USER MOD reduce.3.24.130724 H: found=0, std=0, add=1060, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1053 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 68 THR OG1 : rot 140:sc= -0.646 USER MOD Set 1.2: A 110 HIS : no HD1:sc= -0.889 X(o=-1.5,f=-1.5) USER MOD Set 2.1: A 3 CYS SG : rot -140:sc= -1.57 USER MOD Set 2.2: A 39 HIS : no HE2:sc= -2.2 K(o=-3.8,f=-6.6!) USER MOD Set 3.1: A 36 TYR OH : rot 22:sc= -2.25 USER MOD Set 3.2: A 45 MET CE :methyl 167:sc= 0 (180deg=-0.102) USER MOD Set 4.1: A 13 SER OG : rot 180:sc= -0.0117 USER MOD Set 4.2: A 33 HIS : no HD1:sc= -1.06 X(o=-1.1,f=-0.89) USER MOD Single : A 1 MET CE :methyl -131:sc= -0.0426 (180deg=-0.937) USER MOD Single : A 1 MET N :NH3+ -128:sc= -3.25 (180deg=-9.26!) USER MOD Single : A 2 LYS NZ :NH3+ -105:sc= 0.99 (180deg=0.0655) USER MOD Single : A 6 CYS SG : rot 180:sc= 0 USER MOD Single : A 7 HIS :FLIP no HD1:sc= -1.71 F(o=-2.7,f=-1.7) USER MOD Single : A 8 GLN : amide:sc= -0.0342 K(o=-0.034,f=-0.95) USER MOD Single : A 11 MET CE :methyl 157:sc= -2.64! (180deg=-4.63!) USER MOD Single : A 16 LYS NZ :NH3+ 173:sc= -0.607 (180deg=-0.701) USER MOD Single : A 20 TYR OH : rot 180:sc= -1.08 USER MOD Single : A 21 THR OG1 : rot 88:sc= 1.37 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 149:sc= 1.12 USER MOD Single : A 30 LYS NZ :NH3+ -131:sc= -0.259 (180deg=-1.86!) USER MOD Single : A 37 CYS SG : rot 180:sc= 0 USER MOD Single : A 40 CYS SG : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0.0107 USER MOD Single : A 46 ASN : amide:sc= -1.05 K(o=-1,f=-1.6) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl 171:sc= -1.42 (180deg=-1.59) USER MOD Single : A 56 GLN :FLIP amide:sc= -0.0345 F(o=-0.72,f=-0.035) USER MOD Single : A 58 LYS NZ :NH3+ 161:sc= -0.0652 (180deg=-0.707) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 ASN : amide:sc= 0.309 X(o=0.31,f=-0.036) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -139:sc= 0.232 (180deg=0.0138) USER MOD Single : A 82 SER OG : rot 180:sc=-0.00832 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0.176 USER MOD Single : A 85 GLN : amide:sc= -0.307 K(o=-0.31,f=-1.4!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot -47:sc= 1.19 USER MOD Single : A 97 ASN : amide:sc= -1.92 K(o=-1.9,f=-4.5!) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 TYR OH : rot 77:sc=0.000944 USER MOD Single : A 104 LYS NZ :NH3+ 158:sc= -0.0936 (180deg=-0.629) USER MOD Single : A 106 ASN : amide:sc= -0.394 X(o=-0.39,f=-0.016) USER MOD Single : A 108 GLN :FLIP amide:sc= -2.87 F(o=-4.3,f=-2.9) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.764 USER MOD Single : A 115 LYS NZ :NH3+ -160:sc= -2.03 (180deg=-2.55!) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HD1:sc= -0.195 X(o=-0.19,f=0) USER MOD Single : A 128 ASN :FLIP amide:sc= -2.44! F(o=-4.7,f=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.329 0.000 0.000 1.00 60.43 N ATOM 2 CA MET A 1 2.093 -0.001 -1.242 1.00 5.34 C ATOM 3 C MET A 1 1.747 -1.219 -2.092 1.00 1.32 C ATOM 4 O MET A 1 1.855 -1.185 -3.318 1.00 71.03 O ATOM 5 CB MET A 1 3.593 0.019 -0.944 1.00 21.11 C ATOM 6 CG MET A 1 3.993 1.058 0.091 1.00 2.51 C ATOM 7 SD MET A 1 5.285 2.167 -0.503 1.00 33.32 S ATOM 8 CE MET A 1 6.098 2.595 1.034 1.00 2.12 C ATOM 0 H1 MET A 1 0.852 0.917 0.113 1.00 60.43 H new ATOM 0 H2 MET A 1 0.618 -0.759 -0.029 1.00 60.43 H new ATOM 0 H3 MET A 1 1.971 -0.158 0.803 1.00 60.43 H new ATOM 0 HA MET A 1 1.830 0.897 -1.802 1.00 5.34 H new ATOM 0 HB2 MET A 1 3.899 -0.967 -0.594 1.00 21.11 H new ATOM 0 HB3 MET A 1 4.136 0.212 -1.869 1.00 21.11 H new ATOM 0 HG2 MET A 1 3.117 1.643 0.370 1.00 2.51 H new ATOM 0 HG3 MET A 1 4.339 0.553 0.993 1.00 2.51 H new ATOM 0 HE1 MET A 1 6.217 3.677 1.094 1.00 2.12 H new ATOM 0 HE2 MET A 1 5.495 2.249 1.873 1.00 2.12 H new ATOM 0 HE3 MET A 1 7.078 2.120 1.072 1.00 2.12 H new ATOM 18 N LYS A 2 1.332 -2.296 -1.433 1.00 3.35 N ATOM 19 CA LYS A 2 0.970 -3.526 -2.128 1.00 74.43 C ATOM 20 C LYS A 2 0.399 -4.552 -1.154 1.00 22.04 C ATOM 21 O LYS A 2 0.132 -4.239 0.007 1.00 61.45 O ATOM 22 CB LYS A 2 2.189 -4.110 -2.844 1.00 43.23 C ATOM 23 CG LYS A 2 3.222 -4.702 -1.901 1.00 75.44 C ATOM 24 CD LYS A 2 4.541 -3.952 -1.976 1.00 34.51 C ATOM 25 CE LYS A 2 5.130 -3.718 -0.593 1.00 63.13 C ATOM 26 NZ LYS A 2 5.533 -4.994 0.061 1.00 72.41 N ATOM 0 H LYS A 2 1.238 -2.342 -0.418 1.00 3.35 H new ATOM 0 HA LYS A 2 0.205 -3.285 -2.866 1.00 74.43 H new ATOM 0 HB2 LYS A 2 1.857 -4.883 -3.537 1.00 43.23 H new ATOM 0 HB3 LYS A 2 2.659 -3.328 -3.440 1.00 43.23 H new ATOM 0 HG2 LYS A 2 2.843 -4.672 -0.879 1.00 75.44 H new ATOM 0 HG3 LYS A 2 3.384 -5.751 -2.150 1.00 75.44 H new ATOM 0 HD2 LYS A 2 5.248 -4.518 -2.583 1.00 34.51 H new ATOM 0 HD3 LYS A 2 4.388 -2.995 -2.474 1.00 34.51 H new ATOM 0 HE2 LYS A 2 5.996 -3.062 -0.674 1.00 63.13 H new ATOM 0 HE3 LYS A 2 4.398 -3.205 0.031 1.00 63.13 H new ATOM 0 HZ1 LYS A 2 4.842 -5.240 0.798 1.00 72.41 H new ATOM 0 HZ2 LYS A 2 5.566 -5.753 -0.649 1.00 72.41 H new ATOM 0 HZ3 LYS A 2 6.473 -4.882 0.492 1.00 72.41 H new ATOM 40 N CYS A 3 0.214 -5.777 -1.634 1.00 43.34 N ATOM 41 CA CYS A 3 -0.324 -6.850 -0.805 1.00 23.33 C ATOM 42 C CYS A 3 -0.566 -8.107 -1.634 1.00 33.44 C ATOM 43 O CYS A 3 -1.685 -8.614 -1.726 1.00 21.30 O ATOM 44 CB CYS A 3 -1.627 -6.404 -0.141 1.00 31.54 C ATOM 45 SG CYS A 3 -1.519 -6.234 1.656 1.00 31.24 S ATOM 0 H CYS A 3 0.429 -6.052 -2.593 1.00 43.34 H new ATOM 0 HA CYS A 3 0.409 -7.082 -0.032 1.00 23.33 H new ATOM 0 HB2 CYS A 3 -1.931 -5.448 -0.568 1.00 31.54 H new ATOM 0 HB3 CYS A 3 -2.409 -7.124 -0.381 1.00 31.54 H new ATOM 0 HG CYS A 3 -2.610 -6.684 2.201 1.00 31.24 H new ATOM 51 N PRO A 4 0.506 -8.624 -2.253 1.00 71.42 N ATOM 52 CA PRO A 4 0.435 -9.828 -3.086 1.00 33.24 C ATOM 53 C PRO A 4 0.181 -11.087 -2.264 1.00 2.20 C ATOM 54 O PRO A 4 0.044 -12.181 -2.812 1.00 45.24 O ATOM 55 CB PRO A 4 1.817 -9.887 -3.741 1.00 62.21 C ATOM 56 CG PRO A 4 2.713 -9.153 -2.804 1.00 30.35 C ATOM 57 CD PRO A 4 1.870 -8.072 -2.187 1.00 22.14 C ATOM 0 HA PRO A 4 -0.388 -9.783 -3.799 1.00 33.24 H new ATOM 0 HB2 PRO A 4 2.146 -10.917 -3.878 1.00 62.21 H new ATOM 0 HB3 PRO A 4 1.808 -9.421 -4.726 1.00 62.21 H new ATOM 0 HG2 PRO A 4 3.111 -9.821 -2.040 1.00 30.35 H new ATOM 0 HG3 PRO A 4 3.567 -8.729 -3.332 1.00 30.35 H new ATOM 0 HD2 PRO A 4 2.171 -7.865 -1.160 1.00 22.14 H new ATOM 0 HD3 PRO A 4 1.951 -7.135 -2.738 1.00 22.14 H new ATOM 65 N VAL A 5 0.118 -10.926 -0.946 1.00 71.21 N ATOM 66 CA VAL A 5 -0.121 -12.049 -0.049 1.00 62.42 C ATOM 67 C VAL A 5 -1.612 -12.341 0.080 1.00 73.21 C ATOM 68 O VAL A 5 -2.032 -13.499 0.058 1.00 51.04 O ATOM 69 CB VAL A 5 0.462 -11.783 1.352 1.00 22.40 C ATOM 70 CG1 VAL A 5 1.974 -11.635 1.282 1.00 53.15 C ATOM 71 CG2 VAL A 5 -0.175 -10.547 1.968 1.00 44.24 C ATOM 0 H VAL A 5 0.229 -10.028 -0.476 1.00 71.21 H new ATOM 0 HA VAL A 5 0.380 -12.914 -0.484 1.00 62.42 H new ATOM 0 HB VAL A 5 0.234 -12.637 1.990 1.00 22.40 H new ATOM 0 HG11 VAL A 5 2.368 -11.448 2.281 1.00 53.15 H new ATOM 0 HG12 VAL A 5 2.411 -12.551 0.886 1.00 53.15 H new ATOM 0 HG13 VAL A 5 2.228 -10.800 0.629 1.00 53.15 H new ATOM 0 HG21 VAL A 5 0.249 -10.374 2.957 1.00 44.24 H new ATOM 0 HG22 VAL A 5 0.020 -9.682 1.334 1.00 44.24 H new ATOM 0 HG23 VAL A 5 -1.251 -10.697 2.055 1.00 44.24 H new ATOM 81 N CYS A 6 -2.407 -11.285 0.215 1.00 22.52 N ATOM 82 CA CYS A 6 -3.852 -11.428 0.348 1.00 2.12 C ATOM 83 C CYS A 6 -4.580 -10.591 -0.699 1.00 24.23 C ATOM 84 O CYS A 6 -5.688 -10.928 -1.117 1.00 61.32 O ATOM 85 CB CYS A 6 -4.299 -11.014 1.751 1.00 5.25 C ATOM 86 SG CYS A 6 -5.694 -11.969 2.393 1.00 13.52 S ATOM 0 H CYS A 6 -2.075 -10.321 0.235 1.00 22.52 H new ATOM 0 HA CYS A 6 -4.105 -12.476 0.188 1.00 2.12 