USER MOD reduce.3.24.130724 H: found=0, std=0, add=1357, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1321 hydrogens (10 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 149 ASN : amide:sc= -8.47! C(o=-11!,f=-13!) USER MOD Set 1.2: A 153 TYR OH : rot -162:sc= -2.83! USER MOD Set 2.1: A 4 SER OG : rot 180:sc= -0.0303 USER MOD Set 2.2: A 113 TYR OH : rot 180:sc= -0.49 USER MOD Set 3.1: A 36 THR OG1 : rot -62:sc= -0.436 USER MOD Set 3.2: A 39 HIS : no HD1:sc= -1.33 K(o=-1.8,f=-0.96) USER MOD Set 4.1: A 6 MET CE :methyl -109:sc= -1.08 (180deg=-4.19!) USER MOD Set 4.2: A 155 TYR OH : rot 130:sc= -1.28 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -135:sc= -0.195 (180deg=-1.68!) USER MOD Single : A 9 MET CE :methyl 180:sc= -0.326 (180deg=-0.326) USER MOD Single : A 12 ASN : amide:sc= -7.02! C(o=-7!,f=-6.6!) USER MOD Single : A 17 LYS NZ :NH3+ -151:sc= -0.286 (180deg=-0.367) USER MOD Single : A 19 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 20 ASN : amide:sc= -4.57! C(o=-4.6!,f=-5.2!) USER MOD Single : A 27 SER OG : rot 180:sc= -0.0149 USER MOD Single : A 30 GLN : amide:sc= -0.27 X(o=-0.27,f=-0.49) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 147:sc= -0.356 (180deg=-1.85!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 78:sc= 1.13 USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 MET CE :methyl 160:sc= -0.131 (180deg=-0.863) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 ASN : amide:sc= -17.6! C(o=-18!,f=-29!) USER MOD Single : A 48 TYR OH : rot 180:sc= -0.0475 USER MOD Single : A 60 ASN : amide:sc= -3.99! C(o=-4!,f=-2.7!) USER MOD Single : A 64 THR OG1 : rot 37:sc= -2.54! USER MOD Single : A 66 ASN : amide:sc= -4.76! C(o=-4.8!,f=-4.3!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HE2:sc= -0.584 K(o=-0.58,f=-2.9!) USER MOD Single : A 74 CYS SG : rot 136:sc= 1.74 USER MOD Single : A 78 HIS : no HD1:sc= -0.102 X(o=-0.1,f=0) USER MOD Single : A 79 SER OG : rot 180:sc= -2.18! USER MOD Single : A 87 CYS SG : rot 69:sc= -0.235 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= -4.34! C(o=-4.3!,f=-7.6!) USER MOD Single : A 100 GLN : amide:sc= -13.8! C(o=-14!,f=-11!) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot -128:sc= 0.188 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot -82:sc= 1.21 USER MOD Single : A 116 LYS NZ :NH3+ 157:sc= -0.362 (180deg=-1.25!) USER MOD Single : A 118 HIS : no HD1:sc= -0.0301 X(o=-0.03,f=-0.12) USER MOD Single : A 119 HIS : no HE2:sc= -0.869 K(o=-0.87,f=-3!) USER MOD Single : A 125 THR OG1 : rot -115:sc= 0.133 USER MOD Single : A 130 MET CE :methyl 166:sc=-0.00352 (180deg=-0.35) USER MOD Single : A 132 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 133 THR OG1 : rot 165:sc= -0.681 USER MOD Single : A 134 ASN : amide:sc= -0.0997 K(o=-0.1,f=-2.6!) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0605) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 TYR OH : rot 180:sc= 0 USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 TYR OH : rot 180:sc=-0.00144 USER MOD Single : A 156 HIS : no HE2:sc= -3.9! K(o=-3.9!,f=-2.8) USER MOD Single : A 158 TYR OH : rot 61:sc= 0.00108 USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc= -6.18! C(o=-6.2!,f=-2.7!) USER MOD Single : A 162 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 173 NAP O2D : rot 19:sc= -1.06 USER MOD Single : A 173 NAP O3B : rot -170:sc= -0.937! USER MOD Single : A 173 NAP O3D : rot -110:sc= 0.261 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.373 -2.220 -0.314 1.00 23.51 N ATOM 2 CA MET A 1 2.084 -1.657 -1.496 1.00 1.34 C ATOM 3 C MET A 1 3.558 -2.043 -1.430 1.00 34.15 C ATOM 4 O MET A 1 4.010 -2.637 -0.451 1.00 52.51 O ATOM 5 CB MET A 1 1.942 -0.133 -1.494 1.00 20.22 C ATOM 6 CG MET A 1 0.459 0.242 -1.533 1.00 63.13 C ATOM 7 SD MET A 1 0.226 1.858 -0.753 1.00 52.24 S ATOM 8 CE MET A 1 -1.342 1.488 0.071 1.00 60.34 C ATOM 0 H1 MET A 1 0.478 -2.652 -0.621 1.00 23.51 H new ATOM 0 H2 MET A 1 1.969 -2.942 0.138 1.00 23.51 H new ATOM 0 H3 MET A 1 1.175 -1.459 0.367 1.00 23.51 H new ATOM 0 HA MET A 1 1.650 -2.056 -2.413 1.00 1.34 H new ATOM 0 HB2 MET A 1 2.410 0.285 -0.603 1.00 20.22 H new ATOM 0 HB3 MET A 1 2.458 0.292 -2.355 1.00 20.22 H new ATOM 0 HG2 MET A 1 0.107 0.270 -2.564 1.00 63.13 H new ATOM 0 HG3 MET A 1 -0.132 -0.513 -1.014 1.00 63.13 H new ATOM 0 HE1 MET A 1 -1.678 2.365 0.624 1.00 60.34 H new ATOM 0 HE2 MET A 1 -2.091 1.220 -0.675 1.00 60.34 H new ATOM 0 HE3 MET A 1 -1.203 0.655 0.761 1.00 60.34 H new ATOM 20 N ILE A 2 4.303 -1.700 -2.476 1.00 32.30 N ATOM 21 CA ILE A 2 5.726 -2.016 -2.523 1.00 25.25 C ATOM 22 C ILE A 2 6.552 -0.747 -2.711 1.00 12.31 C ATOM 23 O ILE A 2 6.535 -0.136 -3.779 1.00 63.25 O ATOM 24 CB ILE A 2 6.012 -2.984 -3.672 1.00 13.51 C ATOM 25 CG1 ILE A 2 5.043 -4.166 -3.598 1.00 4.53 C ATOM 26 CG2 ILE A 2 7.449 -3.497 -3.561 1.00 23.11 C ATOM 27 CD1 ILE A 2 5.380 -5.171 -4.700 1.00 11.12 C ATOM 0 H ILE A 2 3.949 -1.207 -3.296 1.00 32.30 H new ATOM 0 HA ILE A 2 6.004 -2.482 -1.578 1.00 25.25 H new ATOM 0 HB ILE A 2 5.882 -2.467 -4.623 1.00 13.51 H new ATOM 0 HG12 ILE A 2 5.111 -4.645 -2.621 1.00 4.53 H new ATOM 0 HG13 ILE A 2 4.017 -3.816 -3.711 1.00 4.53 H new ATOM 0 HG21 ILE A 2 7.653 -4.187 -4.380 1.00 23.11 H new ATOM 0 HG22 ILE A 2 8.141 -2.656 -3.614 1.00 23.11 H new ATOM 0 HG23 ILE A 2 7.578 -4.014 -2.610 1.00 23.11 H new ATOM 0 HD11 ILE A 2 4.690 -6.013 -4.648 1.00 11.12 H new ATOM 0 HD12 ILE A 2 5.290 -4.688 -5.673 1.00 11.12 H new ATOM 0 HD13 ILE A 2 6.401 -5.529 -4.566 1.00 11.12 H new ATOM 39 N VAL A 3 7.279 -0.361 -1.667 1.00 23.13 N ATOM 40 CA VAL A 3 8.113 0.833 -1.728 1.00 22.42 C ATOM 41 C VAL A 3 9.588 0.455 -1.640 1.00 31.32 C ATOM 42 O VAL A 3 10.120 0.242 -0.551 1.00 5.33 O ATOM 43 CB VAL A 3 7.757 1.781 -0.582 1.00 54.52 C ATOM 44 CG1 VAL A 3 8.569 3.071 -0.716 1.00 34.13 C ATOM 45 CG2 VAL A 3 6.264 2.112 -0.639 1.00 11.11 C ATOM 0 H VAL A 3 7.307 -0.854 -0.775 1.00 23.13 H new ATOM 0 HA VAL A 3 7.931 1.334 -2.679 1.00 22.42 H new ATOM 0 HB VAL A 3 7.988 1.303 0.370 1.00 54.52 H new ATOM 0 HG11 VAL A 3 8.316 3.747 0.101 1.00 34.13 H new ATOM 0 HG12 VAL A 3 9.633 2.837 -0.676 1.00 34.13 H new ATOM 0 HG13 VAL A 3 8.338 3.549 -1.668 1.00 34.13 H new ATOM 0 HG21 VAL A 3 6.010 2.788 0.178 1.00 11.11 H new ATOM 0 HG22 VAL A 3 6.033 2.590 -1.591 1.00 11.11 H new ATOM 0 HG23 VAL A 3 5.684 1.194 -0.544 1.00 11.11 H new ATOM 55 N SER A 4 10.240 0.368 -2.794 1.00 2.41 N ATOM 56 CA SER A 4 11.653 0.009 -2.836 1.00 11.10 C ATOM 57 C SER A 4 12.531 1.257 -2.865 1.00 32.41 C ATOM 58 O SER A 4 12.108 2.315 -3.328 1.00 42.52 O ATOM 59 CB SER A 4 11.938 -0.845 -4.070 1.00 55.10 C ATOM 60 OG SER A 4 10.975 -1.887 -4.153 1.00 31.22 O ATOM 0 H SER A 4 9.817 0.540 -3.706 1.00 2.41 H new ATOM 0 HA SER A 4 11.886 -0.560 -1.936 1.00 11.10 H new ATOM 0 HB2 SER A 4 11.903 -0.229 -4.969 1.00 55.10 H new ATOM 0 HB3 SER A 4 12.942 -1.266 -4.011 1.00 55.10 H new ATOM 0 HG SER A 4 11.154 -2.436 -4.945 1.00 31.22 H new ATOM 66 N PHE A 5 13.755 1.122 -2.364 1.00 4.13 N ATOM 67 CA PHE A 5 14.690 2.243 -2.334 1.00 63.30 C ATOM 68 C PHE A 5 16.020 1.845 -2.972 1.00 12.53 C ATOM 69 O PHE A 5 16.501 0.729 -2.778 1.00 74.52 O ATOM 70 CB PHE A 5 14.924 2.679 -0.886 1.00 13.11 C ATOM 71 CG PHE A 5 15.311 4.136 -0.846 1.00 22.31 C ATOM 72 CD1 PHE A 5 16.539 4.550 -1.375 1.00 40.45 C ATOM 73 CD2 PHE A 5 14.443 5.074 -0.276 1.00 31.24 C ATOM 74 CE1 PHE A 5 16.898 5.902 -1.334 1.00 23.04 C ATOM 75 CE2 PHE A 5 14.802 6.427 -0.234 1.00 42.13 C ATOM 76 CZ PHE A 5 16.030 6.841 -0.764 1.00 22.31 C ATOM 0 H PHE A 5 14.122 0.253 -1.975 1.00 4.13 H new ATOM 0 HA PHE A 5 14.263 3.071 -2.900 1.00 63.30 H new ATOM 0 HB2 PHE A 5 14.021 2.517 -0.298 1.00 13.11 H new ATOM 0 HB3 PHE A 5 15.710 2.072 -0.437 1.00 13.11 H new ATOM 0 HD1 PHE A 5 17.209 3.826 -1.815 1.00 40.45 H new ATOM 0 HD2 PHE A 5 13.495 4.754 0.132 1.00 31.24 H new ATOM 0 HE1 PHE A 5 17.845 6.221 -1.742 1.00 23.04 H new ATOM 0 HE2 PHE A 5 14.132 7.150 0.207 1.00 42.13 H new ATOM 0 HZ PHE A 5 16.308 7.884 -0.733 1.00 22.31 H new ATOM 86 N MET A 6 16.607 2.763 -3.735 1.00 24.25 N ATOM 87 CA MET A 6 17.879 2.490 -4.398 1.00 3.53 C ATOM 88 C MET A 6 18.925 3.534 -4.016 1.00 2.34 C ATOM 89 O MET A 6 18.830 4.696 -4.410 1.00 12.34 O ATOM 90 CB MET A 6 17.686 2.489 -5.916 1.00 34.22 C ATOM 91 CG MET A 6 16.956 1.212 -6.334 1.00 60.54 C ATOM 92 SD MET A 6 17.057 1.017 -8.132 1.00 35.41 S ATOM 93 CE MET A 6 18.603 0.077 -8.179 1.00 63.04 C ATOM 0 H MET A 6 16.227 3.694 -3.909 1.00 24.25 H new ATOM 0 HA MET A 6 18.230 1.510 -4.074 1.00 3.53 H new ATOM 0 HB2 MET A 6 17.114 3.365 -6.222 1.00 34.22 H new ATOM 0 HB3 MET A 6 18.652 2.549 -6.417 1.00 34.22 H new ATOM 0 HG2 MET A 6 17.400 0.348 -5.839 1.00 60.54 H new ATOM 0 HG3 MET A 6 15.913 1.258 -6.021 1.00 60.54 H new ATOM 0 HE1 MET A 6 19.398 0.704 -8.584 1.00 63.04 H new ATOM 0 HE2 MET A 6 18.868 -0.238 -7.170 1.00 63.04 H new ATOM 0 HE3 MET A 6 18.476 -0.801 -8.812 1.00 63.04 H new ATOM 103 N VAL A 7 19.922 3.110 -3.245 1.00 13.11 N ATOM 104 CA VAL A 7 20.982 4.014 -2.811 1.00 5.14 C ATOM 105 C VAL A 7 22.325 3.288 -2.777 1.00 72.13 C ATOM 106 O VAL A 7 22.386 2.098 -2.477 1.00 2.20 O ATOM 107 CB VAL A 7 20.661 4.561 -1.421 1.00 10.04 C ATOM 108 CG1 VAL A 7 20.632 3.408 -0.415 1.00 23.04 C ATOM 109 CG2 VAL A 7 21.735 5.570 -1.010 1.00 73.00 C ATOM 0 H VAL A 7 20.018 2.152 -2.909 1.00 13.11 H new ATOM 0 HA VAL A 7 21.046 4.839 -3.521 1.00 5.14 H new ATOM 0 HB VAL A 7 19.689 5.053 -1.439 1.00 10.04 H new ATOM 0 HG11 VAL A 7 20.403 3.797 0.577 1.00 23.04 H new ATOM 0 HG12 VAL A 7 19.868 2.688 -0.708 1.00 23.04 H new ATOM 0 HG13 VAL A 7 21.605 2.917 -0.397 1.00 23.04 H new ATOM 0 HG21 VAL A 7 21.507 5.961 -0.018 1.00 73.00 H new ATOM 0 HG22 VAL A 7 22.708 5.079 -0.991 1.00 73.00 H new ATOM 0 HG23 VAL A 7 21.757 6.391 -1.727 1.00 73.00 H new ATOM 119 N ALA A 8 23.399 4.008 -3.086 1.00 45.14 N ATOM 120 CA ALA A 8 24.731 3.409 -3.083 1.00 23.50 C ATOM 121 C ALA A 8 25.395 3.574 -1.718 1.00 23.14 C ATOM 122 O ALA A 8 24.850 4.225 -0.827 1.00 63.22 O ATOM 123 CB ALA A 8 25.602 4.064 -4.156 1.00 24.24 C ATOM 0 H ALA A 8 23.376 4.996 -3.339 1.00 45.14 H new ATOM 0 HA ALA A 8 24.627 2.345 -3.297 1.00 23.50 H new ATOM 0 HB1 ALA A 8 26.593 3.611 -4.146 1.00 24.24 H new ATOM 0 HB2 ALA A 8 25.145 3.917 -5.135 1.00 24.24 H new ATOM 0 HB3 ALA A 8 25.689 5.131 -3.953 1.00 24.24 H new ATOM 129 N MET A 9 26.574 2.977 -1.561 1.00 62.53 N ATOM 130 CA MET A 9 27.301 3.063 -0.298 1.00 31.35 C ATOM 131 C MET A 9 28.804 3.191 -0.543 1.00 4.43 C ATOM 132 O MET A 9 29.477 2.205 -0.846 1.00 13.54 O ATOM 133 CB MET A 9 27.028 1.814 0.546 1.00 73.41 C ATOM 134 CG MET A 9 26.038 2.156 1.662 1.00 14.31 C ATOM 135 SD MET A 9 26.824 3.281 2.842 1.00 43.14 S ATOM 136 CE MET A 9 25.421 3.440 3.975 1.00 22.50 C ATOM 0 H MET A 9 27.043 2.433 -2.286 1.00 62.53 H new ATOM 0 HA MET A 9 26.956 3.950 0.234 1.00 31.35 H new ATOM 0 HB2 MET A 9 26.624 1.020 -0.082 1.00 73.41 H new ATOM 0 HB3 MET A 9 27.959 1.441 0.973 1.00 73.41 H new ATOM 0 HG2 MET A 9 25.145 2.619 1.241 1.00 14.31 H new ATOM 0 HG3 MET A 9 25.717 1.246 2.169 1.00 14.31 H new ATOM 0 HE1 MET A 9 25.690 4.104 4.796 1.00 22.50 H new ATOM 0 HE2 MET A 9 24.566 3.853 3.440 1.00 22.50 H new ATOM 0 HE3 MET A 9 25.161 2.459 4.372 1.00 22.50 H new ATOM 146 N ASP A 10 29.326 4.408 -0.403 1.00 73.21 N ATOM 147 CA ASP A 10 30.754 4.640 -0.605 1.00 52.13 C ATOM 148 C ASP A 10 31.550 4.048 0.554 1.00 61.22 C ATOM 149 O ASP A 10 31.331 4.397 1.714 1.00 11.02 O ATOM 150 CB ASP A 10 31.039 6.138 -0.710 1.00 34.31 C ATOM 151 CG ASP A 10 30.711 6.636 -2.113 1.00 63.22 C ATOM 152 OD1 ASP A 10 30.780 5.840 -3.035 1.00 24.13 O ATOM 153 OD2 ASP A 10 30.397 7.808 -2.245 1.00 34.51 O ATOM 0 H ASP A 10 28.789 5.239 -0.154 1.00 73.21 H new ATOM 0 HA ASP A 10 31.056 4.155 -1.533 1.00 52.13 H new ATOM 0 HB2 ASP A 10 30.446 6.681 0.025 1.00 34.31 H new ATOM 0 HB3 ASP A 10 32.087 6.334 -0.482 1.00 34.31 H new ATOM 158 N GLU A 11 32.462 3.141 0.230 1.00 12.43 N ATOM 159 CA GLU A 11 33.274 2.479 1.246 1.00 24.11 C ATOM 160 C GLU A 11 33.937 3.476 2.197 1.00 43.41 C ATOM 161 O GLU A 11 34.261 3.125 3.331 1.00 63.42 O ATOM 162 CB GLU A 11 34.350 1.627 0.575 1.00 42.53 C ATOM 163 CG GLU A 11 35.304 2.530 -0.209 1.00 71.13 C ATOM 164 CD GLU A 11 36.595 2.728 0.576 1.00 13.21 C ATOM 165 OE1 GLU A 11 36.507 2.992 1.763 1.00 40.23 O ATOM 166 OE2 GLU A 11 37.653 2.610 -0.021 1.00 52.50 O ATOM 0 H GLU A 11 32.659 2.846 -0.726 1.00 12.43 H new ATOM 0 HA GLU A 11 32.607 1.850 1.835 1.00 24.11 H new ATOM 0 HB2 GLU A 11 34.902 1.063 1.326 1.00 42.53 H new ATOM 0 HB3 GLU A 11 33.888 0.901 -0.094 1.00 42.53 H new ATOM 0 HG2 GLU A 11 35.523 2.086 -1.180 1.00 71.13 H new ATOM 0 HG3 GLU A 11 34.832 3.494 -0.399 1.00 71.13 H new ATOM 173 N ASN A 12 34.145 4.711 1.750 1.00 41.00 N ATOM 174 CA ASN A 12 34.778 5.703 2.616 1.00 33.20 C ATOM 175 C ASN A 12 33.829 6.857 2.925 1.00 51.41 C ATOM 176 O ASN A 12 34.046 7.603 3.879 1.00 62.13 O ATOM 177 CB ASN A 12 36.037 6.254 1.942 1.00 34.33 C ATOM 178 CG ASN A 12 37.210 5.307 2.165 1.00 33.45 C ATOM 179 OD1 ASN A 12 37.409 4.814 3.275 1.00 63.43 O ATOM 180 ND2 ASN A 12 38.005 5.023 1.169 1.00 22.15 N ATOM 0 H ASN A 12 33.893 5.044 0.819 1.00 41.00 H new ATOM 0 HA ASN A 12 35.040 5.210 3.552 1.00 33.20 H new ATOM 0 HB2 ASN A 12 35.861 6.381 0.874 1.00 34.33 H new ATOM 0 HB3 ASN A 12 36.273 7.239 2.345 1.00 34.33 H new ATOM 0 HD21 ASN A 12 38.793 4.391 1.310 1.00 22.15 H new ATOM 0 HD22 ASN A 12 37.838 5.433 0.250 1.00 22.15 H new ATOM 187 N ARG A 13 32.766 6.978 2.135 1.00 13.42 N ATOM 188 CA ARG A 13 31.777 8.035 2.345 1.00 10.32 C ATOM 189 C ARG A 13 30.411 7.397 2.605 1.00 2.51 C ATOM 190 O ARG A 13 30.249 6.642 3.563 1.00 51.21 O ATOM 191 CB ARG A 13 31.708 8.952 1.109 1.00 42.15 C ATOM 192 CG ARG A 13 32.740 10.082 1.218 1.00 75.13 C ATOM 193 CD ARG A 13 34.114 9.514 1.565 1.00 73.45 C ATOM 194 NE ARG A 13 35.156 10.485 1.252 1.00 22.14 N ATOM 195 CZ ARG A 13 36.236 10.605 2.019 1.00 5.11 C ATOM 196 NH1 ARG A 13 36.391 9.827 3.055 1.00 13.25 N ATOM 197 NH2 ARG A 13 37.142 11.499 1.738 1.00 74.35 N ATOM 0 H ARG A 13 32.566 6.362 1.347 1.00 13.42 H new ATOM 0 HA ARG A 13 32.067 8.639 3.205 1.00 10.32 H new ATOM 0 HB2 ARG A 13 31.892 8.369 0.206 1.00 42.15 H new ATOM 0 HB3 ARG A 13 30.707 9.374 1.017 1.00 42.15 H new ATOM 0 HG2 ARG A 13 32.792 10.628 0.276 1.00 75.13 H new ATOM 0 HG3 ARG A 13 32.430 10.794 1.983 1.00 75.13 H new ATOM 0 HD2 ARG A 13 34.152 9.258 2.624 1.00 73.45 H new ATOM 0 HD3 ARG A 13 34.286 8.593 1.008 1.00 73.45 H new ATOM 0 HE ARG A 13 35.055 11.082 0.431 1.00 22.14 H new ATOM 0 HH11 ARG A 13 35.684 9.126 3.277 1.00 13.25 H new ATOM 0 HH12 ARG A 13 37.219 9.919 3.643 1.00 13.25 H new ATOM 0 HH21 ARG A 13 37.023 12.108 0.929 1.00 74.35 H new ATOM 0 HH22 ARG A 13 37.969 11.589 2.328 1.00 74.35 H new ATOM 211 N VAL A 14 29.441 7.672 1.737 1.00 42.21 N ATOM 212 CA VAL A 14 28.118 7.080 1.881 1.00 51.23 C ATOM 213 C VAL A 14 27.364 7.129 0.553 1.00 51.21 C ATOM 214 O VAL A 14 26.749 6.142 0.154 1.00 52.44 O ATOM 215 CB VAL A 14 27.323 7.762 3.005 1.00 42.41 C ATOM 216 CG1 VAL A 14 26.841 9.150 2.581 1.00 33.12 C ATOM 217 CG2 VAL A 14 26.115 6.892 3.359 1.00 71.03 C ATOM 0 H VAL A 14 29.546 8.294 0.936 1.00 42.21 H new ATOM 0 HA VAL A 14 28.240 6.034 2.161 1.00 51.23 H new ATOM 0 HB VAL A 14 27.976 7.879 3.870 1.00 42.41 H new ATOM 0 HG11 VAL A 14 26.282 9.606 3.398 1.00 33.12 H new ATOM 0 HG12 VAL A 14 27.700 9.774 2.336 1.00 33.12 H new ATOM 0 HG13 VAL A 14 26.197 9.060 1.706 1.00 33.12 H new ATOM 0 HG21 VAL A 14 25.545 7.368 4.156 1.00 71.03 H new ATOM 0 HG22 VAL A 14 25.481 6.774 2.480 1.00 71.03 H new ATOM 0 HG23 VAL A 14 26.457 5.913 3.693 1.00 71.03 H new ATOM 227 N ILE A 15 27.436 8.261 -0.150 1.00 63.15 N ATOM 228 CA ILE A 15 26.769 8.373 -1.450 1.00 73.42 C ATOM 229 C ILE A 15 27.394 9.488 -2.283 1.00 41.14 C ATOM 230 O ILE A 15 27.641 9.316 -3.477 1.00 42.42 O ATOM 231 CB ILE A 15 25.260 8.629 -1.297 1.00 73.10 C ATOM 232 CG1 ILE A 15 25.016 9.988 -0.640 1.00 62.34 C ATOM 233 CG2 ILE A 15 24.616 7.534 -0.444 1.00 34.42 C ATOM 234 CD1 ILE A 15 23.508 10.231 -0.533 1.00 53.11 C ATOM 0 H ILE A 15 27.938 9.097 0.150 1.00 63.15 H new ATOM 0 HA ILE A 15 26.904 7.420 -1.962 1.00 73.42 H new ATOM 0 HB ILE A 15 24.812 8.621 -2.290 1.00 73.10 H new ATOM 0 HG12 ILE A 15 25.472 10.014 0.350 1.00 62.34 H new ATOM 0 HG13 ILE A 15 25.483 10.779 -1.227 1.00 62.34 H new ATOM 0 HG21 ILE A 15 23.548 7.730 -0.346 1.00 34.42 H new ATOM 0 HG22 ILE A 15 24.764 6.566 -0.922 1.00 34.42 H new ATOM 0 HG23 ILE A 15 25.076 7.525 0.544 1.00 34.42 H new ATOM 0 HD11 ILE A 15 23.328 11.199 -0.065 1.00 53.11 H new ATOM 0 HD12 ILE A 15 23.066 10.222 -1.529 1.00 53.11 H new ATOM 0 HD13 ILE A 15 23.055 9.446 0.072 1.00 53.11 H new ATOM 246 N GLY A 16 27.647 10.630 -1.653 1.00 32.52 N ATOM 247 CA GLY A 16 28.242 11.761 -2.356 1.00 33.13 C ATOM 248 C GLY A 16 29.760 11.750 -2.219 1.00 54.33 C ATOM 249 O GLY A 16 30.303 12.205 -1.211 1.00 3.14 O ATOM 0 H GLY A 16 27.452 10.797 -0.666 1.00 32.52 H new ATOM 0 HA2 GLY A 16 27.968 11.724 -3.410 1.00 33.13 H new ATOM 0 HA3 GLY A 16 27.844 12.693 -1.956 1.00 33.13 H new ATOM 253 N LYS A 17 30.441 11.229 -3.237 1.00 3.22 N ATOM 254 CA LYS A 17 31.898 11.166 -3.211 1.00 41.33 C ATOM 255 C LYS A 17 32.504 12.414 -3.845 1.00 52.40 C ATOM 256 O LYS A 17 33.606 12.830 -3.487 1.00 42.44 O ATOM 257 CB LYS A 17 32.384 9.921 -3.957 1.00 55.40 C ATOM 258 CG LYS A 17 32.330 10.170 -5.465 1.00 61.00 C ATOM 259 CD LYS A 17 33.713 10.591 -5.962 1.00 5.31 C ATOM 260 CE LYS A 17 34.538 9.345 -6.287 1.00 54.04 C ATOM 261 NZ LYS A 17 34.037 8.735 -7.552 1.00 63.00 N ATOM 0 H LYS A 17 30.012 10.849 -4.081 1.00 3.22 H new ATOM 0 HA LYS A 17 32.219 11.112 -2.171 1.00 41.33 H new ATOM 0 HB2 LYS A 17 33.403 9.679 -3.655 1.00 55.40 H new ATOM 0 HB3 LYS A 17 31.762 9.064 -3.698 1.00 55.40 H new ATOM 0 HG2 LYS A 17 32.005 9.267 -5.982 1.00 61.00 H new ATOM 0 HG3 LYS A 17 31.599 10.947 -5.690 1.00 61.00 H new ATOM 0 HD2 LYS A 17 33.617 11.218 -6.848 1.00 5.31 H new ATOM 0 HD3 LYS A 17 34.218 11.187 -5.202 1.00 5.31 H new ATOM 0 HE2 LYS A 17 35.591 9.609 -6.390 1.00 54.04 H new ATOM 0 HE3 LYS A 17 34.468 8.626 -5.471 1.00 54.04 H new ATOM 0 HZ1 LYS A 17 34.208 7.709 -7.534 1.00 63.00 H new ATOM 0 HZ2 LYS A 17 33.017 8.915 -7.644 1.00 63.00 H new ATOM 0 HZ3 LYS A 17 34.537 9.155 -8.362 1.00 63.00 H new ATOM 275 N ASP A 18 31.779 13.009 -4.786 1.00 54.31 N ATOM 276 CA ASP A 18 32.258 14.211 -5.460 1.00 24.14 C ATOM 277 C ASP A 18 31.161 14.807 -6.333 1.00 44.21 C ATOM 278 O ASP A 18 31.042 14.474 -7.512 1.00 33.42 O ATOM 279 CB ASP A 18 33.477 13.880 -6.323 1.00 54.01 C ATOM 280 CG ASP A 18 34.159 15.167 -6.777 1.00 72.03 C ATOM 281 OD1 ASP A 18 34.138 16.123 -6.020 1.00 41.01 O ATOM 282 OD2 ASP A 18 34.691 15.177 -7.875 1.00 53.22 O ATOM 0 H ASP A 18 30.864 12.682 -5.098 1.00 54.31 H new ATOM 0 HA ASP A 18 32.541 14.940 -4.701 1.00 24.14 H new ATOM 0 HB2 ASP A 18 34.178 13.267 -5.757 1.00 54.01 H new ATOM 0 HB3 ASP A 18 33.171 13.295 -7.190 1.00 54.01 H new ATOM 287 N ASN A 19 30.361 15.689 -5.746 1.00 55.32 N ATOM 288 CA ASN A 19 29.274 16.324 -6.479 1.00 63.33 C ATOM 289 C ASN A 19 28.447 15.277 -7.218 1.00 34.11 C ATOM 290 O ASN A 19 27.697 15.603 -8.137 1.00 31.01 O ATOM 291 CB ASN A 19 29.835 17.333 -7.484 1.00 51.43 C ATOM 292 CG ASN A 19 30.997 18.100 -6.861 1.00 41.20 C ATOM 293 OD1 ASN A 19 30.925 18.503 -5.701 1.00 44.42 O ATOM 294 ND2 ASN A 19 32.071 18.326 -7.568 1.00 54.22 N ATOM 0 H ASN A 19 30.444 15.979 -4.772 1.00 55.32 H new ATOM 0 HA ASN A 19 28.635 16.843 -5.764 1.00 63.33 H new ATOM 0 HB2 ASN A 19 30.171 16.815 -8.383 1.00 51.43 H new ATOM 0 HB3 ASN A 19 29.052 18.028 -7.790 1.00 51.43 H new ATOM 0 HD21 ASN A 19 32.853 18.838 -7.159 1.00 54.22 H new ATOM 0 HD22 ASN A 19 32.128 17.991 -8.530 1.00 54.22 H new ATOM 301 N ASN A 20 28.589 14.018 -6.812 1.00 2.34 N ATOM 302 CA ASN A 20 27.844 12.940 -7.452 1.00 41.12 C ATOM 303 C ASN A 20 28.328 11.572 -6.976 1.00 1.04 C ATOM 304 O ASN A 20 