USER MOD reduce.3.24.130724 H: found=0, std=0, add=1153, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1153 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 33 ASN : amide:sc= 0.341 K(o=0.55,f=-0.2) USER MOD Set 1.2: A 59 ASN : amide:sc= 0.209 K(o=0.55,f=-1.4!) USER MOD Set 2.1: A 9 THR OG1 : rot 63:sc= 0.45 USER MOD Set 2.2: A 83 GLN : amide:sc= -1.05 K(o=-0.6,f=-1.1) USER MOD Set 3.1: A 8 ASN : amide:sc=-0.000934 K(o=0.54,f=-3.6!) USER MOD Set 3.2: A 61 LYS NZ :NH3+ 134:sc= 0.544 (180deg=0.267) USER MOD Set 4.1: A 2 LYS NZ :NH3+ -136:sc= -0.93 (180deg=-2.66!) USER MOD Set 4.2: A 76 TYR OH : rot -150:sc= 1.21 USER MOD Single : A 1 MET CE :methyl -167:sc=-0.00104 (180deg=-0.295) USER MOD Single : A 1 MET N :NH3+ -115:sc= 0.0963 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -0.525 X(o=-0.52,f=-0.044) USER MOD Single : A 11 ASN : amide:sc= -2.66! C(o=-2.7!,f=-3.3!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 156:sc= 0.459 (180deg=0.228) USER MOD Single : A 19 LYS NZ :NH3+ 141:sc= 0.644 (180deg=0.0488) USER MOD Single : A 20 LYS NZ :NH3+ 147:sc= 0.307 (180deg=0.0252) USER MOD Single : A 24 ASN : amide:sc= -0.0517 X(o=-0.052,f=-0.52) USER MOD Single : A 25 GLN : amide:sc= -0.181 K(o=-0.18,f=-3.7!) USER MOD Single : A 27 TYR OH : rot 30:sc= -0.536 USER MOD Single : A 28 GLN : amide:sc= -0.744 X(o=-0.74,f=-0.77) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 157:sc= 0.151 (180deg=0.0374) USER MOD Single : A 40 LYS NZ :NH3+ -113:sc= 0.781 (180deg=0.0699) USER MOD Single : A 42 MET CE :methyl 162:sc= -3.46 (180deg=-3.58!) USER MOD Single : A 43 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0306) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot -100:sc= -0.651 USER MOD Single : A 62 GLN : amide:sc= -0.358 X(o=-0.36,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 145:sc= 0.103 (180deg=-1.46!) USER MOD Single : A 67 MET CE :methyl -120:sc= -0.699 (180deg=-1.9) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 ASN : amide:sc=-0.00348 X(o=-0.0035,f=-0.15) USER MOD Single : A 94 LYS NZ :NH3+ 161:sc= 1.46 (180deg=1.12) USER MOD Single : A 96 LYS NZ :NH3+ 168:sc= -0.11 (180deg=-0.27) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.0203 X(o=-0.02,f=-0.18) USER MOD Single : A 102 TYR OH : rot 130:sc= -0.0296 USER MOD Single : A 106 LYS NZ :NH3+ 177:sc= -1.53! (180deg=-1.56!) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -176:sc= 0.437 (180deg=0.394) USER MOD Single : A 121 MET CE :methyl -142:sc= 0 (180deg=-1.82) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 129 HIS : no HD1:sc= -0.0753 X(o=-0.075,f=0) USER MOD Single : A 130 HIS : no HD1:sc= -0.0279 K(o=-0.028,f=-0.84) USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=-0.0016) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=-0.008) USER MOD Single : A 134 HIS : no HD1:sc= -0.0015 X(o=-0.0015,f=-0.067) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -14.069 10.303 5.453 1.00 33.55 N ATOM 2 CA MET A 1 -12.758 9.690 5.164 1.00 34.15 C ATOM 3 C MET A 1 -12.927 8.203 4.836 1.00 51.32 C ATOM 4 O MET A 1 -13.949 7.586 5.167 1.00 63.42 O ATOM 5 CB MET A 1 -11.759 9.882 6.342 1.00 15.31 C ATOM 6 CG MET A 1 -11.374 11.344 6.626 1.00 3.25 C ATOM 7 SD MET A 1 -10.658 12.187 5.191 1.00 33.21 S ATOM 8 CE MET A 1 -9.148 11.258 4.900 1.00 62.23 C ATOM 0 H1 MET A 1 -14.288 11.013 4.725 1.00 33.55 H new ATOM 0 H2 MET A 1 -14.804 9.567 5.452 1.00 33.55 H new ATOM 0 H3 MET A 1 -14.040 10.761 6.386 1.00 33.55 H new ATOM 0 HA MET A 1 -12.338 10.198 4.296 1.00 34.15 H new ATOM 0 HB2 MET A 1 -12.196 9.454 7.244 1.00 15.31 H new ATOM 0 HB3 MET A 1 -10.852 9.317 6.127 1.00 15.31 H new ATOM 0 HG2 MET A 1 -12.259 11.889 6.954 1.00 3.25 H new ATOM 0 HG3 MET A 1 -10.660 11.371 7.449 1.00 3.25 H new ATOM 0 HE1 MET A 1 -8.511 11.807 4.206 1.00 62.23 H new ATOM 0 HE2 MET A 1 -8.620 11.117 5.843 1.00 62.23 H new ATOM 0 HE3 MET A 1 -9.395 10.286 4.474 1.00 62.23 H new ATOM 20 N LYS A 2 -11.903 7.655 4.179 1.00 24.51 N ATOM 21 CA LYS A 2 -11.819 6.246 3.796 1.00 61.44 C ATOM 22 C LYS A 2 -10.346 5.959 3.530 1.00 61.42 C ATOM 23 O LYS A 2 -9.779 6.467 2.566 1.00 1.21 O ATOM 24 CB LYS A 2 -12.703 5.961 2.551 1.00 65.12 C ATOM 25 CG LYS A 2 -12.655 4.504 2.033 1.00 51.24 C ATOM 26 CD LYS A 2 -13.666 4.256 0.892 1.00 22.22 C ATOM 27 CE LYS A 2 -13.345 5.074 -0.361 1.00 2.14 C ATOM 28 NZ LYS A 2 -14.469 5.099 -1.319 1.00 73.02 N ATOM 0 H LYS A 2 -11.087 8.195 3.891 1.00 24.51 H new ATOM 0 HA LYS A 2 -12.194 5.593 4.584 1.00 61.44 H new ATOM 0 HB2 LYS A 2 -13.736 6.210 2.793 1.00 65.12 H new ATOM 0 HB3 LYS A 2 -12.395 6.627 1.745 1.00 65.12 H new ATOM 0 HG2 LYS A 2 -11.649 4.279 1.680 1.00 51.24 H new ATOM 0 HG3 LYS A 2 -12.864 3.821 2.856 1.00 51.24 H new ATOM 0 HD2 LYS A 2 -13.671 3.196 0.639 1.00 22.22 H new ATOM 0 HD3 LYS A 2 -14.669 4.506 1.238 1.00 22.22 H new ATOM 0 HE2 LYS A 2 -13.095 6.095 -0.071 1.00 2.14 H new ATOM 0 HE3 LYS A 2 -12.464 4.656 -0.849 1.00 2.14 H new ATOM 0 HZ1 LYS A 2 -14.107 4.948 -2.282 1.00 73.02 H new ATOM 0 HZ2 LYS A 2 -15.145 4.345 -1.081 1.00 73.02 H new ATOM 0 HZ3 LYS A 2 -14.947 6.021 -1.269 1.00 73.02 H new ATOM 42 N GLU A 3 -9.728 5.181 4.414 1.00 53.24 N ATOM 43 CA GLU A 3 -8.268 5.093 4.522 1.00 30.11 C ATOM 44 C GLU A 3 -7.686 4.122 3.470 1.00 42.43 C ATOM 45 O GLU A 3 -8.287 3.097 3.153 1.00 51.52 O ATOM 46 CB GLU A 3 -7.897 4.669 5.971 1.00 33.31 C ATOM 47 CG GLU A 3 -8.682 5.400 7.098 1.00 52.42 C ATOM 48 CD GLU A 3 -8.473 6.927 7.172 1.00 31.12 C ATOM 49 OE1 GLU A 3 -9.124 7.687 6.408 1.00 4.34 O ATOM 50 OE2 GLU A 3 -7.656 7.378 8.013 1.00 41.35 O ATOM 0 H GLU A 3 -10.225 4.590 5.080 1.00 53.24 H new ATOM 0 HA GLU A 3 -7.827 6.068 4.316 1.00 30.11 H new ATOM 0 HB2 GLU A 3 -8.063 3.596 6.072 1.00 33.31 H new ATOM 0 HB3 GLU A 3 -6.831 4.842 6.121 1.00 33.31 H new ATOM 0 HG2 GLU A 3 -9.745 5.203 6.962 1.00 52.42 H new ATOM 0 HG3 GLU A 3 -8.397 4.965 8.056 1.00 52.42 H new ATOM 57 N LEU A 4 -6.530 4.470 2.899 1.00 14.20 N ATOM 58 CA LEU A 4 -5.894 3.684 1.821 1.00 33.12 C ATOM 59 C LEU A 4 -4.445 3.359 2.194 1.00 62.24 C ATOM 60 O LEU A 4 -3.615 4.258 2.308 1.00 32.30 O ATOM 61 CB LEU A 4 -5.975 4.452 0.453 1.00 71.02 C ATOM 62 CG LEU A 4 -7.175 4.092 -0.490 1.00 30.30 C ATOM 63 CD1 LEU A 4 -7.144 2.597 -0.863 1.00 33.41 C ATOM 64 CD2 LEU A 4 -8.545 4.494 0.102 1.00 43.21 C ATOM 0 H LEU A 4 -6.004 5.302 3.165 1.00 14.20 H new ATOM 0 HA LEU A 4 -6.434 2.745 1.702 1.00 33.12 H new ATOM 0 HB2 LEU A 4 -6.018 5.520 0.665 1.00 71.02 H new ATOM 0 HB3 LEU A 4 -5.049 4.273 -0.093 1.00 71.02 H new ATOM 0 HG LEU A 4 -7.051 4.680 -1.399 1.00 30.30 H new ATOM 0 HD11 LEU A 4 -7.985 2.368 -1.518 1.00 33.41 H new ATOM 0 HD12 LEU A 4 -6.211 2.370 -1.378 1.00 33.41 H new ATOM 0 HD13 LEU A 4 -7.215 1.995 0.043 1.00 33.41 H new ATOM 0 HD21 LEU A 4 -9.337 4.220 -0.595 1.00 43.21 H new ATOM 0 HD22 LEU A 4 -8.699 3.975 1.048 1.00 43.21 H new ATOM 0 HD23 LEU A 4 -8.567 5.571 0.271 1.00 43.21 H new ATOM 76 N ILE A 5 -4.158 2.065 2.387 1.00 24.10 N ATOM 77 CA ILE A 5 -2.804 1.562 2.685 1.00 64.30 C ATOM 78 C ILE A 5 -2.259 0.811 1.453 1.00 43.45 C ATOM 79 O ILE A 5 -2.906 -0.096 0.932 1.00 3.44 O ATOM 80 CB ILE A 5 -2.806 0.628 3.955 1.00 74.15 C ATOM 81 CG1 ILE A 5 -1.385 0.048 4.249 1.00 13.22 C ATOM 82 CG2 ILE A 5 -3.866 -0.487 3.836 1.00 35.44 C ATOM 83 CD1 ILE A 5 -1.296 -0.850 5.480 1.00 63.24 C ATOM 0 H ILE A 5 -4.863 1.329 2.341 1.00 24.10 H new ATOM 0 HA ILE A 5 -2.155 2.409 2.909 1.00 64.30 H new ATOM 0 HB ILE A 5 -3.081 1.245 4.810 1.00 74.15 H new ATOM 0 HG12 ILE A 5 -1.054 -0.520 3.379 1.00 13.22 H new ATOM 0 HG13 ILE A 5 -0.689 0.878 4.372 1.00 13.22 H new ATOM 0 HG21 ILE A 5 -3.839 -1.112 4.729 1.00 35.44 H new ATOM 0 HG22 ILE A 5 -4.855 -0.040 3.736 1.00 35.44 H new ATOM 0 HG23 ILE A 5 -3.654 -1.099 2.959 1.00 35.44 H new ATOM 0 HD11 ILE A 5 -0.272 -1.203 5.600 1.00 63.24 H new ATOM 0 HD12 ILE A 5 -1.591 -0.285 6.364 1.00 63.24 H new ATOM 0 HD13 ILE A 5 -1.962 -1.704 5.356 1.00 63.24 H new ATOM 95 N LEU A 6 -1.081 1.222 0.975 1.00 4.34 N ATOM 96 CA LEU A 6 -0.420 0.621 -0.185 1.00 52.22 C ATOM 97 C LEU A 6 0.815 -0.135 0.305 1.00 64.42 C ATOM 98 O LEU A 6 1.713 0.467 0.896 1.00 60.35 O ATOM 99 CB LEU A 6 -0.028 1.696 -1.240 1.00 15.45 C ATOM 100 CG LEU A 6 -1.204 2.529 -1.874 1.00 74.11 C ATOM 101 CD1 LEU A 6 -1.753 3.602 -0.907 1.00 2.13 C ATOM 102 CD2 LEU A 6 -0.782 3.153 -3.217 1.00 33.41 C ATOM 0 H LEU A 6 -0.554 1.991 1.388 1.00 4.34 H new ATOM 0 HA LEU A 6 -1.109 -0.066 -0.677 1.00 52.22 H new ATOM 0 HB2 LEU A 6 0.669 2.392 -0.773 1.00 15.45 H new ATOM 0 HB3 LEU A 6 0.511 1.200 -2.047 1.00 15.45 H new ATOM 0 HG LEU A 6 -2.019 1.831 -2.065 1.00 74.11 H new ATOM 0 HD11 LEU A 6 -2.562 4.149 -1.392 1.00 2.13 H new ATOM 0 HD12 LEU A 6 -2.130 3.120 -0.005 1.00 2.13 H new ATOM 0 HD13 LEU A 6 -0.955 4.295 -0.641 1.00 2.13 H new ATOM 0 HD21 LEU A 6 -1.614 3.722 -3.631 1.00 33.41 H new ATOM 0 HD22 LEU A 6 0.068 3.816 -3.059 1.00 33.41 H new ATOM 0 HD23 LEU A 6 -0.501 2.363 -3.913 1.00 33.41 H new ATOM 114 N ILE A 7 0.842 -1.454 0.079 1.00 71.44 N ATOM 115 CA ILE A 7 1.944 -2.326 0.493 1.00 44.14 C ATOM 116 C ILE A 7 2.864 -2.564 -0.712 1.00 32.42 C ATOM 117 O ILE A 7 2.406 -2.956 -1.781 1.00 31.05 O ATOM 118 CB ILE A 7 1.464 -3.721 1.085 1.00 71.44 C ATOM 119 CG1 ILE A 7 0.687 -3.559 2.437 1.00 72.43 C ATOM 120 CG2 ILE A 7 2.656 -4.686 1.283 1.00 50.31 C ATOM 121 CD1 ILE A 7 -0.679 -2.923 2.325 1.00 23.33 C ATOM 0 H ILE A 7 0.091 -1.949 -0.401 1.00 71.44 H new ATOM 0 HA ILE A 7 2.472 -1.818 1.300 1.00 44.14 H new ATOM 0 HB ILE A 7 0.779 -4.145 0.351 1.00 71.44 H new ATOM 0 HG12 ILE A 7 0.575 -4.543 2.893 1.00 72.43 H new ATOM 0 HG13 ILE A 7 1.294 -2.960 3.116 1.00 72.43 H new ATOM 0 HG21 ILE A 7 2.295 -5.631 1.689 1.00 50.31 H new ATOM 0 HG22 ILE A 7 3.142 -4.865 0.324 1.00 50.31 H new ATOM 0 HG23 ILE A 7 3.372 -4.243 1.976 1.00 50.31 H new ATOM 0 HD11 ILE A 7 -1.132 -2.857 3.314 1.00 23.33 H new ATOM 0 HD12 ILE A 7 -0.581 -1.923 1.903 1.00 23.33 H new ATOM 0 HD13 ILE A 7 -1.311 -3.530 1.677 1.00 23.33 H new ATOM 133 N ASN A 8 4.154 -2.307 -0.519 1.00 0.41 N ATOM 134 CA ASN A 8 5.199 -2.599 -1.486 1.00 13.13 C ATOM 135 C ASN A 8 5.895 -3.872 -1.018 1.00 33.11 C ATOM 136 O ASN A 8 6.502 -3.873 0.051 1.00 31.12 O ATOM 137 CB ASN A 8 6.208 -1.432 -1.546 1.00 0.23 C ATOM 138 CG ASN A 8 7.300 -1.588 -2.604 1.00 74.22 C ATOM 139 OD1 ASN A 8 8.450 -1.219 -2.375 1.00 64.44 O ATOM 140 ND2 ASN A 8 6.944 -2.073 -3.791 1.00 34.03 N ATOM 0 H ASN A 8 4.507 -1.879 0.337 1.00 0.41 H new ATOM 0 HA ASN A 8 4.781 -2.729 -2.484 1.00 13.13 H new ATOM 0 HB2 ASN A 8 5.663 -0.508 -1.739 1.00 0.23 H new ATOM 0 HB3 ASN A 8 6.680 -1.326 -0.569 1.00 0.23 H new ATOM 0 HD21 ASN A 8 7.633 -2.146 -4.540 1.00 34.03 H new ATOM 0 HD22 ASN A 8 5.982 -2.372 -3.952 1.00 34.03 H new ATOM 147 N THR A 9 5.748 -4.961 -1.769 1.00 32.34 N ATOM 148 CA THR A 9 6.372 -6.247 -1.428 1.00 10.21 C ATOM 149 C THR A 9 6.809 -6.972 -2.706 1.00 44.11 C ATOM 150 O THR A 9 5.996 -7.258 -3.596 1.00 34.11 O ATOM 151 CB THR A 9 5.432 -7.140 -0.539 1.00 3.14 C ATOM 152 OG1 THR A 9 5.937 -8.484 -0.435 1.00 1.02 O ATOM 153 CG2 THR A 9 3.986 -7.152 -1.041 1.00 1.43 C ATOM 0 H THR A 9 5.197 -4.982 -2.627 1.00 32.34 H new ATOM 0 HA THR A 9 7.259 -6.048 -0.826 1.00 10.21 H new ATOM 0 HB THR A 9 5.427 -6.689 0.453 1.00 3.14 H new ATOM 0 HG1 THR A 9 6.805 -8.473 0.020 1.00 1.02 H new ATOM 0 HG21 THR A 9 3.380 -7.784 -0.391 1.00 1.43 H new ATOM 0 HG22 THR A 9 3.589 -6.137 -1.032 1.00 1.43 H new ATOM 0 HG23 THR A 9 3.957 -7.544 -2.058 1.00 1.43 H new ATOM 161 N ASN A 10 8.123 -7.219 -2.793 1.00 65.14 N ATOM 162 CA ASN A 10 8.749 -7.972 -3.893 1.00 34.13 C ATOM 163 C ASN A 10 8.862 -9.478 -3.524 1.00 0.23 C ATOM 164 O ASN A 10 9.467 -10.272 -4.248 1.00 71.51 O ATOM 165 CB ASN A 10 10.143 -7.354 -4.193 1.00 40.42 C ATOM 166 CG ASN A 10 10.819 -7.850 -5.482 1.00 52.12 C ATOM 167 OD1 ASN A 10 12.040 -7.991 -5.535 1.00 21.25 O ATOM 168 ND2 ASN A 10 10.043 -8.084 -6.541 1.00 33.43 N ATOM 0 H ASN A 10 8.792 -6.898 -2.093 1.00 65.14 H new ATOM 0 HA ASN A 10 8.132 -7.904 -4.789 1.00 34.13 H new ATOM 0 HB2 ASN A 10 10.037 -6.271 -4.252 1.00 40.42 H new ATOM 0 HB3 ASN A 10 10.804 -7.564 -3.352 1.00 40.42 H new ATOM 0 HD21 ASN A 10 10.459 -8.387 -7.421 1.00 33.43 H new ATOM 0 HD22 ASN A 10 9.033 -7.960 -6.471 1.00 33.43 H new ATOM 175 N ASN A 11 8.257 -9.864 -2.385 1.00 41.51 N ATOM 176 CA ASN A 11 8.242 -11.254 -1.895 1.00 22.11 C ATOM 177 C ASN A 11 6.854 -11.866 -2.145 1.00 23.24 C ATOM 178 O ASN A 11 5.887 -11.528 -1.455 1.00 63.00 O ATOM 179 CB ASN A 11 8.612 -11.291 -0.388 1.00 51.54 C ATOM 180 CG ASN A 11 8.618 -12.704 0.218 1.00 41.53 C ATOM 181 OD1 ASN A 11 8.851 -13.704 -0.468 1.00 51.33 O ATOM 182 ND2 ASN A 11 8.405 -12.786 1.520 1.00 52.01 N ATOM 0 H ASN A 11 7.761 -9.214 -1.775 1.00 41.51 H new ATOM 0 HA ASN A 11 8.983 -11.844 -2.434 1.00 22.11 H new ATOM 0 HB2 ASN A 11 9.598 -10.845 -0.255 1.00 51.54 H new ATOM 0 HB3 ASN A 11 7.905 -10.672 0.165 1.00 51.54 H new ATOM 0 HD21 ASN A 11 8.431 -13.694 1.985 1.00 52.01 H new ATOM 0 HD22 ASN A 11 8.215 -11.942 2.060 1.00 52.01 H new ATOM 189 N ASP A 12 6.783 -12.778 -3.132 1.00 65.22 N ATOM 190 CA ASP A 12 5.518 -13.350 -3.643 1.00 42.20 C ATOM 191 C ASP A 12 4.730 -14.105 -2.562 1.00 13.23 C ATOM 192 O ASP A 12 3.511 -13.924 -2.450 1.00 24.34 O ATOM 193 CB ASP A 12 5.790 -14.284 -4.853 1.00 15.25 C ATOM 194 CG ASP A 12 6.310 -13.527 -6.087 1.00 32.10 C ATOM 195 OD1 ASP A 12 5.483 -13.037 -6.888 1.00 3.30 O ATOM 196 OD2 ASP A 12 7.542 -13.395 -6.246 1.00 44.33 O ATOM 0 H ASP A 12 7.610 -13.144 -3.604 1.00 65.22 H new ATOM 0 HA ASP A 12 4.903 -12.510 -3.964 1.00 42.20 H new ATOM 0 HB2 ASP A 12 6.518 -15.042 -4.564 1.00 15.25 H new ATOM 0 HB3 ASP A 12 4.871 -14.808 -5.115 1.00 15.25 H new ATOM 201 N GLU A 13 5.438 -14.935 -1.760 1.00 42.44 N ATOM 202 CA GLU A 13 4.803 -15.741 -0.702 1.00 60.23 C ATOM 203 C GLU A 13 4.200 -14.832 0.380 1.00 74.11 C ATOM 204 O GLU A 13 3.155 -15.158 0.945 1.00 61.33 O ATOM 205 CB GLU A 13 5.794 -16.797 -0.110 1.00 22.22 C ATOM 206 CG GLU A 13 7.014 -16.256 0.694 1.00 35.41 C ATOM 207 CD GLU A 13 6.760 -16.065 2.213 1.00 45.30 C ATOM 208 OE1 GLU A 13 6.701 -17.075 2.949 1.00 4.01 O ATOM 209 OE2 GLU A 13 6.649 -14.912 2.684 1.00 63.05 O ATOM 0 H GLU A 13 6.448 -15.061 -1.829 1.00 42.44 H new ATOM 0 HA GLU A 13 3.984 -16.306 -1.147 1.00 60.23 H new ATOM 0 HB2 GLU A 13 5.228 -17.463 0.542 1.00 22.22 H new ATOM 0 HB3 GLU A 13 6.173 -17.403 -0.933 1.00 22.22 H new ATOM 0 HG2 GLU A 13 7.850 -16.943 0.563 1.00 35.41 H new ATOM 0 HG3 GLU A 13 7.317 -15.300 0.268 1.00 35.41 H new ATOM 216 N LEU A 14 4.846 -13.663 0.619 1.00 1.03 N ATOM 217 CA LEU A 14 4.372 -12.682 1.600 1.00 24.34 C ATOM 218 C LEU A 14 3.064 -12.051 1.127 1.00 11.34 C ATOM 219 O LEU A 14 2.143 -11.908 1.923 1.00 12.23 O ATOM 220 CB LEU A 14 5.418 -11.574 1.851 1.00 2.51 C ATOM 221 CG LEU A 14 5.080 -10.604 3.021 1.00 22.13 C ATOM 222 CD1 LEU A 14 5.084 -11.342 4.374 1.00 41.50 C ATOM 223 CD2 LEU A 14 6.012 -9.383 3.029 1.00 60.33 C ATOM 0 H LEU A 14 5.701 -13.385 0.137 1.00 1.03 H new ATOM 0 HA LEU A 14 4.206 -13.212 2.538 1.00 24.34 H new ATOM 0 HB2 LEU A 14 6.381 -12.043 2.054 1.00 2.51 H new ATOM 0 HB3 LEU A 14 5.534 -10.991 0.937 1.00 2.51 H new ATOM 0 HG LEU A 14 4.069 -10.229 2.860 1.00 22.13 H new ATOM 0 HD11 LEU A 14 4.845 -10.639 5.172 1.00 41.50 H new ATOM 0 HD12 LEU A 14 4.340 -12.138 4.356 1.00 41.50 H new ATOM 0 HD13 LEU A 14 6.070 -11.771 4.552 1.00 41.50 H new ATOM 0 HD21 LEU A 14 5.747 -8.728 3.859 1.00 60.33 H new ATOM 0 HD22 LEU A 14 7.044 -9.714 3.144 1.00 60.33 H new ATOM 0 HD23 LEU A 14 5.907 -8.839 2.090 1.00 60.33 H new ATOM 235 N ILE A 15 3.001 -11.708 -0.186 1.00 51.33 N ATOM 236 CA ILE A 15 1.800 -11.106 -0.814 1.00 62.23 C ATOM 237 C ILE A 15 0.560 -11.969 -0.528 1.00 74.04 C ATOM 238 O ILE A 15 -0.460 -11.453 -0.084 1.00 53.11 O ATOM 239 CB ILE A 15 1.961 -10.937 -2.378 1.00 13.15 C ATOM 240 CG1 ILE A 15 3.269 -10.161 -2.713 1.00 12.23 C ATOM 241 CG2 ILE A 15 0.725 -10.227 -2.995 1.00 61.10 C ATOM 242 CD1 ILE A 15 3.590 -10.002 -4.187 1.00 22.33 C ATOM 0 H ILE A 15 3.778 -11.841 -0.834 1.00 51.33 H new ATOM 0 HA ILE A 15 1.679 -10.115 -0.377 1.00 62.23 H new ATOM 0 HB ILE A 15 2.029 -11.931 -2.819 1.00 13.15 H new