CG GLN B 71 -7.109 7.250 5.365 1.00 0.00 C ATOM 2569 CD GLN B 71 -7.194 8.155 6.578 1.00 0.00 C ATOM 2570 OE1 GLN B 71 -6.978 7.719 7.709 1.00 0.00 O ATOM 2571 NE2 GLN B 71 -7.510 9.424 6.349 1.00 0.00 N ATOM 0 H GLN B 71 -7.347 7.614 2.420 1.00 0.00 H new ATOM 0 HA GLN B 71 -4.726 6.767 2.894 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -5.031 7.656 5.050 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -6.108 8.598 4.037 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -8.039 7.316 4.801 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -7.008 6.216 5.694 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -7.681 9.743 5.395 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -7.582 10.080 7.127 1.00 0.00 H new ATOM 2580 N GLU B 72 -7.046 4.678 3.908 1.00 0.00 N ATOM 2581 CA GLU B 72 -7.278 3.319 4.376 1.00 0.00 C ATOM 2582 C GLU B 72 -6.923 2.312 3.290 1.00 0.00 C ATOM 2583 O GLU B 72 -6.551 1.176 3.581 1.00 0.00 O ATOM 2584 CB GLU B 72 -8.733 3.139 4.810 1.00 0.00 C ATOM 2585 CG GLU B 72 -9.290 4.323 5.583 1.00 0.00 C ATOM 2586 CD GLU B 72 -8.511 4.626 6.851 1.00 0.00 C ATOM 2587 OE1 GLU B 72 -7.306 4.307 6.903 1.00 0.00 O ATOM 2588 OE2 GLU B 72 -9.110 5.187 7.792 1.00 0.00 O ATOM 0 H GLU B 72 -7.893 5.193 3.668 1.00 0.00 H new ATOM 0 HA GLU B 72 -6.636 3.141 5.238 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -9.349 2.971 3.926 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -8.811 2.244 5.427 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -9.284 5.204 4.941 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -10.330 4.124 5.841 1.00 0.00 H new ATOM 2595 N PHE B 73 -7.023 2.743 2.034 1.00 0.00 N ATOM 2596 CA PHE B 73 -6.693 1.883 0.902 1.00 0.00 C ATOM 2597 C PHE B 73 -5.317 1.274 1.106 1.00 0.00 C ATOM 2598 O PHE B 73 -5.150 0.054 1.065 1.00 0.00 O ATOM 2599 CB PHE B 73 -6.715 2.694 -0.399 1.00 0.00 C ATOM 2600 CG PHE B 73 -7.616 2.141 -1.468 1.00 0.00 C ATOM 2601 CD1 PHE B 73 -7.902 0.785 -1.543 1.00 0.00 C ATOM 2602 CD2 PHE B 73 -8.172 2.988 -2.410 1.00 0.00 C ATOM 2603 CE1 PHE B 73 -8.728 0.292 -2.537 1.00 0.00 C ATOM 2604 CE2 PHE B 73 -8.995 2.504 -3.404 1.00 0.00 C ATOM 2605 CZ PHE B 73 -9.275 1.154 -3.469 1.00 0.00 C ATOM 0 H PHE B 73 -7.329 3.681 1.776 1.00 0.00 H new ATOM 0 HA PHE B 73 -7.433 1.086 0.834 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -7.027 3.713 -0.171 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -5.700 2.752 -0.792 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -7.475 0.108 -0.818 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -7.958 4.046 -2.366 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -8.945 -0.765 -2.585 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -9.420 3.180 -4.131 1.00 0.00 H new ATOM 0 HZ PHE B 73 -9.920 0.772 -4.246 1.00 0.00 H new ATOM 2615 N MET B 74 -4.338 2.136 1.345 1.00 0.00 N ATOM 2616 CA MET B 74 -2.975 1.686 1.578 1.00 0.00 C ATOM 2617 C MET B 74 -2.922 0.805 2.817 1.00 0.00 C ATOM 2618 O MET B 74 -2.430 -0.321 2.766 1.00 0.00 O ATOM 2619 CB MET B 74 -2.043 2.884 1.741 1.00 0.00 C ATOM 2620 CG MET B 74 -2.096 3.850 0.571 1.00 0.00 C ATOM 2621 SD MET B 74 -1.681 3.058 -0.996 1.00 0.00 S ATOM 2622 CE MET B 74 -1.536 4.484 -2.070 1.00 0.00 C ATOM 0 H MET B 74 -4.463 3.148 1.382 1.00 0.00 H new ATOM 0 HA MET B 74 -2.645 1.104 0.718 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.304 3.417 2.655 1.00 0.00 H new ATOM 0 HB3 MET B 74 -1.020 2.526 1.862 1.00 0.00 H new ATOM 0 HG2 MET B 74 -3.095 4.280 0.504 1.00 0.00 H new ATOM 0 HG3 MET B 74 -1.406 4.674 0.752 1.00 0.00 H new ATOM 0 HE1 MET B 74 -2.039 4.280 -3.015 1.00 0.00 H new ATOM 0 HE2 MET B 74 -1.998 5.348 -1.592 1.00 0.00 H new ATOM 0 HE3 MET B 74 -0.483 4.693 -2.257 1.00 0.00 H new ATOM 2632 N ALA B 75 -3.449 1.316 3.927 1.00 0.00 N ATOM 2633 CA ALA B 75 -3.476 0.564 5.175 1.00 0.00 C ATOM 2634 C ALA B 75 -4.064 -0.825 4.954 1.00 0.00 C ATOM 2635 O ALA B 75 -3.595 -1.810 5.522 1.00 0.00 O ATOM 2636 CB ALA B 75 -4.281 1.316 6.224 1.00 0.00 C ATOM 0 H ALA B 75 -3.862 2.247 3.986 1.00 0.00 H new ATOM 0 HA ALA B 75 -2.452 0.451 5.531 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -4.294 0.744 7.152 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -3.825 2.289 6.404 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -5.302 1.454 5.869 1.00 0.00 H new ATOM 2642 N PHE B 76 -5.090 -0.892 4.115 1.00 0.00 N ATOM 2643 CA PHE B 76 -5.747 -2.154 3.802 1.00 0.00 C ATOM 2644 C PHE B 76 -4.808 -3.076 3.038 1.00 0.00 C ATOM 2645 O PHE B 76 -4.312 -4.063 3.582 1.00 0.00 O ATOM 2646 CB PHE B 76 -7.003 -1.902 2.976 1.00 0.00 C ATOM 2647 CG PHE B 76 -7.861 -3.118 2.800 1.00 0.00 C ATOM 2648 CD1 PHE B 76 -8.550 -3.660 3.872 1.00 0.00 C ATOM 2649 CD2 PHE B 76 -7.977 -3.719 1.560 1.00 0.00 C ATOM 2650 CE1 PHE B 76 -9.340 -4.780 3.709 1.00 