USER MOD reduce.3.24.130724 H: found=0, std=0, add=1157, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1157 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 126 SER OG : rot 74:sc= 0.29 USER MOD Set 1.2: A 132 HIS : no HD1:sc= -1.97! K(o=-1.7!,f=0.28) USER MOD Set 2.1: A 62 GLN : amide:sc= 0.33 K(o=0.7,f=-0.6) USER MOD Set 2.2: A 65 LYS NZ :NH3+ -108:sc= 0.367 (180deg=0) USER MOD Set 3.1: A 9 THR OG1 : rot 45:sc= 0.757 USER MOD Set 3.2: A 11 ASN : amide:sc= -0.0643 K(o=0.69,f=-4.8!) USER MOD Set 4.1: A 2 LYS NZ :NH3+ -169:sc= 1.77 (180deg=1.35) USER MOD Set 4.2: A 50 ASN : amide:sc= -0.0288 K(o=1.7,f=-2.1!) USER MOD Single : A 1 MET CE :methyl -142:sc= -0.785 (180deg=-1.86) USER MOD Single : A 1 MET N :NH3+ -136:sc= 0.6 (180deg=-0.163) USER MOD Single : A 8 ASN : amide:sc= -0.663 K(o=-0.66,f=-3.1!) USER MOD Single : A 10 ASN : amide:sc= 0.106 X(o=0.11,f=-0.11) USER MOD Single : A 16 LYS NZ :NH3+ 151:sc= -1.18 (180deg=-2.68!) USER MOD Single : A 17 LYS NZ :NH3+ -166:sc= -0.966 (180deg=-1.19) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 163:sc= 0.0171 (180deg=0.000177) USER MOD Single : A 24 ASN : amide:sc= -0.38 X(o=-0.38,f=-0.09) USER MOD Single : A 25 GLN : amide:sc= -0.17 X(o=-0.17,f=-0.089) USER MOD Single : A 27 TYR OH : rot 60:sc= -0.449 USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 33 ASN : amide:sc= -0.813 K(o=-0.81,f=-4.2!) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ -122:sc= 0.0472 (180deg=-0.0276) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl -136:sc= -1.17 (180deg=-2.82!) USER MOD Single : A 43 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00728) USER MOD Single : A 44 LYS NZ :NH3+ -176:sc=-0.000306 (180deg=-0.0279) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ -161:sc= 0.867 (180deg=0.72) USER MOD Single : A 58 SER OG : rot 180:sc= 0.0516 USER MOD Single : A 59 ASN : amide:sc= -0.0109 K(o=-0.011,f=-1.5) USER MOD Single : A 61 LYS NZ :NH3+ -173:sc= 0.161 (180deg=0.105) USER MOD Single : A 67 MET CE :methyl -121:sc= -0.651 (180deg=-4.44!) 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 76 TYR OH : rot 50:sc= -0.251 USER MOD Single : A 77 LYS NZ :NH3+ 176:sc= -0.947! (180deg=-0.981!) USER MOD Single : A 85 GLN : amide:sc= 0.473 X(o=0.47,f=-0.013) USER MOD Single : A 88 ASN : amide:sc= -0.354 X(o=-0.35,f=0) USER MOD Single : A 94 LYS NZ :NH3+ -112:sc= 1.2 (180deg=-0.158) USER MOD Single : A 96 LYS NZ :NH3+ -172:sc=-0.00268 (180deg=-0.0873) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -1.02 K(o=-1,f=0) USER MOD Single : A 102 TYR OH : rot -126:sc= 0.335 USER MOD Single : A 106 LYS NZ :NH3+ 153:sc= 1.04 (180deg=0.646) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 160:sc= 0.345 (180deg=0.232) USER MOD Single : A 121 MET CE :methyl 174:sc= -0.135 (180deg=-0.318) USER MOD Single : A 122 GLN : amide:sc=-0.00765 X(o=-0.0077,f=-0.0077) USER MOD Single : A 123 LYS NZ :NH3+ -141:sc= 0.829 (180deg=0.157) USER MOD Single : A 129 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 130 HIS : no HD1:sc= 0 X(o=0,f=-0.0086) USER MOD Single : A 131 HIS : no HE2:sc= 0.288 K(o=0.29,f=-1.4) USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 134 HIS : no HE2:sc= 0.254 K(o=0.25,f=-1.7) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.050 10.516 13.058 1.00 61.51 N ATOM 2 CA MET A 1 2.607 10.205 11.723 1.00 64.31 C ATOM 3 C MET A 1 3.077 8.750 11.697 1.00 52.13 C ATOM 4 O MET A 1 3.733 8.309 12.634 1.00 1.12 O ATOM 5 CB MET A 1 3.786 11.161 11.381 1.00 3.11 C ATOM 6 CG MET A 1 4.495 10.850 10.049 1.00 33.45 C ATOM 7 SD MET A 1 3.368 10.925 8.642 1.00 43.11 S ATOM 8 CE MET A 1 4.345 10.193 7.334 1.00 41.11 C ATOM 0 H1 MET A 1 1.166 11.052 12.949 1.00 61.51 H new ATOM 0 H2 MET A 1 1.857 9.631 13.569 1.00 61.51 H new ATOM 0 H3 MET A 1 2.735 11.084 13.596 1.00 61.51 H new ATOM 0 HA MET A 1 1.830 10.348 10.972 1.00 64.31 H new ATOM 0 HB2 MET A 1 3.410 12.184 11.348 1.00 3.11 H new ATOM 0 HB3 MET A 1 4.519 11.117 12.187 1.00 3.11 H new ATOM 0 HG2 MET A 1 5.309 11.559 9.898 1.00 33.45 H new ATOM 0 HG3 MET A 1 4.943 9.858 10.101 1.00 33.45 H new ATOM 0 HE1 MET A 1 4.157 10.722 6.400 1.00 41.11 H new ATOM 0 HE2 MET A 1 5.403 10.266 7.585 1.00 41.11 H new ATOM 0 HE3 MET A 1 4.071 9.144 7.219 1.00 41.11 H new ATOM 20 N LYS A 2 2.755 8.023 10.616 1.00 14.32 N ATOM 21 CA LYS A 2 3.184 6.626 10.433 1.00 72.53 C ATOM 22 C LYS A 2 3.374 6.341 8.929 1.00 52.24 C ATOM 23 O LYS A 2 2.747 6.992 8.084 1.00 42.31 O ATOM 24 CB LYS A 2 2.134 5.651 11.050 1.00 51.14 C ATOM 25 CG LYS A 2 2.615 4.178 11.149 1.00 50.25 C ATOM 26 CD LYS A 2 1.511 3.196 11.581 1.00 3.32 C ATOM 27 CE LYS A 2 0.956 3.473 12.985 1.00 10.42 C ATOM 28 NZ LYS A 2 1.975 3.273 14.051 1.00 22.41 N ATOM 0 H LYS A 2 2.192 8.384 9.846 1.00 14.32 H new ATOM 0 HA LYS A 2 4.133 6.469 10.946 1.00 72.53 H new ATOM 0 HB2 LYS A 2 1.870 6.003 12.047 1.00 51.14 H new ATOM 0 HB3 LYS A 2 1.225 5.685 10.449 1.00 51.14 H new ATOM 0 HG2 LYS A 2 3.007 3.867 10.181 1.00 50.25 H new ATOM 0 HG3 LYS A 2 3.439 4.121 11.860 1.00 50.25 H new ATOM 0 HD2 LYS A 2 0.694 3.242 10.861 1.00 3.32 H new ATOM 0 HD3 LYS A 2 1.907 2.181 11.550 1.00 3.32 H new ATOM 0 HE2 LYS A 2 0.584 4.497 13.030 1.00 10.42 H new ATOM 0 HE3 LYS A 2 0.106 2.817 13.172 1.00 10.42 H new ATOM 0 HZ1 LYS A 2 1.511 3.289 14.982 1.00 22.41 H new ATOM 0 HZ2 LYS A 2 2.445 2.356 13.914 1.00 22.41 H new ATOM 0 HZ3 LYS A 2 2.681 4.035 14.003 1.00 22.41 H new ATOM 42 N ILE A 3 4.254 5.378 8.613 1.00 70.02 N ATOM 43 CA ILE A 3 4.483 4.901 7.244 1.00 34.41 C ATOM 44 C ILE A 3 3.580 3.694 6.972 1.00 1.41 C ATOM 45 O ILE A 3 3.684 2.659 7.645 1.00 10.04 O ATOM 46 CB ILE A 3 5.976 4.459 7.022 1.00 22.12 C ATOM 47 CG1 ILE A 3 6.958 5.633 7.309 1.00 10.13 C ATOM 48 CG2 ILE A 3 6.183 3.887 5.592 1.00 0.10 C ATOM 49 CD1 ILE A 3 8.426 5.252 7.234 1.00 13.32 C ATOM 0 H ILE A 3 4.831 4.905 9.309 1.00 70.02 H new ATOM 0 HA ILE A 3 4.258 5.724 6.565 1.00 34.41 H new ATOM 0 HB ILE A 3 6.198 3.663 7.732 1.00 22.12 H new ATOM 0 HG12 ILE A 3 6.766 6.435 6.596 1.00 10.13 H new ATOM 0 HG13 ILE A 3 6.748 6.032 8.301 1.00 10.13 H new ATOM 0 HG21 ILE A 3 7.224 3.589 5.466 1.00 0.10 H new ATOM 0 HG22 ILE A 3 5.538 3.020 5.450 1.00 0.10 H new ATOM 0 HG23 ILE A 3 5.932 4.650 4.855 1.00 0.10 H new ATOM 0 HD11 ILE A 3 9.040 6.127 7.447 1.00 13.32 H new ATOM 0 HD12 ILE A 3 8.638 4.473 7.967 1.00 13.32 H new ATOM 0 HD13 ILE A 3 8.655 4.882 6.235 1.00 13.32 H new ATOM 61 N LEU A 4 2.656 3.858 6.028 1.00 43.42 N ATOM 62 CA LEU A 4 1.894 2.749 5.436 1.00 51.04 C ATOM 63 C LEU A 4 2.304 2.614 3.978 1.00 64.13 C ATOM 64 O LEU A 4 2.414 3.617 3.270 1.00 63.22 O ATOM 65 CB LEU A 4 0.358 2.980 5.528 1.00 64.00 C ATOM 66 CG LEU A 4 -0.338 2.586 6.867 1.00 52.01 C ATOM 67 CD1 LEU A 4 0.220 3.363 8.074 1.00 41.43 C ATOM 68 CD2 LEU A 4 -1.859 2.755 6.732 1.00 72.23 C ATOM 0 H LEU A 4 2.409 4.771 5.646 1.00 43.42 H new ATOM 0 HA LEU A 4 2.117 1.838 5.992 1.00 51.04 H new ATOM 0 HB2 LEU A 4 0.163 4.036 5.343 1.00 64.00 H new ATOM 0 HB3 LEU A 4 -0.118 2.421 4.722 1.00 64.00 H new ATOM 0 HG LEU A 4 -0.118 1.537 7.064 1.00 52.01 H new ATOM 0 HD11 LEU A 4 -0.299 3.050 8.980 1.00 41.43 H new ATOM 0 HD12 LEU A 4 1.286 3.158 8.178 1.00 41.43 H new ATOM 0 HD13 LEU A 4 0.069 4.432 7.920 1.00 41.43 H new ATOM 0 HD21 LEU A 4 -2.340 2.478 7.670 1.00 72.23 H new ATOM 0 HD22 LEU A 4 -2.090 3.794 6.498 1.00 72.23 H new ATOM 0 HD23 LEU A 4 -2.227 2.112 5.932 1.00 72.23 H new ATOM 80 N ILE A 5 2.567 1.381 3.545 1.00 75.23 N ATOM 81 CA ILE A 5 2.701 1.044 2.129 1.00 23.22 C ATOM 82 C ILE A 5 1.641 -0.020 1.805 1.00 30.44 C ATOM 83 O ILE A 5 1.724 -1.151 2.287 1.00 45.43 O ATOM 84 CB ILE A 5 4.152 0.543 1.747 1.00 1.24 C ATOM 85 CG1 ILE A 5 5.238 1.594 2.166 1.00 23.31 C ATOM 86 CG2 ILE A 5 4.241 0.224 0.228 1.00 33.24 C ATOM 87 CD1 ILE A 5 6.669 1.247 1.765 1.00 74.44 C ATOM 0 H ILE A 5 2.694 0.585 4.170 1.00 75.23 H new ATOM 0 HA ILE A 5 2.544 1.943 1.533 1.00 23.22 H new ATOM 0 HB ILE A 5 4.349 -0.377 2.298 1.00 1.24 H new ATOM 0 HG12 ILE A 5 4.978 2.556 1.725 1.00 23.31 H new ATOM 0 HG13 ILE A 5 5.201 1.718 3.248 1.00 23.31 H new ATOM 0 HG21 ILE A 5 5.247 -0.119 -0.013 1.00 33.24 H new ATOM 0 HG22 ILE A 5 3.522 -0.556 -0.023 1.00 33.24 H new ATOM 0 HG23 ILE A 5 4.016 1.123 -0.346 1.00 33.24 H new ATOM 0 HD11 ILE A 5 7.342 2.036 2.100 1.00 74.44 H new ATOM 0 HD12 ILE A 5 6.958 0.303 2.227 1.00 74.44 H new ATOM 0 HD13 ILE A 5 6.731 1.154 0.681 1.00 74.44 H new ATOM 99 N LEU A 6 0.629 0.372 1.016 1.00 33.23 N ATOM 100 CA LEU A 6 -0.456 -0.518 0.585 1.00 62.14 C ATOM 101 C LEU A 6 -0.024 -1.251 -0.685 1.00 64.20 C ATOM 102 O LEU A 6 0.589 -0.656 -1.576 1.00 52.24 O ATOM 103 CB LEU A 6 -1.752 0.284 0.274 1.00 21.24 C ATOM 104 CG LEU A 6 -2.370 1.108 1.429 1.00 64.21 C ATOM 105 CD1 LEU A 6 -3.638 1.865 0.967 1.00 53.34 C ATOM 106 CD2 LEU A 6 -2.660 0.227 2.651 1.00 1.34 C ATOM 0 H LEU A 6 0.541 1.323 0.657 1.00 33.23 H new ATOM 0 HA LEU A 6 -0.662 -1.221 1.392 1.00 62.14 H new ATOM 0 HB2 LEU A 6 -1.538 0.965 -0.550 1.00 21.24 H new ATOM 0 HB3 LEU A 6 -2.506 -0.418 -0.081 1.00 21.24 H new ATOM 0 HG LEU A 6 -1.634 1.854 1.729 1.00 64.21 H new ATOM 0 HD11 LEU A 6 -4.047 2.434 1.802 1.00 53.34 H new ATOM 0 HD12 LEU A 6 -3.380 2.546 0.156 1.00 53.34 H new ATOM 0 HD13 LEU A 6 -4.382 1.149 0.617 1.00 53.34 H new ATOM 0 HD21 LEU A 6 -3.093 0.836 3.444 1.00 1.34 H new ATOM 0 HD22 LEU A 6 -3.361 -0.560 2.374 1.00 1.34 H new ATOM 0 HD23 LEU A 6 -1.732 -0.222 3.004 1.00 1.34 H new ATOM 118 N ILE A 7 -0.329 -2.545 -0.747 1.00 43.33 N ATOM 119 CA ILE A 7 -0.088 -3.387 -1.921 1.00 54.01 C ATOM 120 C ILE A 7 -1.422 -3.996 -2.347 1.00 42.31 C ATOM 121 O ILE A 7 -2.046 -4.719 -1.567 1.00 12.34 O ATOM 122 CB ILE A 7 0.965 -4.527 -1.624 1.00 44.31 C ATOM 123 CG1 ILE A 7 2.335 -3.921 -1.176 1.00 65.33 C ATOM 124 CG2 ILE A 7 1.150 -5.470 -2.842 1.00 23.23 C ATOM 125 CD1 ILE A 7 3.007 -3.009 -2.196 1.00 4.23 C ATOM 0 H ILE A 7 -0.758 -3.049 0.029 1.00 43.33 H new ATOM 0 HA ILE A 7 0.330 -2.774 -2.720 1.00 54.01 H new ATOM 0 HB ILE A 7 0.572 -5.126 -0.803 1.00 44.31 H new ATOM 0 HG12 ILE A 7 2.181 -3.358 -0.255 1.00 65.33 H new ATOM 0 HG13 ILE A 7 3.016 -4.739 -0.940 1.00 65.33 H new ATOM 0 HG21 ILE A 7 1.882 -6.240 -2.598 1.00 23.23 H new ATOM 0 HG22 ILE A 7 0.197 -5.939 -3.087 1.00 23.23 H new ATOM 0 HG23 ILE A 7 1.501 -4.894 -3.698 1.00 23.23 H new ATOM 0 HD11 ILE A 7 3.949 -2.641 -1.790 1.00 4.23 H new ATOM 0 HD12 ILE A 7 3.200 -3.568 -3.112 1.00 4.23 H new ATOM 0 HD13 ILE A 7 2.353 -2.166 -2.417 1.00 4.23 H new ATOM 137 N ASN A 8 -1.871 -3.653 -3.560 1.00 60.22 N ATOM 138 CA ASN A 8 -3.037 -4.265 -4.205 1.00 2.24 C ATOM 139 C ASN A 8 -2.607 -4.728 -5.599 1.00 63.45 C ATOM 140 O ASN A 8 -2.459 -3.920 -6.526 1.00 35.23 O ATOM 141 CB ASN A 8 -4.207 -3.250 -4.270 1.00 50.52 C ATOM 142 CG ASN A 8 -5.446 -3.736 -5.045 1.00 11.25 C ATOM 143 OD1 ASN A 8 -5.749 -4.922 -5.104 1.00 21.40 O ATOM 144 ND2 ASN A 8 -6.183 -2.810 -5.639 1.00 43.40 N ATOM 0 H ASN A 8 -1.428 -2.932 -4.129 1.00 60.22 H new ATOM 0 HA ASN A 8 -3.395 -5.122 -3.634 1.00 2.24 H new ATOM 0 HB2 ASN A 8 -4.508 -3.000 -3.253 1.00 50.52 H new ATOM 0 HB3 ASN A 8 -3.846 -2.331 -4.731 1.00 50.52 H new ATOM 0 HD21 ASN A 8 -7.019 -3.079 -6.157 1.00 43.40 H new ATOM 0 HD22 ASN A 8 -5.914 -1.828 -5.578 1.00 43.40 H new ATOM 151 N THR A 9 -2.353 -6.028 -5.714 1.00 73.21 N ATOM 152 CA THR A 9 -1.968 -6.677 -6.968 1.00 21.24 C ATOM 153 C THR A 9 -2.829 -7.924 -7.194 1.00 43.54 C ATOM 154 O THR A 9 -3.235 -8.595 -6.229 1.00 2.35 O ATOM 155 CB THR A 9 -0.445 -7.022 -7.008 1.00 24.31 C ATOM 156 OG1 THR A 9 -0.113 -7.665 -8.247 1.00 12.32 O ATOM 157 CG2 THR A 9 -0.008 -7.906 -5.848 1.00 62.21 C ATOM 0 H THR A 9 -2.409 -6.673 -4.926 1.00 73.21 H new ATOM 0 HA THR A 9 -2.146 -5.974 -7.781 1.00 21.24 H new ATOM 0 HB THR A 9 0.089 -6.076 -6.919 1.00 24.31 H new ATOM 0 HG1 THR A 9 -0.540 -7.187 -8.988 1.00 12.32 H new ATOM 0 HG21 THR A 9 1.059 -8.112 -5.929 1.00 62.21 H new ATOM 0 HG22 THR A 9 -0.208 -7.395 -4.906 1.00 62.21 H new ATOM 0 HG23 THR A 9 -0.562 -8.844 -5.877 1.00 62.21 H new ATOM 165 N ASN A 10 -3.123 -8.205 -8.473 1.00 72.32 N ATOM 166 CA ASN A 10 -3.930 -9.371 -8.887 1.00 44.15 C ATOM 167 C ASN A 10 -3.238 -10.697 -8.498 1.00 64.31 C ATOM 168 O ASN A 10 -3.884 -11.625 -7.993 1.00 21.24 O ATOM 169 CB ASN A 10 -4.161 -9.324 -10.415 1.00 22.22 C ATOM 170 CG ASN A 10 -4.993 -10.491 -10.971 1.00 25.43 C ATOM 171 OD1 ASN A 10 -5.901 -11.005 -10.316 1.00 71.45 O ATOM 172 ND2 ASN A 10 -4.695 -10.906 -12.192 1.00 73.23 N ATOM 0 H ASN A 10 -2.808 -7.630 -9.254 1.00 72.32 H new ATOM 0 HA ASN A 10 -4.888 -9.328 -8.369 1.00 44.15 H new ATOM 0 HB2 ASN A 10 -4.659 -8.388 -10.666 1.00 22.22 H new ATOM 0 HB3 ASN A 10 -3.193 -9.314 -10.916 1.00 22.22 H new ATOM 0 HD21 ASN A 10 -5.223 -11.670 -12.614 1.00 73.23 H new ATOM 0 HD22 ASN A 10 -3.938 -10.462 -12.711 1.00 73.23 H new ATOM 179 N ASN A 11 -1.918 -10.767 -8.740 1.00 64.40 N ATOM 180 CA ASN A 11 -1.106 -11.967 -8.446 1.00 20.24 C ATOM 181 C ASN A 11 -0.502 -11.873 -7.024 1.00 35.14 C ATOM 182 O ASN A 11 0.321 -11.001 -6.736 1.00 11.14 O ATOM 183 CB ASN A 11 -0.007 -12.191 -9.536 1.00 72.41 C ATOM 184 CG ASN A 11 0.967 -11.020 -9.750 1.00 65.00 C ATOM 185 OD1 ASN A 11 0.609 -9.854 -9.640 1.00 31.53 O ATOM 186 ND2 ASN A 11 2.212 -11.327 -10.061 1.00 42.25 N ATOM 0 H ASN A 11 -1.383 -9.998 -9.143 1.00 64.40 H new ATOM 0 HA ASN A 11 -1.757 -12.841 -8.473 1.00 20.24 H new ATOM 0 HB2 ASN A 11 0.570 -13.076 -9.267 1.00 72.41 H new ATOM 0 HB3 ASN A 11 -0.500 -12.408 -10.484 1.00 72.41 H new ATOM 0 HD21 ASN A 11 2.897 -10.587 -10.215 1.00 42.25 H new ATOM 0 HD22 ASN A 11 2.490 -12.305 -10.148 1.00 42.25 H new ATOM 193 N ASP A 12 -0.952 -12.787 -6.145 1.00 42.11 N ATOM 194 CA ASP A 12 -0.500 -12.896 -4.735 1.00 35.50 C ATOM 195 C ASP A 12 1.012 -13.196 -4.632 1.00 74.42 C ATOM 196 O ASP A 12 1.677 -12.768 -3.675 1.00 63.45 O ATOM 197 CB ASP A 12 -1.318 -14.012 -4.027 1.00 42.40 C ATOM 198 CG ASP A 12 -0.884 -14.279 -2.569 1.00 22.14 C ATOM 199 OD1 ASP A 12 -1.395 -13.609 -1.651 1.00 33.10 O ATOM 200 OD2 ASP A 12 -0.016 -15.158 -2.341 1.00 14.35 O ATOM 0 H ASP A 12 -1.652 -13.486 -6.394 1.00 42.11 H new ATOM 0 HA ASP A 12 -0.669 -11.937 -4.246 1.00 35.50 H new ATOM 0 HB2 ASP A 12 -2.373 -13.737 -4.037 1.00 42.40 H new ATOM 0 HB3 ASP A 12 -1.224 -14.935 -4.598 1.00 42.40 H new ATOM 205 N GLU A 13 1.526 -13.929 -5.632 1.00 73.13 N ATOM 206 CA GLU A 13 2.933 -14.360 -5.697 1.00 34.15 C ATOM 207 C GLU A 13 3.908 -13.161 -5.681 1.00 23.11 C ATOM 208 O GLU A 13 5.022 -13.268 -5.156 1.00 71.55 O ATOM 209 CB GLU A 13 3.157 -15.232 -6.959 1.00 72.13 C ATOM 210 CG GLU A 13 2.811 -14.537 -8.293 1.00 53.24 C ATOM 211 CD GLU A 13 3.118 -15.411 -9.519 1.00 64.15 C ATOM 212 OE1 GLU A 13 4.266 -15.383 -10.010 1.00 44.20 O ATOM 213 OE2 GLU A 13 2.217 -16.128 -9.995 1.00 62.02 O ATOM 0 H GLU A 13 0.971 -14.243 -6.428 1.00 73.13 H new ATOM 0 HA GLU A 13 3.144 -14.953 -4.807 1.00 34.15 H new ATOM 0 HB2 GLU A 13 4.201 -15.544 -6.988 1.00 72.13 H new ATOM 0 HB3 GLU A 13 2.556 -16.137 -6.870 1.00 72.13 H new ATOM 0 HG2 GLU A 13 1.753 -14.274 -8.296 1.00 53.24 H new ATOM 0 HG3 GLU A 13 3.372 -13.605 -8.368 1.00 53.24 H new ATOM 220 N LEU A 14 3.462 -12.028 -6.256 1.00 60.13 N ATOM 221 CA LEU A 14 4.215 -10.771 -6.257 1.00 55.00 C ATOM 222 C LEU A 14 4.328 -10.204 -4.826 1.00 73.02 C ATOM 223 O LEU A 14 5.398 -9.730 -4.444 1.00 41.42 O ATOM 224 CB LEU A 14 3.546 -9.752 -7.217 1.00 2.45 C ATOM 225 CG LEU A 14 4.187 -8.324 -7.293 1.00 73.12 C ATOM 226 CD1 LEU A 14 5.689 -8.359 -7.654 1.00 44.44 C ATOM 227 CD2 LEU A 14 3.407 -7.426 -8.265 1.00 22.54 C ATOM 0 H LEU A 14 2.563 -11.965 -6.734 1.00 60.13 H new ATOM 0 HA LEU A 14 5.226 -10.964 -6.616 1.00 55.00 H new ATOM 0 HB2 LEU A 14 3.548 -10.179 -8.220 1.00 2.45 H new ATOM 0 HB3 LEU A 14 2.503 -9.640 -6.920 1.00 2.45 H new ATOM 0 HG LEU A 14 4.119 -7.897 -6.293 1.00 73.12 H new ATOM 0 HD11 LEU A 14 6.078 -7.341 -7.692 1.00 44.44 H new ATOM 0 HD12 LEU A 14 6.232 -8.927 -6.898 1.00 44.44 H new ATOM 0 HD13 LEU A 14 5.818 -8.833 -8.627 1.00 44.44 H new ATOM 0 HD21 LEU A 14 3.870 -6.440 -8.301 1.00 22.54 H new ATOM 0 HD22 LEU A 14 3.420 -7.870 -9.260 1.00 22.54 H new ATOM 0 HD23 LEU A 14 2.376 -7.330 -7.924 1.00 22.54 H new ATOM 239 N ILE A 15 3.233 -10.298 -4.030 1.00 54.42 N ATOM 240 CA ILE A 