ATOM 0 HG12 ILE A 15 3.203 -9.169 -2.267 1.00 12.23 H new ATOM 0 HG13 ILE A 15 4.104 -10.672 -2.233 1.00 12.23 H new ATOM 0 HG21 ILE A 15 0.864 -10.125 -4.071 1.00 61.10 H new ATOM 0 HG22 ILE A 15 -0.170 -10.818 -2.799 1.00 61.10 H new ATOM 0 HG23 ILE A 15 0.612 -9.239 -2.548 1.00 61.10 H new ATOM 0 HD11 ILE A 15 4.521 -9.447 -4.299 1.00 22.33 H new ATOM 0 HD12 ILE A 15 3.697 -10.986 -4.644 1.00 22.33 H new ATOM 0 HD13 ILE A 15 2.783 -9.459 -4.679 1.00 22.33 H new ATOM 254 N LYS A 16 0.721 -13.298 -0.722 1.00 13.42 N ATOM 255 CA LYS A 16 -0.353 -14.297 -0.510 1.00 71.21 C ATOM 256 C LYS A 16 -0.851 -14.255 0.954 1.00 44.14 C ATOM 257 O LYS A 16 -2.056 -14.212 1.214 1.00 2.30 O ATOM 258 CB LYS A 16 0.157 -15.731 -0.832 1.00 35.14 C ATOM 259 CG LYS A 16 0.935 -15.885 -2.153 1.00 54.45 C ATOM 260 CD LYS A 16 0.145 -15.453 -3.407 1.00 22.24 C ATOM 261 CE LYS A 16 0.962 -15.652 -4.695 1.00 74.14 C ATOM 262 NZ LYS A 16 0.233 -15.172 -5.899 1.00 72.53 N ATOM 0 H LYS A 16 1.602 -13.709 -1.031 1.00 13.42 H new ATOM 0 HA LYS A 16 -1.175 -14.049 -1.181 1.00 71.21 H new ATOM 0 HB2 LYS A 16 0.798 -16.060 -0.014 1.00 35.14 H new ATOM 0 HB3 LYS A 16 -0.700 -16.404 -0.856 1.00 35.14 H new ATOM 0 HG2 LYS A 16 1.850 -15.296 -2.093 1.00 54.45 H new ATOM 0 HG3 LYS A 16 1.233 -16.927 -2.267 1.00 54.45 H new ATOM 0 HD2 LYS A 16 -0.779 -16.028 -3.470 1.00 22.24 H new ATOM 0 HD3 LYS A 16 -0.138 -14.404 -3.315 1.00 22.24 H new ATOM 0 HE2 LYS A 16 1.909 -15.120 -4.609 1.00 74.14 H new ATOM 0 HE3 LYS A 16 1.200 -16.709 -4.813 1.00 74.14 H new ATOM 0 HZ1 LYS A 16 0.820 -15.325 -6.744 1.00 72.53 H new ATOM 0 HZ2 LYS A 16 -0.659 -15.697 -5.997 1.00 72.53 H new ATOM 0 HZ3 LYS A 16 0.028 -14.157 -5.799 1.00 72.53 H new ATOM 276 N LYS A 17 0.124 -14.236 1.882 1.00 22.22 N ATOM 277 CA LYS A 17 -0.111 -14.231 3.338 1.00 24.42 C ATOM 278 C LYS A 17 -0.835 -12.949 3.791 1.00 10.23 C ATOM 279 O LYS A 17 -1.743 -13.016 4.626 1.00 60.54 O ATOM 280 CB LYS A 17 1.249 -14.390 4.067 1.00 2.40 C ATOM 281 CG LYS A 17 1.874 -15.809 3.940 1.00 65.12 C ATOM 282 CD LYS A 17 3.413 -15.820 4.099 1.00 64.43 C ATOM 283 CE LYS A 17 3.919 -15.131 5.373 1.00 72.42 C ATOM 284 NZ LYS A 17 5.406 -15.194 5.473 1.00 52.51 N ATOM 0 H LYS A 17 1.114 -14.223 1.637 1.00 22.22 H new ATOM 0 HA LYS A 17 -0.762 -15.067 3.595 1.00 24.42 H new ATOM 0 HB2 LYS A 17 1.951 -13.658 3.668 1.00 2.40 H new ATOM 0 HB3 LYS A 17 1.113 -14.158 5.123 1.00 2.40 H new ATOM 0 HG2 LYS A 17 1.434 -16.461 4.695 1.00 65.12 H new ATOM 0 HG3 LYS A 17 1.614 -16.227 2.967 1.00 65.12 H new ATOM 0 HD2 LYS A 17 3.760 -16.853 4.096 1.00 64.43 H new ATOM 0 HD3 LYS A 17 3.860 -15.331 3.233 1.00 64.43 H new ATOM 0 HE2 LYS A 17 3.596 -14.090 5.378 1.00 72.42 H new ATOM 0 HE3 LYS A 17 3.474 -15.607 6.247 1.00 72.42 H new ATOM 0 HZ1 LYS A 17 5.747 -14.417 6.074 1.00 52.51 H new ATOM 0 HZ2 LYS A 17 5.688 -16.104 5.891 1.00 52.51 H new ATOM 0 HZ3 LYS A 17 5.822 -15.106 4.524 1.00 52.51 H new ATOM 298 N ILE A 18 -0.439 -11.797 3.198 1.00 73.32 N ATOM 299 CA ILE A 18 -1.052 -10.485 3.483 1.00 15.41 C ATOM 300 C ILE A 18 -2.539 -10.533 3.123 1.00 32.21 C ATOM 301 O ILE A 18 -3.377 -10.193 3.950 1.00 2.34 O ATOM 302 CB ILE A 18 -0.336 -9.307 2.702 1.00 34.35 C ATOM 303 CG1 ILE A 18 1.160 -9.184 3.133 1.00 73.54 C ATOM 304 CG2 ILE A 18 -1.073 -7.952 2.905 1.00 74.13 C ATOM 305 CD1 ILE A 18 1.988 -8.215 2.308 1.00 74.21 C ATOM 0 H ILE A 18 0.313 -11.755 2.510 1.00 73.32 H new ATOM 0 HA ILE A 18 -0.932 -10.281 4.547 1.00 15.41 H new ATOM 0 HB ILE A 18 -0.374 -9.550 1.640 1.00 34.35 H new ATOM 0 HG12 ILE A 18 1.197 -8.873 4.177 1.00 73.54 H new ATOM 0 HG13 ILE A 18 1.621 -10.170 3.078 1.00 73.54 H new ATOM 0 HG21 ILE A 18 -0.552 -7.169 2.354 1.00 74.13 H new ATOM 0 HG22 ILE A 18 -2.096 -8.036 2.538 1.00 74.13 H new ATOM 0 HG23 ILE A 18 -1.088 -7.701 3.966 1.00 74.13 H new ATOM 0 HD11 ILE A 18 3.011 -8.199 2.684 1.00 74.21 H new ATOM 0 HD12 ILE A 18 1.989 -8.533 1.266 1.00 74.21 H new ATOM 0 HD13 ILE A 18 1.559 -7.216 2.382 1.00 74.21 H new ATOM 317 N LYS A 19 -2.838 -11.049 1.902 1.00 53.20 N ATOM 318 CA LYS A 19 -4.216 -11.172 1.382 1.00 54.33 C ATOM 319 C LYS A 19 -5.116 -11.903 2.378 1.00 14.23 C ATOM 320 O LYS A 19 -6.206 -11.435 2.693 1.00 52.24 O ATOM 321 CB LYS A 19 -4.249 -11.929 0.029 1.00 23.12 C ATOM 322 CG LYS A 19 -3.402 -11.287 -1.078 1.00 64.54 C ATOM 323 CD LYS A 19 -3.664 -11.910 -2.460 1.00 71.53 C ATOM 324 CE LYS A 19 -2.986 -11.135 -3.588 1.00 73.44 C ATOM 325 NZ LYS A 19 -3.372 -11.661 -4.918 1.00 3.13 N ATOM 0 H LYS A 19 -2.127 -11.390 1.255 1.00 53.20 H new ATOM 0 HA LYS A 19 -4.586 -10.158 1.232 1.00 54.33 H new ATOM 0 HB2 LYS A 19 -3.902 -12.950 0.189 1.00 23.12 H new ATOM 0 HB3 LYS A 19 -5.282 -11.993 -0.312 1.00 23.12 H new ATOM 0 HG2 LYS A 19 -3.614 -10.219 -1.119 1.00 64.54 H new ATOM 0 HG3 LYS A 19 -2.346 -11.393 -0.830 1.00 64.54 H new ATOM 0 HD2 LYS A 19 -3.306 -12.940 -2.465 1.00 71.53 H new ATOM 0 HD3 LYS A 19 -4.738 -11.945 -2.642 1.00 71.53 H new ATOM 0 HE2 LYS A 19 -3.256 -10.081 -3.520 1.00 73.44 H new ATOM 0 HE3 LYS A 19 -1.904 -11.195 -3.472 1.00 73.44 H new ATOM 0 HZ1 LYS A 19 -3.497 -10.870 -5.581 1.00 3.13 H new ATOM 0 HZ2 LYS A 19 -2.626 -12.294 -5.271 1.00 3.13 H new ATOM 0 HZ3 LYS A 19 -4.265 -12.189 -4.837 1.00 3.13 H new ATOM 339 N LYS A 20 -4.599 -13.030 2.895 1.00 54.21 N ATOM 340 CA LYS A 20 -5.333 -13.898 3.814 1.00 24.13 C ATOM 341 C LYS A 20 -5.642 -13.183 5.138 1.00 32.24 C ATOM 342 O LYS A 20 -6.766 -13.277 5.636 1.00 32.33 O ATOM 343 CB LYS A 20 -4.553 -15.223 4.033 1.00 21.23 C ATOM 344 CG LYS A 20 -4.313 -16.077 2.750 1.00 43.01 C ATOM 345 CD LYS A 20 -5.620 -16.519 2.006 1.00 51.53 C ATOM 346 CE LYS A 20 -6.108 -15.515 0.935 1.00 72.13 C ATOM 347 NZ LYS A 20 -7.497 -15.795 0.473 1.00 4.14 N ATOM 0 H LYS A 20 -3.658 -13.360 2.683 1.00 54.21 H new ATOM 0 HA LYS A 20 -6.295 -14.145 3.366 1.00 24.13 H new ATOM 0 HB2 LYS A 20 -3.586 -14.987 4.478 1.00 21.23 H new ATOM 0 HB3 LYS A 20 -5.097 -15.830 4.757 1.00 21.23 H new ATOM 0 HG2 LYS A 20 -3.693 -15.505 2.059 1.00 43.01 H new ATOM 0 HG3 LYS A 20 -3.747 -16.968 3.023 1.00 43.01 H new ATOM 0 HD2 LYS A 20 -5.446 -17.484 1.531 1.00 51.53 H new ATOM 0 HD3 LYS A 20 -6.412 -16.664 2.741 1.00 51.53 H new ATOM 0 HE2 LYS A 20 -6.062 -14.505 1.342 1.00 72.13 H new ATOM 0 HE3 LYS A 20 -5.432 -15.545 0.080 1.00 72.13 H new ATOM 0 HZ1 LYS A 20 -7.972 -14.900 0.240 1.00 4.14 H new ATOM 0 HZ2 LYS A 20 -7.466 -16.401 -0.371 1.00 4.14 H new ATOM 0 HZ3 LYS A 20 -8.023 -16.280 1.228 1.00 4.14 H new ATOM 361 N GLU A 21 -4.660 -12.418 5.666 1.00 51.13 N ATOM 362 CA GLU A 21 -4.839 -11.635 6.910 1.00 72.30 C ATOM 363 C GLU A 21 -5.914 -10.545 6.740 1.00 73.31 C ATOM 364 O GLU A 21 -6.804 -10.392 7.578 1.00 3.13 O ATOM 365 CB GLU A 21 -3.502 -10.981 7.359 1.00 44.52 C ATOM 366 CG GLU A 21 -2.349 -11.975 7.613 1.00 13.04 C ATOM 367 CD GLU A 21 -2.735 -13.118 8.567 1.00 14.44 C ATOM 368 OE1 GLU A 21 -2.858 -12.863 9.788 1.00 75.24 O ATOM 369 OE2 GLU A 21 -2.911 -14.269 8.110 1.00 50.44 O ATOM 0 H GLU A 21 -3.734 -12.326 5.249 1.00 51.13 H new ATOM 0 HA GLU A 21 -5.168 -12.333 7.680 1.00 72.30 H new ATOM 0 HB2 GLU A 21 -3.188 -10.269 6.596 1.00 44.52 H new ATOM 0 HB3 GLU A 21 -3.680 -10.412 8.272 1.00 44.52 H new ATOM 0 HG2 GLU A 21 -2.026 -12.398 6.662 1.00 13.04 H new ATOM 0 HG3 GLU A 21 -1.497 -11.436 8.028 1.00 13.04 H new ATOM 376 N VAL A 22 -5.830 -9.833 5.617 1.00 35.45 N ATOM 377 CA VAL A 22 -6.663 -8.658 5.319 1.00 52.32 C ATOM 378 C VAL A 22 -8.125 -9.063 5.033 1.00 72.34 C ATOM 379 O VAL A 22 -9.062 -8.357 5.423 1.00 3.34 O ATOM 380 CB VAL A 22 -6.049 -7.884 4.103 1.00 74.13 C ATOM 381 CG1 VAL A 22 -6.885 -6.661 3.702 1.00 1.04 C ATOM 382 CG2 VAL A 22 -4.600 -7.469 4.404 1.00 32.33 C ATOM 0 H VAL A 22 -5.170 -10.057 4.872 1.00 35.45 H new ATOM 0 HA VAL A 22 -6.676 -8.005 6.192 1.00 52.32 H new ATOM 0 HB VAL A 22 -6.056 -8.568 3.254 1.00 74.13 H new ATOM 0 HG11 VAL A 22 -6.415 -6.161 2.855 1.00 1.04 H new ATOM 0 HG12 VAL A 22 -7.889 -6.982 3.423 1.00 1.04 H new ATOM 0 HG13 VAL A 22 -6.946 -5.970 4.543 1.00 1.04 H new ATOM 0 HG21 VAL A 22 -4.190 -6.933 3.548 1.00 32.33 H new ATOM 0 HG22 VAL A 22 -4.582 -6.822 5.281 1.00 32.33 H new ATOM 0 HG23 VAL A 22 -3.999 -8.358 4.597 1.00 32.33 H new ATOM 392 N GLU A 23 -8.295 -10.222 4.374 1.00 53.31 N ATOM 393 CA GLU A 23 -9.621 -10.792 4.063 1.00 23.12 C ATOM 394 C GLU A 23 -10.312 -11.312 5.340 1.00 23.53 C ATOM 395 O GLU A 23 -11.545 -11.338 5.414 1.00 53.22 O ATOM 396 CB GLU A 23 -9.497 -11.908 2.989 1.00 2.55 C ATOM 397 CG GLU A 23 -9.202 -11.381 1.567 1.00 70.55 C ATOM 398 CD GLU A 23 -9.062 -12.491 0.513 1.00 33.01 C ATOM 399 OE1 GLU A 23 -10.097 -13.052 0.088 1.00 52.11 O ATOM 400 OE2 GLU A 23 -7.924 -12.805 0.099 1.00 73.34 O ATOM 0 H GLU A 23 -7.517 -10.792 4.041 1.00 53.31 H new ATOM 0 HA GLU A 23 -10.248 -10.000 3.652 1.00 23.12 H new ATOM 0 HB2 GLU A 23 -8.703 -12.594 3.283 1.00 2.55 H new ATOM 0 HB3 GLU A 23 -10.423 -12.482 2.968 1.00 2.55 H new ATOM 0 HG2 GLU A 23 -10.003 -10.706 1.266 1.00 70.55 H new ATOM 0 HG3 GLU A 23 -8.283 -10.796 1.590 1.00 70.55 H new ATOM 407 N ASN A 24 -9.502 -11.716 6.347 1.00 64.25 N ATOM 408 CA ASN A 24 -10.011 -12.095 7.688 1.00 12.12 C ATOM 409 C ASN A 24 -10.529 -10.848 8.428 1.00 42.34 C ATOM 410 O ASN A 24 -11.513 -10.922 9.167 1.00 63.22 O ATOM 411 CB ASN A 24 -8.911 -12.799 8.536 1.00 74.14 C ATOM 412 CG ASN A 24 -8.493 -14.172 8.003 1.00 41.42 C ATOM 413 OD1 ASN A 24 -9.291 -14.911 7.420 1.00 53.01 O ATOM 414 ND2 ASN A 24 -7.233 -14.530 8.203 1.00 23.05 N ATOM 0 H ASN A 24 -8.489 -11.788 6.256 1.00 64.25 H new ATOM 0 HA ASN A 24 -10.831 -12.800 7.549 1.00 12.12 H new ATOM 0 HB2 ASN A 24 -8.033 -12.155 8.578 1.00 74.14 H new ATOM 0 HB3 ASN A 24 -9.273 -12.913 9.558 1.00 74.14 H new ATOM 0 HD21 ASN A 24 -6.902 -15.436 7.872 1.00 23.05 H new ATOM 0 HD22 ASN A 24 -6.595 -13.899 8.688 1.00 23.05 H new ATOM 421 N GLN A 25 -9.861 -9.698 8.203 1.00 20.25 N ATOM 422 CA GLN A 25 -10.246 -8.404 8.813 1.00 42.43 C ATOM 423 C GLN A 25 -11.428 -7.769 8.047 1.00 15.34 C ATOM 424 O GLN A 25 -12.150 -6.929 8.591 1.00 42.31 O ATOM 425 CB GLN A 25 -9.026 -7.437 8.849 1.00 71.25 C ATOM 426 CG GLN A 25 -7.738 -8.017 9.494 1.00 11.35 C ATOM 427 CD GLN A 25 -7.810 -8.327 11.001 1.00 63.21 C ATOM 428 OE1 GLN A 25 -8.858 -8.645 11.560 1.00 52.24 O ATOM 429 NE2 GLN A 25 -6.666 -8.253 11.666 1.00 3.20 N ATOM 0 H GLN A 25 -9.043 -9.638 7.597 1.00 20.25 H new ATOM 0 HA GLN A 25 -10.569 -8.588 9.838 1.00 42.43 H new ATOM 0 HB2 GLN A 25 -8.795 -7.131 7.828 1.00 71.25 H new ATOM 0 HB3 GLN A 25 -9.312 -6.538 9.394 1.00 71.25 H new ATOM 0 HG2 GLN A 25 -7.475 -8.935 8.968 1.00 11.35 H new ATOM 0 HG3 GLN A 25 -6.924 -7.311 9.328 1.00 11.35 H new ATOM 0 HE21 GLN A 25 -5.810 -7.987 11.180 1.00 3.20 H new ATOM 0 HE22 GLN A 25 -6.642 -8.462 12.664 1.00 3.20 H new ATOM 438 N GLY A 26 -11.605 -8.177 6.774 1.00 64.23 N ATOM 439 CA GLY A 26 -12.746 -7.754 5.955 1.00 63.54 C ATOM 440 C GLY A 26 -12.494 -6.477 5.162 1.00 14.55 C ATOM 441 O GLY A 26 -13.398 -5.651 5.005 1.00 35.02 O ATOM 0 H GLY A 26 -10.962 -8.805 6.292 1.00 64.23 H new ATOM 0 HA2 GLY A 26 -13.002 -8.556 5.263 1.00 63.54 H new ATOM 0 HA3 GLY A 26 -13.610 -7.604 6.602 1.00 63.54 H new ATOM 445 N TYR A 27 -11.258 -6.311 4.664 1.00 30.23 N ATOM 446 CA TYR A 27 -10.878 -5.185 3.774 1.00 50.34 C ATOM 447 C TYR A 27 -10.696 -5.729 2.348 1.00 51.32 C ATOM 448 O TYR A 27 -10.392 -6.920 2.167 1.00 1.44 O ATOM 449 CB TYR A 27 -9.557 -4.498 4.241 1.00 14.25 C ATOM 450 CG TYR A 27 -9.564 -3.797 5.614 1.00 4.42 C ATOM 451 CD1 TYR A 27 -10.230 -4.339 6.717 1.00 42.33 C ATOM 452 CD2 TYR A 27 -8.875 -2.594 5.813 1.00 24.24 C ATOM 453 CE1 TYR A 27 -10.222 -3.716 7.943 1.00 45.52 C ATOM 454 CE2 TYR A 27 -8.862 -1.971 7.045 1.00 52.20 C ATOM 455 CZ TYR A 27 -9.541 -2.536 8.108 1.00 1.23 C ATOM 456 OH TYR A 27 -9.539 -1.917 9.341 1.00 51.32 O ATOM 0 H TYR A 27 -10.489 -6.950 4.863 1.00 30.23 H new ATOM 0 HA TYR A 27 -11.669 -4.435 3.806 1.00 50.34 H new ATOM 0 HB2 TYR A 27 -8.772 -5.254 4.254 1.00 14.25 H new ATOM 0 HB3 TYR A 27 -9.278 -3.760 3.489 1.00 14.25 H new ATOM 0 HD1 TYR A 27 -10.764 -5.271 6.604 1.00 42.33 H new ATOM 0 HD2 TYR A 27 -8.344 -2.145 4.987 1.00 24.24 H new ATOM 0 HE1 TYR A 27 -10.751 -4.155 8.776 1.00 45.52 H new ATOM 0 HE2 TYR A 27 -8.323 -1.045 7.178 1.00 52.20 H new ATOM 0 HH TYR A 27 -9.616 -2.593 10.046 1.00 51.32 H new ATOM 466 N GLN A 28 -10.865 -4.852 1.344 1.00 25.10 N ATOM 467 CA GLN A 28 -10.758 -5.222 -0.078 1.00 74.23 C ATOM 468 C GLN A 28 -9.273 -5.295 -0.465 1.00 43.51 C ATOM 469 O GLN A 28 -8.578 -4.280 -0.427 1.00 34.05 O ATOM 470 CB GLN A 28 -11.496 -4.186 -0.988 1.00 41.31 C ATOM 471 CG GLN A 28 -13.032 -4.095 -0.823 1.00 52.11 C ATOM 472 CD GLN A 28 -13.498 -3.619 0.561 1.00 75.14 C ATOM 473 OE1 GLN A 28 -13.758 -4.425 1.460 1.00 61.32 O ATOM 474 NE2 GLN A 28 -13.564 -2.312 0.758 1.00 75.10 N ATOM 0 H GLN A 28 -11.080 -3.866 1.495 1.00 25.10 H new ATOM 0 HA GLN A 28 -11.231 -6.193 -0.225 1.00 74.23 H new ATOM 0 HB2 GLN A 28 -11.073 -3.200 -0.795 1.00 41.31 H new ATOM 0 HB3 GLN A 28 -11.278 -4.429 -2.028 1.00 41.31 H new ATOM 0 HG2 GLN A 28 -13.426 -3.415 -1.578 1.00 52.11 H new ATOM 0 HG3 GLN A 28 -13.464 -5.076 -1.020 1.00 52.11 H new ATOM 0 HE21 GLN A 28 -13.344 -1.670 -0.003 1.00 75.10 H new ATOM 0 HE22 GLN A 28 -13.835 -1.947 1.671 1.00 75.10 H new ATOM 483 N VAL A 29 -8.786 -6.501 -0.794 1.00 54.41 N ATOM 484 CA VAL A 29 -7.395 -6.707 -1.230 1.00 21.10 C ATOM 485 C VAL A 29 -7.297 -6.536 -2.748 1.00 53.54 C ATOM 486 O VAL A 29 -7.741 -7.411 -3.512 1.00 44.55 O ATOM 487 CB VAL A 29 -6.847 -8.125 -0.840 1.00 12.14 C ATOM 488 CG1 VAL A 29 -5.335 -8.223 -1.135 1.00 74.53 C ATOM 489 CG2 VAL A 29 -7.162 -8.468 0.625 1.00 31.30 C ATOM 0 H VAL A 29 -9.341 -7.357 -0.766 1.00 54.41 H new ATOM 0 HA VAL A 29 -6.787 -5.961 -0.718 1.00 21.10 H new ATOM 0 HB VAL A 29 -7.357 -8.865 -1.456 1.00 12.14 H new ATOM 0 HG11 VAL A 29 -4.974 -9.213 -0.858 1.00 74.53 H new ATOM 0 HG12 VAL A 29 -5.160 -8.057 -2.198 1.00 74.53 H new ATOM 0 HG13 VAL A 29 -4.802 -7.468 -0.558 1.00 74.53 H new ATOM 0 HG21 VAL A 29 -6.768 -9.457 0.860 1.00 31.30 H new ATOM 0 HG22 VAL A 29 -6.700 -7.728 1.279 1.00 31.30 H new ATOM 0 HG23 VAL A 29 -8.241 -8.462 0.776 1.00 31.30 H new ATOM 499 N ARG A 30 -6.753 -5.395 -3.185 1.00 51.23 N ATOM 500 CA ARG A 30 -6.518 -5.106 -4.607 1.00 60.43 C ATOM 501 C ARG A 30 -5.001 -5.010 -4.822 1.00 33.43 C ATOM 502 O ARG A 30 -4.396 -4.013 -4.426 1.00 41.53 O ATOM 503 CB ARG A 30 -7.218 -3.760 -5.000 1.00 53.35 C ATOM 504 CG ARG A 30 -8.672 -3.575 -4.482 1.00 51.45 C ATOM 505 CD ARG A 30 -9.740 -4.375 -5.251 1.00 54.13 C ATOM 506 NE ARG A 30 -9.541 -5.832 -5.194 1.00 34.11 N ATOM 507 CZ ARG A 30 -9.655 -6.678 -6.233 1.00 22.21 C ATOM 508 NH1 ARG A 30 -9.986 -6.233 -7.448 1.00 3.05 N ATOM 509 NH2 ARG A 30 -9.393 -7.961 -6.056 1.00 61.54 N ATOM 0 H ARG A 30 -6.462 -4.642 -2.561 1.00 51.23 H new ATOM 0 HA ARG A 30 -6.933 -5.895 -5.234 1.00 60.43 H new ATOM 0 HB2 ARG A 30 -6.612 -2.935 -4.626 1.00 53.35 H new ATOM 0 HB3 ARG A 30 -7.227 -3.682 -6.087 1.00 53.35 H new ATOM 0 HG2 ARG A 30 -8.708 -3.865 -3.432 1.00 51.45 H new ATOM 0 HG3 ARG A 30 -8.927 -2.516 -4.530 1.00 51.45 H new ATOM 0 HD2 ARG A 30 -10.723 -4.135 -4.846 1.00 54.13 H new ATOM 0 HD3 ARG A 30 -9.739 -4.057 -6.294 1.00 54.13 H new ATOM 0 HE ARG A 30 -9.296 -6.234 -4.289 1.00 34.11 H new ATOM 0 HH11 ARG A 30 -10.156 -5.239 -7.598 1.00 3.05 H new ATOM 0 HH12 ARG A 30 -10.068 -6.888 -8.226 1.00 3.05 H new ATOM 0 HH21 ARG A 30 -9.107 -8.301 -5.138 1.00 61.54 H new ATOM 0 HH22 ARG A 30 -9.476 -8.611 -6.838 1.00 61.54 H new ATOM 523 N ASP A 31 -4.379 -6.038 -5.428 1.00 34.22 N ATOM 524 CA ASP A 31 -2.930 -6.023 -5.735 1.00 11.33 C ATOM 525 C ASP A 31 -2.723 -5.667 -7.213 1.00 20.40 C ATOM 526 O ASP A 31 -3.521 -6.057 -8.080 1.00 12.42 O ATOM 527 CB ASP A 31 -2.234 -7.372 -5.373 1.00 50.10 C ATOM 528 CG ASP A 31 -2.520 -8.526 -6.351 1.00 33.34 C ATOM 529 OD1 ASP A 31 -3.642 -9.065 -6.327 1.00 52.52 O ATOM 530 OD2 ASP A 31 -1.624 -8.899 -7.149 1.00 34.22 O ATOM 0 H ASP A 31 -4.855 -6.893 -5.717 1.00 34.22 H new ATOM 0 HA ASP A 31 -2.459 -5.261 -5.114 1.00 11.33 H new ATOM 0 HB2 ASP A 31 -1.157 -7.209 -5.329 1.00 50.10 H new ATOM 0 HB3 ASP A 31 -2.552 -7.673 -4.375 1.00 50.10 H new ATOM 535 N VAL A 32 -1.644 -4.923 -7.475 1.00 62.13 N ATOM 536 CA VAL A 32 -1.332 -4.365 -8.790 1.00 35.21 C ATOM 537 C VAL A 32 -0.032 -4.985 -9.322 1.00 74.24 C ATOM 538 O VAL A 32 1.027 -4.875 -8.690 1.00 35.14 O ATOM 539 CB VAL A 32 -1.191 -2.798 -8.699 1.00 51.34 C ATOM 540 CG1 VAL A 32 -0.773 -2.190 -10.052 1.00 0.41 C ATOM 541 CG2 VAL A 32 -2.499 -2.148 -8.171 1.00 5.00 C ATOM 0 H VAL A 32 -0.951 -4.689 -6.764 1.00 62.13 H new ATOM 0 HA VAL A 32 -2.145 -4.600 -9.477 1.00 35.21 H new ATOM 0 HB VAL A 32 -0.398 -2.580 -7.984 1.00 51.34 H new ATOM 0 HG11 VAL A 32 -0.685 -1.108 -9.953 1.00 0.41 H new ATOM 0 HG12 VAL A 32 0.187 -2.606 -10.357 1.00 0.41 H new ATOM 0 HG13 VAL A 32 -1.525 -2.426 -10.805 1.00 0.41 H new ATOM 0 HG21 VAL A 32 -2.373 -1.067 -8.119 1.00 5.00 H new ATOM 0 HG22 VAL A 32 -3.321 -2.385 -8.846 1.00 5.00 H new ATOM 0 HG23 VAL A 32 -2.722 -2.536 -7.177 1.00 5.00 H new ATOM 551 N ASN A 33 -0.124 -5.639 -10.492 1.00 71.30 N ATOM 552 CA ASN A 33 1.039 -6.195 -11.215 1.00 65.42 C ATOM 553 C ASN A 33 1.229 -5.453 -12.560 1.00 75.31 C ATOM 554 O ASN A 33 2.245 -5.630 -13.235 1.00 23.43 O ATOM 555 CB ASN A 33 0.843 -7.723 -11.480 1.00 24.24 C ATOM 556 CG ASN A 33 0.446 -8.562 -10.246 1.00 51.53 C ATOM 557 OD1 ASN A 33 -0.254 -9.572 -10.367 1.00 3.34 O ATOM 558 ND2 ASN A 33 0.876 -8.171 -9.058 1.00 50.23 N ATOM 0 H ASN A 33 -1.012 -5.799 -10.968 1.00 71.30 H new ATOM 0 HA ASN A 33 1.927 -6.058 -10.597 1.00 65.42 H new ATOM 0 HB2 ASN A 33 0.076 -7.847 -12.245 1.00 24.24 H new ATOM 0 HB3 ASN A 33 1.769 -8.126 -11.890 1.00 24.24 H new ATOM 0 HD21 ASN A 33 0.630 -8.706 -8.225 1.00 50.23 H new ATOM 0 HD22 ASN A 33 1.454 -7.334 -8.975 1.00 50.23 H new ATOM 565 N ASP A 34 0.249 -4.598 -12.919 1.00 34.34 N ATOM 566 CA ASP A 34 0.152 -3.979 -14.259 1.00 30.03 C ATOM 567 C ASP A 34 -0.244 -2.487 -14.158 1.00 55.51 C ATOM 568 O ASP A 34 -0.941 -2.076 -13.225 1.00 71.33 O ATOM 569 CB ASP A 34 -0.882 -4.781 -15.109 1.00 73.32 C ATOM 570 CG ASP A 34 -1.221 -4.128 -16.468 1.00 33.31 C ATOM 571 OD1 ASP A 34 -0.346 -4.086 -17.356 1.00 0.14 O ATOM 572 OD2 ASP A 34 -2.359 -3.643 -16.639 1.00 1.12 O ATOM 0 H ASP A 34 -0.500 -4.316 -12.286 1.00 34.34 H new ATOM 0 HA ASP A 34 1.126 -4.016 -14.746 1.00 30.03 H new ATOM 0 HB2 ASP A 34 -0.491 -5.783 -15.287 1.00 73.32 H new ATOM 0 HB3 ASP A 34 -1.800 -4.894 -14.533 1.00 73.32 H new ATOM 577 N SER A 35 0.207 -1.703 -15.150 1.00 71.11 N ATOM 578 CA SER A 35 0.001 -0.243 -15.229 1.00 11.32 C ATOM 579 C SER A 35 -1.480 0.149 -15.415 1.00 23.45 C ATOM 580 O SER A 35 -1.942 1.170 -14.898 1.00 64.25 O ATOM 581 CB SER A 35 0.838 0.308 -16.398 1.00 13.31 C ATOM 582 OG SER A 35 0.569 -0.387 -17.619 1.00 3.42 O ATOM 0 H SER A 35 0.738 -2.072 -15.939 1.00 71.11 H new ATOM 0 HA SER A 35 0.319 0.190 -14.280 1.00 11.32 H new ATOM 0 HB2 SER A 35 0.625 1.369 -16.529 1.00 13.31 H new ATOM 0 HB3 SER A 35 1.898 0.223 -16.158 1.00 13.31 H new ATOM 0 HG SER A 35 1.117 -0.009 -18.338 1.00 3.42 H new ATOM 588 N ASP A 36 -2.216 -0.673 -16.166 1.00 12.34 N ATOM 589 CA ASP A 36 -3.622 -0.394 -16.532 1.00 15.32 C ATOM 590 C ASP A 36 -4.555 -0.934 -15.451 1.00 51.22 C ATOM 591 O ASP A 36 -5.716 -0.529 -15.348 1.00 4.43 O ATOM 592 CB ASP A 36 -3.957 -0.984 -17.922 1.00 61.31 C ATOM 593 CG ASP A 36 -3.047 -0.409 -19.018 1.00 5.41 C ATOM 594 OD1 ASP A 36 -3.311 0.714 -19.501 1.00 63.21 O ATOM 595 OD2 ASP A 36 -2.050 -1.069 -19.384 1.00 22.14 O ATOM 0 H ASP A 36 -1.862 -1.553 -16.542 1.00 12.34 H new ATOM 0 HA ASP A 36 -3.765 0.685 -16.598 1.00 15.32 H new ATOM 0 HB2 ASP A 36 -3.850 -2.068 -17.892 1.00 61.31 H new ATOM 0 HB3 ASP A 36 -4.998 -0.773 -18.166 1.00 61.31 H new ATOM 600 N GLU A 37 -4.027 -1.868 -14.664 1.00 73.22 N ATOM 601 CA GLU A 37 -4.671 -2.406 -13.479 1.00 62.43 C ATOM 602 C GLU A 37 -4.762 -1.331 -12.368 1.00 34.20 C ATOM 603 O GLU A 37 -5.810 -1.199 -11.731 1.00 1.23 O ATOM 604 CB GLU A 37 -3.837 -3.636 -13.031 1.00 30.14 C ATOM 605 CG GLU A 37 -4.097 -4.176 -11.618 1.00 15.03 C ATOM 606 CD GLU A 37 -5.373 -5.029 -11.493 1.00 13.33 C ATOM 607 OE1 GLU A 37 -6.459 -4.465 -11.266 1.00 73.54 O ATOM 608 OE2 GLU A 37 -5.292 -6.270 -11.635 1.00 22.22 O ATOM 0 H GLU A 37 -3.111 -2.281 -14.843 1.00 73.22 H new ATOM 0 HA GLU A 37 -5.697 -2.709 -13.690 1.00 62.43 H new ATOM 0 HB2 GLU A 37 -4.016 -4.444 -13.741 1.00 30.14 H new ATOM 0 HB3 GLU A 37 -2.781 -3.375 -13.105 1.00 30.14 H new ATOM 0 HG2 GLU A 37 -3.241 -4.775 -11.307 1.00 15.03 H new ATOM 0 HG3 GLU A 37 -4.166 -3.336 -10.927 1.00 15.03 H new ATOM 615 N LEU A 38 -3.676 -0.544 -12.157 1.00 24.33 N ATOM 616 CA LEU A 38 -3.633 0.448 -11.051 1.00 62.31 C ATOM 617 C LEU A 38 -4.696 1.538 -11.264 1.00 1.02 C ATOM 618 O LEU A 38 -5.420 1.884 -10.338 1.00 3.41 O ATOM 619 CB LEU A 38 -2.192 1.059 -10.857 1.00 3.03 C ATOM 620 CG LEU A 38 -1.676 2.171 -11.862 1.00 11.20 C ATOM 621 CD1 LEU A 38 -2.072 3.611 -11.432 1.00 72.04 C ATOM 622 CD2 LEU A 38 -0.153 2.084 -12.077 1.00 24.33 C ATOM 0 H LEU A 38 -2.831 -0.575 -12.728 1.00 24.33 H new ATOM 0 HA LEU A 38 -3.869 -0.075 -10.124 1.00 62.31 H new ATOM 0 HB2 LEU A 38 -2.148 1.480 -9.853 1.00 3.03 H new ATOM 0 HB3 LEU A 38 -1.480 0.234 -10.888 1.00 3.03 H new ATOM 0 HG LEU A 38 -2.177 1.964 -12.808 1.00 11.20 H new ATOM 0 HD11 LEU A 38 -1.690 4.326 -12.160 1.00 72.04 H new ATOM 0 HD12 LEU A 38 -3.158 3.690 -11.381 1.00 72.04 H new ATOM 0 HD13 LEU A 38 -1.646 3.828 -10.452 1.00 72.04 H new ATOM 0 HD21 LEU A 38 0.161 2.863 -12.772 1.00 24.33 H new ATOM 0 HD22 LEU A 38 0.357 2.221 -11.124 1.00 24.33 H new ATOM 0 HD23 LEU A 38 0.101 1.107 -12.488 1.00 24.33 H new ATOM 634 N LYS A 39 -4.812 2.017 -12.522 1.00 42.53 N ATOM 635 CA LYS A 39 -5.653 3.176 -12.868 1.00 11.52 C ATOM 636 C LYS A 39 -7.151 2.854 -12.715 1.00 34.41 C ATOM 637 O LYS A 39 -7.936 3.712 -12.298 1.00 73.22 O ATOM 638 CB LYS A 39 -5.326 3.671 -14.309 1.00 21.22 C ATOM 639 CG LYS A 39 -5.653 2.677 -15.442 1.00 21.22 C ATOM 640 CD LYS A 39 -5.227 3.180 -16.842 1.00 61.20 C ATOM 641 CE LYS A 39 -3.703 3.355 -16.981 1.00 4.51 C ATOM 642 NZ LYS A 39 -3.305 3.697 -18.373 1.00 33.22 N ATOM 0 H LYS A 39 -4.326 1.610 -13.321 1.00 42.53 H new ATOM 0 HA LYS A 39 -5.425 3.980 -12.168 1.00 11.52 H new ATOM 0 HB2 LYS A 39 -5.875 4.595 -14.490 1.00 21.22 H new ATOM 0 HB3 LYS A 39 -4.265 3.915 -14.359 1.00 21.22 H new ATOM 0 HG2 LYS A 39 -5.156 1.729 -15.238 1.00 21.22 H new ATOM 0 HG3 LYS A 39 -6.725 2.481 -15.445 1.00 21.22 H new ATOM 0 HD2 LYS A 39 -5.577 2.476 -17.597 1.00 61.20 H new ATOM 0 HD3 LYS A 39 -5.716 4.133 -17.044 1.00 61.20 H new ATOM 0 HE2 LYS A 39 -3.365 4.140 -16.304 1.00 4.51 H new ATOM 0 HE3 LYS A 39 -3.203 2.435 -16.677 1.00 4.51 H new ATOM 0 HZ1 LYS A 39 -2.382 4.176 -18.362 1.00 33.22 H new ATOM 0 HZ2 LYS A 39 -3.237 2.827 -18.938 1.00 33.22 H new ATOM 0 HZ3 LYS A 39 -4.017 4.328 -18.793 1.00 33.22 H new ATOM 656 N LYS A 40 -7.524 1.595 -13.012 1.00 2.13 N ATOM 657 CA LYS A 40 -8.926 1.161 -12.982 1.00 65.34 C ATOM 658 C LYS A 40 -9.388 0.921 -11.529 1.00 62.01 C ATOM 659 O LYS A 40 -10.561 1.143 -11.202 1.00 11.20 O ATOM 660 CB LYS A 40 -9.128 -0.081 -13.899 1.00 12.34 C ATOM 661 CG LYS A 40 -8.507 -1.404 -13.419 1.00 10.53 C ATOM 662 CD LYS A 40 -8.692 -2.532 -14.463 1.00 63.04 C ATOM 663 CE LYS A 40 -8.204 -3.890 -13.960 1.00 73.34 C ATOM 664 NZ LYS A 40 -8.916 -4.323 -12.727 1.00 30.23 N ATOM 0 H LYS A 40 -6.868 0.860 -13.276 1.00 2.13 H new ATOM 0 HA LYS A 40 -9.559 1.953 -13.382 1.00 65.34 H new ATOM 0 HB2 LYS A 40 -10.199 -0.236 -14.030 1.00 12.34 H new ATOM 0 HB3 LYS A 40 -8.717 0.151 -14.881 1.00 12.34 H new ATOM 0 HG2 LYS A 40 -7.444 -1.258 -13.224 1.00 10.53 H new ATOM 0 HG3 LYS A 40 -8.966 -1.701 -12.476 1.00 10.53 H new ATOM 0 HD2 LYS A 40 -9.747 -2.606 -14.729 1.00 63.04 H new ATOM 0 HD3 LYS A 40 -8.152 -2.271 -15.373 1.00 63.04 H new ATOM 0 HE2 LYS A 40 -8.346 -4.637 -14.741 1.00 73.34 H new ATOM 0 HE3 LYS A 40 -7.134 -3.838 -13.760 1.00 73.34 H new ATOM 0 HZ1 LYS A 40 -8.251 -4.335 -11.928 1.00 30.23 H new ATOM 0 HZ2 LYS A 40 -9.691 -3.660 -12.523 1.00 30.23 H new ATOM 0 HZ3 LYS A 40 -9.305 -5.277 -12.868 1.00 30.23 H new ATOM 678 N GLU A 41 -8.440 0.519 -10.652 1.00 52.20 N ATOM 679 CA GLU A 41 -8.711 0.326 -9.211 1.00 44.24 C ATOM 680 C GLU A 41 -8.649 1.657 -8.440 1.00 32.12 C ATOM 681 O GLU A 41 -9.274 1.790 -7.383 1.00 22.23 O ATOM 682 CB GLU A 41 -7.751 -0.715 -8.597 1.00 63.13 C ATOM 683 CG GLU A 41 -7.777 -2.089 -9.298 1.00 41.52 C ATOM 684 CD GLU A 41 -9.181 -2.732 -9.398 1.00 71.23 C ATOM 685 OE1 GLU A 41 -9.654 -3.313 -8.397 1.00 31.12 O ATOM 686 OE2 GLU A 41 -9.810 -2.679 -10.485 1.00 4.14 O ATOM 0 H GLU A 41 -7.476 0.321 -10.920 1.00 52.20 H new ATOM 0 HA GLU A 41 -9.727 -0.059 -9.120 1.00 44.24 H new ATOM 0 HB2 GLU A 41 -6.735 -0.321 -8.632 1.00 63.13 H new ATOM 0 HB3 GLU A 41 -8.005 -0.851 -7.546 1.00 63.13 H new ATOM 0 HG2 GLU A 41 -7.370 -1.978 -10.303 1.00 41.52 H new ATOM 0 HG3 GLU A 41 -7.117 -2.770 -8.760 1.00 41.52 H new ATOM 693 N MET A 42 -7.889 2.642 -8.966 1.00 35.13 N ATOM 694 CA MET A 42 -7.902 4.026 -8.440 1.00 34.41 C ATOM 695 C MET A 42 -9.271 4.670 -8.672 1.00 51.13 C ATOM 696 O MET A 42 -9.719 5.502 -7.868 1.00 42.34 O ATOM 697 CB MET A 42 -6.793 4.894 -9.080 1.00 71.43 C ATOM 698 CG MET A 42 -5.352 4.537 -8.683 1.00 42.20 C ATOM 699 SD MET A 42 -4.967 4.849 -6.940 1.00 24.55 S ATOM 700 CE MET A 42 -5.411 3.302 -6.143 1.00 31.13 C ATOM 0 H MET A 42 -7.258 2.505 -9.755 1.00 35.13 H new ATOM 0 HA MET A 42 -7.706 3.971 -7.369 1.00 34.41 H new ATOM 0 HB2 MET A 42 -6.880 4.820 -10.164 1.00 71.43 H new ATOM 0 HB3 MET A 42 -6.975 5.936 -8.816 1.00 71.43 H new ATOM 0 HG2 MET A 42 -5.177 3.483 -8.900 1.00 42.20 H new ATOM 0 HG3 MET A 42 -4.663 5.109 -9.304 1.00 42.20 H new ATOM 0 HE1 MET A 42 -4.937 3.248 -5.163 1.00 31.13 H new ATOM 0 HE2 MET A 42 -6.493 3.251 -6.026 1.00 31.13 H new ATOM 0 HE3 MET A 42 -5.073 2.467 -6.756 1.00 31.13 H new ATOM 710 N LYS A 43 -9.923 4.290 -9.794 1.00 32.24 N ATOM 711 CA LYS A 43 -11.299 4.708 -10.076 1.00 55.54 C ATOM 712 C LYS A 43 -12.261 4.048 -9.082 1.00 34.34 C ATOM 713 O LYS A 43 -13.125 4.716 -8.567 1.00 50.42 O ATOM 714 CB LYS A 43 -11.723 4.400 -11.537 1.00 32.20 C ATOM 715 CG LYS A 43 -10.998 5.258 -12.604 1.00 31.00 C ATOM 716 CD LYS A 43 -11.648 5.155 -14.003 1.00 14.43 C ATOM 717 CE LYS A 43 -13.089 5.708 -14.052 1.00 71.35 C ATOM 718 NZ LYS A 43 -13.159 7.157 -13.696 1.00 44.32 N ATOM 0 H LYS A 43 -9.512 3.695 -10.513 1.00 32.24 H new ATOM 0 HA LYS A 43 -11.344 5.791 -9.957 1.00 55.54 H new ATOM 0 HB2 LYS A 43 -11.533 3.347 -11.744 1.00 32.20 H new ATOM 0 HB3 LYS A 43 -12.798 4.555 -11.632 1.00 32.20 H new ATOM 0 HG2 LYS A 43 -10.997 6.300 -12.285 1.00 31.00 H new ATOM 0 HG3 LYS A 43 -9.956 4.944 -12.669 1.00 31.00 H new ATOM 0 HD2 LYS A 43 -11.034 5.698 -14.722 1.00 14.43 H new ATOM 0 HD3 LYS A 43 -11.657 4.111 -14.315 1.00 14.43 H new ATOM 0 HE2 LYS A 43 -13.496 5.563 -15.053 1.00 71.35 H new ATOM 0 HE3 LYS A 43 -13.717 5.138 -13.367 1.00 71.35 H new ATOM 0 HZ1 LYS A 43 -14.129 7.504 -13.842 1.00 44.32 H new ATOM 0 HZ2 LYS A 43 -12.893 7.283 -12.699 1.00 44.32 H new ATOM 0 HZ3 LYS A 43 -12.505 7.695 -14.299 1.00 44.32 H new ATOM 732 N LYS A 44 -12.053 2.744 -8.783 1.00 4.44 N ATOM 733 CA LYS A 44 -12.912 1.966 -7.838 1.00 71.35 C ATOM 734 C LYS A 44 -13.068 2.664 -6.469 1.00 43.23 C ATOM 735 O LYS A 44 -14.119 2.577 -5.840 1.00 3.20 O ATOM 736 CB LYS A 44 -12.336 0.538 -7.622 1.00 45.25 C ATOM 737 CG LYS A 44 -12.378 -0.368 -8.868 1.00 62.53 C ATOM 738 CD LYS A 44 -13.816 -0.753 -9.274 1.00 52.31 C ATOM 739 CE LYS A 44 -13.851 -1.684 -10.493 1.00 4.34 C ATOM 740 NZ LYS A 44 -15.227 -2.182 -10.755 1.00 32.43 N ATOM 0 H LYS A 44 -11.291 2.197 -9.184 1.00 4.44 H new ATOM 0 HA LYS A 44 -13.898 1.903 -8.298 1.00 71.35 H new ATOM 0 HB2 LYS A 44 -11.302 0.625 -7.287 1.00 45.25 H new ATOM 0 HB3 LYS A 44 -12.892 0.054 -6.819 1.00 45.25 H new ATOM 0 HG2 LYS A 44 -11.894 0.143 -9.700 1.00 62.53 H new ATOM 0 HG3 LYS A 44 -11.805 -1.274 -8.673 1.00 62.53 H new ATOM 0 HD2 LYS A 44 -14.309 -1.241 -8.433 1.00 52.31 H new ATOM 0 HD3 LYS A 44 -14.383 0.152 -9.495 1.00 52.31 H new ATOM 0 HE2 LYS A 44 -13.482 -1.152 -11.370 1.00 4.34 H new ATOM 0 HE3 LYS A 44 -13.182 -2.528 -10.327 1.00 4.34 H new ATOM 0 HZ1 LYS A 44 -15.217 -2.809 -11.585 1.00 32.43 H new ATOM 0 HZ2 LYS A 44 -15.569 -2.710 -9.927 1.00 32.43 H new ATOM 0 HZ3 LYS A 44 -15.859 -1.376 -10.937 1.00 32.43 H new ATOM 754 N LEU A 45 -12.000 3.352 -6.035 1.00 11.24 N ATOM 755 CA LEU A 45 -11.988 4.109 -4.769 1.00 74.21 C ATOM 756 C LEU A 45 -12.941 5.320 -4.828 1.00 3.43 C ATOM 757 O LEU A 45 -13.589 5.654 -3.847 1.00 35.13 O ATOM 758 CB LEU A 45 -10.555 4.595 -4.453 1.00 55.24 C ATOM 759 CG LEU A 45 -9.428 3.530 -4.529 1.00 10.43 C ATOM 760 CD1 LEU A 45 -8.084 4.145 -4.130 1.00 51.24 C ATOM 761 CD2 LEU A 45 -9.751 2.277 -3.688 1.00 43.23 C ATOM 0 H LEU A 45 -11.121 3.400 -6.550 1.00 11.24 H new ATOM 0 HA LEU A 45 -12.331 3.440 -3.980 1.00 74.21 H new ATOM 0 HB2 LEU A 45 -10.309 5.402 -5.143 1.00 55.24 H new ATOM 0 HB3 LEU A 45 -10.553 5.022 -3.450 1.00 55.24 H new ATOM 0 HG LEU A 45 -9.359 3.196 -5.564 1.00 10.43 H new ATOM 0 HD11 LEU A 45 -7.305 3.385 -4.189 1.00 51.24 H new ATOM 0 HD12 LEU A 45 -7.844 4.965 -4.807 1.00 51.24 H new ATOM 0 HD13 LEU A 45 -8.146 4.524 -3.110 1.00 51.24 H new ATOM 0 HD21 LEU A 45 -8.933 1.561 -3.773 1.00 43.23 H new ATOM 0 HD22 LEU A 45 -9.876 2.562 -2.644 1.00 43.23 H new ATOM 0 HD23 LEU A 45 -10.672 1.821 -4.053 1.00 43.23 H new ATOM 773 N ALA A 46 -12.999 5.956 -6.005 1.00 4.12 N ATOM 774 CA ALA A 46 -13.797 7.171 -6.248 1.00 71.13 C ATOM 775 C ALA A 46 -15.269 6.831 -6.529 1.00 42.51 C ATOM 776 O ALA A 46 -16.174 7.353 -5.863 1.00 53.35 O ATOM 777 CB ALA A 46 -13.196 7.933 -7.435 1.00 24.24 C ATOM 0 H ALA A 46 -12.487 5.639 -6.828 1.00 4.12 H new ATOM 0 HA ALA A 46 -13.769 7.791 -5.352 1.00 71.13 H new ATOM 0 HB1 ALA A 46 -13.780 8.834 -7.622 1.00 24.24 H new ATOM 0 HB2 ALA A 46 -12.167 8.209 -7.207 1.00 24.24 H new ATOM 0 HB3 ALA A 46 -13.213 7.299 -8.321 1.00 24.24 H new ATOM 783 N GLU A 47 -15.479 5.946 -7.529 1.00 74.42 N ATOM 784 CA GLU A 47 -16.812 5.554 -8.019 1.00 44.01 C ATOM 785 C GLU A 47 -17.624 4.904 -6.892 1.00 4.21 C ATOM 786 O GLU A 47 -18.801 5.208 -6.708 1.00 3.31 O ATOM 787 CB GLU A 47 -16.705 4.574 -9.231 1.00 23.23 C ATOM 788 CG GLU A 47 -15.682 4.959 -10.331 1.00 64.40 C ATOM 789 CD GLU A 47 -15.760 6.419 -10.818 1.00 21.44 C ATOM 790 OE1 GLU A 47 -16.740 6.769 -11.507 1.00 51.01 O ATOM 791 OE2 GLU A 47 -14.832 7.221 -10.528 1.00 62.44 O ATOM 0 H GLU A 47 -14.717 5.481 -8.022 1.00 74.42 H new ATOM 0 HA GLU A 47 -17.322 6.457 -8.354 1.00 44.01 H new ATOM 0 HB2 GLU A 47 -16.445 3.586 -8.851 1.00 23.23 H new ATOM 0 HB3 GLU A 47 -17.689 4.490 -9.692 1.00 23.23 H new ATOM 0 HG2 GLU A 47 -14.677 4.773 -9.952 1.00 64.40 H new ATOM 0 HG3 GLU A 47 -15.827 4.299 -11.186 1.00 64.40 H new ATOM 798 N GLU A 48 -16.969 4.001 -6.151 1.00 74.15 N ATOM 799 CA GLU A 48 -17.550 3.355 -4.968 1.00 33.52 C ATOM 800 C GLU A 48 -17.094 4.145 -3.735 1.00 24.23 C ATOM 801 O GLU A 48 -15.900 4.192 -3.451 1.00 52.32 O ATOM 802 CB GLU A 48 -17.087 1.872 -4.872 1.00 44.25 C ATOM 803 CG GLU A 48 -17.176 1.066 -6.186 1.00 30.35 C ATOM 804 CD GLU A 48 -18.584 1.042 -6.803 1.00 21.20 C ATOM 805 OE1 GLU A 48 -19.510 0.493 -6.168 1.00 0.43 O ATOM 806 OE2 GLU A 48 -18.768 1.558 -7.926 1.00 63.42 O ATOM 0 H GLU A 48 -16.017 3.697 -6.356 1.00 74.15 H new ATOM 0 HA GLU A 48 -18.638 3.352 -5.033 1.00 33.52 H new ATOM 0 HB2 GLU A 48 -16.055 1.853 -4.523 1.00 44.25 H new ATOM 0 HB3 GLU A 48 -17.689 1.369 -4.115 1.00 44.25 H new ATOM 0 HG2 GLU A 48 -16.479 1.490 -6.909 1.00 30.35 H new ATOM 0 HG3 GLU A 48 -16.855 0.042 -5.996 1.00 30.35 H new ATOM 813 N LYS A 49 -18.028 4.790 -3.026 1.00 52.34 N ATOM 814 CA LYS A 49 -17.694 5.672 -1.884 1.00 14.10 C ATOM 815 C LYS A 49 -18.004 5.001 -0.533 1.00 14.43 C ATOM 816 O LYS A 49 -17.139 4.946 0.353 1.00 22.31 O ATOM 817 CB LYS A 49 -18.454 7.016 -2.015 1.00 21.45 C ATOM 818 CG LYS A 49 -18.132 8.047 -0.906 1.00 15.55 C ATOM 819 CD LYS A 49 -18.869 9.394 -1.110 1.00 62.35 C ATOM 820 CE LYS A 49 -20.402 9.248 -1.091 1.00 50.33 C ATOM 821 NZ LYS A 49 -21.089 10.534 -1.400 1.00 3.22 N ATOM 0 H LYS A 49 -19.027 4.722 -3.219 1.00 