0.00 C ATOM 2651 CE2 PHE B 76 -8.765 -4.840 1.388 1.00 0.00 C ATOM 2652 CZ PHE B 76 -9.448 -5.372 2.465 1.00 0.00 C ATOM 0 H PHE B 76 -5.486 -0.083 3.637 1.00 0.00 H new ATOM 0 HA PHE B 76 -6.023 -2.636 4.740 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.591 -1.119 3.455 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -6.713 -1.528 1.994 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.468 -3.201 4.846 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.445 -3.307 0.716 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -9.873 -5.193 4.553 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -8.847 -5.300 0.414 1.00 0.00 H new ATOM 0 HZ PHE B 76 -10.065 -6.249 2.335 1.00 0.00 H new ATOM 2662 N VAL B 77 -4.564 -2.749 1.771 1.00 0.00 N ATOM 2663 CA VAL B 77 -3.678 -3.552 0.936 1.00 0.00 C ATOM 2664 C VAL B 77 -2.329 -3.772 1.613 1.00 0.00 C ATOM 2665 O VAL B 77 -1.640 -4.754 1.343 1.00 0.00 O ATOM 2666 CB VAL B 77 -3.439 -2.892 -0.436 1.00 0.00 C ATOM 2667 CG1 VAL B 77 -4.574 -3.218 -1.394 1.00 0.00 C ATOM 2668 CG2 VAL B 77 -3.266 -1.386 -0.290 1.00 0.00 C ATOM 0 H VAL B 77 -4.966 -1.937 1.303 1.00 0.00 H new ATOM 0 HA VAL B 77 -4.175 -4.511 0.791 1.00 0.00 H new ATOM 0 HB VAL B 77 -2.517 -3.297 -0.853 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -4.386 -2.742 -2.357 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -4.637 -4.298 -1.529 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -5.514 -2.848 -0.984 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -3.099 -0.942 -1.271 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -4.165 -0.958 0.153 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -2.410 -1.179 0.353 1.00 0.00 H new ATOM 2678 N ALA B 78 -1.958 -2.845 2.488 1.00 0.00 N ATOM 2679 CA ALA B 78 -0.684 -2.930 3.198 1.00 0.00 C ATOM 2680 C ALA B 78 -0.763 -3.866 4.400 1.00 0.00 C ATOM 2681 O ALA B 78 0.061 -4.768 4.548 1.00 0.00 O ATOM 2682 CB ALA B 78 -0.230 -1.547 3.642 1.00 0.00 C ATOM 0 H ALA B 78 -2.519 -2.026 2.724 1.00 0.00 H new ATOM 0 HA ALA B 78 0.048 -3.343 2.504 1.00 0.00 H new ATOM 0 HB1 ALA B 78 0.720 -1.628 4.169 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -0.107 -0.907 2.769 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -0.978 -1.114 4.307 1.00 0.00 H new ATOM 2688 N MET B 79 -1.755 -3.649 5.257 1.00 0.00 N ATOM 2689 CA MET B 79 -1.926 -4.480 6.442 1.00 0.00 C ATOM 2690 C MET B 79 -2.268 -5.907 6.039 1.00 0.00 C ATOM 2691 O MET B 79 -1.689 -6.869 6.547 1.00 0.00 O ATOM 2692 CB MET B 79 -3.023 -3.908 7.342 1.00 0.00 C ATOM 2693 CG MET B 79 -2.602 -2.657 8.096 1.00 0.00 C ATOM 2694 SD MET B 79 -3.807 -2.158 9.341 1.00 0.00 S ATOM 2695 CE MET B 79 -5.307 -2.124 8.362 1.00 0.00 C ATOM 0 H MET B 79 -2.449 -2.909 5.154 1.00 0.00 H new ATOM 0 HA MET B 79 -0.989 -4.487 6.999 1.00 0.00 H new ATOM 0 HB2 MET B 79 -3.897 -3.678 6.733 1.00 0.00 H new ATOM 0 HB3 MET B 79 -3.326 -4.670 8.060 1.00 0.00 H new ATOM 0 HG2 MET B 79 -1.640 -2.834 8.577 1.00 0.00 H new ATOM 0 HG3 MET B 79 -2.459 -1.841 7.387 1.00 0.00 H new ATOM 0 HE1 MET B 79 -6.089 -1.601 8.913 1.00 0.00 H new ATOM 0 HE2 MET B 79 -5.116 -1.606 7.422 1.00 0.00 H new ATOM 0 HE3 MET B 79 -5.630 -3.144 8.155 1.00 0.00 H new ATOM 2705 N VAL B 80 -3.204 -6.031 5.109 1.00 0.00 N ATOM 2706 CA VAL B 80 -3.628 -7.328 4.611 1.00 0.00 C ATOM 2707 C VAL B 80 -2.456 -8.064 3.968 1.00 0.00 C ATOM 2708 O VAL B 80 -2.348 -9.288 4.056 1.00 0.00 O ATOM 2709 CB VAL B 80 -4.769 -7.167 3.585 1.00 0.00 C ATOM 2710 CG1 VAL B 80 -5.077 -8.487 2.887 1.00 0.00 C ATOM 2711 CG2 VAL B 80 -6.014 -6.613 4.261 1.00 0.00 C ATOM 0 H VAL B 80 -3.687 -5.240 4.682 1.00 0.00 H new ATOM 0 HA VAL B 80 -3.992 -7.913 5.456 1.00 0.00 H new ATOM 0 HB VAL B 80 -4.441 -6.459 2.824 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -5.885 -8.340 2.171 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -4.188 -8.838 2.364 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.379 -9.228 3.627 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -6.810 -6.505 3.525 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -6.336 -7.297 5.046 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -5.789 -5.640 4.697 1.00 0.00 H new ATOM 2721 N THR B 81 -1.580 -7.302 3.324 1.00 0.00 N ATOM 2722 CA THR B 81 -0.410 -7.862 2.661 1.00 0.00 C ATOM 2723 C THR B 81 0.620 -8.346 3.679 1.00 0.00 C ATOM 2724 O THR B 81 1.012 -9.514 3.675 1.00 0.00 O ATOM 2725 CB THR B 81 0.209 -6.807 1.728 1.00 0.00 C ATOM 2726 OG1 THR B 81 -0.474 -6.778 0.488 1.00 0.00 O ATOM 2727 CG2 THR B 81 1.683 -7.019 1.429 1.00 0.00 C ATOM 0 H THR B 81 -1.660 -6.288 3.247 1.00 0.00 H new ATOM 0 HA THR B 81 -0.723 -8.724 2.071 1.00 0.00 H new ATOM 0 HB THR B 81 0.109 -5.868 2.272 1.00 0.00 H new ATOM 0 HG1 THR B 81 -1.170 -6.089 0.514 1.00 0.00 H new ATOM 0 HG21 THR B 81 2.037 -6.230 