H new ATOM 0 HB2 CYS A 6 -3.456 -11.118 2.435 1.00 5.25 H new ATOM 0 HB3 CYS A 6 -4.571 -9.958 1.738 1.00 5.25 H new ATOM 0 HG CYS A 6 -5.997 -11.547 3.585 1.00 13.52 H new ATOM 92 N HIS A 7 -3.950 -9.497 -1.117 1.00 12.24 N ATOM 93 CA HIS A 7 -4.539 -8.611 -2.114 1.00 1.12 C ATOM 94 C HIS A 7 -5.769 -7.904 -1.554 1.00 5.22 C ATOM 95 O HIS A 7 -6.810 -7.839 -2.208 1.00 4.43 O ATOM 96 CB HIS A 7 -4.916 -9.399 -3.369 1.00 62.23 C ATOM 97 CG HIS A 7 -3.822 -10.293 -3.866 1.00 45.33 C ATOM 98 ND1 HIS A 7 -3.372 -11.483 -3.403 1.00 12.02 N flip ATOM 99 CD2 HIS A 7 -3.048 -9.995 -4.968 1.00 72.33 C flip ATOM 100 CE1 HIS A 7 -2.347 -11.879 -4.226 1.00 31.13 C flip ATOM 101 NE2 HIS A 7 -2.171 -10.964 -5.162 1.00 54.32 N flip ATOM 0 H HIS A 7 -3.033 -9.204 -0.781 1.00 12.24 H new ATOM 0 HA HIS A 7 -3.797 -7.857 -2.377 1.00 1.12 H new ATOM 0 HB2 HIS A 7 -5.799 -10.002 -3.158 1.00 62.23 H new ATOM 0 HB3 HIS A 7 -5.189 -8.699 -4.159 1.00 62.23 H new ATOM 0 HD2 HIS A 7 -3.144 -9.108 -5.577 1.00 72.33 H new ATOM 0 HE1 HIS A 7 -1.777 -12.791 -4.125 1.00 31.13 H new ATOM 0 HE2 HIS A 7 -1.476 -10.999 -5.908 1.00 54.32 H new ATOM 109 N GLN A 8 -5.642 -7.376 -0.341 1.00 75.22 N ATOM 110 CA GLN A 8 -6.745 -6.676 0.307 1.00 53.34 C ATOM 111 C GLN A 8 -6.490 -5.173 0.340 1.00 33.24 C ATOM 112 O GLN A 8 -7.103 -4.412 -0.407 1.00 24.34 O ATOM 113 CB GLN A 8 -6.947 -7.203 1.729 1.00 5.15 C ATOM 114 CG GLN A 8 -7.467 -8.630 1.780 1.00 63.42 C ATOM 115 CD GLN A 8 -8.961 -8.716 1.539 1.00 62.34 C ATOM 116 OE1 GLN A 8 -9.722 -7.849 1.969 1.00 35.22 O ATOM 117 NE2 GLN A 8 -9.390 -9.766 0.848 1.00 61.52 N ATOM 0 H GLN A 8 -4.787 -7.420 0.213 1.00 75.22 H new ATOM 0 HA GLN A 8 -7.650 -6.860 -0.272 1.00 53.34 H new ATOM 0 HB2 GLN A 8 -5.999 -7.151 2.265 1.00 5.15 H new ATOM 0 HB3 GLN A 8 -7.646 -6.551 2.253 1.00 5.15 H new ATOM 0 HG2 GLN A 8 -6.947 -9.229 1.032 1.00 63.42 H new ATOM 0 HG3 GLN A 8 -7.234 -9.063 2.753 1.00 63.42 H new ATOM 0 HE21 GLN A 8 -8.724 -10.461 0.510 1.00 61.52 H new ATOM 0 HE22 GLN A 8 -10.385 -9.877 0.655 1.00 61.52 H new ATOM 126 N GLY A 9 -5.580 -4.751 1.214 1.00 22.45 N ATOM 127 CA GLY A 9 -5.261 -3.340 1.329 1.00 5.51 C ATOM 128 C GLY A 9 -3.964 -2.980 0.631 1.00 52.11 C ATOM 129 O GLY A 9 -3.722 -3.404 -0.498 1.00 22.42 O ATOM 0 H GLY A 9 -5.059 -5.361 1.844 1.00 22.45 H new ATOM 0 HA2 GLY A 9 -6.074 -2.751 0.905 1.00 5.51 H new ATOM 0 HA3 GLY A 9 -5.189 -3.072 2.383 1.00 5.51 H new ATOM 133 N GLU A 10 -3.129 -2.195 1.305 1.00 40.24 N ATOM 134 CA GLU A 10 -1.852 -1.777 0.740 1.00 24.34 C ATOM 135 C GLU A 10 -0.855 -1.435 1.844 1.00 70.42 C ATOM 136 O GLU A 10 -0.754 -0.284 2.269 1.00 12.00 O ATOM 137 CB GLU A 10 -2.046 -0.569 -0.179 1.00 14.44 C ATOM 138 CG GLU A 10 -2.954 0.500 0.405 1.00 70.31 C ATOM 139 CD GLU A 10 -3.009 1.750 -0.452 1.00 4.40 C ATOM 140 OE1 GLU A 10 -3.626 1.699 -1.536 1.00 62.43 O ATOM 141 OE2 GLU A 10 -2.436 2.780 -0.038 1.00 30.31 O ATOM 0 H GLU A 10 -3.314 -1.836 2.242 1.00 40.24 H new ATOM 0 HA GLU A 10 -1.453 -2.607 0.157 1.00 24.34 H new ATOM 0 HB2 GLU A 10 -1.073 -0.128 -0.396 1.00 14.44 H new ATOM 0 HB3 GLU A 10 -2.461 -0.908 -1.128 1.00 14.44 H new ATOM 0 HG2 GLU A 10 -3.960 0.096 0.516 1.00 70.31 H new ATOM 0 HG3 GLU A 10 -2.604 0.763 1.403 1.00 70.31 H new ATOM 148 N MET A 11 -0.122 -2.443 2.304 1.00 22.43 N ATOM 149 CA MET A 11 0.868 -2.249 3.358 1.00 12.22 C ATOM 150 C MET A 11 1.771 -1.061 3.044 1.00 73.13 C ATOM 151 O MET A 11 2.647 -1.144 2.183 1.00 70.24 O ATOM 152 CB MET A 11 1.711 -3.514 3.533 1.00 13.21 C ATOM 153 CG MET A 11 1.826 -4.348 2.268 1.00 31.10 C ATOM 154 SD MET A 11 3.182 -5.535 2.339 1.00 11.41 S ATOM 155 CE MET A 11 3.087 -6.056 4.050 1.00 75.52 C ATOM 0 H MET A 11 -0.194 -3.402 1.964 1.00 22.43 H new ATOM 0 HA MET A 11 0.337 -2.043 4.288 1.00 12.22 H new ATOM 0 HB2 MET A 11 2.710 -3.232 3.864 1.00 13.21 H new ATOM 0 HB3 MET A 11 1.274 -4.125 4.323 1.00 13.21 H new ATOM 0 HG2 MET A 11 0.890 -4.881 2.103 1.00 31.10 H new ATOM 0 HG3 MET A 11 1.971 -3.687 1.414 1.00 31.10 H new ATOM 0 HE1 MET A 11 3.549 -7.037 4.158 1.00 75.52 H new ATOM 0 HE2 MET A 11 3.612 -5.337 4.679 1.00 75.52 H new ATOM 0 HE3 MET A 11 2.042 -6.111 4.356 1.00 75.52 H new ATOM 165 N VAL A 12 1.552 0.045 3.748 1.00 4.43 N ATOM 166 CA VAL A 12 2.346 1.251 3.545 1.00 44.02 C ATOM 167 C VAL A 12 2.622 1.957 4.868 1.00 54.05 C ATOM 168 O VAL A 12 1.700 2.255 5.628 1.00 64.13 O ATOM 169 CB VAL A 12 1.643 2.232 2.589 1.00 12.31 C ATOM 170 CG1 VAL A 12 0.223 2.512 3.059 1.00 11.34 C ATOM 171 CG2 VAL A 12 2.438 3.523 2.471 1.00 30.22 C ATOM 0 H VAL A 12 0.831 0.131 4.464 1.00 4.43 H new ATOM 0 HA VAL A 12 3.290 0.937 3.101 1.00 44.02 H new ATOM 0 HB VAL A 12 1.589 1.773 1.602 1.00 12.31 H new ATOM 0 HG11 VAL A 12 -0.258 3.207 2.371 1.00 11.34 H new ATOM 0 HG12 VAL A 12 -0.342 1.580 3.086 1.00 11.34 H new ATOM 0 HG13 VAL A 12 0.250 2.950 4.057 1.00 11.34 H new ATOM 0 HG21 VAL A 12 1.926 4.205 1.791 1.00 30.22 H new ATOM 0 HG22 VAL A 12 2.525 3.988 3.453 1.00 30.22 H new ATOM 0 HG23 VAL A 12 3.433 3.303 2.084 1.00 30.22 H new ATOM 181 N SER A 13 3.896 2.222 5.137 1.00 14.13 N ATOM 182 CA SER A 13 4.294 2.890 6.370 1.00 73.31 C ATOM 183 C SER A 13 3.452 4.140 6.607 1.00 23.34 C ATOM 184 O SER A 13 3.285 4.969 5.712 1.00 73.12 O ATOM 185 CB SER A 13 5.777 3.263 6.317 1.00 41.00 C ATOM 186 OG SER A 13 5.956 4.569 5.797 1.00 44.13 O ATOM 0 H SER A 13 4.671 1.984 4.517 1.00 14.13 H new ATOM 0 HA SER A 13 4.129 2.200 7.197 1.00 73.31 H new ATOM 0 HB2 SER A 13 6.206 3.205 7.317 1.00 41.00 H new ATOM 0 HB3 SER A 13 6.314 2.545 5.697 1.00 41.00 H new ATOM 0 HG SER A 13 6.912 4.784 5.775 1.00 44.13 H new ATOM 192 N GLY A 14 2.922 4.269 7.820 1.00 24.45 N ATOM 193 CA GLY A 14 2.103 5.419 8.153 1.00 42.21 C ATOM 194 C GLY A 14 1.576 5.363 9.573 1.00 62.21 C ATOM 195 O GLY A 14 0.428 4.979 9.801 1.00 74.04 O ATOM 0 H GLY A 14 3.046 3.597 8.578 1.00 24.45 H new ATOM 0 HA2 GLY A 14 2.689 6.329 8.022 1.00 42.21 H new ATOM 0 HA3 GLY A 14 1.264 5.477 7.459 1.00 42.21 H new ATOM 199 N ILE A 15 2.414 5.745 10.530 1.00 11.31 N ATOM 200 CA ILE A 15 2.025 5.736 11.935 1.00 74.44 C ATOM 201 C ILE A 15 0.568 6.152 12.104 1.00 23.42 C ATOM 202 O ILE A 15 0.054 6.977 11.349 1.00 55.14 O ATOM 203 CB ILE A 15 2.916 6.673 12.772 1.00 74.41 C ATOM 204 CG1 ILE A 15 3.473 7.798 11.898 1.00 62.23 C ATOM 205 CG2 ILE A 15 4.047 5.889 13.421 1.00 13.42 C ATOM 206 CD1 ILE A 15 2.403 8.616 11.210 1.00 12.43 C ATOM 0 H ILE A 15 3.367 6.065 10.358 1.00 11.31 H new ATOM 0 HA ILE A 15 2.152 4.714 12.291 1.00 74.44 H new ATOM 0 HB ILE A 15 2.310 7.118 13.561 1.00 74.41 H new ATOM 0 HG12 ILE A 15 4.083 8.458 12.515 1.00 62.23 H new ATOM 0 HG13 ILE A 15 4.132 7.368 11.143 1.00 62.23 H new ATOM 0 HG21 ILE A 15 4.668 6.565 14.009 1.00 13.42 H new ATOM 0 HG22 ILE A 15 3.630 5.120 14.072 1.00 13.42 H new ATOM 0 HG23 ILE A 15 4.654 5.419 12.648 1.00 13.42 H new ATOM 0 HD11 ILE A 15 2.871 9.395 10.608 1.00 12.43 H new ATOM 0 HD12 ILE A 15 1.808 7.968 10.566 1.00 12.43 H new ATOM 0 HD13 ILE A 15 1.758 9.075 11.959 1.00 12.43 H new ATOM 218 N LYS A 16 -0.093 5.576 13.103 1.00 32.12 N ATOM 219 CA LYS A 16 -1.491 5.888 13.375 1.00 73.34 C ATOM 220 C LYS A 16 -1.858 5.533 14.813 1.00 21.23 C ATOM 221 O LYS A 16 -0.982 5.303 15.648 1.00 25.30 O ATOM 222 CB LYS A 16 -2.403 5.133 12.405 1.00 53.42 C ATOM 223 CG LYS A 16 -2.395 3.628 12.609 1.00 12.45 C ATOM 224 CD LYS A 16 -1.653 2.917 11.490 1.00 3.02 C ATOM 225 CE LYS A 16 -2.616 2.303 10.485 1.00 52.12 C ATOM 226 NZ LYS A 16 -2.440 2.882 9.124 1.00 63.23 N ATOM 0 H LYS A 16 0.317 4.891 13.737 1.00 32.12 H new ATOM 0 HA LYS A 16 -1.631 6.960 13.236 1.00 73.34 H new ATOM 0 HB2 LYS A 16 -3.423 5.501 12.517 