15 3.205 -9.780 -2.639 1.00 51.24 C ATOM 241 C ILE A 15 4.228 -10.525 -1.763 1.00 31.33 C ATOM 242 O ILE A 15 4.925 -9.898 -0.969 1.00 53.33 O ATOM 243 CB ILE A 15 1.788 -9.905 -1.958 1.00 35.51 C ATOM 244 CG1 ILE A 15 0.669 -9.349 -2.884 1.00 11.24 C ATOM 245 CG2 ILE A 15 1.782 -9.188 -0.582 1.00 11.31 C ATOM 246 CD1 ILE A 15 -0.760 -9.579 -2.411 1.00 52.30 C ATOM 0 H ILE A 15 2.358 -10.728 -4.328 1.00 54.42 H new ATOM 0 HA ILE A 15 3.454 -8.722 -2.713 1.00 51.24 H new ATOM 0 HB ILE A 15 1.582 -10.963 -1.793 1.00 35.51 H new ATOM 0 HG12 ILE A 15 0.823 -8.277 -3.005 1.00 11.24 H new ATOM 0 HG13 ILE A 15 0.782 -9.800 -3.870 1.00 11.24 H new ATOM 0 HG21 ILE A 15 0.797 -9.284 -0.126 1.00 11.31 H new ATOM 0 HG22 ILE A 15 2.529 -9.643 0.069 1.00 11.31 H new ATOM 0 HG23 ILE A 15 2.016 -8.133 -0.721 1.00 11.31 H new ATOM 0 HD11 ILE A 15 -1.456 -9.150 -3.133 1.00 52.30 H new ATOM 0 HD12 ILE A 15 -0.945 -10.649 -2.320 1.00 52.30 H new ATOM 0 HD13 ILE A 15 -0.904 -9.102 -1.441 1.00 52.30 H new ATOM 258 N LYS A 16 4.311 -11.867 -1.952 1.00 54.25 N ATOM 259 CA LYS A 16 5.277 -12.745 -1.243 1.00 63.53 C ATOM 260 C LYS A 16 6.719 -12.200 -1.359 1.00 63.52 C ATOM 261 O LYS A 16 7.511 -12.285 -0.413 1.00 32.21 O ATOM 262 CB LYS A 16 5.218 -14.194 -1.828 1.00 43.11 C ATOM 263 CG LYS A 16 3.880 -14.939 -1.597 1.00 72.10 C ATOM 264 CD LYS A 16 3.596 -15.285 -0.105 1.00 3.12 C ATOM 265 CE LYS A 16 4.399 -16.494 0.434 1.00 43.55 C ATOM 266 NZ LYS A 16 5.873 -16.283 0.428 1.00 32.54 N ATOM 0 H LYS A 16 3.708 -12.372 -2.602 1.00 54.25 H new ATOM 0 HA LYS A 16 4.999 -12.764 -0.189 1.00 63.53 H new ATOM 0 HB2 LYS A 16 5.409 -14.145 -2.900 1.00 43.11 H new ATOM 0 HB3 LYS A 16 6.024 -14.781 -1.387 1.00 43.11 H new ATOM 0 HG2 LYS A 16 3.064 -14.325 -1.979 1.00 72.10 H new ATOM 0 HG3 LYS A 16 3.884 -15.861 -2.178 1.00 72.10 H new ATOM 0 HD2 LYS A 16 3.822 -14.412 0.507 1.00 3.12 H new ATOM 0 HD3 LYS A 16 2.532 -15.490 0.012 1.00 3.12 H new ATOM 0 HE2 LYS A 16 4.076 -16.709 1.452 1.00 43.55 H new ATOM 0 HE3 LYS A 16 4.164 -17.372 -0.167 1.00 43.55 H new ATOM 0 HZ1 LYS A 16 6.306 -16.838 1.193 1.00 32.54 H new ATOM 0 HZ2 LYS A 16 6.264 -16.589 -0.486 1.00 32.54 H new ATOM 0 HZ3 LYS A 16 6.080 -15.274 0.572 1.00 32.54 H new ATOM 280 N LYS A 17 7.018 -11.624 -2.537 1.00 44.35 N ATOM 281 CA LYS A 17 8.323 -11.038 -2.861 1.00 72.05 C ATOM 282 C LYS A 17 8.486 -9.655 -2.210 1.00 12.03 C ATOM 283 O LYS A 17 9.534 -9.358 -1.631 1.00 2.31 O ATOM 284 CB LYS A 17 8.458 -10.922 -4.394 1.00 23.24 C ATOM 285 CG LYS A 17 8.270 -12.259 -5.146 1.00 70.42 C ATOM 286 CD LYS A 17 8.394 -12.092 -6.674 1.00 72.22 C ATOM 287 CE LYS A 17 9.759 -11.516 -7.088 1.00 31.24 C ATOM 288 NZ LYS A 17 9.909 -11.445 -8.557 1.00 14.01 N ATOM 0 H LYS A 17 6.346 -11.553 -3.301 1.00 44.35 H new ATOM 0 HA LYS A 17 9.107 -11.686 -2.468 1.00 72.05 H new ATOM 0 HB2 LYS A 17 7.723 -10.205 -4.760 1.00 23.24 H new ATOM 0 HB3 LYS A 17 9.442 -10.519 -4.632 1.00 23.24 H new ATOM 0 HG2 LYS A 17 9.014 -12.976 -4.799 1.00 70.42 H new ATOM 0 HG3 LYS A 17 7.291 -12.674 -4.906 1.00 70.42 H new ATOM 0 HD2 LYS A 17 8.248 -13.059 -7.156 1.00 72.22 H new ATOM 0 HD3 LYS A 17 7.601 -11.435 -7.031 1.00 72.22 H new ATOM 0 HE2 LYS A 17 9.875 -10.519 -6.663 1.00 31.24 H new ATOM 0 HE3 LYS A 17 10.554 -12.134 -6.672 1.00 31.24 H new ATOM 0 HZ1 LYS A 17 10.908 -11.281 -8.796 1.00 14.01 H new ATOM 0 HZ2 LYS A 17 9.593 -12.340 -8.982 1.00 14.01 H new ATOM 0 HZ3 LYS A 17 9.332 -10.663 -8.928 1.00 14.01 H new ATOM 302 N ILE A 18 7.414 -8.836 -2.302 1.00 30.42 N ATOM 303 CA ILE A 18 7.381 -7.450 -1.783 1.00 33.24 C ATOM 304 C ILE A 18 7.563 -7.427 -0.244 1.00 52.12 C ATOM 305 O ILE A 18 8.119 -6.471 0.304 1.00 30.02 O ATOM 306 CB ILE A 18 6.035 -6.728 -2.201 1.00 13.33 C ATOM 307 CG1 ILE A 18 5.920 -6.658 -3.760 1.00 31.03 C ATOM 308 CG2 ILE A 18 5.913 -5.318 -1.573 1.00 60.42 C ATOM 309 CD1 ILE A 18 4.632 -6.039 -4.291 1.00 75.13 C ATOM 0 H ILE A 18 6.539 -9.121 -2.743 1.00 30.42 H new ATOM 0 HA ILE A 18 8.214 -6.904 -2.227 1.00 33.24 H new ATOM 0 HB ILE A 18 5.207 -7.321 -1.813 1.00 13.33 H new ATOM 0 HG12 ILE A 18 6.764 -6.086 -4.145 1.00 31.03 H new ATOM 0 HG13 ILE A 18 6.010 -7.668 -4.160 1.00 31.03 H new ATOM 0 HG21 ILE A 18 4.975 -4.860 -1.887 1.00 60.42 H new ATOM 0 HG22 ILE A 18 5.931 -5.401 -0.486 1.00 60.42 H new ATOM 0 HG23 ILE A 18 6.747 -4.699 -1.903 1.00 60.42 H new ATOM 0 HD11 ILE A 18 4.651 -6.038 -5.381 1.00 75.13 H new ATOM 0 HD12 ILE A 18 3.778 -6.621 -3.944 1.00 75.13 H new ATOM 0 HD13 ILE A 18 4.544 -5.015 -3.928 1.00 75.13 H new ATOM 321 N LYS A 19 7.116 -8.511 0.425 1.00 24.54 N ATOM 322 CA LYS A 19 7.314 -8.700 1.871 1.00 4.51 C ATOM 323 C LYS A 19 8.811 -8.749 2.191 1.00 3.41 C ATOM 324 O LYS A 19 9.314 -7.909 2.927 1.00 51.50 O ATOM 325 CB LYS A 19 6.616 -9.991 2.361 1.00 51.24 C ATOM 326 CG LYS A 19 5.085 -9.974 2.196 1.00 24.13 C ATOM 327 CD LYS A 19 4.412 -11.270 2.701 1.00 44.35 C ATOM 328 CE LYS A 19 4.668 -11.532 4.199 1.00 44.10 C ATOM 329 NZ LYS A 19 3.925 -12.720 4.691 1.00 73.34 N ATOM 0 H LYS A 19 6.610 -9.275 -0.023 1.00 24.54 H new ATOM 0 HA LYS A 19 6.866 -7.855 2.394 1.00 4.51 H new ATOM 0 HB2 LYS A 19 7.021 -10.842 1.813 1.00 51.24 H new ATOM 0 HB3 LYS A 19 6.857 -10.146 3.413 1.00 51.24 H new ATOM 0 HG2 LYS A 19 4.675 -9.122 2.739 1.00 24.13 H new ATOM 0 HG3 LYS A 19 4.839 -9.829 1.144 1.00 24.13 H new ATOM 0 HD2 LYS A 19 3.338 -11.208 2.526 1.00 44.35 H new ATOM 0 HD3 LYS A 19 4.781 -12.116 2.121 1.00 44.35 H new ATOM 0 HE2 LYS A 19 5.735 -11.678 4.364 1.00 44.10 H new ATOM 0 HE3 LYS A 19 4.373 -10.655 4.776 1.00 44.10 H new ATOM 0 HZ1 LYS A 19 4.125 -12.860 5.702 1.00 73.34 H new ATOM 0 HZ2 LYS A 19 2.904 -12.571 4.557 1.00 73.34 H new ATOM 0 HZ3 LYS A 19 4.224 -13.562 4.159 1.00 73.34 H new ATOM 343 N LYS A 20 9.522 -9.703 1.559 1.00 1.24 N ATOM 344 CA LYS A 20 10.967 -9.919 1.791 1.00 75.02 C ATOM 345 C LYS A 20 11.796 -8.719 1.312 1.00 32.43 C ATOM 346 O LYS A 20 12.889 -8.474 1.825 1.00 4.30 O ATOM 347 CB LYS A 20 11.425 -11.233 1.100 1.00 23.34 C ATOM 348 CG LYS A 20 10.728 -12.491 1.662 1.00 53.20 C ATOM 349 CD LYS A 20 11.060 -12.737 3.159 1.00 61.21 C ATOM 350 CE LYS A 20 10.210 -13.852 3.788 1.00 24.42 C ATOM 351 NZ LYS A 20 10.477 -13.971 5.244 1.00 44.41 N ATOM 0 H LYS A 20 9.116 -10.343 0.877 1.00 1.24 H new ATOM 0 HA LYS A 20 11.134 -10.015 2.864 1.00 75.02 H new ATOM 0 HB2 LYS A 20 11.225 -11.162 0.031 1.00 23.34 H new ATOM 0 HB3 LYS A 20 12.503 -11.340 1.217 1.00 23.34 H new ATOM 0 HG2 LYS A 20 9.649 -12.388 1.545 1.00 53.20 H new ATOM 0 HG3 LYS A 20 11.030 -13.361 1.079 1.00 53.20 H new ATOM 0 HD2 LYS A 20 12.115 -12.995 3.254 1.00 61.21 H new ATOM 0 HD3 LYS A 20 10.906 -11.813 3.716 1.00 61.21 H new ATOM 0 HE2 LYS A 20 9.153 -13.643 3.625 1.00 24.42 H new ATOM 0 HE3 LYS A 20 10.427 -14.800 3.297 1.00 24.42 H new ATOM 0 HZ1 LYS A 20 9.710 -14.510 5.695 1.00 44.41 H new ATOM 0 HZ2 LYS A 20 11.380 -14.465 5.392 1.00 44.41 H new ATOM 0 HZ3 LYS A 20 10.528 -13.022 5.666 1.00 44.41 H new ATOM 365 N GLU A 21 11.242 -7.981 0.331 1.00 2.21 N ATOM 366 CA GLU A 21 11.827 -6.745 -0.197 1.00 11.11 C ATOM 367 C GLU A 21 11.896 -5.673 0.915 1.00 31.51 C ATOM 368 O GLU A 21 12.973 -5.157 1.234 1.00 11.32 O ATOM 369 CB GLU A 21 10.965 -6.235 -1.393 1.00 4.45 C ATOM 370 CG GLU A 21 11.669 -5.247 -2.348 1.00 11.32 C ATOM 371 CD GLU A 21 12.693 -5.933 -3.266 1.00 42.52 C ATOM 372 OE1 GLU A 21 12.274 -6.592 -4.244 1.00 12.31 O ATOM 373 OE2 GLU A 21 13.912 -5.833 -3.014 1.00 31.31 O ATOM 0 H GLU A 21 10.363 -8.235 -0.120 1.00 2.21 H new ATOM 0 HA GLU A 21 12.840 -6.943 -0.546 1.00 11.11 H new ATOM 0 HB2 GLU A 21 10.632 -7.097 -1.971 1.00 4.45 H new ATOM 0 HB3 GLU A 21 10.072 -5.754 -0.995 1.00 4.45 H new ATOM 0 HG2 GLU A 21 10.920 -4.743 -2.959 1.00 11.32 H new ATOM 0 HG3 GLU A 21 12.172 -4.478 -1.762 1.00 11.32 H new ATOM 380 N VAL A 22 10.730 -5.395 1.539 1.00 70.34 N ATOM 381 CA VAL A 22 10.591 -4.327 2.554 1.00 71.32 C ATOM 382 C VAL A 22 11.182 -4.744 3.924 1.00 72.41 C ATOM 383 O VAL A 22 11.546 -3.874 4.729 1.00 11.23 O ATOM 384 CB VAL A 22 9.092 -3.873 2.725 1.00 34.31 C ATOM 385 CG1 VAL A 22 8.496 -3.383 1.384 1.00 44.45 C ATOM 386 CG2 VAL A 22 8.222 -4.986 3.357 1.00 35.33 C ATOM 0 H VAL A 22 9.864 -5.901 1.355 1.00 70.34 H new ATOM 0 HA VAL A 22 11.166 -3.478 2.183 1.00 71.32 H new ATOM 0 HB VAL A 22 9.087 -3.031 3.417 1.00 34.31 H new ATOM 0 HG11 VAL A 22 7.461 -3.077 1.536 1.00 44.45 H new ATOM 0 HG12 VAL A 22 9.075 -2.535 1.017 1.00 44.45 H new ATOM 0 HG13 VAL A 22 8.532 -4.191 0.653 1.00 44.45 H new ATOM 0 HG21 VAL A 22 7.196 -4.633 3.458 1.00 35.33 H new ATOM 0 HG22 VAL A 22 8.241 -5.869 2.718 1.00 35.33 H new ATOM 0 HG23 VAL A 22 8.616 -5.241 4.341 1.00 35.33 H new ATOM 396 N GLU A 23 11.277 -6.073 4.169 1.00 21.31 N ATOM 397 CA GLU A 23 11.848 -6.638 5.415 1.00 11.12 C ATOM 398 C GLU A 23 13.348 -6.307 5.557 1.00 51.20 C ATOM 399 O GLU A 23 13.862 -6.258 6.682 1.00 20.44 O ATOM 400 CB GLU A 23 11.627 -8.176 5.476 1.00 40.20 C ATOM 401 CG GLU A 23 10.188 -8.610 5.825 1.00 72.14 C ATOM 402 CD GLU A 23 9.988 -10.138 5.760 1.00 73.33 C ATOM 403 OE1 GLU A 23 10.666 -10.859 6.520 1.00 41.42 O ATOM 404 OE2 GLU A 23 9.145 -10.626 4.971 1.00 33.00 O ATOM 0 H GLU A 23 10.960 -6.783 3.509 1.00 21.31 H new ATOM 0 HA GLU A 23 11.324 -6.174 6.251 1.00 11.12 H new ATOM 0 HB2 GLU A 23 11.897 -8.606 4.512 1.00 40.20 H new ATOM 0 HB3 GLU A 23 12.308 -8.598 6.215 1.00 40.20 H new ATOM 0 HG2 GLU A 23 9.941 -8.259 6.827 1.00 72.14 H new ATOM 0 HG3 GLU A 23 9.492 -8.128 5.138 1.00 72.14 H new ATOM 411 N ASN A 24 14.039 -6.084 4.411 1.00 50.12 N ATOM 412 CA ASN A 24 15.455 -5.639 4.399 1.00 21.40 C ATOM 413 C ASN A 24 15.627 -4.279 5.118 1.00 63.14 C ATOM 414 O ASN A 24 16.705 -3.989 5.651 1.00 55.30 O ATOM 415 CB ASN A 24 16.021 -5.536 2.953 1.00 10.21 C ATOM 416 CG ASN A 24 16.206 -6.891 2.265 1.00 15.41 C ATOM 417 OD1 ASN A 24 17.208 -7.577 2.482 1.00 43.30 O ATOM 418 ND2 ASN A 24 15.275 -7.270 1.409 1.00 25.12 N ATOM 0 H ASN A 24 13.637 -6.206 3.481 1.00 50.12 H new ATOM 0 HA ASN A 24 16.020 -6.400 4.938 1.00 21.40 H new ATOM 0 HB2 ASN A 24 15.349 -4.923 2.353 1.00 10.21 H new ATOM 0 HB3 ASN A 24 16.981 -5.021 2.984 1.00 10.21 H new ATOM 0 HD21 ASN A 24 15.373 -8.152 0.906 1.00 25.12 H new ATOM 0 HD22 ASN A 24 14.457 -6.681 1.251 1.00 25.12 H new ATOM 425 N GLN A 25 14.568 -3.444 5.096 1.00 12.45 N ATOM 426 CA GLN A 25 14.565 -2.106 5.742 1.00 44.31 C ATOM 427 C GLN A 25 13.664 -2.077 6.996 1.00 42.03 C ATOM 428 O GLN A 25 13.280 -0.999 7.470 1.00 42.20 O ATOM 429 CB GLN A 25 14.145 -1.027 4.702 1.00 2.21 C ATOM 430 CG GLN A 25 15.160 -0.814 3.561 1.00 14.23 C ATOM 431 CD GLN A 25 16.554 -0.426 4.075 1.00 34.15 C ATOM 432 OE1 GLN A 25 16.863 0.752 4.260 1.00 12.04 O ATOM 433 NE2 GLN A 25 17.407 -1.411 4.307 1.00 3.45 N ATOM 0 H GLN A 25 13.689 -3.674 4.632 1.00 12.45 H new ATOM 0 HA GLN A 25 15.574 -1.883 6.087 1.00 44.31 H new ATOM 0 HB2 GLN A 25 13.185 -1.310 4.270 1.00 2.21 H new ATOM 0 HB3 GLN A 25 13.995 -0.080 5.220 1.00 2.21 H new ATOM 0 HG2 GLN A 25 15.236 -1.728 2.972 1.00 14.23 H new ATOM 0 HG3 GLN A 25 14.793 -0.034 2.894 1.00 14.23 H new ATOM 0 HE21 GLN A 25 17.126 -2.378 4.145 1.00 3.45 H new ATOM 0 HE22 GLN A 25 18.346 -1.203 4.647 1.00 3.45 H new ATOM 442 N GLY A 26 13.359 -3.274 7.533 1.00 14.35 N ATOM 443 CA GLY A 26 12.710 -3.418 8.842 1.00 74.21 C ATOM 444 C GLY A 26 11.227 -3.075 8.864 1.00 14.25 C ATOM 445 O GLY A 26 10.690 -2.717 9.920 1.00 60.11 O ATOM 0 H GLY A 26 13.556 -4.162 7.071 1.00 14.35 H new ATOM 0 HA2 GLY A 26 12.835 -4.446 9.182 1.00 74.21 H new ATOM 0 HA3 GLY A 26 13.226 -2.780 9.559 1.00 74.21 H new ATOM 449 N TYR A 27 10.561 -3.168 7.700 1.00 43.51 N ATOM 450 CA TYR A 27 9.105 -2.948 7.607 1.00 53.41 C ATOM 451 C TYR A 27 8.348 -4.185 8.119 1.00 12.32 C ATOM 452 O TYR A 27 8.774 -5.327 7.904 1.00 4.21 O ATOM 453 CB TYR A 27 8.658 -2.616 6.154 1.00 63.11 C ATOM 454 CG TYR A 27 9.106 -1.235 5.633 1.00 42.22 C ATOM 455 CD1 TYR A 27 10.457 -0.908 5.538 1.00 0.44 C ATOM 456 CD2 TYR A 27 8.176 -0.262 5.239 1.00 62.24 C ATOM 457 CE1 TYR A 27 10.870 0.324 5.082 1.00 4.11 C ATOM 458 CE2 TYR A 27 8.593 0.976 4.777 1.00 62.23 C ATOM 459 CZ TYR A 27 9.942 1.260 4.705 1.00 35.40 C ATOM 460 OH TYR A 27 10.369 2.492 4.261 1.00 60.14 O ATOM 0 H TYR A 27 11.006 -3.394 6.811 1.00 43.51 H new ATOM 0 HA TYR A 27 8.864 -2.088 8.232 1.00 53.41 H new ATOM 0 HB2 TYR A 27 9.048 -3.384 5.486 1.00 63.11 H new ATOM 0 HB3 TYR A 27 7.571 -2.671 6.103 1.00 63.11 H new ATOM 0 HD1 TYR A 27 11.198 -1.638 5.829 1.00 0.44 H new ATOM 0 HD2 TYR A 27 7.120 -0.481 5.296 1.00 62.24 H new ATOM 0 HE1 TYR A 27 11.924 0.553 5.021 1.00 4.11 H new ATOM 0 HE2 TYR A 27 7.866 1.715 4.475 1.00 62.23 H new ATOM 0 HH TYR A 27 10.929 2.377 3.465 1.00 60.14 H new ATOM 470 N GLN A 28 7.237 -3.921 8.812 1.00 73.01 N ATOM 471 CA GLN A 28 6.262 -4.929 9.263 1.00 24.41 C ATOM 472 C GLN A 28 5.371 -5.309 8.067 1.00 14.24 C ATOM 473 O GLN A 28 5.335 -4.571 7.088 1.00 23.40 O ATOM 474 CB GLN A 28 5.402 -4.308 10.405 1.00 74.02 C ATOM 475 CG GLN A 28 4.365 -5.247 11.072 1.00 13.44 C ATOM 476 CD GLN A 28 5.006 -6.343 11.928 1.00 21.14 C ATOM 477 OE1 GLN A 28 5.323 -7.426 11.443 1.00 63.13 O ATOM 478 NE2 GLN A 28 5.206 -6.065 13.208 1.00 60.13 N ATOM 0 H GLN A 28 6.980 -2.973 9.085 1.00 73.01 H new ATOM 0 HA GLN A 28 6.763 -5.822 9.637 1.00 24.41 H new ATOM 0 HB2 GLN A 28 6.076 -3.938 11.178 1.00 74.02 H new ATOM 0 HB3 GLN A 28 4.873 -3.444 10.003 1.00 74.02 H new ATOM 0 HG2 GLN A 28 3.695 -4.654 11.695 1.00 13.44 H new ATOM 0 HG3 GLN A 28 3.754 -5.711 10.298 1.00 13.44 H new ATOM 0 HE21 GLN A 28 4.932 -5.156 13.581 1.00 60.13 H new ATOM 0 HE22 GLN A 28 5.634 -6.760 13.820 1.00 60.13 H new ATOM 487 N VAL A 29 4.690 -6.470 8.115 1.00 44.22 N ATOM 488 CA VAL A 29 3.703 -6.858 7.076 1.00 20.22 C ATOM 489 C VAL A 29 2.451 -7.447 7.752 1.00 62.10 C ATOM 490 O VAL A 29 2.574 -8.196 8.721 1.00 14.44 O ATOM 491 CB VAL A 29 4.265 -7.908 6.031 1.00 73.45 C ATOM 492 CG1 VAL A 29 3.244 -8.125 4.883 1.00 74.02 C ATOM 493 CG2 VAL A 29 5.657 -7.504 5.475 1.00 13.24 C ATOM 0 H VAL A 29 4.802 -7.158 8.859 1.00 44.22 H new ATOM 0 HA VAL A 29 3.464 -5.951 6.521 1.00 20.22 H new ATOM 0 HB VAL A 29 4.405 -8.851 6.559 1.00 73.45 H new ATOM 0 HG11 VAL A 29 3.644 -8.849 4.173 1.00 74.02 H new ATOM 0 HG12 VAL A 29 2.307 -8.500 5.295 1.00 74.02 H new ATOM 0 HG13 VAL A 29 3.063 -7.179 4.373 1.00 74.02 H new ATOM 0 HG21 VAL A 29 5.997 -8.257 4.764 1.00 13.24 H new ATOM 0 HG22 VAL A 29 5.583 -6.539 4.974 1.00 13.24 H new ATOM 0 HG23 VAL A 29 6.370 -7.433 6.296 1.00 13.24 H new ATOM 503 N ARG A 30 1.260 -7.087 7.239 1.00 73.10 N ATOM 504 CA ARG A 30 -0.025 -7.665 7.672 1.00 51.25 C ATOM 505 C ARG A 30 -0.929 -7.938 6.452 1.00 42.44 C ATOM 506 O ARG A 30 -0.942 -7.160 5.505 1.00 30.43 O ATOM 507 CB ARG A 30 -0.756 -6.712 8.659 1.00 64.41 C ATOM 508 CG ARG A 30 -2.131 -7.248 9.124 1.00 11.44 C ATOM 509 CD ARG A 30 -2.865 -6.317 10.090 1.00 5.11 C ATOM 510 NE ARG A 30 -4.173 -6.887 10.475 1.00 50.30 N ATOM 511 CZ ARG A 30 -4.368 -7.793 11.451 1.00 45.23 C ATOM 512 NH1 ARG A 30 -3.346 -8.244 12.185 1.00 23.24 N ATOM 513 NH2 ARG A 30 -5.583 -8.282 11.667 1.00 30.22 N ATOM 0 H ARG A 30 1.162 -6.383 6.508 1.00 73.10 H new ATOM 0 HA ARG A 30 0.184 -8.605 8.182 1.00 51.25 H new ATOM 0 HB2 ARG A 30 -0.123 -6.550 9.532 1.00 64.41 H new ATOM 0 HB3 ARG A 30 -0.895 -5.742 8.181 1.00 64.41 H new ATOM 0 HG2 ARG A 30 -2.759 -7.416 8.249 1.00 11.44 H new ATOM 0 HG3 ARG A 30 -1.989 -8.216 9.605 1.00 11.44 H new ATOM 0 HD2 ARG A 30 -2.257 -6.156 10.980 1.00 5.11 H new ATOM 0 HD3 ARG A 30 -3.011 -5.343 9.623 1.00 5.11 H new ATOM 0 HE ARG A 30 -4.994 -6.568 9.960 1.00 50.30 H new ATOM 0 HH11 ARG A 30 -2.401 -7.901 12.009 1.00 23.24 H new ATOM 0 HH12 ARG A 30 -3.511 -8.931 12.921 1.00 23.24 H new ATOM 0 HH21 ARG A 30 -6.367 -7.971 11.094 1.00 30.22 H new ATOM 0 HH22 ARG A 30 -5.732 -8.969 12.406 1.00 30.22 H new ATOM 527 N ASP A 31 -1.686 -9.046 6.515 1.00 52.42 N ATOM 528 CA ASP A 31 -2.724 -9.399 5.533 1.00 4.33 C ATOM 529 C ASP A 31 -4.061 -8.815 6.005 1.00 53.25 C ATOM 530 O ASP A 31 -4.554 -9.185 7.078 1.00 5.15 O ATOM 531 CB ASP A 31 -2.877 -10.951 5.415 1.00 11.10 C ATOM 532 CG ASP A 31 -1.628 -11.698 4.930 1.00 3.20 C ATOM 533 OD1 ASP A 31 -0.535 -11.476 5.486 1.00 74.12 O ATOM 534 OD2 ASP A 