0.765 1.00 0.00 H new ATOM 0 HG22 THR B 81 2.251 -6.992 2.359 1.00 0.00 H new ATOM 0 HG23 THR B 81 1.821 -7.987 0.948 1.00 0.00 H new ATOM 2735 N THR B 82 1.067 -7.431 4.533 1.00 0.00 N ATOM 2736 CA THR B 82 2.072 -7.740 5.545 1.00 0.00 C ATOM 2737 C THR B 82 1.752 -9.013 6.318 1.00 0.00 C ATOM 2738 O THR B 82 2.654 -9.664 6.844 1.00 0.00 O ATOM 2739 CB THR B 82 2.224 -6.569 6.516 1.00 0.00 C ATOM 2740 OG1 THR B 82 0.962 -6.164 7.015 1.00 0.00 O ATOM 2741 CG2 THR B 82 2.883 -5.358 5.895 1.00 0.00 C ATOM 0 H THR B 82 0.747 -6.463 4.544 1.00 0.00 H new ATOM 0 HA THR B 82 3.011 -7.907 5.017 1.00 0.00 H new ATOM 0 HB THR B 82 2.864 -6.939 7.317 1.00 0.00 H new ATOM 0 HG1 THR B 82 0.266 -6.761 6.669 1.00 0.00 H new ATOM 0 HG21 THR B 82 2.960 -4.564 6.638 1.00 0.00 H new ATOM 0 HG22 THR B 82 3.880 -5.626 5.546 1.00 0.00 H new ATOM 0 HG23 THR B 82 2.285 -5.010 5.053 1.00 0.00 H new ATOM 2749 N ALA B 83 0.479 -9.370 6.396 1.00 0.00 N ATOM 2750 CA ALA B 83 0.090 -10.570 7.120 1.00 0.00 C ATOM 2751 C ALA B 83 0.271 -11.819 6.269 1.00 0.00 C ATOM 2752 O ALA B 83 1.167 -12.625 6.515 1.00 0.00 O ATOM 2753 CB ALA B 83 -1.349 -10.473 7.598 1.00 0.00 C ATOM 0 H ALA B 83 -0.293 -8.854 5.973 1.00 0.00 H new ATOM 0 HA ALA B 83 0.745 -10.650 7.987 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -1.616 -11.382 8.136 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -1.455 -9.614 8.261 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -2.010 -10.352 6.740 1.00 0.00 H new ATOM 2759 N CYS B 84 -0.598 -11.985 5.279 1.00 0.00 N ATOM 2760 CA CYS B 84 -0.542 -13.154 4.408 1.00 0.00 C ATOM 2761 C CYS B 84 0.362 -12.943 3.203 1.00 0.00 C ATOM 2762 O CYS B 84 1.245 -13.757 2.936 1.00 0.00 O ATOM 2763 CB CYS B 84 -1.947 -13.560 3.952 1.00 0.00 C ATOM 2764 SG CYS B 84 -2.936 -12.206 3.275 1.00 0.00 S ATOM 0 H CYS B 84 -1.347 -11.328 5.059 1.00 0.00 H new ATOM 0 HA CYS B 84 -0.110 -13.962 4.998 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -1.859 -14.341 3.197 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -2.479 -13.994 4.799 1.00 0.00 H new ATOM 0 HG CYS B 84 -2.403 -11.069 3.611 1.00 0.00 H new ATOM 2770 N HIS B 85 0.145 -11.857 2.469 1.00 0.00 N ATOM 2771 CA HIS B 85 0.958 -11.576 1.292 1.00 0.00 C ATOM 2772 C HIS B 85 2.445 -11.600 1.640 1.00 0.00 C ATOM 2773 O HIS B 85 3.295 -11.723 0.758 1.00 0.00 O ATOM 2774 CB HIS B 85 0.575 -10.228 0.682 1.00 0.00 C ATOM 2775 CG HIS B 85 0.977 -10.086 -0.753 1.00 0.00 C ATOM 2776 ND1 HIS B 85 0.068 -9.924 -1.777 1.00 0.00 N ATOM 2777 CD2 HIS B 85 2.201 -10.085 -1.335 1.00 0.00 C ATOM 2778 CE1 HIS B 85 0.714 -9.831 -2.925 1.00 0.00 C ATOM 2779 NE2 HIS B 85 2.008 -9.924 -2.684 1.00 0.00 N ATOM 0 H HIS B 85 -0.578 -11.165 2.665 1.00 0.00 H new ATOM 0 HA HIS B 85 0.767 -12.356 0.555 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -0.504 -10.095 0.764 1.00 0.00 H new ATOM 0 HB3 HIS B 85 1.040 -9.431 1.262 1.00 0.00 H new ATOM 0 HD1 HIS B 85 -0.945 -9.882 -1.665 1.00 0.00 H new ATOM 0 HD2 HIS B 85 3.150 -10.191 -0.831 1.00 0.00 H new ATOM 0 HE1 HIS B 85 0.260 -9.701 -3.896 1.00 0.00 H new ATOM 2788 N GLU B 86 2.746 -11.490 2.932 1.00 0.00 N ATOM 2789 CA GLU B 86 4.122 -11.506 3.411 1.00 0.00 C ATOM 2790 C GLU B 86 4.932 -12.608 2.739 1.00 0.00 C ATOM 2791 O GLU B 86 5.877 -12.336 2.001 1.00 0.00 O ATOM 2792 CB GLU B 86 4.133 -11.703 4.928 1.00 0.00 C ATOM 2793 CG GLU B 86 4.898 -10.625 5.677 1.00 0.00 C ATOM 2794 CD GLU B 86 6.400 -10.776 5.540 1.00 0.00 C ATOM 2795 OE1 GLU B 86 6.947 -11.774 6.053 1.00 0.00 O ATOM 2796 OE2 GLU B 86 7.032 -9.896 4.917 1.00 0.00 O ATOM 0 H GLU B 86 2.048 -11.388 3.669 1.00 0.00 H new ATOM 0 HA GLU B 86 4.583 -10.551 3.159 1.00 0.00 H new ATOM 0 HB2 GLU B 86 3.105 -11.725 5.290 1.00 0.00 H new ATOM 0 HB3 GLU B 86 4.573 -12.674 5.157 1.00 0.00 H new ATOM 0 HG2 GLU B 86 4.599 -9.646 5.303 1.00 0.00 H new ATOM 0 HG3 GLU B 86 4.628 -10.659 6.732 1.00 0.00 H new ATOM 2803 N PHE B 87 4.544 -13.847 2.994 1.00 0.00 N ATOM 2804 CA PHE B 87 5.220 -14.994 2.408 1.00 0.00 C ATOM 2805 C PHE B 87 4.232 -15.831 1.604 1.00 0.00 C ATOM 2806 O PHE B 87 4.606 -16.488 0.632 1.00 0.00 O ATOM 2807 CB PHE B 87 5.884 -15.841 3.496 1.00 0.00 C ATOM 2808 CG PHE B 87 7.360 -16.050 3.282 1.00 0.00 C ATOM 2809 CD1 PHE B 87 8.166 -15.020 2.814 1.00 0.00 C ATOM 2810 CD2 PHE B 87 7.940 -17.279 3.550 1.00 0.00 C ATOM 2811 CE1 PHE B 87 9.521 -15.216 2.619 1.00 0.00 C ATOM 2812 CE2 PHE B 87 9.294 -17.481 3.355 1.00 0.00 C ATOM 2813 CZ PHE B 87 10.084 -16.448 2.891 1.00 0.00 C ATOM 0 H PHE B 87 3.762 -14.085 3.605 1.00 0.00 H new ATOM 0 HA PHE B 87 5.999 -14.634 1.736 1.00 0.00 H new ATOM 0 HB2 PHE B 87 5.730 -15.361 4.463 1.00 0.00 H new ATOM 0 HB3 PHE B 87 5.391 -16.812 3.540 1.00 0.00 H new ATOM 0 HD1 PHE B 87 7.730 -14.056 2.600 1.00 0.00 H new ATOM 0 HD2 PHE B 87 7.327 -18.090 3.916 1.00 