1.00 53.42 H new ATOM 0 HB3 LYS A 16 -2.095 5.354 11.383 1.00 53.42 H new ATOM 0 HG2 LYS A 16 -1.927 3.392 13.565 1.00 12.45 H new ATOM 0 HG3 LYS A 16 -3.420 3.261 12.657 1.00 12.45 H new ATOM 0 HD2 LYS A 16 -0.996 3.623 10.982 1.00 3.02 H new ATOM 0 HD3 LYS A 16 -1.018 2.137 11.911 1.00 3.02 H new ATOM 0 HE2 LYS A 16 -2.460 1.225 10.444 1.00 52.12 H new ATOM 0 HE3 LYS A 16 -3.641 2.464 10.819 1.00 52.12 H new ATOM 0 HZ1 LYS A 16 -3.028 2.358 8.445 1.00 63.23 H new ATOM 0 HZ2 LYS A 16 -2.728 3.881 9.132 1.00 63.23 H new ATOM 0 HZ3 LYS A 16 -1.441 2.812 8.843 1.00 63.23 H new ATOM 240 N ASP A 17 -3.155 5.489 15.094 1.00 43.33 N ATOM 241 CA ASP A 17 -3.637 5.159 16.430 1.00 75.12 C ATOM 242 C ASP A 17 -3.977 3.676 16.535 1.00 13.40 C ATOM 243 O ASP A 17 -4.871 3.184 15.846 1.00 2.53 O ATOM 244 CB ASP A 17 -4.866 6.002 16.775 1.00 2.30 C ATOM 245 CG ASP A 17 -5.771 6.222 15.579 1.00 51.55 C ATOM 246 OD1 ASP A 17 -6.649 5.368 15.335 1.00 3.04 O ATOM 247 OD2 ASP A 17 -5.601 7.247 14.886 1.00 32.43 O ATOM 0 H ASP A 17 -3.892 5.678 14.415 1.00 43.33 H new ATOM 0 HA ASP A 17 -2.841 5.382 17.141 1.00 75.12 H new ATOM 0 HB2 ASP A 17 -5.430 5.510 17.568 1.00 2.30 H new ATOM 0 HB3 ASP A 17 -4.543 6.967 17.165 1.00 2.30 H new ATOM 252 N ILE A 18 -3.257 2.969 17.400 1.00 43.31 N ATOM 253 CA ILE A 18 -3.483 1.542 17.594 1.00 44.12 C ATOM 254 C ILE A 18 -4.155 1.269 18.935 1.00 34.41 C ATOM 255 O ILE A 18 -3.500 1.100 19.963 1.00 21.11 O ATOM 256 CB ILE A 18 -2.165 0.748 17.522 1.00 61.55 C ATOM 257 CG1 ILE A 18 -1.565 0.840 16.118 1.00 71.03 C ATOM 258 CG2 ILE A 18 -2.399 -0.704 17.911 1.00 61.10 C ATOM 259 CD1 ILE A 18 -2.209 -0.101 15.123 1.00 44.14 C ATOM 0 H ILE A 18 -2.513 3.361 17.977 1.00 43.31 H new ATOM 0 HA ILE A 18 -4.140 1.214 16.788 1.00 44.12 H new ATOM 0 HB ILE A 18 -1.457 1.182 18.228 1.00 61.55 H new ATOM 0 HG12 ILE A 18 -1.665 1.863 15.755 1.00 71.03 H new ATOM 0 HG13 ILE A 18 -0.498 0.624 16.173 1.00 71.03 H new ATOM 0 HG21 ILE A 18 -1.458 -1.252 17.855 1.00 61.10 H new ATOM 0 HG22 ILE A 18 -2.786 -0.750 18.929 1.00 61.10 H new ATOM 0 HG23 ILE A 18 -3.121 -1.152 17.228 1.00 61.10 H new ATOM 0 HD11 ILE A 18 -1.734 0.018 14.149 1.00 44.14 H new ATOM 0 HD12 ILE A 18 -2.087 -1.129 15.463 1.00 44.14 H new ATOM 0 HD13 ILE A 18 -3.271 0.129 15.039 1.00 44.14 H new ATOM 271 N PRO A 19 -5.496 1.223 18.926 1.00 61.10 N ATOM 272 CA PRO A 19 -6.287 0.968 20.134 1.00 42.45 C ATOM 273 C PRO A 19 -6.143 -0.467 20.629 1.00 30.41 C ATOM 274 O PRO A 19 -6.821 -1.373 20.144 1.00 11.21 O ATOM 275 CB PRO A 19 -7.724 1.235 19.679 1.00 41.42 C ATOM 276 CG PRO A 19 -7.707 0.995 18.209 1.00 22.11 C ATOM 277 CD PRO A 19 -6.342 1.415 17.737 1.00 3.24 C ATOM 0 HA PRO A 19 -5.967 1.590 20.970 1.00 42.45 H new ATOM 0 HB2 PRO A 19 -8.428 0.571 20.180 1.00 41.42 H new ATOM 0 HB3 PRO A 19 -8.029 2.256 19.910 1.00 41.42 H new ATOM 0 HG2 PRO A 19 -7.892 -0.055 17.983 1.00 22.11 H new ATOM 0 HG3 PRO A 19 -8.487 1.571 17.710 1.00 22.11 H new ATOM 0 HD2 PRO A 19 -6.002 0.806 16.899 1.00 3.24 H new ATOM 0 HD3 PRO A 19 -6.334 2.452 17.402 1.00 3.24 H new ATOM 285 N TYR A 20 -5.257 -0.667 21.598 1.00 2.01 N ATOM 286 CA TYR A 20 -5.023 -1.993 22.158 1.00 52.44 C ATOM 287 C TYR A 20 -6.270 -2.513 22.866 1.00 43.32 C ATOM 288 O TYR A 20 -6.576 -3.705 22.816 1.00 11.13 O ATOM 289 CB TYR A 20 -3.846 -1.957 23.134 1.00 11.34 C ATOM 290 CG TYR A 20 -3.831 -3.114 24.108 1.00 43.13 C ATOM 291 CD1 TYR A 20 -3.267 -4.334 23.757 1.00 63.05 C ATOM 292 CD2 TYR A 20 -4.381 -2.986 25.377 1.00 3.22 C ATOM 293 CE1 TYR A 20 -3.251 -5.394 24.643 1.00 63.41 C ATOM 294 CE2 TYR A 20 -4.369 -4.041 26.270 1.00 32.41 C ATOM 295 CZ TYR A 20 -3.803 -5.242 25.898 1.00 62.41 C ATOM 296 OH TYR A 20 -3.790 -6.295 26.784 1.00 52.34 O ATOM 0 H TYR A 20 -4.689 0.072 22.012 1.00 2.01 H new ATOM 0 HA TYR A 20 -4.785 -2.669 21.337 1.00 52.44 H new ATOM 0 HB2 TYR A 20 -2.915 -1.958 22.567 1.00 11.34 H new ATOM 0 HB3 TYR A 20 -3.878 -1.022 23.694 1.00 11.34 H new ATOM 0 HD1 TYR A 20 -2.834 -4.456 22.775 1.00 63.05 H new ATOM 0 HD2 TYR A 20 -4.825 -2.047 25.671 1.00 3.22 H new ATOM 0 HE1 TYR A 20 -2.809 -6.336 24.355 1.00 63.41 H new ATOM 0 HE2 TYR A 20 -4.800 -3.925 27.253 1.00 32.41 H new ATOM 0 HH TYR A 20 -4.217 -6.022 27.623 1.00 52.34 H new ATOM 306 N THR A 21 -6.987 -1.610 23.527 1.00 31.31 N ATOM 307 CA THR A 21 -8.201 -1.975 24.247 1.00 30.23 C ATOM 308 C THR A 21 -9.364 -1.071 23.857 1.00 3.24 C ATOM 309 O THR A 21 -9.176 0.110 23.565 1.00 61.12 O ATOM 310 CB THR A 21 -7.995 -1.899 25.771 1.00 13.14 C ATOM 311 OG1 THR A 21 -7.158 -2.975 26.207 1.00 13.12 O ATOM 312 CG2 THR A 21 -9.328 -1.958 26.501 1.00 42.20 C ATOM 0 H THR A 21 -6.748 -0.620 23.579 1.00 31.31 H new ATOM 0 HA THR A 21 -8.435 -3.003 23.971 1.00 30.23 H new ATOM 0 HB THR A 21 -7.514 -0.949 26.003 1.00 13.14 H new ATOM 0 HG1 THR A 21 -6.219 -2.701 26.154 1.00 13.12 H new ATOM 0 HG21 THR A 21 -9.157 -1.903 27.576 1.00 42.20 H new ATOM 0 HG22 THR A 21 -9.951 -1.120 26.189 1.00 42.20 H new ATOM 0 HG23 THR A 21 -9.833 -2.894 26.262 1.00 42.20 H new ATOM 320 N PHE A 22 -10.569 -1.633 23.854 1.00 2.12 N ATOM 321 CA PHE A 22 -11.764 -0.877 23.499 1.00 12.21 C ATOM 322 C PHE A 22 -12.957 -1.318 24.342 1.00 64.04 C ATOM 323 O PHE A 22 -14.089 -1.362 23.861 1.00 42.24 O ATOM 324 CB PHE A 22 -12.083 -1.054 22.013 1.00 53.51 C ATOM 325 CG PHE A 22 -12.562 -2.434 21.663 1.00 13.14 C ATOM 326 CD1 PHE A 22 -11.718 -3.526 21.782 1.00 73.40 C ATOM 327 CD2 PHE A 22 -13.857 -2.639 21.214 1.00 1.01 C ATOM 328 CE1 PHE A 22 -12.156 -4.797 21.461 1.00 50.43 C ATOM 329 CE2 PHE A 22 -14.300 -3.908 20.892 1.00 4.03 C ATOM 330 CZ PHE A 22 -13.448 -4.988 21.014 1.00 22.50 C ATOM 0 H PHE A 22 -10.743 -2.609 24.093 1.00 2.12 H new ATOM 0 HA PHE A 22 -11.569 0.177 23.699 1.00 12.21 H new ATOM 0 HB2 PHE A 22 -12.845 -0.330 21.724 1.00 53.51 H new ATOM 0 HB3 PHE A 22 -11.191 -0.829 21.429 1.00 53.51 H new ATOM 0 HD1 PHE A 22 -10.706 -3.382 22.130 1.00 73.40 H new ATOM 0 HD2 PHE A 22 -14.527 -1.798 21.115 1.00 1.01 H new ATOM 0 HE1 PHE A 22 -11.488 -5.640 21.560 1.00 50.43 H new ATOM 0 HE2 PHE A 22 -15.312 -4.055 20.545 1.00 4.03 H new ATOM 0 HZ PHE A 22 -13.792 -5.980 20.760 1.00 22.50 H new ATOM 340 N ARG A 23 -12.694 -1.643 25.604 1.00 40.11 N ATOM 341 CA ARG A 23 -13.744 -2.083 26.515 1.00 50.31 C ATOM 342 C ARG A 23 -13.757 -1.231 27.781 1.00 23.44 C ATOM 343 O ARG A 23 -14.818 -0.878 28.293 1.00 71.45 O ATOM 344 CB ARG A 23 -13.549 -3.555 26.880 1.00 35.01 C ATOM 345 CG ARG A 23 -12.100 -3.931 27.141 1.00 42.41 C ATOM 346 CD ARG A 23 -11.516 -4.736 25.990 1.00 54.43 C ATOM 347 NE ARG A 23 -12.011 -6.109 25.977 1.00 32.22 N ATOM 348 CZ ARG A 23 -11.841 -6.942 24.955 1.00 12.30 C ATOM 349 NH1 ARG A 23 -11.192 -6.542 23.871 1.00 20.32 N ATOM 350 NH2 ARG A 23 -12.321 -8.177 25.018 1.00 51.43 N ATOM 0 H ARG A 23 -11.763 -1.610 26.019 1.00 40.11 H new ATOM 0 HA ARG A 23 -14.702 -1.966 26.009 1.00 50.31 H new ATOM 0 HB2 ARG A 23 -14.140 -3.782 27.767 1.00 35.01 H new ATOM 0 HB3 ARG A 23 -13.937 -4.175 26.072 1.00 35.01 H new ATOM 0 HG2 ARG A 23 -11.510 -3.027 27.290 1.00 42.41 H new ATOM 0 HG3 ARG A 23 -12.034 -4.510 28.062 1.00 42.41 H new ATOM 0 HD2 ARG A 23 -11.765 -4.252 25.046 1.00 54.43 H new ATOM 0 HD3 ARG A 23 -10.429 -4.743 26.067 1.00 54.43 H new ATOM 0 HE ARG A 23 -12.515 -6.448 26.797 1.00 32.22 H new ATOM 0 HH11 ARG A 23 -10.822 -5.593 23.819 1.00 20.32 H new ATOM 0 HH12 ARG A 23 -11.063 -7.183 23.088 1.00 20.32 H new ATOM 0 HH21 ARG A 23 -12.821 -8.488 25.851 1.00 51.43 H new ATOM 0 HH22 ARG A 23 -12.190 -8.816 24.233 1.00 51.43 H new ATOM 364 N GLY A 24 -12.568 -0.904 28.280 1.00 12.53 N ATOM 365 CA GLY A 24 -12.465 -0.097 