29.250 11.469 -6.164 1.00 64.22 O ATOM 305 CB ASN A 20 28.003 13.034 -8.970 1.00 30.44 C ATOM 306 CG ASN A 20 29.417 13.488 -9.318 1.00 13.13 C ATOM 307 OD1 ASN A 20 29.630 14.652 -9.659 1.00 62.42 O ATOM 308 ND2 ASN A 20 30.401 12.633 -9.253 1.00 20.42 N ATOM 0 H ASN A 20 29.204 13.723 -6.054 1.00 2.34 H new ATOM 0 HA ASN A 20 26.794 13.047 -7.179 1.00 41.12 H new ATOM 0 HB2 ASN A 20 27.801 12.065 -9.426 1.00 30.44 H new ATOM 0 HB3 ASN A 20 27.276 13.736 -9.378 1.00 30.44 H new ATOM 0 HD21 ASN A 20 31.349 12.928 -9.485 1.00 20.42 H new ATOM 0 HD22 ASN A 20 30.222 11.670 -8.970 1.00 20.42 H new ATOM 315 N LEU A 21 27.693 10.526 -7.500 1.00 4.31 N ATOM 316 CA LEU A 21 28.046 9.155 -7.146 1.00 50.11 C ATOM 317 C LEU A 21 28.850 8.514 -8.275 1.00 51.22 C ATOM 318 O LEU A 21 28.700 8.884 -9.439 1.00 50.54 O ATOM 319 CB LEU A 21 26.772 8.340 -6.900 1.00 61.14 C ATOM 320 CG LEU A 21 25.817 8.518 -8.087 1.00 4.41 C ATOM 321 CD1 LEU A 21 24.767 7.401 -8.086 1.00 11.22 C ATOM 322 CD2 LEU A 21 25.113 9.875 -7.980 1.00 51.33 C ATOM 0 H LEU A 21 26.930 10.603 -8.172 1.00 4.31 H new ATOM 0 HA LEU A 21 28.650 9.168 -6.239 1.00 50.11 H new ATOM 0 HB2 LEU A 21 27.020 7.286 -6.773 1.00 61.14 H new ATOM 0 HB3 LEU A 21 26.290 8.667 -5.979 1.00 61.14 H new ATOM 0 HG LEU A 21 26.389 8.473 -9.014 1.00 4.41 H new ATOM 0 HD11 LEU A 21 24.093 7.535 -8.932 1.00 11.22 H new ATOM 0 HD12 LEU A 21 25.264 6.434 -8.167 1.00 11.22 H new ATOM 0 HD13 LEU A 21 24.197 7.439 -7.158 1.00 11.22 H new ATOM 0 HD21 LEU A 21 24.435 10.001 -8.824 1.00 51.33 H new ATOM 0 HD22 LEU A 21 24.547 9.919 -7.050 1.00 51.33 H new ATOM 0 HD23 LEU A 21 25.856 10.672 -7.990 1.00 51.33 H new ATOM 334 N PRO A 22 29.693 7.567 -7.957 1.00 21.32 N ATOM 335 CA PRO A 22 30.529 6.872 -8.976 1.00 33.30 C ATOM 336 C PRO A 22 29.690 5.988 -9.896 1.00 24.32 C ATOM 337 O PRO A 22 28.545 5.662 -9.584 1.00 74.33 O ATOM 338 CB PRO A 22 31.516 6.040 -8.153 1.00 73.21 C ATOM 339 CG PRO A 22 30.904 5.889 -6.798 1.00 43.40 C ATOM 340 CD PRO A 22 29.938 7.059 -6.599 1.00 70.13 C ATOM 0 HA PRO A 22 31.029 7.576 -9.641 1.00 33.30 H new ATOM 0 HB2 PRO A 22 31.685 5.067 -8.615 1.00 73.21 H new ATOM 0 HB3 PRO A 22 32.485 6.535 -8.090 1.00 73.21 H new ATOM 0 HG2 PRO A 22 30.377 4.938 -6.719 1.00 43.40 H new ATOM 0 HG3 PRO A 22 31.674 5.892 -6.027 1.00 43.40 H new ATOM 0 HD2 PRO A 22 29.013 6.734 -6.124 1.00 70.13 H new ATOM 0 HD3 PRO A 22 30.372 7.828 -5.960 1.00 70.13 H new ATOM 348 N TRP A 23 30.262 5.619 -11.037 1.00 32.00 N ATOM 349 CA TRP A 23 29.554 4.788 -12.006 1.00 3.31 C ATOM 350 C TRP A 23 29.574 3.317 -11.597 1.00 23.50 C ATOM 351 O TRP A 23 30.308 2.921 -10.692 1.00 32.33 O ATOM 352 CB TRP A 23 30.193 4.949 -13.385 1.00 11.53 C ATOM 353 CG TRP A 23 30.432 6.401 -13.649 1.00 25.42 C ATOM 354 CD1 TRP A 23 29.781 7.416 -13.036 1.00 31.41 C ATOM 355 CD2 TRP A 23 31.373 7.018 -14.575 1.00 51.22 C ATOM 356 NE1 TRP A 23 30.261 8.616 -13.526 1.00 42.41 N ATOM 357 CE2 TRP A 23 31.243 8.424 -14.477 1.00 24.21 C ATOM 358 CE3 TRP A 23 32.316 6.500 -15.481 1.00 44.32 C ATOM 359 CZ2 TRP A 23 32.021 9.286 -15.250 1.00 33.54 C ATOM 360 CZ3 TRP A 23 33.101 7.366 -16.261 1.00 11.00 C ATOM 361 CH2 TRP A 23 32.954 8.755 -16.145 1.00 3.23 C ATOM 0 H TRP A 23 31.209 5.880 -11.313 1.00 32.00 H new ATOM 0 HA TRP A 23 28.515 5.115 -12.039 1.00 3.31 H new ATOM 0 HB2 TRP A 23 31.133 4.399 -13.430 1.00 11.53 H new ATOM 0 HB3 TRP A 23 29.542 4.530 -14.152 1.00 11.53 H new ATOM 0 HD1 TRP A 23 29.012 7.307 -12.286 1.00 31.41 H new ATOM 0 HE1 TRP A 23 29.930 9.532 -13.222 1.00 42.41 H new ATOM 0 HE3 TRP A 23 32.437 5.431 -15.578 1.00 44.32 H new ATOM 0 HZ2 TRP A 23 31.903 10.356 -15.158 1.00 33.54 H new ATOM 0 HZ3 TRP A 23 33.822 6.959 -16.954 1.00 11.00 H new ATOM 0 HH2 TRP A 23 33.561 9.415 -16.747 1.00 3.23 H new ATOM 372 N ARG A 24 28.758 2.516 -12.278 1.00 73.13 N ATOM 373 CA ARG A 24 28.677 1.088 -11.991 1.00 35.05 C ATOM 374 C ARG A 24 27.840 0.382 -13.056 1.00 40.22 C ATOM 375 O ARG A 24 26.617 0.523 -13.090 1.00 33.32 O ATOM 376 CB ARG A 24 28.049 0.865 -10.614 1.00 53.31 C ATOM 377 CG ARG A 24 27.828 -0.633 -10.391 1.00 23.34 C ATOM 378 CD ARG A 24 27.474 -0.884 -8.924 1.00 22.40 C ATOM 379 NE ARG A 24 26.166 -0.318 -8.616 1.00 42.23 N ATOM 380 CZ ARG A 24 25.050 -0.879 -9.072 1.00 23.33 C ATOM 381 NH1 ARG A 24 25.114 -1.956 -9.806 1.00 40.43 N ATOM 382 NH2 ARG A 24 23.891 -0.353 -8.784 1.00 62.24 N ATOM 0 H ARG A 24 28.145 2.831 -13.030 1.00 73.13 H new ATOM 0 HA ARG A 24 29.685 0.674 -11.998 1.00 35.05 H new ATOM 0 HB2 ARG A 24 28.699 1.267 -9.837 1.00 53.31 H new ATOM 0 HB3 ARG A 24 27.101 1.398 -10.544 1.00 53.31 H new ATOM 0 HG2 ARG A 24 27.027 -0.993 -11.036 1.00 23.34 H new ATOM 0 HG3 ARG A 24 28.727 -1.188 -10.659 1.00 23.34 H new ATOM 0 HD2 ARG A 24 27.471 -1.955 -8.721 1.00 22.40 H new ATOM 0 HD3 ARG A 24 28.232 -0.439 -8.279 1.00 22.40 H new ATOM 0 HE ARG A 24 26.106 0.522 -8.041 1.00 42.23 H new ATOM 0 HH11 ARG A 24 26.020 -2.367 -10.030 1.00 40.43 H new ATOM 0 HH12 ARG A 24 24.258 -2.386 -10.156 1.00 40.43 H new ATOM 0 HH21 ARG A 24 23.841 0.488 -8.209 1.00 62.24 H new ATOM 0 HH22 ARG A 24 23.035 -0.783 -9.134 1.00 62.24 H new ATOM 396 N LEU A 25 28.506 -0.370 -13.926 1.00 1.24 N ATOM 397 CA LEU A 25 27.813 -1.087 -14.992 1.00 44.05 C ATOM 398 C LEU A 25 26.774 -0.184 -15.651 1.00 14.11 C ATOM 399 O LEU A 25 25.566 -0.406 -15.533 1.00 50.22 O ATOM 400 CB LEU A 25 27.135 -2.341 -14.431 1.00 15.31 C ATOM 401 CG LEU A 25 27.914 -3.583 -14.872 1.00 22.42 C ATOM 402 CD1 LEU A 25 27.821 -3.733 -16.391 1.00 61.34 C ATOM 403 CD2 LEU A 25 29.382 -3.435 -14.466 1.00 1.24 C ATOM 0 H LEU A 25 29.518 -0.499 -13.915 1.00 1.24 H new ATOM 0 HA LEU A 25 28.545 -1.385 -15.742 1.00 44.05 H new ATOM 0 HB2 LEU A 25 27.096 -2.290 -13.343 1.00 15.31 H new ATOM 0 HB3 LEU A 25 26.106 -2.400 -14.784 1.00 15.31 H new ATOM 0 HG LEU A 25 27.490 -4.465 -14.393 1.00 22.42 H new ATOM 0 HD11 LEU A 25 28.376 -4.617 -16.704 1.00 61.34 H new ATOM 0 HD12 LEU A 25 26.776 -3.838 -16.683 1.00 61.34 H new ATOM 0 HD13 LEU A 25 28.245 -2.850 -16.870 1.00 61.34 H new ATOM 0 HD21 LEU A 25 29.937 -4.319 -14.780 1.00 1.24 H new ATOM 0 HD22 LEU A 25 29.805 -2.552 -14.945 1.00 1.24 H new ATOM 0 HD23 LEU A 25 29.451 -3.328 -13.383 1.00 1.24 H new ATOM 415 N PRO A 26 27.229 0.826 -16.340 1.00 74.31 N ATOM 416 CA PRO A 26 26.340 1.794 -17.042 1.00 2.42 C ATOM 417 C PRO A 26 25.273 1.091 -17.876 1.00 15.02 C ATOM 418 O PRO A 26 24.152 1.582 -18.010 1.00 31.12 O ATOM 419 CB PRO A 26 27.295 2.586 -17.938 1.00 45.11 C ATOM 420 CG PRO A 26 28.642 2.464 -17.304 1.00 61.44 C ATOM 421 CD PRO A 26 28.652 1.150 -16.522 1.00 22.33 C ATOM 0 HA PRO A 26 25.788 2.422 -16.342 1.00 2.42 H new ATOM 0 HB2 PRO A 26 27.302 2.186 -18.952 1.00 45.11 H new ATOM 0 HB3 PRO A 26 26.989 3.630 -18.009 1.00 45.11 H new ATOM 0 HG2 PRO A 26 29.426 2.468 -18.061 1.00 61.44 H new ATOM 0 HG3 PRO A 26 28.834 3.308 -16.642 1.00 61.44 H new ATOM 0 HD2 PRO A 26 29.172 0.365 -17.070 1.00 22.33 H new ATOM 0 HD3 PRO A 26 29.161 1.261 -15.564 1.00 22.33 H new ATOM 429 N SER A 27 25.631 -0.061 -18.434 1.00 71.21 N ATOM 430 CA SER A 27 24.699 -0.824 -19.257 1.00 32.33 C ATOM 431 C SER A 27 23.534 -1.338 -18.417 1.00 64.31 C ATOM 432 O SER A 27 22.373 -1.212 -18.808 1.00 14.43 O ATOM 433 CB SER A 27 25.421 -2.005 -19.904 1.00 1.13 C ATOM 434 OG SER A 27 26.104 -2.744 -18.900 1.00 74.14 O ATOM 0 H SER A 27 26.553 -0.485 -18.333 1.00 71.21 H new ATOM 0 HA SER A 27 24.309 -0.165 -20.033 1.00 32.33 H new ATOM 0 HB2 SER A 27 24.706 -2.645 -20.420 1.00 1.13 H new ATOM 0 HB3 SER A 27 26.128 -1.648 -20.653 1.00 1.13 H new ATOM 0 HG SER A 27 26.567 -3.504 -19.311 1.00 74.14 H new ATOM 439 N GLU A 28 23.848 -1.917 -17.263 1.00 60.23 N ATOM 440 CA GLU A 28 22.812 -2.444 -16.383 1.00 33.42 C ATOM 441 C GLU A 28 21.789 -1.361 -16.061 1.00 53.03 C ATOM 442 O GLU A 28 20.583 -1.608 -16.074 1.00 54.43 O ATOM 443 CB GLU A 28 23.434 -2.959 -15.084 1.00 11.23 C ATOM 444 CG GLU A 28 22.358 -3.644 -14.239 1.00 2.33 C ATOM 445 CD GLU A 28 21.834 -2.681 -13.178 1.00 51.32 C ATOM 446 OE1 GLU A 28 22.638 -1.956 -12.615 1.00 4.14 O ATOM 447 OE2 GLU A 28 20.637 -2.683 -12.943 1.00 55.13 O ATOM 0 H GLU A 28 24.801 -2.033 -16.918 1.00 60.23 H new ATOM 0 HA GLU A 28 22.313 -3.267 -16.894 1.00 33.42 H new ATOM 0 HB2 GLU A 28 24.238 -3.661 -15.307 1.00 11.23 H new ATOM 0 HB3 GLU A 28 23.877 -2.133 -14.528 1.00 11.23 H new ATOM 0 HG2 GLU A 28 21.539 -3.975 -14.877 1.00 2.33 H new ATOM 0 HG3 GLU A 28 22.770 -4.533 -13.762 1.00 2.33 H new ATOM 454 N LEU A 29 22.279 -0.161 -15.770 1.00 65.32 N ATOM 455 CA LEU A 29 21.396 0.951 -15.444 1.00 70.41 C ATOM 456 C LEU A 29 20.394 1.183 -16.576 1.00 73.35 C ATOM 457 O LEU A 29 19.261 1.604 -16.341 1.00 44.31 O ATOM 458 CB LEU A 29 22.232 2.214 -15.173 1.00 52.42 C ATOM 459 CG LEU A 29 22.084 3.231 -16.310 1.00 45.14 C ATOM 460 CD1 LEU A 29 20.762 3.985 -16.153 1.00 42.55 C ATOM 461 CD2 LEU A 29 23.242 4.230 -16.244 1.00 74.45 C ATOM 0 H LEU A 29 23.274 0.065 -15.753 1.00 65.32 H new ATOM 0 HA LEU A 29 20.831 0.712 -14.543 1.00 70.41 H new ATOM 0 HB2 LEU A 29 21.917 2.667 -14.233 1.00 52.42 H new ATOM 0 HB3 LEU A 29 23.281 1.941 -15.060 1.00 52.42 H new ATOM 0 HG LEU A 29 22.096 2.711 -17.268 1.00 45.14 H new ATOM 0 HD11 LEU A 29 20.657 4.708 -16.962 1.00 42.55 H new ATOM 0 HD12 LEU A 29 19.933 3.278 -16.189 1.00 42.55 H new ATOM 0 HD13 LEU A 29 20.752 4.507 -15.196 1.00 42.55 H new ATOM 0 HD21 LEU A 29 23.142 4.956 -17.051 1.00 74.45 H new ATOM 0 HD22 LEU A 29 23.222 4.748 -15.285 1.00 74.45 H new ATOM 0 HD23 LEU A 29 24.188 3.698 -16.349 1.00 74.45 H new ATOM 473 N GLN A 30 20.820 0.896 -17.803 1.00 51.51 N ATOM 474 CA GLN A 30 19.952 1.070 -18.963 1.00 61.11 C ATOM 475 C GLN A 30 18.901 -0.035 -19.020 1.00 3.54 C ATOM 476 O GLN A 30 17.715 0.235 -19.211 1.00 72.41 O ATOM 477 CB GLN A 30 20.784 1.050 -20.248 1.00 12.32 C ATOM 478 CG GLN A 30 21.577 2.353 -20.366 1.00 74.24 C ATOM 479 CD GLN A 30 20.627 3.521 -20.608 1.00 12.34 C ATOM 480 OE1 GLN A 30 19.777 3.457 -21.496 1.00 24.42 O ATOM 481 NE2 GLN A 30 20.721 4.590 -19.866 1.00 72.11 N ATOM 0 H GLN A 30 21.753 0.545 -18.019 1.00 51.51 H new ATOM 0 HA GLN A 30 19.447 2.032 -18.871 1.00 61.11 H new ATOM 0 HB2 GLN A 30 21.464 0.198 -20.240 1.00 12.32 H new ATOM 0 HB3 GLN A 30 20.132 0.929 -21.113 1.00 12.32 H new ATOM 0 HG2 GLN A 30 22.151 2.523 -19.455 1.00 74.24 H new ATOM 0 HG3 GLN A 30 22.293 2.280 -21.185 1.00 74.24 H new ATOM 0 HE21 GLN A 30 21.426 4.640 -19.131 1.00 72.11 H new ATOM 0 HE22 GLN A 30 20.089 5.376 -20.021 1.00 72.11 H new ATOM 490 N TYR A 31 19.341 -1.279 -18.854 1.00 24.35 N ATOM 491 CA TYR A 31 18.423 -2.413 -18.890 1.00 22.05 C ATOM 492 C TYR A 31 17.351 -2.270 -17.814 1.00 50.21 C ATOM 493 O TYR A 31 16.153 -2.326 -18.099 1.00 24.15 O ATOM 494 CB TYR A 31 19.195 -3.715 -18.663 1.00 42.24 C ATOM 495 CG TYR A 31 19.786 -4.189 -19.970 1.00 72.34 C ATOM 496 CD1 TYR A 31 20.653 -3.358 -20.691 1.00 4.43 C ATOM 497 CD2 TYR A 31 19.467 -5.461 -20.460 1.00 54.13 C ATOM 498 CE1 TYR A 31 21.200 -3.800 -21.902 1.00 1.03 C ATOM 499 CE2 TYR A 31 20.015 -5.902 -21.671 1.00 45.52 C ATOM 500 CZ TYR A 31 20.881 -5.072 -22.392 1.00 5.53 C ATOM 501 OH TYR A 31 21.422 -5.507 -23.585 1.00 1.33 O ATOM 0 H TYR A 31 20.318 -1.526 -18.695 1.00 24.35 H new ATOM 0 HA TYR A 31 17.943 -2.435 -19.868 1.00 22.05 H new ATOM 0 HB2 TYR A 31 19.987 -3.557 -17.931 1.00 42.24 H new ATOM 0 HB3 TYR A 31 18.531 -4.477 -18.255 1.00 42.24 H new ATOM 0 HD1 TYR A 31 20.900 -2.377 -20.313 1.00 4.43 H new ATOM 0 HD2 TYR A 31 18.799 -6.102 -19.904 1.00 54.13 H new ATOM 0 HE1 TYR A 31 21.868 -3.159 -22.458 1.00 1.03 H new ATOM 0 HE2 TYR A 31 19.769 -6.883 -22.049 1.00 45.52 H new ATOM 0 HH TYR A 31 21.099 -6.412 -23.780 1.00 1.33 H new ATOM 511 N VAL A 32 17.791 -2.082 -16.575 1.00 13.43 N ATOM 512 CA VAL A 32 16.866 -1.933 -15.460 1.00 32.20 C ATOM 513 C VAL A 32 15.926 -0.755 -15.697 1.00 0.22 C ATOM 514 O VAL A 32 14.757 -0.791 -15.310 1.00 1.54 O ATOM 515 CB VAL A 32 17.647 -1.712 -14.165 1.00 15.00 C ATOM 516 CG1 VAL A 32 18.253 -0.308 -14.171 1.00 1.44 C ATOM 517 CG2 VAL A 32 16.700 -1.855 -12.973 1.00 2.34 C ATOM 0 H VAL A 32 18.777 -2.029 -16.319 1.00 13.43 H new ATOM 0 HA VAL A 32 16.273 -2.844 -15.378 1.00 32.20 H new ATOM 0 HB VAL A 32 18.445 -2.451 -14.087 1.00 15.00 H new ATOM 0 HG11 VAL A 32 18.810 -0.148 -13.248 1.00 1.44 H new ATOM 0 HG12 VAL A 32 18.925 -0.205 -15.023 1.00 1.44 H new ATOM 0 HG13 VAL A 32 17.456 0.432 -14.246 1.00 1.44 H new ATOM 0 HG21 VAL A 32 17.254 -1.698 -12.047 1.00 2.34 H new ATOM 0 HG22 VAL A 32 15.904 -1.114 -13.050 1.00 2.34 H new ATOM 0 HG23 VAL A 32 16.266 -2.855 -12.971 1.00 2.34 H new ATOM 527 N LYS A 33 16.447 0.290 -16.332 1.00 63.30 N ATOM 528 CA LYS A 33 15.651 1.480 -16.615 1.00 15.33 C ATOM 529 C LYS A 33 14.480 1.150 -17.537 1.00 60.32 C ATOM 530 O LYS A 33 13.319 1.263 -17.145 1.00 15.33 O ATOM 531 CB LYS A 33 16.528 2.547 -17.272 1.00 51.51 C ATOM 532 CG LYS A 33 15.654 3.718 -17.724 1.00 42.31 C ATOM 533 CD LYS A 33 16.543 4.901 -18.109 1.00 64.04 C ATOM 534 CE LYS A 33 17.042 4.719 -19.544 1.00 31.21 C ATOM 535 NZ LYS A 33 15.877 4.523 -20.454 1.00 70.03 N ATOM 0 H LYS A 33 17.412 0.338 -16.659 1.00 63.30 H new ATOM 0 HA LYS A 33 15.256 1.855 -15.671 1.00 15.33 H new ATOM 0 HB2 LYS A 33 17.285 2.894 -16.569 1.00 51.51 H new ATOM 0 HB3 LYS A 33 17.057 2.123 -18.126 1.00 51.51 H new ATOM 0 HG2 LYS A 33 15.040 3.420 -18.574 1.00 42.31 H new ATOM 0 HG3 LYS A 33 14.973 4.007 -16.924 1.00 42.31 H new ATOM 0 HD2 LYS A 33 15.984 5.833 -18.023 1.00 64.04 H new ATOM 0 HD3 LYS A 33 17.389 4.972 -17.425 1.00 64.04 H new ATOM 0 HE2 LYS A 33 17.617 5.592 -19.854 1.00 31.21 H new ATOM 0 HE3 LYS A 33 17.711 3.860 -19.602 1.00 31.21 H new ATOM 0 HZ1 LYS A 33 16.088 4.939 -21.383 1.00 70.03 H new ATOM 0 HZ2 LYS A 33 15.690 3.506 -20.565 1.00 70.03 H new ATOM 0 HZ3 LYS A 33 15.039 4.987 -20.049 1.00 70.03 H new ATOM 549 N LYS A 34 14.793 0.752 -18.765 1.00 11.43 N ATOM 550 CA LYS A 34 13.756 0.420 -19.739 1.00 54.51 C ATOM 551 C LYS A 34 12.870 -0.721 -19.236 1.00 15.44 C ATOM 552 O LYS A 34 11.812 -0.988 -19.804 1.00 51.23 O ATOM 553 CB LYS A 34 14.399 0.023 -21.070 1.00 65.01 C ATOM 554 CG LYS A 34 15.094 -1.333 -20.920 1.00 72.21 C ATOM 555 CD LYS A 34 16.023 -1.570 -22.113 1.00 25.33 C ATOM 556 CE LYS A 34 16.173 -3.074 -22.353 1.00 2.30 C ATOM 557 NZ LYS A 34 17.361 -3.327 -23.217 1.00 63.31 N ATOM 0 H LYS A 34 15.748 0.651 -19.109 1.00 11.43 H new ATOM 0 HA LYS A 34 13.132 1.302 -19.882 1.00 54.51 H new ATOM 0 HB2 LYS A 34 13.640 -0.030 -21.851 1.00 65.01 H new ATOM 0 HB3 LYS A 34 15.120 0.781 -21.378 1.00 65.01 H new ATOM 0 HG2 LYS A 34 15.664 -1.360 -19.991 1.00 72.21 H new ATOM 0 HG3 LYS A 34 14.351 -2.129 -20.861 1.00 72.21 H new ATOM 0 HD2 LYS A 34 15.619 -1.088 -23.003 1.00 25.33 H new ATOM 0 HD3 LYS A 34 16.998 -1.122 -21.922 1.00 25.33 H new ATOM 0 HE2 LYS A 34 16.285 -3.595 -21.402 1.00 2.30 H new ATOM 0 HE3 LYS A 34 15.275 -3.468 -22.828 1.00 2.30 H new ATOM 0 HZ1 LYS A 34 17.461 -4.349 -23.379 1.00 63.31 H new ATOM 0 HZ2 LYS A 34 17.237 -2.843 -24.129 1.00 63.31 H new ATOM 0 HZ3 LYS A 34 18.215 -2.966 -22.747 1.00 63.31 H new ATOM 571 N THR A 35 13.307 -1.394 -18.176 1.00 62.24 N ATOM 572 CA THR A 35 12.538 -2.507 -17.623 1.00 15.21 C ATOM 573 C THR A 35 11.358 -2.010 -16.787 1.00 3.31 C ATOM 574 O THR A 35 10.209 -2.369 -17.049 1.00 41.43 O ATOM 575 CB THR A 35 13.441 -3.386 -16.755 1.00 14.12 C ATOM 576 OG1 THR A 35 14.375 -4.066 -17.582 1.00 2.45 O ATOM 577 CG2 THR A 35 12.593 -4.410 -16.000 1.00 11.00 C ATOM 0 H THR A 35 14.179 -1.193 -17.687 1.00 62.24 H new ATOM 0 HA THR A 35 12.147 -3.088 -18.458 1.00 15.21 H new ATOM 0 HB THR A 35 13.973 -2.759 -16.039 1.00 14.12 H new ATOM 0 HG1 THR A 35 15.091 -3.450 -17.842 1.00 2.45 H new ATOM 0 HG21 THR A 35 13.240 -5.034 -15.383 1.00 11.00 H new ATOM 0 HG22 THR A 35 11.876 -3.891 -15.364 1.00 11.00 H new ATOM 0 HG23 THR A 35 12.058 -5.036 -16.714 1.00 11.00 H new ATOM 585 N THR A 36 11.643 -1.200 -15.772 1.00 32.41 N ATOM 586 CA THR A 36 10.584 -0.689 -14.904 1.00 64.02 C ATOM 587 C THR A 36 10.208 0.747 -15.259 1.00 31.51 C ATOM 588 O THR A 36 9.493 1.411 -14.508 1.00 65.53 O ATOM 589 CB THR A 36 11.033 -0.753 -13.442 1.00 22.43 C ATOM 590 OG1 THR A 36 10.106 -0.041 -12.632 1.00 54.13 O ATOM 591 CG2 THR A 36 12.421 -0.127 -13.300 1.00 23.50 C ATOM 0 H THR A 36 12.583 -0.886 -15.531 1.00 32.41 H new ATOM 0 HA THR A 36 9.704 -1.316 -15.051 1.00 64.02 H new ATOM 0 HB THR A 36 11.074 -1.794 -13.122 1.00 22.43 H new ATOM 0 HG1 THR A 36 10.098 0.903 -12.896 1.00 54.13 H new ATOM 0 HG21 THR A 36 12.737 -0.175 -12.258 1.00 23.50 H new ATOM 0 HG22 THR A 36 13.132 -0.674 -13.920 1.00 23.50 H new ATOM 0 HG23 THR A 36 12.385 0.914 -13.621 1.00 23.50 H new ATOM 599 N MET A 37 10.682 1.223 -16.403 1.00 55.54 N ATOM 600 CA MET A 37 10.372 2.582 -16.829 1.00 14.41 C ATOM 601 C MET A 37 8.885 2.869 -16.647 1.00 73.23 C ATOM 602 O MET A 37 8.056 1.960 -16.707 1.00 0.12 O ATOM 603 CB MET A 37 10.753 2.773 -18.297 1.00 75.15 C ATOM 604 CG MET A 37 9.787 1.983 -19.183 1.00 52.12 C ATOM 605 SD MET A 37 8.590 3.119 -19.927 1.00 42.32 S ATOM 606 CE MET A 37 9.257 3.088 -21.609 1.00 51.34 C ATOM 0 H MET A 37 11.275 0.697 -17.045 1.00 55.54 H new ATOM 0 HA MET A 37 10.946 3.275 -16.215 1.00 14.41 H new ATOM 0 HB2 MET A 37 10.720 3.831 -18.558 1.00 75.15 H new ATOM 0 HB3 MET A 37 11.776 2.436 -18.465 1.00 75.15 H new ATOM 0 HG2 MET A 37 10.338 1.456 -19.962 1.00 52.12 H new ATOM 0 HG3 MET A 37 9.269 1.227 -18.592 1.00 52.12 H new ATOM 0 HE1 MET A 37 8.657 3.734 -22.250 1.00 51.34 H new ATOM 0 HE2 MET A 37 10.288 3.443 -21.598 1.00 51.34 H new ATOM 0 HE3 MET A 37 9.228 2.068 -21.993 1.00 51.34 H new ATOM 616 N GLY A 38 8.552 4.136 -16.422 1.00 14.44 N ATOM 617 CA GLY A 38 7.159 4.526 -16.232 1.00 14.23 C ATOM 618 C GLY A 38 6.801 4.563 -14.751 1.00 60.53 C ATOM 619 O GLY A 38 5.729 5.038 -14.373 1.00 54.21 O ATOM 0 H GLY A 38 9.221 4.904 -16.367 1.00 14.44 H new ATOM 0 HA2 GLY A 38 6.988 5.507 -16.676 1.00 14.23 H new ATOM 0 HA3 GLY A 38 6.507 3.823 -16.750 1.00 14.23 H new ATOM 623 N HIS A 39 7.703 4.061 -13.915 1.00 23.44 N ATOM 624 CA HIS A 39 7.468 4.046 -12.477 1.00 13.31 C ATOM 625 C HIS A 39 7.911 5.365 -11.853 1.00 74.30 C ATOM 626 O HIS A 39 8.835 6.015 -12.342 1.00 5.20 O ATOM 627 CB HIS A 39 8.232 2.889 -11.832 1.00 74.12 C ATOM 628 CG HIS A 39 7.511 1.601 -12.113 1.00 1.22 C ATOM 629 ND1 HIS A 39 6.559 1.490 -13.114 1.00 23.14 N ATOM 630 CD2 HIS A 39 7.591 0.360 -11.533 1.00 33.14 C ATOM 631 CE1 HIS A 39 6.107 0.223 -13.107 1.00 42.50 C ATOM 632 NE2 HIS A 39 6.704 -0.509 -12.162 1.00 20.15 N ATOM 0 H HIS A 39 8.596 3.662 -14.205 1.00 23.44 H new ATOM 0 HA HIS A 39 6.400 3.913 -12.302 1.00 13.31 H new ATOM 0 HB2 HIS A 39 9.247 2.844 -12.226 1.00 74.12 H new ATOM 0 HB3 HIS A 39 8.314 3.046 -10.757 1.00 74.12 H new ATOM 0 HD2 HIS A 39 8.243 0.097 -10.713 1.00 33.14 H new ATOM 0 HE1 HIS A 39 5.354 -0.156 -13.782 1.00 42.50 H new ATOM 0 HE2 HIS A 39 6.544 -1.493 -11.948 1.00 20.15 H new ATOM 641 N PRO A 40 7.266 5.767 -10.792 1.00 51.24 N ATOM 642 CA PRO A 40 7.591 7.040 -10.084 1.00 14.41 C ATOM 643 C PRO A 40 8.959 6.997 -9.406 1.00 11.35 C ATOM 644 O PRO A 40 9.158 6.268 -8.432 1.00 14.23 O ATOM 645 CB PRO A 40 6.473 7.180 -9.046 1.00 75.43 C ATOM 646 CG PRO A 40 5.941 5.801 -8.839 1.00 61.14 C ATOM 647 CD PRO A 40 6.155 5.047 -10.150 1.00 32.33 C ATOM 0 HA PRO A 40 7.646 7.882 -10.774 1.00 14.41 H new ATOM 0 HB2 PRO A 40 6.854 7.597 -8.114 1.00 75.43 H new ATOM 0 HB3 PRO A 40 5.692 7.852 -9.400 1.00 75.43 H new ATOM 0 HG2 PRO A 40 6.459 5.305 -8.018 1.00 61.14 H new ATOM 0 HG3 PRO A 40 4.883 5.829 -8.577 1.00 61.14 H new ATOM 0 HD2 PRO A 40 6.405 4.001 -9.974 1.00 32.33 H new ATOM 0 HD3 PRO A 40 5.259 5.060 -10.770 1.00 32.33 H new ATOM 655 N LEU A 41 9.896 7.788 -9.926 1.00 31.44 N ATOM 656 CA LEU A 41 11.240 7.839 -9.361 1.00 20.30 C ATOM 657 C LEU A 41 11.415 9.117 -8.546 1.00 10.42 C ATOM 658 O LEU A 41 11.370 10.221 -9.089 1.00 4.11 O ATOM 