0.00 H new ATOM 0 HE1 PHE B 87 10.138 -14.408 2.255 1.00 0.00 H new ATOM 0 HE2 PHE B 87 9.733 -18.445 3.565 1.00 0.00 H new ATOM 0 HZ PHE B 87 11.142 -16.603 2.741 1.00 0.00 H new ATOM 2823 N PHE B 88 2.964 -15.788 2.006 1.00 0.00 N ATOM 2824 CA PHE B 88 1.922 -16.527 1.312 1.00 0.00 C ATOM 2825 C PHE B 88 1.534 -15.812 0.019 1.00 0.00 C ATOM 2826 O PHE B 88 0.969 -16.424 -0.888 1.00 0.00 O ATOM 2827 CB PHE B 88 0.691 -16.704 2.208 1.00 0.00 C ATOM 2828 CG PHE B 88 0.857 -17.780 3.243 1.00 0.00 C ATOM 2829 CD1 PHE B 88 1.527 -17.522 4.428 1.00 0.00 C ATOM 2830 CD2 PHE B 88 0.344 -19.050 3.029 1.00 0.00 C ATOM 2831 CE1 PHE B 88 1.681 -18.511 5.381 1.00 0.00 C ATOM 2832 CE2 PHE B 88 0.496 -20.042 3.978 1.00 0.00 C ATOM 2833 CZ PHE B 88 1.165 -19.772 5.156 1.00 0.00 C ATOM 0 H PHE B 88 2.637 -15.249 2.808 1.00 0.00 H new ATOM 0 HA PHE B 88 2.312 -17.514 1.065 1.00 0.00 H new ATOM 0 HB2 PHE B 88 0.476 -15.760 2.708 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -0.172 -16.939 1.585 1.00 0.00 H new ATOM 0 HD1 PHE B 88 1.933 -16.538 4.609 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -0.180 -19.266 2.110 1.00 0.00 H new ATOM 0 HE1 PHE B 88 2.205 -18.298 6.301 1.00 0.00 H new ATOM 0 HE2 PHE B 88 0.092 -21.028 3.799 1.00 0.00 H new ATOM 0 HZ PHE B 88 1.284 -20.546 5.900 1.00 0.00 H new ATOM 2909 N ARG C 2 0.303 15.952 7.435 1.00 0.00 N ATOM 2910 CA ARG C 2 -0.278 16.304 6.143 1.00 0.00 C ATOM 2911 C ARG C 2 0.819 16.592 5.124 1.00 0.00 C ATOM 2912 O ARG C 2 1.060 15.801 4.215 1.00 0.00 O ATOM 2913 CB ARG C 2 -1.192 17.523 6.283 1.00 0.00 C ATOM 2914 CG ARG C 2 -2.560 17.193 6.858 1.00 0.00 C ATOM 2915 CD ARG C 2 -2.475 16.862 8.339 1.00 0.00 C ATOM 2916 NE ARG C 2 -3.787 16.876 8.981 1.00 0.00 N ATOM 2917 CZ ARG C 2 -3.967 16.962 10.297 1.00 0.00 C ATOM 2918 NH1 ARG C 2 -2.923 17.042 11.112 1.00 0.00 N ATOM 2919 NH2 ARG C 2 -5.194 16.967 10.800 1.00 0.00 N ATOM 0 HA ARG C 2 -0.869 15.458 5.793 1.00 0.00 H new ATOM 0 HB2 ARG C 2 -0.706 18.260 6.923 1.00 0.00 H new ATOM 0 HB3 ARG C 2 -1.320 17.985 5.304 1.00 0.00 H new ATOM 0 HG2 ARG C 2 -3.232 18.039 6.711 1.00 0.00 H new ATOM 0 HG3 ARG C 2 -2.989 16.348 6.319 1.00 0.00 H new ATOM 0 HD2 ARG C 2 -2.021 15.879 8.465 1.00 0.00 H new ATOM 0 HD3 ARG C 2 -1.822 17.581 8.834 1.00 0.00 H new ATOM 0 HE ARG C 2 -4.613 16.816 8.386 1.00 0.00 H new ATOM 0 HH11 ARG C 2 -1.977 17.038 10.731 1.00 0.00 H new ATOM 0 HH12 ARG C 2 -3.067 17.108 12.120 1.00 0.00 H new ATOM 0 HH21 ARG C 2 -6.000 16.905 10.178 1.00 0.00 H new ATOM 0 HH22 ARG C 2 -5.331 17.033 11.809 1.00 0.00 H new ATOM 2932 N THR C 3 1.491 17.724 5.291 1.00 0.00 N ATOM 2933 CA THR C 3 2.573 18.104 4.392 1.00 0.00 C ATOM 2934 C THR C 3 3.935 17.770 4.997 1.00 0.00 C ATOM 2935 O THR C 3 4.973 18.036 4.391 1.00 0.00 O ATOM 2936 CB THR C 3 2.497 19.595 4.062 1.00 0.00 C ATOM 2937 OG1 THR C 3 1.159 20.056 4.135 1.00 0.00 O ATOM 2938 CG2 THR C 3 3.025 19.930 2.683 1.00 0.00 C ATOM 0 H THR C 3 1.307 18.393 6.038 1.00 0.00 H new ATOM 0 HA THR C 3 2.458 17.532 3.471 1.00 0.00 H new ATOM 0 HB THR C 3 3.126 20.089 4.803 1.00 0.00 H new ATOM 0 HG1 THR C 3 0.685 19.817 3.311 1.00 0.00 H new ATOM 0 HG21 THR C 3 2.942 21.003 2.513 1.00 0.00 H new ATOM 0 HG22 THR C 3 4.071 19.631 2.611 1.00 0.00 H new ATOM 0 HG23 THR C 3 2.443 19.397 1.931 1.00 0.00 H new ATOM 2946 N LYS C 4 3.927 17.182 6.191 1.00 0.00 N ATOM 2947 CA LYS C 4 5.164 16.810 6.864 1.00 0.00 C ATOM 2948 C LYS C 4 5.733 15.515 6.289 1.00 0.00 C ATOM 2949 O LYS C 4 6.799 15.064 6.705 1.00 0.00 O ATOM 2950 CB LYS C 4 4.923 16.652 8.366 1.00 0.00 C ATOM 2951 CG LYS C 4 6.188 16.774 9.202 1.00 0.00 C ATOM 2952 CD LYS C 4 6.810 15.413 9.473 1.00 0.00 C ATOM 2953 CE LYS C 4 8.306 15.418 9.202 1.00 0.00 C ATOM 2954 NZ LYS C 4 9.090 15.782 10.414 1.00 0.00 N ATOM 0 H LYS C 4 3.079 16.954 6.709 1.00 0.00 H new ATOM 0 HA LYS C 4 5.890 17.607 6.700 1.00 0.00 H new ATOM 0 HB2 LYS C 4 4.208 17.407 8.692 1.00 0.00 H new ATOM 0 HB3 LYS C 4 4.467 15.680 8.552 1.00 0.00 H new ATOM 0 HG2 LYS C 4 6.908 17.408 8.684 1.00 0.00 H new ATOM 0 HG3 LYS C 4 5.955 17.263 10.148 1.00 0.00 H new ATOM 0 HD2 LYS C 4 6.628 15.129 10.510 1.00 0.00 H new ATOM 0 HD3 LYS C 4 6.329 14.661 8.847 1.00 0.00 H new ATOM 0 HE2 LYS C 4 8.615 14.433 8.853 1.00 0.00 H new ATOM 0 HE3 LYS C 4 8.527 16.124 8.401 1.00 0.00 H new ATOM 0 HZ1 LYS C 4 10.068 16.005 10.141 1.00 0.00 H new ATOM 0 HZ2 LYS C 4 8.660 16.612 10.870 1.00 0.00 H new ATOM 0 HZ3 LYS C 4 9.091 14.983 11.080 1.00 0.00 H new ATOM 2968 N ILE C 5 5.010 14.920 5.329 1.00 0.00 N ATOM 2969 CA ILE C 5 5.424 13.667 4.687 1.00 0.00 C ATOM 2970 C ILE C 5 6.128 12.746 5.673 1.00 0.00 C ATOM 2971 O ILE C 5 7.073 12.042 5.322 1.00 0.00 O ATOM 2972 CB ILE C 5 6.333 13.886 3.460 1.00 0.00 C ATOM 2973 CG1 ILE C 5 7.610 14.623 3.850 1.00 0.00 C ATOM 2974 CG2 ILE C 5 5.583 