29.482 1.00 64.21 C ATOM 366 C GLY A 24 -11.131 0.614 29.590 1.00 55.11 C ATOM 367 O GLY A 24 -11.080 1.841 29.681 1.00 61.35 O ATOM 0 H GLY A 24 -11.675 -1.183 27.873 1.00 12.53 H new ATOM 0 HA2 GLY A 24 -13.268 0.640 29.491 1.00 64.21 H new ATOM 0 HA3 GLY A 24 -12.606 -0.733 30.356 1.00 64.21 H new ATOM 371 N ARG A 25 -10.049 -0.157 29.582 1.00 74.32 N ATOM 372 CA ARG A 25 -8.708 0.407 29.683 1.00 25.35 C ATOM 373 C ARG A 25 -8.133 0.694 28.299 1.00 63.35 C ATOM 374 O ARG A 25 -6.985 0.358 28.010 1.00 71.20 O ATOM 375 CB ARG A 25 -7.786 -0.549 30.442 1.00 12.43 C ATOM 376 CG ARG A 25 -7.571 -1.878 29.736 1.00 15.33 C ATOM 377 CD ARG A 25 -8.545 -2.935 30.231 1.00 1.30 C ATOM 378 NE ARG A 25 -7.926 -4.255 30.310 1.00 73.30 N ATOM 379 CZ ARG A 25 -8.480 -5.291 30.930 1.00 52.41 C ATOM 380 NH1 ARG A 25 -9.660 -5.160 31.522 1.00 12.12 N ATOM 381 NH2 ARG A 25 -7.855 -6.461 30.960 1.00 0.21 N ATOM 0 H ARG A 25 -10.074 -1.174 29.507 1.00 74.32 H new ATOM 0 HA ARG A 25 -8.776 1.347 30.231 1.00 25.35 H new ATOM 0 HB2 ARG A 25 -6.820 -0.066 30.592 1.00 12.43 H new ATOM 0 HB3 ARG A 25 -8.205 -0.736 31.431 1.00 12.43 H new ATOM 0 HG2 ARG A 25 -7.693 -1.744 28.661 1.00 15.33 H new ATOM 0 HG3 ARG A 25 -6.549 -2.218 29.901 1.00 15.33 H new ATOM 0 HD2 ARG A 25 -8.920 -2.651 31.214 1.00 1.30 H new ATOM 0 HD3 ARG A 25 -9.405 -2.977 29.562 1.00 1.30 H new ATOM 0 HE ARG A 25 -7.018 -4.389 29.865 1.00 73.30 H new ATOM 0 HH11 ARG A 25 -10.144 -4.262 31.502 1.00 12.12 H new ATOM 0 HH12 ARG A 25 -10.083 -5.957 31.997 1.00 12.12 H new ATOM 0 HH21 ARG A 25 -6.947 -6.566 30.506 1.00 0.21 H new ATOM 0 HH22 ARG A 25 -8.282 -7.255 31.437 1.00 0.21 H new ATOM 395 N LYS A 26 -8.940 1.316 27.447 1.00 21.42 N ATOM 396 CA LYS A 26 -8.513 1.650 26.093 1.00 43.14 C ATOM 397 C LYS A 26 -7.203 2.431 26.113 1.00 43.24 C ATOM 398 O LYS A 26 -7.138 3.543 26.637 1.00 31.25 O ATOM 399 CB LYS A 26 -9.595 2.466 25.381 1.00 73.32 C ATOM 400 CG LYS A 26 -9.177 2.964 24.009 1.00 22.50 C ATOM 401 CD LYS A 26 -10.361 3.048 23.061 1.00 23.31 C ATOM 402 CE LYS A 26 -9.936 3.510 21.676 1.00 34.31 C ATOM 403 NZ LYS A 26 -10.261 4.945 21.446 1.00 53.14 N ATOM 0 H LYS A 26 -9.894 1.599 27.670 1.00 21.42 H new ATOM 0 HA LYS A 26 -8.352 0.719 25.549 1.00 43.14 H new ATOM 0 HB2 LYS A 26 -10.491 1.854 25.279 1.00 73.32 H new ATOM 0 HB3 LYS A 26 -9.862 3.321 26.003 1.00 73.32 H new ATOM 0 HG2 LYS A 26 -8.715 3.947 24.103 1.00 22.50 H new ATOM 0 HG3 LYS A 26 -8.423 2.296 23.593 1.00 22.50 H new ATOM 0 HD2 LYS A 26 -10.840 2.072 22.989 1.00 23.31 H new ATOM 0 HD3 LYS A 26 -11.103 3.738 23.464 1.00 23.31 H new ATOM 0 HE2 LYS A 26 -8.864 3.357 21.555 1.00 34.31 H new ATOM 0 HE3 LYS A 26 -10.432 2.900 20.921 1.00 34.31 H new ATOM 0 HZ1 LYS A 26 -9.956 5.221 20.491 1.00 53.14 H new ATOM 0 HZ2 LYS A 26 -11.287 5.087 21.536 1.00 53.14 H new ATOM 0 HZ3 LYS A 26 -9.767 5.530 22.150 1.00 53.14 H new ATOM 417 N THR A 27 -6.160 1.842 25.536 1.00 73.42 N ATOM 418 CA THR A 27 -4.851 2.482 25.487 1.00 63.02 C ATOM 419 C THR A 27 -4.276 2.449 24.076 1.00 55.04 C ATOM 420 O THR A 27 -3.613 1.487 23.687 1.00 63.21 O ATOM 421 CB THR A 27 -3.858 1.806 26.451 1.00 62.33 C ATOM 422 OG1 THR A 27 -2.529 2.272 26.191 1.00 51.03 O ATOM 423 CG2 THR A 27 -3.908 0.292 26.305 1.00 30.31 C ATOM 0 H THR A 27 -6.196 0.923 25.096 1.00 73.42 H new ATOM 0 HA THR A 27 -4.994 3.518 25.794 1.00 63.02 H new ATOM 0 HB THR A 27 -4.141 2.066 27.471 1.00 62.33 H new ATOM 0 HG1 THR A 27 -2.012 2.266 27.023 1.00 51.03 H new ATOM 0 HG21 THR A 27 -3.198 -0.164 26.996 1.00 30.31 H new ATOM 0 HG22 THR A 27 -4.914 -0.062 26.532 1.00 30.31 H new ATOM 0 HG23 THR A 27 -3.648 0.016 25.283 1.00 30.31 H new ATOM 431 N VAL A 28 -4.531 3.507 23.313 1.00 64.23 N ATOM 432 CA VAL A 28 -4.037 3.600 21.944 1.00 43.33 C ATOM 433 C VAL A 28 -2.555 3.960 21.919 1.00 11.02 C ATOM 434 O VAL A 28 -2.132 4.938 22.535 1.00 70.13 O ATOM 435 CB VAL A 28 -4.822 4.648 21.133 1.00 73.31 C ATOM 436 CG1 VAL A 28 -4.355 4.662 19.686 1.00 72.32 C ATOM 437 CG2 VAL A 28 -6.316 4.375 21.217 1.00 33.52 C ATOM 0 H VAL A 28 -5.077 4.312 23.620 1.00 64.23 H new ATOM 0 HA VAL A 28 -4.179 2.620 21.489 1.00 43.33 H new ATOM 0 HB VAL A 28 -4.631 5.632 21.561 1.00 73.31 H new ATOM 0 HG11 VAL A 28 -4.921 5.408 19.128 1.00 72.32 H new ATOM 0 HG12 VAL A 28 -3.294 4.908 19.649 1.00 72.32 H new ATOM 0 HG13 VAL A 28 -4.515 3.679 19.242 1.00 72.32 H new ATOM 0 HG21 VAL A 28 -6.856 5.125 20.639 1.00 33.52 H new ATOM 0 HG22 VAL A 28 -6.528 3.384 20.815 1.00 33.52 H new ATOM 0 HG23 VAL A 28 -6.636 4.420 22.258 1.00 33.52 H new ATOM 447 N LEU A 29 -1.771 3.163 21.201 1.00 13.11 N ATOM 448 CA LEU A 29 -0.335 3.397 21.094 1.00 1.40 C ATOM 449 C LEU A 29 -0.028 4.398 19.984 1.00 44.03 C ATOM 450 O LEU A 29 0.804 4.141 19.114 1.00 33.53 O ATOM 451 CB LEU A 29 0.397 2.081 20.826 1.00 43.31 C ATOM 452 CG LEU A 29 0.012 0.904 21.723 1.00 33.35 C ATOM 453 CD1 LEU A 29 -0.378 1.394 23.109 1.00 43.42 C ATOM 454 CD2 LEU A 29 -1.124 0.107 21.098 1.00 62.31 C ATOM 0 H LEU A 29 -2.105 2.349 20.685 1.00 13.11 H new ATOM 0 HA LEU A 29 0.012 3.813 22.040 1.00 1.40 H new ATOM 0 HB2 LEU A 29 0.220 1.795 19.789 1.00 43.31 H new ATOM 0 HB3 LEU A 29 1.468 2.256 20.930 1.00 43.31 H new ATOM 0 HG LEU A 29 0.878 0.249 21.822 1.00 33.35 H new ATOM 0 HD11 LEU A 29 -0.649 0.542 23.733 1.00 43.42 H new ATOM 0 HD12 LEU A 29 0.464 1.921 23.559 1.00 43.42 H new ATOM 0 HD13 LEU A 29 -1.229 2.071 23.030 1.00 43.42 H new ATOM 0 HD21 LEU A 29 -1.385 -0.727 21.750 1.00 62.31 H new ATOM 0 HD22 LEU A 29 -1.993 0.752 20.968 1.00 62.31 H new ATOM 0 HD23 LEU A 29 -0.809 -0.276 20.127 1.00 62.31 H new ATOM 466 N LYS A 30 -0.705 5.541 20.022 1.00 2.35 N ATOM 467 CA LYS A 30 -0.503 6.583 19.023 1.00 35.13 C ATOM 468 C LYS A 30 0.969 6.690 18.637 1.00 61.11 C ATOM 469 O LYS A 30 1.791 7.172 19.415 1.00 71.22 O ATOM 470 CB LYS A 30 -1.001 7.930 19.553 1.00 3.14 C ATOM 471 CG LYS A 30 -2.426 7.888 20.076 1.00 20.41 C ATOM 472 CD LYS A 30 -2.949 9.282 20.380 1.00 41.14 C ATOM 473 CE LYS A 30 -3.763 9.304 21.665 1.00 63.25 C ATOM 474 NZ LYS A 30 -4.820 8.256 21.670 1.00 23.21 N ATOM 0 H LYS A 30 -1.399 5.769 20.734 1.00 2.35 H new ATOM 0 HA LYS A 30 -1.075 6.315 18.135 1.00 35.13 H new ATOM 0 HB2 LYS A 30 -0.339 8.264 20.352 1.00 3.14 H new ATOM 0 HB3 LYS A 30 -0.937 8.671 18.756 1.00 3.14 H new ATOM 0 HG2 LYS A 30 -3.071 7.409 19.339 1.00 20.41 H new ATOM 0 HG3 LYS A 30 -2.466 7.279 20.979 1.00 20.41 H new ATOM 0 HD2 LYS A 30 -2.112 9.975 20.466 1.00 41.14 H new ATOM 0 HD3 LYS A 30 -3.566 9.629 19.551 1.00 41.14 H new ATOM 0 HE2 LYS A 30 -3.100 9.155 22.517 1.00 63.25 H new ATOM 0 HE3 LYS A 30 -4.223 10.285 21.787 1.00 63.25 H new ATOM 0 HZ1 LYS A 30 -5.728 8.680 21.947 1.00 23.21 H new ATOM 0 HZ2 LYS A 30 -4.906 7.845 20.719 1.00 23.21 H new ATOM 0 HZ3 LYS A 30 -4.566 7.509 22.348 1.00 23.21 H new ATOM 488 N GLY A 31 1.295 6.237 17.430 1.00 72.21 N ATOM 489 CA GLY A 31 2.667 6.291 16.963 1.00 31.14 C ATOM 490 C GLY A 31 3.229 4.918 16.651 1.00 44.11 C ATOM 491 O GLY A 31 4.344 4.590 17.058 1.00 41.30 O ATOM 0 H GLY A 31 0.633 5.834 16.768 1.00 72.21 H new ATOM 0 HA2 GLY A 31 2.719 6.913 16.069 1.00 31.14 H new ATOM 0 HA3 GLY A 31 3.287 6.770 17.721 1.00 31.14 H new ATOM 495 N ILE A 32 2.455 4.114 15.930 1.00 41.34 N ATOM 496 CA ILE A 32 2.882 2.769 15.566 1.00 61.50 C ATOM 497 C ILE A 32 3.225 2.684 14.082 1.00 51.20 C ATOM 498 O ILE A 32 2.360 2.419 13.248 1.00 55.41 O ATOM 499 CB ILE A 32 1.796 1.726 15.890 1.00 51.41 C ATOM 500 CG1 ILE A 32 1.377 1.834 17.357 1.00 33.55 C ATOM 501 CG2 ILE A 32 2.298 0.324 15.579 1.00 13.22 C ATOM 502 CD1 ILE A 32 2.543 1.978 18.310 1.00 44.04 C ATOM 0 H ILE A 32 1.529 4.371 15.587 