659 CB LEU A 41 12.281 7.796 -10.485 1.00 32.24 C ATOM 660 CG LEU A 41 12.809 6.365 -10.668 1.00 0.53 C ATOM 661 CD1 LEU A 41 13.551 5.923 -9.403 1.00 71.14 C ATOM 662 CD2 LEU A 41 11.639 5.411 -10.941 1.00 60.40 C ATOM 0 H LEU A 41 9.750 8.397 -10.731 1.00 31.44 H new ATOM 0 HA LEU A 41 11.382 6.977 -8.709 1.00 20.30 H new ATOM 0 HB2 LEU A 41 11.836 8.149 -11.416 1.00 32.24 H new ATOM 0 HB3 LEU A 41 13.106 8.468 -10.251 1.00 32.24 H new ATOM 0 HG LEU A 41 13.495 6.342 -11.514 1.00 0.53 H new ATOM 0 HD11 LEU A 41 13.924 4.908 -9.536 1.00 71.14 H new ATOM 0 HD12 LEU A 41 14.388 6.596 -9.218 1.00 71.14 H new ATOM 0 HD13 LEU A 41 12.869 5.950 -8.553 1.00 71.14 H new ATOM 0 HD21 LEU A 41 12.019 4.397 -11.070 1.00 60.40 H new ATOM 0 HD22 LEU A 41 10.946 5.435 -10.100 1.00 60.40 H new ATOM 0 HD23 LEU A 41 11.120 5.722 -11.847 1.00 60.40 H new ATOM 674 N ILE A 42 11.605 8.959 -7.240 1.00 51.23 N ATOM 675 CA ILE A 42 11.776 10.107 -6.358 1.00 15.54 C ATOM 676 C ILE A 42 13.254 10.361 -6.074 1.00 35.44 C ATOM 677 O ILE A 42 14.008 9.435 -5.777 1.00 71.13 O ATOM 678 CB ILE A 42 11.038 9.862 -5.043 1.00 14.34 C ATOM 679 CG1 ILE A 42 9.529 9.942 -5.286 1.00 73.11 C ATOM 680 CG2 ILE A 42 11.445 10.925 -4.021 1.00 71.32 C ATOM 681 CD1 ILE A 42 9.117 8.882 -6.310 1.00 32.43 C ATOM 0 H ILE A 42 11.644 8.054 -6.772 1.00 51.23 H new ATOM 0 HA ILE A 42 11.363 10.985 -6.854 1.00 15.54 H new ATOM 0 HB ILE A 42 11.296 8.874 -4.661 1.00 14.34 H new ATOM 0 HG12 ILE A 42 8.991 9.787 -4.351 1.00 73.11 H new ATOM 0 HG13 ILE A 42 9.261 10.935 -5.647 1.00 73.11 H new ATOM 0 HG21 ILE A 42 10.918 10.749 -3.083 1.00 71.32 H new ATOM 0 HG22 ILE A 42 12.520 10.871 -3.848 1.00 71.32 H new ATOM 0 HG23 ILE A 42 11.188 11.913 -4.402 1.00 71.32 H new ATOM 0 HD11 ILE A 42 8.042 8.940 -6.482 1.00 32.43 H new ATOM 0 HD12 ILE A 42 9.644 9.058 -7.248 1.00 32.43 H new ATOM 0 HD13 ILE A 42 9.371 7.892 -5.931 1.00 32.43 H new ATOM 693 N MET A 43 13.657 11.625 -6.166 1.00 44.51 N ATOM 694 CA MET A 43 15.045 12.001 -5.917 1.00 41.22 C ATOM 695 C MET A 43 15.113 13.343 -5.192 1.00 32.14 C ATOM 696 O MET A 43 14.123 14.071 -5.122 1.00 32.42 O ATOM 697 CB MET A 43 15.802 12.107 -7.244 1.00 13.24 C ATOM 698 CG MET A 43 15.777 10.758 -7.964 1.00 65.25 C ATOM 699 SD MET A 43 14.515 10.791 -9.262 1.00 61.24 S ATOM 700 CE MET A 43 15.638 10.898 -10.678 1.00 53.53 C ATOM 0 H MET A 43 13.045 12.404 -6.410 1.00 44.51 H new ATOM 0 HA MET A 43 15.503 11.234 -5.292 1.00 41.22 H new ATOM 0 HB2 MET A 43 15.348 12.873 -7.872 1.00 13.24 H new ATOM 0 HB3 MET A 43 16.832 12.413 -7.062 1.00 13.24 H new ATOM 0 HG2 MET A 43 16.755 10.547 -8.397 1.00 65.25 H new ATOM 0 HG3 MET A 43 15.563 9.959 -7.254 1.00 65.25 H new ATOM 0 HE1 MET A 43 15.117 10.579 -11.581 1.00 53.53 H new ATOM 0 HE2 MET A 43 15.975 11.928 -10.798 1.00 53.53 H new ATOM 0 HE3 MET A 43 16.499 10.252 -10.509 1.00 53.53 H new ATOM 710 N GLY A 44 16.287 13.667 -4.660 1.00 74.43 N ATOM 711 CA GLY A 44 16.470 14.930 -3.952 1.00 13.41 C ATOM 712 C GLY A 44 17.032 15.995 -4.888 1.00 54.43 C ATOM 713 O GLY A 44 17.889 15.707 -5.725 1.00 10.45 O ATOM 0 H GLY A 44 17.119 13.079 -4.704 1.00 74.43 H new ATOM 0 HA2 GLY A 44 15.517 15.265 -3.542 1.00 13.41 H new ATOM 0 HA3 GLY A 44 17.146 14.786 -3.109 1.00 13.41 H new ATOM 717 N ARG A 45 16.546 17.224 -4.747 1.00 34.32 N ATOM 718 CA ARG A 45 17.014 18.315 -5.593 1.00 3.12 C ATOM 719 C ARG A 45 18.538 18.357 -5.613 1.00 44.31 C ATOM 720 O ARG A 45 19.145 18.781 -6.598 1.00 54.11 O ATOM 721 CB ARG A 45 16.468 19.651 -5.086 1.00 2.24 C ATOM 722 CG ARG A 45 16.606 19.720 -3.563 1.00 53.43 C ATOM 723 CD ARG A 45 16.952 21.151 -3.148 1.00 4.31 C ATOM 724 NE ARG A 45 16.006 22.092 -3.738 1.00 60.02 N ATOM 725 CZ ARG A 45 16.020 23.380 -3.409 1.00 31.53 C ATOM 726 NH1 ARG A 45 16.880 23.820 -2.532 1.00 0.12 N ATOM 727 NH2 ARG A 45 15.173 24.204 -3.963 1.00 50.22 N ATOM 0 H ARG A 45 15.837 17.487 -4.063 1.00 34.32 H new ATOM 0 HA ARG A 45 16.651 18.143 -6.606 1.00 3.12 H new ATOM 0 HB2 ARG A 45 17.011 20.476 -5.548 1.00 2.24 H new ATOM 0 HB3 ARG A 45 15.422 19.759 -5.371 1.00 2.24 H new ATOM 0 HG2 ARG A 45 15.676 19.407 -3.088 1.00 53.43 H new ATOM 0 HG3 ARG A 45 17.383 19.034 -3.226 1.00 53.43 H new ATOM 0 HD2 ARG A 45 16.931 21.237 -2.062 1.00 4.31 H new ATOM 0 HD3 ARG A 45 17.965 21.395 -3.468 1.00 4.31 H new ATOM 0 HE ARG A 45 15.321 21.756 -4.415 1.00 60.02 H new ATOM 0 HH11 ARG A 45 17.542 23.176 -2.099 1.00 0.12 H new ATOM 0 HH12 ARG A 45 16.891 24.808 -2.280 1.00 0.12 H new ATOM 0 HH21 ARG A 45 14.500 23.860 -4.648 1.00 50.22 H new ATOM 0 HH22 ARG A 45 15.184 25.192 -3.711 1.00 50.22 H new ATOM 741 N LYS A 46 19.151 17.910 -4.523 1.00 40.33 N ATOM 742 CA LYS A 46 20.606 17.896 -4.429 1.00 71.34 C ATOM 743 C LYS A 46 21.183 16.792 -5.311 1.00 42.05 C ATOM 744 O LYS A 46 22.191 16.988 -5.990 1.00 63.42 O ATOM 745 CB LYS A 46 21.035 17.674 -2.977 1.00 32.53 C ATOM 746 CG LYS A 46 20.606 18.874 -2.130 1.00 21.33 C ATOM 747 CD LYS A 46 21.518 20.064 -2.429 1.00 71.32 C ATOM 748 CE LYS A 46 21.406 21.091 -1.302 1.00 60.51 C ATOM 749 NZ LYS A 46 21.717 22.446 -1.836 1.00 30.24 N ATOM 0 H LYS A 46 18.668 17.555 -3.698 1.00 40.33 H new ATOM 0 HA LYS A 46 20.986 18.858 -4.772 1.00 71.34 H new ATOM 0 HB2 LYS A 46 20.584 16.761 -2.589 1.00 32.53 H new ATOM 0 HB3 LYS A 46 22.116 17.544 -2.922 1.00 32.53 H new ATOM 0 HG2 LYS A 46 19.570 19.133 -2.347 1.00 21.33 H new ATOM 0 HG3 LYS A 46 20.656 18.621 -1.071 1.00 21.33 H new ATOM 0 HD2 LYS A 46 22.550 19.728 -2.528 1.00 71.32 H new ATOM 0 HD3 LYS A 46 21.239 20.520 -3.379 1.00 71.32 H new ATOM 0 HE2 LYS A 46 20.401 21.076 -0.880 1.00 60.51 H new ATOM 0 HE3 LYS A 46 22.094 20.839 -0.495 1.00 60.51 H new ATOM 0 HZ1 LYS A 46 21.641 23.146 -1.071 1.00 30.24 H new ATOM 0 HZ2 LYS A 46 22.684 22.455 -2.219 1.00 30.24 H new ATOM 0 HZ3 LYS A 46 21.043 22.684 -2.591 1.00 30.24 H new ATOM 763 N ASN A 47 20.530 15.634 -5.299 1.00 74.33 N ATOM 764 CA ASN A 47 20.978 14.504 -6.105 1.00 43.50 C ATOM 765 C ASN A 47 20.674 14.752 -7.578 1.00 24.30 C ATOM 766 O ASN A 47 21.305 14.171 -8.461 1.00 14.00 O ATOM 767 CB ASN A 47 20.275 13.224 -5.649 1.00 12.33 C ATOM 768 CG ASN A 47 20.654 12.902 -4.208 1.00 51.21 C ATOM 769 OD1 ASN A 47 21.768 13.200 -3.777 1.00 72.12 O ATOM 770 ND2 ASN A 47 19.790 12.307 -3.433 1.00 50.11 N ATOM 0 H ASN A 47 19.694 15.454 -4.743 1.00 74.33 H new ATOM 0 HA ASN A 47 22.055 14.392 -5.976 1.00 43.50 H new ATOM 0 HB2 ASN A 47 19.195 13.344 -5.731 1.00 12.33 H new ATOM 0 HB3 ASN A 47 20.553 12.395 -6.300 1.00 12.33 H new ATOM 0 HD21 ASN A 47 20.037 12.088 -2.468 1.00 50.11 H new ATOM 0 HD22 ASN A 47 18.868 12.061 -3.792 1.00 50.11 H new ATOM 777 N TYR A 48 19.698 15.616 -7.833 1.00 44.25 N ATOM 778 CA TYR A 48 19.308 15.936 -9.200 1.00 62.23 C ATOM 779 C TYR A 48 20.402 16.748 -9.894 1.00 22.00 C ATOM 780 O TYR A 48 20.883 16.371 -10.962 1.00 42.52 O ATOM 781 CB TYR A 48 17.982 16.713 -9.184 1.00 70.40 C ATOM 782 CG TYR A 48 18.024 17.857 -10.172 1.00 24.31 C ATOM 783 CD1 TYR A 48 17.746 17.626 -11.525 1.00 30.13 C ATOM 784 CD2 TYR A 48 18.336 19.149 -9.732 1.00 70.34 C ATOM 785 CE1 TYR A 48 17.781 18.687 -12.437 1.00 23.35 C ATOM 786 CE2 TYR A 48 18.372 20.209 -10.644 1.00 42.33 C ATOM 787 CZ TYR A 48 18.095 19.979 -11.996 1.00 45.43 C ATOM 788 OH TYR A 48 18.131 21.025 -12.894 1.00 12.24 O ATOM 0 H TYR A 48 19.165 16.105 -7.114 1.00 44.25 H new ATOM 0 HA TYR A 48 19.172 15.011 -9.760 1.00 62.23 H new ATOM 0 HB2 TYR A 48 17.158 16.043 -9.430 1.00 70.40 H new ATOM 0 HB3 TYR A 48 17.791 17.097 -8.182 1.00 70.40 H new ATOM 0 HD1 TYR A 48 17.505 16.630 -11.864 1.00 30.13 H new ATOM 0 HD2 TYR A 48 18.549 19.327 -8.688 1.00 70.34 H new ATOM 0 HE1 TYR A 48 17.566 18.510 -13.480 1.00 23.35 H new ATOM 0 HE2 TYR A 48 18.614 21.205 -10.304 1.00 42.33 H new ATOM 0 HH TYR A 48 18.364 21.852 -12.423 1.00 12.24 H new ATOM 798 N GLU A 49 20.788 17.863 -9.281 1.00 10.34 N ATOM 799 CA GLU A 49 21.824 18.718 -9.854 1.00 14.42 C ATOM 800 C GLU A 49 23.189 18.041 -9.772 1.00 62.51 C ATOM 801 O GLU A 49 24.099 18.366 -10.535 1.00 64.44 O ATOM 802 CB GLU A 49 21.872 20.054 -9.110 1.00 70.23 C ATOM 803 CG GLU A 49 22.116 19.802 -7.622 1.00 75.10 C ATOM 804 CD GLU A 49 22.371 21.123 -6.904 1.00 43.13 C ATOM 805 OE1 GLU A 49 21.416 21.851 -6.688 1.00 34.43 O ATOM 806 OE2 GLU A 49 23.517 21.388 -6.582 1.00 70.32 O ATOM 0 H GLU A 49 20.404 18.194 -8.396 1.00 10.34 H new ATOM 0 HA GLU A 49 21.581 18.893 -10.902 1.00 14.42 H new ATOM 0 HB2 GLU A 49 22.665 20.681 -9.518 1.00 70.23 H new ATOM 0 HB3 GLU A 49 20.935 20.594 -9.249 1.00 70.23 H new ATOM 0 HG2 GLU A 49 21.253 19.301 -7.183 1.00 75.10 H new ATOM 0 HG3 GLU A 49 22.970 19.138 -7.493 1.00 75.10 H new ATOM 813 N ALA A 50 23.327 17.102 -8.843 1.00 54.42 N ATOM 814 CA ALA A 50 24.589 16.390 -8.671 1.00 23.52 C ATOM 815 C ALA A 50 24.771 15.338 -9.762 1.00 4.35 C ATOM 816 O ALA A 50 25.870 15.161 -10.287 1.00 53.11 O ATOM 817 CB ALA A 50 24.624 15.713 -7.299 1.00 23.34 C ATOM 0 H ALA A 50 22.587 16.817 -8.201 1.00 54.42 H new ATOM 0 HA ALA A 50 25.401 17.113 -8.743 1.00 23.52 H new ATOM 0 HB1 ALA A 50 25.569 15.184 -7.178 1.00 23.34 H new ATOM 0 HB2 ALA A 50 24.529 16.468 -6.518 1.00 23.34 H new ATOM 0 HB3 ALA A 50 23.799 15.005 -7.222 1.00 23.34 H new ATOM 823 N ILE A 51 23.689 14.639 -10.094 1.00 71.04 N ATOM 824 CA ILE A 51 23.747 13.601 -11.119 1.00 23.24 C ATOM 825 C ILE A 51 23.928 14.213 -12.506 1.00 72.42 C ATOM 826 O ILE A 51 24.806 13.802 -13.264 1.00 14.42 O ATOM 827 CB ILE A 51 22.467 12.767 -11.089 1.00 50.24 C ATOM 828 CG1 ILE A 51 22.495 11.842 -9.869 1.00 51.12 C ATOM 829 CG2 ILE A 51 22.377 11.927 -12.364 1.00 52.52 C ATOM 830 CD1 ILE A 51 21.073 11.390 -9.532 1.00 32.41 C ATOM 0 H ILE A 51 22.769 14.770 -9.673 1.00 71.04 H new ATOM 0 HA ILE A 51 24.604 12.962 -10.908 1.00 23.24 H new ATOM 0 HB ILE A 51 21.601 13.427 -11.028 1.00 50.24 H new ATOM 0 HG12 ILE A 51 23.124 10.975 -10.072 1.00 51.12 H new ATOM 0 HG13 ILE A 51 22.933 12.361 -9.017 1.00 51.12 H new ATOM 0 HG21 ILE A 51 21.464 11.332 -12.344 1.00 52.52 H new ATOM 0 HG22 ILE A 51 22.362 12.585 -13.233 1.00 52.52 H new ATOM 0 HG23 ILE A 51 23.241 11.265 -12.425 1.00 52.52 H new ATOM 0 HD11 ILE A 51 21.097 10.732 -8.663 1.00 32.41 H new ATOM 0 HD12 ILE A 51 20.457 12.262 -9.310 1.00 32.41 H new ATOM 0 HD13 ILE A 51 20.651 10.854 -10.382 1.00 32.41 H new ATOM 842 N GLY A 52 23.095 15.197 -12.833 1.00 22.41 N ATOM 843 CA GLY A 52 23.184 15.855 -14.133 1.00 62.33 C ATOM 844 C GLY A 52 21.904 15.662 -14.943 1.00 31.21 C ATOM 845 O GLY A 52 21.949 15.256 -16.105 1.00 64.43 O ATOM 0 H GLY A 52 22.359 15.553 -12.224 1.00 22.41 H new ATOM 0 HA2 GLY A 52 23.370 16.920 -13.992 1.00 62.33 H new ATOM 0 HA3 GLY A 52 24.032 15.454 -14.688 1.00 62.33 H new ATOM 849 N ARG A 53 20.767 15.963 -14.325 1.00 52.24 N ATOM 850 CA ARG A 53 19.479 15.829 -14.998 1.00 71.40 C ATOM 851 C ARG A 53 19.251 14.394 -15.462 1.00 63.11 C ATOM 852 O ARG A 53 19.372 14.084 -16.648 1.00 34.50 O ATOM 853 CB ARG A 53 19.415 16.770 -16.200 1.00 52.41 C ATOM 854 CG ARG A 53 17.972 16.858 -16.699 1.00 74.41 C ATOM 855 CD ARG A 53 17.928 17.667 -17.995 1.00 65.23 C ATOM 856 NE ARG A 53 17.943 16.769 -19.146 1.00 62.50 N ATOM 857 CZ ARG A 53 16.951 16.753 -20.036 1.00 21.34 C ATOM 858 NH1 ARG A 53 15.928 17.555 -19.906 1.00 72.02 N ATOM 859 NH2 ARG A 53 17.004 15.931 -21.047 1.00 31.24 N ATOM 0 H ARG A 53 20.710 16.300 -13.364 1.00 52.24 H new ATOM 0 HA ARG A 53 18.697 16.093 -14.286 1.00 71.40 H new ATOM 0 HB2 ARG A 53 19.776 17.760 -15.921 1.00 52.41 H new ATOM 0 HB3 ARG A 53 20.065 16.406 -16.996 1.00 52.41 H new ATOM 0 HG2 ARG A 53 17.573 15.858 -16.869 1.00 74.41 H new ATOM 0 HG3 ARG A 53 17.343 17.328 -15.943 1.00 74.41 H new ATOM 0 HD2 ARG A 53 17.030 18.285 -18.017 1.00 65.23 H new ATOM 0 HD3 ARG A 53 18.782 18.343 -18.040 1.00 65.23 H new ATOM 0 HE ARG A 53 18.734 16.137 -19.272 1.00 62.50 H new ATOM 0 HH11 ARG A 53 15.883 18.201 -19.118 1.00 72.02 H new ATOM 0 HH12 ARG A 53 15.174 17.535 -20.593 1.00 72.02 H new ATOM 0 HH21 ARG A 53 17.802 15.305 -21.154 1.00 31.24 H new ATOM 0 HH22 ARG A 53 16.248 15.915 -21.731 1.00 31.24 H new ATOM 873 N PRO A 54 18.921 13.525 -14.549 1.00 24.02 N ATOM 874 CA PRO A 54 18.661 12.094 -14.839 1.00 64.22 C ATOM 875 C PRO A 54 17.194 11.835 -15.192 1.00 21.13 C ATOM 876 O PRO A 54 16.356 12.729 -15.075 1.00 53.41 O ATOM 877 CB PRO A 54 19.045 11.406 -13.528 1.00 64.53 C ATOM 878 CG PRO A 54 18.909 12.443 -12.448 1.00 34.11 C ATOM 879 CD PRO A 54 18.762 13.813 -13.122 1.00 60.30 C ATOM 0 HA PRO A 54 19.219 11.731 -15.702 1.00 64.22 H new ATOM 0 HB2 PRO A 54 18.395 10.554 -13.332 1.00 64.53 H new ATOM 0 HB3 PRO A 54 20.065 11.025 -13.574 1.00 64.53 H new ATOM 0 HG2 PRO A 54 18.042 12.231 -11.823 1.00 34.11 H new ATOM 0 HG3 PRO A 54 19.782 12.431 -11.796 1.00 34.11 H new ATOM 0 HD2 PRO A 54 17.790 14.259 -12.911 1.00 60.30 H new ATOM 0 HD3 PRO A 54 19.518 14.514 -12.770 1.00 60.30 H new ATOM 887 N LEU A 55 16.889 10.611 -15.623 1.00 54.14 N ATOM 888 CA LEU A 55 15.516 10.265 -15.987 1.00 53.12 C ATOM 889 C LEU A 55 15.332 8.750 -16.086 1.00 51.10 C ATOM 890 O LEU A 55 14.789 8.244 -17.068 1.00 43.03 O ATOM 891 CB LEU A 55 15.155 10.911 -17.328 1.00 63.33 C ATOM 892 CG LEU A 55 16.095 10.385 -18.415 1.00 24.12 C ATOM 893 CD1 LEU A 55 15.300 10.112 -19.693 1.00 60.45 C ATOM 894 CD2 LEU A 55 17.173 11.430 -18.703 1.00 10.24 C ATOM 0 H LEU A 55 17.563 9.853 -15.728 1.00 54.14 H new ATOM 0 HA LEU A 55 14.856 10.641 -15.205 1.00 53.12 H new ATOM 0 HB2 LEU A 55 14.120 10.685 -17.586 1.00 63.33 H new ATOM 0 HB3 LEU A 55 15.236 11.996 -17.255 1.00 63.33 H new ATOM 0 HG LEU A 55 16.562 9.461 -18.074 1.00 24.12 H new ATOM 0 HD11 LEU A 55 15.971 9.738 -20.466 1.00 60.45 H new ATOM 0 HD12 LEU A 55 14.529 9.368 -19.490 1.00 60.45 H new ATOM 0 HD13 LEU A 55 14.832 11.035 -20.035 1.00 60.45 H new ATOM 0 HD21 LEU A 55 17.844 11.057 -19.477 1.00 10.24 H new ATOM 0 HD22 LEU A 55 16.703 12.353 -19.043 1.00 10.24 H new ATOM 0 HD23 LEU A 55 17.742 11.626 -17.794 1.00 10.24 H new ATOM 906 N PRO A 56 15.770 8.028 -15.088 1.00 62.15 N ATOM 907 CA PRO A 56 15.655 6.536 -15.043 1.00 2.20 C ATOM 908 C PRO A 56 14.210 6.052 -15.111 1.00 25.32 C ATOM 909 O PRO A 56 13.680 5.517 -14.137 1.00 35.50 O ATOM 910 CB PRO A 56 16.281 6.151 -13.697 1.00 14.51 C ATOM 911 CG PRO A 56 16.321 7.407 -12.892 1.00 52.42 C ATOM 912 CD PRO A 56 16.432 8.554 -13.891 1.00 73.15 C ATOM 0 HA PRO A 56 16.149 6.079 -15.901 1.00 2.20 H new ATOM 0 HB2 PRO A 56 15.690 5.384 -13.196 1.00 14.51 H new ATOM 0 HB3 PRO A 56 17.282 5.743 -13.834 1.00 14.51 H new ATOM 0 HG2 PRO A 56 15.422 7.507 -12.284 1.00 52.42 H new ATOM 0 HG3 PRO A 56 17.170 7.404 -12.208 1.00 52.42 H new ATOM 0 HD2 PRO A 56 15.941 9.455 -13.524 1.00 73.15 H new ATOM 0 HD3 PRO A 56 17.472 8.815 -14.089 1.00 73.15 H new ATOM 920 N GLY A 57 13.580 6.226 -16.266 1.00 24.41 N ATOM 921 CA GLY A 57 12.203 5.783 -16.437 1.00 51.11 C ATOM 922 C GLY A 57 11.335 6.878 -17.045 1.00 64.14 C ATOM 923 O GLY A 57 10.108 6.789 -17.021 1.00 12.14 O ATOM 0 H GLY A 57 13.994 6.665 -17.088 1.00 24.41 H new ATOM 0 HA2 GLY A 57 12.180 4.902 -17.078 1.00 51.11 H new ATOM 0 HA3 GLY A 57 11.793 5.486 -15.472 1.00 51.11 H new ATOM 927 N ARG A 58 11.972 7.906 -17.595 1.00 62.53 N ATOM 928 CA ARG A 58 11.228 8.999 -18.209 1.00 23.40 C ATOM 929 C ARG A 58 10.316 9.657 -17.173 1.00 1.12 C ATOM 930 O ARG A 58 9.449 10.463 -17.505 1.00 24.33 O ATOM 931 CB ARG A 58 10.422 8.445 -19.402 1.00 34.44 C ATOM 932 CG ARG A 58 8.985 8.986 -19.416 1.00 73.21 C ATOM 933 CD ARG A 58 8.224 8.373 -20.598 1.00 70.11 C ATOM 934 NE ARG A 58 7.131 7.528 -20.128 1.00 64.21 N ATOM 935 CZ ARG A 58 6.011 8.054 -19.640 1.00 4.31 C ATOM 936 NH1 ARG A 58 5.875 9.350 -19.560 1.00 42.45 N ATOM 937 NH2 ARG A 58 5.046 7.270 -19.244 1.00 3.55 N ATOM 0 H ARG A 58 12.987 8.005 -17.629 1.00 62.53 H new ATOM 0 HA ARG A 58 11.913 9.763 -18.575 1.00 23.40 H new ATOM 0 HB2 ARG A 58 10.921 8.712 -20.334 1.00 34.44 H new ATOM 0 HB3 ARG A 58 10.401 7.356 -19.353 1.00 34.44 H new ATOM 0 HG2 ARG A 58 8.483 8.742 -18.480 1.00 73.21 H new ATOM 0 HG3 ARG A 58 8.994 10.073 -19.499 1.00 73.21 H new ATOM 0 HD2 ARG A 58 7.829 9.166 -21.233 1.00 70.11 H new ATOM 0 HD3 ARG A 58 8.907 7.785 -21.210 1.00 70.11 H new ATOM 0 HE ARG A 58 7.228 6.514 -20.175 1.00 64.21 H new ATOM 0 HH11 ARG A 58 6.629 9.962 -19.872 1.00 42.45 H new ATOM 0 HH12 ARG A 58 5.015 9.750 -19.185 1.00 42.45 H new ATOM 0 HH21 ARG A 58 5.152 6.258 -19.309 1.00 3.55 H new ATOM 0 HH22 ARG A 58 4.186 7.670 -18.869 1.00 3.55 H new ATOM 951 N ARG A 59 10.523 9.311 -15.905 1.00 22.32 N ATOM 952 CA ARG A 59 9.710 9.875 -14.835 1.00 13.41 C ATOM 953 C ARG A 59 10.559 10.234 -13.614 1.00 22.12 C ATOM 954 O ARG A 59 10.530 9.533 -12.598 1.00 61.13 O ATOM 955 CB ARG A 59 8.634 8.870 -14.430 1.00 65.05 C ATOM 956 CG ARG A 59 7.596 9.563 -13.549 1.00 52.42 C ATOM 957 CD ARG A 59 6.315 9.780 -14.354 1.00 42.40 C ATOM 958 NE ARG A 59 5.237 10.225 -13.482 1.00 44.31 N ATOM 959 CZ ARG A 59 4.351 9.365 -12.989 1.00 51.43 C ATOM 960 NH1 ARG A 59 4.459 8.091 -13.256 1.00 43.10 N ATOM 961 NH2 ARG A 59 3.380 9.794 -12.232 1.00 41.01 N ATOM 0 H ARG A 59 11.238 8.651 -15.597 1.00 22.32 H new ATOM 0 HA ARG A 59 9.249 10.790 -15.207 1.00 13.41 H new ATOM 0 HB2 ARG A 59 8.155 8.456 -15.317 1.00 65.05 H new ATOM 0 HB3 ARG A 59 9.084 8.036 -13.892 1.00 65.05 H new ATOM 0 HG2 ARG A 59 7.387 8.957 -12.668 1.00 52.42 H new ATOM 0 HG3 ARG A 59 7.983 10.518 -13.194 1.00 52.42 H new ATOM 0 HD2 ARG A 59 6.489 10.521 -15.134 1.00 42.40 H new ATOM 0 HD3 ARG A 59 6.030 8.853 -14.852 1.00 42.40 H new ATOM 0 HE ARG A 59 5.160 11.214 -13.245 1.00 44.31 H new ATOM 0 HH11 ARG A 59 5.223 7.756 -13.843 1.00 43.10 H new ATOM 0 HH12 ARG A 59 3.779 7.431 -12.878 1.00 43.10 H new ATOM 0 HH21 ARG A 59 3.301 10.788 -12.019 1.00 41.01 H new ATOM 0 HH22 ARG A 59 2.700 9.135 -11.853 1.00 41.01 H new ATOM 975 N ASN A 60 11.304 11.336 -13.717 1.00 64.30 N ATOM 976 CA ASN A 60 12.149 11.784 -12.612 1.00 73.24 C ATOM 977 C ASN A 60 11.420 12.821 -11.763 1.00 52.32 C ATOM 978 O ASN A 60 11.023 13.878 -12.257 1.00 41.12 O ATOM 979 CB ASN A 60 13.449 12.388 -13.147 1.00 3.12 C ATOM 980 CG ASN A 60 13.169 13.210 -14.401 1.00 14.13 C ATOM 981 OD1 ASN A 60 12.821 14.387 -14.308 1.00 73.22 O ATOM 982 ND2 ASN A 60 13.305 12.658 -15.575 1.00 65.01 N ATOM 0 H ASN A 60 11.339 11.929 -14.546 1.00 64.30 H new ATOM 0 HA ASN A 60 12.382 10.918 -11.992 1.00 73.24 H new ATOM 0 HB2 ASN A 60 13.907 13.018 -12.385 1.00 3.12 H new ATOM 0 HB3 ASN A 60 14.161 11.595 -13.374 1.00 3.12 H new ATOM 0 HD21 ASN A 60 13.123 13.202 -16.418 1.00 65.01 H new ATOM 0 HD22 ASN A 60 13.594 11.682 -15.650 1.00 65.01 H new ATOM 989 N ILE A 61 11.243 12.506 -10.485 1.00 13.12 N ATOM 990 CA ILE A 61 10.555 13.408 -9.568 1.00 0.31 C ATOM 991 C ILE A 61 11.491 13.859 -8.451 1.00 53.03 C ATOM 992 O ILE A 61 11.965 13.042 -7.662 1.00 72.25 O ATOM 993 CB ILE A 61 9.348 12.694 -8.955 1.00 21.41 C ATOM 994 CG1 ILE A 61 8.699 11.786 -10.007 1.00 11.34 C ATOM 995 CG2 ILE A 61 8.334 13.728 -8.457 1.00 64.50 C ATOM 996 CD1 ILE A 61 8.188 12.621 -11.185 1.00 2.25 C ATOM 0 H ILE A 61 11.565 11.636 -10.061 1.00 13.12 H new ATOM 0 HA ILE A 61 10.226 14.284 -10.127 1.00 0.31 H new ATOM 0 HB ILE A 61 9.676 12.086 -8.112 1.00 21.41 H new ATOM 0 HG12 ILE A 61 9.423 11.051 -10.360 1.00 11.34 H new ATOM 0 HG13 ILE A 61 7.874 11.232 -9.560 1.00 11.34 H new ATOM 0 HG21 ILE A 61 7.476 13.216 -8.021 1.00 64.50 H new ATOM 0 HG22 ILE A 61 8.801 14.361 -7.702 1.00 64.50 H new ATOM 0 HG23 ILE A 61 8.003 14.344 -9.293 1.00 64.50 H new ATOM 0 HD11 ILE A 61 7.730 11.964 -11.925 1.00 2.25 H new ATOM 0 HD12 ILE A 61 7.449 13.338 -10.829 1.00 2.25 H new ATOM 0 HD13 ILE A 61 9.022 13.155 -11.641 1.00 2.25 H new ATOM 1008 N ILE A 62 11.748 15.161 -8.381 1.00 11.55 N ATOM 1009 CA ILE A 62 12.622 15.699 -7.344 1.00 34.13 C ATOM 1010 C ILE A 62 11.789 16.311 -6.221 1.00 5.55 C ATOM 1011 O ILE A 62 10.777 16.965 -6.475 1.00 63.31 O ATOM 1012 CB ILE A 62 13.555 16.759 -7.932 1.00 43.45 C ATOM 1013 CG1 ILE A 62 12.723 17.862 -8.587 1.00 41.33 C ATOM 1014 CG2 ILE A 62 14.468 16.118 -8.980 1.00 11.44 C ATOM 1015 CD1 ILE A 62 13.654 18.937 -9.149 1.00 41.15 C ATOM 0 H ILE A 62 11.368 15.857 -9.023 1.00 11.55 H new ATOM 0 HA ILE A 62 13.223 14.884 -6.940 1.00 34.13 H new ATOM 0 HB ILE A 62 14.165 17.186 -7.135 1.00 43.45 H new ATOM 0 HG12 ILE A 62 12.109 17.444 -9.385 1.00 41.33 H new ATOM 0 HG13 ILE A 62 12.042 18.301 -7.857 1.00 41.33 H new ATOM 0 HG21 ILE A 62 15.131 16.876 -9.397 1.00 11.44 H new ATOM 0 HG22 ILE A 62 15.062 15.333 -8.513 1.00 11.44 H new ATOM 0 HG23 ILE A 62 13.861 15.689 -9.777 1.00 11.44 H new ATOM 0 HD11 ILE A 62 13.061 19.724 -9.616 1.00 41.15 H new ATOM 0 HD12 ILE A 62 14.249 19.362 -8.340 1.00 41.15 H new ATOM 0 HD13 ILE A 62 14.317 18.492 -9.892 1.00 41.15 H new ATOM 1027 N VAL A 63 12.214 16.090 -4.981 1.00 74.12 N ATOM 1028 CA VAL A 63 11.487 16.621 -3.833 1.00 51.14 C ATOM 1029 C VAL A 63 12.184 17.855 -3.268 1.00 12.01 C ATOM 1030 O VAL A 63 13.307 17.774 -2.771 1.00 45.30 O ATOM 1031 CB VAL A 63 11.380 15.553 -2.744 1.00 73.20 C ATOM 1032 CG1 VAL A 63 10.792 16.176 -1.476 1.00 12.44 C ATOM 1033 CG2 VAL A 63 10.468 14.424 -3.227 1.00 52.20 C ATOM 0 H VAL A 63 13.049 15.553 -4.746 1.00 74.12 H new ATOM 0 HA VAL A 63 10.489 16.907 -4.166 1.00 51.14 H new ATOM 0 HB VAL A 63 12.371 15.153 -2.527 1.00 73.20 H new ATOM 0 HG11 VAL A 63 10.715 15.416 -0.699 1.00 12.44 H new ATOM 0 HG12 VAL A 63 11.440 16.982 -1.132 1.00 12.44 H new ATOM 0 HG13 VAL A 63 9.801 16.575 -1.692 1.00 12.44 H new ATOM 0 HG21 VAL A 63 10.391 13.662 -2.452 1.00 52.20 H new ATOM 0 HG22 VAL A 63 9.477 14.824 -3.443 1.00 52.20 H new ATOM 0 HG23 VAL A 63 10.885 13.981 -4.131 1.00 52.20 H new ATOM 1043 N THR A 64 11.504 18.994 -3.340 1.00 42.53 N ATOM 1044 CA THR A 64 12.061 20.240 -2.826 1.00 42.50 C ATOM 1045 C THR A 64 10.947 21.149 -2.317 1.00 2.14 C ATOM 1046 O THR A 64 9.983 21.426 -3.032 1.00 54.54 O ATOM 1047 CB THR A 64 12.849 20.956 -3.923 1.00 71.15 C ATOM 1048 OG1 THR A 64 13.579 22.034 -3.352 1.00 72.01 O ATOM 1049 CG2 THR A 64 11.883 21.494 -4.979 1.00 73.20 C ATOM 0 H THR A 64 10.572 19.081 -3.746 1.00 42.53 H new ATOM 0 HA THR A 64 12.731 20.004 -1.999 1.00 42.50 H new ATOM 0 HB THR A 64 13.541 20.255 -4.391 1.00 71.15 H new ATOM 0 HG1 THR A 64 13.914 21.771 -2.469 1.00 72.01 H new ATOM 0 HG21 THR A 64 12.446 22.004 -5.761 1.00 73.20 H new ATOM 0 HG22 THR A 64 11.324 20.667 -5.416 1.00 73.20 H new ATOM 0 HG23 THR A 64 11.190 22.195 -4.514 1.00 73.20 H new ATOM 1057 N ARG A 65 11.084 21.605 -1.077 1.00 50.34 N ATOM 1058 CA ARG A 65 10.081 22.478 -0.480 1.00 50.44 C ATOM 1059 C ARG A 65 10.324 23.931 -0.877 1.00 72.44 C ATOM 1060 O ARG A 65 11.367 24.504 -0.562 1.00 61.22 O ATOM 1061 CB ARG A 65 10.122 22.350 1.043 1.00 44.34 C ATOM 1062 CG ARG A 65 11.505 22.761 1.551 1.00 1.30 C ATOM 1063 CD ARG A 65 11.776 22.087 2.897 1.00 14.45 C ATOM 1064 NE ARG A 65 12.719 22.881 3.677 1.00 4.41 N ATOM 1065 CZ ARG A 65 12.351 24.029 4.236 1.00 40.23 C ATOM 1066 NH1 ARG A 65 11.128 24.461 4.094 1.00 12.11 N ATOM 1067 NH2 ARG A 65 13.213 24.724 4.927 1.00 61.31 N ATOM 0 H ARG A 65 11.874 21.387 -0.470 1.00 50.34 H new ATOM 0 HA ARG A 65 9.100 22.175 -0.846 1.00 50.44 H new ATOM 0 HB2 ARG A 65 9.355 22.981 1.493 1.00 44.34 H new ATOM 0 HB3 ARG A 65 9.904 21.324 1.339 1.00 44.34 H new ATOM 0 HG2 ARG A 65 12.269 22.474 0.829 1.00 1.30 H new ATOM 0 HG3 ARG A 65 11.558 23.844 1.658 1.00 1.30 H new ATOM 0 HD2 ARG A 65 10.843 21.972 3.449 1.00 14.45 H new ATOM 0 HD3 ARG A 65 12.177 21.086 2.737 1.00 14.45 H new ATOM 0 HE ARG A 65 13.676 22.550 3.795 1.00 4.41 H new ATOM 0 HH11 ARG A 65 10.455 23.918 3.554 1.00 12.11 H new ATOM 0 HH12 ARG A 65 10.845 25.342 4.523 1.00 12.11 H new ATOM 0 HH21 ARG A 65 14.169 24.386 5.038 1.00 61.31 H new ATOM 0 HH22 ARG A 65 12.931 25.605 5.356 1.00 61.31 H new ATOM 1081 N ASN A 66 9.354 24.521 -1.568 1.00 64.34 N ATOM 1082 CA ASN A 66 9.472 25.909 -2.002 1.00 21.21 C ATOM 1083 C ASN A 66 8.312 26.287 -2.917 1.00 34.23 C ATOM 1084 O ASN A 66 8.130 25.696 -3.982 1.00 30.13 O ATOM 1085 CB ASN A 66 10.795 26.116 -2.742 1.00 13.23 C ATOM 1086 CG ASN A 66 11.868 26.589 -1.767 1.00 75.10 C ATOM 1087 OD1 ASN A 66 11.672 27.577 -1.059 1.00 74.14 O ATOM 1088 ND2 ASN A 66 12.996 25.939 -1.688 1.00 20.52 N ATOM 0 H ASN A 66 8.483 24.064 -1.838 1.00 64.34 H new ATOM 0 HA ASN A 66 9.446 26.547 -1.119 1.00 21.21 H new ATOM 0 HB2 ASN A 66 11.106 25.185 -3.215 1.00 13.23 H new ATOM 0 HB3 ASN A 66 10.666 26.850 -3.538 1.00 13.23 H new ATOM 0 HD21 ASN A 66 13.719 26.249 -1.038 1.00 20.52 H new ATOM 0 HD22 ASN A 66 13.155 25.121 -2.276 1.00 20.52 H new ATOM 1095 N GLU A 67 7.530 27.277 -2.496 1.00 61.15 N ATOM 1096 CA GLU A 67 6.391 27.727 -3.287 1.00 32.33 C ATOM 1097 C GLU A 67 6.863 28.527 -4.497 1.00 74.24 C ATOM 1098 O GLU A 67 7.471 29.587 -4.353 1.00 42.11 O ATOM 1099 CB GLU A 67 5.468 28.596 -2.431 1.00 34.43 C ATOM 1100 CG GLU A 67 5.385 28.016 -1.018 1.00 44.41 C ATOM 1101 CD GLU A 67 4.231 28.662 -0.258 1.00 50.34 C ATOM 1102 OE1 GLU A 67 3.094 28.409 -0.621 1.00 33.51 O ATOM 1103 OE2 GLU A 67 4.501 29.399 0.676 1.00 32.40 O ATOM 0 H GLU A 67 7.663 27.779 -1.618 1.00 61.15 H new ATOM 0 HA GLU A 67 5.845 26.849 -3.633 1.00 32.33 H new ATOM 0 HB2 GLU A 67 5.845 29.618 -2.394 1.00 34.43 H new ATOM 0 HB3 GLU A 67 4.474 28.638 -2.877 1.00 34.43 H new ATOM 0 HG2 GLU A 67 5.241 26.937 -1.067 1.00 44.41 H new ATOM 0 HG3 GLU A 67 6.322 28.189 -0.489 1.00 44.41 H new ATOM 1110 N GLY A 68 6.576 28.013 -5.688 1.00 44.34 N ATOM 1111 CA GLY A 68 6.975 28.691 -6.915 1.00 21.42 C ATOM 1112 C GLY A 68 8.224 28.054 -7.513 1.00 64.21 C ATOM 1113 O GLY A 68 8.719 28.493 -8.551 1.00 64.34 O ATOM 0 H GLY A 68 6.073 27.137 -5.829 1.00 44.34 H new ATOM 0 HA2 GLY A 68 6.160 28.650 -7.638 1.00 21.42 H new ATOM 0 HA3 GLY A 68 7.164 29.744 -6.707 1.00 21.42 H new ATOM 1117 N TYR A 69 8.732 27.017 -6.854 1.00 33.41 N ATOM 1118 CA TYR A 69 9.926 26.333 -7.337 1.00 33.25 C ATOM 1119 C TYR A 69 9.640 25.615 -8.652 1.00 53.04 C ATOM 1120 O TYR A 69 8.581 25.012 -8.824 1.00 4.10 O ATOM 1121 CB TYR A 69 10.413 25.323 -6.296 1.00 3.11 C ATOM 1122 CG TYR A 69 11.910 25.166 -6.415 1.00 4.42 C ATOM 1123 CD1 TYR A 69 12.758 26.179 -5.952 1.00 25.11 C ATOM 1124 CD2 TYR A 69 12.450 24.010 -6.991 1.00 64.12 C ATOM 1125 CE1 TYR A 69 14.146 26.036 -6.064 1.00 33.11 C ATOM 1126 CE2 TYR A 69 13.838 23.867 -7.103 1.00 30.24 C ATOM 1127 CZ TYR A 69 14.686 24.880 -6.640 1.00 42.20 C ATOM 1128 OH TYR A 69 16.055 24.740 -6.752 1.00 32.13 O ATOM 0 H TYR A 69 8.340 26.635 -5.993 1.00 33.41 H new ATOM 0 HA TYR A 69 10.702 27.080 -7.506 1.00 33.25 H new ATOM 0 HB2 TYR A 69 10.150 25.661 -5.294 1.00 3.11 H new ATOM 0 HB3 TYR A 69 9.922 24.362 -6.447 1.00 3.11 H new ATOM 0 HD1 TYR A 69 12.341 27.071 -5.508 1.00 25.11 H new ATOM 0 HD2 TYR A 69 11.796 23.229 -7.349 1.00 64.12 H new ATOM 0 HE1 TYR A 69 14.800 26.817 -5.706 1.00 33.11 H new ATOM 0 HE2 TYR A 69 14.255 22.975 -7.547 1.00 30.24 H new ATOM 0 HH TYR A 69 16.262 23.880 -7.173 1.00 32.13 H new ATOM 1138 N HIS A 70 10.592 25.688 -9.576 1.00 64.31 N ATOM 1139 CA HIS A 70 10.436 25.043 -10.875 1.00 14.25 C ATOM 1140 C HIS A 70 11.799 24.708 -11.469 1.00 5.13 C ATOM 1141 O HIS A 70 12.656 25.580 -11.612 1.00 33.15 O ATOM 1142 CB HIS A 70 9.676 25.967 -11.828 1.00 52.11 C ATOM 1143 CG HIS A 70 10.403 27.278 -11.940 1.00 53.41 C ATOM 1144 ND1 HIS A 70 10.141 28.343 -11.091 1.00 74.14 N ATOM 1145 CD2 HIS A 70 11.388 27.711 -12.793 1.00 14.23 C ATOM 1146 CE1 HIS A 70 10.952 29.355 -11.449 1.00 24.44 C ATOM 1147 NE2 HIS A 70 11.732 29.024 -12.481 1.00 55.54 N ATOM 0 H HIS A 70 11.475 26.184 -9.451 1.00 64.31 H new ATOM 0 HA HIS A 70 9.873 24.120 -10.738 1.00 14.25 H new ATOM 0 HB2 HIS A 70 9.589 25.502 -12.810 1.00 52.11 H new ATOM 0 HB3 HIS A 70 8.663 26.131 -11.462 1.00 52.11 H new ATOM 0 HD1 HIS A 70 9.458 28.357 -10.333 1.00 74.14 H new ATOM 0 HD2 HIS A 70 11.829 27.123 -13.585 1.00 14.23 H new ATOM 0 HE1 HIS A 70 10.970 30.318 -10.961 1.00 24.44 H new ATOM 1156 N VAL A 71 11.995 23.439 -11.813 1.00 62.20 N ATOM 1157 CA VAL A 71 13.261 23.004 -12.389 1.00 21.42 C ATOM 1158 C VAL A 71 13.056 22.498 -13.814 1.00 34.52 C ATOM 1159 O VAL A 71 12.552 21.395 -14.025 1.00 40.11 O ATOM 1160 CB VAL A 71 13.869 21.893 -11.533 1.00 42.43 C ATOM 1161 CG1 VAL A 71 15.321 21.661 -11.953 1.00 4.22 C ATOM 1162 CG2 VAL A 71 13.826 22.307 -10.060 1.00 40.55 C ATOM 0 H VAL A 71 11.300 22.700 -11.704 1.00 62.20 H new ATOM 0 HA VAL A 71 13.940 23.856 -12.413 1.00 21.42 H new ATOM 0 HB VAL A 71 13.300 20.974 -11.672 1.00 42.43 H new ATOM 0 HG11 VAL A 71 15.754 20.869 -11.342 1.00 4.22 H new ATOM 0 HG12 VAL A 71 15.354 21.369 -13.003 1.00 4.22 H new ATOM 0 HG13 VAL A 71 15.891 22.579 -11.814 1.00 4.22 H new ATOM 0 HG21 VAL A 71 14.259 21.516 -9.447 1.00 40.55 H new ATOM 0 HG22 VAL A 71 14.397 23.226 -9.923 1.00 40.55 H new ATOM 0 HG23 VAL A 71 12.792 22.474 -9.759 1.00 40.55 H new ATOM 1172 N GLU A 72 13.452 23.313 -14.787 1.00 50.01 N ATOM 1173 CA GLU A 72 13.307 22.940 -16.189 1.00 4.02 C ATOM 1174 C GLU A 72 14.132 21.694 -16.500 1.00 40.13 C ATOM 1175 O GLU A 72 15.350 21.769 -16.662 1.00 24.32 O ATOM 1176 CB GLU A 72 13.762 24.093 -17.086 1.00 73.34 C ATOM 1177 CG GLU A 72 12.846 25.299 -16.873 1.00 71.33 C ATOM 1178 CD GLU A 72 13.430 26.526 -17.565 1.00 63.40 C ATOM 1179 OE1 GLU A 72 14.605 26.789 -17.370 1.00 43.25 O ATOM 1180 OE2 GLU A 72 12.694 27.184 -18.281 1.00 41.43 O ATOM 0 H GLU A 72 13.873 24.229 -14.632 1.00 50.01 H new ATOM 0 HA GLU A 72 12.256 22.724 -16.381 1.00 4.02 H new ATOM 0 HB2 GLU A 72 14.793 24.361 -16.856 1.00 73.34 H new ATOM 0 HB3 GLU A 72 13.738 23.785 -18.131 1.00 73.34 H new ATOM 0 HG2 GLU A 72 11.853 25.086 -17.269 1.00 71.33 H new ATOM 0 HG3 GLU A 72 12.729 25.494 -15.807 1.00 71.33 H new ATOM 1187 N GLY A 73 13.459 20.552 -16.583 1.00 61.35 N ATOM 1188 CA GLY A 73 14.138 19.295 -16.876 1.00 4.11 C ATOM 1189 C GLY A 73 13.607 18.171 -15.995 1.00 71.20 C ATOM 1190 O GLY A 73 13.561 17.012 -16.409 1.00 42.41 O ATOM 0 H GLY A 73 12.451 20.470 -16.453 1.00 61.35 H new ATOM 0 HA2 GLY A 73 13.997 19.037 -17.926 1.00 4.11 H new ATOM 0 HA3 GLY A 73 15.210 19.411 -16.718 1.00 4.11 H new ATOM 1194 N CYS A 74 13.205 18.521 -14.777 1.00 71.42 N ATOM 1195 CA CYS A 74 12.675 17.533 -13.844 1.00 61.20 C ATOM 1196 C CYS A 74 11.361 18.021 -13.242 1.00 55.52 C ATOM 1197 O CYS A 74 11.077 19.219 -13.240 1.00 74.10 O ATOM 1198 CB CYS A 74 13.688 17.279 -12.725 1.00 13.10 C ATOM 1199 SG CYS A 74 15.267 16.765 -13.446 1.00 33.02 S ATOM 0 H CYS A 74 13.236 19.474 -14.415 1.00 71.42 H new ATOM 0 HA CYS A 74 12.492 16.605 -14.386 1.00 61.20 H new ATOM 0 HB2 CYS A 74 13.824 18.183 -12.131 1.00 13.10 H new ATOM 0 HB3 CYS A 74 13.316 16.508 -12.051 1.00 13.10 H new ATOM 0 HG CYS A 74 16.240 17.389 -12.851 1.00 33.02 H new ATOM 1205 N GLU A 75 10.563 17.088 -12.731 1.00 74.12 N ATOM 1206 CA GLU A 75 9.283 17.442 -12.128 1.00 21.21 C ATOM 1207 C GLU A 75 9.462 17.753 -10.645 1.00 55.43 C ATOM 1208 O GLU A 75 10.026 16.955 -9.897 1.00 44.13 O ATOM 1209 CB GLU A 75 8.286 16.295 -12.304 1.00 25.22 C ATOM 1210 CG GLU A 75 7.702 16.341 -13.718 1.00 41.04 C ATOM 1211 CD GLU A 75 6.456 17.218 -13.739 1.00 40.44 C ATOM 1212 OE1 GLU A 75 5.697 17.161 -12.785 1.00 22.42 O ATOM 1213 OE2 GLU A 75 6.277 17.936 -14.710 1.00 41.21 O ATOM 0 H GLU A 75 10.777 16.091 -12.722 1.00 74.12 H new ATOM 0 HA GLU A 75 8.896 18.330 -12.628 1.00 21.21 H new ATOM 0 HB2 GLU A 75 8.781 15.339 -12.134 1.00 25.22 H new ATOM 0 HB3 GLU A 75 7.488 16.376 -11.566 1.00 25.22 H new ATOM 0 HG2 GLU A 75 8.444 16.732 -14.414 1.00 41.04 H new ATOM 0 HG3 GLU A 75 7.453 15.333 -14.051 1.00 41.04 H new ATOM 1220 N VAL A 76 8.987 18.924 -10.230 1.00 15.54 N ATOM 1221 CA VAL A 76 9.109 19.340 -8.837 1.00 31.35 C ATOM 1222 C VAL A 76 7.990 18.749 -7.984 1.00 35.34 C ATOM 1223 O VAL A 76 6.869 18.552 -8.455 1.00 43.44 O ATOM 1224 CB VAL A 76 9.063 20.865 -8.748 1.00 51.12 C ATOM 1225 CG1 VAL A 76 7.848 21.384 -9.518 1.00 3.43 C ATOM 1226 CG2 VAL A 76 8.953 21.286 -7.281 1.00 20.03 C ATOM 0 H VAL A 76 8.517 19.598 -10.835 1.00 15.54 H new ATOM 0 HA VAL A 76 10.063 18.974 -8.457 1.00 31.35 H new ATOM 0 HB VAL A 76 9.973 21.282 -9.180 1.00 51.12 H new ATOM 0 HG11 VAL A 76 7.815 22.472 -9.455 1.00 3.43 H new ATOM 0 HG12 VAL A 76 7.924 21.083 -10.563 1.00 3.43 H new ATOM 0 HG13 VAL A 76 6.938 20.967 -9.086 1.00 3.43 H new ATOM 0 HG21 VAL A 76 8.920 22.374 -7.216 1.00 20.03 H new ATOM 0 HG22 VAL A 76 8.043 20.869 -6.850 1.00 20.03 H new ATOM 0 HG23 VAL A 76 9.818 20.916 -6.730 1.00 20.03 H new ATOM 1236 N ALA A 77 8.307 18.479 -6.721 1.00 21.11 N ATOM 1237 CA ALA A 77 7.331 17.920 -5.792 1.00 4.12 C ATOM 1238 C ALA A 77 7.481 18.572 -4.421 1.00 0.42 C ATOM 1239 O ALA A 77 8.497 19.206 -4.135 1.00 21.12 O ATOM 1240 CB ALA A 77 7.527 16.408 -5.668 1.00 30.13 C ATOM 0 H ALA A 77 9.231 18.638 -6.318 1.00 21.11 H new ATOM 0 HA ALA A 77 6.330 18.119 -6.175 1.00 4.12 H new ATOM 0 HB1 ALA A 77 6.793 16.002 -4.972 1.00 30.13 H new ATOM 0 HB2 ALA A 77 7.397 15.943 -6.645 1.00 30.13 H new ATOM 0 HB3 ALA A 77 8.531 16.200 -5.298 1.00 30.13 H new ATOM 1246 N HIS A 78 6.466 18.417 -3.576 1.00 74.24 N ATOM 1247 CA HIS A 78 6.508 19.003 -2.241 1.00 55.45 C ATOM 1248 C HIS A 78 7.364 18.153 -1.307 1.00 43.32 C ATOM 1249 O HIS A 78 7.896 17.118 -1.707 1.00 1.34 O ATOM 1250 CB HIS A 78 5.090 19.126 -1.674 1.00 23.13 C ATOM 1251 CG HIS A 78 4.767 20.576 -1.432 1.00 55.11 C ATOM 1252 ND1 HIS A 78 4.293 21.035 -0.213 1.00 45.21 N ATOM 1253 CD2 HIS A 78 4.850 21.682 -2.242 1.00 52.52 C ATOM 1254 CE1 HIS A 78 4.111 22.364 -0.323 1.00 0.02 C ATOM 1255 NE2 HIS A 78 4.435 22.809 -1.540 1.00 2.21 N ATOM 0 H HIS A 78 5.614 17.897 -3.788 1.00 74.24 H new ATOM 0 HA HIS A 78 6.952 19.995 -2.317 1.00 55.45 H new ATOM 0 HB2 HIS A 78 4.371 18.694 -2.370 1.00 23.13 H new ATOM 0 HB3 HIS A 78 5.010 18.565 -0.743 1.00 23.13 H new ATOM 0 HD2 HIS A 78 5.186 21.677 -3.268 1.00 52.52 H new ATOM 0 HE1 HIS A 78 3.747 22.994 0.475 1.00 0.02 H new ATOM 0 HE2 HIS A 78 4.388 23.769 -1.881 1.00 2.21 H new ATOM 1264 N SER A 79 7.493 18.602 -0.063 1.00 73.22 N ATOM 1265 CA SER A 79 8.289 17.881 0.924 1.00 2.31 C ATOM 1266 C SER A 79 7.831 16.430 1.037 1.00 22.14 C ATOM 1267 O SER A 79 6.964 15.980 0.287 1.00 60.34 O ATOM 1268 CB SER A 79 8.167 18.560 2.288 1.00 11.43 C ATOM 1269 OG SER A 79 9.326 18.274 3.060 1.00 50.43 O ATOM 0 H SER A 79 7.059 19.457 0.285 1.00 73.22 H new ATOM 0 HA SER A 79 9.329 17.895 0.598 1.00 2.31 H new ATOM 0 HB2 SER A 79 8.056 19.637 2.162 1.00 11.43 H new ATOM 0 HB3 SER A 79 7.275 18.206 2.805 1.00 11.43 H new ATOM 0 HG SER A 79 9.252 18.709 3.935 1.00 50.43 H new ATOM 1275 N VAL A 80 8.421 15.705 1.982 1.00 70.54 N ATOM 1276 CA VAL A 80 8.068 14.306 2.190 1.00 53.32 C ATOM 1277 C VAL A 80 6.574 14.164 2.458 1.00 31.11 C ATOM 1278 O VAL A 80 5.985 13.112 2.209 1.00 24.32 O ATOM 1279 CB VAL A 80 8.855 13.740 3.374 1.00 3.43 C ATOM 1280 CG1 VAL A 80 8.615 14.610 4.610 1.00 32.00 C ATOM 1281 CG2 VAL A 80 8.387 12.311 3.659 1.00 4.35 C ATOM 0 H VAL A 80 9.141 16.060 2.612 1.00 70.54 H new ATOM 0 HA VAL A 80 8.318 13.750 1.287 1.00 53.32 H new ATOM 0 HB VAL A 80 9.918 13.735 3.134 1.00 3.43 H new ATOM 0 HG11 VAL A 80 9.176 14.207 5.453 1.00 32.00 H new ATOM 0 HG12 VAL A 80 8.946 15.629 4.408 1.00 32.00 H new ATOM 0 HG13 VAL A 80 7.552 14.615 4.850 1.00 32.00 H new ATOM 0 HG21 VAL A 80 8.947 11.906 4.502 1.00 4.35 H new ATOM 0 HG22 VAL A 80 7.324 12.317 3.899 1.00 4.35 H new ATOM 0 HG23 VAL A 80 8.557 11.690 2.779 1.00 4.35 H new ATOM 1291 N GLU A 81 5.967 15.230 2.969 1.00 24.12 N ATOM 1292 CA GLU A 81 4.540 15.216 3.270 1.00 33.44 C ATOM 1293 C GLU A 81 3.735 14.807 2.040 1.00 34.24 C ATOM 1294 O GLU A 81 2.972 13.843 2.078 1.00 42.21 O ATOM 1295 CB GLU A 81 4.090 16.602 3.737 1.00 4.13 C ATOM 1296 CG GLU A 81 4.981 17.068 4.891 1.00 21.31 C ATOM 1297 CD GLU A 81 4.531 18.443 5.373 1.00 1.20 C ATOM 1298 OE1 GLU A 81 3.334 18.646 5.488 1.00 4.44 O ATOM 1299 OE2 GLU A 81 5.391 19.274 5.619 1.00 3.33 O ATOM 0 H GLU A 81 6.437 16.110 3.182 1.00 24.12 H new ATOM 0 HA GLU A 81 4.364 14.490 4.064 1.00 33.44 H new ATOM 0 HB2 GLU A 81 4.146 17.311 2.911 1.00 4.13 H new ATOM 0 HB3 GLU A 81 3.049 16.569 4.058 1.00 4.13 H new ATOM 0 HG2 GLU A 81 4.932 16.352 5.711 1.00 21.31 H new ATOM 0 HG3 GLU A 81 6.020 17.110 4.565 1.00 21.31 H new ATOM 1306 N GLU A 82 3.908 15.550 0.951 1.00 43.52 N ATOM 1307 CA GLU A 82 3.189 15.258 -0.284 1.00 13.21 C ATOM 1308 C GLU A 82 3.637 13.920 -0.866 1.00 23.52 C ATOM 1309 O GLU A 82 2.829 13.171 -1.414 1.00 45.31 O ATOM 1310 CB GLU A 82 3.437 16.371 -1.305 1.00 21.10 C ATOM 1311 CG GLU A 82 2.530 16.163 -2.520 1.00 53.11 C ATOM 1312 CD GLU A 82 1.081 16.446 -2.141 1.00 24.33 C ATOM 1313 OE1 GLU A 82 0.730 17.610 -2.047 1.00 3.12 O ATOM 1314 OE2 GLU A 82 0.342 15.493 -1.951 1.00 52.41 O ATOM 0 H GLU A 82 4.535 16.353 0.898 1.00 43.52 H new ATOM 0 HA GLU A 82 2.124 15.201 -0.058 1.00 13.21 H new ATOM 0 HB2 GLU A 82 3.240 17.343 -0.853 1.00 21.10 H new ATOM 0 HB3 GLU A 82 4.482 16.369 -1.614 1.00 21.10 H new ATOM 0 HG2 GLU A 82 2.838 16.822 -3.332 1.00 53.11 H new ATOM 0 HG3 GLU A 82 2.626 15.141 -2.886 1.00 53.11 H new ATOM 1321 N VAL A 83 4.927 13.628 -0.743 1.00 72.12 N ATOM 1322 CA VAL A 83 5.471 12.378 -1.263 1.00 22.12 C ATOM 1323 C VAL A 83 4.827 11.179 -0.572 1.00 3.34 C ATOM 1324 O VAL A 83 4.623 10.132 -1.186 1.00 22.11 O ATOM 1325 CB VAL A 83 6.985 12.338 -1.048 1.00 73.20 C ATOM 1326 CG1 VAL A 83 7.564 11.091 -1.719 1.00 13.42 C ATOM 1327 CG2 VAL A 83 7.618 13.588 -1.663 1.00 24.54 C ATOM 0 H VAL A 83 5.612 14.234 -0.291 1.00 72.12 H new ATOM 0 HA VAL A 83 5.252 12.327 -2.330 1.00 22.12 H new ATOM 0 HB VAL A 83 7.200 12.308 0.020 1.00 73.20 H new ATOM 0 HG11 VAL A 83 8.643 11.063 -1.566 1.00 13.42 H new ATOM 0 HG12 VAL A 83 7.112 10.200 -1.283 1.00 13.42 H new ATOM 0 HG13 VAL A 83 7.350 11.120 -2.787 1.00 13.42 H new ATOM 0 HG21 VAL A 83 8.697 13.562 -1.511 1.00 24.54 H new ATOM 0 HG22 VAL A 83 7.403 13.617 -2.731 1.00 24.54 H new ATOM 0 HG23 VAL A 83 7.206 14.477 -1.186 1.00 24.54 H new ATOM 1337 N PHE A 84 4.514 11.337 0.709 1.00 72.44 N ATOM 1338 CA PHE A 84 3.899 10.258 1.474 1.00 31.42 C ATOM 1339 C PHE A 84 2.629 9.758 0.781 1.00 64.25 C ATOM 1340 O PHE A 84 2.467 8.559 0.551 1.00 30.11 O ATOM 1341 CB PHE A 84 3.575 10.751 2.895 1.00 62.14 C ATOM 1342 CG PHE A 84 2.174 10.338 3.292 1.00 44.30 C ATOM 1343 CD1 PHE A 84 1.904 9.005 3.626 1.00 61.30 C ATOM 1344 CD2 PHE A 84 1.147 11.288 3.320 1.00 71.21 C ATOM 1345 CE1 PHE A 84 0.607 8.624 3.988 1.00 12.14 C ATOM 1346 CE2 PHE A 84 -0.150 10.907 3.683 1.00 41.20 C ATOM 1347 CZ PHE A 84 -0.421 9.575 4.016 1.00 63.31 C ATOM 0 H PHE A 84 4.674 12.195 1.237 1.00 72.44 H new ATOM 0 HA PHE A 84 4.601 9.426 1.535 1.00 31.42 H new ATOM 0 HB2 PHE A 84 4.296 10.340 3.602 1.00 62.14 H new ATOM 0 HB3 PHE A 84 3.667 11.836 2.940 1.00 62.14 H new ATOM 0 HD1 PHE A 84 2.696 8.271 3.604 1.00 61.30 H new ATOM 0 HD2 PHE A 84 1.355 12.316 3.061 1.00 71.21 H new ATOM 0 HE1 PHE A 84 0.399 7.596 4.246 1.00 12.14 H new ATOM 0 HE2 PHE A 84 -0.942 11.641 3.706 1.00 41.20 H new ATOM 0 HZ PHE A 84 -1.422 9.281 4.294 1.00 63.31 H new ATOM 1357 N GLU A 85 1.729 10.685 0.464 1.00 25.03 N ATOM 1358 CA GLU A 85 0.472 10.329 -0.189 1.00 23.33 C ATOM 1359 C GLU A 85 0.692 9.990 -1.662 1.00 44.14 C ATOM 1360 O GLU A 85 0.096 9.048 -2.186 1.00 53.33 O ATOM 1361 CB GLU A 85 -0.526 11.485 -0.069 1.00 52.13 C ATOM 1362 CG GLU A 85 0.190 12.814 -0.322 1.00 14.31 C ATOM 1363 CD GLU A 85 -0.810 13.963 -0.260 1.00 74.24 C ATOM 1364 OE1 GLU A 85 -1.515 14.163 -1.235 1.00 55.22 O ATOM 1365 OE2 GLU A 85 -0.857 14.626 0.764 1.00 52.31 O ATOM 0 H GLU A 85 1.845 11.682 0.647 1.00 25.03 H new ATOM 0 HA GLU A 85 0.071 9.447 0.310 1.00 23.33 H new ATOM 0 HB2 GLU A 85 -1.336 11.355 -0.787 1.00 52.13 H new ATOM 0 HB3 GLU A 85 -0.977 11.487 0.923 1.00 52.13 H new ATOM 0 HG2 GLU A 85 0.974 12.962 0.421 1.00 14.31 H new ATOM 0 HG3 