14.643 2.373 1.00 0.00 C ATOM 2975 CD1 ILE C 5 7.380 16.082 4.148 1.00 0.00 C ATOM 0 H ILE C 5 4.127 15.292 4.979 1.00 0.00 H new ATOM 0 HA ILE C 5 4.503 13.199 4.340 1.00 0.00 H new ATOM 0 HB ILE C 5 6.618 12.910 3.068 1.00 0.00 H new ATOM 0 HG12 ILE C 5 8.047 14.143 4.726 1.00 0.00 H new ATOM 0 HG13 ILE C 5 8.336 14.533 3.042 1.00 0.00 H new ATOM 0 HG21 ILE C 5 6.238 14.790 1.514 1.00 0.00 H new ATOM 0 HG22 ILE C 5 4.707 14.070 2.068 1.00 0.00 H new ATOM 0 HG23 ILE C 5 5.266 15.612 2.757 1.00 0.00 H new ATOM 0 HD11 ILE C 5 8.326 16.551 4.419 1.00 0.00 H new ATOM 0 HD12 ILE C 5 6.971 16.574 3.265 1.00 0.00 H new ATOM 0 HD13 ILE C 5 6.677 16.178 4.975 1.00 0.00 H new ATOM 2987 N ASP C 6 5.664 12.782 6.914 1.00 0.00 N ATOM 2988 CA ASP C 6 6.239 11.971 7.980 1.00 0.00 C ATOM 2989 C ASP C 6 6.271 10.490 7.608 1.00 0.00 C ATOM 2990 O ASP C 6 5.389 9.725 7.999 1.00 0.00 O ATOM 2991 CB ASP C 6 5.446 12.159 9.274 1.00 0.00 C ATOM 2992 CG ASP C 6 6.241 11.765 10.503 1.00 0.00 C ATOM 2993 OD1 ASP C 6 6.531 10.560 10.660 1.00 0.00 O ATOM 2994 OD2 ASP C 6 6.573 12.659 11.309 1.00 0.00 O ATOM 0 H ASP C 6 4.884 13.369 7.210 1.00 0.00 H new ATOM 0 HA ASP C 6 7.266 12.305 8.128 1.00 0.00 H new ATOM 0 HB2 ASP C 6 5.141 13.202 9.361 1.00 0.00 H new ATOM 0 HB3 ASP C 6 4.535 11.563 9.228 1.00 0.00 H new ATOM 2999 N TRP C 7 7.300 10.090 6.868 1.00 0.00 N ATOM 3000 CA TRP C 7 7.452 8.698 6.466 1.00 0.00 C ATOM 3001 C TRP C 7 7.891 7.863 7.661 1.00 0.00 C ATOM 3002 O TRP C 7 7.185 6.956 8.100 1.00 0.00 O ATOM 3003 CB TRP C 7 8.486 8.564 5.347 1.00 0.00 C ATOM 3004 CG TRP C 7 8.061 9.164 4.042 1.00 0.00 C ATOM 3005 CD1 TRP C 7 6.905 9.840 3.782 1.00 0.00 C ATOM 3006 CD2 TRP C 7 8.795 9.136 2.812 1.00 0.00 C ATOM 3007 NE1 TRP C 7 6.874 10.236 2.466 1.00 0.00 N ATOM 3008 CE2 TRP C 7 8.024 9.815 1.850 1.00 0.00 C ATOM 3009 CE3 TRP C 7 10.031 8.604 2.433 1.00 0.00 C ATOM 3010 CZ2 TRP C 7 8.450 9.974 0.533 1.00 0.00 C ATOM 3011 CZ3 TRP C 7 10.452 8.763 1.126 1.00 0.00 C ATOM 3012 CH2 TRP C 7 9.663 9.443 0.190 1.00 0.00 C ATOM 0 H TRP C 7 8.039 10.709 6.536 1.00 0.00 H new ATOM 0 HA TRP C 7 6.490 8.341 6.098 1.00 0.00 H new ATOM 0 HB2 TRP C 7 9.414 9.038 5.667 1.00 0.00 H new ATOM 0 HB3 TRP C 7 8.704 7.507 5.194 1.00 0.00 H new ATOM 0 HD1 TRP C 7 6.127 10.036 4.505 1.00 0.00 H new ATOM 0 HE1 TRP C 7 6.119 10.758 2.021 1.00 0.00 H new ATOM 0 HE3 TRP C 7 10.646 8.078 3.148 1.00 0.00 H new ATOM 0 HZ2 TRP C 7 7.844 10.498 -0.191 1.00 0.00 H new ATOM 0 HZ3 TRP C 7 11.405 8.356 0.822 1.00 0.00 H new ATOM 0 HH2 TRP C 7 10.020 9.550 -0.824 1.00 0.00 H new ATOM 3023 N ASN C 8 9.068 8.193 8.183 1.00 0.00 N ATOM 3024 CA ASN C 8 9.625 7.497 9.332 1.00 0.00 C ATOM 3025 C ASN C 8 10.967 8.113 9.729 1.00 0.00 C ATOM 3026 O ASN C 8 11.023 8.964 10.614 1.00 0.00 O ATOM 3027 CB ASN C 8 9.785 6.003 9.033 1.00 0.00 C ATOM 3028 CG ASN C 8 10.370 5.238 10.203 1.00 0.00 C ATOM 3029 OD1 ASN C 8 11.524 4.811 10.166 1.00 0.00 O ATOM 3030 ND2 ASN C 8 9.574 5.059 11.251 1.00 0.00 N ATOM 0 H ASN C 8 9.657 8.944 7.823 1.00 0.00 H new ATOM 0 HA ASN C 8 8.934 7.605 10.168 1.00 0.00 H new ATOM 0 HB2 ASN C 8 8.814 5.581 8.776 1.00 0.00 H new ATOM 0 HB3 ASN C 8 10.428 5.877 8.162 1.00 0.00 H new ATOM 0 HD21 ASN C 8 9.913 4.550 12.068 1.00 0.00 H new ATOM 0 HD22 ASN C 8 8.624 5.430 11.239 1.00 0.00 H new ATOM 3037 N LYS C 9 12.043 7.676 9.080 1.00 0.00 N ATOM 3038 CA LYS C 9 13.376 8.190 9.379 1.00 0.00 C ATOM 3039 C LYS C 9 13.811 9.290 8.405 1.00 0.00 C ATOM 3040 O LYS C 9 14.276 10.349 8.826 1.00 0.00 O ATOM 3041 CB LYS C 9 14.395 7.050 9.362 1.00 0.00 C ATOM 3042 CG LYS C 9 15.427 7.146 10.475 1.00 0.00 C ATOM 3043 CD LYS C 9 16.733 7.743 9.975 1.00 0.00 C ATOM 3044 CE LYS C 9 17.879 7.464 10.935 1.00 0.00 C ATOM 3045 NZ LYS C 9 17.665 8.109 12.260 1.00 0.00 N ATOM 0 H LYS C 9 12.018 6.969 8.345 1.00 0.00 H new ATOM 0 HA LYS C 9 13.333 8.634 10.374 1.00 0.00 H new ATOM 0 HB2 LYS C 9 13.868 6.100 9.447 1.00 0.00 H new ATOM 0 HB3 LYS C 9 14.908 7.045 8.400 1.00 0.00 H new ATOM 0 HG2 LYS C 9 15.033 7.758 11.286 1.00 0.00 H new ATOM 0 HG3 LYS C 9 15.613 6.154 10.886 1.00 0.00 H new ATOM 0 HD2 LYS C 9 16.970 7.331 8.994 1.00 0.00 H new ATOM 0 HD3 LYS C 9 16.617 8.819 9.849 1.00 0.00 H new ATOM 0 HE2 LYS C 9 17.986 6.388 11.069 1.00 0.00 H new ATOM 0 HE3 LYS C 9 18.811 7.826 10.502 1.00 0.00 H new ATOM 0 HZ1 LYS C 9 18.484 7.923 12.873 1.00 0.00 H new ATOM 0 HZ2 LYS C 9 17.554 9.135 12.133 1.00 0.00 H new ATOM 0 HZ3 LYS C 9 16.807 7.720 12.701 1.00 0.00 H new ATOM 3059 N ILE C 10 13.695 9.023 7.103 1.00 0.00 N ATOM 3060 CA ILE C 10 14.120 9.985 6.084 1.00 0.00 C ATOM 3061 C ILE C 10 13.459 11.360 6.261 1.00 0.00 C ATOM 3062 O ILE C 10 14.156 12.357 6.450 1.00 0.00 O ATOM 3063 CB ILE C 10 13.895 9.441 4.649 1.00 0.00 C ATOM 3064 CG1 ILE C 10 14.801 10.172 3.653 1.00 0.00 C ATOM 3065 CG2 