52.34 H new ATOM 0 HA LYS A 49 -16.621 5.864 -1.909 1.00 14.10 H new ATOM 0 HB2 LYS A 49 -18.220 7.458 -2.983 1.00 21.45 H new ATOM 0 HB3 LYS A 49 -19.525 6.815 -2.007 1.00 21.45 H new ATOM 0 HG2 LYS A 49 -18.407 7.630 0.063 1.00 15.55 H new ATOM 0 HG3 LYS A 49 -17.057 8.226 -0.883 1.00 15.55 H new ATOM 0 HD2 LYS A 49 -18.566 10.090 -0.328 1.00 62.35 H new ATOM 0 HD3 LYS A 49 -18.562 9.830 -2.061 1.00 62.35 H new ATOM 0 HE2 LYS A 49 -20.703 8.493 -1.817 1.00 50.33 H new ATOM 0 HE3 LYS A 49 -20.720 8.893 -0.111 1.00 50.33 H new ATOM 0 HZ1 LYS A 49 -22.119 10.392 -1.377 1.00 3.22 H new ATOM 0 HZ2 LYS A 49 -20.822 11.249 -0.693 1.00 3.22 H new ATOM 0 HZ3 LYS A 49 -20.806 10.860 -2.346 1.00 3.22 H new ATOM 835 N ASN A 50 -19.225 4.450 -0.413 1.00 33.05 N ATOM 836 CA ASN A 50 -19.822 4.050 0.885 1.00 31.31 C ATOM 837 C ASN A 50 -19.206 2.766 1.473 1.00 21.42 C ATOM 838 O ASN A 50 -19.440 2.467 2.652 1.00 13.04 O ATOM 839 CB ASN A 50 -21.364 3.867 0.759 1.00 22.13 C ATOM 840 CG ASN A 50 -22.114 5.122 0.291 1.00 35.14 C ATOM 841 OD1 ASN A 50 -21.662 6.253 0.482 1.00 32.21 O ATOM 842 ND2 ASN A 50 -23.290 4.932 -0.296 1.00 42.44 N ATOM 0 H ASN A 50 -19.831 4.267 -1.212 1.00 33.05 H new ATOM 0 HA ASN A 50 -19.597 4.866 1.572 1.00 31.31 H new ATOM 0 HB2 ASN A 50 -21.566 3.056 0.060 1.00 22.13 H new ATOM 0 HB3 ASN A 50 -21.762 3.560 1.726 1.00 22.13 H new ATOM 0 HD21 ASN A 50 -23.843 5.733 -0.601 1.00 42.44 H new ATOM 0 HD22 ASN A 50 -23.640 3.985 -0.442 1.00 42.44 H new ATOM 849 N PHE A 51 -18.444 1.998 0.661 1.00 74.21 N ATOM 850 CA PHE A 51 -17.781 0.773 1.145 1.00 3.14 C ATOM 851 C PHE A 51 -16.585 1.140 2.046 1.00 44.43 C ATOM 852 O PHE A 51 -16.019 2.239 1.928 1.00 53.22 O ATOM 853 CB PHE A 51 -17.379 -0.194 -0.023 1.00 60.14 C ATOM 854 CG PHE A 51 -16.200 0.178 -0.949 1.00 30.02 C ATOM 855 CD1 PHE A 51 -15.800 1.496 -1.182 1.00 52.34 C ATOM 856 CD2 PHE A 51 -15.498 -0.835 -1.619 1.00 24.35 C ATOM 857 CE1 PHE A 51 -14.745 1.779 -2.032 1.00 44.33 C ATOM 858 CE2 PHE A 51 -14.453 -0.543 -2.474 1.00 30.34 C ATOM 859 CZ PHE A 51 -14.077 0.765 -2.682 1.00 33.05 C ATOM 0 H PHE A 51 -18.276 2.205 -0.323 1.00 74.21 H new ATOM 0 HA PHE A 51 -18.499 0.216 1.747 1.00 3.14 H new ATOM 0 HB2 PHE A 51 -17.153 -1.164 0.420 1.00 60.14 H new ATOM 0 HB3 PHE A 51 -18.259 -0.328 -0.653 1.00 60.14 H new ATOM 0 HD1 PHE A 51 -16.321 2.305 -0.692 1.00 52.34 H new ATOM 0 HD2 PHE A 51 -15.781 -1.866 -1.463 1.00 24.35 H new ATOM 0 HE1 PHE A 51 -14.443 2.804 -2.187 1.00 44.33 H new ATOM 0 HE2 PHE A 51 -13.930 -1.341 -2.980 1.00 30.34 H new ATOM 0 HZ PHE A 51 -13.262 0.995 -3.352 1.00 33.05 H new ATOM 869 N GLU A 52 -16.242 0.226 2.961 1.00 71.54 N ATOM 870 CA GLU A 52 -15.162 0.416 3.953 1.00 1.54 C ATOM 871 C GLU A 52 -13.782 0.565 3.281 1.00 73.14 C ATOM 872 O GLU A 52 -13.636 0.353 2.063 1.00 21.42 O ATOM 873 CB GLU A 52 -15.141 -0.746 5.000 1.00 32.33 C ATOM 874 CG GLU A 52 -14.840 -2.166 4.450 1.00 64.42 C ATOM 875 CD GLU A 52 -16.015 -2.792 3.675 1.00 3.14 C ATOM 876 OE1 GLU A 52 -16.907 -3.394 4.310 1.00 32.53 O ATOM 877 OE2 GLU A 52 -16.077 -2.645 2.436 1.00 53.25 O ATOM 0 H GLU A 52 -16.708 -0.678 3.040 1.00 71.54 H new ATOM 0 HA GLU A 52 -15.376 1.347 4.478 1.00 1.54 H new ATOM 0 HB2 GLU A 52 -14.395 -0.509 5.759 1.00 32.33 H new ATOM 0 HB3 GLU A 52 -16.109 -0.772 5.501 1.00 32.33 H new ATOM 0 HG2 GLU A 52 -13.970 -2.115 3.795 1.00 64.42 H new ATOM 0 HG3 GLU A 52 -14.575 -2.819 5.281 1.00 64.42 H new ATOM 884 N LYS A 53 -12.777 0.926 4.103 1.00 11.13 N ATOM 885 CA LYS A 53 -11.422 1.251 3.628 1.00 33.11 C ATOM 886 C LYS A 53 -10.728 0.045 2.965 1.00 24.41 C ATOM 887 O LYS A 53 -10.949 -1.115 3.342 1.00 71.32 O ATOM 888 CB LYS A 53 -10.536 1.868 4.742 1.00 52.01 C ATOM 889 CG LYS A 53 -10.340 1.054 6.039 1.00 4.43 C ATOM 890 CD LYS A 53 -11.365 1.413 7.135 1.00 54.54 C ATOM 891 CE LYS A 53 -11.041 0.753 8.474 1.00 11.14 C ATOM 892 NZ LYS A 53 -11.979 1.160 9.542 1.00 11.23 N ATOM 0 H LYS A 53 -12.884 1.000 5.115 1.00 11.13 H new ATOM 0 HA LYS A 53 -11.549 2.013 2.859 1.00 33.11 H new ATOM 0 HB2 LYS A 53 -9.551 2.063 4.317 1.00 52.01 H new ATOM 0 HB3 LYS A 53 -10.963 2.833 5.014 1.00 52.01 H new ATOM 0 HG2 LYS A 53 -10.418 -0.009 5.810 1.00 4.43 H new ATOM 0 HG3 LYS A 53 -9.333 1.225 6.420 1.00 4.43 H new ATOM 0 HD2 LYS A 53 -11.392 2.495 7.263 1.00 54.54 H new ATOM 0 HD3 LYS A 53 -12.360 1.106 6.813 1.00 54.54 H new ATOM 0 HE2 LYS A 53 -11.072 -0.331 8.359 1.00 11.14 H new ATOM 0 HE3 LYS A 53 -10.024 1.013 8.768 1.00 11.14 H new ATOM 0 HZ1 LYS A 53 -11.719 0.687 10.431 1.00 11.23 H new ATOM 0 HZ2 LYS A 53 -11.931 2.191 9.672 1.00 11.23 H new ATOM 0 HZ3 LYS A 53 -12.947 0.889 9.276 1.00 11.23 H new ATOM 906 N ILE A 54 -9.884 0.358 1.969 1.00 13.44 N ATOM 907 CA ILE A 54 -9.328 -0.621 1.022 1.00 2.22 C ATOM 908 C ILE A 54 -7.821 -0.785 1.274 1.00 72.03 C ATOM 909 O ILE A 54 -7.132 0.180 1.629 1.00 15.44 O ATOM 910 CB ILE A 54 -9.561 -0.180 -0.487 1.00 12.51 C ATOM 911 CG1 ILE A 54 -11.057 0.191 -0.768 1.00 44.32 C ATOM 912 CG2 ILE A 54 -9.070 -1.254 -1.487 1.00 34.32 C ATOM 913 CD1 ILE A 54 -11.447 1.605 -0.353 1.00 32.40 C ATOM 0 H ILE A 54 -9.564 1.311 1.797 1.00 13.44 H new ATOM 0 HA ILE A 54 -9.844 -1.567 1.182 1.00 2.22 H new ATOM 0 HB ILE A 54 -8.961 0.718 -0.638 1.00 12.51 H new ATOM 0 HG12 ILE A 54 -11.254 0.071 -1.833 1.00 44.32 H new ATOM 0 HG13 ILE A 54 -11.698 -0.518 -0.244 1.00 44.32 H new ATOM 0 HG21 ILE A 54 -9.249 -0.911 -2.506 1.00 34.32 H new ATOM 0 HG22 ILE A 54 -8.003 -1.424 -1.343 1.00 34.32 H new ATOM 0 HG23 ILE A 54 -9.612 -2.184 -1.317 1.00 34.32 H new ATOM 0 HD11 ILE A 54 -12.499 1.775 -0.584 1.00 32.40 H new ATOM 0 HD12 ILE A 54 -11.287 1.727 0.718 1.00 32.40 H new ATOM 0 HD13 ILE A 54 -10.835 2.325 -0.896 1.00 32.40 H new ATOM 925 N LEU A 55 -7.329 -2.011 1.086 1.00 61.40 N ATOM 926 CA LEU A 55 -5.907 -2.326 1.148 1.00 42.44 C ATOM 927 C LEU A 55 -5.392 -2.604 -0.271 1.00 23.34 C ATOM 928 O LEU A 55 -5.808 -3.574 -0.915 1.00 64.20 O ATOM 929 CB LEU A 55 -5.672 -3.534 2.089 1.00 30.44 C ATOM 930 CG LEU A 55 -4.165 -3.939 2.336 1.00 61.01 C ATOM 931 CD1 LEU A 55 -3.849 -4.090 3.842 1.00 50.21 C ATOM 932 CD2 LEU A 55 -3.775 -5.218 1.552 1.00 70.33 C ATOM 0 H LEU A 55 -7.917 -2.820 0.884 1.00 61.40 H new ATOM 0 HA LEU A 55 -5.353 -1.481 1.556 1.00 42.44 H new ATOM 0 HB2 LEU A 55 -6.130 -3.312 3.053 1.00 30.44 H new ATOM 0 HB3 LEU A 55 -6.196 -4.397 1.678 1.00 30.44 H new ATOM 0 HG LEU A 55 -3.554 -3.121 1.953 1.00 61.01 H new ATOM 0 HD11 LEU A 55 -2.803 -4.369 3.968 1.00 50.21 H new ATOM 0 HD12 LEU A 55 -4.036 -3.144 4.350 1.00 50.21 H new ATOM 0 HD13 LEU A 55 -4.485 -4.864 4.271 1.00 50.21 H new ATOM 0 HD21 LEU A 55 -2.731 -5.462 1.750 1.00 70.33 H new ATOM 0 HD22 LEU A 55 -4.408 -6.047 1.870 1.00 70.33 H new ATOM 0 HD23 LEU A 55 -3.912 -5.046 0.484 1.00 70.33 H new ATOM 944 N ILE A 56 -4.513 -1.730 -0.762 1.00 64.50 N ATOM 945 CA ILE A 56 -3.849 -1.883 -2.061 1.00 41.23 C ATOM 946 C ILE A 56 -2.468 -2.518 -1.829 1.00 44.13 C ATOM 947 O ILE A 56 -1.799 -2.207 -0.847 1.00 10.34 O ATOM 948 CB ILE A 56 -3.655 -0.487 -2.788 1.00 53.01 C ATOM 949 CG1 ILE A 56 -4.993 0.319 -2.874 1.00 4.43 C ATOM 950 CG2 ILE A 56 -3.029 -0.656 -4.199 1.00 63.55 C ATOM 951 CD1 ILE A 56 -6.078 -0.302 -3.740 1.00 41.21 C ATOM 0 H ILE A 56 -4.237 -0.884 -0.264 1.00 64.50 H new ATOM 0 HA ILE A 56 -4.473 -2.511 -2.696 1.00 41.23 H new ATOM 0 HB ILE A 56 -2.959 0.087 -2.176 1.00 53.01 H new ATOM 0 HG12 ILE A 56 -5.386 0.445 -1.865 1.00 4.43 H new ATOM 0 HG13 ILE A 56 -4.773 1.315 -3.257 1.00 4.43 H new ATOM 0 HG21 ILE A 56 -2.912 0.323 -4.665 1.00 63.55 H new ATOM 0 HG22 ILE A 56 -2.054 -1.134 -4.109 1.00 63.55 H new ATOM 0 HG23 ILE A 56 -3.681 -1.275 -4.815 1.00 63.55 H new ATOM 0 HD11 ILE A 56 -6.961 0.337 -3.730 1.00 41.21 H new ATOM 0 HD12 ILE A 56 -5.714 -0.403 -4.763 1.00 41.21 H new ATOM 0 HD13 ILE A 56 -6.337 -1.286 -3.349 1.00 41.21 H new ATOM 963 N ILE A 57 -2.073 -3.451 -2.697 1.00 51.51 N ATOM 964 CA ILE A 57 -0.690 -3.957 -2.780 1.00 21.45 C ATOM 965 C ILE A 57 -0.166 -3.643 -4.193 1.00 34.54 C ATOM 966 O ILE A 57 -0.961 -3.493 -5.126 1.00 22.42 O ATOM 967 CB ILE A 57 -0.605 -5.514 -2.493 1.00 23.43 C ATOM 968 CG1 ILE A 57 -1.307 -5.877 -1.148 1.00 24.31 C ATOM 969 CG2 ILE A 57 0.862 -6.006 -2.485 1.00 50.44 C ATOM 970 CD1 ILE A 57 -1.318 -7.363 -0.813 1.00 24.34 C ATOM 0 H ILE A 57 -2.705 -3.884 -3.370 1.00 51.51 H new ATOM 0 HA ILE A 57 -0.081 -3.470 -2.018 1.00 21.45 H new ATOM 0 HB ILE A 57 -1.129 -6.023 -3.302 1.00 23.43 H new ATOM 0 HG12 ILE A 57 -0.811 -5.340 -0.339 1.00 24.31 H new ATOM 0 HG13 ILE A 57 -2.336 -5.519 -1.184 1.00 24.31 H new ATOM 0 HG21 ILE A 57 0.885 -7.077 -2.285 1.00 50.44 H new ATOM 0 HG22 ILE A 57 1.318 -5.808 -3.455 1.00 50.44 H new ATOM 0 HG23 ILE A 57 1.418 -5.480 -1.709 1.00 50.44 H new ATOM 0 HD11 ILE A 57 -1.827 -7.518 0.139 1.00 24.34 H new ATOM 0 HD12 ILE A 57 -1.842 -7.909 -1.598 1.00 24.34 H new ATOM 0 HD13 ILE A 57 -0.293 -7.727 -0.740 1.00 24.34 H new ATOM 982 N SER A 58 1.151 -3.487 -4.343 1.00 23.35 N ATOM 983 CA SER A 58 1.796 -3.337 -5.650 1.00 62.43 C ATOM 984 C SER A 58 3.224 -3.886 -5.593 1.00 0.42 C ATOM 985 O SER A 58 3.873 -3.881 -4.532 1.00 75.25 O ATOM 986 CB SER A 58 1.799 -1.861 -6.093 1.00 32.00 C ATOM 987 OG SER A 58 2.353 -1.707 -7.386 1.00 74.55 O ATOM 0 H SER A 58 1.803 -3.461 -3.559 1.00 23.35 H new ATOM 0 HA SER A 58 1.229 -3.907 -6.386 1.00 62.43 H new ATOM 0 HB2 SER A 58 0.779 -1.476 -6.085 1.00 32.00 H new ATOM 0 HB3 SER A 58 2.370 -1.267 -5.379 1.00 32.00 H new ATOM 0 HG SER A 58 3.282 -1.403 -7.310 1.00 74.55 H new ATOM 993 N ASN A 59 3.691 -4.360 -6.754 1.00 72.02 N ATOM 994 CA ASN A 59 5.031 -4.929 -6.927 1.00 14.43 C ATOM 995 C ASN A 59 6.085 -3.816 -6.887 1.00 70.03 C ATOM 996 O ASN A 59 6.933 -3.769 -5.993 1.00 5.22 O ATOM 997 CB ASN A 59 5.130 -5.685 -8.287 1.00 20.13 C ATOM 998 CG ASN A 59 4.143 -6.843 -8.443 1.00 40.04 C ATOM 999 OD1 ASN A 59 3.067 -6.853 -7.854 1.00 24.14 O ATOM 1000 ND2 ASN A 59 4.494 -7.817 -9.265 1.00 33.51 N ATOM 0 H ASN A 59 3.140 -4.359 -7.612 1.00 72.02 H new ATOM 0 HA ASN A 59 5.213 -5.632 -6.114 1.00 14.43 H new ATOM 0 HB2 ASN A 59 4.966 -4.973 -9.096 1.00 20.13 H new ATOM 0 HB3 ASN A 59 6.143 -6.070 -8.401 1.00 20.13 H new ATOM 0 HD21 ASN A 59 3.864 -8.603 -9.423 1.00 33.51 H new ATOM 0 HD22 ASN A 59 5.395 -7.782 -9.741 1.00 33.51 H new ATOM 1007 N ASP A 60 5.982 -2.898 -7.857 1.00 12.52 N ATOM 1008 CA ASP A 60 7.020 -1.889 -8.133 1.00 22.23 C ATOM 1009 C ASP A 60 6.602 -0.518 -7.559 1.00 21.42 C ATOM 1010 O ASP A 60 5.407 -0.206 -7.467 1.00 14.43 O ATOM 1011 CB ASP A 60 7.263 -1.808 -9.673 1.00 63.23 C ATOM 1012 CG ASP A 60 8.592 -1.116 -10.056 1.00 41.51 C ATOM 1013 OD1 ASP A 60 8.681 0.122 -9.944 1.00 71.11 O ATOM 1014 OD2 ASP A 60 9.557 -1.809 -10.459 1.00 1.23 O ATOM 0 H ASP A 60 5.174 -2.832 -8.476 1.00 12.52 H new ATOM 0 HA ASP A 60 7.952 -2.179 -7.647 1.00 22.23 H new ATOM 0 HB2 ASP A 60 7.256 -2.816 -10.087 1.00 63.23 H new ATOM 0 HB3 ASP A 60 6.436 -1.268 -10.135 1.00 63.23 H new ATOM 1019 N LYS A 61 7.614 0.301 -7.217 1.00 5.33 N ATOM 1020 CA LYS A 61 7.429 1.611 -6.556 1.00 42.10 C ATOM 1021 C LYS A 61 6.907 2.706 -7.512 1.00 4.12 C ATOM 1022 O LYS A 61 6.412 3.744 -7.050 1.00 23.00 O ATOM 1023 CB LYS A 61 8.753 2.062 -5.881 1.00 31.33 C ATOM 1024 CG LYS A 61 9.199 1.168 -4.697 1.00 5.41 C ATOM 1025 CD LYS A 61 10.495 1.679 -4.021 1.00 64.41 C ATOM 1026 CE LYS A 61 10.851 0.907 -2.739 1.00 44.45 C ATOM 1027 NZ LYS A 61 11.137 -0.523 -3.009 1.00 21.03 N ATOM 0 H LYS A 61 8.592 0.072 -7.392 1.00 5.33 H new ATOM 0 HA LYS A 61 6.659 1.474 -5.796 1.00 42.10 H new ATOM 0 HB2 LYS A 61 9.544 2.074 -6.631 1.00 31.33 H new ATOM 0 HB3 LYS A 61 8.636 3.085 -5.525 1.00 31.33 H new ATOM 0 HG2 LYS A 61 8.400 1.126 -3.957 1.00 5.41 H new ATOM 0 HG3 LYS A 61 9.357 0.150 -5.054 1.00 5.41 H new ATOM 0 HD2 LYS A 61 11.322 1.600 -4.727 1.00 64.41 H new ATOM 0 HD3 LYS A 61 10.380 2.736 -3.782 1.00 64.41 H new ATOM 0 HE2 LYS A 61 11.720 1.367 -2.269 1.00 44.45 H new ATOM 0 HE3 LYS A 61 10.027 0.984 -2.030 1.00 44.45 H new ATOM 0 HZ1 LYS A 61 12.002 -0.805 -2.505 1.00 21.03 H new ATOM 0 HZ2 LYS A 61 10.340 -1.105 -2.681 1.00 21.03 H new ATOM 0 HZ3 LYS A 61 11.270 -0.663 -4.031 1.00 21.03 H new ATOM 1041 N GLN A 62 7.014 2.471 -8.834 1.00 3.35 N ATOM 1042 CA GLN A 62 6.529 3.424 -9.856 1.00 43.24 C ATOM 1043 C GLN A 62 4.985 3.451 -9.878 1.00 73.35 C ATOM 1044 O GLN A 62 4.370 4.513 -10.037 1.00 32.03 O ATOM 1045 CB GLN A 62 7.083 3.061 -11.265 1.00 14.21 C ATOM 1046 CG GLN A 62 6.548 1.739 -11.861 1.00 32.11 C ATOM 1047 CD GLN A 62 7.029 1.435 -13.273 1.00 22.20 C ATOM 1048 OE1 GLN A 62 6.305 0.825 -14.059 1.00 23.31 O ATOM 1049 NE2 GLN A 62 8.253 1.815 -13.603 1.00 55.23 N ATOM 0 H GLN A 62 7.434 1.626 -9.222 1.00 3.35 H new ATOM 0 HA GLN A 62 6.894 4.417 -9.592 1.00 43.24 H new ATOM 0 HB2 GLN A 62 6.845 3.873 -11.952 1.00 14.21 H new ATOM 0 HB3 GLN A 62 8.170 3.001 -11.206 1.00 14.21 H new ATOM 0 HG2 GLN A 62 6.841 0.917 -11.208 1.00 32.11 H new ATOM 0 HG3 GLN A 62 5.459 1.772 -11.863 1.00 32.11 H new ATOM 0 HE21 GLN A 62 8.829 2.319 -12.929 1.00 55.23 H new ATOM 0 HE22 GLN A 62 8.620 1.603 -14.531 1.00 55.23 H new ATOM 1058 N LEU A 63 4.385 2.255 -9.687 1.00 31.20 N ATOM 1059 CA LEU A 63 2.928 2.070 -9.683 1.00 41.04 C ATOM 1060 C LEU A 63 2.345 2.772 -8.446 1.00 34.21 C ATOM 1061 O LEU A 63 1.316 3.461 -8.524 1.00 1.22 O ATOM 1062 CB LEU A 63 2.585 0.546 -9.680 1.00 23.20 C ATOM 1063 CG LEU A 63 3.309 -0.330 -10.762 1.00 41.43 C ATOM 1064 CD1 LEU A 63 2.942 -1.825 -10.633 1.00 4.23 C ATOM 1065 CD2 LEU A 63 3.032 0.188 -12.187 1.00 41.12 C ATOM 0 H LEU A 63 4.905 1.392 -9.531 1.00 31.20 H new ATOM 0 HA LEU A 63 2.490 2.508 -10.580 1.00 41.04 H new ATOM 0 HB2 LEU A 63 2.825 0.143 -8.696 1.00 23.20 H new ATOM 0 HB3 LEU A 63 1.509 0.437 -9.815 1.00 23.20 H new ATOM 0 HG LEU A 63 4.380 -0.241 -10.577 1.00 41.43 H new ATOM 0 HD11 LEU A 63 3.465 -2.396 -11.401 1.00 4.23 H new ATOM 0 HD12 LEU A 63 3.236 -2.188 -9.648 1.00 4.23 H new ATOM 0 HD13 LEU A 63 1.866 -1.948 -10.759 1.00 4.23 H new ATOM 0 HD21 LEU A 63 3.549 -0.443 -12.910 1.00 41.12 H new ATOM 0 HD22 LEU A 63 1.960 0.160 -12.382 1.00 41.12 H new ATOM 0 HD23 LEU A 63 3.391 1.213 -12.278 1.00 41.12 H new ATOM 1077 N LEU A 64 3.075 2.611 -7.316 1.00 44.15 N ATOM 1078 CA LEU A 64 2.770 3.271 -6.039 1.00 41.24 C ATOM 1079 C LEU A 64 2.723 4.789 -6.200 1.00 34.41 C ATOM 1080 O LEU A 64 1.723 5.386 -5.873 1.00 21.11 O ATOM 1081 CB LEU A 64 3.828 2.913 -4.970 1.00 43.21 C ATOM 1082 CG LEU A 64 3.916 1.420 -4.567 1.00 30.11 C ATOM 1083 CD1 LEU A 64 5.115 1.187 -3.641 1.00 4.22 C ATOM 1084 CD2 LEU A 64 2.601 0.944 -3.913 1.00 31.14 C ATOM 0 H LEU A 64 3.899 2.012 -7.273 1.00 44.15 H new ATOM 0 HA LEU A 64 1.791 2.915 -5.717 1.00 41.24 H new ATOM 0 HB2 LEU A 64 4.805 3.227 -5.337 1.00 43.21 H new ATOM 0 HB3 LEU A 64 3.621 3.498 -4.074 1.00 43.21 H new ATOM 0 HG LEU A 64 4.065 0.828 -5.470 1.00 30.11 H new ATOM 0 HD11 LEU A 64 5.163 0.133 -3.367 1.00 4.22 H new ATOM 0 HD12 LEU A 64 6.033 1.470 -4.156 1.00 4.22 H new ATOM 0 HD13 LEU A 64 5.003 1.792 -2.741 1.00 4.22 H new ATOM 0 HD21 LEU A 64 2.690 -0.107 -3.640 1.00 31.14 H new ATOM 0 HD22 LEU A 64 2.404 1.536 -3.019 1.00 31.14 H new ATOM 0 HD23 LEU A 64 1.779 1.067 -4.618 1.00 31.14 H new ATOM 1096 N LYS A 65 3.808 5.366 -6.770 1.00 32.44 N ATOM 1097 CA LYS A 65 4.011 6.831 -6.893 1.00 53.32 C ATOM 1098 C LYS A 65 2.779 7.526 -7.508 1.00 45.02 C ATOM 1099 O LYS A 65 2.285 8.515 -6.957 1.00 1.45 O ATOM 1100 CB LYS A 65 5.295 7.108 -7.732 1.00 22.12 C ATOM 1101 CG LYS A 65 5.568 8.590 -8.117 1.00 72.54 C ATOM 1102 CD LYS A 65 5.603 9.555 -6.909 1.00 42.20 C ATOM 1103 CE LYS A 65 6.020 10.986 -7.311 1.00 11.22 C ATOM 1104 NZ LYS A 65 5.291 11.485 -8.520 1.00 45.14 N ATOM 0 H LYS A 65 4.576 4.821 -7.162 1.00 32.44 H new ATOM 0 HA LYS A 65 4.141 7.250 -5.895 1.00 53.32 H new ATOM 0 HB2 LYS A 65 6.154 6.737 -7.173 1.00 22.12 H new ATOM 0 HB3 LYS A 65 5.235 6.523 -8.650 1.00 22.12 H new ATOM 0 HG2 LYS A 65 6.520 8.649 -8.644 1.00 72.54 H new ATOM 0 HG3 LYS A 65 4.798 8.922 -8.813 1.00 72.54 H new ATOM 0 HD2 LYS A 65 4.619 9.584 -6.442 1.00 42.20 H new ATOM 0 HD3 LYS A 65 6.299 9.173 -6.162 1.00 42.20 H new ATOM 0 HE2 LYS A 65 5.834 11.662 -6.476 1.00 11.22 H