GLU A 85 0.676 12.795 -1.298 1.00 14.31 H new ATOM 1372 N LEU A 86 1.546 10.763 -2.325 1.00 23.23 N ATOM 1373 CA LEU A 86 1.830 10.531 -3.738 1.00 72.22 C ATOM 1374 C LEU A 86 2.303 9.099 -3.965 1.00 41.32 C ATOM 1375 O LEU A 86 2.128 8.542 -5.048 1.00 73.31 O ATOM 1376 CB LEU A 86 2.907 11.509 -4.224 1.00 4.20 C ATOM 1377 CG LEU A 86 2.345 12.385 -5.347 1.00 12.02 C ATOM 1378 CD1 LEU A 86 1.289 13.332 -4.776 1.00 74.23 C ATOM 1379 CD2 LEU A 86 3.477 13.207 -5.968 1.00 71.43 C ATOM 0 H LEU A 86 2.049 11.548 -1.912 1.00 23.23 H new ATOM 0 HA LEU A 86 0.911 10.691 -4.302 1.00 72.22 H new ATOM 0 HB2 LEU A 86 3.243 12.134 -3.397 1.00 4.20 H new ATOM 0 HB3 LEU A 86 3.777 10.958 -4.581 1.00 4.20 H new ATOM 0 HG LEU A 86 1.893 11.750 -6.109 1.00 12.02 H new ATOM 0 HD11 LEU A 86 0.889 13.956 -5.576 1.00 74.23 H new ATOM 0 HD12 LEU A 86 0.482 12.751 -4.331 1.00 74.23 H new ATOM 0 HD13 LEU A 86 1.743 13.966 -4.014 1.00 74.23 H new ATOM 0 HD21 LEU A 86 3.077 13.831 -6.768 1.00 71.43 H new ATOM 0 HD22 LEU A 86 3.928 13.841 -5.204 1.00 71.43 H new ATOM 0 HD23 LEU A 86 4.233 12.536 -6.375 1.00 71.43 H new ATOM 1391 N CYS A 87 2.913 8.510 -2.941 1.00 34.51 N ATOM 1392 CA CYS A 87 3.416 7.145 -3.051 1.00 52.41 C ATOM 1393 C CYS A 87 2.272 6.143 -3.183 1.00 71.11 C ATOM 1394 O CYS A 87 2.340 5.217 -3.991 1.00 75.53 O ATOM 1395 CB CYS A 87 4.262 6.797 -1.824 1.00 32.21 C ATOM 1396 SG CYS A 87 5.909 7.524 -2.003 1.00 11.43 S ATOM 0 H CYS A 87 3.070 8.951 -2.035 1.00 34.51 H new ATOM 0 HA CYS A 87 4.031 7.086 -3.949 1.00 52.41 H new ATOM 0 HB2 CYS A 87 3.783 7.173 -0.920 1.00 32.21 H new ATOM 0 HB3 CYS A 87 4.340 5.715 -1.717 1.00 32.21 H new ATOM 0 HG CYS A 87 5.824 8.818 -1.912 1.00 11.43 H new ATOM 1402 N LYS A 88 1.225 6.327 -2.385 1.00 33.35 N ATOM 1403 CA LYS A 88 0.080 5.422 -2.426 1.00 5.31 C ATOM 1404 C LYS A 88 -0.611 5.481 -3.785 1.00 63.03 C ATOM 1405 O LYS A 88 -1.610 4.798 -4.012 1.00 22.43 O ATOM 1406 CB LYS A 88 -0.918 5.789 -1.324 1.00 3.14 C ATOM 1407 CG LYS A 88 -1.978 6.744 -1.880 1.00 54.43 C ATOM 1408 CD LYS A 88 -2.697 7.438 -0.723 1.00 64.54 C ATOM 1409 CE LYS A 88 -3.684 8.468 -1.276 1.00 44.31 C ATOM 1410 NZ LYS A 88 -4.502 9.017 -0.157 1.00 60.54 N ATOM 0 H LYS A 88 1.145 7.086 -1.708 1.00 33.35 H new ATOM 0 HA LYS A 88 0.442 4.407 -2.264 1.00 5.31 H new ATOM 0 HB2 LYS A 88 -1.394 4.888 -0.937 1.00 3.14 H new ATOM 0 HB3 LYS A 88 -0.396 6.257 -0.489 1.00 3.14 H new ATOM 0 HG2 LYS A 88 -1.511 7.485 -2.528 1.00 54.43 H new ATOM 0 HG3 LYS A 88 -2.695 6.194 -2.490 1.00 54.43 H new ATOM 0 HD2 LYS A 88 -3.225 6.702 -0.116 1.00 64.54 H new ATOM 0 HD3 LYS A 88 -1.972 7.927 -0.072 1.00 64.54 H new ATOM 0 HE2 LYS A 88 -3.145 9.273 -1.777 1.00 44.31 H new ATOM 0 HE3 LYS A 88 -4.331 8.005 -2.021 1.00 44.31 H new ATOM 0 HZ1 LYS A 88 -5.174 9.718 -0.530 1.00 60.54 H new ATOM 0 HZ2 LYS A 88 -5.026 8.244 0.302 1.00 60.54 H new ATOM 0 HZ3 LYS A 88 -3.877 9.472 0.539 1.00 60.54 H new ATOM 1424 N ASN A 89 -0.081 6.304 -4.683 1.00 60.23 N ATOM 1425 CA ASN A 89 -0.669 6.441 -6.009 1.00 74.11 C ATOM 1426 C ASN A 89 -0.412 5.191 -6.846 1.00 24.25 C ATOM 1427 O ASN A 89 -1.194 4.861 -7.737 1.00 41.04 O ATOM 1428 CB ASN A 89 -0.085 7.664 -6.720 1.00 51.23 C ATOM 1429 CG ASN A 89 -0.338 8.922 -5.895 1.00 64.01 C ATOM 1430 OD1 ASN A 89 -0.811 8.838 -4.762 1.00 42.11 O ATOM 1431 ND2 ASN A 89 -0.047 10.091 -6.398 1.00 25.33 N ATOM 0 H ASN A 89 0.745 6.880 -4.520 1.00 60.23 H new ATOM 0 HA ASN A 89 -1.745 6.570 -5.893 1.00 74.11 H new ATOM 0 HB2 ASN A 89 0.986 7.529 -6.872 1.00 51.23 H new ATOM 0 HB3 ASN A 89 -0.536 7.770 -7.707 1.00 51.23 H new ATOM 0 HD21 ASN A 89 -0.212 10.937 -5.852 1.00 25.33 H new ATOM 0 HD22 ASN A 89 0.345 10.159 -7.337 1.00 25.33 H new ATOM 1438 N GLU A 90 0.687 4.499 -6.557 1.00 2.02 N ATOM 1439 CA GLU A 90 1.031 3.290 -7.298 1.00 43.14 C ATOM 1440 C GLU A 90 1.552 2.206 -6.359 1.00 72.51 C ATOM 1441 O GLU A 90 2.208 2.498 -5.359 1.00 1.24 O ATOM 1442 CB GLU A 90 2.100 3.608 -8.345 1.00 1.23 C ATOM 1443 CG GLU A 90 1.439 3.805 -9.711 1.00 50.13 C ATOM 1444 CD GLU A 90 0.959 2.465 -10.258 1.00 73.31 C ATOM 1445 OE1 GLU A 90 1.800 1.642 -10.578 1.00 62.11 O ATOM 1446 OE2 GLU A 90 -0.244 2.282 -10.349 1.00 13.25 O ATOM 0 H GLU A 90 1.348 4.752 -5.823 1.00 2.02 H new ATOM 0 HA GLU A 90 0.129 2.925 -7.790 1.00 43.14 H new ATOM 0 HB2 GLU A 90 2.645 4.508 -8.061 1.00 1.23 H new ATOM 0 HB3 GLU A 90 2.827 2.797 -8.395 1.00 1.23 H new ATOM 0 HG2 GLU A 90 0.598 4.492 -9.621 1.00 50.13 H new ATOM 0 HG3 GLU A 90 2.148 4.257 -10.405 1.00 50.13 H new ATOM 1453 N GLU A 91 1.259 0.953 -6.692 1.00 10.42 N ATOM 1454 CA GLU A 91 1.706 -0.170 -5.875 1.00 73.44 C ATOM 1455 C GLU A 91 3.224 -0.306 -5.938 1.00 11.52 C ATOM 1456 O GLU A 91 3.884 -0.486 -4.914 1.00 41.50 O ATOM 1457 CB GLU A 91 1.059 -1.465 -6.372 1.00 53.52 C ATOM 1458 CG GLU A 91 1.403 -1.670 -7.849 1.00 10.45 C ATOM 1459 CD GLU A 91 0.337 -2.529 -8.520 1.00 55.41 C ATOM 1460 OE1 GLU A 91 -0.147 -3.446 -7.877 1.00 71.32 O ATOM 1461 OE2 GLU A 91 0.021 -2.258 -9.666 1.00 75.12 O ATOM 0 H GLU A 91 0.718 0.691 -7.516 1.00 10.42 H new ATOM 0 HA GLU A 91 1.409 0.015 -4.843 1.00 73.44 H new ATOM 0 HB2 GLU A 91 1.414 -2.311 -5.784 1.00 53.52 H new ATOM 0 HB3 GLU A 91 -0.022 -1.418 -6.242 1.00 53.52 H new ATOM 0 HG2 GLU A 91 1.473 -0.705 -8.351 1.00 10.45 H new ATOM 0 HG3 GLU A 91 2.378 -2.149 -7.940 1.00 10.45 H new ATOM 1468 N GLU A 92 3.770 -0.220 -7.147 1.00 1.22 N ATOM 1469 CA GLU A 92 5.213 -0.337 -7.332 1.00 21.22 C ATOM 1470 C GLU A 92 5.841 1.036 -7.552 1.00 73.32 C ATOM 1471 O GLU A 92 5.595 1.685 -8.569 1.00 63.22 O ATOM 1472 CB GLU A 92 5.514 -1.235 -8.534 1.00 10.44 C ATOM 1473 CG GLU A 92 5.531 -2.700 -8.091 1.00 51.41 C ATOM 1474 CD GLU A 92 5.679 -3.611 -9.305 1.00 0.41 C ATOM 1475 OE1 GLU A 92 4.767 -3.640 -10.114 1.00 14.32 O ATOM 1476 OE2 GLU A 92 6.703 -4.266 -9.408 1.00 42.45 O ATOM 0 H GLU A 92 3.241 -0.071 -8.006 1.00 1.22 H new ATOM 0 HA GLU A 92 5.640 -0.778 -6.431 1.00 21.22 H new ATOM 0 HB2 GLU A 92 4.761 -1.088 -9.308 1.00 10.44 H new ATOM 0 HB3 GLU A 92 6.476 -0.965 -8.970 1.00 10.44 H new ATOM 0 HG2 GLU A 92 6.354 -2.869 -7.397 1.00 51.41 H new ATOM 0 HG3 GLU A 92 4.611 -2.938 -7.558 1.00 51.41 H new ATOM 1483 N ILE A 93 6.654 1.470 -6.594 1.00 3.31 N ATOM 1484 CA ILE A 93 7.315 2.767 -6.694 1.00 12.24 C ATOM 1485 C ILE A 93 8.770 2.663 -6.248 1.00 21.44 C ATOM 1486 O ILE A 93 9.103 1.876 -5.363 1.00 3.42 O ATOM 1487 CB ILE A 93 6.587 3.794 -5.825 1.00 33.54 C ATOM 1488 CG1 ILE A 93 6.727 3.407 -4.350 1.00 54.33 C ATOM 1489 CG2 ILE A 93 5.106 3.825 -6.204 1.00 22.43 C ATOM 1490 CD1 ILE A 93 5.921 4.382 -3.489 1.00 74.24 C ATOM 0 H ILE A 93 6.870 0.947 -5.745 1.00 3.31 H new ATOM 0 HA ILE A 93 7.287 3.087 -7.736 1.00 12.24 H new ATOM 0 HB ILE A 93 7.024 4.779 -5.986 1.00 33.54 H new ATOM 0 HG12 ILE A 93 6.372 2.388 -4.195 1.00 54.33 H new ATOM 0 HG13 ILE A 93 7.776 3.427 -4.056 1.00 54.33 H new ATOM 0 HG21 ILE A 93 4.587 4.557 -5.585 1.00 22.43 H new ATOM 0 HG22 ILE A 93 5.005 4.101 -7.254 1.00 22.43 H new ATOM 0 HG23 ILE A 93 4.669 2.839 -6.044 1.00 22.43 H new ATOM 0 HD11 ILE A 93 6.020 4.107 -2.439 1.00 74.24 H new ATOM 0 HD12 ILE A 93 6.297 5.394 -3.636 1.00 74.24 H new ATOM 0 HD13 ILE A 93 4.871 4.340 -3.778 1.00 74.24 H new ATOM 1502 N PHE A 94 9.633 3.467 -6.863 1.00 63.52 N ATOM 1503 CA PHE A 94 11.048 3.456 -6.515 1.00 3.22 C ATOM 1504 C PHE A 94 11.436 4.777 -5.860 1.00 73.13 C ATOM 1505 O PHE A 94 11.155 5.850 -6.394 1.00 40.02 O ATOM 1506 CB PHE A 94 11.891 3.220 -7.768 1.00 54.35 C ATOM 1507 CG PHE A 94 11.906 1.747 -8.092 1.00 12.33 C ATOM 1508 CD1 PHE A 94 10.708 1.083 -8.377 1.00 60.12 C ATOM 1509 CD2 PHE A 94 13.117 1.046 -8.107 1.00 53.31 C ATOM 1510 CE1 PHE A 94 10.720 -0.284 -8.678 1.00 15.01 C ATOM 1511 CE2 PHE A 94 13.130 -0.321 -8.407 1.00 4.31 C ATOM 1512 CZ PHE A 94 11.931 -0.986 -8.693 1.00 60.23 C ATOM 0 H PHE A 94 9.380 4.128 -7.598 1.00 63.52 H new ATOM 0 HA PHE A 94 11.233 2.647 -5.808 1.00 3.22 H new ATOM 0 HB2 PHE A 94 11.482 3.784 -8.606 1.00 54.35 H new ATOM 0 HB3 PHE A 94 12.908 3.579 -7.608 1.00 54.35 H new ATOM 0 HD1 PHE A 94 9.774 1.625 -8.365 1.00 60.12 H new ATOM 0 HD2 PHE A 94 14.041 1.560 -7.887 1.00 53.31 H new ATOM 0 HE1 PHE A 94 9.795 -0.797 -8.899 1.00 15.01 H new ATOM 0 HE2 PHE A 94 14.064 -0.863 -8.418 1.00 4.31 H new ATOM 0 HZ PHE A 94 11.941 -2.041 -8.925 1.00 60.23 H new ATOM 1522 N ILE A 95 12.065 4.694 -4.691 1.00 4.44 N ATOM 1523 CA ILE A 95 12.463 5.896 -3.966 1.00 42.33 C ATOM 1524 C ILE A 95 13.981 6.044 -3.929 1.00 3.24 C ATOM 1525 O ILE A 95 14.691 5.171 -3.429 1.00 34.14 O ATOM 1526 CB ILE A 95 11.923 5.844 -2.534 1.00 10.20 C ATOM 1527 CG1 ILE A 95 10.461 5.382 -2.546 1.00 42.11 C ATOM 1528 CG2 ILE A 95 12.007 7.236 -1.906 1.00 32.41 C ATOM 1529 CD1 ILE A 95 9.555 6.555 -2.924 1.00 41.25 C ATOM 0 H ILE A 95 12.308 3.817 -4.230 1.00 4.44 H new ATOM 0 HA ILE A 95 12.045 6.756 -4.489 1.00 42.33 H new ATOM 0 HB ILE A 95 12.520 5.141 -1.952 1.00 10.20 H new ATOM 0 HG12 ILE A 95 10.333 4.566 -3.258 1.00 42.11 H new ATOM 0 HG13 ILE A 95 10.183 4.996 -1.565 1.00 42.11 H new ATOM 0 HG21 ILE A 95 11.623 7.199 -0.887 1.00 32.41 H new ATOM 0 HG22 ILE A 95 13.046 7.566 -1.890 1.00 32.41 H new ATOM 0 HG23 ILE A 95 11.413 7.936 -2.493 1.00 32.41 H new ATOM 0 HD11 ILE A 95 8.516 6.225 -2.932 1.00 41.25 H new ATOM 0 HD12 ILE A 95 9.675 7.357 -2.196 1.00 41.25 H new ATOM 0 HD13 ILE A 95 9.827 6.921 -3.914 1.00 41.25 H new ATOM 1541 N PHE A 96 14.468 7.166 -4.450 1.00 31.13 N ATOM 1542 CA PHE A 96 15.900 7.440 -4.462 1.00 23.52 C ATOM 1543 C PHE A 96 16.223 8.543 -3.460 1.00 50.24 C ATOM 1544 O PHE A 96 17.269 8.523 -2.810 1.00 64.43 O ATOM 1545 CB PHE A 96 16.339 7.875 -5.865 1.00 75.31 C ATOM 1546 CG PHE A 96 17.381 6.918 -6.397 1.00 12.20 C ATOM 1547 CD1 PHE A 96 18.719 7.051 -6.004 1.00 62.40 C ATOM 1548 CD2 PHE A 96 17.010 5.903 -7.286 1.00 14.53 C ATOM 1549 CE1 PHE A 96 19.685 6.167 -6.500 1.00 65.23 C ATOM 1550 CE2 PHE A 96 17.977 5.019 -7.783 1.00 21.34 C ATOM 1551 CZ PHE A 96 19.314 5.152 -7.389 1.00 41.45 C ATOM 0 H PHE A 96 13.894 7.898 -4.868 1.00 31.13 H new ATOM 0 HA PHE A 96 16.436 6.532 -4.185 1.00 23.52 H new ATOM 0 HB2 PHE A 96 15.479 7.898 -6.534 1.00 75.31 H new ATOM 0 HB3 PHE A 96 16.744 8.886 -5.832 1.00 75.31 H new ATOM 0 HD1 PHE A 96 19.005 7.835 -5.319 1.00 62.40 H new ATOM 0 HD2 PHE A 96 15.978 5.801 -7.589 1.00 14.53 H new ATOM 0 HE1 PHE A 96 20.716 6.269 -6.196 1.00 65.23 H new ATOM 0 HE2 PHE A 96 17.691 4.236 -8.469 1.00 21.34 H new ATOM 0 HZ PHE A 96 20.060 4.471 -7.772 1.00 41.45 H new ATOM 1561 N GLY A 97 15.309 9.503 -3.340 1.00 34.52 N ATOM 1562 CA GLY A 97 15.488 10.616 -2.414 1.00 31.34 C ATOM 1563 C GLY A 97 16.965 10.927 -2.200 1.00 54.20 C ATOM 1564 O GLY A 97 17.599 11.578 -3.031 1.00 23.23 O ATOM 0 H GLY A 97 14.439 9.532 -3.872 1.00 34.52 H new ATOM 0 HA2 GLY A 97 14.981 11.499 -2.802 1.00 31.34 H new ATOM 0 HA3 GLY A 97 15.023 10.375 -1.458 1.00 31.34 H new ATOM 1568 N GLY A 98 17.503 10.461 -1.078 1.00 62.43 N ATOM 1569 CA GLY A 98 18.905 10.696 -0.756 1.00 31.51 C ATOM 1570 C GLY A 98 19.260 10.091 0.598 1.00 52.21 C ATOM 1571 O GLY A 98 18.533 9.245 1.119 1.00 12.52 O ATOM 0 H GLY A 98 16.992 9.921 -0.380 1.00 62.43 H new ATOM 0 HA2 GLY A 98 19.538 10.262 -1.530 1.00 31.51 H new ATOM 0 HA3 GLY A 98 19.105 11.767 -0.744 1.00 31.51 H new ATOM 1575 N ALA A 99 20.380 10.529 1.164 1.00 63.42 N ATOM 1576 CA ALA A 99 20.819 10.020 2.458 1.00 34.32 C ATOM 1577 C ALA A 99 19.850 10.443 3.558 1.00 10.12 C ATOM 1578 O ALA A 99 19.217 9.602 4.196 1.00 23.55 O ATOM 1579 CB ALA A 99 22.219 10.547 2.780 1.00 4.23 C ATOM 0 H ALA A 99 20.996 11.230 0.751 1.00 63.42 H new ATOM 0 HA ALA A 99 20.843 8.931 2.409 1.00 34.32 H new ATOM 0 HB1 ALA A 99 22.539 10.162 3.748 1.00 4.23 H new ATOM 0 HB2 ALA A 99 22.917 10.219 2.010 1.00 4.23 H new ATOM 0 HB3 ALA A 99 22.199 11.636 2.811 1.00 4.23 H new ATOM 1585 N GLN A 100 19.736 11.750 3.772 1.00 1.42 N ATOM 1586 CA GLN A 100 18.837 12.266 4.797 1.00 10.12 C ATOM 1587 C GLN A 100 17.417 11.774 4.547 1.00 30.24 C ATOM 1588 O GLN A 100 16.664 11.511 5.485 1.00 13.13 O ATOM 1589 CB GLN A 100 18.860 13.796 4.796 1.00 43.24 C ATOM 1590 CG GLN A 100 18.557 14.312 3.389 1.00 15.01 C ATOM 1591 CD GLN A 100 19.365 15.576 3.112 1.00 51.14 C ATOM 1592 OE1 GLN A 100 19.155 16.602 3.759 1.00 31.23 O ATOM 1593 NE2 GLN A 100 20.283 15.562 2.185 1.00 13.13 N ATOM 0 H GLN A 100 20.249 12.464 3.255 1.00 1.42 H new ATOM 0 HA GLN A 100 19.173 11.904 5.769 1.00 10.12 H new ATOM 0 HB2 GLN A 100 18.124 14.181 5.502 1.00 43.24 H new ATOM 0 HB3 GLN A 100 19.835 14.155 5.124 1.00 43.24 H new ATOM 0 HG2 GLN A 100 18.800 13.547 2.652 1.00 15.01 H new ATOM 0 HG3 GLN A 100 17.492 14.522 3.291 1.00 15.01 H new ATOM 0 HE21 GLN A 100 20.455 14.711 1.650 1.00 13.13 H new ATOM 0 HE22 GLN A 100 20.829 16.403 1.995 1.00 13.13 H new ATOM 1602 N ILE A 101 17.061 11.647 3.273 1.00 62.53 N ATOM 1603 CA ILE A 101 15.731 11.179 2.906 1.00 11.43 C ATOM 1604 C ILE A 101 15.625 9.672 3.115 1.00 4.10 C ATOM 1605 O ILE A 101 14.557 9.153 3.438 1.00 73.12 O ATOM 1606 CB ILE A 101 15.443 11.523 1.444 1.00 20.34 C ATOM 1607 CG1 ILE A 101 15.823 12.990 1.191 1.00 15.44 C ATOM 1608 CG2 ILE A 101 13.954 11.308 1.156 1.00 34.32 C ATOM 1609 CD1 ILE A 101 14.811 13.644 0.245 1.00 41.35 C ATOM 0 H ILE A 101 17.670 11.860 2.483 1.00 62.53 H new ATOM 0 HA ILE A 101 14.997 11.674 3.541 1.00 11.43 H new ATOM 0 HB ILE A 101 16.028 10.880 0.786 1.00 20.34 H new ATOM 0 HG12 ILE A 101 15.853 13.533 2.135 1.00 15.44 H new ATOM 0 HG13 ILE A 101 16.823 13.045 0.760 1.00 15.44 H new ATOM 0 HG21 ILE A 101 13.746 11.553 0.114 1.00 34.32 H new ATOM 0 HG22 ILE A 101 13.694 10.266 1.343 1.00 34.32 H new ATOM 0 HG23 ILE A 101 13.361 11.952 1.805 1.00 34.32 H new ATOM 0 HD11 ILE A 101 15.092 14.683 0.074 1.00 41.35 H new ATOM 0 HD12 ILE A 101 14.803 13.109 -0.705 1.00 41.35 H new ATOM 0 HD13 ILE A 101 13.818 13.605 0.692 1.00 41.35 H new ATOM 1621 N TYR A 102 16.744 8.977 2.937 1.00 52.51 N ATOM 1622 CA TYR A 102 16.771 7.530 3.118 1.00 72.31 C ATOM 1623 C TYR A 102 16.421 7.177 4.563 1.00 34.11 C ATOM 1624 O TYR A 102 15.818 6.138 4.832 1.00 64.20 O ATOM 1625 CB TYR A 102 18.165 6.988 2.760 1.00 52.35 C ATOM 1626 CG TYR A 102 18.596 5.941 3.765 1.00 41.14 C ATOM 1627 CD1 TYR A 102 18.986 6.329 5.053 1.00 34.34 C ATOM 1628 CD2 TYR A 102 18.599 4.587 3.412 1.00 30.04 C ATOM 1629 CE1 TYR A 102 19.378 5.363 5.987 1.00 70.31 C ATOM 1630 CE2 TYR A 102 18.993 3.620 4.346 1.00 33.21 C ATOM 1631 CZ TYR A 102 19.382 4.009 5.634 1.00 63.33 C ATOM 1632 OH TYR A 102 19.767 3.057 6.556 1.00 2.35 O ATOM 0 H TYR A 102 17.638 9.389 2.670 1.00 52.51 H new ATOM 0 HA TYR A 102 16.033 7.072 2.459 1.00 72.31 H new ATOM 0 HB2 TYR A 102 18.149 6.556 1.759 1.00 52.35 H new ATOM 0 HB3 TYR A 102 18.887 7.805 2.743 1.00 52.35 H new ATOM 0 HD1 TYR A 102 18.984 7.374 5.326 1.00 34.34 H new ATOM 0 HD2 TYR A 102 18.297 4.287 2.419 1.00 30.04 H new ATOM 0 HE1 TYR A 102 19.677 5.663 6.980 1.00 70.31 H new ATOM 0 HE2 TYR A 102 18.997 2.575 4.073 1.00 33.21 H new ATOM 0 HH TYR A 102 19.711 2.167 6.150 1.00 2.35 H new ATOM 1642 N ASP A 103 16.816 8.047 5.486 1.00 35.13 N ATOM 1643 CA ASP A 103 16.553 7.823 6.903 1.00 32.01 C ATOM 1644 C ASP A 103 15.122 8.211 7.263 1.00 52.20 C ATOM 1645 O ASP A 103 14.443 7.497 8.000 1.00 54.13 O ATOM 1646 CB ASP A 103 17.530 8.648 7.744 1.00 20.43 C ATOM 1647 CG ASP A 103 17.510 8.164 9.189 1.00 23.13 C ATOM 1648 OD1 ASP A 103 16.875 7.155 9.446 1.00 71.12 O ATOM 1649 OD2 ASP A 103 18.131 8.809 10.018 1.00 2.43 O ATOM 0 H ASP A 103 17.318 8.911 5.280 1.00 35.13 H new ATOM 0 HA ASP A 103 16.687 6.762 7.112 1.00 32.01 H new ATOM 0 HB2 ASP A 103 18.537 8.561 7.336 1.00 20.43 H new ATOM 0 HB3 ASP A 103 17.259 9.703 7.701 1.00 20.43 H new ATOM 1654 N LEU A 104 14.676 9.350 6.748 1.00 50.53 N ATOM 1655 CA LEU A 104 13.327 9.830 7.032 1.00 24.12 C ATOM 1656 C LEU A 104 12.273 8.878 6.472 1.00 75.31 C ATOM 1657 O LEU A 104 11.182 8.754 7.029 1.00 45.40 O ATOM 1658 CB LEU A 104 13.132 11.221 6.427 1.00 54.44 C ATOM 1659 CG LEU A 104 13.440 12.284 7.483 1.00 55.33 C ATOM 1660 CD1 LEU A 104 14.795 11.986 8.127 1.00 44.31 C ATOM 1661 CD2 LEU A 104 13.483 13.664 6.822 1.00 42.55 C ATOM 0 H LEU A 104 15.223 9.956 6.136 1.00 50.53 H new ATOM 0 HA LEU A 104 13.207 9.878 8.114 1.00 24.12 H new ATOM 0 HB2 LEU A 104 13.786 11.349 5.565 1.00 54.44 H new ATOM 0 HB3 LEU A 104 12.108 11.334 6.070 1.00 54.44 H new ATOM 0 HG LEU A 104 12.663 12.271 8.247 1.00 55.33 H new ATOM 0 HD11 LEU A 104 15.015 12.743 8.879 1.00 44.31 H new ATOM 0 HD12 LEU A 104 14.766 11.004 8.599 1.00 44.31 H new ATOM 0 HD13 LEU A 104 15.572 11.998 7.362 1.00 44.31 H new ATOM 0 HD21 LEU A 104 13.702 14.421 7.575 1.00 42.55 H new ATOM 0 HD22 LEU A 104 14.259 13.677 6.057 1.00 42.55 H new ATOM 0 HD23 LEU A 104 12.518 13.878 6.363 1.00 42.55 H new ATOM 1673 N PHE A 105 12.597 8.212 5.367 1.00 12.01 N ATOM 1674 CA PHE A 105 11.657 7.282 4.748 1.00 3.03 C ATOM 1675 C PHE A 105 12.027 5.839 5.075 1.00 53.24 C ATOM 1676 O PHE A 105 11.547 4.906 4.430 1.00 24.30 O ATOM 1677 CB PHE A 105 11.653 7.479 3.228 1.00 12.11 C ATOM 1678 CG PHE A 105 10.239 7.702 2.748 1.00 3.02 C ATOM 1679 CD1 PHE A 105 9.443 8.683 3.350 1.00 43.11 C ATOM 1680 CD2 PHE A 105 9.724 6.929 1.701 1.00 63.43 C ATOM 1681 CE1 PHE A 105 8.133 8.890 2.907 1.00 72.42 C ATOM 1682 CE2 PHE A 105 8.413 7.136 1.256 1.00 51.22 C ATOM 1683 CZ PHE A 105 7.617 8.117 1.860 1.00 42.32 C ATOM 0 H PHE A 105 13.493 8.297 4.886 1.00 12.01 H new ATOM 0 HA PHE A 105 10.663 7.485 5.146 1.00 3.03 H new ATOM 0 HB2 PHE A 105 12.277 8.332 2.960 1.00 12.11 H new ATOM 0 HB3 PHE A 105 12.080 6.605 2.737 1.00 12.11 H new ATOM 0 HD1 PHE A 105 9.841 9.280 4.157 1.00 43.11 H new ATOM 0 HD2 PHE A 105 10.339 6.172 1.236 1.00 63.43 H new ATOM 0 HE1 PHE A 105 7.519 9.647 3.373 1.00 72.42 H new ATOM 0 HE2 PHE A 105 8.016 6.540 0.448 1.00 51.22 H new ATOM 0 HZ PHE A 105 6.605 8.277 1.518 1.00 42.32 H new ATOM 1693 N LEU A 106 12.878 5.660 6.079 1.00 60.54 N ATOM 1694 CA LEU A 106 13.298 4.320 6.476 1.00 45.02 C ATOM 1695 C LEU A 106 12.123 3.541 7.060 1.00 22.43 C ATOM 1696 O LEU A 106 12.012 2.331 6.866 1.00 73.22 O ATOM 1697 CB LEU A 106 14.423 4.404 7.512 1.00 52.13 C ATOM 1698 CG LEU A 106 15.223 3.100 7.506 1.00 54.15 C ATOM 1699 CD1 LEU A 106 16.251 3.139 6.374 1.00 14.10 C ATOM 1700 CD2 LEU A 106 15.945 2.940 8.847 1.00 15.13 C ATOM 0 H LEU A 106 13.287 6.416 6.628 1.00 60.54 H new ATOM 0 HA LEU A 106 13.662 3.799 5.590 1.00 45.02 H new ATOM 0 HB2 LEU A 106 15.078 5.245 7.286 1.00 52.13 H new ATOM 0 HB3 LEU A 106 14.006 4.582 8.503 1.00 52.13 H new ATOM 0 HG LEU A 106 14.547 2.258 7.354 1.00 54.15 H new ATOM 0 HD11 LEU A 106 16.822 2.210 6.369 1.00 14.10 H new ATOM 0 HD12 LEU A 106 15.737 3.255 5.420 1.00 14.10 H new ATOM 0 HD13 LEU A 106 16.928 3.980 6.526 1.00 14.10 H new ATOM 0 HD21 LEU A 106 16.516 2.011 8.844 1.00 15.13 H new ATOM 0 HD22 LEU A 106 16.622 3.781 8.999 1.00 15.13 H new ATOM 0 HD23 LEU A 106 15.212 2.914 9.654 1.00 15.13 H new ATOM 1712 N PRO A 107 11.256 4.212 7.770 1.00 52.12 N ATOM 1713 CA PRO A 107 10.068 3.589 8.402 1.00 61.55 C ATOM 1714 C PRO A 107 8.852 3.576 7.475 1.00 0.20 C ATOM 1715 O PRO A 107 7.756 3.187 7.879 1.00 5.13 O ATOM 1716 CB PRO A 107 9.816 4.479 9.621 1.00 53.40 C ATOM 1717 CG PRO A 107 10.447 5.809 9.314 1.00 70.33 C ATOM 1718 CD PRO A 107 11.310 5.647 8.055 1.00 52.05 C ATOM 0 HA PRO A 107 10.236 2.541 8.651 1.00 61.55 H new ATOM 0 HB2 PRO A 107 8.748 4.590 9.807 1.00 53.40 H new ATOM 0 HB3 PRO A 107 10.252 4.040 10.519 1.00 53.40 H new ATOM 0 HG2 PRO A 107 9.680 6.567 9.155 1.00 70.33 H new ATOM 0 HG3 PRO A 107 11.057 6.144 10.153 1.00 70.33 H new ATOM 0 HD2 PRO A 107 10.918 6.234 7.224 1.00 52.05 H new ATOM 0 HD3 PRO A 107 12.333 5.982 8.227 1.00 52.05 H new ATOM 1726 N TYR A 108 9.055 4.005 6.233 1.00 10.41 N ATOM 1727 CA TYR A 108 7.969 4.041 5.258 1.00 62.31 C ATOM 1728 C TYR A 108 8.297 3.162 4.056 1.00 1.02 C ATOM 1729 O TYR A 108 7.411 2.780 3.292 1.00 24.34 O ATOM 