ILE C 10 12.441 9.543 4.227 1.00 0.00 C ATOM 3066 CD1 ILE C 10 14.240 11.489 3.160 1.00 0.00 C ATOM 0 H ILE C 10 13.313 8.154 6.730 1.00 0.00 H new ATOM 0 HA ILE C 10 15.192 10.124 6.225 1.00 0.00 H new ATOM 0 HB ILE C 10 14.157 8.383 4.653 1.00 0.00 H new ATOM 0 HG12 ILE C 10 15.767 10.354 4.123 1.00 0.00 H new ATOM 0 HG13 ILE C 10 14.980 9.522 2.796 1.00 0.00 H new ATOM 0 HG21 ILE C 10 12.327 9.151 3.216 1.00 0.00 H new ATOM 0 HG22 ILE C 10 11.822 8.964 4.912 1.00 0.00 H new ATOM 0 HG23 ILE C 10 12.128 10.587 4.249 1.00 0.00 H new ATOM 0 HD11 ILE C 10 14.941 11.943 2.459 1.00 0.00 H new ATOM 0 HD12 ILE C 10 13.288 11.314 2.659 1.00 0.00 H new ATOM 0 HD13 ILE C 10 14.087 12.159 4.006 1.00 0.00 H new ATOM 3078 N LEU C 11 12.128 11.426 6.209 1.00 0.00 N ATOM 3079 CA LEU C 11 11.430 12.689 6.375 1.00 0.00 C ATOM 3080 C LEU C 11 11.148 12.954 7.852 1.00 0.00 C ATOM 3081 O LEU C 11 10.768 14.061 8.234 1.00 0.00 O ATOM 3082 CB LEU C 11 10.124 12.681 5.570 1.00 0.00 C ATOM 3083 CG LEU C 11 10.271 12.878 4.056 1.00 0.00 C ATOM 3084 CD1 LEU C 11 11.424 13.813 3.718 1.00 0.00 C ATOM 3085 CD2 LEU C 11 10.423 11.549 3.337 1.00 0.00 C ATOM 0 H LEU C 11 11.520 10.622 6.054 1.00 0.00 H new ATOM 0 HA LEU C 11 12.065 13.491 5.999 1.00 0.00 H new ATOM 0 HB2 LEU C 11 9.617 11.732 5.746 1.00 0.00 H new ATOM 0 HB3 LEU C 11 9.475 13.466 5.958 1.00 0.00 H new ATOM 0 HG LEU C 11 9.352 13.348 3.704 1.00 0.00 H new ATOM 0 HD11 LEU C 11 11.495 13.927 2.636 1.00 0.00 H new ATOM 0 HD12 LEU C 11 11.248 14.787 4.175 1.00 0.00 H new ATOM 0 HD13 LEU C 11 12.355 13.396 4.101 1.00 0.00 H new ATOM 0 HD21 LEU C 11 10.525 11.724 2.266 1.00 0.00 H new ATOM 0 HD22 LEU C 11 11.310 11.035 3.707 1.00 0.00 H new ATOM 0 HD23 LEU C 11 9.543 10.933 3.522 1.00 0.00 H new ATOM 3097 N SER C 12 11.344 11.929 8.680 1.00 0.00 N ATOM 3098 CA SER C 12 11.123 12.040 10.117 1.00 0.00 C ATOM 3099 C SER C 12 9.747 12.628 10.420 1.00 0.00 C ATOM 3100 O SER C 12 8.794 12.307 9.681 1.00 0.00 O ATOM 3101 CB SER C 12 12.216 12.898 10.757 1.00 0.00 C ATOM 3102 OG SER C 12 11.975 13.085 12.141 1.00 0.00 O ATOM 3103 OXT SER C 12 9.633 13.401 11.394 1.00 0.00 O ATOM 0 H SER C 12 11.658 11.007 8.375 1.00 0.00 H new ATOM 0 HA SER C 12 11.164 11.037 10.542 1.00 0.00 H new ATOM 0 HB2 SER C 12 13.186 12.422 10.615 1.00 0.00 H new ATOM 0 HB3 SER C 12 12.261 13.866 10.259 1.00 0.00 H new ATOM 0 HG SER C 12 11.129 13.564 12.264 1.00 0.00 H new ATOM 3110 N THR D 1 1.038 -14.017 12.453 1.00 0.00 N ATOM 3111 CA THR D 1 0.630 -13.006 11.442 1.00 0.00 C ATOM 3112 C THR D 1 0.817 -13.534 10.025 1.00 0.00 C ATOM 3113 O THR D 1 0.137 -13.093 9.097 1.00 0.00 O ATOM 3114 CB THR D 1 1.468 -11.743 11.650 1.00 0.00 C ATOM 3115 OG1 THR D 1 1.909 -11.647 12.992 1.00 0.00 O ATOM 3116 CG2 THR D 1 0.722 -10.469 11.319 1.00 0.00 C ATOM 0 H1 THR D 1 0.729 -13.708 13.397 1.00 0.00 H new ATOM 0 H2 THR D 1 0.598 -14.932 12.227 1.00 0.00 H new ATOM 0 H3 THR D 1 2.073 -14.119 12.444 1.00 0.00 H new ATOM 0 HA THR D 1 -0.429 -12.781 11.570 1.00 0.00 H new ATOM 0 HB THR D 1 2.310 -11.840 10.965 1.00 0.00 H new ATOM 0 HG1 THR D 1 2.444 -10.834 13.103 1.00 0.00 H new ATOM 0 HG21 THR D 1 1.373 -9.612 11.488 1.00 0.00 H new ATOM 0 HG22 THR D 1 0.413 -10.489 10.274 1.00 0.00 H new ATOM 0 HG23 THR D 1 -0.159 -10.387 11.956 1.00 0.00 H new ATOM 3126 N ARG D 2 1.737 -14.482 9.858 1.00 0.00 N ATOM 3127 CA ARG D 2 1.999 -15.063 8.546 1.00 0.00 C ATOM 3128 C ARG D 2 0.696 -15.494 7.882 1.00 0.00 C ATOM 3129 O ARG D 2 0.234 -14.865 6.934 1.00 0.00 O ATOM 3130 CB ARG D 2 2.941 -16.262 8.673 1.00 0.00 C ATOM 3131 CG ARG D 2 4.400 -15.876 8.842 1.00 0.00 C ATOM 3132 CD ARG D 2 4.665 -15.292 10.220 1.00 0.00 C ATOM 3133 NE ARG D 2 6.093 -15.230 10.524 1.00 0.00 N ATOM 3134 CZ ARG D 2 6.583 -15.093 11.755 1.00 0.00 C ATOM 3135 NH1 ARG D 2 5.765 -15.007 12.796 1.00 0.00 N ATOM 3136 NH2 ARG D 2 7.895 -15.045 11.945 1.00 0.00 N ATOM 0 H ARG D 2 2.310 -14.862 10.612 1.00 0.00 H new ATOM 0 HA ARG D 2 2.475 -14.304 7.925 1.00 0.00 H new ATOM 0 HB2 ARG D 2 2.633 -16.866 9.526 1.00 0.00 H new ATOM 0 HB3 ARG D 2 2.840 -16.888 7.786 1.00 0.00 H new ATOM 0 HG2 ARG D 2 5.029 -16.753 8.690 1.00 0.00 H new ATOM 0 HG3 ARG D 2 4.676 -15.149 8.078 1.00 0.00 H new ATOM 0 HD2 ARG D 2 4.239 -14.291 10.277 1.00 0.00 H new ATOM 0 HD3 ARG D 2 4.160 -15.897 10.973 1.00 0.00 H new ATOM 0 HE ARG D 2 6.753 -15.295 9.749 1.00 0.00 H new ATOM 0 HH11 ARG D 2 4.755 -15.046 12.656 1.00 0.00 H new ATOM 0 HH12 ARG D 2 6.146 -14.902 13.736 1.00 0.00 H new ATOM 0 HH21 ARG D 2 8.528 -15.113 11.148 1.00 0.00 H new ATOM 0 HH22 ARG D 2 8.270 -14.940 12.888 1.00 0.00 H new ATOM 3149 N THR D 3 0.102 -16.562 8.396 1.00 0.00 N ATOM 3150 CA THR D 3 -1.157 -17.063 7.859 1.00 0.00 C ATOM 3151 C THR D 3 -2.341 -16.596 8.704 1.00 0.00 C ATOM 3152 O THR D 3 -3.488 -16.936 8.416 1.00 