new ATOM 0 HE3 LYS A 65 7.092 11.006 -7.505 1.00 11.22 H new ATOM 0 HZ1 LYS A 65 5.118 12.506 -8.424 1.00 45.14 H new ATOM 0 HZ2 LYS A 65 5.865 11.309 -9.369 1.00 45.14 H new ATOM 0 HZ3 LYS A 65 4.382 10.987 -8.608 1.00 45.14 H new ATOM 1118 N GLU A 66 2.283 6.960 -8.621 1.00 72.31 N ATOM 1119 CA GLU A 66 1.057 7.428 -9.286 1.00 74.43 C ATOM 1120 C GLU A 66 -0.167 7.306 -8.357 1.00 3.25 C ATOM 1121 O GLU A 66 -0.879 8.296 -8.134 1.00 24.21 O ATOM 1122 CB GLU A 66 0.826 6.633 -10.591 1.00 11.43 C ATOM 1123 CG GLU A 66 1.907 6.864 -11.660 1.00 3.53 C ATOM 1124 CD GLU A 66 1.664 6.037 -12.927 1.00 63.24 C ATOM 1125 OE1 GLU A 66 0.824 6.443 -13.767 1.00 22.44 O ATOM 1126 OE2 GLU A 66 2.292 4.969 -13.081 1.00 53.51 O ATOM 0 H GLU A 66 2.722 6.164 -9.085 1.00 72.31 H new ATOM 0 HA GLU A 66 1.184 8.483 -9.529 1.00 74.43 H new ATOM 0 HB2 GLU A 66 0.784 5.570 -10.355 1.00 11.43 H new ATOM 0 HB3 GLU A 66 -0.145 6.906 -11.005 1.00 11.43 H new ATOM 0 HG2 GLU A 66 1.936 7.922 -11.920 1.00 3.53 H new ATOM 0 HG3 GLU A 66 2.883 6.611 -11.246 1.00 3.53 H new ATOM 1133 N MET A 67 -0.363 6.098 -7.779 1.00 44.31 N ATOM 1134 CA MET A 67 -1.551 5.782 -6.957 1.00 4.34 C ATOM 1135 C MET A 67 -1.652 6.674 -5.698 1.00 20.42 C ATOM 1136 O MET A 67 -2.739 7.109 -5.358 1.00 44.33 O ATOM 1137 CB MET A 67 -1.577 4.278 -6.566 1.00 34.03 C ATOM 1138 CG MET A 67 -1.835 3.322 -7.739 1.00 74.11 C ATOM 1139 SD MET A 67 -2.095 1.605 -7.231 1.00 13.44 S ATOM 1140 CE MET A 67 -0.481 1.138 -6.606 1.00 13.43 C ATOM 0 H MET A 67 0.293 5.322 -7.869 1.00 44.31 H new ATOM 0 HA MET A 67 -2.424 5.996 -7.574 1.00 4.34 H new ATOM 0 HB2 MET A 67 -0.624 4.019 -6.105 1.00 34.03 H new ATOM 0 HB3 MET A 67 -2.349 4.125 -5.812 1.00 34.03 H new ATOM 0 HG2 MET A 67 -2.710 3.665 -8.291 1.00 74.11 H new ATOM 0 HG3 MET A 67 -0.989 3.365 -8.425 1.00 74.11 H new ATOM 0 HE1 MET A 67 -0.096 0.298 -7.184 1.00 13.43 H new ATOM 0 HE2 MET A 67 0.202 1.983 -6.695 1.00 13.43 H new ATOM 0 HE3 MET A 67 -0.566 0.849 -5.558 1.00 13.43 H new ATOM 1150 N LEU A 68 -0.508 6.952 -5.046 1.00 75.13 N ATOM 1151 CA LEU A 68 -0.427 7.798 -3.829 1.00 33.11 C ATOM 1152 C LEU A 68 -1.020 9.201 -4.073 1.00 65.25 C ATOM 1153 O LEU A 68 -1.724 9.753 -3.225 1.00 63.33 O ATOM 1154 CB LEU A 68 1.058 7.936 -3.377 1.00 51.04 C ATOM 1155 CG LEU A 68 1.793 6.608 -3.008 1.00 15.22 C ATOM 1156 CD1 LEU A 68 3.305 6.832 -2.852 1.00 41.22 C ATOM 1157 CD2 LEU A 68 1.199 5.954 -1.748 1.00 62.54 C ATOM 0 H LEU A 68 0.398 6.595 -5.348 1.00 75.13 H new ATOM 0 HA LEU A 68 -1.011 7.312 -3.047 1.00 33.11 H new ATOM 0 HB2 LEU A 68 1.615 8.425 -4.176 1.00 51.04 H new ATOM 0 HB3 LEU A 68 1.093 8.598 -2.512 1.00 51.04 H new ATOM 0 HG LEU A 68 1.639 5.917 -3.836 1.00 15.22 H new ATOM 0 HD11 LEU A 68 3.788 5.889 -2.595 1.00 41.22 H new ATOM 0 HD12 LEU A 68 3.716 7.207 -3.789 1.00 41.22 H new ATOM 0 HD13 LEU A 68 3.485 7.559 -2.060 1.00 41.22 H new ATOM 0 HD21 LEU A 68 1.739 5.033 -1.527 1.00 62.54 H new ATOM 0 HD22 LEU A 68 1.290 6.639 -0.905 1.00 62.54 H new ATOM 0 HD23 LEU A 68 0.147 5.725 -1.918 1.00 62.54 H new ATOM 1169 N GLU A 69 -0.730 9.739 -5.267 1.00 50.21 N ATOM 1170 CA GLU A 69 -1.131 11.098 -5.678 1.00 40.23 C ATOM 1171 C GLU A 69 -2.597 11.126 -6.129 1.00 42.22 C ATOM 1172 O GLU A 69 -3.293 12.133 -5.942 1.00 3.12 O ATOM 1173 CB GLU A 69 -0.197 11.584 -6.808 1.00 25.30 C ATOM 1174 CG GLU A 69 1.296 11.554 -6.418 1.00 65.11 C ATOM 1175 CD GLU A 69 2.227 11.933 -7.566 1.00 2.41 C ATOM 1176 OE1 GLU A 69 2.272 11.185 -8.557 1.00 22.34 O ATOM 1177 OE2 GLU A 69 2.933 12.965 -7.488 1.00 13.21 O ATOM 0 H GLU A 69 -0.205 9.239 -5.984 1.00 50.21 H new ATOM 0 HA GLU A 69 -1.041 11.770 -4.825 1.00 40.23 H new ATOM 0 HB2 GLU A 69 -0.348 10.960 -7.689 1.00 25.30 H new ATOM 0 HB3 GLU A 69 -0.473 12.601 -7.086 1.00 25.30 H new ATOM 0 HG2 GLU A 69 1.461 12.237 -5.585 1.00 65.11 H new ATOM 0 HG3 GLU A 69 1.553 10.555 -6.066 1.00 65.11 H new ATOM 1184 N LEU A 70 -3.054 10.003 -6.716 1.00 64.34 N ATOM 1185 CA LEU A 70 -4.456 9.826 -7.134 1.00 63.25 C ATOM 1186 C LEU A 70 -5.376 9.710 -5.903 1.00 10.31 C ATOM 1187 O LEU A 70 -6.425 10.334 -5.850 1.00 44.10 O ATOM 1188 CB LEU A 70 -4.579 8.598 -8.075 1.00 32.24 C ATOM 1189 CG LEU A 70 -3.866 8.768 -9.456 1.00 32.43 C ATOM 1190 CD1 LEU A 70 -3.890 7.470 -10.278 1.00 3.23 C ATOM 1191 CD2 LEU A 70 -4.474 9.945 -10.248 1.00 15.22 C ATOM 0 H LEU A 70 -2.463 9.196 -6.913 1.00 64.34 H new ATOM 0 HA LEU A 70 -4.780 10.704 -7.694 1.00 63.25 H new ATOM 0 HB2 LEU A 70 -4.163 7.726 -7.570 1.00 32.24 H new ATOM 0 HB3 LEU A 70 -5.635 8.393 -8.248 1.00 32.24 H new ATOM 0 HG LEU A 70 -2.820 8.999 -9.257 1.00 32.43 H new ATOM 0 HD11 LEU A 70 -3.384 7.633 -11.230 1.00 3.23 H new ATOM 0 HD12 LEU A 70 -3.380 6.680 -9.726 1.00 3.23 H new ATOM 0 HD13 LEU A 70 -4.923 7.175 -10.462 1.00 3.23 H new ATOM 0 HD21 LEU A 70 -3.961 10.043 -11.205 1.00 15.22 H new ATOM 0 HD22 LEU A 70 -5.534 9.758 -10.422 1.00 15.22 H new ATOM 0 HD23 LEU A 70 -4.357 10.866 -9.678 1.00 15.22 H new ATOM 1203 N ILE A 71 -4.935 8.952 -4.901 1.00 64.15 N ATOM 1204 CA ILE A 71 -5.636 8.804 -3.608 1.00 32.43 C ATOM 1205 C ILE A 71 -5.653 10.151 -2.844 1.00 34.32 C ATOM 1206 O ILE A 71 -6.634 10.487 -2.154 1.00 21.11 O ATOM 1207 CB ILE A 71 -4.941 7.664 -2.770 1.00 45.51 C ATOM 1208 CG1 ILE A 71 -5.136 6.294 -3.496 1.00 50.20 C ATOM 1209 CG2 ILE A 71 -5.444 7.608 -1.310 1.00 5.44 C ATOM 1210 CD1 ILE A 71 -4.345 5.134 -2.924 1.00 3.15 C ATOM 0 H ILE A 71 -4.071 8.413 -4.956 1.00 64.15 H new ATOM 0 HA ILE A 71 -6.674 8.521 -3.781 1.00 32.43 H new ATOM 0 HB ILE A 71 -3.877 7.891 -2.709 1.00 45.51 H new ATOM 0 HG12 ILE A 71 -6.195 6.037 -3.471 1.00 50.20 H new ATOM 0 HG13 ILE A 71 -4.863 6.416 -4.544 1.00 50.20 H new ATOM 0 HG21 ILE A 71 -4.932 6.805 -0.779 1.00 5.44 H new ATOM 0 HG22 ILE A 71 -5.237 8.558 -0.817 1.00 5.44 H new ATOM 0 HG23 ILE A 71 -6.518 7.421 -1.302 1.00 5.44 H new ATOM 0 HD11 ILE A 71 -4.553 4.233 -3.500 1.00 3.15 H new ATOM 0 HD12 ILE A 71 -3.280 5.360 -2.975 1.00 3.15 H new ATOM 0 HD13 ILE A 71 -4.633 4.975 -1.885 1.00 3.15 H new ATOM 1222 N SER A 72 -4.573 10.929 -3.027 1.00 71.31 N ATOM 1223 CA SER A 72 -4.418 12.259 -2.425 1.00 1.41 C ATOM 1224 C SER A 72 -5.451 13.249 -2.994 1.00 14.22 C ATOM 1225 O SER A 72 -6.067 14.011 -2.234 1.00 51.34 O ATOM 1226 CB SER A 72 -2.980 12.775 -2.644 1.00 40.41 C ATOM 1227 OG SER A 72 -2.783 14.049 -2.061 1.00 1.01 O ATOM 0 H SER A 72 -3.778 10.648 -3.602 1.00 71.31 H new ATOM 0 HA SER A 72 -4.599 12.176 -1.353 1.00 1.41 H new ATOM 0 HB2 SER A 72 -2.271 12.066 -2.216 1.00 40.41 H new ATOM 0 HB3 SER A 72 -2.772 12.829 -3.713 1.00 40.41 H new ATOM 0 HG SER A 72 -1.861 14.342 -2.219 1.00 1.01 H new ATOM 1233 N LYS A 73 -5.655 13.226 -4.333 1.00 14.30 N ATOM 1234 CA LYS A 73 -6.619 14.135 -4.994 1.00 22.50 C ATOM 1235 C LYS A 73 -8.068 13.683 -4.756 1.00 25.05 C ATOM 1236 O LYS A 73 -9.001 14.476 -4.924 1.00 61.21 O ATOM 1237 CB LYS A 73 -6.287 14.347 -6.513 1.00 33.43 C ATOM 1238 CG LYS A 73 -6.259 13.106 -7.451 1.00 13.14 C ATOM 1239 CD LYS A 73 -7.645 12.499 -7.795 1.00 52.24 C ATOM 1240 CE LYS A 73 -8.640 13.507 -8.399 1.00 63.15 C ATOM 1241 NZ LYS A 73 -8.165 14.073 -9.690 1.00 63.32 N ATOM 0 H LYS A 73 -5.170 12.594 -4.970 1.00 14.30 H new ATOM 0 HA LYS A 73 -6.517 15.115 -4.529 1.00 22.50 H new ATOM 0 HB2 LYS A 73 -7.016 15.050 -6.916 1.00 33.43 H new ATOM 0 HB3 LYS A 73 -5.312 14.830 -6.574 1.00 33.43 H new ATOM 0 HG2 LYS A 73 -5.763 13.386 -8.381 1.00 13.14 H new ATOM 0 HG3 LYS A 73 -5.649 12.333 -6.984 1.00 13.14 H new ATOM 0 HD2 LYS A 73 -7.506 11.677 -8.497 1.00 52.24 H new ATOM 0 HD3 LYS A 73 -8.079 12.075 -6.890 1.00 52.24 H new ATOM 0 HE2 LYS A 73 -9.601 13.016 -8.553 1.00 63.15 H new ATOM 0 HE3 LYS A 73 -8.806 14.318 -7.690 1.00 63.15 H new ATOM 0 HZ1 LYS A 73 -8.870 14.745 -10.055 1.00 63.32 H new ATOM 0 HZ2 LYS A 73 -7.261 14.566 -9.541 1.00 63.32 H new ATOM 0 HZ3 LYS A 73 -8.031 13.304 -10.378 1.00 63.32 H new ATOM 1255 N LEU A 74 -8.253 12.395 -4.392 1.00 12.33 N ATOM 1256 CA LEU A 74 -9.559 11.865 -3.948 1.00 23.24 C ATOM 1257 C LEU A 74 -9.859 12.368 -2.527 1.00 63.24 C ATOM 1258 O LEU A 74 -11.017 12.546 -2.147 1.00 71.31 O ATOM 1259 CB LEU A 74 -9.561 10.306 -3.997 1.00 54.22 C ATOM 1260 CG LEU A 74 -9.434 9.667 -5.418 1.00 63.31 C ATOM 1261 CD1 LEU A 74 -9.331 8.120 -5.357 1.00 63.32 C ATOM 1262 CD2 LEU A 74 -10.586 10.132 -6.325 1.00 21.24 C ATOM 0 H LEU A 74 -7.507 11.699 -4.398 1.00 12.33 H new ATOM 0 HA LEU A 74 -10.339 12.221 -4.621 1.00 23.24 H new ATOM 0 HB2 LEU A 74 -8.739 9.941 -3.381 1.00 54.22 H new ATOM 0 HB3 LEU A 74 -10.484 9.949 -3.540 1.00 54.22 H new ATOM 0 HG LEU A 74 -8.500 10.017 -5.857 1.00 63.31 H new ATOM 0 HD11 LEU A 74 -9.245 7.721 -6.368 1.00 63.32 H new ATOM 0 HD12 LEU A 74 -8.452 7.836 -4.778 1.00 63.32 H new ATOM 0 HD13 LEU A 74 -10.224 7.714 -4.882 1.00 63.32 H new ATOM 0 HD21 LEU A 74 -10.480 9.677 -7.310 1.00 21.24 H new ATOM 0 HD22 LEU A 74 -11.538 9.832 -5.887 1.00 21.24 H new ATOM 0 HD23 LEU A 74 -10.557 11.217 -6.422 1.00 21.24 H new ATOM 1274 N GLY A 75 -8.780 12.589 -1.755 1.00 30.21 N ATOM 1275 CA GLY A 75 -8.863 13.181 -0.420 1.00 43.12 C ATOM 1276 C GLY A 75 -8.840 12.141 0.679 1.00 54.12 C ATOM 1277 O GLY A 75 -9.215 12.429 1.819 1.00 42.11 O ATOM 0 H GLY A 75 -7.829 12.360 -2.045 1.00 30.21 H new ATOM 0 HA2 GLY A 75 -8.031 13.871 -0.280 1.00 43.12 H new ATOM 0 HA3 GLY A 75 -9.779 13.766 -0.342 1.00 43.12 H new ATOM 1281 N TYR A 76 -8.396 10.926 0.331 1.00 34.04 N ATOM 1282 CA TYR A 76 -8.306 9.797 1.268 1.00 71.13 C ATOM 1283 C TYR A 76 -6.955 9.798 1.991 1.00 13.41 C ATOM 1284 O TYR A 76 -6.021 10.512 1.594 1.00 0.22 O ATOM 1285 CB TYR A 76 -8.495 8.456 0.512 1.00 24.00 C ATOM 1286 CG TYR A 76 -9.820 8.318 -0.249 1.00 13.54 C ATOM 1287 CD1 TYR A 76 -11.001 8.882 0.243 1.00 52.33 C ATOM 1288 CD2 TYR A 76 -9.893 7.611 -1.452 1.00 42.32 C ATOM 1289 CE1 TYR A 76 -12.191 8.756 -0.438 1.00 51.44 C ATOM 1290 CE2 TYR A 76 -11.082 7.481 -2.135 1.00 0.15 C ATOM 1291 CZ TYR A 76 -12.229 8.061 -1.628 1.00 24.30 C ATOM 1292 OH TYR A 76 -13.424 7.939 -2.302 1.00 32.31 O ATOM 0 H TYR A 76 -8.087 10.697 -0.614 1.00 34.04 H new ATOM 0 HA TYR A 76 -9.098 9.906 2.009 1.00 71.13 H new ATOM 0 HB2 TYR A 76 -7.674 8.337 -0.195 1.00 24.00 H new ATOM 0 HB3 TYR A 76 -8.419 7.639 1.229 1.00 24.00 H new ATOM 0 HD1 TYR A 76 -10.979 9.427 1.175 1.00 52.33 H new ATOM 0 HD2 TYR A 76 -8.999 7.157 -1.854 1.00 42.32 H new ATOM 0 HE1 TYR A 76 -13.092 9.200 -0.041 1.00 51.44 H new ATOM 0 HE2 TYR A 76 -11.118 6.928 -3.062 1.00 0.15 H new ATOM 0 HH TYR A 76 -13.429 7.101 -2.809 1.00 32.31 H new ATOM 1302 N LYS A 77 -6.878 8.982 3.056 1.00 11.44 N ATOM 1303 CA LYS A 77 -5.638 8.759 3.806 1.00 43.30 C ATOM 1304 C LYS A 77 -4.639 8.020 2.924 1.00 10.41 C ATOM 1305 O LYS A 77 -4.889 6.885 2.516 1.00 23.20 O ATOM 1306 CB LYS A 77 -5.932 7.921 5.070 1.00 61.23 C ATOM 1307 CG LYS A 77 -4.721 7.452 5.935 1.00 21.11 C ATOM 1308 CD LYS A 77 -4.108 8.561 6.835 1.00 0.11 C ATOM 1309 CE LYS A 77 -3.104 9.470 6.100 1.00 13.44 C ATOM 1310 NZ LYS A 77 -2.651 10.618 6.937 1.00 61.41 N ATOM 0 H LYS A 77 -7.676 8.460 3.418 1.00 11.44 H new ATOM 0 HA LYS A 77 -5.220 9.720 4.105 1.00 43.30 H new ATOM 0 HB2 LYS A 77 -6.594 8.504 5.710 1.00 61.23 H new ATOM 0 HB3 LYS A 77 -6.486 7.034 4.762 1.00 61.23 H new ATOM 0 HG2 LYS A 77 -5.041 6.623 6.567 1.00 21.11 H new ATOM 0 HG3 LYS A 77 -3.945 7.067 5.273 1.00 21.11 H new ATOM 0 HD2 LYS A 77 -4.913 9.175 7.239 1.00 0.11 H new ATOM 0 HD3 LYS A 77 -3.608 8.093 7.683 1.00 0.11 H new ATOM 0 HE2 LYS A 77 -2.238 8.880 5.799 1.00 13.44 H new ATOM 0 HE3 LYS A 77 -3.564 9.849 5.187 1.00 13.44 H new ATOM 0 HZ1 LYS A 77 -1.978 11.197 6.396 1.00 61.41 H new ATOM 0 HZ2 LYS A 77 -3.472 11.199 7.203 1.00 61.41 H new ATOM 0 HZ3 LYS A 77 -2.187 10.260 7.796 1.00 61.41 H new ATOM 1324 N VAL A 78 -3.533 8.690 2.592 1.00 64.03 N ATOM 1325 CA VAL A 78 -2.444 8.071 1.848 1.00 41.10 C ATOM 1326 C VAL A 78 -1.452 7.469 2.853 1.00 50.31 C ATOM 1327 O VAL A 78 -0.734 8.195 3.547 1.00 10.23 O ATOM 1328 CB VAL A 78 -1.724 9.105 0.910 1.00 74.31 C ATOM 1329 CG1 VAL A 78 -0.688 8.401 0.012 1.00 14.31 C ATOM 1330 CG2 VAL A 78 -2.748 9.898 0.069 1.00 42.20 C ATOM 0 H VAL A 78 -3.372 9.668 2.831 1.00 64.03 H new ATOM 0 HA VAL A 78 -2.848 7.289 1.205 1.00 41.10 H new ATOM 0 HB VAL A 78 -1.191 9.818 1.539 1.00 74.31 H new ATOM 0 HG11 VAL A 78 -0.202 9.137 -0.629 1.00 14.31 H new ATOM 0 HG12 VAL A 78 0.061 7.912 0.635 1.00 14.31 H new ATOM 0 HG13 VAL A 78 -1.189 7.656 -0.606 1.00 14.31 H new ATOM 0 HG21 VAL A 78 -2.222 10.606 -0.571 1.00 42.20 H new ATOM 0 HG22 VAL A 78 -3.323 9.208 -0.549 1.00 42.20 H new ATOM 0 HG23 VAL A 78 -3.422 10.440 0.732 1.00 42.20 H new ATOM 1340 N PHE A 79 -1.469 6.140 2.946 1.00 21.11 N ATOM 1341 CA PHE A 79 -0.587 5.355 3.814 1.00 22.05 C ATOM 1342 C PHE A 79 0.224 4.435 2.893 1.00 55.51 C ATOM 1343 O PHE A 79 -0.337 3.830 1.988 1.00 23.04 O ATOM 1344 CB PHE A 79 -1.445 4.540 4.837 1.00 11.22 C ATOM 1345 CG PHE A 79 -0.685 3.869 5.996 1.00 34.01 C ATOM 1346 CD1 PHE A 79 0.240 2.846 5.768 1.00 11.25 C ATOM 1347 CD2 PHE A 79 -0.920 4.244 7.323 1.00 21.14 C ATOM 1348 CE1 PHE A 79 0.901 2.230 6.809 1.00 14.31 C ATOM 1349 CE2 PHE A 79 -0.254 3.626 8.367 1.00 52.14 C ATOM 1350 CZ PHE A 79 0.655 2.619 8.108 1.00 74.15 C ATOM 0 H PHE A 79 -2.113 5.562 2.406 1.00 21.11 H new ATOM 0 HA PHE A 79 0.084 5.987 4.396 1.00 22.05 H new ATOM 0 HB2 PHE A 79 -2.193 5.209 5.263 1.00 11.22 H new ATOM 0 HB3 PHE A 79 -1.983 3.766 4.290 1.00 11.22 H new ATOM 0 HD1 PHE A 79 0.441 2.532 4.755 1.00 11.25 H new ATOM 0 HD2 PHE A 79 -1.632 5.028 7.536 1.00 21.14 H new ATOM 0 HE1 PHE A 79 1.612 1.442 6.607 1.00 14.31 H new ATOM 0 HE2 PHE A 79 -0.445 3.931 9.385 1.00 52.14 H new ATOM 0 HZ PHE A 79 1.173 2.136 8.924 1.00 74.15 H new ATOM 1360 N LEU A 80 1.535 4.339 3.118 1.00 34.43 N ATOM 1361 CA LEU A 80 2.434 3.551 2.269 1.00 52.34 C ATOM 1362 C LEU A 80 3.357 2.708 3.150 1.00 35.32 C ATOM 1363 O LEU A 80 4.297 3.220 3.740 1.00 72.03 O ATOM 1364 CB LEU A 80 3.256 4.490 1.345 1.00 44.20 C ATOM 1365 CG LEU A 80 4.276 3.792 0.382 1.00 23.12 C ATOM 1366 CD1 LEU A 80 3.567 2.913 -0.662 1.00 24.22 C ATOM 1367 CD2 LEU A 80 5.201 4.827 -0.283 1.00 54.21 C ATOM 0 H LEU A 80 2.005 4.805 3.894 1.00 34.43 H new ATOM 0 HA LEU A 80 1.847 2.884 1.637 1.00 52.34 H new ATOM 0 HB2 LEU A 80 2.560 5.073 0.742 1.00 44.20 H new ATOM 0 HB3 LEU A 80 3.803 5.194 1.972 1.00 44.20 H new ATOM 0 HG LEU A 80 4.896 3.129 0.985 1.00 23.12 H new ATOM 0 HD11 LEU A 80 4.309 2.447 -1.310 1.00 24.22 H new ATOM 0 HD12 LEU A 80 2.991 2.139 -0.155 1.00 24.22 H new ATOM 0 HD13 LEU A 80 2.897 3.529 -1.262 1.00 24.22 H new ATOM 0 HD21 LEU A 80 5.900 4.317 -0.947 1.00 54.21 H new ATOM 0 HD22 LEU A 80 4.603 5.533 -0.859 1.00 54.21 H new ATOM 0 HD23 LEU A 80 5.757 5.365 0.485 1.00 54.21 H new ATOM 1379 N LEU A 81 3.055 1.419 3.267 1.00 23.01 N ATOM 1380 CA LEU A 81 3.921 0.455 3.950 1.00 74.40 C ATOM 1381 C LEU A 81 4.813 -0.202 2.893 1.00 44.55 C ATOM 1382 O LEU A 81 4.309 -0.930 2.046 1.00 54.41 O ATOM 1383 CB LEU A 81 3.052 -0.600 4.692 1.00 72.45 C ATOM 1384 CG LEU A 81 3.817 -1.780 5.374 1.00 51.53 C ATOM 1385 CD1 LEU A 81 4.833 -1.273 6.419 1.00 40.15 C ATOM 1386 CD2 LEU A 81 2.828 -2.792 5.985 1.00 10.21 C ATOM 0 H LEU A 81 2.200 1.009 2.891 1.00 23.01 H new ATOM 0 HA LEU A 81 4.544 0.948 4.696 1.00 74.40 H new ATOM 0 HB2 LEU A 81 2.469 -0.085 5.456 1.00 72.45 H new ATOM 0 HB3 LEU A 81 2.343 -1.020 3.979 1.00 72.45 H new ATOM 0 HG LEU A 81 4.389 -2.296 4.603 1.00 51.53 H new ATOM 0 HD11 LEU A 81 5.345 -2.123 6.871 1.00 40.15 H new ATOM 0 HD12 LEU A 81 5.563 -0.627 5.933 1.00 40.15 H new ATOM 0 HD13 LEU A 81 4.310 -0.711 7.193 1.00 40.15 H new ATOM 0 HD21 LEU A 81 3.382 -3.605 6.454 1.00 10.21 H new ATOM 0 HD22 LEU A 81 2.213 -2.293 6.734 1.00 10.21 H new ATOM 0 HD23 LEU A 81 2.188 -3.195 5.200 1.00 10.21 H new ATOM 1398 N LEU A 82 6.129 0.059 2.923 1.00 25.32 N ATOM 1399 CA LEU A 82 7.070 -0.524 1.945 1.00 34.42 C ATOM 1400 C LEU A 82 8.034 -1.510 2.632 1.00 1.22 C ATOM 1401 O LEU A 82 8.527 -1.252 3.740 1.00 1.54 O ATOM 1402 CB LEU A 82 7.801 0.590 1.100 1.00 41.42 C ATOM 1403 CG LEU A 82 8.230 1.929 1.806 1.00 61.13 C ATOM 1404 CD1 LEU A 82 9.345 1.734 2.848 1.00 11.25 C ATOM 1405 CD2 LEU A 82 8.647 2.990 0.762 