31 -1.741 -12.554 4.018 1.00 14.51 O ATOM 0 H ASP A 31 -1.592 -9.733 7.263 1.00 52.42 H new ATOM 0 HA ASP A 31 -2.438 -8.997 4.561 1.00 4.33 H new ATOM 0 HB2 ASP A 31 -3.161 -11.347 6.390 1.00 11.10 H new ATOM 0 HB3 ASP A 31 -3.698 -11.168 4.732 1.00 11.10 H new ATOM 539 N VAL A 32 -4.634 -7.881 5.234 1.00 3.31 N ATOM 540 CA VAL A 32 -6.025 -7.442 5.439 1.00 41.24 C ATOM 541 C VAL A 32 -6.900 -8.209 4.440 1.00 31.12 C ATOM 542 O VAL A 32 -6.846 -7.960 3.230 1.00 63.32 O ATOM 543 CB VAL A 32 -6.188 -5.891 5.270 1.00 0.33 C ATOM 544 CG1 VAL A 32 -7.659 -5.451 5.473 1.00 44.14 C ATOM 545 CG2 VAL A 32 -5.243 -5.145 6.239 1.00 3.11 C ATOM 0 H VAL A 32 -4.158 -7.414 4.462 1.00 3.31 H new ATOM 0 HA VAL A 32 -6.332 -7.659 6.462 1.00 41.24 H new ATOM 0 HB VAL A 32 -5.911 -5.629 4.249 1.00 0.33 H new ATOM 0 HG11 VAL A 32 -7.736 -4.371 5.349 1.00 44.14 H new ATOM 0 HG12 VAL A 32 -8.292 -5.947 4.737 1.00 44.14 H new ATOM 0 HG13 VAL A 32 -7.986 -5.725 6.476 1.00 44.14 H new ATOM 0 HG21 VAL A 32 -5.366 -4.070 6.111 1.00 3.11 H new ATOM 0 HG22 VAL A 32 -5.485 -5.419 7.266 1.00 3.11 H new ATOM 0 HG23 VAL A 32 -4.210 -5.420 6.024 1.00 3.11 H new ATOM 555 N ASN A 33 -7.690 -9.154 4.967 1.00 71.34 N ATOM 556 CA ASN A 33 -8.432 -10.149 4.157 1.00 33.54 C ATOM 557 C ASN A 33 -9.938 -9.851 4.142 1.00 2.30 C ATOM 558 O ASN A 33 -10.671 -10.392 3.308 1.00 61.13 O ATOM 559 CB ASN A 33 -8.185 -11.574 4.735 1.00 42.34 C ATOM 560 CG ASN A 33 -6.702 -11.936 4.873 1.00 51.14 C ATOM 561 OD1 ASN A 33 -5.858 -11.469 4.108 1.00 31.54 O ATOM 562 ND2 ASN A 33 -6.376 -12.779 5.846 1.00 61.31 N ATOM 0 H ASN A 33 -7.838 -9.256 5.971 1.00 71.34 H new ATOM 0 HA ASN A 33 -8.068 -10.093 3.131 1.00 33.54 H new ATOM 0 HB2 ASN A 33 -8.660 -11.647 5.713 1.00 42.34 H new ATOM 0 HB3 ASN A 33 -8.670 -12.307 4.090 1.00 42.34 H new ATOM 0 HD21 ASN A 33 -5.403 -13.057 5.976 1.00 61.31 H new ATOM 0 HD22 ASN A 33 -7.099 -13.149 6.464 1.00 61.31 H new ATOM 569 N ASP A 34 -10.387 -8.987 5.063 1.00 3.14 N ATOM 570 CA ASP A 34 -11.819 -8.726 5.300 1.00 53.43 C ATOM 571 C ASP A 34 -12.001 -7.312 5.879 1.00 24.44 C ATOM 572 O ASP A 34 -11.027 -6.685 6.307 1.00 3.23 O ATOM 573 CB ASP A 34 -12.387 -9.827 6.253 1.00 41.14 C ATOM 574 CG ASP A 34 -13.892 -9.703 6.557 1.00 2.43 C ATOM 575 OD1 ASP A 34 -14.702 -9.700 5.608 1.00 13.41 O ATOM 576 OD2 ASP A 34 -14.264 -9.564 7.741 1.00 43.43 O ATOM 0 H ASP A 34 -9.768 -8.447 5.668 1.00 3.14 H new ATOM 0 HA ASP A 34 -12.374 -8.769 4.363 1.00 53.43 H new ATOM 0 HB2 ASP A 34 -12.200 -10.805 5.809 1.00 41.14 H new ATOM 0 HB3 ASP A 34 -11.837 -9.793 7.193 1.00 41.14 H new ATOM 581 N SER A 35 -13.250 -6.817 5.860 1.00 30.04 N ATOM 582 CA SER A 35 -13.625 -5.504 6.405 1.00 20.33 C ATOM 583 C SER A 35 -13.453 -5.460 7.940 1.00 21.44 C ATOM 584 O SER A 35 -13.131 -4.407 8.504 1.00 10.31 O ATOM 585 CB SER A 35 -15.076 -5.185 6.007 1.00 34.32 C ATOM 586 OG SER A 35 -15.448 -3.867 6.377 1.00 1.11 O ATOM 0 H SER A 35 -14.038 -7.326 5.460 1.00 30.04 H new ATOM 0 HA SER A 35 -12.961 -4.748 5.986 1.00 20.33 H new ATOM 0 HB2 SER A 35 -15.192 -5.306 4.930 1.00 34.32 H new ATOM 0 HB3 SER A 35 -15.748 -5.899 6.483 1.00 34.32 H new ATOM 0 HG SER A 35 -16.375 -3.701 6.107 1.00 1.11 H new ATOM 592 N ASP A 36 -13.656 -6.613 8.607 1.00 63.31 N ATOM 593 CA ASP A 36 -13.425 -6.736 10.053 1.00 64.23 C ATOM 594 C ASP A 36 -11.917 -6.612 10.320 1.00 1.31 C ATOM 595 O ASP A 36 -11.506 -5.880 11.212 1.00 21.44 O ATOM 596 CB ASP A 36 -13.997 -8.071 10.602 1.00 44.03 C ATOM 597 CG ASP A 36 -14.149 -8.085 12.135 1.00 63.21 C ATOM 598 OD1 ASP A 36 -13.149 -8.285 12.851 1.00 64.44 O ATOM 599 OD2 ASP A 36 -15.282 -7.865 12.634 1.00 61.32 O ATOM 0 H ASP A 36 -13.980 -7.472 8.163 1.00 63.31 H new ATOM 0 HA ASP A 36 -13.949 -5.937 10.578 1.00 64.23 H new ATOM 0 HB2 ASP A 36 -14.969 -8.256 10.146 1.00 44.03 H new ATOM 0 HB3 ASP A 36 -13.343 -8.889 10.301 1.00 44.03 H new ATOM 604 N GLU A 37 -11.105 -7.285 9.469 1.00 4.20 N ATOM 605 CA GLU A 37 -9.628 -7.187 9.516 1.00 54.04 C ATOM 606 C GLU A 37 -9.157 -5.744 9.266 1.00 63.24 C ATOM 607 O GLU A 37 -8.164 -5.309 9.851 1.00 43.24 O ATOM 608 CB GLU A 37 -8.961 -8.127 8.469 1.00 52.14 C ATOM 609 CG GLU A 37 -9.260 -9.623 8.664 1.00 73.42 C ATOM 610 CD GLU A 37 -8.902 -10.150 10.068 1.00 62.23 C ATOM 611 OE1 GLU A 37 -7.803 -9.829 10.581 1.00 61.23 O ATOM 612 OE2 GLU A 37 -9.721 -10.886 10.663 1.00 32.44 O ATOM 0 H GLU A 37 -11.453 -7.905 8.738 1.00 4.20 H new ATOM 0 HA GLU A 37 -9.325 -7.496 10.516 1.00 54.04 H new ATOM 0 HB2 GLU A 37 -9.291 -7.831 7.473 1.00 52.14 H new ATOM 0 HB3 GLU A 37 -7.882 -7.979 8.504 1.00 52.14 H new ATOM 0 HG2 GLU A 37 -10.320 -9.800 8.479 1.00 73.42 H new ATOM 0 HG3 GLU A 37 -8.707 -10.195 7.919 1.00 73.42 H new ATOM 619 N LEU A 38 -9.899 -5.024 8.392 1.00 74.14 N ATOM 620 CA LEU A 38 -9.608 -3.633 8.033 1.00 71.34 C ATOM 621 C LEU A 38 -9.705 -2.736 9.268 1.00 62.42 C ATOM 622 O LEU A 38 -8.758 -2.055 9.616 1.00 74.40 O ATOM 623 CB LEU A 38 -10.588 -3.130 6.938 1.00 33.25 C ATOM 624 CG LEU A 38 -10.287 -1.703 6.371 1.00 53.11 C ATOM 625 CD1 LEU A 38 -8.982 -1.700 5.563 1.00 11.13 C ATOM 626 CD2 LEU A 38 -11.469 -1.153 5.543 1.00 11.42 C ATOM 0 H LEU A 38 -10.719 -5.402 7.918 1.00 74.14 H new ATOM 0 HA LEU A 38 -8.593 -3.589 7.638 1.00 71.34 H new ATOM 0 HB2 LEU A 38 -10.578 -3.840 6.111 1.00 33.25 H new ATOM 0 HB3 LEU A 38 -11.598 -3.134 7.349 1.00 33.25 H new ATOM 0 HG LEU A 38 -10.157 -1.032 7.220 1.00 53.11 H new ATOM 0 HD11 LEU A 38 -8.794 -0.697 5.179 1.00 11.13 H new ATOM 0 HD12 LEU A 38 -8.155 -2.003 6.206 1.00 11.13 H new ATOM 0 HD13 LEU A 38 -9.068 -2.397 4.730 1.00 11.13 H new ATOM 0 HD21 LEU A 38 -11.220 -0.161 5.168 1.00 11.42 H new ATOM 0 HD22 LEU A 38 -11.666 -1.820 4.703 1.00 11.42 H new ATOM 0 HD23 LEU A 38 -12.356 -1.090 6.173 1.00 11.42 H new ATOM 638 N LYS A 39 -10.860 -2.785 9.956 1.00 24.31 N ATOM 639 CA LYS A 39 -11.104 -1.918 11.119 1.00 75.33 C ATOM 640 C LYS A 39 -10.223 -2.329 12.320 1.00 63.12 C ATOM 641 O LYS A 39 -9.935 -1.502 13.176 1.00 44.13 O ATOM 642 CB LYS A 39 -12.623 -1.876 11.468 1.00 24.11 C ATOM 643 CG LYS A 39 -13.291 -3.221 11.860 1.00 43.53 C ATOM 644 CD LYS A 39 -13.091 -3.605 13.347 1.00 12.32 C ATOM 645 CE LYS A 39 -13.734 -4.940 13.708 1.00 41.11 C ATOM 646 NZ LYS A 39 -15.212 -4.910 13.564 1.00 2.30 N ATOM 0 H LYS A 39 -11.632 -3.411 9.728 1.00 24.31 H new ATOM 0 HA LYS A 39 -10.811 -0.900 10.860 1.00 75.33 H new ATOM 0 HB2 LYS A 39 -12.763 -1.175 12.291 1.00 24.11 H new ATOM 0 HB3 LYS A 39 -13.157 -1.469 10.609 1.00 24.11 H new ATOM 0 HG2 LYS A 39 -14.359 -3.161 11.650 1.00 43.53 H new ATOM 0 HG3 LYS A 39 -12.886 -4.014 11.231 1.00 43.53 H new ATOM 0 HD2 LYS A 39 -12.024 -3.651 13.565 1.00 12.32 H new ATOM 0 HD3 LYS A 39 -13.512 -2.823 13.979 1.00 12.32 H new ATOM 0 HE2 LYS A 39 -13.325 -5.723 13.069 1.00 41.11 H new ATOM 0 HE3 LYS A 39 -13.476 -5.199 14.735 1.00 41.11 H new ATOM 0 HZ1 LYS A 39 -15.654 -5.150 14.474 1.00 2.30 H new ATOM 0 HZ2 LYS A 39 -15.513 -3.958 13.273 1.00 2.30 H new ATOM 0 HZ3 LYS A 39 -15.505 -5.601 12.844 1.00 2.30 H new ATOM 660 N LYS A 40 -9.808 -3.620 12.368 1.00 55.23 N ATOM 661 CA LYS A 40 -8.893 -4.122 13.415 1.00 51.34 C ATOM 662 C LYS A 40 -7.561 -3.357 13.373 1.00 41.42 C ATOM 663 O LYS A 40 -7.181 -2.708 14.354 1.00 62.25 O ATOM 664 CB LYS A 40 -8.642 -5.659 13.264 1.00 23.13 C ATOM 665 CG LYS A 40 -9.818 -6.604 13.653 1.00 11.21 C ATOM 666 CD LYS A 40 -9.991 -6.839 15.185 1.00 13.02 C ATOM 667 CE LYS A 40 -10.671 -5.674 15.936 1.00 4.20 C ATOM 668 NZ LYS A 40 -10.999 -6.032 17.342 1.00 41.23 N ATOM 0 H LYS A 40 -10.094 -4.329 11.693 1.00 55.23 H new ATOM 0 HA LYS A 40 -9.367 -3.954 14.382 1.00 51.34 H new ATOM 0 HB2 LYS A 40 -8.374 -5.859 12.227 1.00 23.13 H new ATOM 0 HB3 LYS A 40 -7.778 -5.924 13.873 1.00 23.13 H new ATOM 0 HG2 LYS A 40 -10.745 -6.189 13.257 1.00 11.21 H new ATOM 0 HG3 LYS A 40 -9.667 -7.568 13.167 1.00 11.21 H new ATOM 0 HD2 LYS A 40 -10.578 -7.745 15.337 1.00 13.02 H new ATOM 0 HD3 LYS A 40 -9.010 -7.016 15.626 1.00 13.02 H new ATOM 0 HE2 LYS A 40 -10.014 -4.805 15.927 1.00 4.20 H new ATOM 0 HE3 LYS A 40 -11.583 -5.389 15.412 1.00 4.20 H new ATOM 0 HZ1 LYS A 40 -11.454 -5.222 17.809 1.00 41.23 H new ATOM 0 HZ2 LYS A 40 -11.647 -6.845 17.351 1.00 41.23 H new ATOM 0 HZ3 LYS A 40 -10.126 -6.279 17.850 1.00 41.23 H new ATOM 682 N GLU A 41 -6.892 -3.401 12.203 1.00 52.14 N ATOM 683 CA GLU A 41 -5.571 -2.784 12.032 1.00 13.45 C ATOM 684 C GLU A 41 -5.668 -1.265 11.894 1.00 31.11 C ATOM 685 O GLU A 41 -4.777 -0.571 12.353 1.00 32.43 O ATOM 686 CB GLU A 41 -4.780 -3.446 10.871 1.00 13.41 C ATOM 687 CG GLU A 41 -5.500 -3.563 9.500 1.00 4.41 C ATOM 688 CD GLU A 41 -5.448 -2.304 8.610 1.00 74.40 C ATOM 689 OE1 GLU A 41 -4.364 -1.709 8.483 1.00 42.35 O ATOM 690 OE2 GLU A 41 -6.482 -1.929 8.029 1.00 21.41 O ATOM 0 H GLU A 41 -7.250 -3.859 11.365 1.00 52.14 H new ATOM 0 HA GLU A 41 -4.999 -2.970 12.941 1.00 13.45 H new ATOM 0 HB2 GLU A 41 -3.860 -2.880 10.723 1.00 13.41 H new ATOM 0 HB3 GLU A 41 -4.490 -4.448 11.187 1.00 13.41 H new ATOM 0 HG2 GLU A 41 -5.060 -4.394 8.949 1.00 4.41 H new ATOM 0 HG3 GLU A 41 -6.545 -3.817 9.679 1.00 4.41 H new ATOM 697 N MET A 42 -6.780 -0.755 11.326 1.00 12.25 N ATOM 698 CA MET A 42 -7.025 0.701 11.247 1.00 43.14 C ATOM 699 C MET A 42 -7.173 1.323 12.644 1.00 54.23 C ATOM 700 O MET A 42 -6.814 2.485 12.839 1.00 71.12 O ATOM 701 CB MET A 42 -8.256 1.053 10.352 1.00 43.33 C ATOM 702 CG MET A 42 -7.935 1.143 8.850 1.00 30.01 C ATOM 703 SD MET A 42 -6.560 2.274 8.499 1.00 23.35 S ATOM 704 CE MET A 42 -7.052 3.793 9.312 1.00 55.12 C ATOM 0 H MET A 42 -7.520 -1.326 10.917 1.00 12.25 H new ATOM 0 HA MET A 42 -6.146 1.135 10.770 1.00 43.14 H new ATOM 0 HB2 MET A 42 -9.029 0.299 10.503 1.00 43.33 H new ATOM 0 HB3 MET A 42 -8.671 2.005 10.682 1.00 43.33 H new ATOM 0 HG2 MET A 42 -7.689 0.150 8.474 1.00 30.01 H new ATOM 0 HG3 MET A 42 -8.822 1.477 8.312 1.00 30.01 H new ATOM 0 HE1 MET A 42 -6.856 4.639 8.653 1.00 55.12 H new ATOM 0 HE2 MET A 42 -8.116 3.753 9.544 1.00 55.12 H new ATOM 0 HE3 MET A 42 -6.484 3.912 10.235 1.00 55.12 H new ATOM 714 N LYS A 43 -7.704 0.544 13.605 1.00 74.34 N ATOM 715 CA LYS A 43 -7.762 0.957 15.021 1.00 52.50 C ATOM 716 C LYS A 43 -6.353 0.942 15.645 1.00 30.42 C ATOM 717 O LYS A 43 -6.084 1.708 16.561 1.00 42.10 O ATOM 718 CB LYS A 43 -8.753 0.060 15.836 1.00 23.21 C ATOM 719 CG LYS A 43 -10.143 0.684 16.113 1.00 74.15 C ATOM 720 CD LYS A 43 -10.959 0.964 14.832 1.00 33.03 C ATOM 721 CE LYS A 43 -12.381 1.461 15.129 1.00 63.34 C ATOM 722 NZ LYS A 43 -12.374 2.780 15.812 1.00 63.25 N ATOM 0 H LYS A 43 -8.101 -0.379 13.426 1.00 74.34 H new ATOM 0 HA LYS A 43 -8.142 1.978 15.061 1.00 52.50 H new ATOM 0 HB2 LYS A 43 -8.895 -0.876 15.297 1.00 23.21 H new ATOM 0 HB3 LYS A 43 -8.289 -0.189 16.790 1.00 23.21 H new ATOM 0 HG2 LYS A 43 -10.712 0.013 16.757 1.00 74.15 H new ATOM 0 HG3 LYS A 43 -10.011 1.617 16.661 1.00 74.15 H new ATOM 0 HD2 LYS A 43 -10.437 1.708 14.230 1.00 33.03 H new ATOM 0 HD3 LYS A 43 -11.014 0.053 14.236 1.00 33.03 H new ATOM 0 HE2 LYS A 43 -12.941 1.537 14.197 1.00 63.34 H new ATOM 0 HE3 LYS A 43 -12.898 0.732 15.753 1.00 63.34 H new ATOM 0 HZ1 LYS A 43 -13.352 3.105 15.950 1.00 63.25 H new ATOM 0 HZ2 LYS A 43 -11.906 2.690 16.736 1.00 63.25 H new ATOM 0 HZ3 LYS A 43 -11.859 3.470 15.229 1.00 63.25 H new ATOM 736 N LYS A 44 -5.454 0.064 15.148 1.00 24.52 N ATOM 737 CA LYS A 44 -4.047 0.025 15.616 1.00 73.02 C ATOM 738 C LYS A 44 -3.275 1.241 15.068 1.00 31.01 C ATOM 739 O LYS A 44 -2.414 1.792 15.743 1.00 1.22 O ATOM 740 CB LYS A 44 -3.336 -1.299 15.197 1.00 23.45 C ATOM 741 CG LYS A 44 -4.097 -2.600 15.548 1.00 31.13 C ATOM 742 CD LYS A 44 -4.510 -2.713 17.034 1.00 51.44 C ATOM 743 CE LYS A 44 -3.323 -2.701 18.011 1.00 55.31 C ATOM 744 NZ LYS A 44 -2.328 -3.763 17.719 1.00 20.43 N ATOM 0 H LYS A 44 -5.674 -0.624 14.427 1.00 24.52 H new ATOM 0 HA LYS A 44 -4.056 0.064 16.705 1.00 73.02 H new ATOM 0 HB2 LYS A 44 -3.167 -1.276 14.120 1.00 23.45 H new ATOM 0 HB3 LYS A 44 -2.356 -1.332 15.673 1.00 23.45 H new ATOM 0 HG2 LYS A 44 -4.992 -2.662 14.928 1.00 31.13 H new ATOM 0 HG3 LYS A 44 -3.471 -3.454 15.291 1.00 31.13 H new ATOM 0 HD2 LYS A 44 -5.179 -1.888 17.279 1.00 51.44 H new ATOM 0 HD3 LYS A 44 -5.075 -3.634 17.175 1.00 51.44 H new ATOM 0 HE2 LYS A 44 -2.833 -1.728 17.968 1.00 55.31 H new ATOM 0 HE3 LYS A 44 -3.694 -2.827 19.028 1.00 55.31 H new ATOM 0 HZ1 LYS A 44 -1.585 -3.752 18.447 1.00 20.43 H new ATOM 0 HZ2 LYS A 44 -2.800 -4.690 17.719 1.00 20.43 H new ATOM 0 HZ3 LYS A 44 -1.901 -3.592 16.786 1.00 20.43 H new ATOM 758 N LEU A 45 -3.631 1.652 13.838 1.00 4.21 N ATOM 759 CA LEU A 45 -3.038 2.814 13.153 1.00 32.25 C ATOM 760 C LEU A 45 -3.591 4.127 13.748 1.00 64.40 C ATOM 761 O LEU A 45 -2.922 5.163 13.714 1.00 4.12 O ATOM 762 CB LEU A 45 -3.361 2.739 11.633 1.00 71.33 C ATOM 763 CG LEU A 45 -2.940 1.421 10.905 1.00 71.02 C ATOM 764 CD1 LEU A 45 -3.565 1.331 9.505 1.00 35.35 C ATOM 765 CD2 LEU A 45 -1.414 1.249 10.847 1.00 55.55 C ATOM 0 H LEU A 45 -4.347 1.181 13.285 1.00 4.21 H new ATOM 0 HA LEU A 45 -1.957 2.799 13.294 1.00 32.25 H new ATOM 0 HB2 LEU A 45 -4.435 2.875 11.503 1.00 71.33 H new ATOM 0 HB3 LEU A 45 -2.871 3.577 11.136 1.00 71.33 H new ATOM 0 HG LEU A 45 -3.329 0.594 11.499 1.00 71.02 H new ATOM 0 HD11 LEU A 45 -3.252 0.403 9.026 1.00 35.35 H new ATOM 0 HD12 LEU A 45 -4.652 1.347 9.590 1.00 35.35 H new ATOM 0 HD13 LEU A 45 -3.235 2.179 8.904 1.00 35.35 H new ATOM 0 HD21 LEU A 45 -1.172 0.319 10.332 1.00 55.55 H new ATOM 0 HD22 LEU A 45 -0.974 2.088 10.308 1.00 55.55 H new ATOM 0 HD23 LEU A 45 -1.013 1.218 11.860 1.00 55.55 H new ATOM 777 N ALA A 46 -4.835 4.060 14.273 1.00 54.42 N ATOM 778 CA ALA A 46 -5.539 5.226 14.830 1.00 72.02 C ATOM 779 C ALA A 46 -5.136 5.499 16.285 1.00 73.33 C ATOM 780 O ALA A 46 -4.799 6.639 16.631 1.00 33.34 O ATOM 781 CB ALA A 46 -7.060 5.025 14.722 1.00 11.13 C ATOM 0 H ALA A 46 -5.374 3.195 14.320 1.00 54.42 H new ATOM 0 HA ALA A 46 -5.249 6.099 14.245 1.00 72.02 H new ATOM 0 HB1 ALA A 46 -7.572 5.893 15.137 1.00 11.13 H new ATOM 0 HB2 ALA A 46 -7.338 4.906 13.675 1.00 11.13 H new ATOM 0 HB3 ALA A 46 -7.350 4.133 15.278 1.00 11.13 H new ATOM 787 N GLU A 47 -5.176 4.453 17.135 1.00 41.31 N ATOM 788 CA GLU A 47 -4.836 4.580 18.571 1.00 24.34 C ATOM 789 C GLU A 47 -3.320 4.723 18.751 1.00 41.43 C ATOM 790 O GLU A 47 -2.846 5.569 19.515 1.00 21.43 O ATOM 791 CB GLU A 47 -5.366 3.371 19.398 1.00 55.45 C ATOM 792 CG GLU A 47 -6.877 3.090 19.257 1.00 74.11 C ATOM 793 CD GLU A 47 -7.756 4.346 19.395 1.00 2.55 C ATOM 794 OE1 GLU A 47 -7.886 4.874 20.525 1.00 75.15 O ATOM 795 OE2 GLU A 47 -8.322 4.803 18.376 1.00 72.11 O ATOM 0 H GLU A 47 -5.440 3.509 16.854 1.00 41.31 H new ATOM 0 HA GLU A 47 -5.326 5.478 18.946 1.00 24.34 H new ATOM 0 HB2 GLU A 47 -4.817 2.478 19.099 1.00 55.45 H new ATOM 0 HB3 GLU A 47 -5.142 3.545 20.450 1.00 55.45 H new ATOM 0 HG2 GLU A 47 -7.063 2.632 18.286 1.00 74.11 H new ATOM 0 HG3 GLU A 47 -7.175 2.364 20.014 1.00 74.11 H new ATOM 802 N GLU A 48 -2.567 3.869 18.046 1.00 33.30 N ATOM 803 CA GLU A 48 -1.101 3.922 18.014 1.00 2.50 C ATOM 804 C GLU A 48 -0.671 4.565 16.691 1.00 40.13 C ATOM 805 O GLU A 48 -0.254 3.882 15.761 1.00 53.40 O ATOM 806 CB GLU A 48 -0.503 2.494 18.188 1.00 54.45 C ATOM 807 CG GLU A 48 -0.888 1.792 19.508 1.00 52.55 C ATOM 808 CD GLU A 48 -0.393 0.336 19.566 1.00 1.52 C ATOM 809 OE1 GLU A 48 -1.094 -0.553 19.047 1.00 73.54 O ATOM 810 OE2 GLU A 48 0.700 0.078 20.110 1.00 2.25 O ATOM 0 H GLU A 48 -2.961 3.118 17.479 1.00 33.30 H new ATOM 0 HA GLU A 48 -0.722 4.525 18.839 1.00 2.50 H new ATOM 0 HB2 GLU A 48 -0.829 1.874 17.353 1.00 54.45 H new ATOM 0 HB3 GLU A 48 0.583 2.560 18.130 1.00 54.45 H new ATOM 0 HG2 GLU A 48 -0.470 2.348 20.347 1.00 52.55 H new ATOM 0 HG3 GLU A 48 -1.972 1.809 19.622 1.00 52.55 H new ATOM 817 N LYS A 49 -0.841 5.899 16.608 1.00 21.23 N ATOM 818 CA LYS A 49 -0.503 6.704 15.407 1.00 75.00 C ATOM 819 C LYS A 49 0.971 7.199 15.465 1.00 72.33 C ATOM 820 O LYS A 49 1.393 8.096 14.718 1.00 52.20 O ATOM 821 CB LYS A 49 -1.532 7.868 15.290 1.00 33.43 C ATOM 822 CG LYS A 49 -1.446 8.705 13.987 1.00 44.01 C ATOM 823 CD LYS A 49 -2.638 9.662 13.796 1.00 71.11 C ATOM 824 CE LYS A 49 -2.866 10.621 14.979 1.00 10.13 C ATOM 825 NZ LYS A 49 -1.689 11.479 15.254 1.00 54.10 N ATOM 0 H LYS A 49 -1.219 6.456 17.374 1.00 21.23 H new ATOM 0 HA LYS A 49 -0.572 6.093 14.507 1.00 75.00 H new ATOM 0 HB2 LYS A 49 -2.536 7.452 15.368 1.00 33.43 H new ATOM 0 HB3 LYS A 49 -1.397 8.536 16.140 1.00 33.43 H new ATOM 0 HG2 LYS A 49 -0.522 9.284 13.996 1.00 44.01 H new ATOM 0 HG3 LYS A 49 -1.391 8.030 13.133 1.00 44.01 H new ATOM 0 HD2 LYS A 49 -2.479 10.249 12.891 1.00 71.11 H new ATOM 0 HD3 LYS A 49 -3.542 9.073 13.639 1.00 71.11 H new ATOM 0 HE2 LYS A 49 -3.729 11.252 14.769 1.00 10.13 H new ATOM 0 HE3 LYS A 49 -3.104 10.041 15.871 1.00 10.13 H new ATOM 0 HZ1 LYS A 49 -1.896 12.105 16.059 1.00 54.10 H new ATOM 0 HZ2 LYS A 49 -0.869 10.881 15.482 1.00 54.10 H new ATOM 0 HZ3 LYS A 49 -1.475 12.054 14.414 1.00 54.10 H new ATOM 839 N ASN A 50 1.754 6.562 16.356 1.00 65.42 N ATOM 840 CA ASN A 50 3.212 6.746 16.468 1.00 72.23 C ATOM 841 C ASN A 50 3.918 6.328 15.165 1.00 24.10 C ATOM 842 O ASN A 50 3.319 5.666 14.304 1.00 23.32 O ATOM 843 CB ASN A 50 3.752 5.916 17.666 1.00 13.02 C ATOM 844 CG ASN A 50 3.582 4.386 17.513 1.00 1.34 C ATOM 845 OD1 ASN A 50 2.656 3.895 16.867 1.00 54.13 O ATOM 846 ND2 ASN A 50 4.476 3.623 18.119 1.00 53.34 N ATOM 0 H ASN A 50 1.383 5.893 17.030 1.00 65.42 H new ATOM 0 HA ASN A 50 3.420 7.802 16.640 1.00 72.23 H new ATOM 0 HB2 ASN A 50 4.810 6.140 17.799 1.00 13.02 H new ATOM 0 HB3 ASN A 50 3.241 6.237 18.574 1.00 13.02 H new ATOM 0 HD21 ASN A 50 4.406 2.607 18.056 1.00 53.34 H new ATOM 0 HD22 ASN A 50 5.236 4.050 18.649 1.00 53.34 H new ATOM 853 N PHE A 51 5.188 6.711 15.024 1.00 33.32 N ATOM 854 CA PHE A 51 5.961 6.419 13.817 1.00 23.53 C ATOM 855 C PHE A 51 6.303 4.919 13.759 1.00 60.52 C ATOM 856 O PHE A 51 6.820 4.362 14.734 1.00 3.50 O ATOM 857 CB PHE A 51 7.239 7.288 13.767 1.00 25.21 C ATOM 858 CG PHE A 51 7.845 7.396 12.370 1.00 71.32 C ATOM 859 CD1 PHE A 51 8.740 6.439 11.886 1.00 12.21 C ATOM 860 CD2 PHE A 51 7.504 8.460 11.532 1.00 72.31 C ATOM 861 CE1 PHE A 51 9.269 6.545 10.619 1.00 54.53 C ATOM 862 CE2 PHE A 51 8.038 8.564 10.266 1.00 62.10 C ATOM 863 CZ PHE A 51 8.918 7.609 9.812 1.00 12.21 C ATOM 0 H PHE A 51 5.705 7.227 15.736 1.00 33.32 H new ATOM 0 HA PHE A 51 5.359 6.665 12.943 1.00 23.53 H new ATOM 0 HB2 PHE A 51 7.004 8.288 14.131 1.00 25.21 H new ATOM 0 HB3 PHE A 51 7.982 6.868 14.446 1.00 25.21 H new ATOM 0 HD1 PHE A 51 9.021 5.606 12.513 1.00 12.21 H new ATOM 0 HD2 PHE A 51 6.812 9.212 11.881 1.00 72.31 H new ATOM 0 HE1 PHE A 51 9.958 5.796 10.257 1.00 54.53 H new ATOM 0 HE2 PHE A 51 7.766 9.394 9.631 1.00 62.10 H new ATOM 0 HZ PHE A 51 9.336 7.692 8.820 1.00 12.21 H new ATOM 873 N GLU A 52 5.999 4.286 12.614 1.00 3.32 N ATOM 874 CA GLU A 52 6.272 2.863 12.380 1.00 21.31 C ATOM 875 C GLU A 52 6.229 2.573 10.871 1.00 71.35 C ATOM 876 O GLU A 52 5.462 3.190 10.134 1.00 2.41 O ATOM 877 CB GLU A 52 5.246 1.971 13.146 1.00 14.24 C ATOM 878 CG GLU A 52 5.492 0.448 13.030 1.00 32.21 C ATOM 879 CD GLU A 52 6.871 0.009 13.557 1.00 4.53 C ATOM 880 OE1 GLU A 52 7.012 -0.204 14.781 1.00 2.23 O ATOM 881 OE2 GLU A 52 7.818 -0.138 12.751 1.00 1.23 O ATOM 0 H GLU A 52 5.555 4.751 11.822 1.00 3.32 H new ATOM 0 HA GLU A 52 7.266 2.624 12.758 1.00 21.31 H new ATOM 0 HB2 GLU A 52 5.262 2.248 14.200 1.00 14.24 H new ATOM 0 HB3 GLU A 52 4.246 2.192 12.774 1.00 14.24 H new ATOM 0 HG2 GLU A 52 4.715 -0.081 13.582 1.00 32.21 H new ATOM 0 HG3 GLU A 52 5.399 0.151 11.985 1.00 32.21 H new ATOM 888 N LYS A 53 7.082 1.645 10.433 1.00 60.13 N ATOM 889 CA LYS A 53 7.145 1.176 9.046 1.00 24.23 C ATOM 890 C LYS A 53 6.264 -0.080 8.915 1.00 4.32 C ATOM 891 O LYS A 53 6.631 -1.133 9.432 1.00 23.33 O ATOM 892 CB LYS A 53 8.627 0.858 8.695 1.00 42.24 C ATOM 893 CG LYS A 53 9.591 2.051 8.894 1.00 33.34 C ATOM 894 CD LYS A 53 11.088 1.654 8.795 1.00 42.32 C ATOM 895 CE LYS A 53 12.022 2.807 9.204 1.00 43.35 C ATOM 896 NZ LYS A 53 13.448 2.389 9.241 1.00 52.12 N ATOM 0 H LYS A 53 7.761 1.190 11.043 1.00 60.13 H new ATOM 0 HA LYS A 53 6.779 1.936 8.356 1.00 24.23 H new ATOM 0 HB2 LYS A 53 8.965 0.025 9.311 1.00 42.24 H new ATOM 0 HB3 LYS A 53 8.681 0.530 7.657 1.00 42.24 H new ATOM 0 HG2 LYS A 53 9.374 2.813 8.145 1.00 33.34 H new ATOM 0 HG3 LYS A 53 9.405 2.500 9.870 1.00 33.34 H new ATOM 0 HD2 LYS A 53 11.277 0.791 9.434 1.00 42.32 H new ATOM 0 HD3 LYS A 53 11.315 1.350 7.773 1.00 42.32 H new ATOM 0 HE2 LYS A 53 11.905 3.633 8.502 1.00 43.35 H new ATOM 0 HE3 LYS A 53 11.729 3.179 10.186 1.00 43.35 H new ATOM 0 HZ1 LYS A 53 14.040 3.197 9.521 1.00 52.12 H new ATOM 0 HZ2 LYS A 53 13.566 1.618 9.929 1.00 52.12 H new ATOM 0 HZ3 LYS A 53 13.737 2.058 8.298 1.00 52.12 H new ATOM 910 N ILE A 54 5.073 0.055 8.293 1.00 64.20 N ATOM 911 CA ILE A 54 4.129 -1.073 8.090 1.00 31.20 C ATOM 912 C ILE A 54 3.773 -1.199 6.592 1.00 53.31 C ATOM 913 O ILE A 54 3.496 -0.203 5.919 1.00 5.45 O ATOM 914 CB ILE A 54 2.798 -0.913 8.942 1.00 54.45 C ATOM 915 CG1 ILE A 54 3.129 -0.784 10.465 1.00 13.23 C ATOM 916 CG2 ILE A 54 1.822 -2.098 8.694 1.00 52.34 C ATOM 917 CD1 ILE A 54 1.922 -0.658 11.388 1.00 72.23 C ATOM 0 H ILE A 54 4.737 0.942 7.918 1.00 64.20 H new ATOM 0 HA ILE A 54 4.631 -1.977 8.434 1.00 31.20 H new ATOM 0 HB ILE A 54 2.303 0.002 8.616 1.00 54.45 H new ATOM 0 HG12 ILE A 54 3.708 -1.656 10.769 1.00 13.23 H new ATOM 0 HG13 ILE A 54 3.767 0.088 10.608 1.00 13.23 H new ATOM 0 HG21 ILE A 54 0.921 -1.959 9.292 1.00 52.34 H new ATOM 0 HG22 ILE A 54 1.555 -2.134 7.638 1.00 52.34 H new ATOM 0 HG23 ILE A 54 2.305 -3.033 8.979 1.00 52.34 H new ATOM 0 HD11 ILE A 54 2.261 -0.574 12.421 1.00 72.23 H new ATOM 0 HD12 ILE A 54 1.351 0.231 11.120 1.00 72.23 H new ATOM 0 HD13 ILE A 54 1.290 -1.540 11.284 1.00 72.23 H new ATOM 929 N LEU A 55 3.798 -2.441 6.100 1.00 20.53 N ATOM 930 CA LEU A 55 3.374 -2.825 4.749 1.00 42.34 C ATOM 931 C LEU A 55 2.030 -3.556 4.876 1.00 3.01 C ATOM 932 O LEU A 55 1.970 -4.651 5.450 1.00 50.05 O ATOM 933 CB LEU A 55 4.422 -3.777 4.098 1.00 5.22 C ATOM 934 CG LEU A 55 4.118 -4.229 2.621 1.00 21.34 C ATOM 935 CD1 LEU A 55 4.540 -3.147 1.618 1.00 42.02 C ATOM 936 CD2 LEU A 55 4.762 -5.590 2.281 1.00 73.52 C ATOM 0 H LEU A 55 4.125 -3.235 6.650 1.00 20.53 H new ATOM 0 HA LEU A 55 3.282 -1.939 4.120 1.00 42.34 H new ATOM 0 HB2 LEU A 55 5.393 -3.281 4.113 1.00 5.22 H new ATOM 0 HB3 LEU A 55 4.509 -4.668 4.719 1.00 5.22 H new ATOM 0 HG LEU A 55 3.039 -4.364 2.543 1.00 21.34 H new ATOM 0 HD11 LEU A 55 4.319 -3.484 0.605 1.00 42.02 H new ATOM 0 HD12 LEU A 55 3.991 -2.228 1.822 1.00 42.02 H new ATOM 0 HD13 LEU A 55 5.610 -2.960 1.713 1.00 42.02 H new ATOM 0 HD21 LEU A 55 4.524 -5.858 1.252 1.00 73.52 H new ATOM 0 HD22 LEU A 55 5.844 -5.520 2.397 1.00 73.52 H new ATOM 0 HD23 LEU A 55 4.374 -6.354 2.954 1.00 73.52 H new ATOM 948 N ILE A 56 0.949 -2.935 4.405 1.00 2.23 N ATOM 949 CA ILE A 56 -0.375 -3.565 4.391 1.00 3.22 C ATOM 950 C ILE A 56 -0.615 -4.249 3.033 1.00 51.03 C ATOM 951 O ILE A 56 -0.499 -3.628 1.972 1.00 4.31 O ATOM 952 CB ILE A 56 -1.520 -2.538 4.700 1.00 41.14 C ATOM 953 CG1 ILE A 56 -1.394 -1.976 6.155 1.00 12.23 C ATOM 954 CG2 ILE A 56 -2.916 -3.168 4.459 1.00 41.13 C ATOM 955 CD1 ILE A 56 -1.518 -3.020 7.259 1.00 43.41 C ATOM 0 H ILE A 56 0.963 -1.989 4.025 1.00 2.23 H new ATOM 0 HA ILE A 56 -0.395 -4.314 5.182 1.00 3.22 H new ATOM 0 HB ILE A 56 -1.413 -1.700 4.011 1.00 41.14 H new ATOM 0 HG12 ILE A 56 -0.430 -1.477 6.254 1.00 12.23 H new ATOM 0 HG13 ILE A 56 -2.163 -1.218 6.304 1.00 12.23 H new ATOM 0 HG21 ILE A 56 -3.690 -2.433 4.681 1.00 41.13 H new ATOM 0 HG22 ILE A 56 -3.000 -3.480 3.418 1.00 41.13 H new ATOM 0 HG23 ILE A 56 -3.041 -4.034 5.108 1.00 41.13 H new ATOM 0 HD11 ILE A 56 -1.418 -2.536 8.230 1.00 43.41 H new ATOM 0 HD12 ILE A 56 -2.492 -3.504 7.194 1.00 43.41 H new ATOM 0 HD13 ILE A 56 -0.733 -3.767 7.143 1.00 43.41 H new ATOM 967 N LYS A 57 -0.936 -5.537 3.109 1.00 61.23 N ATOM 968 CA LYS A 57 -1.309 -6.375 1.974 1.00 31.15 C ATOM 969 C LYS A 57 -2.841 -6.398 1.810 1.00 43.04 C ATOM 970 O LYS A 57 -3.579 -6.400 2.804 1.00 14.04 O ATOM 971 CB LYS A 57 -0.783 -7.819 2.216 1.00 1.30 C ATOM 972 CG LYS A 57 -1.390 -8.881 1.277 1.00 55.05 C ATOM 973 CD LYS A 57 -0.952 -10.310 1.618 1.00 32.21 C ATOM 974 CE LYS A 57 -1.664 -11.364 0.760 1.00 53.43 C ATOM 975 NZ LYS A 57 -1.220 -12.742 1.096 1.00 64.25 N ATOM 0 H LYS A 57 -0.944 -6.044 3.994 1.00 61.23 H new ATOM 0 HA LYS A 57 -0.868 -5.969 1.064 1.00 31.15 H new ATOM 0 HB2 LYS A 57 0.301 -7.823 2.098 1.00 1.30 H new ATOM 0 HB3 LYS A 57 -0.992 -8.101 3.248 1.00 1.30 H new ATOM 0 HG2 LYS A 57 -2.477 -8.820 1.325 1.00 55.05 H new ATOM 0 HG3 LYS A 57 -1.103 -8.655 0.250 1.00 55.05 H new ATOM 0 HD2 LYS A 57 0.125 -10.399 1.478 1.00 32.21 H new ATOM 0 HD3 LYS A 57 -1.154 -10.507 2.671 1.00 32.21 H new ATOM 0 HE2 LYS A 57 -2.741 -11.284 0.906 1.00 53.43 H new ATOM 0 HE3 LYS A 57 -1.469 -11.166 -0.294 1.00 53.43 H new ATOM 0 HZ1 LYS A 57 -1.459 -13.384 0.314 1.00 64.25 H new ATOM 0 HZ2 LYS A 57 -0.191 -12.748 1.247 1.00 64.25 H new ATOM 0 HZ3 LYS A 57 -1.699 -13.059 1.963 1.00 64.25 H new ATOM 989 N SER A 58 -3.283 -6.439 0.545 1.00 1.43 N ATOM 990 CA SER A 58 -4.671 -6.708 0.156 1.00 54.55 C ATOM 991 C SER A 58 -4.715 -6.982 -1.363 1.00 34.11 C ATOM 992 O SER A 58 -3.697 -6.889 -2.061 1.00 1.30 O ATOM 993 CB SER A 58 -5.606 -5.527 0.549 1.00 45.25 C ATOM 994 OG SER A 58 -6.974 -5.810 0.277 1.00 1.43 O ATOM 0 H SER A 58 -2.669 -6.282 -0.254 1.00 1.43 H new ATOM 0 HA SER A 58 -5.035 -7.585 0.691 1.00 54.55 H new ATOM 0 HB2 SER A 58 -5.486 -5.309 1.610 1.00 45.25 H new ATOM 0 HB3 SER A 58 -5.307 -4.632 0.004 1.00 45.25 H new ATOM 0 HG SER A 58 -7.525 -5.044 0.540 1.00 1.43 H new ATOM 1000 N ASN A 59 -5.894 -7.363 -1.848 1.00 54.44 N ATOM 1001 CA ASN A 59 -6.182 -7.532 -3.286 1.00 1.31 C ATOM 1002 C ASN A 59 -7.621 -7.069 -3.575 1.00 53.54 C ATOM 1003 O ASN A 59 -8.183 -7.361 -4.638 1.00 43.51 O ATOM 1004 CB ASN A 59 -5.933 -9.005 -3.731 1.00 61.44 C ATOM 1005 CG ASN A 59 -6.616 -10.067 -2.851 1.00 34.52 C ATOM 1006 OD1 ASN A 59 -7.670 -9.839 -2.252 1.00 13.23 O ATOM 1007 ND2 ASN A 59 -6.014 -11.245 -2.772 1.00 54.13 N ATOM 0 H ASN A 59 -6.695 -7.568 -1.251 1.00 54.44 H new ATOM 0 HA ASN A 59 -5.503 -6.912 -3.872 1.00 1.31 H new ATOM 0 HB2 ASN A 59 -6.282 -9.124 -4.757 1.00 61.44 H new ATOM 0 HB3 ASN A 59 -4.859 -9.192 -3.735 1.00 61.44 H new ATOM 0 HD21 ASN A 59 -6.422 -11.989 -2.206 1.00 54.13 H new ATOM 0 HD22 ASN A 59 -5.143 -11.408 -3.277 1.00 54.13 H new ATOM 1014 N ASP A 60 -8.194 -6.313 -2.615 1.00 63.34 N ATOM 1015 CA ASP A 60 -9.557 -5.776 -2.687 1.00 44.54 C ATOM 1016 C ASP A 60 -9.514 -4.264 -2.415 1.00 45.15 C ATOM 1017 O ASP A 60 -9.424 -3.831 -1.259 1.00 10.42 O ATOM 1018 CB ASP A 60 -10.488 -6.506 -1.680 1.00 73.13 C ATOM 1019 CG ASP A 60 -11.930 -5.969 -1.691 1.00 35.25 C ATOM 1020 OD1 ASP A 60 -12.547 -5.941 -2.771 1.00 71.33 O ATOM 1021 OD2 ASP A 60 -12.445 -5.560 -0.632 1.00 24.00 O ATOM 0 H ASP A 60 -7.708 -6.058 -1.755 1.00 63.34 H new ATOM 0 HA ASP A 60 -9.965 -5.945 -3.684 1.00 44.54 H new ATOM 0 HB2 ASP A 60 -10.502 -7.571 -1.913 1.00 73.13 H new ATOM 0 HB3 ASP A 60 -10.077 -6.405 -0.676 1.00 73.13 H new ATOM 1026 N LYS A 61 -9.559 -3.485 -3.510 1.00 34.03 N ATOM 1027 CA LYS A 61 -9.465 -2.007 -3.503 1.00 41.03 C ATOM 1028 C LYS A 61 -10.579 -1.310 -2.687 1.00 4.13 C ATOM 1029 O LYS A 61 -10.450 -0.117 -2.386 1.00 44.21 O ATOM 1030 CB LYS A 61 -9.437 -1.430 -4.958 1.00 65.20 C ATOM 1031 CG LYS A 61 -10.672 -1.752 -5.855 1.00 32.11 C ATOM 1032 CD LYS A 61 -10.558 -3.114 -6.588 1.00 22.44 C ATOM 1033 CE LYS A 61 -11.750 -3.406 -7.506 1.00 24.41 C ATOM 1034 NZ LYS A 61 -11.572 -4.690 -8.235 1.00 44.33 N ATOM 0 H LYS A 61 -9.664 -3.871 -4.448 1.00 34.03 H new ATOM 0 HA LYS A 61 -8.522 -1.787 -3.002 1.00 41.03 H new ATOM 0 HB2 LYS A 61 -9.334 -0.347 -4.894 1.00 65.20 H new ATOM 0 HB3 LYS A 61 -8.544 -1.806 -5.458 1.00 65.20 H new ATOM 0 HG2 LYS A 61 -11.570 -1.753 -5.238 1.00 32.11 H new ATOM 0 HG3 LYS A 61 -10.793 -0.959 -6.593 1.00 32.11 H new ATOM 0 HD2 LYS A 61 -9.642 -3.126 -7.178 1.00 22.44 H new ATOM 0 HD3 LYS A 61 -10.472 -3.911 -5.849 1.00 22.44 H new ATOM 0 HE2 LYS A 61 -12.665 -3.445 -6.915 1.00 24.41 H new ATOM 0 HE3 LYS A 61 -11.868 -2.593 -8.222 1.00 24.41 H new ATOM 0 HZ1 LYS A 61 -12.335 -4.801 -8.933 1.00 44.33 H new ATOM 0 HZ2 LYS A 61 -10.653 -4.688 -8.723 1.00 44.33 H new ATOM 0 HZ3 LYS A 61 -11.603 -5.480 -7.559 1.00 44.33 H new ATOM 1048 N GLN A 62 -11.656 -2.051 -2.331 1.00 51.24 N ATOM 1049 CA GLN A 62 -12.748 -1.527 -1.485 1.00 63.12 C ATOM 1050 C GLN A 62 -12.192 -1.154 -0.097 1.00 10.12 C ATOM 1051 O GLN A 62 -12.365 -0.017 0.376 1.00 41.22 O ATOM 1052 CB GLN A 62 -13.882 -2.577 -1.342 1.00 12.34 C ATOM 1053 CG GLN A 62 -14.487 -3.072 -2.672 1.00 0.42 C ATOM 1054 CD GLN A 62 -15.136 -1.964 -3.507 1.00 24.44 C ATOM 1055 OE1 GLN A 62 -14.491 -1.333 -4.349 1.00 70.12 O ATOM 1056 NE2 GLN A 62 -16.416 -1.717 -3.276 1.00 20.33 N ATOM 0 H GLN A 62 -11.789 -3.020 -2.621 1.00 51.24 H new ATOM 0 HA GLN A 62 -13.164 -0.638 -1.958 1.00 63.12 H new ATOM 0 HB2 GLN A 62 -13.494 -3.436 -0.795 1.00 12.34 H new ATOM 0 HB3 GLN A 62 -14.679 -2.147 -0.736 1.00 12.34 H new ATOM 0 HG2 GLN A 62 -13.703 -3.547 -3.262 1.00 0.42 H new ATOM 0 HG3 GLN A 62 -15.233 -3.837 -2.458 1.00 0.42 H new ATOM 0 HE21 GLN A 62 -16.921 -2.257 -2.573 1.00 20.33 H new ATOM 0 HE22 GLN A 62 -16.897 -0.987 -3.801 1.00 20.33 H new ATOM 1065 N LEU A 63 -11.477 -2.133 0.497 1.00 72.04 N ATOM 1066 CA LEU A 63 -10.806 -2.002 1.803 1.00 44.44 C ATOM 1067 C LEU A 63 -9.840 -0.803 1.822 1.00 62.24 C ATOM 1068 O LEU A 63 -9.780 -0.067 2.803 1.00 55.11 O ATOM 1069 CB LEU A 63 -10.028 -3.315 2.130 1.00 62.23 C ATOM 1070 CG LEU A 63 -10.893 -4.608 2.239 1.00 61.43 C ATOM 1071 CD1 LEU A 63 -10.022 -5.863 2.476 1.00 22.42 C ATOM 1072 CD2 LEU A 63 -11.975 -4.455 3.323 1.00 44.20 C ATOM 0 H LEU A 63 -11.349 -3.052 0.073 1.00 72.04 H new ATOM 0 HA LEU A 63 -11.571 -1.829 2.560 1.00 44.44 H new ATOM 0 HB2 LEU A 63 -9.274 -3.469 1.359 1.00 62.23 H new ATOM 0 HB3 LEU A 63 -9.497 -3.175 3.072 1.00 62.23 H new ATOM 0 HG LEU A 63 -11.397 -4.750 1.283 1.00 61.43 H new ATOM 0 HD11 LEU A 63 -10.662 -6.742 2.546 1.00 22.42 H new ATOM 0 HD12 LEU A 63 -9.327 -5.986 1.645 1.00 22.42 H new ATOM 0 HD13 LEU A 63 -9.462 -5.747 3.404 1.00 22.42 H new ATOM 0 HD21 LEU A 63 -12.565 -5.370 3.380 1.00 44.20 H new ATOM 0 HD22 LEU A 63 -11.501 -4.269 4.287 1.00 44.20 H new ATOM 0 HD23 LEU A 63 -12.626 -3.618 3.071 1.00 44.20 H new ATOM 1084 N LEU A 64 -9.115 -0.613 0.703 1.00 14.41 N ATOM 1085 CA LEU A 64 -8.106 0.450 0.559 1.00 12.32 C ATOM 1086 C LEU A 64 -8.755 1.844 0.582 1.00 12.43 C ATOM 1087 O LEU A 64 -8.235 2.740 1.245 1.00 25.51 O ATOM 1088 CB LEU A 64 -7.257 0.259 -0.730 1.00 13.40 C ATOM 1089 CG LEU A 64 -6.164 -0.864 -0.673 1.00 41.05 C ATOM 1090 CD1 LEU A 64 -6.768 -2.269 -0.544 1.00 42.21 C ATOM 1091 CD2 LEU A 64 -5.232 -0.784 -1.885 1.00 40.53 C ATOM 0 H LEU A 64 -9.214 -1.195 -0.129 1.00 14.41 H new ATOM 0 HA LEU A 64 -7.435 0.376 1.415 1.00 12.32 H new ATOM 0 HB2 LEU A 64 -7.932 0.039 -1.557 1.00 13.40 H new ATOM 0 HB3 LEU A 64 -6.766 1.204 -0.962 1.00 13.40 H new ATOM 0 HG LEU A 64 -5.579 -0.686 0.230 1.00 41.05 H new ATOM 0 HD11 LEU A 64 -5.967 -3.008 -0.509 1.00 42.21 H new ATOM 0 HD12 LEU A 64 -7.357 -2.329 0.371 1.00 42.21 H new ATOM 0 HD13 LEU A 64 -7.409 -2.470 -1.402 1.00 42.21 H new ATOM 0 HD21 LEU A 64 -4.483 -1.574 -1.821 1.00 40.53 H new ATOM 0 HD22 LEU A 64 -5.813 -0.908 -2.799 1.00 40.53 H new ATOM 0 HD23 LEU A 64 -4.736 0.186 -1.899 1.00 40.53 H new ATOM 1103 N LYS A 65 -9.900 2.011 -0.127 1.00 11.52 N ATOM 1104 CA LYS A 65 -10.643 3.293 -0.150 1.00 74.43 C ATOM 1105 C LYS A 65 -11.040 3.691 1.275 1.00 51.13 C ATOM 1106 O LYS A 65 -10.658 4.760 1.760 1.00 0.22 O ATOM 1107 CB LYS A 65 -11.923 3.194 -1.025 1.00 22.21 C ATOM 1108 CG LYS A 65 -11.655 2.957 -2.519 1.00 15.03 C ATOM 1109 CD LYS A 65 -12.942 2.897 -3.380 1.00 60.23 C ATOM 1110 CE LYS A 65 -13.836 1.695 -3.038 1.00 55.25 C ATOM 1111 NZ LYS A 65 -15.021 1.612 -3.933 1.00 31.03 N ATOM 0 H LYS A 65 -10.327 1.274 -0.689 1.00 11.52 H new ATOM 0 HA LYS A 65 -9.986 4.048 -0.582 1.00 74.43 H new ATOM 0 HB2 LYS A 65 -12.545 2.382 -0.647 1.00 22.21 H new ATOM 0 HB3 LYS A 65 -12.497 4.114 -0.913 1.00 22.21 H new ATOM 0 HG2 LYS A 65 -11.014 3.754 -2.895 1.00 15.03 H new ATOM 0 HG3 LYS A 65 -11.105 2.023 -2.637 1.00 15.03 H new ATOM 0 HD2 LYS A 65 -13.510 3.817 -3.240 1.00 60.23 H new ATOM 0 HD3 LYS A 65 -12.666 2.850 -4.433 1.00 60.23 H new ATOM 0 HE2 LYS A 65 -13.255 0.776 -3.119 1.00 55.25 H new ATOM 0 HE3 LYS A 65 -14.168 1.772 -2.003 1.00 55.25 H new ATOM 0 HZ1 LYS A 65 -15.876 1.874 -3.402 1.00 31.03 H new ATOM 0 HZ2 LYS A 65 -14.897 2.264 -4.734 1.00 31.03 H new ATOM 0 HZ3 LYS A 65 -15.119 0.640 -4.290 1.00 31.03 H new ATOM 1125 N GLU A 66 -11.740 2.751 1.934 1.00 74.50 N ATOM 1126 CA GLU A 66 -12.326 2.933 3.272 1.00 73.12 C ATOM 1127 C GLU A 66 -11.246 3.190 4.339 1.00 51.50 C ATOM 1128 O GLU A 66 -11.465 3.964 5.279 1.00 42.42 O ATOM 1129 CB GLU A 66 -13.153 1.680 3.625 1.00 2.51 C ATOM 1130 CG GLU A 66 -14.271 1.364 2.616 1.00 4.22 C ATOM 1131 CD GLU A 66 -14.969 0.030 2.902 1.00 53.41 C ATOM 1132 OE1 GLU A 66 -15.831 -0.019 3.801 1.00 35.10 O ATOM 1133 OE2 GLU A 66 -14.665 -0.970 2.226 1.00 11.22 O ATOM 0 H GLU A 66 -11.917 1.826 1.543 1.00 74.50 H new ATOM 0 HA GLU A 66 -12.970 3.812 3.257 1.00 73.12 H new ATOM 0 HB2 GLU A 66 -12.484 0.822 3.691 1.00 2.51 H new ATOM 0 HB3 GLU A 66 -13.596 1.815 4.612 1.00 2.51 H new ATOM 0 HG2 GLU A 66 -15.009 2.166 2.635 1.00 4.22 H new ATOM 0 HG3 GLU A 66 -13.851 1.341 1.610 1.00 4.22 H new ATOM 1140 N MET A 67 -10.082 2.534 4.164 1.00 20.23 N ATOM 1141 CA MET A 67 -8.896 2.734 5.008 1.00 63.32 C ATOM 1142 C MET A 67 -8.455 4.207 4.961 1.00 65.32 C ATOM 1143 O MET A 67 -8.349 4.864 5.999 1.00 2.02 O ATOM 1144 CB MET A 67 -7.731 1.829 4.523 1.00 11.02 C ATOM 1145 CG MET A 67 -6.414 2.056 5.272 1.00 2.14 C ATOM 1146 SD MET A 67 -5.049 1.084 4.642 1.00 65.11 S ATOM 1147 CE MET A 67 -5.531 -0.550 5.168 1.00 35.53 C ATOM 0 H MET A 67 -9.941 1.845 3.425 1.00 20.23 H new ATOM 0 HA MET A 67 -9.153 2.467 6.033 1.00 63.32 H new ATOM 0 HB2 MET A 67 -8.025 0.785 4.633 1.00 11.02 H new ATOM 0 HB3 MET A 67 -7.567 2.003 3.460 1.00 11.02 H new ATOM 0 HG2 MET A 67 -6.152 3.113 5.216 1.00 2.14 H new ATOM 0 HG3 MET A 67 -6.561 1.820 6.326 1.00 2.14 H new ATOM 0 HE1 MET A 67 -4.758 -0.967 5.814 1.00 35.53 H new ATOM 0 HE2 MET A 67 -6.471 -0.493 5.717 1.00 35.53 H new ATOM 0 HE3 MET A 67 -5.658 -1.190 4.295 1.00 35.53 H new ATOM 1157 N LEU A 68 -8.255 4.703 3.725 1.00 73.52 N ATOM 1158 CA LEU A 68 -7.743 6.054 3.452 1.00 54.10 C ATOM 1159 C LEU A 68 -8.727 7.141 3.929 1.00 74.40 C ATOM 1160 O LEU A 68 -8.297 8.229 4.308 1.00 24.10 O ATOM 1161 CB LEU A 68 -7.441 6.194 1.937 1.00 22.12 C ATOM 1162 CG LEU A 68 -6.337 5.230 1.373 1.00 43.43 C ATOM 1163 CD1 LEU A 68 -6.337 5.219 -0.164 1.00 61.00 C ATOM 1164 CD2 LEU A 68 -4.937 5.576 1.919 1.00 22.11 C ATOM 0 H LEU A 68 -8.448 4.167 2.879 1.00 73.52 H new ATOM 0 HA LEU A 68 -6.820 6.198 4.014 1.00 54.10 H new ATOM 0 HB2 LEU A 68 -8.364 6.023 1.383 1.00 22.12 H new ATOM 0 HB3 LEU A 68 -7.136 7.222 1.739 1.00 22.12 H new ATOM 0 HG LEU A 68 -6.584 4.227 1.719 1.00 43.43 H new ATOM 0 HD11 LEU A 68 -5.562 4.542 -0.523 1.00 61.00 H new ATOM 0 HD12 LEU A 68 -7.309 4.882 -0.525 1.00 61.00 H new ATOM 0 HD13 LEU A 68 -6.141 6.225 -0.535 1.00 61.00 H new ATOM 0 HD21 LEU A 68 -4.203 4.885 1.504 1.00 22.11 H new ATOM 0 HD22 LEU A 68 -4.677 6.595 1.634 1.00 22.11 H new ATOM 0 HD23 LEU A 68 -4.939 5.492 3.006 1.00 22.11 H new ATOM 1176 N GLU A 69 -10.044 6.822 3.929 1.00 22.13 N ATOM 1177 CA GLU A 69 -11.095 7.736 4.439 1.00 73.21 C ATOM 1178 C GLU A 69 -10.931 7.974 5.953 1.00 2.23 C ATOM 1179 O GLU A 69 -11.216 9.063 6.455 1.00 41.12 O ATOM 1180 CB GLU A 69 -12.516 7.179 4.129 1.00 3.20 C ATOM 1181 CG GLU A 69 -12.810 6.957 2.630 1.00 2.44 C ATOM 1182 CD GLU A 69 -12.641 8.222 1.763 1.00 23.44 C ATOM 1183 OE1 GLU A 69 -11.522 8.471 1.258 1.00 15.14 O ATOM 1184 OE2 GLU A 69 -13.624 8.977 1.589 1.00 65.33 O ATOM 0 H GLU A 69 -10.405 5.934 3.580 1.00 22.13 H new ATOM 0 HA GLU A 69 -10.981 8.691 3.927 1.00 73.21 H new ATOM 0 HB2 GLU A 69 -12.643 6.232 4.654 1.00 3.20 H new ATOM 0 HB3 GLU A 69 -13.257 7.869 4.532 1.00 3.20 H new ATOM 0 HG2 GLU A 69 -12.147 6.179 2.252 1.00 2.44 H new ATOM 0 HG3 GLU A 69 -13.830 6.588 2.521 1.00 2.44 H new ATOM 1191 N LEU A 70 -10.470 6.937 6.669 1.00 42.10 N ATOM 1192 CA LEU A 70 -10.173 7.015 8.114 1.00 63.10 C ATOM 1193 C LEU A 70 -8.806 7.702 8.341 1.00 32.44 C ATOM 1194 O LEU A 70 -8.628 8.452 9.308 1.00 40.10 O ATOM 1195 CB LEU A 70 -10.186 5.590 8.720 1.00 33.45 C ATOM 1196 CG LEU A 70 -11.518 4.791 8.566 1.00 12.00 C ATOM 1197 CD1 LEU A 70 -11.345 3.322 9.010 1.00 53.02 C ATOM 1198 CD2 LEU A 70 -12.676 5.482 9.321 1.00 13.12 C ATOM 0 H LEU A 70 -10.291 6.018 6.265 1.00 42.10 H new ATOM 0 HA LEU A 70 -10.936 7.613 8.612 1.00 63.10 H new ATOM 0 HB2 LEU A 70 -9.385 5.013 8.258 1.00 33.45 H new ATOM 0 HB3 LEU A 70 -9.953 5.667 9.782 1.00 33.45 H new ATOM 0 HG LEU A 70 -11.779 4.782 7.508 1.00 12.00 H new ATOM 0 HD11 LEU A 70 -12.290 2.792 8.891 1.00 53.02 H new ATOM 0 HD12 LEU A 70 -10.581 2.844 8.397 1.00 53.02 H new ATOM 0 HD13 LEU A 70 -11.041 3.292 10.056 1.00 53.02 H new ATOM 0 HD21 LEU A 70 -13.590 4.902 9.195 1.00 13.12 H new ATOM 0 HD22 LEU A 70 -12.431 5.548 10.381 1.00 13.12 H new ATOM 0 HD23 LEU A 70 -12.825 6.485 8.920 1.00 13.12 H new ATOM 1210 N ILE A 71 -7.858 7.448 7.409 1.00 61.41 N ATOM 1211 CA ILE A 71 -6.514 8.077 7.396 1.00 32.13 C ATOM 1212 C ILE A 71 -6.626 9.597 7.111 1.00 31.11 C ATOM 1213 O ILE A 71 -5.723 10.362 7.457 1.00 32.13 O ATOM 1214 CB ILE A 71 -5.566 7.373 6.338 1.00 40.50 C ATOM 1215 CG1 ILE A 71 -5.331 5.882 6.731 1.00 55.33 C ATOM 1216 CG2 ILE A 71 -4.214 8.113 6.155 1.00 20.24 C ATOM 1217 CD1 ILE A 71 -4.481 5.087 5.755 1.00 71.31 C ATOM 0 H ILE A 71 -8.004 6.796 6.638 1.00 61.41 H new ATOM 0 HA ILE A 71 -6.069 7.945 8.382 1.00 32.13 H new ATOM 0 HB ILE A 71 -6.075 7.415 5.375 1.00 40.50 H new ATOM 0 HG12 ILE A 71 -4.856 5.851 7.712 1.00 55.33 H new ATOM 0 HG13 ILE A 71 -6.299 5.391 6.830 1.00 55.33 H new ATOM 0 HG21 ILE A 71 -3.607 7.585 5.419 1.00 20.24 H new ATOM 0 HG22 ILE A 71 -4.400 9.130 5.810 1.00 20.24 H new ATOM 0 HG23 ILE A 71 -3.684 8.144 7.107 1.00 20.24 H new ATOM 0 HD11 ILE A 71 -4.375 4.064 6.115 1.00 71.31 H new ATOM 0 HD12 ILE A 71 -4.961 5.080 4.777 1.00 71.31 H new ATOM 0 HD13 ILE A 71 -3.496 5.547 5.672 1.00 71.31 H new ATOM 1229 N SER A 72 -7.751 10.026 6.503 1.00 75.14 N ATOM 1230 CA SER A 72 -8.061 11.451 6.281 1.00 32.12 C ATOM 1231 C SER A 72 -8.048 12.239 7.616 1.00 53.52 C ATOM 1232 O SER A 72 -7.581 13.386 7.662 1.00 21.21 O ATOM 1233 CB SER A 72 -9.434 11.588 5.582 1.00 63.25 C ATOM 1234 OG SER A 72 -9.726 12.937 5.258 1.00 54.33 O ATOM 0 H SER A 72 -8.470 9.393 6.152 1.00 75.14 H new ATOM 0 HA SER A 72 -7.291 11.876 5.637 1.00 32.12 H new ATOM 0 HB2 SER A 72 -9.441 10.986 4.673 1.00 63.25 H new ATOM 0 HB3 SER A 72 -10.214 11.193 6.232 1.00 63.25 H new ATOM 0 HG SER A 72 -10.600 12.986 4.817 1.00 54.33 H new ATOM 1240 N LYS A 73 -8.542 11.594 8.697 1.00 53.41 N ATOM 1241 CA LYS A 73 -8.546 12.175 10.057 1.00 45.21 C ATOM 1242 C LYS A 73 -7.148 12.089 10.705 1.00 3.12 C ATOM 1243 O LYS A 73 -6.757 12.963 11.486 1.00 24.45 O ATOM 1244 CB LYS A 73 -9.553 11.426 10.962 1.00 22.12 C ATOM 1245 CG LYS A 73 -11.017 11.433 10.474 1.00 20.00 C ATOM 1246 CD LYS A 73 -11.949 10.705 11.474 1.00 1.45 C ATOM 1247 CE LYS A 73 -13.430 10.768 11.081 1.00 0.52 C ATOM 1248 NZ LYS A 73 -14.285 10.086 12.085 1.00 0.20 N ATOM 0 H LYS A 73 -8.948 10.659 8.651 1.00 53.41 H new ATOM 0 HA LYS A 73 -8.835 13.222 9.961 1.00 45.21 H new ATOM 0 HB2 LYS A 73 -9.226 10.391 11.061 1.00 22.12 H new ATOM 0 HB3 LYS A 73 -9.518 11.868 11.958 1.00 22.12 H new ATOM 0 HG2 LYS A 73 -11.354 12.461 10.343 1.00 20.00 H new ATOM 0 HG3 LYS A 73 -11.079 10.950 9.499 1.00 20.00 H new ATOM 0 HD2 LYS A 73 -11.645 9.661 11.549 1.00 1.45 H new ATOM 0 HD3 LYS A 73 -11.824 11.146 12.463 1.00 1.45 H new ATOM 0 HE2 LYS A 73 -13.739 11.809 10.985 1.00 0.52 H new ATOM 0 HE3 LYS A 73 -13.569 10.302 10.105 1.00 0.52 H new ATOM 0 HZ1 LYS A 73 -15.281 10.146 11.791 1.00 0.20 H new ATOM 0 HZ2 LYS A 73 -14.005 9.087 12.158 1.00 0.20 H new ATOM 0 HZ3 LYS A 73 -14.169 10.547 13.010 1.00 0.20 H new ATOM 1262 N LEU A 74 -6.417 11.005 10.387 1.00 3.30 N ATOM 1263 CA LEU A 74 -5.120 10.680 11.016 1.00 53.42 C ATOM 1264 C LEU A 74 -3.989 11.587 10.490 1.00 22.33 C ATOM 1265 O LEU A 74 -3.101 11.995 11.251 1.00 4.40 O ATOM 1266 CB LEU A 74 -4.792 9.177 10.779 1.00 72.15 C ATOM 1267 CG LEU A 74 -5.838 8.156 11.341 1.00 74.13 C ATOM 1268 CD1 LEU A 74 -5.447 6.699 11.011 1.00 12.32 C ATOM 1269 CD2 LEU A 74 -6.047 8.347 12.856 1.00 10.41 C ATOM 0 H LEU A 74 -6.709 10.326 9.684 1.00 3.30 H new ATOM 0 HA LEU A 74 -5.197 10.864 12.088 1.00 53.42 H new ATOM 0 HB2 LEU A 74 -4.690 9.011 9.707 1.00 72.15 H new ATOM 0 HB3 LEU A 74 -3.823 8.960 11.228 1.00 72.15 H new ATOM 0 HG LEU A 74 -6.787 8.359 10.845 1.00 74.13 H new ATOM 0 HD11 LEU A 74 -6.197 6.020 11.417 1.00 12.32 H new ATOM 0 HD12 LEU A 74 -5.392 6.573 9.930 1.00 12.32 H new ATOM 0 HD13 LEU A 74 -4.476 6.474 11.453 1.00 12.32 H new ATOM 0 HD21 LEU A 74 -6.779 7.624 13.216 1.00 10.41 H new ATOM 0 HD22 LEU A 74 -5.101 8.196 13.376 1.00 10.41 H new ATOM 0 HD23 LEU A 74 -6.410 9.357 13.049 1.00 10.41 H new ATOM 1281 N GLY A 75 -4.055 11.890 9.182 1.00 5.34 N ATOM 1282 CA GLY A 75 -3.106 12.761 8.507 1.00 0.45 C ATOM 1283 C GLY A 75 -1.684 12.207 8.470 1.00 40.21 C ATOM 1284 O GLY A 75 -0.842 12.611 9.272 1.00 12.22 O ATOM 0 H GLY A 75 -4.782 11.527 8.565 1.00 5.34 H new ATOM 0 HA2 GLY A 75 -3.446 12.932 7.486 1.00 0.45 H new ATOM 0 HA3 GLY A 75 -3.096 13.730 9.007 1.00 0.45 H new ATOM 1288 N TYR A 76 -1.427 11.255 7.553 1.00 42.33 N ATOM 1289 CA TYR A 76 -0.063 10.771 7.248 1.00 22.30 C ATOM 1290 C TYR A 76 0.017 10.254 5.799 1.00 14.23 C ATOM 1291 O TYR A 76 -1.012 9.950 5.176 1.00 40.34 O ATOM 1292 CB TYR A 76 0.439 9.705 8.280 1.00 33.23 C ATOM 1293 CG TYR A 76 -0.472 8.493 8.559 1.00 11.35 C ATOM 1294 CD1 TYR A 76 -0.721 7.526 7.581 1.00 51.24 C ATOM 1295 CD2 TYR A 76 -1.059 8.302 9.816 1.00 33.40 C ATOM 1296 CE1 TYR A 76 -1.517 6.431 7.842 1.00 25.42 C ATOM 1297 CE2 TYR A 76 -1.852 7.203 10.079 1.00 73.54 C ATOM 1298 CZ TYR A 76 -2.080 6.271 9.087 1.00 44.24 C ATOM 1299 OH TYR A 76 -2.879 5.176 9.345 1.00 53.14 O ATOM 0 H TYR A 76 -2.155 10.800 7.003 1.00 42.33 H new ATOM 0 HA TYR A 76 0.614 11.620 7.341 1.00 22.30 H new ATOM 0 HB2 TYR A 76 1.401 9.328 7.932 1.00 33.23 H new ATOM 0 HB3 TYR A 76 0.619 10.214 9.227 1.00 33.23 H new ATOM 0 HD1 TYR A 76 -0.281 7.639 6.601 1.00 51.24 H new ATOM 0 HD2 TYR A 76 -0.888 9.029 10.596 1.00 33.40 H new ATOM 0 HE1 TYR A 76 -1.699 5.699 7.069 1.00 25.42 H new ATOM 0 HE2 TYR A 76 -2.292 7.073 11.057 1.00 73.54 H new ATOM 0 HH TYR A 76 -2.418 4.360 9.059 1.00 53.14 H new ATOM 1309 N LYS A 77 1.255 10.162 5.278 1.00 2.54 N ATOM 1310 CA LYS A 77 1.518 9.775 3.888 1.00 44.01 C ATOM 1311 C LYS A 77 1.511 8.244 3.740 1.00 4.31 C ATOM 1312 O LYS A 77 2.176 7.530 4.504 1.00 22.32 O ATOM 1313 CB LYS A 77 2.863 10.355 3.401 1.00 64.02 C ATOM 1314 CG LYS A 77 3.095 10.199 1.877 1.00 2.22 C ATOM 1315 CD LYS A 77 4.382 10.897 1.410 1.00 31.51 C ATOM 1316 CE LYS A 77 4.645 10.720 -0.093 1.00 42.30 C ATOM 1317 NZ LYS A 77 3.589 11.351 -0.940 1.00 73.01 N ATOM 0 H LYS A 77 2.100 10.356 5.815 1.00 2.54 H new ATOM 0 HA LYS A 77 0.722 10.187 3.267 1.00 44.01 H new ATOM 0 HB2 LYS A 77 2.907 11.413 3.660 1.00 64.02 H new ATOM 0 HB3 LYS A 77 3.675 9.862 3.935 1.00 64.02 H new ATOM 0 HG2 LYS A 77 3.147 9.140 1.626 1.00 2.22 H new ATOM 0 HG3 LYS A 77 2.243 10.613 1.338 1.00 2.22 H new ATOM 0 HD2 LYS A 77 4.317 11.961 1.640 1.00 31.51 H new ATOM 0 HD3 LYS A 77 5.228 10.501 1.971 1.00 31.51 H new ATOM 0 HE2 LYS A 77 5.613 11.155 -0.342 1.00 42.30 H new ATOM 0 HE3 LYS A 77 4.704 9.657 -0.325 1.00 42.30 H new ATOM 0 HZ1 LYS A 77 3.849 11.262 -1.943 1.00 73.01 H new ATOM 0 HZ2 LYS A 77 2.680 10.874 -0.774 1.00 73.01 H new ATOM 0 HZ3 LYS A 77 3.502 12.358 -0.693 1.00 73.01 H new ATOM 1331 N VAL A 78 0.738 7.764 2.756 1.00 13.34 N ATOM 1332 CA VAL A 78 0.607 6.339 2.420 1.00 31.12 C ATOM 1333 C VAL A 78 1.129 6.106 0.986 1.00 54.21 C ATOM 1334 O VAL A 78 0.966 6.972 0.115 1.00 73.35 O ATOM 1335 CB VAL A 78 -0.891 5.874 2.548 1.00 21.52 C ATOM 1336 CG1 VAL A 78 -1.051 4.373 2.229 1.00 51.14 C ATOM 1337 CG2 VAL A 78 -1.452 6.200 3.955 1.00 4.12 C ATOM 0 H VAL A 78 0.174 8.368 2.158 1.00 13.34 H new ATOM 0 HA VAL A 78 1.199 5.748 3.119 1.00 31.12 H new ATOM 0 HB VAL A 78 -1.470 6.430 1.810 1.00 21.52 H new ATOM 0 HG11 VAL A 78 -2.099 4.090 2.328 1.00 51.14 H new ATOM 0 HG12 VAL A 78 -0.718 4.180 1.209 1.00 51.14 H new ATOM 0 HG13 VAL A 78 -0.449 3.787 2.924 1.00 51.14 H new ATOM 0 HG21 VAL A 78 -2.489 5.869 4.019 1.00 4.12 H new ATOM 0 HG22 VAL A 78 -0.859 5.685 4.711 1.00 4.12 H new ATOM 0 HG23 VAL A 78 -1.403 7.275 4.126 1.00 4.12 H new ATOM 1347 N PHE A 79 1.771 4.944 0.758 1.00 61.32 N ATOM 1348 CA PHE A 79 2.389 4.576 -0.524 1.00 3.33 C ATOM 1349 C PHE A 79 1.667 3.354 -1.099 1.00 43.01 C ATOM 1350 O PHE A 79 1.811 2.260 -0.579 1.00 64.51 O ATOM 1351 CB PHE A 79 3.889 4.244 -0.309 1.00 25.54 C ATOM 1352 CG PHE A 79 4.705 5.377 0.291 1.00 74.21 C ATOM 1353 CD1 PHE A 79 4.752 5.569 1.670 1.00 12.33 C ATOM 1354 CD2 PHE A 79 5.421 6.257 -0.521 1.00 14.31 C ATOM 1355 CE1 PHE A 79 5.481 6.599 2.215 1.00 31.04 C ATOM 1356 CE2 PHE A 79 6.150 7.285 0.027 1.00 65.20 C ATOM 1357 CZ PHE A 79 6.181 7.458 1.393 1.00 10.42 C ATOM 0 H PHE A 79 1.875 4.225 1.474 1.00 61.32 H new ATOM 0 HA PHE A 79 2.307 5.411 -1.220 1.00 3.33 H new ATOM 0 HB2 PHE A 79 3.966 3.373 0.342 1.00 25.54 H new ATOM 0 HB3 PHE A 79 4.327 3.965 -1.267 1.00 25.54 H new ATOM 0 HD1 PHE A 79 4.208 4.899 2.320 1.00 12.33 H new ATOM 0 HD2 PHE A 79 5.402 6.129 -1.593 1.00 14.31 H new ATOM 0 HE1 PHE A 79 5.506 6.736 3.286 1.00 31.04 H new ATOM 0 HE2 PHE A 79 6.699 7.958 -0.614 1.00 65.20 H new ATOM 0 HZ PHE A 79 6.754 8.267 1.821 1.00 10.42 H new ATOM 1367 N LEU A 80 0.908 3.527 -2.173 1.00 32.24 N ATOM 1368 CA LEU A 80 0.093 2.449 -2.755 1.00 51.53 C ATOM 1369 C LEU A 80 0.683 1.995 -4.097 1.00 44.21 C ATOM 1370 O LEU A 80 0.892 2.802 -5.000 1.00 40.01 O ATOM 1371 CB LEU A 80 -1.376 2.935 -2.894 1.00 70.44 C ATOM 1372 CG LEU A 80 -2.368 2.017 -3.699 1.00 41.41 C ATOM 1373 CD1 LEU A 80 -2.324 0.550 -3.234 1.00 33.20 C ATOM 1374 CD2 LEU A 80 -3.804 2.583 -3.642 1.00 5.20 C ATOM 0 H LEU A 80 0.834 4.414 -2.671 1.00 32.24 H new ATOM 0 HA LEU A 80 0.101 1.580 -2.096 1.00 51.53 H new ATOM 0 HB2 LEU A 80 -1.782 3.072 -1.892 1.00 70.44 H new ATOM 0 HB3 LEU A 80 -1.363 3.916 -3.370 1.00 70.44 H new ATOM 0 HG LEU A 80 -2.038 2.021 -4.738 1.00 41.41 H new ATOM 0 HD11 LEU A 80 -3.027 -0.039 -3.822 1.00 33.20 H new ATOM 0 HD12 LEU A 80 -1.317 0.155 -3.370 1.00 33.20 H new ATOM 0 HD13 LEU A 80 -2.596 0.494 -2.180 1.00 33.20 H new ATOM 0 HD21 LEU A 80 -4.474 1.933 -4.205 1.00 5.20 H new ATOM 0 HD22 LEU A 80 -4.134 2.633 -2.604 1.00 5.20 H new ATOM 0 HD23 LEU A 80 -3.819 3.583 -4.076 1.00 5.20 H new ATOM 1386 N LEU A 81 0.986 0.692 -4.196 1.00 44.02 N ATOM 1387 CA LEU A 81 1.368 0.048 -5.457 1.00 65.40 C ATOM 1388 C LEU A 81 0.190 -0.770 -5.989 1.00 72.24 C ATOM 1389 O LEU A 81 -0.397 -1.586 -5.267 1.00 64.20 O ATOM 1390 CB LEU A 81 2.607 -0.866 -5.280 1.00 40.45 C ATOM 1391 CG LEU A 81 3.154 -1.545 -6.586 1.00 1.45 C ATOM 1392 CD1 LEU A 81 3.398 -0.510 -7.708 1.00 41.01 C ATOM 1393 CD2 LEU A 81 4.432 -2.346 -6.287 1.00 3.32 C ATOM 0 H LEU A 81 0.972 0.055 -3.400 1.00 44.02 H new ATOM 0 HA LEU A 81 1.631 0.829 -6.170 1.00 65.40 H new ATOM 0 HB2 LEU A 81 3.409 -0.275 -4.838 1.00 40.45 H new ATOM 0 HB3 LEU A 81 2.357 -1.649 -4.565 1.00 40.45 H new ATOM 0 HG LEU A 81 2.391 -2.237 -6.944 1.00 1.45 H new ATOM 0 HD11 LEU A 81 3.776 -1.018 -8.595 1.00 41.01 H new ATOM 0 HD12 LEU A 81 2.461 -0.007 -7.949 1.00 41.01 H new ATOM 0 HD13 LEU A 81 4.129 0.226 -7.372 1.00 41.01 H new ATOM 0 HD21 LEU A 81 4.795 -2.808 -7.205 1.00 3.32 H new ATOM 0 HD22 LEU A 81 5.196 -1.677 -5.891 1.00 3.32 H new ATOM 0 HD23 LEU A 81 4.212 -3.121 -5.553 1.00 3.32 H new ATOM 1405 N LEU A 82 -0.147 -0.525 -7.254 1.00 20.44 N ATOM 1406 CA LEU A 82 -1.187 -1.245 -7.988 1.00 3.55 C ATOM 1407 C LEU A 82 -0.513 -2.001 -9.137 1.00 65.04 C ATOM 1408 O LEU A 82 0.190 -1.387 -9.937 1.00 74.01 O ATOM 1409 CB LEU A 82 -2.217 -0.217 -8.506 1.00 22.13 C ATOM 1410 CG LEU A 82 -2.966 0.582 -7.395 1.00 60.45 C ATOM 1411 CD1 LEU A 82 -3.749 1.758 -7.977 1.00 12.45 C ATOM 1412 CD2 LEU A 82 -3.881 -0.343 -6.569 1.00 54.10 C ATOM 0 H LEU A 82 0.307 0.198 -7.812 1.00 20.44 H new ATOM 0 HA LEU A 82 -1.711 -1.963 -7.357 1.00 3.55 H new ATOM 0 HB2 LEU A 82 -1.705 0.490 -9.159 1.00 22.13 H new ATOM 0 HB3 LEU A 82 -2.954 -0.739 -9.117 1.00 22.13 H new ATOM 0 HG LEU A 82 -2.212 0.995 -6.724 1.00 60.45 H new ATOM 0 HD11 LEU A 82 -4.257 2.290 -7.173 1.00 12.45 H new ATOM 0 HD12 LEU A 82 -3.063 2.436 -8.484 1.00 12.45 H new ATOM 0 HD13 LEU A 82 -4.486 1.387 -8.689 1.00 12.45 H new ATOM 0 HD21 LEU A 82 -4.391 0.240 -5.802 1.00 54.10 H new ATOM 0 HD22 LEU A 82 -4.619 -0.804 -7.225 1.00 54.10 H new ATOM 0 HD23 LEU A 82 -3.281 -1.120 -6.095 1.00 54.10 H new ATOM 1424 N ALA A 83 -0.707 -3.328 -9.213 1.00 44.41 N ATOM 1425 CA ALA A 83 0.027 -4.179 -10.175 1.00 54.01 C ATOM 1426 C ALA A 83 -0.892 -5.230 -10.831 1.00 70.43 C ATOM 1427 O ALA A 83 -1.458 -6.090 -10.146 1.00 22.04 O ATOM 1428 CB ALA A 83 1.222 -4.843 -9.476 1.00 5.13 C ATOM 0 H ALA A 83 -1.364 -3.838 -8.622 1.00 44.41 H new ATOM 0 HA ALA A 83 0.398 -3.543 -10.979 1.00 54.01 H new ATOM 0 HB1 ALA A 83 1.759 -5.469 -10.189 1.00 5.13 H new ATOM 0 HB2 ALA A 83 1.892 -4.074 -9.091 1.00 5.13 H new ATOM 0 HB3 ALA A 83 0.865 -5.459 -8.651 1.00 5.13 H new ATOM 1434 N ASP A 84 -1.046 -5.103 -12.163 1.00 13.40 N ATOM 1435 CA ASP A 84 -1.752 -6.063 -13.031 1.00 75.01 C ATOM 1436 C ASP A 84 -1.661 -5.592 -14.493 1.00 52.44 C ATOM 1437 O ASP A 84 -1.486 -4.392 -14.756 1.00 64.30 O ATOM 1438 CB ASP A 84 -3.250 -6.267 -12.619 1.00 43.02 C ATOM 1439 CG ASP A 84 -3.988 -7.303 -13.496 1.00 64.14 C ATOM 1440 OD1 ASP A 84 -3.523 -8.459 -13.579 1.00 4.44 O ATOM 1441 OD2 ASP A 84 -4.985 -6.958 -14.157 1.00 13.22 O ATOM 0 H ASP A 84 -0.672 -4.307 -12.679 1.00 13.40 H new ATOM 0 HA ASP A 84 -1.263 -7.030 -12.916 1.00 75.01 H new ATOM 0 HB2 ASP A 84 -3.293 -6.586 -11.578 1.00 43.02 H new ATOM 0 HB3 ASP A 84 -3.770 -5.311 -12.682 1.00 43.02 H new ATOM 1446 N GLN A 85 -1.788 -6.555 -15.429 1.00 21.51 N ATOM 1447 CA GLN A 85 -1.766 -6.304 -16.881 1.00 22.33 C ATOM 1448 C GLN A 85 -2.897 -5.332 -17.304 1.00 52.25 C ATOM 1449 O GLN A 85 -2.700 -4.478 -18.185 1.00 42.52 O ATOM 1450 CB GLN A 85 -1.862 -7.656 -17.640 1.00 15.11 C ATOM 1451 CG GLN A 85 -1.807 -7.558 -19.185 1.00 54.00 C ATOM 1452 CD GLN A 85 -0.552 -6.849 -19.714 1.00 22.44 C ATOM 1453 OE1 GLN A 85 0.478 -7.474 -19.961 1.00 22.10 O ATOM 1454 NE2 GLN A 85 -0.641 -5.540 -19.921 1.00 3.14 N ATOM 0 H GLN A 85 -1.910 -7.540 -15.193 1.00 21.51 H new ATOM 0 HA GLN A 85 -0.824 -5.821 -17.142 1.00 22.33 H new ATOM 0 HB2 GLN A 85 -1.049 -8.300 -17.305 1.00 15.11 H new ATOM 0 HB3 GLN A 85 -2.794 -8.146 -17.357 1.00 15.11 H new ATOM 0 HG2 GLN A 85 -1.851 -8.563 -19.606 1.00 54.00 H new ATOM 0 HG3 GLN A 85 -2.690 -7.026 -19.538 1.00 54.00 H new ATOM 0 HE21 GLN A 85 -1.508 -5.048 -19.707 1.00 3.14 H new ATOM 0 HE22 GLN A 85 0.158 -5.027 -20.294 1.00 3.14 H new ATOM 1463 N ASP A 86 -4.079 -5.455 -16.666 1.00 64.42 N ATOM 1464 CA ASP A 86 -5.160 -4.465 -16.818 1.00 22.31 C ATOM 1465 C ASP A 86 -4.801 -3.241 -15.968 1.00 5.24 C ATOM 1466 O ASP A 86 -5.124 -3.167 -14.774 1.00 13.25 O ATOM 1467 CB ASP A 86 -6.556 -5.031 -16.430 1.00 33.50 C ATOM 1468 CG ASP A 86 -7.690 -3.993 -16.614 1.00 31.14 C ATOM 1469 OD1 ASP A 86 -8.168 -3.822 -17.758 1.00 42.22 O ATOM 1470 OD2 ASP A 86 -8.104 -3.334 -15.628 1.00 63.21 O ATOM 0 H ASP A 86 -4.307 -6.229 -16.042 1.00 64.42 H new ATOM 0 HA ASP A 86 -5.242 -4.190 -17.870 1.00 22.31 H new ATOM 0 HB2 ASP A 86 -6.770 -5.910 -17.039 1.00 33.50 H new ATOM 0 HB3 ASP A 86 -6.535 -5.360 -15.391 1.00 33.50 H new ATOM 1475 N GLU A 87 -4.061 -2.322 -16.591 1.00 4.31 N ATOM 1476 CA GLU A 87 -3.640 -1.060 -15.972 1.00 10.43 C ATOM 1477 C GLU A 87 -4.821 -0.080 -15.862 1.00 34.11 C ATOM 1478 O GLU A 87 -4.712 0.930 -15.171 1.00 22.24 O ATOM 1479 CB GLU A 87 -2.470 -0.430 -16.761 1.00 53.31 C ATOM 1480 CG GLU A 87 -2.845 0.110 -18.156 1.00 44.13 C ATOM 1481 CD GLU A 87 -1.649 0.706 -18.912 1.00 21.03 C ATOM 1482 OE1 GLU A 87 -1.368 1.916 -18.759 1.00 62.13 O ATOM 1483 OE2 GLU A 87 -0.972 -0.038 -19.653 1.00 42.14 O ATOM 0 H GLU A 87 -3.733 -2.433 -17.550 1.00 4.31 H new ATOM 0 HA GLU A 87 -3.291 -1.276 -14.962 1.00 10.43 H new ATOM 0 HB2 GLU A 87 -2.051 0.386 -16.172 1.00 53.31 H new ATOM 0 HB3 GLU A 87 -1.684 -1.177 -16.875 1.00 53.31 H new ATOM 0 HG2 GLU A 87 -3.276 -0.698 -18.748 1.00 44.13 H new ATOM 0 HG3 GLU A 87 -3.616 0.873 -18.049 1.00 44.13 H new ATOM 1490 N ASN A 88 -5.931 -0.390 -16.576 1.00 63.05 N ATOM 1491 CA ASN A 88 -7.128 0.457 -16.647 1.00 2.22 C ATOM 1492 C ASN A 88 -7.721 0.712 -15.253 1.00 61.24 C ATOM 1493 O ASN A 88 -7.785 1.862 -14.819 1.00 13.33 O ATOM 1494 CB ASN A 88 -8.192 -0.181 -17.579 1.00 61.44 C ATOM 1495 CG ASN A 88 -9.476 0.652 -17.736 1.00 73.00 C ATOM 1496 OD1 ASN A 88 -10.564 0.102 -17.914 1.00 11.35 O ATOM 1497 ND2 ASN A 88 -9.370 1.981 -17.703 1.00 14.22 N ATOM 0 H ASN A 88 -6.012 -1.248 -17.122 1.00 63.05 H new ATOM 0 HA ASN A 88 -6.828 1.419 -17.063 1.00 2.22 H new ATOM 0 HB2 ASN A 88 -7.750 -0.335 -18.563 1.00 61.44 H new ATOM 0 HB3 ASN A 88 -8.456 -1.165 -17.190 1.00 61.44 H new ATOM 0 HD21 ASN A 88 -10.199 2.562 -17.826 1.00 14.22 H new ATOM 0 HD22 ASN A 88 -8.460 2.416 -17.554 1.00 14.22 H new ATOM 1504 N GLU A 89 -8.110 -0.375 -14.555 1.00 71.32 N ATOM 1505 CA GLU A 89 -8.722 -0.301 -13.211 1.00 23.24 C ATOM 1506 C GLU A 89 -7.781 0.414 -12.232 1.00 20.44 C ATOM 1507 O GLU A 89 -8.207 1.276 -11.467 1.00 42.33 O ATOM 1508 CB GLU A 89 -9.032 -1.724 -12.687 1.00 12.33 C ATOM 1509 CG GLU A 89 -9.628 -1.776 -11.263 1.00 4.41 C ATOM 1510 CD GLU A 89 -9.787 -3.209 -10.740 1.00 42.30 C ATOM 1511 OE1 GLU A 89 -10.603 -3.968 -11.307 1.00 13.41 O ATOM 1512 OE2 GLU A 89 -9.102 -3.594 -9.770 1.00 11.34 O ATOM 0 H GLU A 89 -8.009 -1.327 -14.906 1.00 71.32 H new ATOM 0 HA GLU A 89 -9.651 0.265 -13.287 1.00 23.24 H new ATOM 0 HB2 GLU A 89 -9.728 -2.205 -13.374 1.00 12.33 H new ATOM 0 HB3 GLU A 89 -8.113 -2.310 -12.702 1.00 12.33 H new ATOM 0 HG2 GLU A 89 -8.986 -1.215 -10.584 1.00 4.41 H new ATOM 0 HG3 GLU A 89 -10.600 -1.283 -11.262 1.00 4.41 H new ATOM 1519 N LEU A 90 -6.492 0.048 -12.327 1.00 54.41 N ATOM 1520 CA LEU A 90 -5.429 0.532 -11.442 1.00 72.50 C ATOM 1521 C LEU A 90 -5.241 2.058 -11.576 1.00 35.42 C ATOM 1522 O LEU A 90 -5.175 2.767 -10.576 1.00 51.31 O ATOM 1523 CB LEU A 90 -4.101 -0.184 -11.788 1.00 61.03 C ATOM 1524 CG LEU A 90 -4.131 -1.738 -11.854 1.00 62.25 C ATOM 1525 CD1 LEU A 90 -2.745 -2.287 -12.235 1.00 0.50 C ATOM 1526 CD2 LEU A 90 -4.650 -2.364 -10.539 1.00 42.54 C ATOM 0 H LEU A 90 -6.157 -0.605 -13.036 1.00 54.41 H new ATOM 0 HA LEU A 90 -5.715 0.312 -10.414 1.00 72.50 H new ATOM 0 HB2 LEU A 90 -3.757 0.189 -12.753 1.00 61.03 H new ATOM 0 HB3 LEU A 90 -3.356 0.109 -11.048 1.00 61.03 H new ATOM 0 HG LEU A 90 -4.837 -2.025 -12.634 1.00 62.25 H new ATOM 0 HD11 LEU A 90 -2.784 -3.376 -12.277 1.00 0.50 H new ATOM 0 HD12 LEU A 90 -2.455 -1.897 -13.210 1.00 0.50 H new ATOM 0 HD13 LEU A 90 -2.014 -1.978 -11.488 1.00 0.50 H new ATOM 0 HD21 LEU A 90 -4.654 -3.450 -10.630 1.00 42.54 H new ATOM 0 HD22 LEU A 90 -3.999 -2.071 -9.715 1.00 42.54 H new ATOM 0 HD23 LEU A 90 -5.663 -2.012 -10.344 1.00 42.54 H new ATOM 1538 N GLU A 91 -5.182 2.540 -12.828 1.00 54.44 N ATOM 1539 CA GLU A 91 -4.888 3.948 -13.132 1.00 31.12 C ATOM 1540 C GLU A 91 -6.067 4.845 -12.739 1.00 23.22 C ATOM 1541 O GLU A 91 -5.875 5.893 -12.125 1.00 34.25 O ATOM 1542 CB GLU A 91 -4.537 4.135 -14.627 1.00 20.33 C ATOM 1543 CG GLU A 91 -4.080 5.565 -14.990 1.00 32.35 C ATOM 1544 CD GLU A 91 -3.712 5.713 -16.470 1.00 51.54 C ATOM 1545 OE1 GLU A 91 -4.603 6.002 -17.284 1.00 53.14 O ATOM 1546 OE2 GLU A 91 -2.530 5.523 -16.830 1.00 13.35 O ATOM 0 H GLU A 91 -5.337 1.965 -13.656 1.00 54.44 H new ATOM 0 HA GLU A 91 -4.019 4.242 -12.543 1.00 31.12 H new ATOM 0 HB2 GLU A 91 -3.747 3.433 -14.895 1.00 20.33 H new ATOM 0 HB3 GLU A 91 -5.409 3.879 -15.229 1.00 20.33 H new ATOM 0 HG2 GLU A 91 -4.876 6.269 -14.746 1.00 32.35 H new ATOM 0 HG3 GLU A 91 -3.219 5.833 -14.378 1.00 32.35 H new ATOM 1553 N GLU A 92 -7.284 4.411 -13.081 1.00 1.15 N ATOM 1554 CA GLU A 92 -8.509 5.157 -12.764 1.00 2.53 C ATOM 1555 C GLU A 92 -8.716 5.240 -11.238 1.00 0.15 C ATOM 1556 O GLU A 92 -9.149 6.266 -10.728 1.00 23.22 O ATOM 1557 CB GLU A 92 -9.725 4.506 -13.469 1.00 42.33 C ATOM 1558 CG GLU A 92 -9.593 4.433 -15.008 1.00 11.31 C ATOM 1559 CD GLU A 92 -9.368 5.803 -15.675 1.00 24.22 C ATOM 1560 OE1 GLU A 92 -10.361 6.518 -15.921 1.00 33.02 O ATOM 1561 OE2 GLU A 92 -8.204 6.174 -15.955 1.00 30.33 O ATOM 0 H GLU A 92 -7.449 3.538 -13.582 1.00 1.15 H new ATOM 0 HA GLU A 92 -8.410 6.177 -13.136 1.00 2.53 H new ATOM 0 HB2 GLU A 92 -9.862 3.498 -13.078 1.00 42.33 H new ATOM 0 HB3 GLU A 92 -10.623 5.070 -13.218 1.00 42.33 H new ATOM 0 HG2 GLU A 92 -8.763 3.774 -15.262 1.00 11.31 H new ATOM 0 HG3 GLU A 92 -10.495 3.982 -15.420 1.00 11.31 H new ATOM 1568 N PHE A 93 -8.376 4.141 -10.540 1.00 24.20 N ATOM 1569 CA PHE A 93 -8.386 4.071 -9.067 1.00 70.14 C ATOM 1570 C PHE A 93 -7.365 5.061 -8.463 1.00 42.13 C ATOM 1571 O PHE A 93 -7.711 5.861 -7.585 1.00 23.32 O ATOM 1572 CB PHE A 93 -8.076 2.611 -8.611 1.00 53.33 C ATOM 1573 CG PHE A 93 -8.092 2.381 -7.103 1.00 52.43 C ATOM 1574 CD1 PHE A 93 -9.195 2.748 -6.343 1.00 1.51 C ATOM 1575 CD2 PHE A 93 -7.010 1.790 -6.443 1.00 23.13 C ATOM 1576 CE1 PHE A 93 -9.212 2.542 -4.981 1.00 64.52 C ATOM 1577 CE2 PHE A 93 -7.033 1.583 -5.079 1.00 53.41 C ATOM 1578 CZ PHE A 93 -8.135 1.961 -4.346 1.00 21.24 C ATOM 0 H PHE A 93 -8.085 3.271 -10.985 1.00 24.20 H new ATOM 0 HA PHE A 93 -9.375 4.353 -8.706 1.00 70.14 H new ATOM 0 HB2 PHE A 93 -8.803 1.942 -9.072 1.00 53.33 H new ATOM 0 HB3 PHE A 93 -7.096 2.329 -8.994 1.00 53.33 H new ATOM 0 HD1 PHE A 93 -10.049 3.200 -6.825 1.00 1.51 H new ATOM 0 HD2 PHE A 93 -6.141 1.490 -7.011 1.00 23.13 H new ATOM 0 HE1 PHE A 93 -10.077 2.838 -4.406 1.00 64.52 H new ATOM 0 HE2 PHE A 93 -6.188 1.125 -4.587 1.00 53.41 H new ATOM 0 HZ PHE A 93 -8.156 1.803 -3.278 1.00 21.24 H new ATOM 1588 N LYS A 94 -6.119 5.026 -8.993 1.00 34.12 N ATOM 1589 CA LYS A 94 -4.976 5.753 -8.409 1.00 13.24 C ATOM 1590 C LYS A 94 -5.143 7.273 -8.546 1.00 13.21 C ATOM 1591 O LYS A 94 -4.595 8.011 -7.738 1.00 14.24 O ATOM 1592 CB LYS A 94 -3.617 5.262 -9.022 1.00 63.31 C ATOM 1593 CG LYS A 94 -3.205 5.794 -10.420 1.00 21.21 C ATOM 1594 CD LYS A 94 -2.330 7.075 -10.367 1.00 41.00 C ATOM 1595 CE LYS A 94 -1.978 7.594 -11.758 1.00 62.41 C ATOM 1596 NZ LYS A 94 -1.157 8.831 -11.693 1.00 32.02 N ATOM 0 H LYS A 94 -5.883 4.496 -9.832 1.00 34.12 H new ATOM 0 HA LYS A 94 -4.954 5.528 -7.343 1.00 13.24 H new ATOM 0 HB2 LYS A 94 -2.823 5.521 -8.321 1.00 63.31 H new ATOM 0 HB3 LYS A 94 -3.651 4.174 -9.077 1.00 63.31 H new ATOM 0 HG2 LYS A 94 -2.659 5.013 -10.950 1.00 21.21 H new ATOM 0 HG3 LYS A 94 -4.105 6.003 -10.999 1.00 21.21 H new ATOM 0 HD2 LYS A 94 -2.860 7.852 -9.815 1.00 41.00 H new ATOM 0 HD3 LYS A 94 -1.413 6.863 -9.818 1.00 41.00 H new ATOM 0 HE2 LYS A 94 -1.434 6.825 -12.306 1.00 62.41 H new ATOM 0 HE3 LYS A 94 -2.894 7.794 -12.314 1.00 62.41 H new ATOM 0 HZ1 LYS A 94 -1.712 9.635 -12.049 1.00 32.02 H new ATOM 0 HZ2 LYS A 94 -0.878 9.011 -10.707 1.00 32.02 H new ATOM 0 HZ3 LYS A 94 -0.305 8.713 -12.277 1.00 32.02 H new ATOM 1610 N ARG A 95 -5.900 7.716 -9.571 1.00 51.25 N ATOM 1611 CA ARG A 95 -6.184 9.153 -9.817 1.00 44.12 C ATOM 1612 C ARG A 95 -6.859 9.812 -8.591 1.00 43.12 C ATOM 1613 O ARG A 95 -6.536 10.951 -8.231 1.00 41.31 O ATOM 1614 CB ARG A 95 -7.075 9.317 -11.081 1.00 15.21 C ATOM 1615 CG ARG A 95 -6.374 8.962 -12.411 1.00 44.12 C ATOM 1616 CD ARG A 95 -7.340 8.943 -13.613 1.00 72.44 C ATOM 1617 NE ARG A 95 -6.685 8.469 -14.846 1.00 4.22 N ATOM 1618 CZ ARG A 95 -6.110 9.252 -15.779 1.00 4.15 C ATOM 1619 NH1 ARG A 95 -6.093 10.576 -15.644 1.00 1.31 N ATOM 1620 NH2 ARG A 95 -5.581 8.702 -16.856 1.00 21.02 N ATOM 0 H ARG A 95 -6.333 7.093 -10.252 1.00 51.25 H new ATOM 0 HA ARG A 95 -5.234 9.659 -9.986 1.00 44.12 H new ATOM 0 HB2 ARG A 95 -7.958 8.688 -10.971 1.00 15.21 H new ATOM 0 HB3 ARG A 95 -7.423 10.349 -11.133 1.00 15.21 H new ATOM 0 HG2 ARG A 95 -5.580 9.684 -12.601 1.00 44.12 H new ATOM 0 HG3 ARG A 95 -5.900 7.985 -12.317 1.00 44.12 H new ATOM 0 HD2 ARG A 95 -8.189 8.299 -13.384 1.00 72.44 H new ATOM 0 HD3 ARG A 95 -7.735 9.946 -13.776 1.00 72.44 H new ATOM 0 HE ARG A 95 -6.666 7.462 -15.006 1.00 4.22 H new ATOM 0 HH11 ARG A 95 -6.519 11.011 -14.826 1.00 1.31 H new ATOM 0 HH12 ARG A 95 -5.654 11.156 -16.359 1.00 1.31 H new ATOM 0 HH21 ARG A 95 -5.609 7.690 -16.978 1.00 21.02 H new ATOM 0 HH22 ARG A 95 -5.144 9.289 -17.566 1.00 21.02 H new ATOM 1634 N LYS A 96 -7.784 9.060 -7.953 1.00 40.20 N ATOM 1635 CA LYS A 96 -8.513 9.518 -6.752 1.00 20.44 C ATOM 1636 C LYS A 96 -7.574 9.542 -5.536 1.00 74.11 C ATOM 1637 O LYS A 96 -7.588 10.489 -4.745 1.00 53.54 O ATOM 1638 CB LYS A 96 -9.756 8.613 -6.446 1.00 41.54 C ATOM 1639 CG LYS A 96 -10.952 8.748 -7.427 1.00 62.54 C ATOM 1640 CD LYS A 96 -10.665 8.177 -8.832 1.00 1.13 C ATOM 1641 CE LYS A 96 -11.874 8.255 -9.782 1.00 61.42 C ATOM 1642 NZ LYS A 96 -13.031 7.461 -9.281 1.00 32.55 N ATOM 0 H LYS A 96 -8.044 8.122 -8.256 1.00 40.20 H new ATOM 0 HA LYS A 96 -8.874 10.527 -6.953 1.00 20.44 H new ATOM 0 HB2 LYS A 96 -9.431 7.573 -6.441 1.00 41.54 H new ATOM 0 HB3 LYS A 96 -10.109 8.842 -5.440 1.00 41.54 H new ATOM 0 HG2 LYS A 96 -11.817 8.236 -7.005 1.00 62.54 H new ATOM 0 HG3 LYS A 96 -11.219 9.801 -7.519 1.00 62.54 H new ATOM 0 HD2 LYS A 96 -9.830 8.721 -9.273 1.00 1.13 H new ATOM 0 HD3 LYS A 96 -10.354 7.137 -8.737 1.00 1.13 H new ATOM 0 HE2 LYS A 96 -12.174 9.296 -9.902 1.00 61.42 H new ATOM 0 HE3 LYS A 96 -11.584 7.891 -10.768 1.00 61.42 H new ATOM 0 HZ1 LYS A 96 -13.772 7.429 -10.010 1.00 32.55 H new ATOM 0 HZ2 LYS A 96 -12.719 6.493 -9.062 1.00 32.55 H new ATOM 0 HZ3 LYS A 96 -13.411 7.906 -8.421 1.00 32.55 H new ATOM 1656 N ILE A 97 -6.738 8.496 -5.431 1.00 41.02 N ATOM 1657 CA ILE A 97 -5.842 8.274 -4.280 1.00 72.33 C ATOM 1658 C ILE A 97 -4.716 9.341 -4.262 1.00 43.34 C ATOM 1659 O ILE A 97 -4.368 9.889 -3.210 1.00 44.00 O ATOM 1660 CB ILE A 97 -5.224 6.816 -4.331 1.00 63.23 C ATOM 1661 CG1 ILE A 97 -6.326 5.727 -4.572 1.00 73.10 C ATOM 1662 CG2 ILE A 97 -4.399 6.495 -3.062 1.00 21.42 C ATOM 1663 CD1 ILE A 97 -7.501 5.752 -3.606 1.00 5.21 C ATOM 0 H ILE A 97 -6.663 7.774 -6.147 1.00 41.02 H new ATOM 0 HA ILE A 97 -6.424 8.368 -3.363 1.00 72.33 H new ATOM 0 HB ILE A 97 -4.543 6.794 -5.182 1.00 63.23 H new ATOM 0 HG12 ILE A 97 -6.710 5.843 -5.585 1.00 73.10 H new ATOM 0 HG13 ILE A 97 -5.857 4.744 -4.520 1.00 73.10 H new ATOM 0 HG21 ILE A 97 -3.993 5.486 -3.137 1.00 21.42 H new ATOM 0 HG22 ILE A 97 -3.581 7.209 -2.970 1.00 21.42 H new ATOM 0 HG23 ILE A 97 -5.041 6.563 -2.184 1.00 21.42 H new ATOM 0 HD11 ILE A 97 -8.201 4.958 -3.864 1.00 5.21 H new ATOM 0 HD12 ILE A 97 -7.139 5.600 -2.589 1.00 5.21 H new ATOM 0 HD13 ILE A 97 -8.005 6.716 -3.671 1.00 5.21 H new ATOM 1675 N GLU A 98 -4.225 9.667 -5.470 1.00 20.21 N ATOM 1676 CA GLU A 98 -3.086 10.577 -5.700 1.00 41.31 C ATOM 1677 C GLU A 98 -3.495 12.035 -5.460 1.00 14.21 C ATOM 1678 O GLU A 98 -2.692 12.843 -4.972 1.00 43.02 O ATOM 1679 CB GLU A 98 -2.577 10.387 -7.154 1.00 44.34 C ATOM 1680 CG GLU A 98 -1.234 11.058 -7.477 1.00 2.10 C ATOM 1681 CD GLU A 98 -0.785 10.769 -8.913 1.00 12.42 C ATOM 1682 OE1 GLU A 98 -0.275 9.658 -9.174 1.00 24.02 O ATOM 1683 OE2 GLU A 98 -0.977 11.625 -9.798 1.00 40.14 O ATOM 0 H GLU A 98 -4.618 9.297 -6.336 1.00 20.21 H new ATOM 0 HA GLU A 98 -2.287 10.339 -4.998 1.00 41.31 H new ATOM 0 HB2 GLU A 98 -2.487 9.319 -7.352 1.00 44.34 H new ATOM 0 HB3 GLU A 98 -3.331 10.776 -7.838 1.00 44.34 H new ATOM 0 HG2 GLU A 98 -1.322 12.135 -7.333 1.00 2.10 H new ATOM 0 HG3 GLU A 98 -0.474 10.704 -6.780 1.00 2.10 H new ATOM 1690 N SER A 99 -4.768 12.339 -5.774 1.00 34.33 N ATOM 1691 CA SER A 99 -5.337 13.686 -5.631 1.00 13.25 C ATOM 1692 C SER A 99 -5.430 14.093 -4.141 1.00 23.51 C ATOM 1693 O SER A 99 -5.389 15.287 -3.810 1.00 4.43 O ATOM 1694 CB SER A 99 -6.726 13.742 -6.310 1.00 53.54 C ATOM 1695 OG SER A 99 -7.266 15.051 -6.295 1.00 10.10 O ATOM 0 H SER A 99 -5.431 11.653 -6.135 1.00 34.33 H new ATOM 0 HA SER A 99 -4.677 14.400 -6.124 1.00 13.25 H new ATOM 0 HB2 SER A 99 -6.641 13.395 -7.340 1.00 53.54 H new ATOM 0 HB3 SER A 99 -7.408 13.062 -5.800 1.00 53.54 H new ATOM 0 HG SER A 99 -8.142 15.048 -6.733 1.00 10.10 H new ATOM 1701 N GLN A 100 -5.515 13.078 -3.257 1.00 51.24 N ATOM 1702 CA GLN A 100 -5.634 13.262 -1.793 1.00 1.25 C ATOM 1703 C GLN A 100 -4.250 13.403 -1.114 1.00 64.25 C ATOM 1704 O GLN A 100 -4.173 13.638 0.098 1.00 41.50 O ATOM 1705 CB GLN A 100 -6.421 12.066 -1.193 1.00 60.11 C ATOM 1706 CG GLN A 100 -7.822 11.868 -1.802 1.00 4.32 C ATOM 1707 CD GLN A 100 -8.543 10.627 -1.279 1.00 51.55 C ATOM 1708 OE1 GLN A 100 -9.289 10.684 -0.305 1.00 1.45 O ATOM 1709 NE2 GLN A 100 -8.311 9.486 -1.912 1.00 44.32 N ATOM 0 H GLN A 100 -5.503 12.098 -3.540 1.00 51.24 H new ATOM 0 HA GLN A 100 -6.174 14.190 -1.604 1.00 1.25 H new ATOM 0 HB2 GLN A 100 -5.841 11.154 -1.337 1.00 60.11 H new ATOM 0 HB3 GLN A 100 -6.521 12.213 -0.118 1.00 60.11 H new ATOM 0 HG2 GLN A 100 -8.429 12.748 -1.590 1.00 4.32 H new ATOM 0 HG3 GLN A 100 -7.732 11.796 -2.886 1.00 4.32 H new ATOM 0 HE21 GLN A 100 -7.687 9.468 -2.718 1.00 44.32 H new ATOM 0 HE22 GLN A 100 -8.757 8.626 -1.593 1.00 44.32 H new ATOM 1718 N GLY A 101 -3.162 13.253 -1.905 1.00 23.10 N ATOM 1719 CA GLY A 101 -1.785 13.422 -1.415 1.00 75.11 C ATOM 1720 C GLY A 101 -1.062 12.107 -1.155 1.00 12.21 C ATOM 1721 O GLY A 101 0.143 12.111 -0.850 1.00 54.03 O ATOM 0 H GLY A 101 -3.219 13.013 -2.895 1.00 23.10 H new ATOM 0 HA2 GLY A 101 -1.218 14.000 -2.144 1.00 75.11 H new ATOM 0 HA3 GLY A 101 -1.806 14.004 -0.493 1.00 75.11 H new ATOM 1725 N TYR A 102 -1.793 10.981 -1.268 1.00 11.35 N ATOM 1726 CA TYR A 102 -1.219 9.636 -1.090 1.00 62.42 C ATOM 1727 C TYR A 102 -0.371 9.273 -2.318 1.00 33.15 C ATOM 1728 O TYR A 102 -0.832 9.424 -3.456 1.00 41.32 O ATOM 1729 CB TYR A 102 -2.330 8.579 -0.874 1.00 23.32 C ATOM 1730 CG TYR A 102 -3.273 8.879 0.300 1.00 1.15 C ATOM 1731 CD1 TYR A 102 -2.787 8.956 1.606 1.00 52.23 C ATOM 1732 CD2 TYR A 102 -4.644 9.089 0.102 1.00 61.13 C ATOM 1733 CE1 TYR A 102 -3.628 9.228 2.669 1.00 61.04 C ATOM 1734 CE2 TYR A 102 -5.488 9.361 1.163 1.00 4.32 C ATOM 1735 CZ TYR A 102 -4.977 9.426 2.444 1.00 32.43 C ATOM 1736 OH TYR A 102 -5.818 9.690 3.508 1.00 1.33 O ATOM 0 H TYR A 102 -2.790 10.979 -1.484 1.00 11.35 H new ATOM 0 HA TYR A 102 -0.588 9.643 -0.202 1.00 62.42 H new ATOM 0 HB2 TYR A 102 -2.920 8.499 -1.787 1.00 23.32 H new ATOM 0 HB3 TYR A 102 -1.863 7.608 -0.710 1.00 23.32 H new ATOM 0 HD1 TYR A 102 -1.734 8.800 1.790 1.00 52.23 H new ATOM 0 HD2 TYR A 102 -5.049 9.037 -0.898 1.00 61.13 H new ATOM 0 HE1 TYR A 102 -3.232 9.286 3.672 1.00 61.04 H new ATOM 0 HE2 TYR A 102 -6.542 9.522 0.990 1.00 4.32 H new ATOM 0 HH TYR A 102 -6.559 9.049 3.506 1.00 1.33 H new ATOM 1746 N GLU A 103 0.863 8.809 -2.074 1.00 21.24 N ATOM 1747 CA GLU A 103 1.821 8.483 -3.135 1.00 41.25 C ATOM 1748 C GLU A 103 1.463 7.132 -3.749 1.00 75.43 C ATOM 1749 O GLU A 103 1.755 6.099 -3.163 1.00 31.44 O ATOM 1750 CB GLU A 103 3.262 8.439 -2.564 1.00 14.21 C ATOM 1751 CG GLU A 103 4.377 8.528 -3.623 1.00 52.11 C ATOM 1752 CD GLU A 103 4.393 9.904 -4.310 1.00 74.50 C ATOM 1753 OE1 GLU A 103 4.811 10.888 -3.656 1.00 13.53 O ATOM 1754 OE2 GLU A 103 3.951 10.029 -5.471 1.00 51.22 O ATOM 0 H GLU A 103 1.223 8.650 -1.133 1.00 21.24 H new ATOM 0 HA GLU A 103 1.775 9.254 -3.904 1.00 41.25 H new ATOM 0 HB2 GLU A 103 3.384 9.261 -1.858 1.00 14.21 H new ATOM 0 HB3 GLU A 103 3.387 7.514 -2.001 1.00 14.21 H new ATOM 0 HG2 GLU A 103 5.343 8.344 -3.152 1.00 52.11 H new ATOM 0 HG3 GLU A 103 4.233 7.748 -4.371 1.00 52.11 H new ATOM 1761 N VAL A 104 0.834 7.137 -4.922 1.00 73.14 N ATOM 1762 CA VAL A 104 0.352 5.903 -5.558 1.00 12.21 C ATOM 1763 C VAL A 104 0.855 5.794 -7.000 1.00 21.22 C ATOM 1764 O VAL A 104 0.707 6.722 -7.802 1.00 20.44 O ATOM 1765 CB VAL A 104 -1.212 5.796 -5.511 1.00 72.31 C ATOM 1766 CG1 VAL A 104 -1.888 7.049 -6.087 1.00 5.04 C ATOM 1767 CG2 VAL A 104 -1.706 4.504 -6.209 1.00 21.33 C ATOM 0 H VAL A 104 0.643 7.984 -5.457 1.00 73.14 H new ATOM 0 HA VAL A 104 0.758 5.068 -4.987 1.00 12.21 H new ATOM 0 HB VAL A 104 -1.504 5.735 -4.463 1.00 72.31 H new ATOM 0 HG11 VAL A 104 -2.971 6.934 -6.036 1.00 5.04 H new ATOM 0 HG12 VAL A 104 -1.588 7.923 -5.509 1.00 5.04 H new ATOM 0 HG13 VAL A 104 -1.586 7.180 -7.126 1.00 5.04 H new ATOM 0 HG21 VAL A 104 -2.794 4.457 -6.160 1.00 21.33 H new ATOM 0 HG22 VAL A 104 -1.389 4.510 -7.252 1.00 21.33 H new ATOM 0 HG23 VAL A 104 -1.283 3.634 -5.706 1.00 21.33 H new ATOM 1777 N ARG A 105 1.470 4.648 -7.298 1.00 24.31 N ATOM 1778 CA ARG A 105 1.919 4.281 -8.643 1.00 14.01 C ATOM 1779 C ARG A 105 1.159 3.028 -9.106 1.00 21.24 C ATOM 1780 O ARG A 105 0.660 2.246 -8.286 1.00 35.21 O ATOM 1781 CB ARG A 105 3.442 4.005 -8.660 1.00 60.41 C ATOM 1782 CG ARG A 105 4.377 5.173 -8.237 1.00 73.34 C ATOM 1783 CD ARG A 105 4.360 6.389 -9.189 1.00 24.33 C ATOM 1784 NE ARG A 105 3.244 7.309 -8.913 1.00 64.42 N ATOM 1785 CZ ARG A 105 3.369 8.567 -8.448 1.00 64.54 C ATOM 1786 NH1 ARG A 105 4.572 9.092 -8.208 1.00 52.44 N ATOM 1787 NH2 ARG A 105 2.298 9.281 -8.192 1.00 51.33 N ATOM 0 H ARG A 105 1.674 3.935 -6.598 1.00 24.31 H new ATOM 0 HA ARG A 105 1.715 5.111 -9.320 1.00 14.01 H new ATOM 0 HB2 ARG A 105 3.640 3.158 -8.003 1.00 60.41 H new ATOM 0 HB3 ARG A 105 3.719 3.698 -9.668 1.00 60.41 H new ATOM 0 HG2 ARG A 105 4.092 5.506 -7.239 1.00 73.34 H new ATOM 0 HG3 ARG A 105 5.398 4.797 -8.168 1.00 73.34 H new ATOM 0 HD2 ARG A 105 5.302 6.929 -9.099 1.00 24.33 H new ATOM 0 HD3 ARG A 105 4.291 6.039 -10.219 1.00 24.33 H new ATOM 0 HE ARG A 105 2.300 6.966 -9.088 1.00 64.42 H new ATOM 0 HH11 ARG A 105 5.413 8.539 -8.377 1.00 52.44 H new ATOM 0 HH12 ARG A 105 4.651 10.046 -7.856 1.00 52.44 H new ATOM 0 HH21 ARG A 105 1.371 8.883 -8.345 1.00 51.33 H new ATOM 0 HH22 ARG A 105 2.392 10.234 -7.840 1.00 51.33 H new ATOM 1801 N LYS A 106 1.096 2.842 -10.429 1.00 2.04 N ATOM 1802 CA LYS A 106 0.460 1.674 -11.058 1.00 24.53 C ATOM 1803 C LYS A 106 1.413 1.095 -12.125 1.00 25.20 C ATOM 1804 O LYS A 106 2.159 1.847 -12.770 1.00 12.31 O ATOM 1805 CB LYS A 106 -0.983 2.057 -11.608 1.00 63.01 C ATOM 1806 CG LYS A 106 -1.266 1.824 -13.123 1.00 55.32 C ATOM 1807 CD LYS A 106 -0.693 2.937 -14.041 1.00 71.13 C ATOM 1808 CE LYS A 106 -0.919 2.616 -15.520 1.00 53.14 C ATOM 1809 NZ LYS A 106 -0.375 3.653 -16.424 1.00 55.34 N ATOM 0 H LYS A 106 1.488 3.502 -11.101 1.00 2.04 H new ATOM 0 HA LYS A 106 0.289 0.883 -10.327 1.00 24.53 H new ATOM 0 HB2 LYS A 106 -1.720 1.491 -11.038 1.00 63.01 H new ATOM 0 HB3 LYS A 106 -1.155 3.112 -11.393 1.00 63.01 H new ATOM 0 HG2 LYS A 106 -0.841 0.865 -13.420 1.00 55.32 H new ATOM 0 HG3 LYS A 106 -2.343 1.757 -13.277 1.00 55.32 H new ATOM 0 HD2 LYS A 106 -1.165 3.889 -13.798 1.00 71.13 H new ATOM 0 HD3 LYS A 106 0.374 3.053 -13.852 1.00 71.13 H new ATOM 0 HE2 LYS A 106 -0.455 1.658 -15.754 1.00 53.14 H new ATOM 0 HE3 LYS A 106 -1.988 2.506 -15.703 1.00 53.14 H new ATOM 0 HZ1 LYS A 106 -0.134 3.223 -17.340 1.00 55.34 H new ATOM 0 HZ2 LYS A 106 -1.087 4.397 -16.567 1.00 55.34 H new ATOM 0 HZ3 LYS A 106 0.479 4.069 -16.001 1.00 55.34 H new ATOM 1823 N VAL A 107 1.392 -0.239 -12.290 1.00 21.53 N ATOM 1824 CA VAL A 107 2.319 -0.987 -13.180 1.00 50.20 C ATOM 1825 C VAL A 107 1.611 -2.202 -13.809 1.00 63.25 C ATOM 1826 O VAL A 107 0.486 -2.545 -13.431 1.00 75.02 O ATOM 1827 CB VAL A 107 3.615 -1.482 -12.418 1.00 14.20 C ATOM 1828 CG1 VAL A 107 4.515 -0.309 -11.972 1.00 62.45 C ATOM 1829 CG2 VAL A 107 3.242 -2.373 -11.217 1.00 42.33 C ATOM 0 H VAL A 107 0.726 -0.842 -11.807 1.00 21.53 H new ATOM 0 HA VAL A 107 2.626 -0.291 -13.961 1.00 50.20 H new ATOM 0 HB VAL A 107 4.191 -2.078 -13.125 1.00 14.20 H new ATOM 0 HG11 VAL A 107 5.391 -0.699 -11.454 1.00 62.45 H new ATOM 0 HG12 VAL A 107 4.833 0.258 -12.847 1.00 62.45 H new ATOM 0 HG13 VAL A 107 3.957 0.343 -11.300 1.00 62.45 H new ATOM 0 HG21 VAL A 107 4.150 -2.700 -10.711 1.00 42.33 H new ATOM 0 HG22 VAL A 107 2.623 -1.806 -10.522 1.00 42.33 H new ATOM 0 HG23 VAL A 107 2.689 -3.244 -11.568 1.00 42.33 H new ATOM 1839 N THR A 108 2.305 -2.859 -14.764 1.00 4.43 N ATOM 1840 CA THR A 108 1.779 -4.014 -15.518 1.00 40.01 C ATOM 1841 C THR A 108 2.626 -5.289 -15.300 1.00 14.13 C ATOM 1842 O THR A 108 2.133 -6.402 -15.521 1.00 1.33 O ATOM 1843 CB THR A 108 1.722 -3.678 -17.052 1.00 74.01 C ATOM 1844 OG1 THR A 108 3.014 -3.218 -17.504 1.00 44.22 O ATOM 1845 CG2 THR A 108 0.658 -2.603 -17.373 1.00 72.54 C ATOM 0 H THR A 108 3.254 -2.599 -15.034 1.00 4.43 H new ATOM 0 HA THR A 108 0.775 -4.212 -15.143 1.00 40.01 H new ATOM 0 HB THR A 108 1.444 -4.594 -17.574 1.00 74.01 H new ATOM 0 HG1 THR A 108 2.971 -3.012 -18.461 1.00 44.22 H new ATOM 0 HG21 THR A 108 0.655 -2.403 -18.444 1.00 72.54 H new ATOM 0 HG22 THR A 108 -0.325 -2.961 -17.068 1.00 72.54 H new ATOM 0 HG23 THR A 108 0.893 -1.686 -16.833 1.00 72.54 H new ATOM 1853 N ASP A 109 3.893 -5.133 -14.868 1.00 62.01 N ATOM 1854 CA ASP A 109 4.871 -6.258 -14.819 1.00 4.03 C ATOM 1855 C ASP A 109 5.402 -6.478 -13.382 1.00 35.42 C ATOM 1856 O ASP A 109 5.344 -5.570 -12.554 1.00 40.41 O ATOM 1857 CB ASP A 109 6.045 -5.969 -15.805 1.00 43.43 C ATOM 1858 CG ASP A 109 6.957 -7.186 -16.069 1.00 72.24 C ATOM 1859 OD1 ASP A 109 7.871 -7.448 -15.268 1.00 73.23 O ATOM 1860 OD2 ASP A 109 6.749 -7.897 -17.076 1.00 62.42 O ATOM 0 H ASP A 109 4.271 -4.242 -14.546 1.00 62.01 H new ATOM 0 HA ASP A 109 4.365 -7.175 -15.122 1.00 4.03 H new ATOM 0 HB2 ASP A 109 5.633 -5.624 -16.753 1.00 43.43 H new ATOM 0 HB3 ASP A 109 6.650 -5.155 -15.405 1.00 43.43 H new ATOM 1865 N ASP A 110 5.937 -7.697 -13.131 1.00 41.14 N ATOM 1866 CA ASP A 110 6.502 -8.128 -11.831 1.00 0.10 C ATOM 1867 C ASP A 110 7.784 -7.351 -11.478 1.00 71.24 C ATOM 1868 O ASP A 110 7.847 -6.696 -10.434 1.00 42.10 O ATOM 1869 CB ASP A 110 6.803 -9.663 -11.879 1.00 33.20 C ATOM 1870 CG ASP A 110 7.732 -10.169 -10.743 1.00 22.21 C ATOM 1871 OD1 ASP A 110 7.248 -10.476 -9.642 1.00 14.24 O ATOM 1872 OD2 ASP A 110 8.964 -10.271 -10.955 1.00 22.41 O ATOM 0 H ASP A 110 5.989 -8.424 -13.844 1.00 41.14 H new ATOM 0 HA ASP A 110 5.767 -7.916 -11.055 1.00 0.10 H new ATOM 0 HB2 ASP A 110 5.860 -10.208 -11.831 1.00 33.20 H new ATOM 0 HB3 ASP A 110 7.260 -9.902 -12.839 1.00 33.20 H new ATOM 1877 N GLU A 111 8.814 -7.443 -12.354 1.00 12.03 N ATOM 1878 CA GLU A 111 10.148 -6.853 -12.081 1.00 2.15 C ATOM 1879 C GLU A 111 10.108 -5.319 -12.178 1.00 11.34 C ATOM 1880 O GLU A 111 10.962 -4.629 -11.610 1.00 11.04 O ATOM 1881 CB GLU A 111 11.260 -7.500 -12.979 1.00 34.24 C ATOM 1882 CG GLU A 111 11.036 -7.490 -14.518 1.00 41.32 C ATOM 1883 CD GLU A 111 11.284 -6.134 -15.212 1.00 4.53 C ATOM 1884 OE1 GLU A 111 12.463 -5.784 -15.452 1.00 51.11 O ATOM 1885 OE2 GLU A 111 10.316 -5.404 -15.512 1.00 54.13 O ATOM 0 H GLU A 111 8.747 -7.919 -13.254 1.00 12.03 H new ATOM 0 HA GLU A 111 10.419 -7.089 -11.052 1.00 2.15 H new ATOM 0 HB2 GLU A 111 12.200 -6.987 -12.773 1.00 34.24 H new ATOM 0 HB3 GLU A 111 11.386 -8.536 -12.664 1.00 34.24 H new ATOM 0 HG2 GLU A 111 11.691 -8.235 -14.969 1.00 41.32 H new ATOM 0 HG3 GLU A 111 10.011 -7.802 -14.721 1.00 41.32 H new ATOM 1892 N GLU A 112 9.100 -4.811 -12.906 1.00 34.11 N ATOM 1893 CA GLU A 112 8.763 -3.385 -12.952 1.00 32.21 C ATOM 1894 C GLU A 112 8.185 -2.941 -11.599 1.00 74.05 C ATOM 1895 O GLU A 112 8.582 -1.905 -11.062 1.00 2.45 O ATOM 1896 CB GLU A 112 7.754 -3.128 -14.094 1.00 74.31 C ATOM 1897 CG GLU A 112 7.241 -1.675 -14.196 1.00 30.42 C ATOM 1898 CD GLU A 112 6.271 -1.453 -15.361 1.00 54.25 C ATOM 1899 OE1 GLU A 112 5.248 -2.175 -15.449 1.00 50.21 O ATOM 1900 OE2 GLU A 112 6.518 -0.555 -16.198 1.00 34.41 O ATOM 0 H GLU A 112 8.491 -5.389 -13.485 1.00 34.11 H new ATOM 0 HA GLU A 112 9.663 -2.802 -13.147 1.00 32.21 H new ATOM 0 HB2 GLU A 112 8.222 -3.400 -15.040 1.00 74.31 H new ATOM 0 HB3 GLU A 112 6.899 -3.791 -13.959 1.00 74.31 H new ATOM 0 HG2 GLU A 112 6.745 -1.406 -13.263 1.00 30.42 H new ATOM 0 HG3 GLU A 112 8.092 -1.004 -14.309 1.00 30.42 H new ATOM 1907 N ALA A 113 7.262 -3.766 -11.051 1.00 71.30 N ATOM 1908 CA ALA A 113 6.632 -3.522 -9.745 1.00 70.43 C ATOM 1909 C ALA A 113 7.679 -3.473 -8.623 1.00 73.32 C ATOM 1910 O ALA A 113 7.585 -2.628 -7.741 1.00 51.43 O ATOM 1911 CB ALA A 113 5.579 -4.596 -9.434 1.00 50.12 C ATOM 0 H ALA A 113 6.937 -4.618 -11.507 1.00 71.30 H new ATOM 0 HA ALA A 113 6.138 -2.552 -9.797 1.00 70.43 H new ATOM 0 HB1 ALA A 113 5.128 -4.393 -8.463 1.00 50.12 H new ATOM 0 HB2 ALA A 113 4.807 -4.582 -10.203 1.00 50.12 H new ATOM 0 HB3 ALA A 113 6.054 -5.577 -9.415 1.00 50.12 H new ATOM 1917 N LEU A 114 8.678 -4.382 -8.705 1.00 75.22 N ATOM 1918 CA LEU A 114 9.786 -4.486 -7.729 1.00 71.03 C ATOM 1919 C LEU A 114 10.606 -3.179 -7.655 1.00 32.24 C ATOM 1920 O LEU A 114 11.027 -2.774 -6.569 1.00 15.11 O ATOM 1921 CB LEU A 114 10.710 -5.680 -8.097 1.00 73.12 C ATOM 1922 CG LEU A 114 10.068 -7.100 -8.001 1.00 41.23 C ATOM 1923 CD1 LEU A 114 11.047 -8.180 -8.501 1.00 13.52 C ATOM 1924 CD2 LEU A 114 9.578 -7.399 -6.563 1.00 64.52 C ATOM 0 H LEU A 114 8.738 -5.069 -9.457 1.00 75.22 H new ATOM 0 HA LEU A 114 9.349 -4.658 -6.745 1.00 71.03 H new ATOM 0 HB2 LEU A 114 11.070 -5.534 -9.116 1.00 73.12 H new ATOM 0 HB3 LEU A 114 11.582 -5.653 -7.444 1.00 73.12 H new ATOM 0 HG LEU A 114 9.193 -7.119 -8.651 1.00 41.23 H new ATOM 0 HD11 LEU A 114 10.577 -9.161 -8.424 1.00 13.52 H new ATOM 0 HD12 LEU A 114 11.307 -7.982 -9.541 1.00 13.52 H new ATOM 0 HD13 LEU A 114 11.951 -8.162 -7.892 1.00 13.52 H new ATOM 0 HD21 LEU A 114 9.136 -8.395 -6.529 1.00 64.52 H new ATOM 0 HD22 LEU A 114 10.421 -7.353 -5.874 1.00 64.52 H new ATOM 0 HD23 LEU A 114 8.831 -6.660 -6.272 1.00 64.52 H new ATOM 1936 N LYS A 115 10.808 -2.535 -8.829 1.00 30.42 N ATOM 1937 CA LYS A 115 11.487 -1.222 -8.934 1.00 63.40 C ATOM 1938 C LYS A 115 10.715 -0.153 -8.144 1.00 44.44 C ATOM 1939 O LYS A 115 11.304 0.692 -7.473 1.00 13.23 O ATOM 1940 CB LYS A 115 11.586 -0.761 -10.414 1.00 43.33 C ATOM 1941 CG LYS A 115 12.392 -1.689 -11.343 1.00 21.54 C ATOM 1942 CD LYS A 115 12.377 -1.184 -12.808 1.00 3.34 C ATOM 1943 CE LYS A 115 13.173 -2.084 -13.761 1.00 42.42 C ATOM 1944 NZ LYS A 115 12.620 -3.464 -13.824 1.00 61.04 N ATOM 0 H LYS A 115 10.505 -2.910 -9.728 1.00 30.42 H new ATOM 0 HA LYS A 115 12.489 -1.341 -8.523 1.00 63.40 H new ATOM 0 HB2 LYS A 115 10.577 -0.662 -10.814 1.00 43.33 H new ATOM 0 HB3 LYS A 115 12.038 0.231 -10.438 1.00 43.33 H new ATOM 0 HG2 LYS A 115 13.421 -1.753 -10.990 1.00 21.54 H new ATOM 0 HG3 LYS A 115 11.977 -2.696 -11.301 1.00 21.54 H new ATOM 0 HD2 LYS A 115 11.345 -1.121 -13.154 1.00 3.34 H new ATOM 0 HD3 LYS A 115 12.787 -0.175 -12.843 1.00 3.34 H new ATOM 0 HE2 LYS A 115 13.169 -1.647 -14.759 1.00 42.42 H new ATOM 0 HE3 LYS A 115 14.212 -2.125 -13.436 1.00 42.42 H new ATOM 0 HZ1 LYS A 115 12.947 -3.930 -14.694 1.00 61.04 H new ATOM 0 HZ2 LYS A 115 12.945 -4.006 -12.998 1.00 61.04 H new ATOM 0 HZ3 LYS A 115 11.581 -3.422 -13.824 1.00 61.04 H new ATOM 1958 N ILE A 116 9.378 -0.221 -8.246 1.00 64.20 N ATOM 1959 CA ILE A 116 8.478 0.768 -7.647 1.00 61.33 C ATOM 1960 C ILE A 116 8.327 0.531 -6.125 1.00 42.24 C ATOM 1961 O ILE A 116 8.104 1.481 -5.367 1.00 43.43 O ATOM 1962 CB ILE A 116 7.078 0.765 -8.357 1.00 33.51 C ATOM 1963 CG1 ILE A 116 7.238 0.851 -9.911 1.00 42.33 C ATOM 1964 CG2 ILE A 116 6.194 1.915 -7.840 1.00 63.01 C ATOM 1965 CD1 ILE A 116 7.950 2.090 -10.436 1.00 3.50 C ATOM 0 H ILE A 116 8.894 -0.966 -8.747 1.00 64.20 H new ATOM 0 HA ILE A 116 8.923 1.752 -7.792 1.00 61.33 H new ATOM 0 HB ILE A 116 6.586 -0.177 -8.116 1.00 33.51 H new ATOM 0 HG12 ILE A 116 7.783 -0.030 -10.250 1.00 42.33 H new ATOM 0 HG13 ILE A 116 6.247 0.806 -10.362 1.00 42.33 H new ATOM 0 HG21 ILE A 116 5.230 1.890 -8.348 1.00 63.01 H new ATOM 0 HG22 ILE A 116 6.041 1.802 -6.767 1.00 63.01 H new ATOM 0 HG23 ILE A 116 6.684 2.868 -8.039 1.00 63.01 H new ATOM 0 HD11 ILE A 116 8.005 2.045 -11.524 1.00 3.50 H new ATOM 0 HD12 ILE A 116 7.398 2.981 -10.137 1.00 3.50 H new ATOM 0 HD13 ILE A 116 8.958 2.133 -10.024 1.00 3.50 H new ATOM 1977 N VAL A 117 8.464 -0.744 -5.690 1.00 23.14 N ATOM 1978 CA VAL A 117 8.554 -1.096 -4.257 1.00 71.24 C ATOM 1979 C VAL A 117 9.770 -0.383 -3.644 1.00 45.30 C ATOM 1980 O VAL A 117 9.661 0.231 -2.581 1.00 62.11 O ATOM 1981 CB VAL A 117 8.687 -2.650 -4.019 1.00 13.10 C ATOM 1982 CG1 VAL A 117 8.806 -2.981 -2.509 1.00 20.23 C ATOM 1983 CG2 VAL A 117 7.509 -3.420 -4.644 1.00 32.23 C ATOM 0 H VAL A 