0.00 O ATOM 3153 CB THR D 3 -1.136 -18.590 7.783 1.00 0.00 C ATOM 3154 OG1 THR D 3 0.187 -19.066 7.613 1.00 0.00 O ATOM 3155 CG2 THR D 3 -1.973 -19.143 6.649 1.00 0.00 C ATOM 0 H THR D 3 0.470 -17.098 9.182 1.00 0.00 H new ATOM 0 HA THR D 3 -1.275 -16.660 6.853 1.00 0.00 H new ATOM 0 HB THR D 3 -1.560 -18.933 8.727 1.00 0.00 H new ATOM 0 HG1 THR D 3 0.452 -18.968 6.675 1.00 0.00 H new ATOM 0 HG21 THR D 3 -1.915 -20.231 6.651 1.00 0.00 H new ATOM 0 HG22 THR D 3 -3.010 -18.835 6.779 1.00 0.00 H new ATOM 0 HG23 THR D 3 -1.597 -18.762 5.700 1.00 0.00 H new ATOM 3163 N LYS D 4 -2.059 -15.811 9.741 1.00 0.00 N ATOM 3164 CA LYS D 4 -3.105 -15.299 10.615 1.00 0.00 C ATOM 3165 C LYS D 4 -3.816 -14.107 9.976 1.00 0.00 C ATOM 3166 O LYS D 4 -4.760 -13.564 10.550 1.00 0.00 O ATOM 3167 CB LYS D 4 -2.515 -14.892 11.967 1.00 0.00 C ATOM 3168 CG LYS D 4 -3.542 -14.836 13.086 1.00 0.00 C ATOM 3169 CD LYS D 4 -4.105 -13.433 13.258 1.00 0.00 C ATOM 3170 CE LYS D 4 -5.622 -13.446 13.355 1.00 0.00 C ATOM 3171 NZ LYS D 4 -6.088 -13.576 14.763 1.00 0.00 N ATOM 0 H LYS D 4 -1.116 -15.517 9.994 1.00 0.00 H new ATOM 0 HA LYS D 4 -3.835 -16.093 10.769 1.00 0.00 H new ATOM 0 HB2 LYS D 4 -1.731 -15.598 12.240 1.00 0.00 H new ATOM 0 HB3 LYS D 4 -2.043 -13.914 11.869 1.00 0.00 H new ATOM 0 HG2 LYS D 4 -4.354 -15.531 12.871 1.00 0.00 H new ATOM 0 HG3 LYS D 4 -3.083 -15.162 14.019 1.00 0.00 H new ATOM 0 HD2 LYS D 4 -3.686 -12.980 14.157 1.00 0.00 H new ATOM 0 HD3 LYS D 4 -3.799 -12.812 12.416 1.00 0.00 H new ATOM 0 HE2 LYS D 4 -6.021 -12.528 12.924 1.00 0.00 H new ATOM 0 HE3 LYS D 4 -6.016 -14.273 12.764 1.00 0.00 H new ATOM 0 HZ1 LYS D 4 -7.095 -13.835 14.773 1.00 0.00 H new ATOM 0 HZ2 LYS D 4 -5.536 -14.315 15.244 1.00 0.00 H new ATOM 0 HZ3 LYS D 4 -5.958 -12.670 15.257 1.00 0.00 H new ATOM 3185 N ILE D 5 -3.353 -13.703 8.784 1.00 0.00 N ATOM 3186 CA ILE D 5 -3.928 -12.569 8.054 1.00 0.00 C ATOM 3187 C ILE D 5 -4.391 -11.476 9.004 1.00 0.00 C ATOM 3188 O ILE D 5 -5.403 -10.816 8.771 1.00 0.00 O ATOM 3189 CB ILE D 5 -5.099 -12.971 7.133 1.00 0.00 C ATOM 3190 CG1 ILE D 5 -6.235 -13.598 7.936 1.00 0.00 C ATOM 3191 CG2 ILE D 5 -4.618 -13.922 6.046 1.00 0.00 C ATOM 3192 CD1 ILE D 5 -5.917 -14.989 8.419 1.00 0.00 C ATOM 0 H ILE D 5 -2.574 -14.152 8.303 1.00 0.00 H new ATOM 0 HA ILE D 5 -3.123 -12.191 7.423 1.00 0.00 H new ATOM 0 HB ILE D 5 -5.483 -12.069 6.657 1.00 0.00 H new ATOM 0 HG12 ILE D 5 -6.459 -12.964 8.794 1.00 0.00 H new ATOM 0 HG13 ILE D 5 -7.134 -13.630 7.320 1.00 0.00 H new ATOM 0 HG21 ILE D 5 -5.456 -14.196 5.405 1.00 0.00 H new ATOM 0 HG22 ILE D 5 -3.849 -13.432 5.448 1.00 0.00 H new ATOM 0 HG23 ILE D 5 -4.204 -14.820 6.505 1.00 0.00 H new ATOM 0 HD11 ILE D 5 -6.763 -15.381 8.983 1.00 0.00 H new ATOM 0 HD12 ILE D 5 -5.721 -15.635 7.563 1.00 0.00 H new ATOM 0 HD13 ILE D 5 -5.036 -14.959 9.060 1.00 0.00 H new ATOM 3204 N ASP D 6 -3.644 -11.310 10.087 1.00 0.00 N ATOM 3205 CA ASP D 6 -3.962 -10.314 11.103 1.00 0.00 C ATOM 3206 C ASP D 6 -4.105 -8.919 10.501 1.00 0.00 C ATOM 3207 O ASP D 6 -3.169 -8.120 10.533 1.00 0.00 O ATOM 3208 CB ASP D 6 -2.880 -10.299 12.184 1.00 0.00 C ATOM 3209 CG ASP D 6 -3.365 -9.678 13.481 1.00 0.00 C ATOM 3210 OD1 ASP D 6 -3.630 -8.458 13.491 1.00 0.00 O ATOM 3211 OD2 ASP D 6 -3.481 -10.413 14.484 1.00 0.00 O ATOM 0 H ASP D 6 -2.806 -11.857 10.286 1.00 0.00 H new ATOM 0 HA ASP D 6 -4.919 -10.591 11.545 1.00 0.00 H new ATOM 0 HB2 ASP D 6 -2.547 -11.319 12.375 1.00 0.00 H new ATOM 0 HB3 ASP D 6 -2.015 -9.745 11.820 1.00 0.00 H new ATOM 3216 N TRP D 7 -5.287 -8.625 9.967 1.00 0.00 N ATOM 3217 CA TRP D 7 -5.552 -7.319 9.380 1.00 0.00 C ATOM 3218 C TRP D 7 -5.708 -6.282 10.482 1.00 0.00 C ATOM 3219 O TRP D 7 -4.932 -5.331 10.579 1.00 0.00 O ATOM 3220 CB TRP D 7 -6.826 -7.352 8.532 1.00 0.00 C ATOM 3221 CG TRP D 7 -6.713 -8.176 7.286 1.00 0.00 C ATOM 3222 CD1 TRP D 7 -5.642 -8.918 6.879 1.00 0.00 C ATOM 3223 CD2 TRP D 7 -7.720 -8.341 6.281 1.00 0.00 C ATOM 3224 NE1 TRP D 7 -5.920 -9.533 5.683 1.00 0.00 N ATOM 3225 CE2 TRP D 7 -7.191 -9.194 5.294 1.00 0.00 C ATOM 3226 CE3 TRP D 7 -9.020 -7.850 6.120 1.00 0.00 C ATOM 3227 CZ2 TRP D 7 -7.915 -9.566 4.164 1.00 0.00 C ATOM 3228 CZ3 TRP D 7 -9.737 -8.221 4.998 1.00 0.00 C ATOM 3229 CH2 TRP D 7 -9.184 -9.071 4.033 1.00 0.00 C ATOM 0 H TRP D 7 -6.074 -9.273 9.930 1.00 0.00 H new ATOM 0 HA TRP D 7 -4.711 -7.054 8.739 1.00 0.00 H new ATOM 0 HB2 TRP D 7 -7.643 -7.742 9.139 1.00 0.00 H new ATOM 0 HB3 TRP D 7 -7.092 -6.332 8.256 1.00 0.00 H new ATOM 0 HD1 TRP D 7 -4.711 -9.008 7.419 1.00 0.00 H new ATOM 0 HE1 TRP D 7 -5.285 -10.143 5.168 1.00 0.00 H new ATOM 0 HE3 TRP D 7 -9.455 -7.193 6.859 1.00 0.00 H new ATOM 0 HZ2 TRP D 7 -7.490 -10.221 3.418 1.00 0.00 H new ATOM 0 HZ3 TRP D 7 -10.742 -7.848 4.863 1.00 0.00 H new ATOM 0 HH2 TRP D 7 -9.771 -9.342 3.168 1.00 0.00 H new ATOM 3240 N ASN