1730 CB TYR A 108 7.740 5.480 4.790 1.00 41.23 C ATOM 1731 CG TYR A 108 6.382 5.593 4.139 1.00 41.03 C ATOM 1732 CD1 TYR A 108 6.244 5.361 2.766 1.00 42.05 C ATOM 1733 CD2 TYR A 108 5.262 5.935 4.908 1.00 34.35 C ATOM 1734 CE1 TYR A 108 4.986 5.468 2.161 1.00 35.33 C ATOM 1735 CE2 TYR A 108 4.004 6.043 4.303 1.00 0.41 C ATOM 1736 CZ TYR A 108 3.866 5.810 2.929 1.00 53.04 C ATOM 1737 OH TYR A 108 2.626 5.916 2.332 1.00 71.54 O ATOM 0 H TYR A 108 9.955 4.331 5.879 1.00 10.41 H new ATOM 0 HA TYR A 108 7.065 3.662 5.734 1.00 62.31 H new ATOM 0 HB2 TYR A 108 7.806 6.163 5.637 1.00 41.23 H new ATOM 0 HB3 TYR A 108 8.518 5.771 4.084 1.00 41.23 H new ATOM 0 HD1 TYR A 108 7.108 5.099 2.173 1.00 42.05 H new ATOM 0 HD2 TYR A 108 5.369 6.115 5.967 1.00 34.35 H new ATOM 0 HE1 TYR A 108 4.879 5.287 1.102 1.00 35.33 H new ATOM 0 HE2 TYR A 108 3.140 6.306 4.896 1.00 0.41 H new ATOM 0 HH TYR A 108 2.222 6.778 2.567 1.00 71.54 H new ATOM 1747 N VAL A 109 9.576 2.847 3.894 1.00 55.02 N ATOM 1748 CA VAL A 109 10.014 2.016 2.779 1.00 24.13 C ATOM 1749 C VAL A 109 9.822 0.537 3.099 1.00 30.41 C ATOM 1750 O VAL A 109 10.004 0.107 4.238 1.00 44.14 O ATOM 1751 CB VAL A 109 11.491 2.288 2.481 1.00 41.34 C ATOM 1752 CG1 VAL A 109 11.976 1.361 1.363 1.00 74.14 C ATOM 1753 CG2 VAL A 109 11.658 3.745 2.041 1.00 12.42 C ATOM 0 H VAL A 109 10.324 3.152 4.516 1.00 55.02 H new ATOM 0 HA VAL A 109 9.411 2.265 1.906 1.00 24.13 H new ATOM 0 HB VAL A 109 12.080 2.104 3.380 1.00 41.34 H new ATOM 0 HG11 VAL A 109 13.028 1.560 1.156 1.00 74.14 H new ATOM 0 HG12 VAL A 109 11.857 0.323 1.674 1.00 74.14 H new ATOM 0 HG13 VAL A 109 11.389 1.539 0.462 1.00 74.14 H new ATOM 0 HG21 VAL A 109 12.709 3.943 1.828 1.00 12.42 H new ATOM 0 HG22 VAL A 109 11.066 3.924 1.144 1.00 12.42 H new ATOM 0 HG23 VAL A 109 11.319 4.407 2.838 1.00 12.42 H new ATOM 1763 N ASP A 110 9.468 -0.239 2.080 1.00 75.01 N ATOM 1764 CA ASP A 110 9.271 -1.672 2.256 1.00 42.44 C ATOM 1765 C ASP A 110 10.531 -2.420 1.836 1.00 41.30 C ATOM 1766 O ASP A 110 11.056 -3.248 2.582 1.00 64.43 O ATOM 1767 CB ASP A 110 8.086 -2.148 1.414 1.00 54.21 C ATOM 1768 CG ASP A 110 7.655 -3.541 1.860 1.00 30.31 C ATOM 1769 OD1 ASP A 110 8.424 -4.181 2.557 1.00 35.45 O ATOM 1770 OD2 ASP A 110 6.563 -3.946 1.498 1.00 60.12 O ATOM 0 H ASP A 110 9.313 0.098 1.130 1.00 75.01 H new ATOM 0 HA ASP A 110 9.063 -1.873 3.307 1.00 42.44 H new ATOM 0 HB2 ASP A 110 7.254 -1.451 1.515 1.00 54.21 H new ATOM 0 HB3 ASP A 110 8.362 -2.164 0.360 1.00 54.21 H new ATOM 1775 N LYS A 111 11.016 -2.108 0.638 1.00 64.20 N ATOM 1776 CA LYS A 111 12.222 -2.738 0.119 1.00 42.02 C ATOM 1777 C LYS A 111 13.383 -1.750 0.157 1.00 23.34 C ATOM 1778 O LYS A 111 13.226 -0.581 -0.196 1.00 75.11 O ATOM 1779 CB LYS A 111 11.996 -3.204 -1.321 1.00 0.43 C ATOM 1780 CG LYS A 111 11.699 -4.706 -1.340 1.00 25.12 C ATOM 1781 CD LYS A 111 10.279 -4.953 -0.827 1.00 54.42 C ATOM 1782 CE LYS A 111 9.979 -6.453 -0.858 1.00 22.31 C ATOM 1783 NZ LYS A 111 8.671 -6.710 -0.193 1.00 3.54 N ATOM 0 H LYS A 111 10.592 -1.424 0.011 1.00 64.20 H new ATOM 0 HA LYS A 111 12.460 -3.601 0.741 1.00 42.02 H new ATOM 0 HB2 LYS A 111 11.166 -2.654 -1.765 1.00 0.43 H new ATOM 0 HB3 LYS A 111 12.878 -2.991 -1.925 1.00 0.43 H new ATOM 0 HG2 LYS A 111 11.804 -5.095 -2.353 1.00 25.12 H new ATOM 0 HG3 LYS A 111 12.419 -5.238 -0.718 1.00 25.12 H new ATOM 0 HD2 LYS A 111 10.177 -4.572 0.189 1.00 54.42 H new ATOM 0 HD3 LYS A 111 9.559 -4.415 -1.444 1.00 54.42 H new ATOM 0 HE2 LYS A 111 9.952 -6.808 -1.888 1.00 22.31 H new ATOM 0 HE3 LYS A 111 10.771 -7.004 -0.352 1.00 22.31 H new ATOM 0 HZ1 LYS A 111 8.466 -7.729 -0.213 1.00 3.54 H new ATOM 0 HZ2 LYS A 111 8.714 -6.385 0.794 1.00 3.54 H new ATOM 0 HZ3 LYS A 111 7.919 -6.195 -0.695 1.00 3.54 H new ATOM 1797 N LEU A 112 14.544 -2.222 0.590 1.00 41.53 N ATOM 1798 CA LEU A 112 15.716 -1.360 0.672 1.00 70.10 C ATOM 1799 C LEU A 112 16.909 -2.000 -0.031 1.00 73.23 C ATOM 1800 O LEU A 112 17.341 -3.095 0.330 1.00 1.22 O ATOM 1801 CB LEU A 112 16.061 -1.097 2.140 1.00 34.12 C ATOM 1802 CG LEU A 112 17.304 -0.208 2.231 1.00 10.33 C ATOM 1803 CD1 LEU A 112 16.957 1.205 1.755 1.00 23.42 C ATOM 1804 CD2 LEU A 112 17.783 -0.153 3.685 1.00 21.05 C ATOM 0 H LEU A 112 14.700 -3.185 0.887 1.00 41.53 H new ATOM 0 HA LEU A 112 15.488 -0.417 0.175 1.00 70.10 H new ATOM 0 HB2 LEU A 112 15.221 -0.615 2.639 1.00 34.12 H new ATOM 0 HB3 LEU A 112 16.239 -2.041 2.656 1.00 34.12 H new ATOM 0 HG LEU A 112 18.093 -0.619 1.602 1.00 10.33 H new ATOM 0 HD11 LEU A 112 17.842 1.838 1.820 1.00 23.42 H new ATOM 0 HD12 LEU A 112 16.613 1.167 0.721 1.00 23.42 H new ATOM 0 HD13 LEU A 112 16.169 1.618 2.385 1.00 23.42 H new ATOM 0 HD21 LEU A 112 18.668 0.479 3.753 1.00 21.05 H new ATOM 0 HD22 LEU A 112 16.993 0.260 4.313 1.00 21.05 H new ATOM 0 HD23 LEU A 112 18.029 -1.159 4.025 1.00 21.05 H new ATOM 1816 N TYR A 113 17.441 -1.308 -1.035 1.00 0.42 N ATOM 1817 CA TYR A 113 18.588 -1.819 -1.777 1.00 63.22 C ATOM 1818 C TYR A 113 19.794 -0.904 -1.602 1.00 11.22 C ATOM 1819 O TYR A 113 19.716 0.299 -1.853 1.00 42.12 O ATOM 1820 CB TYR A 113 18.256 -1.932 -3.269 1.00 21.00 C ATOM 1821 CG TYR A 113 16.941 -2.654 -3.471 1.00 71.43 C ATOM 1822 CD1 TYR A 113 16.629 -3.795 -2.719 1.00 61.10 C ATOM 1823 CD2 TYR A 113 16.033 -2.181 -4.428 1.00 62.33 C ATOM 1824 CE1 TYR A 113 15.414 -4.456 -2.922 1.00 74.44 C ATOM 1825 CE2 TYR A 113 14.817 -2.844 -4.630 1.00 52.14 C ATOM 1826 CZ TYR A 113 14.508 -3.981 -3.876 1.00 43.40 C ATOM 1827 OH TYR A 113 13.310 -4.635 -4.075 1.00 21.53 O ATOM 0 H TYR A 113 17.100 -0.400 -1.351 1.00 0.42 H new ATOM 0 HA TYR A 113 18.826 -2.807 -1.383 1.00 63.22 H new ATOM 0 HB2 TYR A 113 18.202 -0.937 -3.711 1.00 21.00 H new ATOM 0 HB3 TYR A 113 19.053 -2.467 -3.785 1.00 21.00 H new ATOM 0 HD1 TYR A 113 17.328 -4.164 -1.982 1.00 61.10 H new ATOM 0 HD2 TYR A 113 16.272 -1.304 -5.011 1.00 62.33 H new ATOM 0 HE1 TYR A 113 15.175 -5.335 -2.341 1.00 74.44 H new ATOM 0 HE2 TYR A 113 14.118 -2.478 -5.367 1.00 52.14 H new ATOM 0 HH TYR A 113 12.798 -4.174 -4.772 1.00 21.53 H new ATOM 1837 N ILE A 114 20.911 -1.486 -1.177 1.00 20.04 N ATOM 1838 CA ILE A 114 22.134 -0.720 -0.978 1.00 64.21 C ATOM 1839 C ILE A 114 23.287 -1.346 -1.759 1.00 64.43 C ATOM 1840 O ILE A 114 23.489 -2.560 -1.721 1.00 53.14 O ATOM 1841 CB ILE A 114 22.490 -0.669 0.509 1.00 32.23 C ATOM 1842 CG1 ILE A 114 21.224 -0.403 1.328 1.00 73.14 C ATOM 1843 CG2 ILE A 114 23.498 0.455 0.751 1.00 43.12 C ATOM 1844 CD1 ILE A 114 20.651 -1.732 1.823 1.00 42.24 C ATOM 0 H ILE A 114 20.994 -2.480 -0.965 1.00 20.04 H new ATOM 0 HA ILE A 114 21.967 0.294 -1.342 1.00 64.21 H new ATOM 0 HB ILE A 114 22.925 -1.621 0.812 1.00 32.23 H new ATOM 0 HG12 ILE A 114 21.454 0.244 2.174 1.00 73.14 H new ATOM 0 HG13 ILE A 114 20.486 0.119 0.719 1.00 73.14 H new ATOM 0 HG21 ILE A 114 23.753 0.493 1.810 1.00 43.12 H new ATOM 0 HG22 ILE A 114 24.399 0.267 0.167 1.00 43.12 H new ATOM 0 HG23 ILE A 114 23.061 1.407 0.448 1.00 43.12 H new ATOM 0 HD11 ILE A 114 19.750 -1.545 2.406 1.00 42.24 H new ATOM 0 HD12 ILE A 114 20.406 -2.363 0.969 1.00 42.24 H new ATOM 0 HD13 ILE A 114 21.389 -2.236 2.447 1.00 42.24 H new ATOM 1856 N THR A 115 24.038 -0.511 -2.469 1.00 54.14 N ATOM 1857 CA THR A 115 25.165 -0.997 -3.255 1.00 61.04 C ATOM 1858 C THR A 115 26.484 -0.527 -2.651 1.00 72.15 C ATOM 1859 O THR A 115 26.813 0.657 -2.703 1.00 22.11 O ATOM 1860 CB THR A 115 25.056 -0.493 -4.696 1.00 0.50 C ATOM 1861 OG1 THR A 115 23.786 -0.843 -5.226 1.00 0.43 O ATOM 1862 CG2 THR A 115 26.156 -1.128 -5.544 1.00 23.33 C ATOM 0 H THR A 115 23.888 0.497 -2.516 1.00 54.14 H new ATOM 0 HA THR A 115 25.142 -2.087 -3.248 1.00 61.04 H new ATOM 0 HB THR A 115 25.168 0.591 -4.710 1.00 0.50 H new ATOM 0 HG1 THR A 115 23.806 -1.773 -5.536 1.00 0.43 H new ATOM 0 HG21 THR A 115 26.078 -0.769 -6.570 1.00 23.33 H new ATOM 0 HG22 THR A 115 27.131 -0.857 -5.138 1.00 23.33 H new ATOM 0 HG23 THR A 115 26.046 -2.212 -5.530 1.00 23.33 H new ATOM 1870 N LYS A 116 27.237 -1.465 -2.083 1.00 12.31 N ATOM 1871 CA LYS A 116 28.523 -1.136 -1.477 1.00 31.24 C ATOM 1872 C LYS A 116 29.609 -1.056 -2.544 1.00 23.24 C ATOM 1873 O LYS A 116 29.895 -2.038 -3.228 1.00 4.02 O ATOM 1874 CB LYS A 116 28.901 -2.198 -0.441 1.00 0.14 C ATOM 1875 CG LYS A 116 30.072 -1.692 0.405 1.00 25.31 C ATOM 1876 CD LYS A 116 30.270 -2.609 1.616 1.00 32.52 C ATOM 1877 CE LYS A 116 30.723 -3.991 1.141 1.00 55.44 C ATOM 1878 NZ LYS A 116 31.807 -3.836 0.129 1.00 14.12 N ATOM 0 H LYS A 116 26.982 -2.451 -2.030 1.00 12.31 H new ATOM 0 HA LYS A 116 28.436 -0.167 -0.986 1.00 31.24 H new ATOM 0 HB2 LYS A 116 28.046 -2.419 0.198 1.00 0.14 H new ATOM 0 HB3 LYS A 116 29.174 -3.128 -0.940 1.00 0.14 H new ATOM 0 HG2 LYS A 116 30.982 -1.665 -0.195 1.00 25.31 H new ATOM 0 HG3 LYS A 116 29.879 -0.672 0.737 1.00 25.31 H new ATOM 0 HD2 LYS A 116 31.013 -2.183 2.290 1.00 32.52 H new ATOM 0 HD3 LYS A 116 29.340 -2.693 2.178 1.00 32.52 H new ATOM 0 HE2 LYS A 116 31.081 -4.579 1.986 1.00 55.44 H new ATOM 0 HE3 LYS A 116 29.882 -4.533 0.709 1.00 55.44 H new ATOM 0 HZ1 LYS A 116 32.374 -4.707 0.091 1.00 14.12 H new ATOM 0 HZ2 LYS A 116 31.387 -3.656 -0.805 1.00 14.12 H new ATOM 0 HZ3 LYS A 116 32.418 -3.037 0.394 1.00 14.12 H new ATOM 1892 N ILE A 117 30.208 0.122 -2.683 1.00 60.22 N ATOM 1893 CA ILE A 117 31.259 0.319 -3.674 1.00 30.32 C ATOM 1894 C ILE A 117 32.618 0.470 -2.995 1.00 3.14 C ATOM 1895 O ILE A 117 32.760 1.220 -2.029 1.00 42.33 O ATOM 1896 CB ILE A 117 30.960 1.564 -4.510 1.00 2.20 C ATOM 1897 CG1 ILE A 117 29.577 1.420 -5.153 1.00 23.14 C ATOM 1898 CG2 ILE A 117 32.021 1.713 -5.603 1.00 53.14 C ATOM 1899 CD1 ILE A 117 29.296 2.631 -6.044 1.00 31.31 C ATOM 0 H ILE A 117 29.986 0.948 -2.127 1.00 60.22 H new ATOM 0 HA ILE A 117 31.289 -0.556 -4.324 1.00 30.32 H new ATOM 0 HB ILE A 117 30.975 2.447 -3.871 1.00 2.20 H new ATOM 0 HG12 ILE A 117 29.533 0.504 -5.742 1.00 23.14 H new ATOM 0 HG13 ILE A 117 28.812 1.339 -4.380 1.00 23.14 H new ATOM 0 HG21 ILE A 117 31.808 2.601 -6.199 1.00 53.14 H new ATOM 0 HG22 ILE A 117 33.005 1.812 -5.144 1.00 53.14 H new ATOM 0 HG23 ILE A 117 32.007 0.833 -6.246 1.00 53.14 H new ATOM 0 HD11 ILE A 117 28.312 2.526 -6.500 1.00 31.31 H new ATOM 0 HD12 ILE A 117 29.322 3.539 -5.442 1.00 31.31 H new ATOM 0 HD13 ILE A 117 30.054 2.691 -6.825 1.00 31.31 H new ATOM 1911 N HIS A 118 33.615 -0.249 -3.507 1.00 52.45 N ATOM 1912 CA HIS A 118 34.960 -0.188 -2.942 1.00 75.43 C ATOM 1913 C HIS A 118 35.781 0.905 -3.620 1.00 10.31 C ATOM 1914 O HIS A 118 36.835 0.636 -4.196 1.00 74.31 O ATOM 1915 CB HIS A 118 35.662 -1.537 -3.116 1.00 20.34 C ATOM 1916 CG HIS A 118 36.822 -1.628 -2.162 1.00 42.21 C ATOM 1917 ND1 HIS A 118 36.654 -1.595 -0.787 1.00 52.40 N ATOM 1918 CD2 HIS A 118 38.174 -1.749 -2.372 1.00 62.52 C ATOM 1919 CE1 HIS A 118 37.874 -1.695 -0.227 1.00 1.22 C ATOM 1920 NE2 HIS A 118 38.836 -1.792 -1.149 1.00 42.23 N ATOM 0 H HIS A 118 33.518 -0.876 -4.306 1.00 52.45 H new ATOM 0 HA HIS A 118 34.875 0.044 -1.880 1.00 75.43 H new ATOM 0 HB2 HIS A 118 34.960 -2.350 -2.930 1.00 20.34 H new ATOM 0 HB3 HIS A 118 36.012 -1.647 -4.142 1.00 20.34 H new ATOM 0 HD2 HIS A 118 38.651 -1.803 -3.340 1.00 62.52 H new ATOM 0 HE1 HIS A 118 38.053 -1.697 0.838 1.00 1.22 H new ATOM 0 HE2 HIS A 118 39.840 -1.879 -0.990 1.00 42.23 H new ATOM 1929 N HIS A 119 35.290 2.138 -3.547 1.00 13.15 N ATOM 1930 CA HIS A 119 35.987 3.265 -4.157 1.00 12.44 C ATOM 1931 C HIS A 119 35.220 4.560 -3.909 1.00 51.51 C ATOM 1932 O HIS A 119 34.075 4.706 -4.339 1.00 72.14 O ATOM 1933 CB HIS A 119 36.137 3.037 -5.665 1.00 20.42 C ATOM 1934 CG HIS A 119 37.594 2.888 -6.015 1.00 72.44 C ATOM 1935 ND1 HIS A 119 38.199 1.649 -6.153 1.00 3.23 N ATOM 1936 CD2 HIS A 119 38.579 3.815 -6.255 1.00 53.14 C ATOM 1937 CE1 HIS A 119 39.492 1.861 -6.463 1.00 35.13 C ATOM 1938 NE2 HIS A 119 39.776 3.163 -6.538 1.00 51.15 N ATOM 0 H HIS A 119 34.419 2.381 -3.075 1.00 13.15 H new ATOM 0 HA HIS A 119 36.976 3.346 -3.705 1.00 12.44 H new ATOM 0 HB2 HIS A 119 35.588 2.144 -5.963 1.00 20.42 H new ATOM 0 HB3 HIS A 119 35.705 3.874 -6.214 1.00 20.42 H new ATOM 0 HD1 HIS A 119 37.747 0.742 -6.040 1.00 3.23 H new ATOM 0 HD2 HIS A 119 38.445 4.886 -6.228 1.00 53.14 H new ATOM 0 HE1 HIS A 119 40.212 1.073 -6.631 1.00 35.13 H new ATOM 1947 N ALA A 120 35.855 5.497 -3.214 1.00 33.04 N ATOM 1948 CA ALA A 120 35.217 6.772 -2.916 1.00 64.22 C ATOM 1949 C ALA A 120 36.237 7.774 -2.387 1.00 75.35 C ATOM 1950 O ALA A 120 37.275 7.393 -1.846 1.00 1.21 O ATOM 1951 CB ALA A 120 34.112 6.571 -1.880 1.00 62.11 C ATOM 0 H ALA A 120 36.803 5.399 -2.850 1.00 33.04 H new ATOM 0 HA ALA A 120 34.786 7.165 -3.837 1.00 64.22 H new ATOM 0 HB1 ALA A 120 33.639 7.529 -1.662 1.00 62.11 H new ATOM 0 HB2 ALA A 120 33.367 5.879 -2.273 1.00 62.11 H new ATOM 0 HB3 ALA A 120 34.541 6.161 -0.965 1.00 62.11 H new ATOM 1957 N PHE A 121 35.932 9.056 -2.550 1.00 74.14 N ATOM 1958 CA PHE A 121 36.827 10.110 -2.088 1.00 43.45 C ATOM 1959 C PHE A 121 36.033 11.337 -1.651 1.00 21.22 C ATOM 1960 O PHE A 121 34.917 11.563 -2.119 1.00 12.14 O ATOM 1961 CB PHE A 121 37.803 10.492 -3.202 1.00 44.33 C ATOM 1962 CG PHE A 121 38.933 9.492 -3.241 1.00 3.41 C ATOM 1963 CD1 PHE A 121 39.914 9.505 -2.241 1.00 64.30 C ATOM 1964 CD2 PHE A 121 38.998 8.550 -4.274 1.00 44.32 C ATOM 1965 CE1 PHE A 121 40.960 8.575 -2.276 1.00 70.21 C ATOM 1966 CE2 PHE A 121 40.044 7.620 -4.309 1.00 13.43 C ATOM 1967 CZ PHE A 121 41.026 7.633 -3.310 1.00 34.32 C ATOM 0 H PHE A 121 35.077 9.389 -2.996 1.00 74.14 H new ATOM 0 HA PHE A 121 37.387 9.736 -1.231 1.00 43.45 H new ATOM 0 HB2 PHE A 121 37.287 10.512 -4.162 1.00 44.33 H new ATOM 0 HB3 PHE A 121 38.195 11.494 -3.030 1.00 44.33 H new ATOM 0 HD1 PHE A 121 39.863 10.232 -1.444 1.00 64.30 H new ATOM 0 HD2 PHE A 121 38.241 8.540 -5.044 1.00 44.32 H new ATOM 0 HE1 PHE A 121 41.716 8.584 -1.505 1.00 70.21 H new ATOM 0 HE2 PHE A 121 40.094 6.893 -5.106 1.00 13.43 H new ATOM 0 HZ PHE A 121 41.834 6.917 -3.337 1.00 34.32 H new ATOM 1977 N GLU A 122 36.617 12.117 -0.745 1.00 10.43 N ATOM 1978 CA GLU A 122 35.965 13.321 -0.233 1.00 3.35 C ATOM 1979 C GLU A 122 34.889 13.815 -1.194 1.00 0.32 C ATOM 1980 O GLU A 122 35.140 13.992 -2.386 1.00 13.11 O ATOM 1981 CB GLU A 122 37.003 14.424 -0.023 1.00 42.32 C ATOM 1982 CG GLU A 122 38.232 14.138 -0.887 1.00 22.55 C ATOM 1983 CD GLU A 122 39.063 13.024 -0.259 1.00 34.14 C ATOM 1984 OE1 GLU A 122 38.854 12.744 0.910 1.00 21.12 O ATOM 1985 OE2 GLU A 122 39.894 12.466 -0.956 1.00 62.23 O ATOM 0 H GLU A 122 37.540 11.938 -0.350 1.00 10.43 H new ATOM 0 HA GLU A 122 35.493 13.071 0.717 1.00 3.35 H new ATOM 0 HB2 GLU A 122 36.578 15.393 -0.285 1.00 42.32 H new ATOM 0 HB3 GLU A 122 37.288 14.475 1.028 1.00 42.32 H new ATOM 0 HG2 GLU A 122 37.922 13.849 -1.891 1.00 22.55 H new ATOM 0 HG3 GLU A 122 38.835 15.041 -0.987 1.00 22.55 H new ATOM 1992 N GLY A 123 33.689 14.036 -0.666 1.00 44.54 N ATOM 1993 CA GLY A 123 32.579 14.510 -1.484 1.00 41.24 C ATOM 1994 C GLY A 123 31.705 15.488 -0.706 1.00 14.30 C ATOM 1995 O GLY A 123 32.172 16.540 -0.268 1.00 44.40 O ATOM 0 H GLY A 123 33.462 13.895 0.318 1.00 44.54 H new ATOM 0 HA2 GLY A 123 32.965 14.995 -2.381 1.00 41.24 H new ATOM 0 HA3 GLY A 123 31.978 13.663 -1.814 1.00 41.24 H new ATOM 1999 N ASP A 124 30.431 15.139 -0.543 1.00 32.23 N ATOM 2000 CA ASP A 124 29.503 16.002 0.180 1.00 71.14 C ATOM 2001 C ASP A 124 28.698 15.216 1.215 1.00 2.20 C ATOM 2002 O ASP A 124 28.179 15.793 2.170 1.00 31.23 O ATOM 2003 CB ASP A 124 28.544 16.673 -0.806 1.00 34.21 C ATOM 2004 CG ASP A 124 29.306 17.668 -1.674 1.00 24.13 C ATOM 2005 OD1 ASP A 124 30.497 17.475 -1.856 1.00 32.11 O ATOM 2006 OD2 ASP A 124 28.687 18.609 -2.145 1.00 74.32 O ATOM 0 H ASP A 124 30.022 14.275 -0.898 1.00 32.23 H new ATOM 0 HA ASP A 124 30.089 16.757 0.704 1.00 71.14 H new ATOM 0 HB2 ASP A 124 28.068 15.920 -1.433 1.00 34.21 H new ATOM 0 HB3 ASP A 124 27.749 17.185 -0.263 1.00 34.21 H new ATOM 2011 N THR A 125 28.591 13.903 1.025 1.00 1.23 N ATOM 2012 CA THR A 125 27.836 13.072 1.961 1.00 75.24 C ATOM 2013 C THR A 125 28.650 11.852 2.389 1.00 32.14 C ATOM 2014 O THR A 125 28.886 10.931 1.594 1.00 41.22 O ATOM 2015 CB THR A 125 26.524 12.624 1.317 1.00 10.02 C ATOM 2016 OG1 THR A 125 26.018 13.676 0.507 1.00 62.05 O ATOM 2017 CG2 THR A 125 25.508 12.285 2.410 1.00 0.11 C ATOM 0 H THR A 125 29.010 13.397 0.245 1.00 1.23 H new ATOM 0 HA THR A 125 27.619 13.666 2.849 1.00 75.24 H new ATOM 0 HB THR A 125 26.700 11.741 0.702 1.00 10.02 H new ATOM 0 HG1 THR A 125 25.173 14.001 0.883 1.00 62.05 H new ATOM 0 HG21 THR A 125 24.572 11.966 1.951 1.00 0.11 H new ATOM 0 HG22 THR A 125 25.899 11.481 3.034 1.00 0.11 H new ATOM 0 HG23 THR A 125 25.328 13.167 3.025 1.00 0.11 H new ATOM 2025 N PHE A 126 29.081 11.864 3.653 1.00 31.40 N ATOM 2026 CA PHE A 126 29.880 10.773 4.202 1.00 41.32 C ATOM 2027 C PHE A 126 29.225 10.176 5.447 1.00 1.14 C ATOM 2028 O PHE A 126 28.798 10.899 6.346 1.00 13.12 O ATOM 2029 CB PHE A 126 31.270 11.294 4.572 1.00 14.30 C ATOM 2030 CG PHE A 126 31.152 12.250 5.735 1.00 65.33 C ATOM 2031 CD1 PHE A 126 31.199 11.766 7.047 1.00 15.34 C ATOM 2032 CD2 PHE A 126 30.993 13.620 5.498 1.00 4.14 C ATOM 2033 CE1 PHE A 126 31.088 12.654 8.124 1.00 15.10 C ATOM 2034 CE2 PHE A 126 30.881 14.508 6.574 1.00 21.21 C ATOM 2035 CZ PHE A 126 30.929 14.025 7.887 1.00 55.00 C ATOM 0 H PHE A 126 28.889 12.618 4.313 1.00 31.40 H new ATOM 0 HA PHE A 126 29.955 9.995 3.443 1.00 41.32 H new ATOM 0 HB2 PHE A 126 31.924 10.463 4.835 1.00 14.30 H new ATOM 0 HB3 PHE A 126 31.722 11.797 3.717 1.00 14.30 H new ATOM 0 HD1 PHE A 126 31.321 10.708 7.229 1.00 15.34 H new ATOM 0 HD2 PHE A 126 30.957 13.992 4.485 1.00 4.14 H new ATOM 0 HE1 PHE A 126 31.125 12.282 9.137 1.00 15.10 H new ATOM 0 HE2 PHE A 126 30.758 15.565 6.391 1.00 21.21 H new ATOM 0 HZ PHE A 126 30.843 14.710 8.718 1.00 55.00 H new ATOM 2045 N PHE A 127 29.169 8.849 5.493 1.00 1.31 N ATOM 2046 CA PHE A 127 28.587 8.143 6.632 1.00 21.52 C ATOM 2047 C PHE A 127 28.976 6.667 6.578 1.00 31.33 C ATOM 2048 O PHE A 127 29.213 6.120 5.501 1.00 63.13 O ATOM 2049 CB PHE A 127 27.061 8.277 6.624 1.00 23.15 C ATOM 2050 CG PHE A 127 26.660 9.595 7.247 1.00 53.02 C ATOM 2051 CD1 PHE A 127 27.019 9.890 8.568 1.00 41.23 C ATOM 2052 CD2 PHE A 127 25.921 10.520 6.501 1.00 41.32 C ATOM 2053 CE1 PHE A 127 26.639 11.110 9.141 1.00 63.14 C ATOM 2054 CE2 PHE A 127 25.541 11.739 7.074 1.00 71.12 C ATOM 2055 CZ PHE A 127 25.900 12.034 8.394 1.00 34.00 C ATOM 0 H PHE A 127 29.520 8.239 4.755 1.00 1.31 H new ATOM 0 HA PHE A 127 28.971 8.586 7.551 1.00 21.52 H new ATOM 0 HB2 PHE A 127 26.687 8.219 5.602 1.00 23.15 H new ATOM 0 HB3 PHE A 127 26.611 7.452 7.176 1.00 23.15 H new ATOM 0 HD1 PHE A 127 27.589 9.177 9.145 1.00 41.23 H new ATOM 0 HD2 PHE A 127 25.644 10.293 5.482 1.00 41.32 H new ATOM 0 HE1 PHE A 127 26.916 11.338 10.160 1.00 63.14 H new ATOM 0 HE2 PHE A 127 24.971 12.452 6.497 1.00 71.12 H new ATOM 0 HZ PHE A 127 25.607 12.975 8.836 1.00 34.00 H new ATOM 2065 N PRO A 128 29.050 6.021 7.710 1.00 24.35 N ATOM 2066 CA PRO A 128 29.425 4.582 7.785 1.00 32.11 C ATOM 2067 C PRO A 128 28.329 3.678 7.226 1.00 23.10 C ATOM 2068 O PRO A 128 27.330 4.160 6.692 1.00 41.05 O ATOM 2069 CB PRO A 128 29.645 4.330 9.279 1.00 12.51 C ATOM 2070 CG PRO A 128 28.886 5.402 9.991 1.00 25.31 C ATOM 2071 CD PRO A 128 28.780 6.593 9.036 1.00 34.43 C ATOM 0 HA PRO A 128 30.308 4.358 7.187 1.00 32.11 H new ATOM 0 HB2 PRO A 128 29.286 3.341 9.565 1.00 12.51 H new ATOM 0 HB3 PRO A 128 30.705 4.369 9.530 1.00 12.51 H new ATOM 0 HG2 PRO A 128 27.895 5.048 10.275 1.00 25.31 H new ATOM 0 HG3 PRO A 128 29.397 5.690 10.910 1.00 25.31 H new ATOM 0 HD2 PRO A 128 27.791 7.050 9.078 1.00 34.43 H new ATOM 0 HD3 PRO A 128 29.501 7.370 9.288 1.00 34.43 H new ATOM 2079 N GLU A 129 28.524 2.369 7.347 1.00 33.12 N ATOM 2080 CA GLU A 129 27.543 1.414 6.842 1.00 62.21 C ATOM 2081 C GLU A 129 27.225 0.357 7.895 1.00 3.15 C ATOM 2082 O GLU A 129 27.923 0.241 8.903 1.00 13.11 O ATOM 2083 CB GLU A 129 28.079 0.732 5.582 1.00 42.23 C ATOM 2084 CG GLU A 129 29.551 