1.00 41.34 H new ATOM 0 HA ILE A 32 3.772 2.550 16.156 1.00 61.50 H new ATOM 0 HB ILE A 32 0.924 1.925 15.267 1.00 51.41 H new ATOM 0 HG12 ILE A 32 0.714 2.691 17.475 1.00 33.55 H new ATOM 0 HG13 ILE A 32 0.804 0.948 17.629 1.00 33.55 H new ATOM 0 HG21 ILE A 32 1.519 -0.402 15.813 1.00 13.22 H new ATOM 0 HG22 ILE A 32 2.552 0.255 14.521 1.00 13.22 H new ATOM 0 HG23 ILE A 32 3.183 0.113 16.179 1.00 13.22 H new ATOM 0 HD11 ILE A 32 2.171 2.049 19.332 1.00 44.04 H new ATOM 0 HD12 ILE A 32 3.195 1.109 18.221 1.00 44.04 H new ATOM 0 HD13 ILE A 32 3.104 2.880 18.065 1.00 44.04 H new ATOM 514 N HIS A 33 4.495 2.910 13.761 1.00 21.31 N ATOM 515 CA HIS A 33 4.955 2.856 12.377 1.00 41.35 C ATOM 516 C HIS A 33 5.042 1.414 11.889 1.00 44.10 C ATOM 517 O HIS A 33 5.205 0.488 12.682 1.00 61.35 O ATOM 518 CB HIS A 33 6.318 3.535 12.244 1.00 5.35 C ATOM 519 CG HIS A 33 6.413 4.463 11.072 1.00 0.30 C ATOM 520 ND1 HIS A 33 7.391 5.428 10.953 1.00 33.31 N ATOM 521 CD2 HIS A 33 5.646 4.568 9.961 1.00 31.24 C ATOM 522 CE1 HIS A 33 7.220 6.088 9.821 1.00 30.21 C ATOM 523 NE2 HIS A 33 6.168 5.585 9.200 1.00 1.41 N ATOM 0 H HIS A 33 5.224 3.132 14.439 1.00 21.31 H new ATOM 0 HA HIS A 33 4.231 3.387 11.759 1.00 41.35 H new ATOM 0 HB2 HIS A 33 6.527 4.093 13.157 1.00 5.35 H new ATOM 0 HB3 HIS A 33 7.089 2.770 12.154 1.00 5.35 H new ATOM 0 HD2 HIS A 33 4.784 3.964 9.718 1.00 31.24 H new ATOM 0 HE1 HIS A 33 7.836 6.900 9.464 1.00 30.21 H new ATOM 0 HE2 HIS A 33 5.803 5.901 8.301 1.00 1.41 H new ATOM 531 N GLY A 34 4.931 1.230 10.576 1.00 2.15 N ATOM 532 CA GLY A 34 4.999 -0.102 10.005 1.00 52.54 C ATOM 533 C GLY A 34 4.574 -0.132 8.551 1.00 1.24 C ATOM 534 O GLY A 34 5.284 0.369 7.678 1.00 24.33 O ATOM 0 H GLY A 34 4.795 1.980 9.898 1.00 2.15 H new ATOM 0 HA2 GLY A 34 6.018 -0.479 10.090 1.00 52.54 H new ATOM 0 HA3 GLY A 34 4.362 -0.774 10.580 1.00 52.54 H new ATOM 538 N LEU A 35 3.412 -0.721 8.287 1.00 71.40 N ATOM 539 CA LEU A 35 2.894 -0.816 6.927 1.00 65.11 C ATOM 540 C LEU A 35 1.379 -0.994 6.933 1.00 20.50 C ATOM 541 O LEU A 35 0.875 -2.117 6.905 1.00 71.20 O ATOM 542 CB LEU A 35 3.553 -1.982 6.189 1.00 12.11 C ATOM 543 CG LEU A 35 5.015 -1.783 5.789 1.00 35.34 C ATOM 544 CD1 LEU A 35 5.543 -3.012 5.066 1.00 55.23 C ATOM 545 CD2 LEU A 35 5.166 -0.544 4.918 1.00 3.10 C ATOM 0 H LEU A 35 2.811 -1.140 8.997 1.00 71.40 H new ATOM 0 HA LEU A 35 3.130 0.113 6.409 1.00 65.11 H new ATOM 0 HB2 LEU A 35 3.487 -2.869 6.820 1.00 12.11 H new ATOM 0 HB3 LEU A 35 2.976 -2.188 5.288 1.00 12.11 H new ATOM 0 HG LEU A 35 5.603 -1.640 6.696 1.00 35.34 H new ATOM 0 HD11 LEU A 35 6.585 -2.852 4.789 1.00 55.23 H new ATOM 0 HD12 LEU A 35 5.471 -3.879 5.723 1.00 55.23 H new ATOM 0 HD13 LEU A 35 4.952 -3.187 4.167 1.00 55.23 H new ATOM 0 HD21 LEU A 35 6.213 -0.418 4.643 1.00 3.10 H new ATOM 0 HD22 LEU A 35 4.565 -0.658 4.016 1.00 3.10 H new ATOM 0 HD23 LEU A 35 4.828 0.333 5.471 1.00 3.10 H new ATOM 557 N TYR A 36 0.658 0.121 6.968 1.00 22.33 N ATOM 558 CA TYR A 36 -0.800 0.088 6.977 1.00 32.35 C ATOM 559 C TYR A 36 -1.378 1.425 6.523 1.00 40.42 C ATOM 560 O TYR A 36 -0.698 2.451 6.555 1.00 31.45 O ATOM 561 CB TYR A 36 -1.314 -0.253 8.377 1.00 23.13 C ATOM 562 CG TYR A 36 -0.242 -0.211 9.443 1.00 4.35 C ATOM 563 CD1 TYR A 36 0.394 0.980 9.768 1.00 20.32 C ATOM 564 CD2 TYR A 36 0.134 -1.362 10.123 1.00 55.33 C ATOM 565 CE1 TYR A 36 1.375 1.024 10.741 1.00 34.01 C ATOM 566 CE2 TYR A 36 1.112 -1.328 11.098 1.00 74.14 C ATOM 567 CZ TYR A 36 1.730 -0.133 11.403 1.00 52.55 C ATOM 568 OH TYR A 36 2.705 -0.095 12.373 1.00 34.52 O ATOM 0 H TYR A 36 1.059 1.059 6.991 1.00 22.33 H new ATOM 0 HA TYR A 36 -1.125 -0.684 6.279 1.00 32.35 H new ATOM 0 HB2 TYR A 36 -2.107 0.445 8.644 1.00 23.13 H new ATOM 0 HB3 TYR A 36 -1.758 -1.248 8.359 1.00 23.13 H new ATOM 0 HD1 TYR A 36 0.117 1.887 9.252 1.00 20.32 H new ATOM 0 HD2 TYR A 36 -0.346 -2.300 9.886 1.00 55.33 H new ATOM 0 HE1 TYR A 36 1.860 1.958 10.981 1.00 34.01 H new ATOM 0 HE2 TYR A 36 1.391 -2.232 11.619 1.00 74.14 H new ATOM 0 HH TYR A 36 2.790 0.819 12.716 1.00 34.52 H new ATOM 578 N CYS A 37 -2.637 1.405 6.101 1.00 44.21 N ATOM 579 CA CYS A 37 -3.309 2.615 5.640 1.00 41.34 C ATOM 580 C CYS A 37 -4.794 2.357 5.405 1.00 73.40 C ATOM 581 O CYS A 37 -5.639 3.187 5.737 1.00 63.34 O ATOM 582 CB CYS A 37 -2.658 3.126 4.354 1.00 10.50 C ATOM 583 SG CYS A 37 -3.532 4.508 3.582 1.00 50.45 S ATOM 0 H CYS A 37 -3.214 0.564 6.068 1.00 44.21 H new ATOM 0 HA CYS A 37 -3.209 3.374 6.416 1.00 41.34 H new ATOM 0 HB2 CYS A 37 -1.636 3.434 4.575 1.00 10.50 H new ATOM 0 HB3 CYS A 37 -2.596 2.305 3.640 1.00 10.50 H new ATOM 0 HG CYS A 37 -2.904 4.870 2.503 1.00 50.45 H new ATOM 589 N VAL A 38 -5.104 1.200 4.827 1.00 51.21 N ATOM 590 CA VAL A 38 -6.486 0.832 4.546 1.00 35.21 C ATOM 591 C VAL A 38 -6.864 -0.466 5.252 1.00 23.54 C ATOM 592 O VAL A 38 -7.920 -0.561 5.876 1.00 53.44 O ATOM 593 CB VAL A 38 -6.728 0.671 3.034 1.00 1.32 C ATOM 594 CG1 VAL A 38 -5.661 -0.219 2.414 1.00 24.02 C ATOM 595 CG2 VAL A 38 -8.118 0.110 2.773 1.00 44.33 C ATOM 0 H VAL A 38 -4.416 0.502 4.545 1.00 51.21 H new ATOM 0 HA VAL A 38 -7.112 1.642 4.922 1.00 35.21 H new ATOM 0 HB VAL A 38 -6.664 1.654 2.567 1.00 1.32 H new ATOM 0 HG11 VAL A 38 -5.849 -0.321 1.345 1.00 24.02 H new ATOM 0 HG12 VAL A 38 -4.679 0.228 2.569 1.00 24.02 H new ATOM 0 HG13 VAL A 38 -5.690 -1.202 2.883 1.00 24.02 H new ATOM 0 HG21 VAL A 38 -8.271 0.003 1.699 1.00 44.33 H new ATOM 0 HG22 VAL A 38 -8.213 -0.864 3.252 1.00 44.33 H new ATOM 0 HG23 VAL A 38 -8.867 0.789 3.181 1.00 44.33 H new ATOM 605 N HIS A 39 -5.992 -1.464 5.148 1.00 71.53 N ATOM 606 CA HIS A 39 -6.234 -2.758 5.777 1.00 22.14 C ATOM 607 C HIS A 39 -5.621 -2.805 7.173 1.00 4.11 C ATOM 608 O HIS A 39 -4.876 -1.906 7.566 1.00 22.13 O ATOM 609 CB HIS A 39 -5.658 -3.883 4.916 1.00 50.11 C ATOM 610 CG HIS A 39 -4.175 -3.795 4.730 1.00 45.35 C ATOM 611 ND1 HIS A 39 -3.399 -2.815 5.313 1.00 11.13 N ATOM 612 CD2 HIS A 39 -3.324 -4.574 4.021 1.00 35.14 C ATOM 613 CE1 HIS A 39 -2.136 -2.994 4.970 1.00 50.41 C ATOM 614 NE2 HIS A 39 -2.063 -4.055 4.186 1.00 62.33 N ATOM 0 H HIS A 39 -5.113 -1.402 4.635 1.00 71.53 H new ATOM 0 HA HIS A 39 -7.312 -2.895 5.867 1.00 22.14 H new ATOM 0 HB2 HIS A 39 -5.902 -4.841 5.374 1.00 50.11 H new ATOM 0 HB3 HIS A 39 -6.140 -3.865 3.939 1.00 50.11 H new ATOM 0 HD1 HIS A 39 -3.746 -2.068 5.915 1.00 11.13 H new ATOM 0 HD2 HIS A 39 -3.588 -5.442 3.435 1.00 35.14 H new ATOM 0 HE1 HIS A 39 -1.304 -2.378 5.278 1.00 50.41 H new ATOM 622 N CYS A 40 -5.939 -3.858 7.918 1.00 74.13 N ATOM 623 CA CYS A 40 -5.421 -4.022 9.272 1.00 13.42 C ATOM 624 C CYS A 40 -5.015 -5.470 9.527 1.00 1.34 C ATOM 625 O CYS A 40 -4.926 -5.906 10.674 1.00 33.12 O ATOM 626 CB CYS A 40 -6.467 -3.585 10.297 1.00 24.25 C ATOM 627 SG CYS A 40 -5.913 -2.264 11.400 1.00 43.44 S ATOM 0 H CYS A 40 -6.553 -4.611 7.607 1.00 74.13 H new ATOM 0 HA CYS A 40 -4.537 -3.392 9.375 1.00 13.42 H new ATOM 0 HB2 CYS A 40 -7.360 -3.252 9.769 1.00 24.25 H new ATOM 0 HB3 CYS A 40 -6.755 -4.448 10.897 1.00 24.25 H new ATOM 0 HG CYS A 40 -6.868 -1.962 12.229 1.00 43.44 H new ATOM 633 N GLU A 41 -4.772 -6.210 8.449 1.00 13.33 N ATOM 634 CA GLU A 41 -4.378 -7.610 8.558 1.00 54.20 C ATOM 635 C GLU A 41 -2.934 -7.805 8.105 1.00 41.35 C ATOM 636 O GLU A 41 -2.080 -8.225 8.885 1.00 5.33 O ATOM 637 CB GLU A 41 -5.309 -8.491 7.723 1.00 45.52 C ATOM 638 CG GLU A 41 -6.652 -8.754 8.383 1.00 3.22 C ATOM 639 CD GLU A 41 -7.281 -10.056 7.927 1.00 14.41 C ATOM 640 OE1 GLU A 41 -6.773 -11.129 8.315 1.00 11.32 O ATOM 641 OE2 GLU A 41 -8.283 -10.002 7.183 1.00 43.24 O ATOM 0 H GLU A 41 -4.841 -5.864 7.492 1.00 13.33 H new ATOM 0 HA GLU A 41 -4.455 -7.902 9.605 1.00 54.20 H new