D 8 -6.722 -6.485 11.316 1.00 0.00 N ATOM 3241 CA ASN D 8 -7.000 -5.589 12.428 1.00 0.00 C ATOM 3242 C ASN D 8 -8.197 -6.093 13.232 1.00 0.00 C ATOM 3243 O ASN D 8 -8.029 -6.778 14.239 1.00 0.00 O ATOM 3244 CB ASN D 8 -7.250 -4.165 11.922 1.00 0.00 C ATOM 3245 CG ASN D 8 -7.551 -3.194 13.048 1.00 0.00 C ATOM 3246 OD1 ASN D 8 -8.688 -2.751 13.213 1.00 0.00 O ATOM 3247 ND2 ASN D 8 -6.531 -2.860 13.830 1.00 0.00 N ATOM 0 H ASN D 8 -7.369 -7.270 11.240 1.00 0.00 H new ATOM 0 HA ASN D 8 -6.129 -5.570 13.083 1.00 0.00 H new ATOM 0 HB2 ASN D 8 -6.375 -3.819 11.372 1.00 0.00 H new ATOM 0 HB3 ASN D 8 -8.084 -4.173 11.221 1.00 0.00 H new ATOM 0 HD21 ASN D 8 -6.673 -2.212 14.605 1.00 0.00 H new ATOM 0 HD22 ASN D 8 -5.605 -3.252 13.656 1.00 0.00 H new ATOM 3254 N LYS D 9 -9.405 -5.746 12.792 1.00 0.00 N ATOM 3255 CA LYS D 9 -10.619 -6.166 13.483 1.00 0.00 C ATOM 3256 C LYS D 9 -11.256 -7.406 12.845 1.00 0.00 C ATOM 3257 O LYS D 9 -11.591 -8.363 13.540 1.00 0.00 O ATOM 3258 CB LYS D 9 -11.632 -5.021 13.514 1.00 0.00 C ATOM 3259 CG LYS D 9 -12.368 -4.898 14.839 1.00 0.00 C ATOM 3260 CD LYS D 9 -13.744 -5.539 14.773 1.00 0.00 C ATOM 3261 CE LYS D 9 -14.633 -5.070 15.914 1.00 0.00 C ATOM 3262 NZ LYS D 9 -14.098 -5.483 17.242 1.00 0.00 N ATOM 0 H LYS D 9 -9.567 -5.176 11.962 1.00 0.00 H new ATOM 0 HA LYS D 9 -10.332 -6.433 14.500 1.00 0.00 H new ATOM 0 HB2 LYS D 9 -11.116 -4.084 13.306 1.00 0.00 H new ATOM 0 HB3 LYS D 9 -12.359 -5.168 12.716 1.00 0.00 H new ATOM 0 HG2 LYS D 9 -11.782 -5.371 15.627 1.00 0.00 H new ATOM 0 HG3 LYS D 9 -12.468 -3.846 15.105 1.00 0.00 H new ATOM 0 HD2 LYS D 9 -14.214 -5.296 13.820 1.00 0.00 H new ATOM 0 HD3 LYS D 9 -13.643 -6.624 14.811 1.00 0.00 H new ATOM 0 HE2 LYS D 9 -14.723 -3.984 15.881 1.00 0.00 H new ATOM 0 HE3 LYS D 9 -15.636 -5.477 15.784 1.00 0.00 H new ATOM 0 HZ1 LYS D 9 -14.733 -5.144 17.993 1.00 0.00 H new ATOM 0 HZ2 LYS D 9 -14.035 -6.520 17.284 1.00 0.00 H new ATOM 0 HZ3 LYS D 9 -13.152 -5.073 17.378 1.00 0.00 H new ATOM 3276 N ILE D 10 -11.458 -7.368 11.526 1.00 0.00 N ATOM 3277 CA ILE D 10 -12.099 -8.479 10.819 1.00 0.00 C ATOM 3278 C ILE D 10 -11.393 -9.821 11.068 1.00 0.00 C ATOM 3279 O ILE D 10 -12.008 -10.752 11.586 1.00 0.00 O ATOM 3280 CB ILE D 10 -12.230 -8.194 9.300 1.00 0.00 C ATOM 3281 CG1 ILE D 10 -13.334 -9.064 8.689 1.00 0.00 C ATOM 3282 CG2 ILE D 10 -10.917 -8.405 8.568 1.00 0.00 C ATOM 3283 CD1 ILE D 10 -12.884 -10.460 8.312 1.00 0.00 C ATOM 0 H ILE D 10 -11.189 -6.586 10.929 1.00 0.00 H new ATOM 0 HA ILE D 10 -13.104 -8.564 11.233 1.00 0.00 H new ATOM 0 HB ILE D 10 -12.500 -7.144 9.184 1.00 0.00 H new ATOM 0 HG12 ILE D 10 -14.158 -9.139 9.399 1.00 0.00 H new ATOM 0 HG13 ILE D 10 -13.723 -8.567 7.800 1.00 0.00 H new ATOM 0 HG21 ILE D 10 -11.054 -8.195 7.507 1.00 0.00 H new ATOM 0 HG22 ILE D 10 -10.161 -7.734 8.976 1.00 0.00 H new ATOM 0 HG23 ILE D 10 -10.592 -9.438 8.694 1.00 0.00 H new ATOM 0 HD11 ILE D 10 -13.723 -11.011 7.887 1.00 0.00 H new ATOM 0 HD12 ILE D 10 -12.082 -10.398 7.577 1.00 0.00 H new ATOM 0 HD13 ILE D 10 -12.523 -10.978 9.200 1.00 0.00 H new ATOM 3295 N LEU D 11 -10.111 -9.929 10.713 1.00 0.00 N ATOM 3296 CA LEU D 11 -9.373 -11.162 10.925 1.00 0.00 C ATOM 3297 C LEU D 11 -8.743 -11.178 12.316 1.00 0.00 C ATOM 3298 O LEU D 11 -8.265 -12.213 12.782 1.00 0.00 O ATOM 3299 CB LEU D 11 -8.297 -11.326 9.844 1.00 0.00 C ATOM 3300 CG LEU D 11 -8.798 -11.775 8.466 1.00 0.00 C ATOM 3301 CD1 LEU D 11 -9.982 -12.725 8.577 1.00 0.00 C ATOM 3302 CD2 LEU D 11 -9.138 -10.586 7.585 1.00 0.00 C ATOM 0 H LEU D 11 -9.571 -9.179 10.281 1.00 0.00 H new ATOM 0 HA LEU D 11 -10.067 -12.000 10.856 1.00 0.00 H new ATOM 0 HB2 LEU D 11 -7.777 -10.375 9.728 1.00 0.00 H new ATOM 0 HB3 LEU D 11 -7.562 -12.050 10.196 1.00 0.00 H new ATOM 0 HG LEU D 11 -7.982 -12.321 7.993 1.00 0.00 H new ATOM 0 HD11 LEU D 11 -10.307 -13.020 7.579 1.00 0.00 H new ATOM 0 HD12 LEU D 11 -9.686 -13.611 9.139 1.00 0.00 H new ATOM 0 HD13 LEU D 11 -10.802 -12.226 9.093 1.00 0.00 H new ATOM 0 HD21 LEU D 11 -9.490 -10.940 6.616 1.00 0.00 H new ATOM 0 HD22 LEU D 11 -9.919 -9.993 8.060 1.00 0.00 H new ATOM 0 HD23 LEU D 11 -8.249 -9.971 7.446 1.00 0.00 H new ATOM 3314 N SER D 12 -8.753 -10.020 12.977 1.00 0.00 N ATOM 3315 CA SER D 12 -8.193 -9.890 14.317 1.00 0.00 C ATOM 3316 C SER D 12 -6.775 -10.453 14.382 1.00 0.00 C ATOM 3317 O SER D 12 -6.032 -10.288 13.392 1.00 0.00 O ATOM 3318 CB SER D 12 -9.088 -10.599 15.336 1.00 0.00 C ATOM 3319 OG SER D 12 -8.522 -10.551 16.634 1.00 0.00 O ATOM 3320 OXT SER D 12 -6.420 -11.049 15.420 1.00 0.00 O ATOM 0 H SER D 12 -9.145 -9.157 12.602 1.00 0.00 H new ATOM 0 HA SER D 12 -8.147 -8.828 14.560 1.00 0.00 H new ATOM 0 HB2 SER D 12 -10.072 -10.131 15.348 1.00 0.00 H new ATOM 0 HB3 SER D 12 -9.232 -11.637 15.037 1.00 0.00 H new ATOM 0 HG SER D 12 -7.641 -10.981 16.623 1.00 0.00 H new