1.00 2.41 C ATOM 0 H LEU A 82 6.569 0.669 3.612 1.00 25.32 H new ATOM 0 HA LEU A 82 6.499 -1.106 1.222 1.00 34.42 H new ATOM 0 HB2 LEU A 82 8.698 0.142 0.673 1.00 41.42 H new ATOM 0 HB3 LEU A 82 7.148 0.852 0.268 1.00 41.42 H new ATOM 0 HG LEU A 82 7.353 2.283 2.349 1.00 61.13 H new ATOM 0 HD11 LEU A 82 9.595 2.695 3.298 1.00 11.25 H new ATOM 0 HD12 LEU A 82 9.003 1.048 3.623 1.00 11.25 H new ATOM 0 HD13 LEU A 82 10.229 1.320 2.362 1.00 11.25 H new ATOM 0 HD21 LEU A 82 8.940 3.907 1.273 1.00 2.41 H new ATOM 0 HD22 LEU A 82 9.488 2.615 0.178 1.00 2.41 H new ATOM 0 HD23 LEU A 82 7.808 3.196 0.098 1.00 2.41 H new ATOM 1417 N GLN A 83 8.264 -2.659 1.961 1.00 32.23 N ATOM 1418 CA GLN A 83 9.144 -3.727 2.449 1.00 63.40 C ATOM 1419 C GLN A 83 9.945 -4.308 1.272 1.00 30.30 C ATOM 1420 O GLN A 83 9.399 -4.572 0.189 1.00 72.11 O ATOM 1421 CB GLN A 83 8.337 -4.829 3.228 1.00 24.21 C ATOM 1422 CG GLN A 83 7.674 -5.974 2.410 1.00 73.42 C ATOM 1423 CD GLN A 83 8.622 -7.128 2.017 1.00 12.45 C ATOM 1424 OE1 GLN A 83 8.453 -7.763 0.970 1.00 25.41 O ATOM 1425 NE2 GLN A 83 9.608 -7.424 2.855 1.00 63.44 N ATOM 0 H GLN A 83 7.837 -2.867 1.058 1.00 32.23 H new ATOM 0 HA GLN A 83 9.849 -3.309 3.167 1.00 63.40 H new ATOM 0 HB2 GLN A 83 9.012 -5.285 3.952 1.00 24.21 H new ATOM 0 HB3 GLN A 83 7.552 -4.328 3.795 1.00 24.21 H new ATOM 0 HG2 GLN A 83 6.848 -6.384 2.991 1.00 73.42 H new ATOM 0 HG3 GLN A 83 7.245 -5.550 1.502 1.00 73.42 H new ATOM 0 HE21 GLN A 83 9.727 -6.885 3.713 1.00 63.44 H new ATOM 0 HE22 GLN A 83 10.247 -8.190 2.641 1.00 63.44 H new ATOM 1434 N ASP A 84 11.243 -4.467 1.502 1.00 14.54 N ATOM 1435 CA ASP A 84 12.190 -5.100 0.577 1.00 2.24 C ATOM 1436 C ASP A 84 13.359 -5.651 1.392 1.00 0.12 C ATOM 1437 O ASP A 84 13.561 -5.270 2.556 1.00 43.54 O ATOM 1438 CB ASP A 84 12.730 -4.112 -0.519 1.00 50.21 C ATOM 1439 CG ASP A 84 11.792 -3.920 -1.732 1.00 33.30 C ATOM 1440 OD1 ASP A 84 11.842 -4.744 -2.674 1.00 30.51 O ATOM 1441 OD2 ASP A 84 11.011 -2.944 -1.753 1.00 12.43 O ATOM 0 H ASP A 84 11.685 -4.150 2.365 1.00 14.54 H new ATOM 0 HA ASP A 84 11.664 -5.894 0.048 1.00 2.24 H new ATOM 0 HB2 ASP A 84 12.908 -3.141 -0.057 1.00 50.21 H new ATOM 0 HB3 ASP A 84 13.693 -4.477 -0.876 1.00 50.21 H new ATOM 1446 N GLN A 85 14.138 -6.528 0.759 1.00 23.30 N ATOM 1447 CA GLN A 85 15.355 -7.101 1.354 1.00 51.24 C ATOM 1448 C GLN A 85 16.532 -6.115 1.209 1.00 32.43 C ATOM 1449 O GLN A 85 17.582 -6.292 1.834 1.00 63.31 O ATOM 1450 CB GLN A 85 15.657 -8.467 0.701 1.00 42.22 C ATOM 1451 CG GLN A 85 14.513 -9.491 0.845 1.00 0.44 C ATOM 1452 CD GLN A 85 14.820 -10.852 0.217 1.00 24.31 C ATOM 1453 OE1 GLN A 85 15.364 -11.750 0.868 1.00 42.51 O ATOM 1454 NE2 GLN A 85 14.487 -11.011 -1.055 1.00 52.25 N ATOM 0 H GLN A 85 13.946 -6.865 -0.184 1.00 23.30 H new ATOM 0 HA GLN A 85 15.203 -7.268 2.420 1.00 51.24 H new ATOM 0 HB2 GLN A 85 15.865 -8.315 -0.358 1.00 42.22 H new ATOM 0 HB3 GLN A 85 16.561 -8.881 1.147 1.00 42.22 H new ATOM 0 HG2 GLN A 85 14.294 -9.631 1.904 1.00 0.44 H new ATOM 0 HG3 GLN A 85 13.613 -9.083 0.385 1.00 0.44 H new ATOM 0 HE21 GLN A 85 14.039 -10.249 -1.564 1.00 52.25 H new ATOM 0 HE22 GLN A 85 14.679 -11.895 -1.526 1.00 52.25 H new ATOM 1463 N ASP A 86 16.348 -5.084 0.361 1.00 32.21 N ATOM 1464 CA ASP A 86 17.268 -3.940 0.252 1.00 52.41 C ATOM 1465 C ASP A 86 16.594 -2.699 0.867 1.00 22.34 C ATOM 1466 O ASP A 86 15.563 -2.229 0.369 1.00 71.41 O ATOM 1467 CB ASP A 86 17.655 -3.666 -1.227 1.00 5.15 C ATOM 1468 CG ASP A 86 18.735 -2.573 -1.356 1.00 1.50 C ATOM 1469 OD1 ASP A 86 19.940 -2.892 -1.274 1.00 3.32 O ATOM 1470 OD2 ASP A 86 18.384 -1.393 -1.516 1.00 23.10 O ATOM 0 H ASP A 86 15.550 -5.024 -0.271 1.00 32.21 H new ATOM 0 HA ASP A 86 18.186 -4.171 0.792 1.00 52.41 H new ATOM 0 HB2 ASP A 86 18.018 -4.588 -1.682 1.00 5.15 H new ATOM 0 HB3 ASP A 86 16.767 -3.364 -1.783 1.00 5.15 H new ATOM 1475 N GLU A 87 17.194 -2.181 1.950 1.00 2.44 N ATOM 1476 CA GLU A 87 16.679 -1.026 2.701 1.00 21.30 C ATOM 1477 C GLU A 87 16.971 0.303 1.973 1.00 43.15 C ATOM 1478 O GLU A 87 16.242 1.279 2.174 1.00 65.42 O ATOM 1479 CB GLU A 87 17.278 -1.018 4.133 1.00 45.01 C ATOM 1480 CG GLU A 87 16.833 0.168 5.021 1.00 0.15 C ATOM 1481 CD GLU A 87 17.401 0.125 6.443 1.00 31.51 C ATOM 1482 OE1 GLU A 87 18.642 0.129 6.592 1.00 70.34 O ATOM 1483 OE2 GLU A 87 16.616 0.121 7.418 1.00 75.23 O ATOM 0 H GLU A 87 18.061 -2.557 2.333 1.00 2.44 H new ATOM 0 HA GLU A 87 15.595 -1.121 2.771 1.00 21.30 H new ATOM 0 HB2 GLU A 87 17.003 -1.948 4.631 1.00 45.01 H new ATOM 0 HB3 GLU A 87 18.365 -1.007 4.056 1.00 45.01 H new ATOM 0 HG2 GLU A 87 17.139 1.100 4.546 1.00 0.15 H new ATOM 0 HG3 GLU A 87 15.744 0.180 5.075 1.00 0.15 H new ATOM 1490 N ASN A 88 18.004 0.329 1.101 1.00 43.10 N ATOM 1491 CA ASN A 88 18.435 1.571 0.401 1.00 34.13 C ATOM 1492 C ASN A 88 17.317 2.070 -0.533 1.00 30.25 C ATOM 1493 O ASN A 88 17.048 3.273 -0.611 1.00 61.51 O ATOM 1494 CB ASN A 88 19.734 1.341 -0.418 1.00 4.44 C ATOM 1495 CG ASN A 88 20.866 0.686 0.373 1.00 42.11 C ATOM 1496 OD1 ASN A 88 20.988 0.854 1.588 1.00 71.23 O ATOM 1497 ND2 ASN A 88 21.697 -0.086 -0.311 1.00 33.00 N ATOM 0 H ASN A 88 18.558 -0.494 0.862 1.00 43.10 H new ATOM 0 HA ASN A 88 18.640 2.325 1.161 1.00 34.13 H new ATOM 0 HB2 ASN A 88 19.500 0.717 -1.281 1.00 4.44 H new ATOM 0 HB3 ASN A 88 20.082 2.300 -0.803 1.00 4.44 H new ATOM 0 HD21 ASN A 88 22.463 -0.560 0.167 1.00 33.00 H new ATOM 0 HD22 ASN A 88 21.571 -0.206 -1.316 1.00 33.00 H new ATOM 1504 N GLU A 89 16.658 1.105 -1.209 1.00 50.11 N ATOM 1505 CA GLU A 89 15.512 1.356 -2.097 1.00 72.04 C ATOM 1506 C GLU A 89 14.287 1.806 -1.296 1.00 24.22 C ATOM 1507 O GLU A 89 13.521 2.667 -1.748 1.00 34.20 O ATOM 1508 CB GLU A 89 15.188 0.092 -2.924 1.00 63.45 C ATOM 1509 CG GLU A 89 16.334 -0.334 -3.859 1.00 21.11 C ATOM 1510 CD GLU A 89 15.994 -1.565 -4.700 1.00 2.02 C ATOM 1511 OE1 GLU A 89 15.374 -1.401 -5.774 1.00 33.52 O ATOM 1512 OE2 GLU A 89 16.336 -2.697 -4.295 1.00 62.33 O ATOM 0 H GLU A 89 16.913 0.119 -1.150 1.00 50.11 H new ATOM 0 HA GLU A 89 15.779 2.161 -2.782 1.00 72.04 H new ATOM 0 HB2 GLU A 89 14.958 -0.729 -2.245 1.00 63.45 H new ATOM 0 HB3 GLU A 89 14.292 0.275 -3.518 1.00 63.45 H new ATOM 0 HG2 GLU A 89 16.581 0.495 -4.522 1.00 21.11 H new ATOM 0 HG3 GLU A 89 17.223 -0.542 -3.263 1.00 21.11 H new ATOM 1519 N LEU A 90 14.119 1.216 -0.099 1.00 44.10 N ATOM 1520 CA LEU A 90 13.028 1.567 0.824 1.00 13.41 C ATOM 1521 C LEU A 90 13.137 3.023 1.277 1.00 51.42 C ATOM 1522 O LEU A 90 12.156 3.759 1.225 1.00 63.01 O ATOM 1523 CB LEU A 90 13.027 0.629 2.061 1.00 61.01 C ATOM 1524 CG LEU A 90 12.741 -0.869 1.768 1.00 33.13 C ATOM 1525 CD1 LEU A 90 12.803 -1.712 3.059 1.00 51.35 C ATOM 1526 CD2 LEU A 90 11.388 -1.024 1.048 1.00 24.03 C ATOM 0 H LEU A 90 14.735 0.484 0.254 1.00 44.10 H new ATOM 0 HA LEU A 90 12.089 1.440 0.285 1.00 13.41 H new ATOM 0 HB2 LEU A 90 13.997 0.706 2.553 1.00 61.01 H new ATOM 0 HB3 LEU A 90 12.281 0.991 2.768 1.00 61.01 H new ATOM 0 HG LEU A 90 13.519 -1.247 1.104 1.00 33.13 H new ATOM 0 HD11 LEU A 90 12.599 -2.756 2.822 1.00 51.35 H new ATOM 0 HD12 LEU A 90 13.796 -1.628 3.501 1.00 51.35 H new ATOM 0 HD13 LEU A 90 12.058 -1.348 3.767 1.00 51.35 H new ATOM 0 HD21 LEU A 90 11.201 -2.079 0.849 1.00 24.03 H new ATOM 0 HD22 LEU A 90 10.593 -0.627 1.679 1.00 24.03 H new ATOM 0 HD23 LEU A 90 11.412 -0.476 0.106 1.00 24.03 H new ATOM 1538 N GLU A 91 14.352 3.430 1.680 1.00 3.21 N ATOM 1539 CA GLU A 91 14.580 4.728 2.328 1.00 63.34 C ATOM 1540 C GLU A 91 14.702 5.873 1.318 1.00 64.34 C ATOM 1541 O GLU A 91 14.361 7.002 1.662 1.00 15.44 O ATOM 1542 CB GLU A 91 15.819 4.677 3.256 1.00 31.30 C ATOM 1543 CG GLU A 91 17.161 4.369 2.578 1.00 22.35 C ATOM 1544 CD GLU A 91 18.313 4.266 3.590 1.00 34.33 C ATOM 1545 OE1 GLU A 91 18.917 5.313 3.923 1.00 75.53 O ATOM 1546 OE2 GLU A 91 18.591 3.150 4.081 1.00 12.11 O ATOM 0 H GLU A 91 15.198 2.871 1.566 1.00 3.21 H new ATOM 0 HA GLU A 91 13.700 4.934 2.937 1.00 63.34 H new ATOM 0 HB2 GLU A 91 15.905 5.637 3.766 1.00 31.30 H new ATOM 0 HB3 GLU A 91 15.642 3.923 4.023 1.00 31.30 H new ATOM 0 HG2 GLU A 91 17.080 3.433 2.025 1.00 22.35 H new ATOM 0 HG3 GLU A 91 17.387 5.150 1.852 1.00 22.35 H new ATOM 1553 N GLU A 92 15.177 5.590 0.078 1.00 61.43 N ATOM 1554 CA GLU A 92 15.304 6.630 -0.966 1.00 34.15 C ATOM 1555 C GLU A 92 13.907 7.078 -1.443 1.00 31.11 C ATOM 1556 O GLU A 92 13.657 8.271 -1.629 1.00 41.33 O ATOM 1557 CB GLU A 92 16.171 6.147 -2.167 1.00 52.51 C ATOM 1558 CG GLU A 92 15.558 5.011 -3.015 1.00 44.22 C ATOM 1559 CD GLU A 92 16.387 4.653 -4.258 1.00 41.43 C ATOM 1560 OE1 GLU A 92 16.332 5.413 -5.248 1.00 44.32 O ATOM 1561 OE2 GLU A 92 17.094 3.618 -4.254 1.00 14.13 O ATOM 0 H GLU A 92 15.474 4.660 -0.218 1.00 61.43 H new ATOM 0 HA GLU A 92 15.818 7.484 -0.524 1.00 34.15 H new ATOM 0 HB2 GLU A 92 16.365 6.999 -2.819 1.00 52.51 H new ATOM 0 HB3 GLU A 92 17.135 5.812 -1.785 1.00 52.51 H new ATOM 0 HG2 GLU A 92 15.450 4.123 -2.393 1.00 44.22 H new ATOM 0 HG3 GLU A 92 14.556 5.304 -3.329 1.00 44.22 H new ATOM 1568 N PHE A 93 13.003 6.095 -1.622 1.00 32.53 N ATOM 1569 CA PHE A 93 11.615 6.353 -2.018 1.00 52.22 C ATOM 1570 C PHE A 93 10.839 6.944 -0.835 1.00 34.22 C ATOM 1571 O PHE A 93 10.104 7.905 -1.011 1.00 0.22 O ATOM 1572 CB PHE A 93 10.948 5.058 -2.536 1.00 42.42 C ATOM 1573 CG PHE A 93 9.554 5.246 -3.159 1.00 1.30 C ATOM 1574 CD1 PHE A 93 9.377 6.049 -4.291 1.00 42.45 C ATOM 1575 CD2 PHE A 93 8.425 4.609 -2.632 1.00 22.35 C ATOM 1576 CE1 PHE A 93 8.127 6.210 -4.865 1.00 55.41 C ATOM 1577 CE2 PHE A 93 7.181 4.771 -3.213 1.00 12.13 C ATOM 1578 CZ PHE A 93 7.029 5.569 -4.325 1.00 12.41 C ATOM 0 H PHE A 93 13.218 5.106 -1.496 1.00 32.53 H new ATOM 0 HA PHE A 93 11.605 7.077 -2.833 1.00 52.22 H new ATOM 0 HB2 PHE A 93 11.603 4.603 -3.279 1.00 42.42 H new ATOM 0 HB3 PHE A 93 10.867 4.353 -1.708 1.00 42.42 H new ATOM 0 HD1 PHE A 93 10.229 6.552 -4.724 1.00 42.45 H new ATOM 0 HD2 PHE A 93 8.527 3.982 -1.759 1.00 22.35 H new ATOM 0 HE1 PHE A 93 8.010 6.838 -5.736 1.00 55.41 H new ATOM 0 HE2 PHE A 93 6.323 4.268 -2.792 1.00 12.13 H new ATOM 0 HZ PHE A 93 6.054 5.693 -4.773 1.00 12.41 H new ATOM 1588 N LYS A 94 11.044 6.374 0.376 1.00 12.21 N ATOM 1589 CA LYS A 94 10.394 6.856 1.612 1.00 73.14 C ATOM 1590 C LYS A 94 10.694 8.341 1.867 1.00 53.00 C ATOM 1591 O LYS A 94 9.773 9.091 2.141 1.00 1.04 O ATOM 1592 CB LYS A 94 10.816 6.005 2.844 1.00 1.23 C ATOM 1593 CG LYS A 94 10.335 6.549 4.201 1.00 20.51 C ATOM 1594 CD LYS A 94 10.634 5.598 5.374 1.00 11.44 C ATOM 1595 CE LYS A 94 10.537 6.309 6.726 1.00 41.22 C ATOM 1596 NZ LYS A 94 9.215 6.969 6.937 1.00 30.51 N ATOM 0 H LYS A 94 11.660 5.574 0.521 1.00 12.21 H new ATOM 0 HA LYS A 94 9.319 6.745 1.468 1.00 73.14 H new ATOM 0 HB2 LYS A 94 10.431 4.993 2.717 1.00 1.23 H new ATOM 0 HB3 LYS A 94 11.903 5.933 2.862 1.00 1.23 H new ATOM 0 HG2 LYS A 94 10.813 7.510 4.390 1.00 20.51 H new ATOM 0 HG3 LYS A 94 9.261 6.730 4.153 1.00 20.51 H new ATOM 0 HD2 LYS A 94 9.933 4.763 5.352 1.00 11.44 H new ATOM 0 HD3 LYS A 94 11.633 5.179 5.255 1.00 11.44 H new ATOM 0 HE2 LYS A 94 10.710 5.587 7.524 1.00 41.22 H new ATOM 0 HE3 LYS A 94 11.327 7.057 6.796 1.00 41.22 H new ATOM 0 HZ1 LYS A 94 9.075 7.150 7.952 1.00 30.51 H new ATOM 0 HZ2 LYS A 94 9.190 7.870 6.418 1.00 30.51 H new ATOM 0 HZ3 LYS A 94 8.457 6.348 6.589 1.00 30.51 H new ATOM 1610 N ARG A 95 11.979 8.753 1.753 1.00 53.34 N ATOM 1611 CA ARG A 95 12.393 10.153 2.018 1.00 44.45 C ATOM 1612 C ARG A 95 11.836 11.126 0.961 1.00 61.03 C ATOM 1613 O ARG A 95 11.651 12.320 1.245 1.00 73.21 O ATOM 1614 CB ARG A 95 13.933 10.289 2.134 1.00 11.32 C ATOM 1615 CG ARG A 95 14.725 10.049 0.830 1.00 31.20 C ATOM 1616 CD ARG A 95 16.246 10.126 1.029 1.00 61.24 C ATOM 1617 NE ARG A 95 16.696 11.467 1.438 1.00 61.33 N ATOM 1618 CZ ARG A 95 17.970 11.803 1.711 1.00 53.04 C ATOM 1619 NH1 ARG A 95 18.955 10.903 1.628 1.00 34.10 N ATOM 1620 NH2 ARG A 95 18.251 13.047 2.073 1.00 43.05 N ATOM 0 H ARG A 95 12.746 8.138 1.480 1.00 53.34 H new ATOM 0 HA ARG A 95 11.963 10.427 2.981 1.00 44.45 H new ATOM 0 HB2 ARG A 95 14.165 11.289 2.500 1.00 11.32 H new ATOM 0 HB3 ARG A 95 14.286 9.585 2.887 1.00 11.32 H new ATOM 0 HG2 ARG A 95 14.466 9.069 0.429 1.00 31.20 H new ATOM 0 HG3 ARG A 95 14.423 10.787 0.087 1.00 31.20 H new ATOM 0 HD2 ARG A 95 16.547 9.400 1.784 1.00 61.24 H new ATOM 0 HD3 ARG A 95 16.745 9.847 0.101 1.00 61.24 H new ATOM 0 HE ARG A 95 15.988 12.197 1.521 1.00 61.33 H new ATOM 0 HH11 ARG A 95 18.747 9.943 1.354 1.00 34.10 H new ATOM 0 HH12 ARG A 95 19.915 11.176 1.839 1.00 34.10 H new ATOM 0 HH21 ARG A 95 17.505 13.739 2.142 1.00 43.05 H new ATOM 0 HH22 ARG A 95 19.213 13.312 2.282 1.00 43.05 H new ATOM 1634 N LYS A 96 11.570 10.607 -0.257 1.00 11.42 N ATOM 1635 CA LYS A 96 10.839 11.361 -1.289 1.00 51.43 C ATOM 1636 C LYS A 96 9.397 11.586 -0.827 1.00 11.25 C ATOM 1637 O LYS A 96 8.909 12.703 -0.855 1.00 2.12 O ATOM 1638 CB LYS A 96 10.853 10.629 -2.663 1.00 11.34 C ATOM 1639 CG LYS A 96 12.219 10.561 -3.395 1.00 73.11 C ATOM 1640 CD LYS A 96 12.761 11.942 -3.875 1.00 20.13 C ATOM 1641 CE LYS A 96 13.649 12.662 -2.841 1.00 53.01 C ATOM 1642 NZ LYS A 96 14.898 11.905 -2.547 1.00 2.23 N ATOM 0 H LYS A 96 11.852 9.670 -0.546 1.00 11.42 H new ATOM 0 HA LYS A 96 11.340 12.319 -1.427 1.00 51.43 H new ATOM 0 HB2 LYS A 96 10.496 9.610 -2.511 1.00 11.34 H new ATOM 0 HB3 LYS A 96 10.137 11.123 -3.320 1.00 11.34 H new ATOM 0 HG2 LYS A 96 12.953 10.108 -2.728 1.00 73.11 H new ATOM 0 HG3 LYS A 96 12.123 9.902 -4.258 1.00 73.11 H new ATOM 0 HD2 LYS A 96 13.333 11.797 -4.792 1.00 20.13 H new ATOM 0 HD3 LYS A 96 11.917 12.585 -4.124 1.00 20.13 H new ATOM 0 HE2 LYS A 96 13.906 13.654 -3.213 1.00 53.01 H new ATOM 0 HE3 LYS A 96 13.087 12.804 -1.918 1.00 53.01 H new ATOM 0 HZ1 LYS A 96 15.553 12.510 -2.012 1.00 2.23 H new ATOM 0 HZ2 LYS A 96 14.668 11.061 -1.984 1.00 2.23 H new ATOM 0 HZ3 LYS A 96 15.346 11.615 -3.439 1.00 2.23 H new ATOM 1656 N ILE A 97 8.756 10.503 -0.359 1.00 60.23 N ATOM 1657 CA ILE A 97 7.350 10.503 0.085 1.00 72.22 C ATOM 1658 C ILE A 97 7.154 11.337 1.383 1.00 64.23 C ATOM 1659 O ILE A 97 6.077 11.901 1.602 1.00 14.14 O ATOM 1660 CB ILE A 97 6.836 9.017 0.241 1.00 54.14 C ATOM 1661 CG1 ILE A 97 6.999 8.231 -1.104 1.00 63.31 C ATOM 1662 CG2 ILE A 97 5.374 8.945 0.720 1.00 62.03 C ATOM 1663 CD1 ILE A 97 6.316 8.858 -2.317 1.00 74.01 C ATOM 0 H ILE A 97 9.204 9.590 -0.277 1.00 60.23 H new ATOM 0 HA ILE A 97 6.744 10.991 -0.678 1.00 72.22 H new ATOM 0 HB ILE A 97 7.454 8.551 1.009 1.00 54.14 H new ATOM 0 HG12 ILE A 97 8.063 8.130 -1.319 1.00 63.31 H new ATOM 0 HG13 ILE A 97 6.605 7.224 -0.967 1.00 63.31 H new ATOM 0 HG21 ILE A 97 5.072 7.902 0.810 1.00 62.03 H new ATOM 0 HG22 ILE A 97 5.284 9.434 1.690 1.00 62.03 H new ATOM 0 HG23 ILE A 97 4.730 9.448 -0.001 1.00 62.03 H new ATOM 0 HD11 ILE A 97 6.490 8.236 -3.195 1.00 74.01 H new ATOM 0 HD12 ILE A 97 5.244 8.933 -2.133 1.00 74.01 H new ATOM 0 HD13 ILE A 97 6.725 9.853 -2.491 1.00 74.01 H new ATOM 1675 N GLU A 98 8.208 11.422 2.223 1.00 70.14 N ATOM 1676 CA GLU A 98 8.283 12.371 3.359 1.00 31.21 C ATOM 1677 C GLU A 98 8.142 13.822 2.851 1.00 61.23 C ATOM 1678 O GLU A 98 7.355 14.610 3.387 1.00 15.32 O ATOM 1679 CB GLU A 98 9.646 12.224 4.096 1.00 50.42 C ATOM 1680 CG GLU A 98 9.903 10.867 4.788 1.00 53.23 C ATOM 1681 CD GLU A 98 9.045 10.616 6.035 1.00 2.05 C ATOM 1682 OE1 GLU A 98 9.057 11.463 6.953 1.00 14.31 O ATOM 1683 OE2 GLU A 98 8.392 9.557 6.131 1.00 64.30 O ATOM 0 H GLU A 98 9.035 10.832 2.133 1.00 70.14 H new ATOM 0 HA GLU A 98 7.470 12.144 4.048 1.00 31.21 H new ATOM 0 HB2 GLU A 98 10.446 12.399 3.376 1.00 50.42 H new ATOM 0 HB3 GLU A 98 9.716 13.011 4.847 1.00 50.42 H new ATOM 0 HG2 GLU A 98 9.721 10.067 4.070 1.00 53.23 H new ATOM 0 HG3 GLU A 98 10.955 10.810 5.069 1.00 53.23 H new ATOM 1690 N SER A 99 8.916 14.135 1.793 1.00 33.13 N ATOM 1691 CA SER A 99 8.937 15.457 1.150 1.00 61.12 C ATOM 1692 C SER A 99 7.621 15.723 0.390 1.00 0.44 C ATOM 1693 O SER A 99 7.178 16.874 0.287 1.00 5.31 O ATOM 1694 CB SER A 99 10.154 15.534 0.200 1.00 61.33 C ATOM 1695 OG SER A 99 10.302 16.819 -0.384 1.00 55.43 O ATOM 0 H SER A 99 9.551 13.466 1.358 1.00 33.13 H new ATOM 0 HA SER A 99 9.028 16.229 1.914 1.00 61.12 H new ATOM 0 HB2 SER A 99 11.059 15.282 0.752 1.00 61.33 H new ATOM 0 