0.370 5.784 1.00 13.13 C ATOM 2085 CD GLU A 129 29.974 -0.683 4.765 1.00 34.14 C ATOM 2086 OE1 GLU A 129 29.494 -1.800 4.863 1.00 22.24 O ATOM 2087 OE2 GLU A 129 30.772 -0.356 3.902 1.00 1.12 O ATOM 0 H GLU A 129 29.343 1.948 7.785 1.00 33.12 H new ATOM 0 HA GLU A 129 26.629 1.958 6.603 1.00 62.21 H new ATOM 0 HB2 GLU A 129 27.499 -0.166 5.367 1.00 42.23 H new ATOM 0 HB3 GLU A 129 27.971 1.395 4.723 1.00 42.23 H new ATOM 0 HG2 GLU A 129 30.171 1.260 5.678 1.00 13.13 H new ATOM 0 HG3 GLU A 129 29.706 -0.007 6.795 1.00 13.13 H new ATOM 2094 N MET A 130 26.169 -0.411 7.651 1.00 41.44 N ATOM 2095 CA MET A 130 25.766 -1.458 8.583 1.00 3.04 C ATOM 2096 C MET A 130 25.943 -0.991 10.024 1.00 64.11 C ATOM 2097 O MET A 130 26.726 -1.566 10.781 1.00 51.35 O ATOM 2098 CB MET A 130 26.604 -2.717 8.346 1.00 13.13 C ATOM 2099 CG MET A 130 26.113 -3.428 7.084 1.00 62.31 C ATOM 2100 SD MET A 130 27.387 -4.576 6.504 1.00 63.25 S ATOM 2101 CE MET A 130 27.242 -5.778 7.850 1.00 1.04 C ATOM 0 H MET A 130 25.580 -0.330 6.822 1.00 41.44 H new ATOM 0 HA MET A 130 24.713 -1.684 8.414 1.00 3.04 H new ATOM 0 HB2 MET A 130 27.656 -2.452 8.241 1.00 13.13 H new ATOM 0 HB3 MET A 130 26.528 -3.384 9.205 1.00 13.13 H new ATOM 0 HG2 MET A 130 25.190 -3.968 7.294 1.00 62.31 H new ATOM 0 HG3 MET A 130 25.886 -2.698 6.307 1.00 62.31 H new ATOM 0 HE1 MET A 130 27.759 -6.697 7.574 1.00 1.04 H new ATOM 0 HE2 MET A 130 27.690 -5.367 8.755 1.00 1.04 H new ATOM 0 HE3 MET A 130 26.189 -5.994 8.033 1.00 1.04 H new ATOM 2111 N ASP A 131 25.212 0.055 10.397 1.00 51.32 N ATOM 2112 CA ASP A 131 25.297 0.591 11.750 1.00 1.32 C ATOM 2113 C ASP A 131 23.925 0.590 12.417 1.00 24.45 C ATOM 2114 O ASP A 131 23.099 1.466 12.161 1.00 32.33 O ATOM 2115 CB ASP A 131 25.845 2.019 11.713 1.00 13.01 C ATOM 2116 CG ASP A 131 25.988 2.559 13.131 1.00 64.14 C ATOM 2117 OD1 ASP A 131 26.856 2.080 13.842 1.00 31.02 O ATOM 2118 OD2 ASP A 131 25.228 3.445 13.486 1.00 41.11 O ATOM 0 H ASP A 131 24.559 0.545 9.786 1.00 51.32 H new ATOM 0 HA ASP A 131 25.970 -0.043 12.328 1.00 1.32 H new ATOM 0 HB2 ASP A 131 26.812 2.033 11.210 1.00 13.01 H new ATOM 0 HB3 ASP A 131 25.177 2.659 11.137 1.00 13.01 H new ATOM 2123 N MET A 132 23.691 -0.396 13.275 1.00 31.34 N ATOM 2124 CA MET A 132 22.416 -0.501 13.975 1.00 32.23 C ATOM 2125 C MET A 132 21.253 -0.417 12.991 1.00 60.53 C ATOM 2126 O MET A 132 20.180 0.084 13.326 1.00 12.00 O ATOM 2127 CB MET A 132 22.296 0.619 15.010 1.00 4.45 C ATOM 2128 CG MET A 132 23.650 0.837 15.686 1.00 53.25 C ATOM 2129 SD MET A 132 23.431 1.866 17.159 1.00 21.30 S ATOM 2130 CE MET A 132 23.714 0.568 18.387 1.00 43.04 C ATOM 0 H MET A 132 24.362 -1.130 13.502 1.00 31.34 H new ATOM 0 HA MET A 132 22.378 -1.467 14.479 1.00 32.23 H new ATOM 0 HB2 MET A 132 21.966 1.539 14.529 1.00 4.45 H new ATOM 0 HB3 MET A 132 21.543 0.361 15.755 1.00 4.45 H new ATOM 0 HG2 MET A 132 24.089 -0.122 15.961 1.00 53.25 H new ATOM 0 HG3 MET A 132 24.341 1.317 14.993 1.00 53.25 H new ATOM 0 HE1 MET A 132 23.625 0.989 19.388 1.00 43.04 H new ATOM 0 HE2 MET A 132 22.974 -0.222 18.259 1.00 43.04 H new ATOM 0 HE3 MET A 132 24.714 0.154 18.255 1.00 43.04 H new ATOM 2140 N THR A 133 21.475 -0.911 11.777 1.00 14.43 N ATOM 2141 CA THR A 133 20.438 -0.888 10.751 1.00 33.43 C ATOM 2142 C THR A 133 19.226 -1.701 11.194 1.00 4.12 C ATOM 2143 O THR A 133 18.093 -1.227 11.128 1.00 23.22 O ATOM 2144 CB THR A 133 20.985 -1.452 9.435 1.00 55.11 C ATOM 2145 OG1 THR A 133 19.910 -1.666 8.531 1.00 22.40 O ATOM 2146 CG2 THR A 133 21.704 -2.779 9.699 1.00 5.51 C ATOM 0 H THR A 133 22.357 -1.329 11.481 1.00 14.43 H new ATOM 0 HA THR A 133 20.130 0.146 10.599 1.00 33.43 H new ATOM 0 HB THR A 133 21.690 -0.742 9.003 1.00 55.11 H new ATOM 0 HG1 THR A 133 20.264 -1.793 7.626 1.00 22.40 H new ATOM 0 HG21 THR A 133 22.091 -3.176 8.761 1.00 5.51 H new ATOM 0 HG22 THR A 133 22.530 -2.614 10.391 1.00 5.51 H new ATOM 0 HG23 THR A 133 21.003 -3.492 10.133 1.00 5.51 H new ATOM 2154 N ASN A 134 19.474 -2.925 11.650 1.00 43.24 N ATOM 2155 CA ASN A 134 18.394 -3.792 12.107 1.00 33.32 C ATOM 2156 C ASN A 134 17.662 -4.416 10.923 1.00 73.32 C ATOM 2157 O ASN A 134 16.813 -5.291 11.098 1.00 4.53 O ATOM 2158 CB ASN A 134 17.404 -2.989 12.952 1.00 51.41 C ATOM 2159 CG ASN A 134 16.630 -3.923 13.874 1.00 24.22 C ATOM 2160 OD1 ASN A 134 17.004 -5.084 14.039 1.00 22.22 O ATOM 2161 ND2 ASN A 134 15.568 -3.483 14.491 1.00 33.11 N ATOM 0 H ASN A 134 20.405 -3.336 11.713 1.00 43.24 H new ATOM 0 HA ASN A 134 18.828 -4.590 12.710 1.00 33.32 H new ATOM 0 HB2 ASN A 134 17.937 -2.243 13.541 1.00 51.41 H new ATOM 0 HB3 ASN A 134 16.713 -2.450 12.304 1.00 51.41 H new ATOM 0 HD21 ASN A 134 15.046 -4.101 15.112 1.00 33.11 H new ATOM 0 HD22 ASN A 134 15.260 -2.521 14.353 1.00 33.11 H new ATOM 2168 N TRP A 135 17.992 -3.962 9.719 1.00 55.20 N ATOM 2169 CA TRP A 135 17.353 -4.486 8.518 1.00 43.02 C ATOM 2170 C TRP A 135 17.789 -5.927 8.260 1.00 61.01 C ATOM 2171 O TRP A 135 18.833 -6.368 8.743 1.00 51.02 O ATOM 2172 CB TRP A 135 17.706 -3.609 7.314 1.00 0.13 C ATOM 2173 CG TRP A 135 16.790 -2.429 7.280 1.00 45.10 C ATOM 2174 CD1 TRP A 135 16.896 -1.340 8.076 1.00 32.50 C ATOM 2175 CD2 TRP A 135 15.632 -2.200 6.426 1.00 0.32 C ATOM 2176 NE1 TRP A 135 15.879 -0.457 7.763 1.00 71.12 N ATOM 2177 CE2 TRP A 135 15.073 -0.942 6.752 1.00 4.15 C ATOM 2178 CE3 TRP A 135 15.019 -2.954 5.409 1.00 63.53 C ATOM 2179 CZ2 TRP A 135 13.945 -0.449 6.093 1.00 72.02 C ATOM 2180 CZ3 TRP A 135 13.885 -2.462 4.743 1.00 44.02 C ATOM 2181 CH2 TRP A 135 13.349 -1.212 5.085 1.00 34.53 C ATOM 0 H TRP A 135 18.691 -3.239 9.549 1.00 55.20 H new ATOM 0 HA TRP A 135 16.273 -4.473 8.667 1.00 43.02 H new ATOM 0 HB2 TRP A 135 18.742 -3.278 7.381 1.00 0.13 H new ATOM 0 HB3 TRP A 135 17.614 -4.183 6.392 1.00 0.13 H new ATOM 0 HD1 TRP A 135 17.651 -1.186 8.832 1.00 32.50 H new ATOM 0 HE1 TRP A 135 15.741 0.443 8.223 1.00 71.12 H new ATOM 0 HE3 TRP A 135 15.423 -3.918 5.138 1.00 63.53 H new ATOM 0 HZ2 TRP A 135 13.536 0.514 6.360 1.00 72.02 H new ATOM 0 HZ3 TRP A 135 13.423 -3.049 3.963 1.00 44.02 H new ATOM 0 HH2 TRP A 135 12.476 -0.839 4.570 1.00 34.53 H new ATOM 2192 N LYS A 136 16.975 -6.659 7.503 1.00 40.33 N ATOM 2193 CA LYS A 136 17.275 -8.055 7.192 1.00 53.40 C ATOM 2194 C LYS A 136 17.576 -8.223 5.704 1.00 44.42 C ATOM 2195 O LYS A 136 16.892 -7.655 4.853 1.00 62.43 O ATOM 2196 CB LYS A 136 16.080 -8.935 7.586 1.00 31.25 C ATOM 2197 CG LYS A 136 16.294 -10.384 7.123 1.00 0.31 C ATOM 2198 CD LYS A 136 17.239 -11.107 8.087 1.00 5.44 C ATOM 2199 CE LYS A 136 17.739 -12.397 7.433 1.00 33.42 C ATOM 2200 NZ LYS A 136 18.158 -13.361 8.489 1.00 35.33 N ATOM 0 H LYS A 136 16.107 -6.311 7.095 1.00 40.33 H new ATOM 0 HA LYS A 136 18.156 -8.360 7.757 1.00 53.40 H new ATOM 0 HB2 LYS A 136 15.945 -8.910 8.667 1.00 31.25 H new ATOM 0 HB3 LYS A 136 15.168 -8.537 7.142 1.00 31.25 H new ATOM 0 HG2 LYS A 136 15.338 -10.905 7.078 1.00 0.31 H new ATOM 0 HG3 LYS A 136 16.710 -10.395 6.116 1.00 0.31 H new ATOM 0 HD2 LYS A 136 18.082 -10.463 8.339 1.00 5.44 H new ATOM 0 HD3 LYS A 136 16.722 -11.335 9.019 1.00 5.44 H new ATOM 0 HE2 LYS A 136 16.952 -12.834 6.818 1.00 33.42 H new ATOM 0 HE3 LYS A 136 18.577 -12.180 6.771 1.00 33.42 H new ATOM 0 HZ1 LYS A 136 18.498 -14.237 8.044 1.00 35.33 H new ATOM 0 HZ2 LYS A 136 18.922 -12.943 9.058 1.00 35.33 H new ATOM 0 HZ3 LYS A 136 17.347 -13.577 9.104 1.00 35.33 H new ATOM 2214 N GLU A 137 18.600 -9.016 5.400 1.00 5.30 N ATOM 2215 CA GLU A 137 18.980 -9.263 4.012 1.00 33.52 C ATOM 2216 C GLU A 137 18.316 -10.538 3.504 1.00 52.34 C ATOM 2217 O GLU A 137 18.273 -11.548 4.206 1.00 5.42 O ATOM 2218 CB GLU A 137 20.502 -9.391 3.898 1.00 53.34 C ATOM 2219 CG GLU A 137 20.996 -10.487 4.845 1.00 64.45 C ATOM 2220 CD GLU A 137 22.520 -10.545 4.828 1.00 44.04 C ATOM 2221 OE1 GLU A 137 23.131 -9.759 5.535 1.00 45.41 O ATOM 2222 OE2 GLU A 137 23.055 -11.374 4.111 1.00 55.03 O ATOM 0 H GLU A 137 19.178 -9.495 6.090 1.00 5.30 H new ATOM 0 HA GLU A 137 18.646 -8.422 3.404 1.00 33.52 H new ATOM 0 HB2 GLU A 137 20.781 -9.630 2.872 1.00 53.34 H new ATOM 0 HB3 GLU A 137 20.977 -8.441 4.145 1.00 53.34 H new ATOM 0 HG2 GLU A 137 20.643 -10.290 5.857 1.00 64.45 H new ATOM 0 HG3 GLU A 137 20.584 -11.451 4.545 1.00 64.45 H new ATOM 2229 N VAL A 138 17.789 -10.484 2.284 1.00 14.11 N ATOM 2230 CA VAL A 138 17.118 -11.643 1.704 1.00 30.12 C ATOM 2231 C VAL A 138 17.940 -12.238 0.564 1.00 1.32 C ATOM 2232 O VAL A 138 17.763 -13.402 0.204 1.00 42.24 O ATOM 2233 CB VAL A 138 15.740 -11.235 1.185 1.00 74.31 C ATOM 2234 CG1 VAL A 138 14.746 -11.188 2.348 1.00 12.45 C ATOM 2235 CG2 VAL A 138 15.830 -9.850 0.539 1.00 31.23 C ATOM 0 H VAL A 138 17.813 -9.660 1.684 1.00 14.11 H new ATOM 0 HA VAL A 138 17.009 -12.400 2.481 1.00 30.12 H new ATOM 0 HB VAL A 138 15.401 -11.963 0.447 1.00 74.31 H new ATOM 0 HG11 VAL A 138 13.764 -10.897 1.976 1.00 12.45 H new ATOM 0 HG12 VAL A 138 14.681 -12.173 2.811 1.00 12.45 H new ATOM 0 HG13 VAL A 138 15.084 -10.461 3.087 1.00 12.45 H new ATOM 0 HG21 VAL A 138 14.848 -9.557 0.168 1.00 31.23 H new ATOM 0 HG22 VAL A 138 16.170 -9.125 1.279 1.00 31.23 H new ATOM 0 HG23 VAL A 138 16.537 -9.881 -0.290 1.00 31.23 H new ATOM 2245 N PHE A 139 18.837 -11.438 -0.003 1.00 51.42 N ATOM 2246 CA PHE A 139 19.673 -11.907 -1.102 1.00 20.52 C ATOM 2247 C PHE A 139 20.830 -10.942 -1.346 1.00 73.30 C ATOM 2248 O PHE A 139 20.736 -9.756 -1.030 1.00 30.51 O ATOM 2249 CB PHE A 139 18.836 -12.036 -2.377 1.00 54.24 C ATOM 2250 CG PHE A 139 19.635 -12.758 -3.435 1.00 11.15 C ATOM 2251 CD1 PHE A 139 20.487 -12.039 -4.282 1.00 43.03 C ATOM 2252 CD2 PHE A 139 19.524 -14.147 -3.569 1.00 2.34 C ATOM 2253 CE1 PHE A 139 21.228 -12.709 -5.263 1.00 13.40 C ATOM 2254 CE2 PHE A 139 20.265 -14.817 -4.550 1.00 21.01 C ATOM 2255 CZ PHE A 139 21.117 -14.098 -5.397 1.00 40.51 C ATOM 0 H PHE A 139 19.003 -10.471 0.277 1.00 51.42 H new ATOM 0 HA PHE A 139 20.079 -12.882 -0.834 1.00 20.52 H new ATOM 0 HB2 PHE A 139 17.916 -12.581 -2.167 1.00 54.24 H new ATOM 0 HB3 PHE A 139 18.547 -11.048 -2.736 1.00 54.24 H new ATOM 0 HD1 PHE A 139 20.573 -10.967 -4.179 1.00 43.03 H new ATOM 0 HD2 PHE A 139 18.867 -14.702 -2.916 1.00 2.34 H new ATOM 0 HE1 PHE A 139 21.885 -12.154 -5.916 1.00 13.40 H new ATOM 0 HE2 PHE A 139 20.179 -15.889 -4.653 1.00 21.01 H new ATOM 0 HZ PHE A 139 21.689 -14.615 -6.154 1.00 40.51 H new ATOM 2265 N VAL A 140 21.920 -11.458 -1.906 1.00 31.04 N ATOM 2266 CA VAL A 140 23.087 -10.628 -2.182 1.00 51.04 C ATOM 2267 C VAL A 140 23.678 -10.958 -3.551 1.00 31.40 C ATOM 2268 O VAL A 140 23.850 -12.126 -3.900 1.00 50.21 O ATOM 2269 CB VAL A 140 24.147 -10.846 -1.103 1.00 54.12 C ATOM 2270 CG1 VAL A 140 25.181 -9.721 -1.167 1.00 12.00 C ATOM 2271 CG2 VAL A 140 23.479 -10.844 0.274 1.00 15.42 C ATOM 0 H VAL A 140 22.019 -12.437 -2.175 1.00 31.04 H new ATOM 0 HA VAL A 140 22.772 -9.585 -2.181 1.00 51.04 H new ATOM 0 HB VAL A 140 24.641 -11.803 -1.268 1.00 54.12 H new ATOM 0 HG11 VAL A 140 25.937 -9.877 -0.397 1.00 12.00 H new ATOM 0 HG12 VAL A 140 25.657 -9.720 -2.148 1.00 12.00 H new ATOM 0 HG13 VAL A 140 24.687 -8.763 -1.002 1.00 12.00 H new ATOM 0 HG21 VAL A 140 24.234 -10.999 1.045 1.00 15.42 H new ATOM 0 HG22 VAL A 140 22.985 -9.886 0.437 1.00 15.42 H new ATOM 0 HG23 VAL A 140 22.741 -11.645 0.322 1.00 15.42 H new ATOM 2281 N GLU A 141 23.994 -9.917 -4.318 1.00 74.12 N ATOM 2282 CA GLU A 141 24.573 -10.098 -5.645 1.00 24.31 C ATOM 2283 C GLU A 141 25.869 -9.299 -5.769 1.00 61.54 C ATOM 2284 O GLU A 141 25.879 -8.084 -5.575 1.00 40.43 O ATOM 2285 CB GLU A 141 23.578 -9.639 -6.716 1.00 33.23 C ATOM 2286 CG GLU A 141 24.066 -10.083 -8.095 1.00 72.24 C ATOM 2287 CD GLU A 141 23.063 -9.661 -9.163 1.00 44.23 C ATOM 2288 OE1 GLU A 141 22.901 -8.468 -9.359 1.00 73.23 O ATOM 2289 OE2 GLU A 141 22.470 -10.538 -9.771 1.00 41.24 O ATOM 0 H GLU A 141 23.859 -8.944 -4.044 1.00 74.12 H new ATOM 0 HA GLU A 141 24.794 -11.156 -5.789 1.00 24.31 H new ATOM 0 HB2 GLU A 141 22.593 -10.060 -6.515 1.00 33.23 H new ATOM 0 HB3 GLU A 141 23.473 -8.554 -6.688 1.00 33.23 H new ATOM 0 HG2 GLU A 141 25.040 -9.642 -8.305 1.00 72.24 H new ATOM 0 HG3 GLU A 141 24.196 -11.165 -8.113 1.00 72.24 H new ATOM 2296 N LYS A 142 26.961 -9.989 -6.085 1.00 74.41 N ATOM 2297 CA LYS A 142 28.257 -9.329 -6.221 1.00 54.13 C ATOM 2298 C LYS A 142 28.460 -8.821 -7.646 1.00 74.11 C ATOM 2299 O LYS A 142 27.767 -9.246 -8.570 1.00 24.30 O ATOM 2300 CB LYS A 142 29.381 -10.306 -5.858 1.00 51.31 C ATOM 2301 CG LYS A 142 29.488 -10.433 -4.333 1.00 43.04 C ATOM 2302 CD LYS A 142 28.528 -11.516 -3.835 1.00 54.43 C ATOM 2303 CE LYS A 142 28.344 -11.374 -2.323 1.00 43.53 C ATOM 2304 NZ LYS A 142 27.297 -12.326 -1.856 1.00 1.53 N ATOM 0 H LYS A 142 26.976 -10.995 -6.250 1.00 74.41 H new ATOM 0 HA LYS A 142 28.281 -8.477 -5.541 1.00 54.13 H new ATOM 0 HB2 LYS A 142 29.183 -11.282 -6.300 1.00 51.31 H new ATOM 0 HB3 LYS A 142 30.327 -9.955 -6.270 1.00 51.31 H new ATOM 0 HG2 LYS A 142 30.511 -10.683 -4.050 1.00 43.04 H new ATOM 0 HG3 LYS A 142 29.251 -9.479 -3.862 1.00 43.04 H new ATOM 0 HD2 LYS A 142 27.566 -11.425 -4.340 1.00 54.43 H new ATOM 0 HD3 LYS A 142 28.921 -12.504 -4.074 1.00 54.43 H new ATOM 0 HE2 LYS A 142 29.286 -11.573 -1.811 1.00 43.53 H new ATOM 0 HE3 LYS A 142 28.057 -10.352 -2.076 1.00 43.53 H new ATOM 0 HZ1 LYS A 142 27.088 -12.148 -0.853 1.00 1.53 H new ATOM 0 HZ2 LYS A 142 26.432 -12.194 -2.419 1.00 1.53 H new ATOM 0 HZ3 LYS A 142 27.639 -13.302 -1.970 1.00 1.53 H new ATOM 2318 N GLY A 143 29.410 -7.905 -7.815 1.00 52.12 N ATOM 2319 CA GLY A 143 29.687 -7.344 -9.132 1.00 62.34 C ATOM 2320 C GLY A 143 31.104 -7.675 -9.587 1.00 64.14 C ATOM 2321 O GLY A 143 31.782 -8.511 -8.989 1.00 20.10 O ATOM 0 H GLY A 143 29.995 -7.539 -7.064 1.00 52.12 H new ATOM 0 HA2 GLY A 143 28.970 -7.734 -9.854 1.00 62.34 H new ATOM 0 HA3 GLY A 143 29.555 -6.262 -9.104 1.00 62.34 H new ATOM 2325 N LEU A 144 31.545 -7.010 -10.650 1.00 41.21 N ATOM 2326 CA LEU A 144 32.882 -7.237 -11.186 1.00 20.15 C ATOM 2327 C LEU A 144 33.369 -6.004 -11.945 1.00 63.10 C ATOM 2328 O LEU A 144 32.566 -5.219 -12.449 1.00 62.01 O ATOM 2329 CB LEU A 144 32.867 -8.446 -12.125 1.00 34.22 C ATOM 2330 CG LEU A 144 34.287 -8.991 -12.276 1.00 44.32 C ATOM 2331 CD1 LEU A 144 34.753 -9.579 -10.942 1.00 22.52 C ATOM 2332 CD2 LEU A 144 34.300 -10.084 -13.346 1.00 33.44 C ATOM 0 H LEU A 144 30.999 -6.312 -11.155 1.00 41.21 H new ATOM 0 HA LEU A 144 33.561 -7.430 -10.356 1.00 20.15 H new ATOM 0 HB2 LEU A 144 32.209 -9.220 -11.729 1.00 34.22 H new ATOM 0 HB3 LEU A 144 32.471 -8.159 -13.099 1.00 34.22 H new ATOM 0 HG LEU A 144 34.957 -8.184 -12.571 1.00 44.32 H new ATOM 0 HD11 LEU A 144 35.766 -9.968 -11.050 1.00 22.52 H new ATOM 0 HD12 LEU A 144 34.742 -8.802 -10.178 1.00 22.52 H new ATOM 0 HD13 LEU A 144 34.084 -10.387 -10.647 1.00 22.52 H new ATOM 0 HD21 LEU A 144 35.312 -10.474 -13.455 1.00 33.44 H new ATOM 0 HD22 LEU A 144 33.630 -10.891 -13.050 1.00 33.44 H new ATOM 0 HD23 LEU A 144 33.967 -9.667 -14.296 1.00 33.44 H new ATOM 2344 N THR A 145 34.686 -5.838 -12.020 1.00 11.25 N ATOM 2345 CA THR A 145 35.263 -4.693 -12.720 1.00 71.24 C ATOM 2346 C THR A 145 35.181 -4.880 -14.233 1.00 42.23 C ATOM 2347 O THR A 145 35.151 -6.005 -14.731 1.00 53.14 O ATOM 2348 CB THR A 145 36.727 -4.509 -12.310 1.00 43.23 C ATOM 2349 OG1 THR A 145 37.542 -4.472 -13.473 1.00 44.41 O ATOM 2350 CG2 THR A 145 37.162 -5.674 -11.419 1.00 14.33 C ATOM 0 H THR A 145 35.369 -6.475 -11.609 1.00 11.25 H new ATOM 0 HA THR A 145 34.691 -3.807 -12.445 1.00 71.24 H new ATOM 0 HB THR A 145 36.834 -3.574 -11.759 1.00 43.23 H new ATOM 0 HG1 THR A 145 38.479 -4.353 -13.212 1.00 44.41 H new ATOM 0 HG21 THR A 145 38.204 -5.541 -11.129 1.00 14.33 H new ATOM 0 HG22 THR A 145 36.537 -5.702 -10.526 1.00 14.33 H new ATOM 0 HG23 THR A 145 37.055 -6.610 -11.966 1.00 14.33 H new ATOM 2358 N ASP A 146 35.149 -3.766 -14.958 1.00 21.02 N ATOM 2359 CA ASP A 146 35.075 -3.806 -16.416 1.00 41.23 C ATOM 2360 C ASP A 146 35.669 -2.532 -17.010 1.00 3.25 C ATOM 2361 O ASP A 146 35.810 -1.523 -16.318 1.00 41.41 O ATOM 2362 CB ASP A 146 33.618 -3.946 -16.863 1.00 21.43 C ATOM 2363 CG ASP A 146 32.944 -5.077 -16.093 1.00 53.14 C ATOM 2364 OD1 ASP A 146 32.515 -4.834 -14.978 1.00 10.54 O ATOM 2365 OD2 ASP A 146 32.869 -6.169 -16.631 1.00 34.52 O ATOM 0 H ASP A 146 35.173 -2.826 -14.562 1.00 21.02 H new ATOM 0 HA ASP A 146 35.646 -4.665 -16.769 1.00 41.23 H new ATOM 0 HB2 ASP A 146 33.085 -3.011 -16.693 1.00 21.43 H new ATOM 0 HB3 ASP A 146 33.575 -4.147 -17.933 1.00 21.43 H new ATOM 2370 N GLU A 147 36.015 -2.582 -18.294 1.00 71.43 N ATOM 2371 CA GLU A 147 36.592 -1.421 -18.961 1.00 11.54 C ATOM 2372 C GLU A 147 35.766 -0.173 -18.663 1.00 70.00 C ATOM 2373 O GLU A 147 36.309 0.878 -18.320 1.00 60.44 O ATOM 2374 CB GLU A 147 36.639 -1.655 -20.472 1.00 14.13 C ATOM 2375 CG GLU A 147 37.613 -0.663 -21.112 1.00 31.31 C ATOM 2376 CD GLU A 147 39.050 -1.064 -20.795 1.00 34.31 C ATOM 2377 OE1 GLU A 147 39.427 -2.170 -21.147 1.00 73.44 O ATOM 2378 OE2 GLU A 147 39.752 -0.259 -20.207 1.00 31.42 O ATOM 0 H GLU A 147 35.907 -3.405 -18.887 1.00 71.43 H new ATOM 0 HA GLU A 147 37.605 -1.274 -18.587 1.00 11.54 H new ATOM 0 HB2 GLU A 147 36.953 -2.677 -20.683 1.00 14.13 H new ATOM 0 HB3 GLU A 147 35.644 -1.533 -20.901 1.00 14.13 H new ATOM 0 HG2 GLU A 147 37.463 -0.639 -22.191 1.00 31.31 H new ATOM 0 HG3 GLU A 147 37.417 0.343 -20.740 1.00 31.31 H new ATOM 2385 N LYS A 148 34.449 -0.299 -18.792 1.00 14.02 N ATOM 2386 CA LYS A 148 33.554 0.822 -18.530 1.00 21.22 C ATOM 2387 C LYS A 148 33.589 1.185 -17.048 1.00 72.41 C ATOM 2388 O LYS A 148 33.534 2.360 -16.682 1.00 12.34 O ATOM 2389 CB LYS A 148 32.118 0.447 -18.928 1.00 73.15 C ATOM 2390 CG LYS A 148 31.603 1.362 -20.048 1.00 25.33 C ATOM 2391 CD LYS A 148 31.909 0.728 -21.405 1.00 30.43 C ATOM 2392 CE LYS A 148 30.743 -0.172 -21.817 1.00 70.23 C ATOM 2393 NZ LYS A 148 31.085 -0.892 -23.077 1.00 13.13 N ATOM 0 H LYS A 148 33.981 -1.160 -19.074 1.00 14.02 H new ATOM 0 HA LYS A 148 33.883 1.679 -19.118 1.00 21.22 H new ATOM 0 HB2 LYS A 148 32.087 -0.591 -19.258 1.00 73.15 H new ATOM 0 HB3 LYS A 148 31.464 0.525 -18.060 1.00 73.15 H new ATOM 0 HG2 LYS A 148 30.529 1.517 -19.941 1.00 25.33 H new ATOM 0 HG3 LYS A 148 32.075 2.342 -19.978 1.00 25.33 H new ATOM 0 HD2 LYS A 148 32.067 1.504 -22.154 1.00 30.43 H new ATOM 0 HD3 LYS A 148 32.830 0.147 -21.349 1.00 30.43 H new ATOM 0 HE2 LYS A 148 30.526 -0.889 -21.025 1.00 70.23 H new ATOM 0 HE3 LYS A 148 29.843 0.426 -21.961 1.00 70.23 H new ATOM 0 HZ1 LYS A 148 30.290 -1.503 -23.354 1.00 13.13 H new ATOM 0 HZ2 LYS A 148 31.271 -0.201 -23.832 1.00 13.13 H new ATOM 0 HZ3 LYS A 148 31.933 -1.475 -22.925 1.00 13.13 H new ATOM 2407 N ASN A 149 33.674 0.164 -16.201 1.00 33.55 N ATOM 2408 CA ASN A 149 33.706 0.375 -14.758 1.00 1.31 C ATOM 2409 C ASN A 149 34.783 -0.490 -14.110 1.00 32.22 C ATOM 2410 O ASN A 149 34.487 -1.543 -13.542 1.00 71.14 O ATOM 2411 CB ASN A 149 32.345 0.022 -14.159 1.00 62.54 C ATOM 2412 CG ASN A 149 31.747 -1.166 -14.904 1.00 13.32 C ATOM 2413 OD1 ASN A 149 31.840 -2.302 -14.440 1.00 11.31 O ATOM 2414 ND2 ASN A 149 31.138 -0.974 -16.043 1.00 20.45 N ATOM 0 H ASN A 149 33.722 -0.814 -16.487 1.00 33.55 H new ATOM 0 HA ASN A 149 33.936 1.423 -14.566 1.00 1.31 H new ATOM 0 HB2 ASN A 149 32.454 -0.217 -13.101 1.00 62.54 H new ATOM 0 HB3 ASN A 149 31.675 0.879 -14.225 1.00 62.54 H new ATOM 0 HD21 ASN A 149 30.739 -1.766 -16.548 1.00 20.45 H new ATOM 0 HD22 ASN A 149 31.061 -0.032 -16.428 1.00 20.45 H new ATOM 2421 N PRO A 150 36.015 -0.068 -14.184 1.00 31.34 N ATOM 2422 CA PRO A 150 37.157 -0.818 -13.593 1.00 62.34 C ATOM 2423 C PRO A 150 37.219 -0.676 -12.072 1.00 71.15 C ATOM 2424 O PRO A 150 38.202 -0.177 -11.525 1.00 45.54 O ATOM 2425 CB PRO A 150 38.384 -0.195 -14.257 1.00 33.21 C ATOM 2426 CG PRO A 150 37.973 1.186 -14.658 1.00 13.54 C ATOM 2427 CD PRO A 150 36.453 1.173 -14.842 1.00 73.45 C ATOM 0 HA PRO A 150 37.075 -1.891 -13.767 1.00 62.34 H new ATOM 0 HB2 PRO A 150 39.229 -0.167 -13.569 1.00 33.21 H new ATOM 0 HB3 PRO A 150 38.697 -0.777 -15.124 1.00 33.21 H new ATOM 0 HG2 PRO A 150 38.262 1.910 -13.896 1.00 13.54 H new ATOM 0 HG3 PRO A 150 38.470 1.482 -15.582 1.00 13.54 H new ATOM 0 HD2 PRO A 150 35.990 2.049 -14.387 1.00 73.45 H new ATOM 0 HD3 PRO A 150 36.180 1.181 -15.897 1.00 73.45 H new ATOM 2435 N TYR A 151 36.165 -1.127 -11.399 1.00 51.34 N ATOM 2436 CA TYR A 151 36.108 -1.055 -9.943 1.00 70.15 C ATOM 2437 C TYR A 151 35.404 -2.284 -9.377 1.00 21.33 C ATOM 2438 O TYR A 151 34.708 -3.000 -10.097 1.00 60.44 O ATOM 2439 CB TYR A 151 35.355 0.203 -9.501 1.00 72.43 C ATOM 2440 CG TYR A 151 36.032 1.430 -10.061 1.00 23.11 C ATOM 2441 CD1 TYR A 151 37.234 1.884 -9.504 1.00 61.03 C ATOM 2442 CD2 TYR A 151 35.453 2.117 -11.134 1.00 53.30 C ATOM 2443 CE1 TYR A 151 37.857 3.027 -10.022 1.00 53.25 C ATOM 2444 CE2 TYR A 151 36.076 3.258 -11.651 1.00 0.04 C ATOM 2445 CZ TYR A 151 37.278 3.713 -11.096 1.00 44.23 C ATOM 2446 OH TYR A 151 37.891 4.839 -11.606 1.00 40.01 O ATOM 0 H TYR A 151 35.343 -1.544 -11.836 1.00 51.34 H new ATOM 0 HA TYR A 151 37.130 -1.017 -9.565 1.00 70.15 H new ATOM 0 HB2 TYR A 151 34.322 0.158 -9.845 1.00 72.43 H new ATOM 0 HB3 TYR A 151 35.327 0.257 -8.413 1.00 72.43 H new ATOM 0 HD1 TYR A 151 37.680 1.354 -8.676 1.00 61.03 H new ATOM 0 HD2 TYR A 151 34.526 1.767 -11.563 1.00 53.30 H new ATOM 0 HE1 TYR A 151 38.784 3.379 -9.593 1.00 53.25 H new ATOM 0 HE2 TYR A 151 35.629 3.788 -12.479 1.00 0.04 H new ATOM 0 HH TYR A 151 37.359 5.193 -12.349 1.00 40.01 H new ATOM 2456 N THR A 152 35.585 -2.518 -8.082 1.00 55.14 N ATOM 2457 CA THR A 152 34.956 -3.659 -7.427 1.00 42.21 C ATOM 2458 C THR A 152 33.809 -3.191 -6.538 1.00 40.43 C ATOM 2459 O THR A 152 34.002 -2.364 -5.646 1.00 24.34 O ATOM 2460 CB THR A 152 35.984 -4.414 -6.582 1.00 64.52 C ATOM 2461 OG1 THR A 152 37.079 -4.800 -7.402 1.00 30.35 O ATOM 2462 CG2 THR A 152 35.333 -5.658 -5.977 1.00 71.50 C ATOM 0 H THR A 152 36.158 -1.938 -7.469 1.00 55.14 H new ATOM 0 HA THR A 152 34.563 -4.326 -8.195 1.00 42.21 H new ATOM 0 HB THR A 152 36.342 -3.767 -5.781 1.00 64.52 H new ATOM 0 HG1 THR A 152 37.739 -5.282 -6.861 1.00 30.35 H new ATOM 0 HG21 THR A 152 36.066 -6.196 -5.375 1.00 71.50 H new ATOM 0 HG22 THR A 152 34.494 -5.360 -5.348 1.00 71.50 H new ATOM 0 HG23 THR A 152 34.974 -6.306 -6.776 1.00 71.50 H new ATOM 2470 N TYR A 153 32.616 -3.720 -6.786 1.00 72.12 N ATOM 2471 CA TYR A 153 31.450 -3.340 -5.998 1.00 3.15 C ATOM 2472 C TYR A 153 30.528 -4.537 -5.783 1.00 12.42 C ATOM 2473 O TYR A 153 30.580 -5.517 -6.526 1.00 53.31 O ATOM 2474 CB TYR A 153 30.681 -2.225 -6.708 1.00 20.25 C ATOM 2475 CG TYR A 153 30.852 -2.366 -8.201 1.00 43.22 C ATOM 2476 CD1 TYR A 153 30.260 -3.440 -8.875 1.00 32.31 C ATOM 2477 CD2 TYR A 153 31.604 -1.423 -8.911 1.00 14.25 C ATOM 2478 CE1 TYR A 153 30.419 -3.572 -10.259 1.00 50.35 C ATOM 2479 CE2 TYR A 153 31.764 -1.555 -10.296 1.00 52.34 C ATOM 2480 CZ TYR A 153 31.171 -2.630 -10.969 1.00 43.45 C ATOM 2481 OH TYR A 153 31.329 -2.761 -12.333 1.00 73.23 O ATOM 0 H TYR A 153 32.432 -4.406 -7.518 1.00 72.12 H new ATOM 0 HA TYR A 153 31.795 -2.985 -5.027 1.00 3.15 H new ATOM 0 HB2 TYR A 153 29.624 -2.274 -6.446 1.00 20.25 H new ATOM 0 HB3 TYR A 153 31.046 -1.252 -6.380 1.00 20.25 H new ATOM 0 HD1 TYR A 153 29.680 -4.168 -8.327 1.00 32.31 H new ATOM 0 HD2 TYR A 153 32.061 -0.594 -8.391 1.00 14.25 H new ATOM 0 HE1 TYR A 153 29.961 -4.401 -10.779 1.00 50.35 H new ATOM 0 HE2 TYR A 153 32.344 -0.828 -10.845 1.00 52.34 H new ATOM 0 HH TYR A 153 32.084 -2.211 -12.629 1.00 73.23 H new ATOM 2491 N TYR A 154 29.685 -4.446 -4.759 1.00 34.13 N ATOM 2492 CA TYR A 154 28.751 -5.522 -4.450 1.00 33.12 C ATOM 2493 C TYR A 154 27.345 -4.968 -4.247 1.00 32.45 C ATOM 2494 O TYR A 154 27.171 -3.814 -3.856 1.00 32.52 O ATOM 2495 CB TYR A 154 29.194 -6.258 -3.184 1.00 13.44 C ATOM 2496 CG TYR A 154 30.679 -6.527 -3.244 1.00 71.05 C ATOM 2497 CD1 TYR A 154 31.235 -7.133 -4.377 1.00 75.53 C ATOM 2498 CD2 TYR A 154 31.498 -6.172 -2.166 1.00 62.12 C ATOM 2499 CE1 TYR A 154 32.611 -7.384 -4.431 1.00 41.04 C ATOM 2500 CE2 TYR A 154 32.874 -6.424 -2.221 1.00 73.32 C ATOM 2501 CZ TYR A 154 33.430 -7.029 -3.353 1.00 34.34 C ATOM 2502 OH TYR A 154 34.787 -7.277 -3.406 1.00 51.13 O ATOM 0 H TYR A 154 29.630 -3.643 -4.133 1.00 34.13 H new ATOM 0 HA TYR A 154 28.742 -6.217 -5.289 1.00 33.12 H new ATOM 0 HB2 TYR A 154 28.958 -5.661 -2.303 1.00 13.44 H new ATOM 0 HB3 TYR A 154 28.648 -7.197 -3.088 1.00 13.44 H new ATOM 0 HD1 TYR A 154 30.603 -7.407 -5.209 1.00 75.53 H new ATOM 0 HD2 TYR A 154 31.069 -5.704 -1.292 1.00 62.12 H new ATOM 0 HE1 TYR A 154 33.041 -7.852 -5.305 1.00 41.04 H new ATOM 0 HE2 TYR A 154 33.506 -6.151 -1.389 1.00 73.32 H new ATOM 0 HH TYR A 154 35.209 -6.968 -2.577 1.00 51.13 H new ATOM 2512 N TYR A 155 26.345 -5.802 -4.511 1.00 32.30 N ATOM 2513 CA TYR A 155 24.954 -5.393 -4.352 1.00 40.44 C ATOM 2514 C TYR A 155 24.290 -6.190 -3.234 1.00 44.30 C ATOM 2515 O TYR A 155 24.530 -7.388 -3.087 1.00 3.22 O ATOM 2516 CB TYR A 155 24.194 -5.615 -5.661 1.00 44.01 C ATOM 2517 CG TYR A 155 22.994 -4.701 -5.713 1.00 2.21 C ATOM 2518 CD1 TYR A 155 21.790 -5.091 -5.114 1.00 30.44 C ATOM 2519 CD2 TYR A 155 23.083 -3.465 -6.365 1.00 31.24 C ATOM 2520 CE1 TYR A 155 20.676 -4.244 -5.165 1.00 30.44 C ATOM 2521 CE2 TYR A 155 21.970 -2.619 -6.416 1.00 11.12 C ATOM 2522 CZ TYR A 155 20.766 -3.008 -5.817 1.00 3.31 C ATOM 2523 OH TYR A 155 19.669 -2.173 -5.868 1.00 62.15 O ATOM 0 H TYR A 155 26.470 -6.761 -4.835 1.00 32.30 H new ATOM 0 HA TYR A 155 24.930 -4.334 -4.093 1.00 40.44 H new ATOM 0 HB2 TYR A 155 24.849 -5.420 -6.510 1.00 44.01 H new ATOM 0 HB3 TYR A 155 23.875 -6.655 -5.736 1.00 44.01 H new ATOM 0 HD1 TYR A 155 21.720 -6.045 -4.613 1.00 30.44 H new ATOM 0 HD2 TYR A 155 24.011 -3.165 -6.829 1.00 31.24 H new ATOM 0 HE1 TYR A 155 19.748 -4.544 -4.702 1.00 30.44 H new ATOM 0 HE2 TYR A 155 22.040 -1.665 -6.918 1.00 11.12 H new ATOM 0 HH TYR A 155 19.929 -1.273 -5.580 1.00 62.15 H new ATOM 2533 N HIS A 156 23.456 -5.518 -2.448 1.00 1.33 N ATOM 2534 CA HIS A 156 22.765 -6.176 -1.345 1.00 40.02 C ATOM 2535 C HIS A 156 21.262 -5.929 -1.427 1.00 22.05 C ATOM 2536 O HIS A 156 20.819 -4.897 -1.932 1.00 71.13 O ATOM 2537 CB HIS A 156 23.295 -5.651 -0.010 1.00 74.53 C ATOM 2538 CG HIS A 156 24.798 -5.652 -0.030 1.00 31.31 C ATOM 2539 ND1 HIS A 156 25.549 -6.272 0.956 1.00 70.23 N ATOM 2540 CD2 HIS A 156 25.705 -5.111 -0.908 1.00 63.43 C ATOM 2541 CE1 HIS A 156 26.847 -6.091 0.651 1.00 1.24 C ATOM 2542 NE2 HIS A 156 26.998 -5.389 -0.475 1.00 54.33 N ATOM 0 H HIS A 156 23.243 -4.526 -2.552 1.00 1.33 H new ATOM 0 HA HIS A 156 22.950 -7.248 -1.416 1.00 40.02 H new ATOM 0 HB2 HIS A 156 22.924 -4.642 0.169 1.00 74.53 H new ATOM 0 HB3 HIS A 156 22.931 -6.274 0.808 1.00 74.53 H new ATOM 0 HD1 HIS A 156 25.184 -6.774 1.765 1.00 70.23 H new ATOM 0 HD2 HIS A 156 25.453 -4.555 -1.799 1.00 63.43 H new ATOM 0 HE1 HIS A 156 27.667 -6.468 1.245 1.00 1.24 H new ATOM 2551 N VAL A 157 20.485 -6.881 -0.922 1.00 41.45 N ATOM 2552 CA VAL A 157 19.033 -6.759 -0.938 1.00 65.23 C ATOM 2553 C VAL A 157 18.481 -6.806 0.483 1.00 25.01 C ATOM 2554 O VAL A 157 18.740 -7.752 1.228 1.00 3.42 O ATOM 2555 CB VAL A 157 18.423 -7.892 -1.764 1.00 64.02 C ATOM 2556 CG1 VAL A 157 16.933 -7.623 -1.976 1.00 61.14 C ATOM 2557 CG2 VAL A 157 19.124 -7.969 -3.123 1.00 43.33 C ATOM 0 H VAL A 157 20.834 -7.741 -0.499 1.00 41.45 H new ATOM 0 HA VAL A 157 18.769 -5.802 -1.388 1.00 65.23 H new ATOM 0 HB VAL A 157 18.551 -8.836 -1.234 1.00 64.02 H new ATOM 0 HG11 VAL A 157 16.498 -8.430 -2.565 1.00 61.14 H new ATOM 0 HG12 VAL A 157 16.432 -7.568 -1.009 1.00 61.14 H new ATOM 0 HG13 VAL A 157 16.805 -6.679 -2.505 1.00 61.14 H new ATOM 0 HG21 VAL A 157 18.689 -8.777 -3.712 1.00 43.33 H new ATOM 0 HG22 VAL A 157 18.996 -7.025 -3.652 1.00 43.33 H new ATOM 0 HG23 VAL A 157 20.187 -8.160 -2.974 1.00 43.33 H new ATOM 2567 N TYR A 158 17.723 -5.780 0.856 1.00 62.10 N ATOM 2568 CA TYR A 158 17.146 -5.716 2.194 1.00 54.20 C ATOM 2569 C TYR A 158 15.643 -5.457 2.121 1.00 73.31 C ATOM 2570 O TYR A 158 15.156 -4.840 1.174 1.00 42.54 O ATOM 2571 CB TYR A 158 17.820 -4.602 2.997 1.00 25.11 C ATOM 2572 CG TYR A 158 19.143 -5.096 3.533 1.00 74.33 C ATOM 2573 CD1 TYR A 158 19.191 -5.770 4.759 1.00 10.44 C ATOM 2574 CD2 TYR A 158 20.320 -4.882 2.806 1.00 44.42 C ATOM 2575 CE1 TYR A 158 20.414 -6.229 5.259 1.00 54.02 C ATOM 2576 CE2 TYR A 158 21.545 -5.342 3.306 1.00 61.33 C ATOM 2577 CZ TYR A 158 21.592 -6.015 4.533 1.00 34.25 C ATOM 2578 OH TYR A 158 22.798 -6.468 5.026 1.00 32.44 O ATOM 0 H TYR A 158 17.495 -4.987 0.256 1.00 62.10 H new ATOM 0 HA TYR A 158 17.312 -6.674 2.688 1.00 54.20 H new ATOM 0 HB2 TYR A 158 17.975 -3.727 2.366 1.00 25.11 H new ATOM 0 HB3 TYR A 158 17.176 -4.291 3.819 1.00 25.11 H new ATOM 0 HD1 TYR A 158 18.283 -5.936 5.319 1.00 10.44 H new ATOM 0 HD2 TYR A 158 20.284 -4.362 1.860 1.00 44.42 H new ATOM 0 HE1 TYR A 158 20.450 -6.749 6.205 1.00 54.02 H new ATOM 0 HE2 TYR A 158 22.453 -5.178 2.745 1.00 61.33 H new ATOM 0 HH TYR A 158 22.764 -7.442 5.130 1.00 32.44 H new ATOM 2588 N GLU A 159 14.915 -5.934 3.127 1.00 23.43 N ATOM 2589 CA GLU A 159 13.468 -5.748 3.167 1.00 13.15 C ATOM 2590 C GLU A 159 12.970 -5.698 4.608 1.00 61.12 C ATOM 2591 O GLU A 159 13.602 -6.242 5.513 1.00 13.11 O ATOM 2592 CB GLU A 159 12.773 -6.894 2.430 1.00 31.22 C ATOM 2593 CG GLU A 159 12.989 -8.200 3.198 1.00 55.13 C ATOM 2594 CD GLU A 159 12.044 -8.264 4.394 1.00 12.52 C ATOM 2595 OE1 GLU A 159 10.846 -8.169 4.183 1.00 53.54 O ATOM 2596 OE2 GLU A 159 12.533 -8.409 5.502 1.00 31.55 O ATOM 0 H GLU A 159 15.300 -6.448 3.919 1.00 23.43 H new ATOM 0 HA GLU A 159 13.232 -4.802 2.679 1.00 13.15 H new ATOM 0 HB2 GLU A 159 11.707 -6.687 2.336 1.00 31.22 H new ATOM 0 HB3 GLU A 159 13.170 -6.984 1.419 1.00 31.22 H new ATOM 0 HG2 GLU A 159 12.815 -9.051 2.540 1.00 55.13 H new ATOM 0 HG3 GLU A 159 14.023 -8.266 3.537 1.00 55.13 H new ATOM 2603 N LYS A 160 11.831 -5.043 4.811 1.00 25.23 N ATOM 2604 CA LYS A 160 11.252 -4.927 6.144 1.00 52.14 C ATOM 2605 C LYS A 160 9.885 -5.604 6.195 1.00 44.11 C ATOM 2606 O LYS A 160 9.250 -5.816 5.162 1.00 54.22 O ATOM 2607 CB LYS A 160 11.105 -3.452 6.519 1.00 22.41 C ATOM 2608 CG LYS A 160 12.285 -3.025 7.397 1.00 72.54 C ATOM 2609 CD LYS A 160 12.052 -3.486 8.838 1.00 50.14 C ATOM 2610 CE LYS A 160 12.865 -2.609 9.793 1.00 73.23 C ATOM 2611 NZ LYS A 160 13.426 -3.451 10.887 1.00 1.54 N ATOM 0 H LYS A 160 11.294 -4.587 4.074 1.00 25.23 H new ATOM 0 HA LYS A 160 11.916 -5.420 6.854 1.00 52.14 H new ATOM 0 HB2 LYS A 160 11.068 -2.839 5.618 1.00 22.41 H new ATOM 0 HB3 LYS A 160 10.167 -3.293 7.051 1.00 22.41 H new ATOM 0 HG2 LYS A 160 13.210 -3.455 7.013 1.00 72.54 H new ATOM 0 HG3 LYS A 160 12.400 -1.942 7.366 1.00 72.54 H new ATOM 0 HD2 LYS A 160 10.992 -3.424 9.084 1.00 50.14 H new ATOM 0 HD3 LYS A 160 12.344 -4.530 8.949 1.00 50.14 H new ATOM 0 HE2 LYS A 160 13.671 -2.114 9.251 1.00 73.23 H new ATOM 0 HE3 LYS A 160 12.233 -1.825 10.211 1.00 73.23 H new ATOM 0 HZ1 LYS A 160 13.978 -2.855 11.536 1.00 1.54 H new ATOM 0 HZ2 LYS A 160 12.649 -3.904 11.410 1.00 1.54 H new ATOM 0 HZ3 LYS A 160 14.043 -4.183 10.480 1.00 1.54 H new ATOM 2625 N GLN A 161 9.437 -5.940 7.401 1.00 42.50 N ATOM 2626 CA GLN A 161 8.142 -6.590 7.568 1.00 11.42 C ATOM 2627 C GLN A 161 7.175 -5.675 8.312 1.00 52.14 C ATOM 2628 O GLN A 161 6.643 -6.039 9.361 1.00 43.01 O ATOM 2629 CB GLN A 161 8.306 -7.899 8.342 1.00 63.31 C ATOM 2630 CG GLN A 161 9.227 -7.672 9.542 1.00 31.15 C ATOM 2631 CD GLN A 161 10.682 -7.661 9.089 1.00 31.13 C ATOM 2632 OE1 GLN A 161 11.190 -8.672 8.604 1.00 31.01 O ATOM 2633 NE2 GLN A 161 11.388 -6.571 9.219 1.00 2.44 N ATOM 0 H GLN A 161 9.946 -5.775 8.269 1.00 42.50 H new ATOM 0 HA GLN A 161 7.736 -6.803 6.579 1.00 11.42 H new ATOM 0 HB2 GLN A 161 7.334 -8.258 8.679 1.00 63.31 H new ATOM 0 HB3 GLN A 161 8.722 -8.668 7.692 1.00 63.31 H new ATOM 0 HG2 GLN A 161 8.981 -6.727 10.026 1.00 31.15 H new ATOM 0 HG3 GLN A 161 9.074 -8.458 10.282 1.00 31.15 H new ATOM 0 HE21 GLN A 161 10.965 -5.734 9.621 1.00 2.44 H new ATOM 0 HE22 GLN A 161 12.363 -6.556 8.918 1.00 2.44 H new ATOM 2642 N GLN A 162 6.954 -4.486 7.763 1.00 1.31 N ATOM 2643 CA GLN A 162 6.048 -3.526 8.385 1.00 63.00 C ATOM 2644 C GLN A 162 4.713 -3.495 7.647 1.00 74.03 C ATOM 2645 O GLN A 162 3.709 -3.239 8.290 1.00 71.45 O ATOM 2646 CB GLN A 162 6.675 -2.131 8.370 1.00 45.43 C ATOM 2647 CG GLN A 162 7.695 -2.017 9.504 1.00 22.40 C ATOM 2648 CD GLN A 162 8.182 -0.576 9.626 1.00 30.21 C ATOM 2649 OE1 GLN A 162 9.089 -0.164 8.904 1.00 1.23 O ATOM 2650 NE2 GLN A 162 7.630 0.217 10.504 1.00 54.33 N ATOM 0 H GLN A 162 7.385 -4.165 6.896 1.00 1.31 H new ATOM 0 HA GLN A 162 5.873 -3.834 9.416 1.00 63.00 H new ATOM 0 HB2 GLN A 162 7.160 -1.949 7.411 1.00 45.43 H new ATOM 0 HB3 GLN A 162 5.901 -1.372 8.485 1.00 45.43 H new ATOM 0 HG2 GLN A 162 7.244 -2.338 10.443 1.00 22.40 H new ATOM 0 HG3 GLN A 162 8.539 -2.680 9.313 1.00 22.40 H new ATOM 0 HE21 GLN A 162 6.878 -0.128 11.101 1.00 54.33 H new ATOM 0 HE22 GLN A 162 7.950 1.181 10.593 1.00 54.33 H new TER 2659 GLN A 162 HETATM 2660 PA NAP A 173 19.922 14.757 -0.737 1.00 20.00 P HETATM 2661 O1A NAP A 173 19.304 13.821 0.229 1.00 20.00 O HETATM 2662 O2A NAP A 173 20.126 14.298 -2.130 1.00 20.00 O HETATM 2663 O5B NAP A 173 19.089 16.134 -0.750 1.00 20.00 O HETATM 2664 C5B NAP A 173 18.949 16.898 0.451 1.00 20.00 C HETATM 2665 C4B NAP A 173 17.534 17.466 0.577 1.00 20.00 C HETATM 2666 O4B NAP A 173 16.838 16.844 1.667 1.00 20.00 O HETATM 2667 C3B NAP A 173 17.603 18.937 0.988 1.00 20.00 C HETATM 2668 O3B NAP A 173 17.610 19.761 -0.181 1.00 20.00 O HETATM 2669 C2B NAP A 173 16.291 19.141 1.749 1.00 20.00 C HETATM 2670 O2B NAP A 173 15.385 19.895 0.940 1.00 20.00 O HETATM 2671 C1B NAP A 173 15.740 17.726 1.946 1.00 20.00 C HETATM 2672 N9A NAP A 173 15.317 17.551 3.353 1.00 20.00 N HETATM 2673 C8A NAP A 173 16.125 17.515 4.411 1.00 20.00 C HETATM 2674 N7A NAP A 173 15.406 17.340 5.517 1.00 20.00 N HETATM 2675 C5A NAP A 173 14.126 17.263 5.162 1.00 20.00 C HETATM 2676 C6A NAP A 173 12.939 17.087 5.860 1.00 20.00 C HETATM 2677 N6A NAP A 173 12.946 16.949 7.183 1.00 20.00 N HETATM 2678 N1A NAP A 173 11.786 17.054 5.178 1.00 20.00 N HETATM 2679 C2A NAP A 173 11.768 17.187 3.863 1.00 20.00 C HETATM 2680 N3A NAP A 173 12.878 17.355 3.167 1.00 20.00 N HETATM 2681 C4A NAP A 173 14.068 17.398 3.783 1.00 20.00 C HETATM 2682 O3 NAP A 173 21.355 15.215 -0.164 1.00 20.00 O HETATM 2683 PN NAP A 173 22.280 14.160 0.625 1.00 20.00 P HETATM 2684 O1N NAP A 173 23.247 14.896 1.470 1.00 20.00 O HETATM 2685 O2N NAP A 173 21.420 13.139 1.265 1.00 20.00 O HETATM 2686 O5D NAP A 173 23.087 13.436 -0.565 1.00 20.00 O HETATM 2687 C5D NAP A 173 23.667 14.216 -1.614 1.00 20.00 C HETATM 2688 C4D NAP A 173 24.416 13.326 -2.608 1.00 20.00 C HETATM 2689 O4D NAP A 173 23.844 12.008 -2.604 1.00 20.00 O HETATM 2690 C3D NAP A 173 24.230 13.830 -4.040 1.00 20.00 C HETATM 2691 O3D NAP A 173 25.371 14.583 -4.458 1.00 20.00 O HETATM 2692 C2D NAP A 173 24.123 12.553 -4.873 1.00 20.00 C HETATM 2693 O2D NAP A 173 25.192 12.480 -5.820 1.00 20.00 O HETATM 2694 C1D NAP A 173 24.266 11.427 -3.847 1.00 20.00 C HETATM 2695 N1N NAP A 173 23.388 10.287 -4.191 1.00 20.00 N HETATM 2696 C2N NAP A 173 23.945 9.077 -4.623 1.00 20.00 C HETATM 2697 C3N NAP A 173 23.115 8.011 -4.951 1.00 20.00 C HETATM 2698 C7N NAP A 173 23.722 6.689 -5.425 1.00 20.00 C HETATM 2699 O7N NAP A 173 22.970 5.736 -6.038 1.00 20.00 O HETATM 2700 N7N NAP A 173 25.023 6.521 -5.205 1.00 20.00 N HETATM 2701 C4N NAP A 173 21.735 8.145 -4.850 1.00 20.00 C HETATM 2702 C5N NAP A 173 21.177 9.344 -4.422 1.00 20.00 C HETATM 2703 C6N NAP A 173 21.998 10.417 -4.091 1.00 20.00 C HETATM 2704 P2B NAP A 173 15.634 21.467 0.699 1.00 20.00 P HETATM 2705 O1X NAP A 173 14.884 22.309 1.658 1.00 20.00 O HETATM 2706 O2X NAP A 173 17.224 21.703 0.787 1.00 20.00 O HETATM 2707 O3X NAP A 173 15.206 21.747 -0.828 1.00 20.00 O HETATM 0 HO3N NAP A 173 25.129 15.530 -4.533 1.00 20.00 H new HETATM 0 HO3A NAP A 173 17.814 20.686 0.072 1.00 20.00 H new HETATM 0 HO2N NAP A 173 25.914 13.083 -5.545 1.00 20.00 H new HETATM 0 H72N NAP A 173 25.483 5.659 -5.499 1.00 20.00 H new HETATM 0 H71N NAP A 173 25.561 7.254 -4.742 1.00 20.00 H new HETATM 0 H62A NAP A 173 12.069 16.820 7.687 1.00 20.00 H new HETATM 0 H61A NAP A 173 13.829 16.972 7.693 1.00 20.00 H new HETATM 0 H52N NAP A 173 22.886 14.771 -2.134 1.00 20.00 H new HETATM 0 H52A NAP A 173 19.171 16.270 1.314 1.00 20.00 H new HETATM 0 H51N NAP A 173 24.352 14.950 -1.190 1.00 20.00 H new HETATM 0 H51A NAP A 173 19.673 17.712 0.455 1.00 20.00 H new HETATM 0 H8A NAP A 173 17.210 17.614 4.376 1.00 20.00 H new HETATM 0 H6N NAP A 173 21.560 11.357 -3.755 1.00 20.00 H new HETATM 0 H5N NAP A 173 20.094 9.444 -4.346 1.00 20.00 H new HETATM 0 H4N NAP A 173 21.088 7.306 -5.107 1.00 20.00 H new HETATM 0 H4D NAP A 173 25.465 13.332 -2.313 1.00 20.00 H new HETATM 0 H4B NAP A 173 17.042 17.306 -0.382 1.00 20.00 H new HETATM 0 H3D NAP A 173 23.362 14.482 -4.141 1.00 20.00 H new HETATM 0 H3B NAP A 173 18.490 19.187 1.570 1.00 20.00 H new HETATM 0 H2N NAP A 173 25.027 8.971 -4.702 1.00 20.00 H new HETATM 0 H2D NAP A 173 23.192 12.503 -5.438 1.00 20.00 H new HETATM 0 H2B NAP A 173 16.428 19.674 2.690 1.00 20.00 H new HETATM 0 H2A NAP A 173 10.812 17.157 3.339 1.00 20.00 H new HETATM 0 H1D NAP A 173 25.285 11.042 -3.808 1.00 20.00 H new HETATM 0 H1B NAP A 173 14.882 17.530 1.303 1.00 20.00 H new HETATM 2714 C8 N22 A 174 23.308 2.187 -10.190 1.00 20.00 C HETATM 2715 C7 N22 A 174 22.674 3.234 -11.109 1.00 20.00 C HETATM 2716 C5 N22 A 174 21.150 3.101 -11.120 1.00 20.00 C HETATM 2717 N4 N22 A 174 20.629 1.866 -11.141 1.00 20.00 N HETATM 2718 C3 N22 A 174 19.304 1.663 -11.151 1.00 20.00 C HETATM 2719 N8 N22 A 174 18.831 0.420 -11.173 1.00 20.00 N HETATM 2720 N2 N22 A 174 18.450 2.697 -11.139 1.00 20.00 N HETATM 2721 C1 N22 A 174 18.909 3.955 -11.118 1.00 20.00 C HETATM 2722 N7 N22 A 174 18.059 4.978 -11.104 1.00 20.00 N HETATM 2723 C6 N22 A 174 20.279 4.184 -11.109 1.00 20.00 C HETATM 2724 C9 N22 A 174 20.791 5.521 -11.092 1.00 20.00 C HETATM 2725 C10 N22 A 174 21.230 6.663 -11.078 1.00 20.00 C HETATM 2726 C11 N22 A 174 21.758 8.033 -11.060 1.00 20.00 C HETATM 2727 C13 N22 A 174 22.198 8.470 -12.459 1.00 20.00 C HETATM 2728 C18 N22 A 174 21.351 8.174 -13.521 1.00 20.00 C HETATM 2729 C17 N22 A 174 21.684 8.542 -14.819 1.00 20.00 C HETATM 2730 O2 N22 A 174 20.844 8.244 -15.847 1.00 20.00 O HETATM 2731 C4 N22 A 174 20.138 9.423 -16.243 1.00 20.00 C HETATM 2732 C16 N22 A 174 22.876 9.213 -15.067 1.00 20.00 C HETATM 2733 C15 N22 A 174 23.728 9.512 -14.011 1.00 20.00 C HETATM 2734 C14 N22 A 174 23.388 9.142 -12.715 1.00 20.00 C HETATM 2735 O10 N22 A 174 24.229 9.439 -11.688 1.00 20.00 O HETATM 2736 C2 N22 A 174 24.934 8.260 -11.291 1.00 20.00 C HETATM 0 HN8A N22 A 174 17.824 0.258 -11.181 1.00 20.00 H new HETATM 0 HN7A N22 A 174 18.413 5.935 -11.088 1.00 20.00 H new HETATM 0 H11A N22 A 174 20.995 8.716 -10.685 1.00 20.00 H new HETATM 0 HN8 N22 A 174 19.475 -0.371 -11.182 1.00 20.00 H new HETATM 0 HN7 N22 A 174 17.054 4.806 -11.109 1.00 20.00 H new HETATM 0 H8B N22 A 174 22.938 2.323 -9.174 1.00 20.00 H new HETATM 0 H8A N22 A 174 23.047 1.189 -10.541 1.00 20.00 H new HETATM 0 H8 N22 A 174 24.392 2.303 -10.200 1.00 20.00 H new HETATM 0 H7A N22 A 174 22.953 4.233 -10.775 1.00 20.00 H new HETATM 0 H7 N22 A 174 23.060 3.117 -12.121 1.00 20.00 H new HETATM 0 H4B N22 A 174 19.560 9.801 -15.400 1.00 20.00 H new HETATM 0 H4A N22 A 174 20.850 10.183 -16.565 1.00 20.00 H new HETATM 0 H4 N22 A 174 19.465 9.185 -17.067 1.00 20.00 H new HETATM 0 H2B N22 A 174 24.221 7.501 -10.968 1.00 20.00 H new HETATM 0 H2A N22 A 174 25.511 7.880 -12.134 1.00 20.00 H new HETATM 0 H2 N22 A 174 25.608 8.499 -10.468 1.00 20.00 H new HETATM 0 H18 N22 A 174 20.415 7.647 -13.333 1.00 20.00 H new HETATM 0 H16 N22 A 174 23.141 9.503 -16.084 1.00 20.00 H new HETATM 0 H15 N22 A 174 24.664 10.037 -14.199 1.00 20.00 H new HETATM 0 H11 N22 A 174 22.603 8.092 -10.374 1.00 20.00 H new