117 8.515 -1.548 -6.316 1.00 23.14 H new ATOM 0 HA VAL A 117 7.628 -0.774 -3.780 1.00 71.24 H new ATOM 0 HB VAL A 117 9.603 -2.972 -4.514 1.00 13.10 H new ATOM 0 HG11 VAL A 117 8.896 -4.059 -2.379 1.00 20.23 H new ATOM 0 HG12 VAL A 117 9.688 -2.491 -2.098 1.00 20.23 H new ATOM 0 HG13 VAL A 117 7.917 -2.626 -1.987 1.00 20.23 H new ATOM 0 HG21 VAL A 117 7.634 -4.487 -4.461 1.00 32.23 H new ATOM 0 HG22 VAL A 117 6.575 -3.082 -4.196 1.00 32.23 H new ATOM 0 HG23 VAL A 117 7.484 -3.237 -5.718 1.00 32.23 H new ATOM 1993 N ARG A 118 10.904 -0.440 -4.384 1.00 43.40 N ATOM 1994 CA ARG A 118 12.165 0.214 -3.997 1.00 54.34 C ATOM 1995 C ARG A 118 11.945 1.725 -3.846 1.00 53.43 C ATOM 1996 O ARG A 118 12.357 2.303 -2.845 1.00 60.13 O ATOM 1997 CB ARG A 118 13.282 -0.069 -5.036 1.00 63.35 C ATOM 1998 CG ARG A 118 13.682 -1.554 -5.163 1.00 41.04 C ATOM 1999 CD ARG A 118 14.768 -1.785 -6.226 1.00 30.43 C ATOM 2000 NE ARG A 118 16.025 -1.072 -5.907 1.00 44.03 N ATOM 2001 CZ ARG A 118 17.250 -1.423 -6.338 1.00 3.14 C ATOM 2002 NH1 ARG A 118 17.430 -2.491 -7.120 1.00 41.14 N ATOM 2003 NH2 ARG A 118 18.303 -0.698 -5.976 1.00 33.12 N ATOM 0 H ARG A 118 10.963 -0.944 -5.269 1.00 43.40 H new ATOM 0 HA ARG A 118 12.486 -0.197 -3.040 1.00 54.34 H new ATOM 0 HB2 ARG A 118 12.952 0.289 -6.011 1.00 63.35 H new ATOM 0 HB3 ARG A 118 14.166 0.510 -4.766 1.00 63.35 H new ATOM 0 HG2 ARG A 118 14.041 -1.914 -4.199 1.00 41.04 H new ATOM 0 HG3 ARG A 118 12.801 -2.144 -5.415 1.00 41.04 H new ATOM 0 HD2 ARG A 118 14.970 -2.853 -6.310 1.00 30.43 H new ATOM 0 HD3 ARG A 118 14.400 -1.452 -7.197 1.00 30.43 H new ATOM 0 HE ARG A 118 15.957 -0.247 -5.311 1.00 44.03 H new ATOM 0 HH11 ARG A 118 16.630 -3.058 -7.401 1.00 41.14 H new ATOM 0 HH12 ARG A 118 18.367 -2.740 -7.436 1.00 41.14 H new ATOM 0 HH21 ARG A 118 18.179 0.117 -5.376 1.00 33.12 H new ATOM 0 HH22 ARG A 118 19.236 -0.957 -6.298 1.00 33.12 H new ATOM 2017 N GLU A 119 11.239 2.333 -4.837 1.00 4.23 N ATOM 2018 CA GLU A 119 10.886 3.769 -4.826 1.00 0.24 C ATOM 2019 C GLU A 119 10.155 4.137 -3.526 1.00 3.05 C ATOM 2020 O GLU A 119 10.586 5.029 -2.800 1.00 51.41 O ATOM 2021 CB GLU A 119 9.996 4.137 -6.054 1.00 11.32 C ATOM 2022 CG GLU A 119 10.681 3.981 -7.426 1.00 13.43 C ATOM 2023 CD GLU A 119 11.912 4.888 -7.594 1.00 21.43 C ATOM 2024 OE1 GLU A 119 11.744 6.132 -7.621 1.00 13.14 O ATOM 2025 OE2 GLU A 119 13.043 4.377 -7.700 1.00 21.33 O ATOM 0 H GLU A 119 10.902 1.838 -5.662 1.00 4.23 H new ATOM 0 HA GLU A 119 11.814 4.338 -4.886 1.00 0.24 H new ATOM 0 HB2 GLU A 119 9.104 3.511 -6.037 1.00 11.32 H new ATOM 0 HB3 GLU A 119 9.664 5.169 -5.946 1.00 11.32 H new ATOM 0 HG2 GLU A 119 10.982 2.942 -7.559 1.00 13.43 H new ATOM 0 HG3 GLU A 119 9.961 4.207 -8.212 1.00 13.43 H new ATOM 2032 N PHE A 120 9.074 3.392 -3.229 1.00 42.21 N ATOM 2033 CA PHE A 120 8.246 3.609 -2.029 1.00 13.33 C ATOM 2034 C PHE A 120 9.056 3.454 -0.730 1.00 21.03 C ATOM 2035 O PHE A 120 8.837 4.204 0.208 1.00 60.33 O ATOM 2036 CB PHE A 120 7.022 2.652 -2.030 1.00 5.13 C ATOM 2037 CG PHE A 120 5.986 2.952 -3.118 1.00 42.24 C ATOM 2038 CD1 PHE A 120 5.669 4.270 -3.471 1.00 51.13 C ATOM 2039 CD2 PHE A 120 5.314 1.924 -3.775 1.00 44.22 C ATOM 2040 CE1 PHE A 120 4.724 4.541 -4.435 1.00 31.44 C ATOM 2041 CE2 PHE A 120 4.369 2.206 -4.734 1.00 25.13 C ATOM 2042 CZ PHE A 120 4.075 3.505 -5.062 1.00 33.20 C ATOM 0 H PHE A 120 8.750 2.622 -3.815 1.00 42.21 H new ATOM 0 HA PHE A 120 7.888 4.638 -2.064 1.00 13.33 H new ATOM 0 HB2 PHE A 120 7.376 1.629 -2.155 1.00 5.13 H new ATOM 0 HB3 PHE A 120 6.534 2.704 -1.057 1.00 5.13 H new ATOM 0 HD1 PHE A 120 6.174 5.088 -2.979 1.00 51.13 H new ATOM 0 HD2 PHE A 120 5.537 0.896 -3.529 1.00 44.22 H new ATOM 0 HE1 PHE A 120 4.494 5.563 -4.697 1.00 31.44 H new ATOM 0 HE2 PHE A 120 3.854 1.398 -5.233 1.00 25.13 H new ATOM 0 HZ PHE A 120 3.331 3.714 -5.816 1.00 33.20 H new ATOM 2052 N MET A 121 10.007 2.501 -0.717 1.00 42.24 N ATOM 2053 CA MET A 121 10.874 2.227 0.453 1.00 64.40 C ATOM 2054 C MET A 121 11.867 3.384 0.713 1.00 21.23 C ATOM 2055 O MET A 121 12.182 3.673 1.873 1.00 64.53 O ATOM 2056 CB MET A 121 11.633 0.885 0.240 1.00 60.55 C ATOM 2057 CG MET A 121 10.745 -0.374 0.305 1.00 44.34 C ATOM 2058 SD MET A 121 11.580 -1.864 -0.308 1.00 52.22 S ATOM 2059 CE MET A 121 13.042 -1.934 0.724 1.00 12.23 C ATOM 0 H MET A 121 10.199 1.897 -1.516 1.00 42.24 H new ATOM 0 HA MET A 121 10.240 2.145 1.336 1.00 64.40 H new ATOM 0 HB2 MET A 121 12.129 0.914 -0.730 1.00 60.55 H new ATOM 0 HB3 MET A 121 12.415 0.801 0.995 1.00 60.55 H new ATOM 0 HG2 MET A 121 10.432 -0.538 1.336 1.00 44.34 H new ATOM 0 HG3 MET A 121 9.841 -0.205 -0.280 1.00 44.34 H new ATOM 0 HE1 MET A 121 13.585 -2.858 0.524 1.00 12.23 H new ATOM 0 HE2 MET A 121 13.684 -1.081 0.504 1.00 12.23 H new ATOM 0 HE3 MET A 121 12.748 -1.906 1.773 1.00 12.23 H new ATOM 2069 N GLN A 122 12.348 4.036 -0.371 1.00 73.44 N ATOM 2070 CA GLN A 122 13.312 5.158 -0.273 1.00 41.25 C ATOM 2071 C GLN A 122 12.598 6.436 0.202 1.00 52.10 C ATOM 2072 O GLN A 122 13.069 7.123 1.117 1.00 14.23 O ATOM 2073 CB GLN A 122 14.015 5.410 -1.641 1.00 70.33 C ATOM 2074 CG GLN A 122 14.756 4.190 -2.238 1.00 4.32 C ATOM 2075 CD GLN A 122 15.776 3.551 -1.295 1.00 23.42 C ATOM 2076 OE1 GLN A 122 15.456 2.638 -0.526 1.00 13.43 O ATOM 2077 NE2 GLN A 122 17.015 4.021 -1.346 1.00 74.12 N ATOM 0 H GLN A 122 12.083 3.803 -1.328 1.00 73.44 H new ATOM 0 HA GLN A 122 14.075 4.888 0.457 1.00 41.25 H new ATOM 0 HB2 GLN A 122 13.267 5.747 -2.359 1.00 70.33 H new ATOM 0 HB3 GLN A 122 14.729 6.224 -1.519 1.00 70.33 H new ATOM 0 HG2 GLN A 122 14.021 3.437 -2.524 1.00 4.32 H new ATOM 0 HG3 GLN A 122 15.266 4.500 -3.150 1.00 4.32 H new ATOM 0 HE21 GLN A 122 17.248 4.776 -1.992 1.00 74.12 H new ATOM 0 HE22 GLN A 122 17.735 3.628 -0.740 1.00 74.12 H new ATOM 2086 N LYS A 123 11.439 6.721 -0.423 1.00 40.32 N ATOM 2087 CA LYS A 123 10.610 7.900 -0.097 1.00 51.54 C ATOM 2088 C LYS A 123 10.011 7.779 1.325 1.00 12.23 C ATOM 2089 O LYS A 123 9.816 8.789 2.011 1.00 4.04 O ATOM 2090 CB LYS A 123 9.488 8.111 -1.176 1.00 4.14 C ATOM 2091 CG LYS A 123 9.930 8.817 -2.496 1.00 4.41 C ATOM 2092 CD LYS A 123 10.967 8.018 -3.325 1.00 5.01 C ATOM 2093 CE LYS A 123 11.305 8.685 -4.665 1.00 45.53 C ATOM 2094 NZ LYS A 123 12.315 7.910 -5.440 1.00 51.21 N ATOM 0 H LYS A 123 11.051 6.142 -1.167 1.00 40.32 H new ATOM 0 HA LYS A 123 11.252 8.781 -0.110 1.00 51.54 H new ATOM 0 HB2 LYS A 123 9.070 7.137 -1.431 1.00 4.14 H new ATOM 0 HB3 LYS A 123 8.685 8.695 -0.727 1.00 4.14 H new ATOM 0 HG2 LYS A 123 9.049 8.996 -3.112 1.00 4.41 H new ATOM 0 HG3 LYS A 123 10.351 9.792 -2.250 1.00 4.41 H new ATOM 0 HD2 LYS A 123 11.881 7.904 -2.741 1.00 5.01 H new ATOM 0 HD3 LYS A 123 10.581 7.016 -3.511 1.00 5.01 H new ATOM 0 HE2 LYS A 123 10.396 8.788 -5.257 1.00 45.53 H new ATOM 0 HE3 LYS A 123 11.683 9.691 -4.483 1.00 45.53 H new ATOM 0 HZ1 LYS A 123 12.974 8.566 -5.905 1.00 51.21 H new ATOM 0 HZ2 LYS A 123 12.843 7.287 -4.796 1.00 51.21 H new ATOM 0 HZ3 LYS A 123 11.833 7.335 -6.160 1.00 51.21 H new ATOM 2108 N ALA A 124 9.741 6.527 1.751 1.00 10.13 N ATOM 2109 CA ALA A 124 9.234 6.221 3.102 1.00 50.11 C ATOM 2110 C ALA A 124 10.352 6.335 4.141 1.00 32.13 C ATOM 2111 O ALA A 124 10.129 6.853 5.236 1.00 75.43 O ATOM 2112 CB ALA A 124 8.605 4.822 3.136 1.00 62.03 C ATOM 0 H ALA A 124 9.869 5.701 1.167 1.00 10.13 H new ATOM 0 HA ALA A 124 8.464 6.951 3.351 1.00 50.11 H new ATOM 0 HB1 ALA A 124 8.236 4.613 4.140 1.00 62.03 H new ATOM 0 HB2 ALA A 124 7.777 4.778 2.429 1.00 62.03 H new ATOM 0 HB3 ALA A 124 9.355 4.079 2.863 1.00 62.03 H new ATOM 2118 N GLY A 125 11.554 5.841 3.790 1.00 43.45 N ATOM 2119 CA GLY A 125 12.724 5.944 4.665 1.00 33.53 C ATOM 2120 C GLY A 125 13.068 7.393 5.001 1.00 53.13 C ATOM 2121 O GLY A 125 13.473 7.700 6.132 1.00 1.53 O ATOM 0 H GLY A 125 11.735 5.367 2.905 1.00 43.45 H new ATOM 0 HA2 GLY A 125 12.535 5.394 5.587 1.00 33.53 H new ATOM 0 HA3 GLY A 125 13.579 5.472 4.182 1.00 33.53 H new ATOM 2125 N SER A 126 12.855 8.282 4.013 1.00 32.04 N ATOM 2126 CA SER A 126 13.071 9.735 4.139 1.00 24.34 C ATOM 2127 C SER A 126 12.113 10.394 5.158 1.00 73.22 C ATOM 2128 O SER A 126 12.428 11.450 5.699 1.00 71.41 O ATOM 2129 CB SER A 126 12.904 10.405 2.762 1.00 54.54 C ATOM 2130 OG SER A 126 13.911 9.992 1.853 1.00 71.03 O ATOM 0 H SER A 126 12.522 8.006 3.089 1.00 32.04 H new ATOM 0 HA SER A 126 14.086 9.879 4.511 1.00 24.34 H new ATOM 0 HB2 SER A 126 11.923 10.160 2.355 1.00 54.54 H new ATOM 0 HB3 SER A 126 12.940 11.488 2.877 1.00 54.54 H new ATOM 0 HG SER A 126 13.729 9.075 1.558 1.00 71.03 H new ATOM 2136 N LEU A 127 10.944 9.767 5.406 1.00 61.32 N ATOM 2137 CA LEU A 127 9.915 10.315 6.320 1.00 24.14 C ATOM 2138 C LEU A 127 10.423 10.354 7.775 1.00 33.51 C ATOM 2139 O LEU A 127 9.938 11.159 8.575 1.00 45.44 O ATOM 2140 CB LEU A 127 8.590 9.508 6.217 1.00 40.52 C ATOM 2141 CG LEU A 127 7.894 9.514 4.817 1.00 2.02 C ATOM 2142 CD1 LEU A 127 6.587 8.702 4.836 1.00 53.21 C ATOM 2143 CD2 LEU A 127 7.651 10.953 4.309 1.00 73.42 C ATOM 0 H LEU A 127 10.687 8.875 4.984 1.00 61.32 H new ATOM 0 HA LEU A 127 9.711 11.340 6.011 1.00 24.14 H new ATOM 0 HB2 LEU A 127 8.794 8.474 6.495 1.00 40.52 H new ATOM 0 HB3 LEU A 127 7.888 9.903 6.952 1.00 40.52 H new ATOM 0 HG LEU A 127 8.574 9.030 4.116 1.00 2.02 H new ATOM 0 HD11 LEU A 127 6.129 8.727 3.847 1.00 53.21 H new ATOM 0 HD12 LEU A 127 6.804 7.669 5.110 1.00 53.21 H new ATOM 0 HD13 LEU A 127 5.901 9.134 5.565 1.00 53.21 H new ATOM 0 HD21 LEU A 127 7.166 10.917 3.334 1.00 73.42 H new ATOM 0 HD22 LEU A 127 7.011 11.484 5.013 1.00 73.42 H new ATOM 0 HD23 LEU A 127 8.605 11.474 4.221 1.00 73.42 H new ATOM 2155 N GLU A 128 11.394 9.475 8.107 1.00 74.51 N ATOM 2156 CA GLU A 128 12.078 9.505 9.408 1.00 13.15 C ATOM 2157 C GLU A 128 13.200 10.561 9.368 1.00 32.31 C ATOM 2158 O GLU A 128 13.043 11.673 9.890 1.00 62.52 O ATOM 2159 CB GLU A 128 12.649 8.099 9.770 1.00 63.30 C ATOM 2160 CG GLU A 128 13.446 8.049 11.098 1.00 52.35 C ATOM 2161 CD GLU A 128 12.619 8.467 12.330 1.00 64.41 C ATOM 2162 OE1 GLU A 128 11.796 7.657 12.807 1.00 51.32 O ATOM 2163 OE2 GLU A 128 12.773 9.614 12.820 1.00 4.50 O ATOM 0 H GLU A 128 11.719 8.735 7.485 1.00 74.51 H new ATOM 0 HA GLU A 128 11.360 9.775 10.183 1.00 13.15 H new ATOM 0 HB2 GLU A 128 11.823 7.390 9.830 1.00 63.30 H new ATOM 0 HB3 GLU A 128 13.297 7.765 8.960 1.00 63.30 H new ATOM 0 HG2 GLU A 128 13.821 7.037 11.249 1.00 52.35 H new ATOM 0 HG3 GLU A 128 14.315 8.702 11.015 1.00 52.35 H new ATOM 2170 N HIS A 129 14.311 10.222 8.687 1.00 45.11 N ATOM 2171 CA HIS A 129 15.511 11.072 8.613 1.00 23.24 C ATOM 2172 C HIS A 129 15.796 11.364 7.139 1.00 24.01 C ATOM 2173 O HIS A 129 15.532 10.510 6.286 1.00 32.13 O ATOM 2174 CB HIS A 129 16.713 10.379 9.305 1.00 23.31 C ATOM 2175 CG HIS A 129 17.907 11.278 9.512 1.00 74.40 C ATOM 2176 ND1 HIS A 129 18.109 11.993 10.671 1.00 53.10 N ATOM 2177 CD2 HIS A 129 18.946 11.598 8.701 1.00 23.44 C ATOM 2178 CE1 HIS A 129 19.211 12.693 10.569 1.00 54.02 C ATOM 2179 NE2 HIS A 129 19.737 12.474 9.381 1.00 4.21 N ATOM 0 H HIS A 129 14.400 9.347 8.171 1.00 45.11 H new ATOM 0 HA HIS A 129 15.346 12.012 9.140 1.00 23.24 H new ATOM 0 HB2 HIS A 129 16.389 9.994 10.272 1.00 23.31 H new ATOM 0 HB3 HIS A 129 17.018 9.521 8.706 1.00 23.31 H new ATOM 0 HD2 HIS A 129 19.115 11.227 7.701 1.00 23.44 H new ATOM 0 HE1 HIS A 129 19.620 13.341 11.330 1.00 54.02 H new ATOM 0 HE2 HIS A 129 20.597 12.893 9.028 1.00 4.21 H new ATOM 2188 N HIS A 130 16.379 12.554 6.878 1.00 1.51 N ATOM 2189 CA HIS A 130 16.372 13.204 5.558 1.00 33.31 C ATOM 2190 C HIS A 130 14.914 13.525 5.218 1.00 1.35 C ATOM 2191 O HIS A 130 14.390 13.147 4.173 1.00 50.14 O ATOM 2192 CB HIS A 130 17.090 12.367 4.453 1.00 25.01 C ATOM 2193 CG HIS A 130 18.557 12.181 4.718 1.00 54.42 C ATOM 2194 ND1 HIS A 130 19.157 10.951 4.841 1.00 24.45 N ATOM 2195 CD2 HIS A 130 19.543 13.089 4.882 1.00 70.20 C ATOM 2196 CE1 HIS A 130 20.438 11.110 5.089 1.00 51.32 C ATOM 2197 NE2 HIS A 130 20.699 12.402 5.112 1.00 11.43 N ATOM 0 H HIS A 130 16.872 13.093 7.589 1.00 1.51 H new ATOM 0 HA HIS A 130 16.956 14.124 5.597 1.00 33.31 H new ATOM 0 HB2 HIS A 130 16.613 11.390 4.378 1.00 25.01 H new ATOM 0 HB3 HIS A 130 16.960 12.860 3.490 1.00 25.01 H new ATOM 0 HD2 HIS A 130 19.436 14.163 4.839 1.00 70.20 H new ATOM 0 HE1 HIS A 130 21.154 10.317 5.247 1.00 51.32 H new ATOM 0 HE2 HIS A 130 21.615 12.820 5.275 1.00 11.43 H new ATOM 2206 N HIS A 131 14.275 14.210 6.183 1.00 34.31 N ATOM 2207 CA HIS A 131 12.853 14.544 6.165 1.00 31.43 C ATOM 2208 C HIS A 131 12.616 15.701 5.171 1.00 70.33 C ATOM 2209 O HIS A 131 12.571 16.874 5.561 1.00 64.34 O ATOM 2210 CB HIS A 131 12.415 14.880 7.624 1.00 52.22 C ATOM 2211 CG HIS A 131 10.943 15.116 7.840 1.00 70.10 C ATOM 2212 ND1 HIS A 131 10.075 14.143 8.293 1.00 62.03 N ATOM 2213 CD2 HIS A 131 10.193 16.233 7.708 1.00 75.11 C ATOM 2214 CE1 HIS A 131 8.873 14.659 8.433 1.00 2.42 C ATOM 2215 NE2 HIS A 131 8.917 15.922 8.080 1.00 73.12 N ATOM 0 H HIS A 131 14.753 14.553 7.016 1.00 34.31 H new ATOM 0 HA HIS A 131 12.242 13.710 5.821 1.00 31.43 H new ATOM 0 HB2 HIS A 131 12.729 14.062 8.273 1.00 52.22 H new ATOM 0 HB3 HIS A 131 12.955 15.770 7.947 1.00 52.22 H new ATOM 0 HD1 HIS A 131 10.327 13.174 8.489 1.00 62.03 H new ATOM 0 HD2 HIS A 131 10.541 17.198 7.369 1.00 75.11 H new ATOM 0 HE1 HIS A 131 7.997 14.132 8.780 1.00 2.42 H new ATOM 2224 N HIS A 132 12.514 15.332 3.865 1.00 43.21 N ATOM 2225 CA HIS A 132 12.373 16.284 2.733 1.00 63.24 C ATOM 2226 C HIS A 132 11.216 17.278 2.958 1.00 10.40 C ATOM 2227 O HIS A 132 11.359 18.476 2.692 1.00 62.13 O ATOM 2228 CB HIS A 132 12.147 15.541 1.384 1.00 70.12 C ATOM 2229 CG HIS A 132 13.298 14.699 0.884 1.00 44.22 C ATOM 2230 ND1 HIS A 132 14.075 15.048 -0.201 1.00 21.21 N ATOM 2231 CD2 HIS A 132 13.750 13.490 1.271 1.00 62.41 C ATOM 2232 CE1 HIS A 132 14.949 14.091 -0.442 1.00 34.43 C ATOM 2233 NE2 HIS A 132 14.767 13.132 0.436 1.00 55.13 N ATOM 0 H HIS A 132 12.528 14.356 3.568 1.00 43.21 H new ATOM 0 HA HIS A 132 13.310 16.838 2.685 1.00 63.24 H new ATOM 0 HB2 HIS A 132 11.273 14.898 1.489 1.00 70.12 H new ATOM 0 HB3 HIS A 132 11.908 16.282 0.621 1.00 70.12 H new ATOM 0 HD2 HIS A 132 13.373 12.907 2.098 1.00 62.41 H new ATOM 0 HE1 HIS A 132 15.689 14.095 -1.228 1.00 34.43 H new ATOM 0 HE2 HIS A 132 15.298 12.263 0.485 1.00 55.13 H new ATOM 2242 N HIS A 133 10.084 16.756 3.472 1.00 31.10 N ATOM 2243 CA HIS A 133 8.862 17.543 3.738 1.00 72.24 C ATOM 2244 C HIS A 133 9.051 18.475 4.957 1.00 52.53 C ATOM 2245 O HIS A 133 8.601 18.168 6.065 1.00 12.12 O ATOM 2246 CB HIS A 133 7.641 16.592 3.952 1.00 63.24 C ATOM 2247 CG HIS A 133 7.089 15.998 2.686 1.00 64.44 C ATOM 2248 ND1 HIS A 133 5.902 16.415 2.124 1.00 32.53 N ATOM 2249 CD2 HIS A 133 7.553 15.012 1.881 1.00 51.12 C ATOM 2250 CE1 HIS A 133 5.668 15.724 1.032 1.00 32.31 C ATOM 2251 NE2 HIS A 133 6.653 14.868 0.855 1.00 33.12 N ATOM 0 H HIS A 133 9.991 15.770 3.716 1.00 31.10 H new ATOM 0 HA HIS A 133 8.666 18.171 2.869 1.00 72.24 H new ATOM 0 HB2 HIS A 133 7.938 15.783 4.619 1.00 63.24 H new ATOM 0 HB3 HIS A 133 6.848 17.146 4.455 1.00 63.24 H new ATOM 0 HD2 HIS A 133 8.462 14.445 2.021 1.00 51.12 H new ATOM 0 HE1 HIS A 133 4.810 15.839 0.386 1.00 32.31 H new ATOM 0 HE2 HIS A 133 6.734 14.207 0.083 1.00 33.12 H new ATOM 2260 N HIS A 134 9.728 19.613 4.735 1.00 42.50 N ATOM 2261 CA HIS A 134 10.005 20.619 5.782 1.00 71.53 C ATOM 2262 C HIS A 134 10.103 22.018 5.116 1.00 61.31 C ATOM 2263 O HIS A 134 9.515 22.989 5.633 1.00 71.43 O ATOM 2264 CB HIS A 134 11.296 20.267 6.599 1.00 44.31 C ATOM 2265 CG HIS A 134 12.616 20.462 5.871 1.00 3.14 C ATOM 2266 ND1 HIS A 134 13.095 19.585 4.923 1.00 72.01 N ATOM 2267 CD2 HIS A 134 13.538 21.459 5.946 1.00 53.12 C ATOM 2268 CE1 HIS A 134 14.244 20.028 4.456 1.00 62.44 C ATOM 2269 NE2 HIS A 134 14.532 21.160 5.056 1.00 4.11 N ATOM 2270 OXT HIS A 134 10.722 22.119 4.030 1.00 37.35 O ATOM 0 H HIS A 134 10.102 19.866 3.820 1.00 42.50 H new ATOM 0 HA HIS A 134 9.187 20.624 6.503 1.00 71.53 H new ATOM 0 HB2 HIS A 134 11.308 20.876 7.503 1.00 44.31 H new ATOM 0 HB3 HIS A 134 11.229 19.227 6.917 1.00 44.31 H new ATOM 0 HD1 HIS A 134 12.632 18.725 4.628 1.00 72.01 H new ATOM 0 HD2 HIS A 134 13.493 22.326 6.589 1.00 53.12 H new ATOM 0 HE1 HIS A 134 14.849 19.541 3.705 1.00 62.44 H new TER 2279 HIS A 134