HB3 SER A 99 10.044 14.790 -0.589 1.00 61.33 H new ATOM 0 HG SER A 99 11.084 16.822 -0.975 1.00 55.43 H new ATOM 1701 N GLN A 100 6.999 14.637 -0.127 1.00 34.02 N ATOM 1702 CA GLN A 100 5.698 14.693 -0.821 1.00 60.11 C ATOM 1703 C GLN A 100 4.555 14.858 0.198 1.00 45.00 C ATOM 1704 O GLN A 100 3.457 15.277 -0.163 1.00 14.01 O ATOM 1705 CB GLN A 100 5.463 13.422 -1.689 1.00 4.02 C ATOM 1706 CG GLN A 100 6.495 13.192 -2.811 1.00 32.53 C ATOM 1707 CD GLN A 100 6.556 14.317 -3.851 1.00 54.55 C ATOM 1708 OE1 GLN A 100 5.556 14.970 -4.162 1.00 50.12 O ATOM 1709 NE2 GLN A 100 7.737 14.561 -4.389 1.00 74.22 N ATOM 0 H GLN A 100 7.390 13.696 -0.072 1.00 34.02 H new ATOM 0 HA GLN A 100 5.711 15.557 -1.485 1.00 60.11 H new ATOM 0 HB2 GLN A 100 5.461 12.550 -1.035 1.00 4.02 H new ATOM 0 HB3 GLN A 100 4.471 13.486 -2.137 1.00 4.02 H new ATOM 0 HG2 GLN A 100 7.481 13.073 -2.363 1.00 32.53 H new ATOM 0 HG3 GLN A 100 6.261 12.256 -3.318 1.00 32.53 H new ATOM 0 HE21 GLN A 100 8.547 14.006 -4.114 1.00 74.22 H new ATOM 0 HE22 GLN A 100 7.839 15.305 -5.080 1.00 74.22 H new ATOM 1718 N GLY A 101 4.832 14.493 1.466 1.00 54.31 N ATOM 1719 CA GLY A 101 3.916 14.720 2.580 1.00 12.55 C ATOM 1720 C GLY A 101 2.841 13.660 2.707 1.00 61.13 C ATOM 1721 O GLY A 101 1.688 13.980 2.997 1.00 72.01 O ATOM 0 H GLY A 101 5.701 14.033 1.737 1.00 54.31 H new ATOM 0 HA2 GLY A 101 4.488 14.759 3.507 1.00 12.55 H new ATOM 0 HA3 GLY A 101 3.442 15.694 2.457 1.00 12.55 H new ATOM 1725 N TYR A 102 3.211 12.391 2.486 1.00 21.30 N ATOM 1726 CA TYR A 102 2.301 11.245 2.682 1.00 13.10 C ATOM 1727 C TYR A 102 2.820 10.379 3.831 1.00 55.20 C ATOM 1728 O TYR A 102 4.035 10.319 4.062 1.00 21.05 O ATOM 1729 CB TYR A 102 2.184 10.380 1.402 1.00 60.22 C ATOM 1730 CG TYR A 102 1.834 11.148 0.123 1.00 4.03 C ATOM 1731 CD1 TYR A 102 0.684 11.935 0.052 1.00 42.32 C ATOM 1732 CD2 TYR A 102 2.642 11.072 -1.017 1.00 13.34 C ATOM 1733 CE1 TYR A 102 0.359 12.614 -1.102 1.00 11.04 C ATOM 1734 CE2 TYR A 102 2.317 11.753 -2.170 1.00 23.50 C ATOM 1735 CZ TYR A 102 1.175 12.522 -2.208 1.00 11.25 C ATOM 1736 OH TYR A 102 0.850 13.213 -3.352 1.00 72.15 O ATOM 0 H TYR A 102 4.143 12.127 2.168 1.00 21.30 H new ATOM 0 HA TYR A 102 1.311 11.637 2.916 1.00 13.10 H new ATOM 0 HB2 TYR A 102 3.129 9.860 1.247 1.00 60.22 H new ATOM 0 HB3 TYR A 102 1.424 9.617 1.567 1.00 60.22 H new ATOM 0 HD1 TYR A 102 0.039 12.013 0.915 1.00 42.32 H new ATOM 0 HD2 TYR A 102 3.537 10.468 -0.993 1.00 13.34 H new ATOM 0 HE1 TYR A 102 -0.535 13.218 -1.139 1.00 11.04 H new ATOM 0 HE2 TYR A 102 2.954 11.684 -3.039 1.00 23.50 H new ATOM 0 HH TYR A 102 1.630 13.718 -3.662 1.00 72.15 H new ATOM 1746 N GLU A 103 1.892 9.719 4.543 1.00 43.12 N ATOM 1747 CA GLU A 103 2.216 8.767 5.615 1.00 53.04 C ATOM 1748 C GLU A 103 2.890 7.520 5.007 1.00 34.45 C ATOM 1749 O GLU A 103 2.281 6.825 4.199 1.00 73.51 O ATOM 1750 CB GLU A 103 0.908 8.387 6.371 1.00 43.34 C ATOM 1751 CG GLU A 103 1.059 7.333 7.494 1.00 22.12 C ATOM 1752 CD GLU A 103 1.881 7.821 8.702 1.00 41.34 C ATOM 1753 OE1 GLU A 103 1.310 8.497 9.586 1.00 73.04 O ATOM 1754 OE2 GLU A 103 3.097 7.537 8.772 1.00 73.24 O ATOM 0 H GLU A 103 0.890 9.833 4.389 1.00 43.12 H new ATOM 0 HA GLU A 103 2.909 9.217 6.325 1.00 53.04 H new ATOM 0 HB2 GLU A 103 0.485 9.293 6.804 1.00 43.34 H new ATOM 0 HB3 GLU A 103 0.186 8.014 5.644 1.00 43.34 H new ATOM 0 HG2 GLU A 103 0.068 7.038 7.837 1.00 22.12 H new ATOM 0 HG3 GLU A 103 1.532 6.442 7.081 1.00 22.12 H new ATOM 1761 N VAL A 104 4.161 7.277 5.367 1.00 42.31 N ATOM 1762 CA VAL A 104 4.942 6.131 4.862 1.00 5.41 C ATOM 1763 C VAL A 104 5.744 5.470 5.996 1.00 65.24 C ATOM 1764 O VAL A 104 6.495 6.140 6.713 1.00 11.25 O ATOM 1765 CB VAL A 104 5.883 6.541 3.660 1.00 21.44 C ATOM 1766 CG1 VAL A 104 6.752 7.768 3.990 1.00 73.32 C ATOM 1767 CG2 VAL A 104 6.755 5.350 3.180 1.00 75.21 C ATOM 0 H VAL A 104 4.678 7.869 6.017 1.00 42.31 H new ATOM 0 HA VAL A 104 4.232 5.399 4.477 1.00 5.41 H new ATOM 0 HB VAL A 104 5.227 6.825 2.837 1.00 21.44 H new ATOM 0 HG11 VAL A 104 7.381 8.010 3.133 1.00 73.32 H new ATOM 0 HG12 VAL A 104 6.109 8.618 4.220 1.00 73.32 H new ATOM 0 HG13 VAL A 104 7.382 7.546 4.851 1.00 73.32 H new ATOM 0 HG21 VAL A 104 7.388 5.672 2.353 1.00 75.21 H new ATOM 0 HG22 VAL A 104 7.381 5.003 4.002 1.00 75.21 H new ATOM 0 HG23 VAL A 104 6.109 4.537 2.847 1.00 75.21 H new ATOM 1777 N ARG A 105 5.567 4.149 6.158 1.00 23.40 N ATOM 1778 CA ARG A 105 6.283 3.334 7.153 1.00 3.04 C ATOM 1779 C ARG A 105 7.252 2.392 6.431 1.00 4.43 C ATOM 1780 O ARG A 105 6.930 1.884 5.348 1.00 21.01 O ATOM 1781 CB ARG A 105 5.282 2.503 8.008 1.00 41.25 C ATOM 1782 CG ARG A 105 4.133 3.311 8.648 1.00 72.35 C ATOM 1783 CD ARG A 105 4.608 4.519 9.468 1.00 1.34 C ATOM 1784 NE ARG A 105 5.555 4.147 10.533 1.00 41.02 N ATOM 1785 CZ ARG A 105 6.108 5.008 11.404 1.00 23.22 C ATOM 1786 NH1 ARG A 105 5.822 6.310 11.361 1.00 33.50 N ATOM 1787 NH2 ARG A 105 6.978 4.562 12.296 1.00 35.14 N ATOM 0 H ARG A 105 4.912 3.609 5.593 1.00 23.40 H new ATOM 0 HA ARG A 105 6.836 3.996 7.819 1.00 3.04 H new ATOM 0 HB2 ARG A 105 4.850 1.725 7.378 1.00 41.25 H new ATOM 0 HB3 ARG A 105 5.836 2.001 8.801 1.00 41.25 H new ATOM 0 HG2 ARG A 105 3.463 3.658 7.861 1.00 72.35 H new ATOM 0 HG3 ARG A 105 3.552 2.651 9.293 1.00 72.35 H new ATOM 0 HD2 ARG A 105 5.081 5.241 8.803 1.00 1.34 H new ATOM 0 HD3 ARG A 105 3.744 5.014 9.912 1.00 1.34 H new ATOM 0 HE ARG A 105 5.810 3.163 10.616 1.00 41.02 H new ATOM 0 HH11 ARG A 105 5.174 6.667 10.659 1.00 33.50 H new ATOM 0 HH12 ARG A 105 6.251 6.949 12.030 1.00 33.50 H new ATOM 0 HH21 ARG A 105 7.224 3.572 12.318 1.00 35.14 H new ATOM 0 HH22 ARG A 105 7.403 5.208 12.961 1.00 35.14 H new ATOM 1801 N LYS A 106 8.427 2.146 7.035 1.00 70.43 N ATOM 1802 CA LYS A 106 9.445 1.238 6.480 1.00 12.13 C ATOM 1803 C LYS A 106 9.580 -0.011 7.351 1.00 14.41 C ATOM 1804 O LYS A 106 9.531 0.082 8.584 1.00 21.12 O ATOM 1805 CB LYS A 106 10.833 1.932 6.397 1.00 33.45 C ATOM 1806 CG LYS A 106 11.947 1.065 5.738 1.00 73.55 C ATOM 1807 CD LYS A 106 13.374 1.520 6.104 1.00 11.41 C ATOM 1808 CE LYS A 106 13.642 2.993 5.781 1.00 15.53 C ATOM 1809 NZ LYS A 106 15.014 3.408 6.183 1.00 4.45 N ATOM 0 H LYS A 106 8.698 2.571 7.922 1.00 70.43 H new ATOM 0 HA LYS A 106 9.119 0.962 5.477 1.00 12.13 H new ATOM 0 HB2 LYS A 106 10.729 2.859 5.833 1.00 33.45 H new ATOM 0 HB3 LYS A 106 11.150 2.205 7.403 1.00 33.45 H new ATOM 0 HG2 LYS A 106 11.816 0.026 6.041 1.00 73.55 H new ATOM 0 HG3 LYS A 106 11.830 1.098 4.655 1.00 73.55 H new ATOM 0 HD2 LYS A 106 13.539 1.353 7.168 1.00 11.41 H new ATOM 0 HD3 LYS A 106 14.094 0.901 5.568 1.00 11.41 H new ATOM 0 HE2 LYS A 106 13.511 3.160 4.712 1.00 15.53 H new ATOM 0 HE3 LYS A 106 12.909 3.616 6.293 1.00 15.53 H new ATOM 0 HZ1 LYS A 106 15.174 4.396 5.902 1.00 4.45 H new ATOM 0 HZ2 LYS A 106 15.115 3.321 7.214 1.00 4.45 H new ATOM 0 HZ3 LYS A 106 15.713 2.797 5.714 1.00 4.45 H new ATOM 1823 N VAL A 107 9.768 -1.168 6.692 1.00 64.41 N ATOM 1824 CA VAL A 107 10.170 -2.429 7.336 1.00 63.35 C ATOM 1825 C VAL A 107 11.098 -3.205 6.379 1.00 35.51 C ATOM 1826 O VAL A 107 10.768 -3.412 5.212 1.00 61.33 O ATOM 1827 CB VAL A 107 8.940 -3.335 7.749 1.00 52.11 C ATOM 1828 CG1 VAL A 107 8.207 -2.782 8.990 1.00 41.14 C ATOM 1829 CG2 VAL A 107 7.961 -3.503 6.575 1.00 32.11 C ATOM 0 H VAL A 107 9.643 -1.254 5.683 1.00 64.41 H new ATOM 0 HA VAL A 107 10.690 -2.175 8.260 1.00 63.35 H new ATOM 0 HB VAL A 107 9.339 -4.315 8.012 1.00 52.11 H new ATOM 0 HG11 VAL A 107 7.370 -3.434 9.239 1.00 41.14 H new ATOM 0 HG12 VAL A 107 8.898 -2.741 9.832 1.00 41.14 H new ATOM 0 HG13 VAL A 107 7.835 -1.780 8.776 1.00 41.14 H new ATOM 0 HG21 VAL A 107 7.125 -4.130 6.885 1.00 32.11 H new ATOM 0 HG22 VAL A 107 7.588 -2.525 6.270 1.00 32.11 H new ATOM 0 HG23 VAL A 107 8.475 -3.973 5.737 1.00 32.11 H new ATOM 1839 N THR A 108 12.287 -3.571 6.866 1.00 1.44 N ATOM 1840 CA THR A 108 13.214 -4.455 6.136 1.00 62.22 C ATOM 1841 C THR A 108 12.738 -5.924 6.258 1.00 62.13 C ATOM 1842 O THR A 108 12.931 -6.744 5.352 1.00 44.42 O ATOM 1843 CB THR A 108 14.679 -4.297 6.673 1.00 35.42 C ATOM 1844 OG1 THR A 108 15.044 -2.899 6.703 1.00 55.10 O ATOM 1845 CG2 THR A 108 15.706 -5.063 5.812 1.00 64.21 C ATOM 0 H THR A 108 12.638 -3.267 7.774 1.00 1.44 H new ATOM 0 HA THR A 108 13.216 -4.170 5.084 1.00 62.22 H new ATOM 0 HB THR A 108 14.698 -4.720 7.677 1.00 35.42 H new ATOM 0 HG1 THR A 108 15.959 -2.807 7.041 1.00 55.10 H new ATOM 0 HG21 THR A 108 16.705 -4.922 6.225 1.00 64.21 H new ATOM 0 HG22 THR A 108 15.460 -6.125 5.811 1.00 64.21 H new ATOM 0 HG23 THR A 108 15.679 -4.684 4.790 1.00 64.21 H new ATOM 1853 N ASP A 109 12.072 -6.214 7.392 1.00 40.32 N ATOM 1854 CA ASP A 109 11.547 -7.552 7.719 1.00 14.13 C ATOM 1855 C ASP A 109 10.179 -7.763 7.053 1.00 52.10 C ATOM 1856 O ASP A 109 9.317 -6.874 7.094 1.00 32.11 O ATOM 1857 CB ASP A 109 11.384 -7.724 9.250 1.00 15.41 C ATOM 1858 CG ASP A 109 12.676 -7.510 10.047 1.00 14.31 C ATOM 1859 OD1 ASP A 109 13.062 -6.346 10.264 1.00 54.52 O ATOM 1860 OD2 ASP A 109 13.307 -8.500 10.467 1.00 42.43 O ATOM 0 H ASP A 109 11.882 -5.519 8.113 1.00 40.32 H new ATOM 0 HA ASP A 109 12.261 -8.288 7.348 1.00 14.13 H new ATOM 0 HB2 ASP A 109 10.630 -7.021 9.605 1.00 15.41 H new ATOM 0 HB3 ASP A 109 11.006 -8.726 9.454 1.00 15.41 H new ATOM 1865 N ASP A 110 9.996 -8.948 6.466 1.00 41.33 N ATOM 1866 CA ASP A 110 8.725 -9.378 5.853 1.00 51.34 C ATOM 1867 C ASP A 110 7.643 -9.640 6.927 1.00 11.41 C ATOM 1868 O ASP A 110 6.455 -9.375 6.713 1.00 42.15 O ATOM 1869 CB ASP A 110 8.959 -10.664 5.021 1.00 10.01 C ATOM 1870 CG ASP A 110 10.017 -10.499 3.915 1.00 70.12 C ATOM 1871 OD1 ASP A 110 11.224 -10.502 4.233 1.00 34.41 O ATOM 1872 OD2 ASP A 110 9.649 -10.374 2.730 1.00 20.21 O ATOM 0 H ASP A 110 10.733 -9.650 6.399 1.00 41.33 H new ATOM 0 HA ASP A 110 8.371 -8.577 5.205 1.00 51.34 H new ATOM 0 HB2 ASP A 110 9.267 -11.468 5.689 1.00 10.01 H new ATOM 0 HB3 ASP A 110 8.016 -10.970 4.567 1.00 10.01 H new ATOM 1877 N GLU A 111 8.077 -10.164 8.090 1.00 25.55 N ATOM 1878 CA GLU A 111 7.182 -10.477 9.224 1.00 3.31 C ATOM 1879 C GLU A 111 6.641 -9.189 9.877 1.00 62.51 C ATOM 1880 O GLU A 111 5.486 -9.140 10.321 1.00 20.22 O ATOM 1881 CB GLU A 111 7.930 -11.368 10.259 1.00 24.33 C ATOM 1882 CG GLU A 111 9.187 -10.727 10.893 1.00 73.22 C ATOM 1883 CD GLU A 111 10.003 -11.713 11.749 1.00 30.11 C ATOM 1884 OE1 GLU A 111 9.675 -11.899 12.940 1.00 10.44 O ATOM 1885 OE2 GLU A 111 10.966 -12.314 11.227 1.00 11.11 O ATOM 0 H GLU A 111 9.057 -10.382 8.271 1.00 25.55 H new ATOM 0 HA GLU A 111 6.322 -11.032 8.849 1.00 3.31 H new ATOM 0 HB2 GLU A 111 7.235 -11.632 11.056 1.00 24.33 H new ATOM 0 HB3 GLU A 111 8.223 -12.297 9.770 1.00 24.33 H new ATOM 0 HG2 GLU A 111 9.823 -10.330 10.102 1.00 73.22 H new ATOM 0 HG3 GLU A 111 8.884 -9.883 11.512 1.00 73.22 H new ATOM 1892 N GLU A 112 7.481 -8.138 9.901 1.00 63.11 N ATOM 1893 CA GLU A 112 7.108 -6.819 10.441 1.00 33.15 C ATOM 1894 C GLU A 112 6.172 -6.070 9.476 1.00 25.41 C ATOM 1895 O GLU A 112 5.417 -5.188 9.906 1.00 74.34 O ATOM 1896 CB GLU A 112 8.372 -5.991 10.767 1.00 25.52 C ATOM 1897 CG GLU A 112 9.251 -6.595 11.883 1.00 51.22 C ATOM 1898 CD GLU A 112 8.504 -6.785 13.214 1.00 33.32 C ATOM 1899 OE1 GLU A 112 8.305 -5.783 13.936 1.00 50.23 O ATOM 1900 OE2 GLU A 112 8.093 -7.930 13.531 1.00 21.35 O ATOM 0 H GLU A 112 8.437 -8.180 9.547 1.00 63.11 H new ATOM 0 HA GLU A 112 6.559 -6.970 11.370 1.00 33.15 H new ATOM 0 HB2 GLU A 112 8.971 -5.891 9.862 1.00 25.52 H new ATOM 0 HB3 GLU A 112 8.069 -4.986 11.062 1.00 25.52 H new ATOM 0 HG2 GLU A 112 9.636 -7.559 11.550 1.00 51.22 H new ATOM 0 HG3 GLU A 112 10.112 -5.947 12.048 1.00 51.22 H new ATOM 1907 N ALA A 113 6.234 -6.430 8.177 1.00 71.13 N ATOM 1908 CA ALA A 113 5.278 -5.946 7.165 1.00 72.12 C ATOM 1909 C ALA A 113 3.865 -6.440 7.489 1.00 42.44 C ATOM 1910 O ALA A 113 2.910 -5.668 7.443 1.00 51.21 O ATOM 1911 CB ALA A 113 5.704 -6.386 5.759 1.00 74.42 C ATOM 0 H ALA A 113 6.944 -7.060 7.804 1.00 71.13 H new ATOM 0 HA ALA A 113 5.274 -4.856 7.187 1.00 72.12 H new ATOM 0 HB1 ALA A 113 4.984 -6.018 5.029 1.00 74.42 H new ATOM 0 HB2 ALA A 113 6.690 -5.979 5.534 1.00 74.42 H new ATOM 0 HB3 ALA A 113 5.742 -7.474 5.714 1.00 74.42 H new ATOM 1917 N LEU A 114 3.766 -7.730 7.882 1.00 60.51 N ATOM 1918 CA LEU A 114 2.501 -8.339 8.322 1.00 13.41 C ATOM 1919 C LEU A 114 1.977 -7.616 9.575 1.00 73.13 C ATOM 1920 O LEU A 114 0.790 -7.329 9.674 1.00 14.52 O ATOM 1921 CB LEU A 114 2.694 -9.852 8.633 1.00 13.23 C ATOM 1922 CG LEU A 114 2.994 -10.785 7.423 1.00 33.54 C ATOM 1923 CD1 LEU A 114 3.331 -12.217 7.897 1.00 1.24 C ATOM 1924 CD2 LEU A 114 1.817 -10.794 6.422 1.00 63.00 C ATOM 0 H LEU A 114 4.559 -8.371 7.901 1.00 60.51 H new ATOM 0 HA LEU A 114 1.775 -8.240 7.515 1.00 13.41 H new ATOM 0 HB2 LEU A 114 3.511 -9.950 9.348 1.00 13.23 H new ATOM 0 HB3 LEU A 114 1.792 -10.215 9.127 1.00 13.23 H new ATOM 0 HG LEU A 114 3.868 -10.390 6.906 1.00 33.54 H new ATOM 0 HD11 LEU A 114 3.536 -12.848 7.032 1.00 1.24 H new ATOM 0 HD12 LEU A 114 4.209 -12.189 8.543 1.00 1.24 H new ATOM 0 HD13 LEU A 114 2.486 -12.625 8.451 1.00 1.24 H new ATOM 0 HD21 LEU A 114 2.054 -11.454 5.587 1.00 63.00 H new ATOM 0 HD22 LEU A 114 0.917 -11.151 6.922 1.00 63.00 H new ATOM 0 HD23 LEU A 114 1.649 -9.784 6.049 1.00 63.00 H new ATOM 1936 N LYS A 115 2.898 -7.306 10.511 1.00 3.24 N ATOM 1937 CA LYS A 115 2.560 -6.680 11.804 1.00 70.43 C ATOM 1938 C LYS A 115 1.838 -5.325 11.603 1.00 63.44 C ATOM 1939 O LYS A 115 0.771 -5.110 12.180 1.00 22.44 O ATOM 1940 CB LYS A 115 3.834 -6.505 12.672 1.00 14.32 C ATOM 1941 CG LYS A 115 3.583 -5.855 14.058 1.00 2.23 C ATOM 1942 CD LYS A 115 4.862 -5.770 14.924 1.00 41.44 C ATOM 1943 CE LYS A 115 5.371 -7.143 15.386 1.00 41.13 C ATOM 1944 NZ LYS A 115 6.648 -7.040 16.146 1.00 73.05 N ATOM 0 H LYS A 115 3.895 -7.483 10.391 1.00 3.24 H new ATOM 0 HA LYS A 115 1.873 -7.343 12.329 1.00 70.43 H new ATOM 0 HB2 LYS A 115 4.294 -7.482 12.821 1.00 14.32 H new ATOM 0 HB3 LYS A 115 4.551 -5.895 12.123 1.00 14.32 H new ATOM 0 HG2 LYS A 115 3.179 -4.852 13.916 1.00 2.23 H new ATOM 0 HG3 LYS A 115 2.827 -6.430 14.592 1.00 2.23 H new ATOM 0 HD2 LYS A 115 5.646 -5.272 14.354 1.00 41.44 H new ATOM 0 HD3 LYS A 115 4.661 -5.151 15.798 1.00 41.44 H new ATOM 0 HE2 LYS A 115 4.615 -7.618 16.011 1.00 41.13 H new ATOM 0 HE3 LYS A 115 5.517 -7.786 14.518 1.00 41.13 H new ATOM 0 HZ1 LYS A 115 6.991 -7.994 16.380 1.00 73.05 H new ATOM 0 HZ2 LYS A 115 7.358 -6.549 15.566 1.00 73.05 H new ATOM 0 HZ3 LYS A 115 6.488 -6.505 17.023 1.00 73.05 H new ATOM 1958 N ILE A 116 2.407 -4.460 10.734 1.00 14.31 N ATOM 1959 CA ILE A 116 1.859 -3.108 10.461 1.00 52.44 C ATOM 1960 C ILE A 116 0.549 -3.179 9.632 1.00 13.25 C ATOM 1961 O ILE A 116 -0.289 -2.276 9.718 1.00 21.15 O ATOM 1962 CB ILE A 116 2.938 -2.164 9.788 1.00 61.33 C ATOM 1963 CG1 ILE A 116 4.185 -2.024 10.728 1.00 53.21 C ATOM 1964 CG2 ILE A 116 2.355 -0.767 9.433 1.00 34.41 C ATOM 1965 CD1 ILE A 116 5.251 -1.044 10.258 1.00 1.44 C ATOM 0 H ILE A 116 3.252 -4.675 10.205 1.00 14.31 H new ATOM 0 HA ILE A 116 1.603 -2.661 11.422 1.00 52.44 H new ATOM 0 HB ILE A 116 3.245 -2.626 8.850 1.00 61.33 H new ATOM 0 HG12 ILE A 116 3.842 -1.715 11.715 1.00 53.21 H new ATOM 0 HG13 ILE A 116 4.644 -3.006 10.843 1.00 53.21 H new ATOM 0 HG21 ILE A 116 3.131 -0.155 8.974 1.00 34.41 H new ATOM 0 HG22 ILE A 116 1.526 -0.885 8.735 1.00 34.41 H new ATOM 0 HG23 ILE A 116 1.998 -0.280 10.341 1.00 34.41 H new ATOM 0 HD11 ILE A 116 6.069 -1.023 10.979 1.00 1.44 H new ATOM 0 HD12 ILE A 116 5.632 -1.359 9.286 1.00 1.44 H new ATOM 0 HD13 ILE A 116 4.817 -0.048 10.172 1.00 1.44 H new ATOM 1977 N VAL A 117 0.369 -4.265 8.849 1.00 1.44 N ATOM 1978 CA VAL A 117 -0.914 -4.552 8.164 1.00 41.31 C ATOM 1979 C VAL A 117 -2.055 -4.689 9.206 1.00 0.20 C ATOM 1980 O VAL A 117 -3.107 -4.051 9.069 1.00 74.22 O ATOM 1981 CB VAL A 117 -0.822 -5.848 7.258 1.00 22.33 C ATOM 1982 CG1 VAL A 117 -2.216 -6.359 6.823 1.00 24.41 C ATOM 1983 CG2 VAL A 117 0.074 -5.600 6.020 1.00 24.41 C ATOM 0 H VAL A 117 1.096 -4.959 8.674 1.00 1.44 H new ATOM 0 HA VAL A 117 -1.135 -3.714 7.503 1.00 41.31 H new ATOM 0 HB VAL A 117 -0.365 -6.626 7.869 1.00 22.33 H new ATOM 0 HG11 VAL A 117 -2.100 -7.249 6.204 1.00 24.41 H new ATOM 0 HG12 VAL A 117 -2.805 -6.606 