ATOM 0 HB2 GLU A 41 -5.476 -8.015 6.757 1.00 45.52 H new ATOM 0 HB3 GLU A 41 -4.816 -9.444 7.529 1.00 45.52 H new ATOM 0 HG2 GLU A 41 -6.523 -8.777 9.465 1.00 3.22 H new ATOM 0 HG3 GLU A 41 -7.330 -7.930 8.160 1.00 3.22 H new ATOM 648 N GLU A 42 -2.670 -7.498 6.839 1.00 65.02 N ATOM 649 CA GLU A 42 -1.330 -7.642 6.282 1.00 10.03 C ATOM 650 C GLU A 42 -0.429 -6.494 6.729 1.00 2.12 C ATOM 651 O GLU A 42 0.066 -5.723 5.907 1.00 61.34 O ATOM 652 CB GLU A 42 -1.391 -7.691 4.754 1.00 23.25 C ATOM 653 CG GLU A 42 -0.042 -7.935 4.098 1.00 31.20 C ATOM 654 CD GLU A 42 0.788 -8.967 4.837 1.00 43.02 C ATOM 655 OE1 GLU A 42 0.275 -10.081 5.074 1.00 50.24 O ATOM 656 OE2 GLU A 42 1.949 -8.660 5.179 1.00 63.54 O ATOM 0 H GLU A 42 -3.366 -7.148 6.180 1.00 65.02 H new ATOM 0 HA GLU A 42 -0.909 -8.577 6.652 1.00 10.03 H new ATOM 0 HB2 GLU A 42 -2.080 -8.479 4.451 1.00 23.25 H new ATOM 0 HB3 GLU A 42 -1.800 -6.751 4.385 1.00 23.25 H new ATOM 0 HG2 GLU A 42 -0.196 -8.266 3.071 1.00 31.20 H new ATOM 0 HG3 GLU A 42 0.510 -6.996 4.051 1.00 31.20 H new ATOM 663 N SER A 43 -0.222 -6.387 8.038 1.00 34.12 N ATOM 664 CA SER A 43 0.615 -5.332 8.596 1.00 71.31 C ATOM 665 C SER A 43 2.042 -5.828 8.813 1.00 42.31 C ATOM 666 O SER A 43 2.274 -7.024 8.989 1.00 74.12 O ATOM 667 CB SER A 43 0.030 -4.832 9.918 1.00 61.50 C ATOM 668 OG SER A 43 -0.356 -5.916 10.746 1.00 24.42 O ATOM 0 H SER A 43 -0.623 -7.018 8.732 1.00 34.12 H new ATOM 0 HA SER A 43 0.640 -4.507 7.884 1.00 71.31 H new ATOM 0 HB2 SER A 43 0.767 -4.218 10.437 1.00 61.50 H new ATOM 0 HB3 SER A 43 -0.833 -4.196 9.720 1.00 61.50 H new ATOM 0 HG SER A 43 -0.725 -5.571 11.586 1.00 24.42 H new ATOM 674 N ILE A 44 2.992 -4.900 8.800 1.00 31.12 N ATOM 675 CA ILE A 44 4.396 -5.241 8.996 1.00 74.12 C ATOM 676 C ILE A 44 5.102 -4.194 9.851 1.00 51.11 C ATOM 677 O ILE A 44 4.870 -2.995 9.699 1.00 21.11 O ATOM 678 CB ILE A 44 5.136 -5.375 7.652 1.00 0.13 C ATOM 679 CG1 ILE A 44 4.723 -6.667 6.944 1.00 2.44 C ATOM 680 CG2 ILE A 44 6.641 -5.343 7.871 1.00 73.44 C ATOM 681 CD1 ILE A 44 5.124 -7.920 7.691 1.00 54.21 C ATOM 0 H ILE A 44 2.816 -3.906 8.656 1.00 31.12 H new ATOM 0 HA ILE A 44 4.418 -6.202 9.511 1.00 74.12 H new ATOM 0 HB ILE A 44 4.862 -4.532 7.018 1.00 0.13 H new ATOM 0 HG12 ILE A 44 3.642 -6.666 6.806 1.00 2.44 H new ATOM 0 HG13 ILE A 44 5.171 -6.687 5.951 1.00 2.44 H new ATOM 0 HG21 ILE A 44 7.150 -5.439 6.912 1.00 73.44 H new ATOM 0 HG22 ILE A 44 6.921 -4.399 8.338 1.00 73.44 H new ATOM 0 HG23 ILE A 44 6.932 -6.169 8.520 1.00 73.44 H new ATOM 0 HD11 ILE A 44 4.799 -8.797 7.131 1.00 54.21 H new ATOM 0 HD12 ILE A 44 6.208 -7.944 7.806 1.00 54.21 H new ATOM 0 HD13 ILE A 44 4.654 -7.923 8.675 1.00 54.21 H new ATOM 693 N MET A 45 5.967 -4.656 10.748 1.00 2.22 N ATOM 694 CA MET A 45 6.710 -3.759 11.625 1.00 64.43 C ATOM 695 C MET A 45 8.135 -4.260 11.835 1.00 64.33 C ATOM 696 O MET A 45 8.374 -5.465 11.911 1.00 4.42 O ATOM 697 CB MET A 45 6.000 -3.625 12.974 1.00 22.41 C ATOM 698 CG MET A 45 4.710 -2.824 12.905 1.00 40.12 C ATOM 699 SD MET A 45 4.010 -2.494 14.533 1.00 73.23 S ATOM 700 CE MET A 45 2.389 -3.236 14.362 1.00 13.21 C ATOM 0 H MET A 45 6.171 -5.646 10.887 1.00 2.22 H new ATOM 0 HA MET A 45 6.755 -2.780 11.147 1.00 64.43 H new ATOM 0 HB2 MET A 45 5.780 -4.620 13.360 1.00 22.41 H new ATOM 0 HB3 MET A 45 6.676 -3.150 13.685 1.00 22.41 H new ATOM 0 HG2 MET A 45 4.901 -1.878 12.397 1.00 40.12 H new ATOM 0 HG3 MET A 45 3.981 -3.367 12.304 1.00 40.12 H new ATOM 0 HE1 MET A 45 1.922 -3.321 15.343 1.00 13.21 H new ATOM 0 HE2 MET A 45 1.769 -2.612 13.719 1.00 13.21 H new ATOM 0 HE3 MET A 45 2.487 -4.227 13.920 1.00 13.21 H new ATOM 710 N ASN A 46 9.078 -3.328 11.926 1.00 24.34 N ATOM 711 CA ASN A 46 10.480 -3.677 12.126 1.00 43.34 C ATOM 712 C ASN A 46 10.830 -3.694 13.611 1.00 33.43 C ATOM 713 O ASN A 46 9.950 -3.621 14.469 1.00 11.24 O ATOM 714 CB ASN A 46 11.384 -2.686 11.389 1.00 64.13 C ATOM 715 CG ASN A 46 11.024 -2.558 9.921 1.00 32.23 C ATOM 716 OD1 ASN A 46 10.408 -3.452 9.341 1.00 1.30 O ATOM 717 ND2 ASN A 46 11.410 -1.442 9.313 1.00 63.34 N ATOM 0 H ASN A 46 8.897 -2.326 11.865 1.00 24.34 H new ATOM 0 HA ASN A 46 10.641 -4.676 11.721 1.00 43.34 H new ATOM 0 HB2 ASN A 46 11.311 -1.708 11.865 1.00 64.13 H new ATOM 0 HB3 ASN A 46 12.421 -3.008 11.479 1.00 64.13 H new ATOM 0 HD21 ASN A 46 11.198 -1.300 8.326 1.00 63.34 H new ATOM 0 HD22 ASN A 46 11.919 -0.727 9.834 1.00 63.34 H new ATOM 724 N LYS A 47 12.122 -3.789 13.908 1.00 0.51 N ATOM 725 CA LYS A 47 12.590 -3.814 15.288 1.00 53.33 C ATOM 726 C LYS A 47 12.088 -2.595 16.055 1.00 43.32 C ATOM 727 O LYS A 47 11.363 -2.727 17.041 1.00 44.03 O ATOM 728 CB LYS A 47 14.120 -3.860 15.329 1.00 2.20 C ATOM 729 CG LYS A 47 14.687 -5.268 15.273 1.00 2.10 C ATOM 730 CD LYS A 47 14.770 -5.779 13.844 1.00 44.41 C ATOM 731 CE LYS A 47 15.866 -5.073 13.061 1.00 10.43 C ATOM 732 NZ LYS A 47 17.077 -5.926 12.911 1.00 33.54 N ATOM 0 H LYS A 47 12.864 -3.850 13.210 1.00 0.51 H new ATOM 0 HA LYS A 47 12.192 -4.710 15.764 1.00 53.33 H new ATOM 0 HB2 LYS A 47 14.515 -3.284 14.492 1.00 2.20 H new ATOM 0 HB3 LYS A 47 14.466 -3.374 16.241 1.00 2.20 H new ATOM 0 HG2 LYS A 47 15.680 -5.280 15.723 1.00 2.10 H new ATOM 0 HG3 LYS A 47 14.061 -5.937 15.864 1.00 2.10 H new ATOM 0 HD2 LYS A 47 14.960 -6.852 13.851 1.00 44.41 H new ATOM 0 HD3 LYS A 47 13.812 -5.629 13.347 1.00 44.41 H new ATOM 0 HE2 LYS A 47 15.490 -4.800 12.075 1.00 10.43 H new ATOM 0 HE3 LYS A 47 16.135 -4.146 13.568 1.00 10.43 H new ATOM 0 HZ1 LYS A 47 17.801 -5.409 12.372 1.00 33.54 H new ATOM 0 HZ2 LYS A 47 17.451 -6.166 13.851 1.00 33.54 H new ATOM 0 HZ3 LYS A 47 16.826 -6.799 12.405 1.00 33.54 H new ATOM 746 N GLU A 48 12.476 -1.410 15.595 1.00 74.32 N ATOM 747 CA GLU A 48 12.063 -0.168 16.239 1.00 2.54 C ATOM 748 C GLU A 48 10.548 -0.125 16.415 1.00 21.15 C ATOM 749 O GLU A 48 10.048 0.017 17.530 1.00 62.33 O ATOM 750 CB GLU A 48 12.527 1.037 15.417 1.00 12.25 C ATOM 751 CG GLU A 48 13.472 1.959 16.170 1.00 61.32 C ATOM 752 CD GLU A 48 14.825 2.082 15.497 1.00 10.54 C ATOM 753 OE1 GLU A 48 15.340 1.054 15.008 1.00 53.23 O ATOM 754 OE2 GLU A 48 15.370 3.205 15.460 1.00 72.34 O ATOM 0 H GLU A 48 13.075 -1.283 14.779 1.00 74.32 H new ATOM 0 HA GLU A 48 12.527 -0.127 17.224 1.00 2.54 H new ATOM 0 HB2 GLU A 48 13.023 0.681 14.514 1.00 12.25 H new ATOM 0 HB3 GLU A 48 11.654 1.607 15.098 1.00 12.25 H new ATOM 0 HG2 GLU A 48 13.020 2.947 16.253 1.00 61.32 H new ATOM 0 HG3 GLU A 48 13.608 1.584 17.185 1.00 61.32 H new ATOM 761 N GLU A 49 9.825 -0.247 15.307 1.00 70.33 N ATOM 762 CA GLU A 49 8.368 -0.220 15.339 1.00 50.20 C ATOM 763 C GLU A 49 7.829 -1.198 16.379 1.00 55.14 C ATOM 764 O GLU A 49 7.107 -0.810 17.297 1.00 22.32 O ATOM 765 CB GLU A 49 7.798 -0.560 13.960 1.00 2.30 C ATOM 766 CG GLU A 49 8.209 0.421 12.874 1.00 23.44 C ATOM 767 CD GLU A 49 9.484 0.007 12.166 1.00 34.30 C ATOM 768 OE1 GLU A 49 10.578 0.302 12.691 1.00 4.24 O ATOM 769 OE2 GLU A 49 9.388 -0.613 11.086 1.00 22.13 O ATOM 0 H GLU A 49 10.224 -0.366 14.376 1.00 70.33 H new ATOM 0 HA GLU A 49 8.055 0.787 15.615 1.00 50.20 H new ATOM 0 HB2 GLU A 49 8.125 -1.561 13.677 1.00 2.30 H new ATOM 0 HB3 GLU A 49 6.710 -0.586 14.022 1.00 2.30 H new ATOM 0 HG2 GLU A 49 7.404 0.507 12.144 1.00 23.44 H new ATOM 0 HG3 GLU A 49 8.347 1.408 13.315 1.00 23.44 H new ATOM 776 N SER A 50 8.184 -2.470 16.227 1.00 33.32 N ATOM 777 CA SER A 50 7.733 -3.506 17.149 1.00 42.43 C ATOM 778 C SER A 50 8.065 -3.131 18.590 1.00 44.52 C ATOM 779 O SER A 50 7.248 -3.311 19.494 1.00 52.33 O ATOM 780 CB SER A 50 8.377 -4.848 16.797 1.00 53.24 C ATOM 781 OG SER A 50 7.910 -5.878 17.651 1.00 71.31 O ATOM 0 H SER A 50 8.783 -2.808 15.474 1.00 33.32 H new ATOM 0 HA SER A 50 6.651 -3.596 17.055 1.00 42.43 H new ATOM 0 HB2 SER A 50 8.153 -5.101 15.761 1.00 53.24 H new ATOM 0 HB3 SER A 50 9.461 -4.767 16.879 1.00 53.24 H new ATOM 0 HG SER A 50 8.336 -6.726 17.404 1.00 71.31 H new ATOM 787 N ASP A 51 9.269 -2.610 18.797 1.00 72.14 N ATOM 788 CA ASP A 51 9.711 -2.209 20.128 1.00 14.13 C ATOM 789 C ASP A 51 8.754 -1.187 20.733 1.00 1.11 C ATOM 790 O ASP A 51 8.391 -1.279 21.905 1.00 21.41 O ATOM 791 CB ASP A 51 11.124 -1.629 20.066 1.00 1.24 C ATOM 792 CG ASP A 51 12.184 -2.642 20.451 1.00 33.22 C ATOM 793 OD1 ASP A 51 12.564 -3.461 19.587 1.00 61.02 O ATOM 794 OD2 ASP A 51 12.633 -2.617 21.616 1.00 62.43 O ATOM 0 H ASP A 51 9.957 -2.455 18.060 1.00 72.14 H new ATOM 0 HA ASP A 51 9.718 -3.094 20.764 1.00 14.13 H new ATOM 0 HB2 ASP A 51 11.321 -1.267 19.057 1.00 1.24 H new ATOM 0 HB3 ASP A 51 11.190 -0.768 20.732 1.00 1.24 H new ATOM 799 N ALA A 52 8.350 -0.211 19.925 1.00 63.45 N ATOM 800 CA ALA A 52 7.435 0.828 20.380 1.00 35.41 C ATOM 801 C ALA A 52 6.068 0.244 20.723 1.00 62.23 C ATOM 802 O ALA A 52 5.621 0.316 21.868 1.00 12.32 O ATOM 803 CB ALA A 52 7.298 1.911 19.321 1.00 24.20 C ATOM 0 H ALA A 52 8.642 -0.119 18.952 1.00 63.45 H new ATOM 0 HA ALA A 52 7.849 1.271 21.286 1.00 35.41 H new ATOM 0 HB1 ALA A 52 6.612 2.681 19.674 1.00 24.20 H new ATOM 0 HB2 ALA A 52 8.274 2.356 19.128 1.00 24.20 H new ATOM 0 HB3 ALA A 52 6.910 1.473 18.401 1.00 24.20 H new ATOM 809 N PHE A 53 5.409 -0.333 19.724 1.00 23.40 N ATOM 810 CA PHE A 53 4.092 -0.927 19.919 1.00 75.25 C ATOM 811 C PHE A 53 4.106 -1.906 21.090 1.00 54.14 C ATOM 812 O PHE A 53 3.216 -1.886 21.940 1.00 43.41 O ATOM 813 CB PHE A 53 3.638 -1.644 18.646 1.00 21.14 C ATOM 814 CG PHE A 53 2.482 -2.578 18.863 1.00 43.55 C ATOM 815 CD1 PHE A 53 2.700 -3.900 19.216 1.00 64.40 C ATOM 816 CD2 PHE A 53 1.178 -2.135 18.714 1.00 1.51 C ATOM 817 CE1 PHE A 53 1.639 -4.763 19.417 1.00 64.32 C ATOM 818 CE2 PHE A 53 0.113 -2.993 18.914 1.00 75.51 C ATOM 819 CZ PHE A 53 0.344 -4.309 19.265 1.00 44.44 C ATOM 0 H PHE A 53 5.766 -0.402 18.771 1.00 23.40 H new ATOM 0 HA PHE A 53 3.389 -0.125 20.146 1.00 75.25 H new ATOM 0 HB2 PHE A 53 3.358 -0.900 17.900 1.00 21.14 H new ATOM 0 HB3 PHE A 53 4.477 -2.206 18.237 1.00 21.14 H new ATOM 0 HD1 PHE A 53 3.711 -4.261 19.336 1.00 64.40 H new ATOM 0 HD2 PHE A 53 0.991 -1.108 18.438 1.00 1.51 H new ATOM 0 HE1 PHE A 53 1.823 -5.791 19.693 1.00 64.32 H new ATOM 0 HE2 PHE A 53 -0.899 -2.635 18.796 1.00 75.51 H new ATOM 0 HZ PHE A 53 -0.487 -4.981 19.420 1.00 44.44 H new ATOM 829 N MET A 54 5.121 -2.763 21.125 1.00 72.25 N ATOM 830 CA MET A 54 5.252 -3.749 22.191 1.00 23.14 C ATOM 831 C MET A 54 5.456 -3.068 23.540 1.00 71.31 C ATOM 832 O MET A 54 4.753 -3.362 24.507 1.00 72.22 O ATOM 833 CB MET A 54 6.420 -4.693 21.901 1.00 53.24 C ATOM 834 CG MET A 54 6.149 -5.664 20.763 1.00 41.12 C ATOM 835 SD MET A 54 5.677 -7.304 21.346 1.00 1.32 S ATOM 836 CE MET A 54 4.215 -6.914 22.305 1.00 22.25 C ATOM 0 H MET A 54 5.865 -2.795 20.428 1.00 72.25 H new ATOM 0 HA MET A 54 4.329 -4.327 22.232 1.00 23.14 H new ATOM 0 HB2 MET A 54 7.303 -4.101 21.660 1.00 53.24 H new ATOM 0 HB3 MET A 54 6.652 -5.259 22.803 1.00 53.24 H new ATOM 0 HG2 MET A 54 5.355 -5.265 20.131 1.00 41.12 H new ATOM 0 HG3 MET A 54 7.040 -5.746 20.141 1.00 41.12 H new ATOM 0 HE1 MET A 54 3.716 -7.837 22.599 1.00 22.25 H new ATOM 0 HE2 MET A 54 4.503 -6.358 23.197 1.00 22.25 H new ATOM 0 HE3 MET A 54 3.536 -6.310 21.704 1.00 22.25 H new ATOM 846 N ALA A 55 6.422 -2.158 23.598 1.00 1.31 N ATOM 847 CA ALA A 55 6.717 -1.434 24.829 1.00 1.43 C ATOM 848 C ALA A 55 5.451 -0.833 25.429 1.00 62.43 C ATOM 849 O ALA A 55 5.262 -0.848 26.645 1.00 62.54 O ATOM 850 CB ALA A 55 7.748 -0.346 24.567 1.00 4.04 C ATOM 0 H ALA A 55 7.014 -1.904 22.807 1.00 1.31 H new ATOM 0 HA ALA A 55 7.128 -2.142 25.549 1.00 1.43 H new ATOM 0 HB1 ALA A 55 7.959 0.186 25.494 1.00 4.04 H new ATOM 0 HB2 ALA A 55 8.666 -0.798 24.191 1.00 4.04 H new ATOM 0 HB3 ALA A 55 7.359 0.354 23.827 1.00 4.04 H new ATOM 856 N GLN A 56 4.588 -0.303 24.569 1.00 50.13 N ATOM 857 CA GLN A 56 3.340 0.305 25.015 1.00 41.35 C ATOM 858 C GLN A 56 2.354 -0.759 25.485 1.00 34.15 C ATOM 859 O GLN A 56 2.037 -0.846 26.672 1.00 42.12 O ATOM 860 CB GLN A 56 2.719 1.132 23.888 1.00 31.30 C ATOM 861 CG GLN A 56 3.680 2.130 23.265 1.00 14.33 C ATOM 862 CD GLN A 56 3.130 3.543 23.256 1.00 43.41 C ATOM 863 OE1 GLN A 56 2.804 4.044 22.070 1.00 2.13 O flip ATOM 864 NE2 GLN A 56 3.000 4.177 24.303 1.00 45.15 N flip ATOM 0 H GLN A 56 4.730 -0.282 23.559 1.00 50.13 H new ATOM 0 HA GLN A 56 3.565 0.962 25.855 1.00 41.35 H new ATOM 0 HB2 GLN A 56 2.355 0.458 23.112 1.00 31.30 H new ATOM 0 HB3 GLN A 56 1.853 1.668 24.277 1.00 31.30 H new ATOM 0 HG2 GLN A 56 4.621 2.114 23.815 1.00 14.33 H new ATOM 0 HG3 GLN A 56 3.903 1.824 22.243 1.00 14.33 H new ATOM 0 HE21 GLN A 56 3.263 3.753 25.192 1.00 45.15 H new ATOM 0 HE22 GLN A 56 2.629 5.127 24.281 1.00 45.15 H new ATOM 873 N VAL A 57 1.871 -1.567 24.547 1.00 35.54 N ATOM 874 CA VAL A 57 0.921 -2.626 24.865 1.00 63.43 C ATOM 875 C VAL A 57 1.369 -3.417 26.088 1.00 74.13 C ATOM 876 O VAL A 57 0.549 -3.834 26.907 1.00 4.33 O ATOM 877 CB VAL A 57 0.741 -3.593 23.679 1.00 5.43 C ATOM 878 CG1 VAL A 57 0.364 -2.829 22.419 1.00 11.04 C ATOM 879 CG2 VAL A 57 2.006 -4.408 23.460 1.00 32.12 C ATOM 0 H VAL A 57 2.122 -1.508 23.560 1.00 35.54 H new ATOM 0 HA VAL A 57 -0.032 -2.143 25.078 1.00 63.43 H new ATOM 0 HB VAL A 57 -0.071 -4.281 23.914 1.00 5.43 H new ATOM 0 HG11 VAL A 57 0.241 -3.529 21.592 1.00 11.04 H new ATOM 0 HG12 VAL A 57 -0.571 -2.294 22.584 1.00 11.04 H new ATOM 0 HG13 VAL A 57 1.152 -2.116 22.177 1.00 11.04 H new ATOM 0 HG21 VAL A 57 1.861 -5.086 22.619 1.00 32.12 H new ATOM 0 HG22 VAL A 57 2.838 -3.737 23.247 1.00 32.12 H new ATOM 0 HG23 VAL A 57 2.226 -4.986 24.358 1.00 32.12 H new ATOM 889 N LYS A 58 2.676 -3.620 26.208 1.00 72.31 N ATOM 890 CA LYS A 58 3.236 -4.360 27.333 1.00 51.44 C ATOM 891 C LYS A 58 3.124 -3.555 28.624 1.00 14.05 C ATOM 892 O LYS A 58 2.637 -4.055 29.637 1.00 2.55 O ATOM 893 CB LYS A 58 4.702 -4.708 27.062 1.00 54.33 C ATOM 894 CG LYS A 58 4.885 -5.815 26.039 1.00 14.23 C ATOM 895 CD LYS A 58 4.178 -7.091 26.465 1.00 13.31 C ATOM 896 CE LYS A 58 4.623 -7.539 27.849 1.00 22.12 C ATOM 897 NZ LYS A 58 3.563 -7.317 28.871 1.00 73.22 N ATOM 0 H LYS A 58 3.368 -3.282 25.539 1.00 72.31 H new ATOM 0 HA LYS A 58 2.665 -5.281 27.450 1.00 51.44 H new ATOM 0 HB2 LYS A 58 5.221 -3.814 26.715 1.00 54.33 H new ATOM 0 HB3 LYS A 58 5.175 -5.007 27.997 1.00 54.33 H new ATOM 0 HG2 LYS A 58 4.497 -5.488 25.074 1.00 14.23 H new ATOM 0 HG3 LYS A 58 5.948 -6.015 25.904 1.00 14.23 H new ATOM 0 HD2 LYS A 58 3.100 -6.929 26.463 1.00 13.31 H new ATOM 0 HD3 LYS A 58 4.383 -7.881 25.742 1.00 13.31 H new ATOM 0 HE2 LYS A 58 4.885 -8.597 27.822 1.00 22.12 H new ATOM 0 HE3 LYS A 58 5.523 -6.995 28.135 1.00 22.12 H new ATOM 0 HZ1 LYS A 58 3.757 -7.907 29.706 1.00 73.22 H new ATOM 0 HZ2 LYS A 58 3.554 -6.315 29.149 1.00 73.22 H new ATOM 0 HZ3 LYS A 58 2.637 -7.574 28.473 1.00 73.22 H new ATOM 911 N ALA A 59 3.576 -2.306 28.578 1.00 62.13 N ATOM 912 CA ALA A 59 3.523 -1.431 29.743 1.00 54.00 C ATOM 913 C ALA A 59 2.117 -1.387 30.332 1.00 32.31 C ATOM 914 O ALA A 59 1.930 -1.584 31.533 1.00 72.22 O ATOM 915 CB ALA A 59 3.986 -0.030 29.372 1.00 53.22 C ATOM 0 H ALA A 59 3.983 -1.877 27.747 1.00 62.13 H new ATOM 0 HA ALA A 59 4.194 -1.835 30.501 1.00 54.00 H new ATOM 0 HB1 ALA A 59 3.941 0.613 30.251 1.00 53.22 H new ATOM 0 HB2 ALA A 59 5.011 -0.071 29.004 1.00 53.22 H new ATOM 0 HB3 ALA A 59 3.338 0.373 28.594 1.00 53.22 H new ATOM 921 N PHE A 60 1.131 -1.127 29.480 1.00 24.05 