7.706 1.00 24.41 H new ATOM 0 HG13 VAL A 117 -2.726 -5.583 6.252 1.00 24.41 H new ATOM 0 HG21 VAL A 117 0.119 -6.506 5.416 1.00 24.41 H new ATOM 0 HG22 VAL A 117 -0.344 -4.788 5.425 1.00 24.41 H new ATOM 0 HG23 VAL A 117 1.079 -5.331 6.346 1.00 24.41 H new ATOM 1993 N ARG A 118 -1.814 -5.498 10.264 1.00 14.44 N ATOM 1994 CA ARG A 118 -2.799 -5.686 11.358 1.00 44.21 C ATOM 1995 C ARG A 118 -2.943 -4.397 12.192 1.00 31.21 C ATOM 1996 O ARG A 118 -4.039 -4.080 12.654 1.00 31.34 O ATOM 1997 CB ARG A 118 -2.437 -6.875 12.302 1.00 75.44 C ATOM 1998 CG ARG A 118 -2.691 -8.305 11.745 1.00 50.12 C ATOM 1999 CD ARG A 118 -1.755 -8.717 10.593 1.00 13.33 C ATOM 2000 NE ARG A 118 -1.511 -10.177 10.531 1.00 51.35 N ATOM 2001 CZ ARG A 118 -0.342 -10.778 10.835 1.00 0.41 C ATOM 2002 NH1 ARG A 118 0.701 -10.068 11.243 1.00 61.23 N ATOM 2003 NH2 ARG A 118 -0.224 -12.094 10.741 1.00 70.21 N ATOM 0 H ARG A 118 -0.951 -6.029 10.384 1.00 14.44 H new ATOM 0 HA ARG A 118 -3.747 -5.923 10.875 1.00 44.21 H new ATOM 0 HB2 ARG A 118 -1.382 -6.793 12.564 1.00 75.44 H new ATOM 0 HB3 ARG A 118 -3.005 -6.763 13.226 1.00 75.44 H new ATOM 0 HG2 ARG A 118 -2.583 -9.023 12.558 1.00 50.12 H new ATOM 0 HG3 ARG A 118 -3.723 -8.368 11.399 1.00 50.12 H new ATOM 0 HD2 ARG A 118 -2.186 -8.387 9.648 1.00 13.33 H new ATOM 0 HD3 ARG A 118 -0.802 -8.201 10.706 1.00 13.33 H new ATOM 0 HE ARG A 118 -2.285 -10.772 10.236 1.00 51.35 H new ATOM 0 HH11 ARG A 118 0.625 -9.055 11.330 1.00 61.23 H new ATOM 0 HH12 ARG A 118 1.579 -10.535 11.470 1.00 61.23 H new ATOM 0 HH21 ARG A 118 -1.019 -12.657 10.438 1.00 70.21 H new ATOM 0 HH22 ARG A 118 0.662 -12.544 10.972 1.00 70.21 H new ATOM 2017 N GLU A 119 -1.822 -3.680 12.403 1.00 41.21 N ATOM 2018 CA GLU A 119 -1.829 -2.379 13.102 1.00 14.31 C ATOM 2019 C GLU A 119 -2.691 -1.350 12.367 1.00 53.51 C ATOM 2020 O GLU A 119 -3.407 -0.604 13.016 1.00 32.52 O ATOM 2021 CB GLU A 119 -0.393 -1.838 13.315 1.00 60.41 C ATOM 2022 CG GLU A 119 0.436 -2.650 14.326 1.00 11.45 C ATOM 2023 CD GLU A 119 1.820 -2.052 14.592 1.00 41.45 C ATOM 2024 OE1 GLU A 119 1.930 -1.146 15.454 1.00 35.24 O ATOM 2025 OE2 GLU A 119 2.801 -2.484 13.951 1.00 35.53 O ATOM 0 H GLU A 119 -0.896 -3.981 12.098 1.00 41.21 H new ATOM 0 HA GLU A 119 -2.272 -2.548 14.083 1.00 14.31 H new ATOM 0 HB2 GLU A 119 0.127 -1.829 12.357 1.00 60.41 H new ATOM 0 HB3 GLU A 119 -0.452 -0.804 13.655 1.00 60.41 H new ATOM 0 HG2 GLU A 119 -0.112 -2.714 15.266 1.00 11.45 H new ATOM 0 HG3 GLU A 119 0.553 -3.668 13.955 1.00 11.45 H new ATOM 2032 N PHE A 120 -2.665 -1.354 11.018 1.00 42.05 N ATOM 2033 CA PHE A 120 -3.463 -0.411 10.205 1.00 60.13 C ATOM 2034 C PHE A 120 -4.962 -0.529 10.535 1.00 23.32 C ATOM 2035 O PHE A 120 -5.678 0.455 10.485 1.00 55.32 O ATOM 2036 CB PHE A 120 -3.232 -0.636 8.689 1.00 53.40 C ATOM 2037 CG PHE A 120 -4.038 0.312 7.794 1.00 64.42 C ATOM 2038 CD1 PHE A 120 -3.622 1.630 7.594 1.00 75.23 C ATOM 2039 CD2 PHE A 120 -5.224 -0.106 7.172 1.00 21.52 C ATOM 2040 CE1 PHE A 120 -4.355 2.493 6.802 1.00 72.14 C ATOM 2041 CE2 PHE A 120 -5.956 0.763 6.384 1.00 24.11 C ATOM 2042 CZ PHE A 120 -5.519 2.059 6.196 1.00 3.44 C ATOM 0 H PHE A 120 -2.099 -2.000 10.468 1.00 42.05 H new ATOM 0 HA PHE A 120 -3.129 0.596 10.456 1.00 60.13 H new ATOM 0 HB2 PHE A 120 -2.171 -0.513 8.470 1.00 53.40 H new ATOM 0 HB3 PHE A 120 -3.492 -1.665 8.440 1.00 53.40 H new ATOM 0 HD1 PHE A 120 -2.715 1.980 8.065 1.00 75.23 H new ATOM 0 HD2 PHE A 120 -5.570 -1.120 7.310 1.00 21.52 H new ATOM 0 HE1 PHE A 120 -4.018 3.509 6.656 1.00 72.14 H new ATOM 0 HE2 PHE A 120 -6.870 0.428 5.916 1.00 24.11 H new ATOM 0 HZ PHE A 120 -6.088 2.735 5.574 1.00 3.44 H new ATOM 2052 N MET A 121 -5.397 -1.736 10.905 1.00 1.32 N ATOM 2053 CA MET A 121 -6.809 -2.015 11.225 1.00 51.25 C ATOM 2054 C MET A 121 -7.299 -1.188 12.453 1.00 54.41 C ATOM 2055 O MET A 121 -8.494 -0.907 12.572 1.00 62.04 O ATOM 2056 CB MET A 121 -7.020 -3.538 11.442 1.00 5.04 C ATOM 2057 CG MET A 121 -6.372 -4.434 10.361 1.00 12.04 C ATOM 2058 SD MET A 121 -6.835 -3.968 8.678 1.00 20.13 S ATOM 2059 CE MET A 121 -5.899 -5.134 7.682 1.00 30.03 C ATOM 0 H MET A 121 -4.787 -2.549 10.993 1.00 1.32 H new ATOM 0 HA MET A 121 -7.416 -1.702 10.375 1.00 51.25 H new ATOM 0 HB2 MET A 121 -6.614 -3.813 12.416 1.00 5.04 H new ATOM 0 HB3 MET A 121 -8.090 -3.743 11.473 1.00 5.04 H new ATOM 0 HG2 MET A 121 -5.288 -4.384 10.459 1.00 12.04 H new ATOM 0 HG3 MET A 121 -6.661 -5.470 10.536 1.00 12.04 H new ATOM 0 HE1 MET A 121 -5.531 -4.634 6.786 1.00 30.03 H new ATOM 0 HE2 MET A 121 -5.055 -5.511 8.260 1.00 30.03 H new ATOM 0 HE3 MET A 121 -6.542 -5.966 7.395 1.00 30.03 H new ATOM 2069 N GLN A 122 -6.364 -0.814 13.366 1.00 4.55 N ATOM 2070 CA GLN A 122 -6.656 0.100 14.509 1.00 42.24 C ATOM 2071 C GLN A 122 -6.182 1.553 14.227 1.00 23.54 C ATOM 2072 O GLN A 122 -6.782 2.513 14.730 1.00 50.10 O ATOM 2073 CB GLN A 122 -6.034 -0.442 15.830 1.00 20.04 C ATOM 2074 CG GLN A 122 -4.500 -0.541 15.860 1.00 45.20 C ATOM 2075 CD GLN A 122 -3.938 -1.089 17.178 1.00 61.14 C ATOM 2076 OE1 GLN A 122 -3.775 -2.298 17.345 1.00 55.23 O ATOM 2077 NE2 GLN A 122 -3.651 -0.208 18.129 1.00 44.34 N ATOM 0 H GLN A 122 -5.395 -1.132 13.334 1.00 4.55 H new ATOM 0 HA GLN A 122 -7.739 0.131 14.628 1.00 42.24 H new ATOM 0 HB2 GLN A 122 -6.353 0.202 16.650 1.00 20.04 H new ATOM 0 HB3 GLN A 122 -6.446 -1.432 16.023 1.00 20.04 H new ATOM 0 HG2 GLN A 122 -4.171 -1.182 15.042 1.00 45.20 H new ATOM 0 HG3 GLN A 122 -4.078 0.448 15.680 1.00 45.20 H new ATOM 0 HE21 GLN A 122 -3.796 0.788 17.962 1.00 44.34 H new ATOM 0 HE22 GLN A 122 -3.285 -0.527 19.026 1.00 44.34 H new ATOM 2086 N LYS A 123 -5.107 1.705 13.412 1.00 42.43 N ATOM 2087 CA LYS A 123 -4.505 3.027 13.084 1.00 2.11 C ATOM 2088 C LYS A 123 -5.405 3.812 12.117 1.00 70.21 C ATOM 2089 O LYS A 123 -5.382 5.047 12.105 1.00 65.52 O ATOM 2090 CB LYS A 123 -3.083 2.868 12.459 1.00 52.52 C ATOM 2091 CG LYS A 123 -2.046 2.143 13.347 1.00 44.22 C ATOM 2092 CD LYS A 123 -1.676 2.884 14.654 1.00 63.43 C ATOM 2093 CE LYS A 123 -0.870 4.170 14.399 1.00 43.02 C ATOM 2094 NZ LYS A 123 -0.361 4.755 15.667 1.00 42.45 N ATOM 0 H LYS A 123 -4.634 0.920 12.965 1.00 42.43 H new ATOM 0 HA LYS A 123 -4.413 3.580 14.019 1.00 2.11 H new ATOM 0 HB2 LYS A 123 -3.176 2.323 11.520 1.00 52.52 H new ATOM 0 HB3 LYS A 123 -2.699 3.859 12.216 1.00 52.52 H new ATOM 0 HG2 LYS A 123 -2.434 1.157 13.603 1.00 44.22 H new ATOM 0 HG3 LYS A 123 -1.137 1.987 12.766 1.00 44.22 H new ATOM 0 HD2 LYS A 123 -2.588 3.133 15.196 1.00 63.43 H new ATOM 0 HD3 LYS A 123 -1.097 2.218 15.293 1.00 63.43 H new ATOM 0 HE2 LYS A 123 -0.033 3.950 13.737 1.00 43.02 H new ATOM 0 HE3 LYS A 123 -1.498 4.899 13.887 1.00 43.02 H new ATOM 0 HZ1 LYS A 123 0.177 5.620 15.459 1.00 42.45 H new ATOM 0 HZ2 LYS A 123 -1.162 4.987 16.288 1.00 42.45 H new ATOM 0 HZ3 LYS A 123 0.258 4.068 16.142 1.00 42.45 H new ATOM 2108 N ALA A 124 -6.201 3.073 11.320 1.00 23.31 N ATOM 2109 CA ALA A 124 -7.173 3.640 10.372 1.00 55.52 C ATOM 2110 C ALA A 124 -8.405 4.188 11.111 1.00 23.21 C ATOM 2111 O ALA A 124 -9.268 4.815 10.492 1.00 55.21 O ATOM 2112 CB ALA A 124 -7.590 2.582 9.339 1.00 52.24 C ATOM 0 H ALA A 124 -6.185 2.053 11.318 1.00 23.31 H new ATOM 0 HA ALA A 124 -6.697 4.469 9.849 1.00 55.52 H new ATOM 0 HB1 ALA A 124 -8.309 3.016 8.644 1.00 52.24 H new ATOM 0 HB2 ALA A 124 -6.712 2.245 8.789 1.00 52.24 H new ATOM 0 HB3 ALA A 124 -8.045 1.734 9.850 1.00 52.24 H new ATOM 2118 N GLY A 125 -8.495 3.894 12.433 1.00 65.40 N ATOM 2119 CA GLY A 125 -9.439 4.558 13.324 1.00 14.43 C ATOM 2120 C GLY A 125 -9.146 6.047 13.356 1.00 3.44 C ATOM 2121 O GLY A 125 -8.255 6.481 14.098 1.00 22.21 O ATOM 0 H GLY A 125 -7.914 3.194 12.894 1.00 65.40 H new ATOM 0 HA2 GLY A 125 -10.460 4.385 12.983 1.00 14.43 H new ATOM 0 HA3 GLY A 125 -9.363 4.140 14.328 1.00 14.43 H new ATOM 2125 N SER A 126 -9.861 6.803 12.501 1.00 44.51 N ATOM 2126 CA SER A 126 -9.555 8.199 12.172 1.00 14.14 C ATOM 2127 C SER A 126 -9.748 9.125 13.395 1.00 60.22 C ATOM 2128 O SER A 126 -10.802 9.747 13.574 1.00 13.31 O ATOM 2129 CB SER A 126 -10.432 8.641 10.970 1.00 13.00 C ATOM 2130 OG SER A 126 -10.334 7.716 9.892 1.00 52.23 O ATOM 0 H SER A 126 -10.683 6.449 12.012 1.00 44.51 H new ATOM 0 HA SER A 126 -8.505 8.279 11.890 1.00 14.14 H new ATOM 0 HB2 SER A 126 -11.472 8.725 11.287 1.00 13.00 H new ATOM 0 HB3 SER A 126 -10.120 9.630 10.633 1.00 13.00 H new ATOM 0 HG SER A 126 -10.897 8.018 9.149 1.00 52.23 H new ATOM 2136 N LEU A 127 -8.714 9.166 14.253 1.00 65.13 N ATOM 2137 CA LEU A 127 -8.663 10.038 15.441 1.00 12.20 C ATOM 2138 C LEU A 127 -8.421 11.501 15.013 1.00 22.40 C ATOM 2139 O LEU A 127 -8.271 11.783 13.815 1.00 25.11 O ATOM 2140 CB LEU A 127 -7.553 9.563 16.441 1.00 54.32 C ATOM 2141 CG LEU A 127 -6.042 9.819 16.055 1.00 30.05 C ATOM 2142 CD1 LEU A 127 -5.099 9.433 17.216 1.00 5.21 C ATOM 2143 CD2 LEU A 127 -5.623 9.083 14.760 1.00 2.20 C ATOM 0 H LEU A 127 -7.881 8.589 14.141 1.00 65.13 H new ATOM 0 HA LEU A 127 -9.622 9.976 15.955 1.00 12.20 H new ATOM 0 HB2 LEU A 127 -7.739 10.048 17.399 1.00 54.32 H new ATOM 0 HB3 LEU A 127 -7.680 8.492 16.596 1.00 54.32 H new ATOM 0 HG LEU A 127 -5.952 10.888 15.864 1.00 30.05 H new ATOM 0 HD11 LEU A 127 -4.066 9.619 16.923 1.00 5.21 H new ATOM 0 HD12 LEU A 127 -5.340 10.031 18.095 1.00 5.21 H new ATOM 0 HD13 LEU A 127 -5.225 8.376 17.451 1.00 5.21 H new ATOM 0 HD21 LEU A 127 -4.576 9.295 14.544 1.00 2.20 H new ATOM 0 HD22 LEU A 127 -5.756 8.009 14.892 1.00 2.20 H new ATOM 0 HD23 LEU A 127 -6.242 9.426 13.930 1.00 2.20 H new ATOM 2155 N GLU A 128 -8.397 12.426 15.990 1.00 15.32 N ATOM 2156 CA GLU A 128 -8.070 13.838 15.729 1.00 15.42 C ATOM 2157 C GLU A 128 -6.609 13.946 15.215 1.00 51.41 C ATOM 2158 O GLU A 128 -5.642 13.831 15.978 1.00 12.14 O ATOM 2159 CB GLU A 128 -8.330 14.727 16.984 1.00 41.35 C ATOM 2160 CG GLU A 128 -7.622 14.287 18.281 1.00 64.11 C ATOM 2161 CD GLU A 128 -7.798 15.297 19.427 1.00 43.20 C ATOM 2162 OE1 GLU A 128 -7.062 16.310 19.455 1.00 1.44 O ATOM 2163 OE2 GLU A 128 -8.673 15.095 20.295 1.00 64.15 O ATOM 0 H GLU A 128 -8.601 12.220 16.968 1.00 15.32 H new ATOM 0 HA GLU A 128 -8.731 14.220 14.951 1.00 15.42 H new ATOM 0 HB2 GLU A 128 -8.022 15.747 16.753 1.00 41.35 H new ATOM 0 HB3 GLU A 128 -9.404 14.753 17.170 1.00 41.35 H new ATOM 0 HG2 GLU A 128 -8.013 13.319 18.593 1.00 64.11 H new ATOM 0 HG3 GLU A 128 -6.559 14.152 18.082 1.00 64.11 H new ATOM 2170 N HIS A 129 -6.478 14.063 13.882 1.00 51.52 N ATOM 2171 CA HIS A 129 -5.183 14.132 13.196 1.00 11.25 C ATOM 2172 C HIS A 129 -4.579 15.530 13.358 1.00 25.30 C ATOM 2173 O HIS A 129 -5.129 16.508 12.838 1.00 4.41 O ATOM 2174 CB HIS A 129 -5.337 13.783 11.689 1.00 42.30 C ATOM 2175 CG HIS A 129 -5.875 12.395 11.426 1.00 32.41 C ATOM 2176 ND1 HIS A 129 -7.132 12.153 10.913 1.00 5.23 N ATOM 2177 CD2 HIS A 129 -5.308 11.176 11.589 1.00 64.12 C ATOM 2178 CE1 HIS A 129 -7.309 10.857 10.775 1.00 75.31 C ATOM 2179 NE2 HIS A 129 -6.219 10.248 11.179 1.00 73.12 N ATOM 0 H HIS A 129 -7.276 14.112 13.249 1.00 51.52 H new ATOM 0 HA HIS A 129 -4.513 13.400 13.648 1.00 11.25 H new ATOM 0 HB2 HIS A 129 -6.001 14.512 11.225 1.00 42.30 H new ATOM 0 HB3 HIS A 129 -4.366 13.882 11.204 1.00 42.30 H new ATOM 0 HD2 HIS A 129 -4.318 10.976 11.972 1.00 64.12 H new ATOM 0 HE1 HIS A 129 -8.198 10.377 10.395 1.00 75.31 H new ATOM 0 HE2 HIS A 129 -6.076 9.238 11.185 1.00 73.12 H new ATOM 2188 N HIS A 130 -3.483 15.625 14.130 1.00 71.41 N ATOM 2189 CA HIS A 130 -2.696 16.863 14.239 1.00 62.24 C ATOM 2190 C HIS A 130 -1.938 17.098 12.916 1.00 2.00 C ATOM 2191 O HIS A 130 -0.881 16.508 12.661 1.00 22.24 O ATOM 2192 CB HIS A 130 -1.743 16.838 15.477 1.00 30.44 C ATOM 2193 CG HIS A 130 -0.782 15.674 15.550 1.00 53.23 C ATOM 2194 ND1 HIS A 130 -1.152 14.428 15.993 1.00 40.13 N ATOM 2195 CD2 HIS A 130 0.544 15.584 15.262 1.00 52.40 C ATOM 2196 CE1 HIS A 130 -0.111 13.626 15.970 1.00 24.55 C ATOM 2197 NE2 HIS A 130 0.927 14.301 15.528 1.00 5.21 N ATOM 0 H HIS A 130 -3.121 14.853 14.691 1.00 71.41 H new ATOM 0 HA HIS A 130 -3.370 17.703 14.405 1.00 62.24 H new ATOM 0 HB2 HIS A 130 -1.165 17.762 15.484 1.00 30.44 H new ATOM 0 HB3 HIS A 130 -2.353 16.837 16.380 1.00 30.44 H new ATOM 0 HD2 HIS A 130 1.175 16.378 14.892 1.00 52.40 H new ATOM 0 HE1 HIS A 130 -0.109 12.587 16.265 1.00 24.55 H new ATOM 0 HE2 HIS A 130 1.867 13.926 15.404 1.00 5.21 H new ATOM 2206 N HIS A 131 -2.546 17.912 12.041 1.00 35.11 N ATOM 2207 CA HIS A 131 -2.004 18.210 10.712 1.00 61.04 C ATOM 2208 C HIS A 131 -2.464 19.616 10.284 1.00 63.11 C ATOM 2209 O HIS A 131 -3.395 19.783 9.483 1.00 51.01 O ATOM 2210 CB HIS A 131 -2.439 17.111 9.698 1.00 1.50 C ATOM 2211 CG HIS A 131 -1.762 17.214 8.356 1.00 54.13 C ATOM 2212 ND1 HIS A 131 -2.300 17.908 7.296 1.00 53.34 N ATOM 2213 CD2 HIS A 131 -0.590 16.701 7.910 1.00 15.35 C ATOM 2214 CE1 HIS A 131 -1.492 17.817 6.262 1.00 64.31 C ATOM 2215 NE2 HIS A 131 -0.449 17.093 6.609 1.00 54.10 N ATOM 0 H HIS A 131 -3.430 18.382 12.238 1.00 35.11 H new ATOM 0 HA HIS A 131 -0.914 18.205 10.738 1.00 61.04 H new ATOM 0 HB2 HIS A 131 -2.227 16.131 10.126 1.00 1.50 H new ATOM 0 HB3 HIS A 131 -3.518 17.170 9.555 1.00 1.50 H new ATOM 0 HD2 HIS A 131 0.102 16.096 8.476 1.00 15.35 H new ATOM 0 HE1 HIS A 131 -1.657 18.262 5.292 1.00 64.31 H new ATOM 0 HE2 HIS A 131 0.339 16.862 6.003 1.00 54.10 H new ATOM 2224 N HIS A 132 -1.834 20.627 10.896 1.00 44.24 N ATOM 2225 CA HIS A 132 -2.114 22.056 10.636 1.00 1.21 C ATOM 2226 C HIS A 132 -1.042 22.636 9.685 1.00 35.10 C ATOM 2227 O HIS A 132 -0.392 21.884 8.941 1.00 64.22 O ATOM 2228 CB HIS A 132 -2.148 22.836 11.983 1.00 54.14 C ATOM 2229 CG HIS A 132 -3.286 22.489 12.905 1.00 24.15 C ATOM 2230 ND1 HIS A 132 -4.228 23.414 13.315 1.00 44.22 N ATOM 2231 CD2 HIS A 132 -3.605 21.335 13.538 1.00 33.25 C ATOM 2232 CE1 HIS A 132 -5.067 22.840 14.149 1.00 15.45 C ATOM 2233 NE2 HIS A 132 -4.712 21.587 14.300 1.00 33.32 N ATOM 0 H HIS A 132 -1.106 20.480 11.595 1.00 44.24 H new ATOM 0 HA HIS A 132 -3.087 22.158 10.155 1.00 1.21 H new ATOM 0 HB2 HIS A 132 -1.210 22.658 12.509 1.00 54.14 H new ATOM 0 HB3 HIS A 132 -2.193 23.903 11.764 1.00 54.14 H new ATOM 0 HD2 HIS A 132 -3.083 20.393 13.456 1.00 33.25 H new ATOM 0 HE1 HIS A 132 -5.907 23.320 14.629 1.00 15.45 H new ATOM 0 HE2 HIS A 132 -5.187 20.907 14.893 1.00 33.32 H new ATOM 2242 N HIS A 133 -0.886 23.977 9.704 1.00 42.35 N ATOM 2243 CA HIS A 133 0.113 24.689 8.898 1.00 1.42 C ATOM 2244 C HIS A 133 1.542 24.345 9.366 1.00 40.10 C ATOM 2245 O HIS A 133 1.907 24.616 10.520 1.00 13.13 O ATOM 2246 CB HIS A 133 -0.129 26.216 8.989 1.00 21.30 C ATOM 2247 CG HIS A 133 0.760 27.033 8.087 1.00 64.35 C ATOM 2248 ND1 HIS A 133 1.969 27.557 8.492 1.00 43.13 N ATOM 2249 CD2 HIS A 133 0.605 27.422 6.799 1.00 32.52 C ATOM 2250 CE1 HIS A 133 2.511 28.224 7.498 1.00 51.42 C ATOM 2251 NE2 HIS A 133 1.707 28.155 6.463 1.00 24.20 N ATOM 0 H HIS A 133 -1.455 24.594 10.284 1.00 42.35 H new ATOM 0 HA HIS A 133 0.011 24.372 7.860 1.00 1.42 H new ATOM 0 HB2 HIS A 133 -1.170 26.424 8.741 1.00 21.30 H new ATOM 0 HB3 HIS A 133 0.023 26.537 10.020 1.00 21.30 H new ATOM 0 HD2 HIS A 133 -0.234 27.195 6.157 1.00 32.52 H new ATOM 0 HE1 HIS A 133 3.458 28.742 7.528 1.00 51.42 H new ATOM 0 HE2 HIS A 133 1.878 28.581 5.552 1.00 24.20 H new ATOM 2260 N HIS A 134 2.326 23.728 8.471 1.00 74.05 N ATOM 2261 CA HIS A 134 3.746 23.400 8.724 1.00 32.14 C ATOM 2262 C HIS A 134 4.654 24.569 8.250 1.00 32.14 C ATOM 2263 O HIS A 134 5.656 24.872 8.928 1.00 11.33 O ATOM 2264 CB HIS A 134 4.144 22.062 8.035 1.00 31.13 C ATOM 2265 CG HIS A 134 4.086 22.079 6.529 1.00 44.24 C ATOM 2266 ND1 HIS A 134 5.153 22.454 5.744 1.00 22.22 N ATOM 2267 CD2 HIS A 134 3.085 21.787 5.674 1.00 45.21 C ATOM 2268 CE1 HIS A 134 4.813 22.381 4.478 1.00 25.43 C ATOM 2269 NE2 HIS A 134 3.560 21.982 4.404 1.00 24.11 N ATOM 2270 OXT HIS A 134 4.329 25.208 7.221 1.00 37.70 O ATOM 0 H HIS A 134 1.998 23.440 7.549 1.00 74.05 H new ATOM 0 HA HIS A 134 3.886 23.266 9.797 1.00 32.14 H new ATOM 0 HB2 HIS A 134 5.157 21.800 8.342 1.00 31.13 H new ATOM 0 HB3 HIS A 134 3.486 21.273 8.400 1.00 31.13 H new ATOM 0 HD2 HIS A 134 2.091 21.460 5.941 1.00 45.21 H new ATOM 0 HE1 HIS A 134 5.453 22.610 3.639 1.00 25.43 H new ATOM 0 HE2 HIS A 134 3.031 21.841 3.543 1.00 24.11 H new TER 2279 HIS A 134