N ATOM 922 CA PHE A 60 -0.258 -1.055 29.918 1.00 72.14 C ATOM 923 C PHE A 60 -0.753 -2.422 30.384 1.00 50.24 C ATOM 924 O PHE A 60 -1.382 -2.540 31.435 1.00 11.13 O ATOM 925 CB PHE A 60 -1.146 -0.539 28.784 1.00 33.31 C ATOM 926 CG PHE A 60 -2.056 0.583 29.198 1.00 64.21 C ATOM 927 CD1 PHE A 60 -1.621 1.897 29.154 1.00 64.43 C ATOM 928 CD2 PHE A 60 -3.346 0.322 29.632 1.00 31.22 C ATOM 929 CE1 PHE A 60 -2.455 2.932 29.534 1.00 31.33 C ATOM 930 CE2 PHE A 60 -4.185 1.352 30.013 1.00 23.33 C ATOM 931 CZ PHE A 60 -3.739 2.658 29.965 1.00 13.31 C ATOM 0 H PHE A 60 1.268 -0.963 28.483 1.00 24.05 H new ATOM 0 HA PHE A 60 -0.313 -0.362 30.758 1.00 72.14 H new ATOM 0 HB2 PHE A 60 -0.514 -0.199 27.964 1.00 33.31 H new ATOM 0 HB3 PHE A 60 -1.749 -1.363 28.402 1.00 33.31 H new ATOM 0 HD1 PHE A 60 -0.618 2.116 28.819 1.00 64.43 H new ATOM 0 HD2 PHE A 60 -3.700 -0.698 29.673 1.00 31.22 H new ATOM 0 HE1 PHE A 60 -2.104 3.953 29.494 1.00 31.33 H new ATOM 0 HE2 PHE A 60 -5.189 1.136 30.348 1.00 23.33 H new ATOM 0 HZ PHE A 60 -4.393 3.464 30.264 1.00 13.31 H new ATOM 941 N ARG A 61 -0.464 -3.450 29.593 1.00 54.11 N ATOM 942 CA ARG A 61 -0.880 -4.808 29.923 1.00 34.10 C ATOM 943 C ARG A 61 -0.506 -5.157 31.361 1.00 54.25 C ATOM 944 O ARG A 61 -1.345 -5.613 32.137 1.00 65.23 O ATOM 945 CB ARG A 61 -0.238 -5.809 28.961 1.00 34.43 C ATOM 946 CG ARG A 61 -1.060 -6.061 27.707 1.00 54.35 C ATOM 947 CD ARG A 61 -0.214 -6.669 26.600 1.00 61.05 C ATOM 948 NE ARG A 61 -0.876 -7.807 25.968 1.00 72.02 N ATOM 949 CZ ARG A 61 -1.072 -8.973 26.574 1.00 14.31 C ATOM 950 NH1 ARG A 61 -0.660 -9.153 27.821 1.00 52.51 N ATOM 951 NH2 ARG A 61 -1.683 -9.961 25.932 1.00 41.34 N ATOM 0 H ARG A 61 0.056 -3.369 28.719 1.00 54.11 H new ATOM 0 HA ARG A 61 -1.964 -4.863 29.824 1.00 34.10 H new ATOM 0 HB2 ARG A 61 0.747 -5.442 28.672 1.00 34.43 H new ATOM 0 HB3 ARG A 61 -0.086 -6.754 29.482 1.00 34.43 H new ATOM 0 HG2 ARG A 61 -1.889 -6.729 27.942 1.00 54.35 H new ATOM 0 HG3 ARG A 61 -1.495 -5.123 27.361 1.00 54.35 H new ATOM 0 HD2 ARG A 61 -0.001 -5.910 25.848 1.00 61.05 H new ATOM 0 HD3 ARG A 61 0.744 -6.989 27.010 1.00 61.05 H new ATOM 0 HE ARG A 61 -1.206 -7.701 25.009 1.00 72.02 H new ATOM 0 HH11 ARG A 61 -0.191 -8.395 28.318 1.00 52.51 H new ATOM 0 HH12 ARG A 61 -0.812 -10.049 28.284 1.00 52.51 H new ATOM 0 HH21 ARG A 61 -2.002 -9.825 24.973 1.00 41.34 H new ATOM 0 HH22 ARG A 61 -1.833 -10.856 26.398 1.00 41.34 H new ATOM 965 N ALA A 62 0.758 -4.940 31.707 1.00 12.45 N ATOM 966 CA ALA A 62 1.243 -5.230 33.051 1.00 62.42 C ATOM 967 C ALA A 62 0.577 -4.325 34.082 1.00 41.34 C ATOM 968 O ALA A 62 -0.008 -4.802 35.055 1.00 75.13 O ATOM 969 CB ALA A 62 2.755 -5.078 33.111 1.00 75.01 C ATOM 0 H ALA A 62 1.465 -4.564 31.075 1.00 12.45 H new ATOM 0 HA ALA A 62 0.983 -6.261 33.289 1.00 62.42 H new ATOM 0 HB1 ALA A 62 3.103 -5.298 34.120 1.00 75.01 H new ATOM 0 HB2 ALA A 62 3.218 -5.771 32.409 1.00 75.01 H new ATOM 0 HB3 ALA A 62 3.029 -4.056 32.847 1.00 75.01 H new ATOM 975 N SER A 63 0.669 -3.018 33.863 1.00 33.42 N ATOM 976 CA SER A 63 0.079 -2.046 34.776 1.00 2.12 C ATOM 977 C SER A 63 -1.368 -2.409 35.095 1.00 22.33 C ATOM 978 O SER A 63 -1.813 -2.288 36.236 1.00 4.52 O ATOM 979 CB SER A 63 0.143 -0.642 34.171 1.00 54.30 C ATOM 980 OG SER A 63 0.763 0.269 35.061 1.00 54.03 O ATOM 0 H SER A 63 1.147 -2.607 33.061 1.00 33.42 H new ATOM 0 HA SER A 63 0.652 -2.061 35.703 1.00 2.12 H new ATOM 0 HB2 SER A 63 0.696 -0.672 33.232 1.00 54.30 H new ATOM 0 HB3 SER A 63 -0.864 -0.298 33.936 1.00 54.30 H new ATOM 0 HG SER A 63 0.793 1.158 34.650 1.00 54.03 H new ATOM 986 N VAL A 64 -2.098 -2.855 34.077 1.00 71.34 N ATOM 987 CA VAL A 64 -3.494 -3.237 34.247 1.00 53.43 C ATOM 988 C VAL A 64 -3.613 -4.632 34.850 1.00 11.22 C ATOM 989 O VAL A 64 -4.595 -4.949 35.520 1.00 3.11 O ATOM 990 CB VAL A 64 -4.253 -3.202 32.908 1.00 35.34 C ATOM 991 CG1 VAL A 64 -5.729 -3.500 33.122 1.00 41.12 C ATOM 992 CG2 VAL A 64 -4.067 -1.855 32.225 1.00 72.40 C ATOM 0 H VAL A 64 -1.745 -2.960 33.126 1.00 71.34 H new ATOM 0 HA VAL A 64 -3.940 -2.511 34.927 1.00 53.43 H new ATOM 0 HB VAL A 64 -3.842 -3.974 32.258 1.00 35.34 H new ATOM 0 HG11 VAL A 64 -6.249 -3.471 32.164 1.00 41.12 H new ATOM 0 HG12 VAL A 64 -5.840 -4.490 33.565 1.00 41.12 H new ATOM 0 HG13 VAL A 64 -6.158 -2.753 33.790 1.00 41.12 H new ATOM 0 HG21 VAL A 64 -4.610 -1.848 31.280 1.00 72.40 H new ATOM 0 HG22 VAL A 64 -4.450 -1.064 32.870 1.00 72.40 H new ATOM 0 HG23 VAL A 64 -3.007 -1.687 32.035 1.00 72.40 H new ATOM 1002 N ASN A 65 -2.604 -5.463 34.607 1.00 65.42 N ATOM 1003 CA ASN A 65 -2.595 -6.826 35.126 1.00 63.33 C ATOM 1004 C ASN A 65 -2.631 -6.828 36.651 1.00 34.44 C ATOM 1005 O ASN A 65 -2.982 -7.830 37.273 1.00 74.22 O ATOM 1006 CB ASN A 65 -1.354 -7.573 34.633 1.00 65.12 C ATOM 1007 CG ASN A 65 -0.567 -8.200 35.768 1.00 25.04 C ATOM 1008 OD1 ASN A 65 -0.716 -9.386 36.061 1.00 23.33 O ATOM 1009 ND2 ASN A 65 0.276 -7.402 36.414 1.00 24.43 N ATOM 0 H ASN A 65 -1.783 -5.216 34.054 1.00 65.42 H new ATOM 0 HA ASN A 65 -3.487 -7.334 34.759 1.00 63.33 H new ATOM 0 HB2 ASN A 65 -1.656 -8.350 33.931 1.00 65.12 H new ATOM 0 HB3 ASN A 65 -0.711 -6.883 34.087 1.00 65.12 H new ATOM 0 HD21 ASN A 65 0.832 -7.767 37.187 1.00 24.43 H new ATOM 0 HD22 ASN A 65 0.367 -6.425 36.137 1.00 24.43 H new ATOM 1016 N ALA A 66 -2.266 -5.697 37.247 1.00 34.40 N ATOM 1017 CA ALA A 66 -2.259 -5.567 38.699 1.00 71.20 C ATOM 1018 C ALA A 66 -3.655 -5.779 39.276 1.00 64.32 C ATOM 1019 O ALA A 66 -3.806 -6.109 40.452 1.00 75.05 O ATOM 1020 CB ALA A 66 -1.720 -4.203 39.104 1.00 31.54 C ATOM 0 H ALA A 66 -1.972 -4.858 36.747 1.00 34.40 H new ATOM 0 HA ALA A 66 -1.605 -6.339 39.105 1.00 71.20 H new ATOM 0 HB1 ALA A 66 -1.720 -4.120 40.191 1.00 31.54 H new ATOM 0 HB2 ALA A 66 -0.702 -4.089 38.732 1.00 31.54 H new ATOM 0 HB3 ALA A 66 -2.351 -3.422 38.680 1.00 31.54 H new ATOM 1026 N GLU A 67 -4.671 -5.587 38.441 1.00 20.14 N ATOM 1027 CA GLU A 67 -6.054 -5.757 38.870 1.00 72.20 C ATOM 1028 C GLU A 67 -6.303 -7.182 39.355 1.00 43.13 C ATOM 1029 O GLU A 67 -5.380 -7.993 39.434 1.00 75.41 O ATOM 1030 CB GLU A 67 -7.012 -5.422 37.724 1.00 22.11 C ATOM 1031 CG GLU A 67 -6.867 -4.001 37.205 1.00 61.11 C ATOM 1032 CD GLU A 67 -8.091 -3.151 37.483 1.00 0.53 C ATOM 1033 OE1 GLU A 67 -9.206 -3.576 37.116 1.00 63.32 O ATOM 1034 OE2 GLU A 67 -7.933 -2.059 38.068 1.00 43.35 O ATOM 0 H GLU A 67 -4.563 -5.314 37.464 1.00 20.14 H new ATOM 0 HA GLU A 67 -6.236 -5.073 39.699 1.00 72.20 H new ATOM 0 HB2 GLU A 67 -6.841 -6.119 36.903 1.00 22.11 H new ATOM 0 HB3 GLU A 67 -8.037 -5.573 38.062 1.00 22.11 H new ATOM 0 HG2 GLU A 67 -5.995 -3.537 37.666 1.00 61.11 H new ATOM 0 HG3 GLU A 67 -6.684 -4.027 36.131 1.00 61.11 H new ATOM 1041 N THR A 68 -7.557 -7.480 39.680 1.00 44.20 N ATOM 1042 CA THR A 68 -7.928 -8.805 40.160 1.00 74.54 C ATOM 1043 C THR A 68 -7.547 -9.882 39.150 1.00 54.25 C ATOM 1044 O THR A 68 -6.551 -10.584 39.323 1.00 43.32 O ATOM 1045 CB THR A 68 -9.439 -8.897 40.444 1.00 12.11 C ATOM 1046 OG1 THR A 68 -9.799 -7.978 41.483 1.00 61.32 O ATOM 1047 CG2 THR A 68 -9.828 -10.309 40.853 1.00 73.14 C ATOM 0 H THR A 68 -8.333 -6.821 39.619 1.00 44.20 H new ATOM 0 HA THR A 68 -7.380 -8.970 41.088 1.00 74.54 H new ATOM 0 HB THR A 68 -9.974 -8.640 39.530 1.00 12.11 H new ATOM 0 HG1 THR A 68 -10.657 -7.557 41.265 1.00 61.32 H new ATOM 0 HG21 THR A 68 -10.900 -10.349 41.048 1.00 73.14 H new ATOM 0 HG22 THR A 68 -9.580 -11.002 40.049 1.00 73.14 H new ATOM 0 HG23 THR A 68 -9.284 -10.589 41.755 1.00 73.14 H new ATOM 1055 N VAL A 69 -8.345 -10.006 38.094 1.00 72.34 N ATOM 1056 CA VAL A 69 -8.090 -10.997 37.055 1.00 71.13 C ATOM 1057 C VAL A 69 -8.356 -10.420 35.669 1.00 51.04 C ATOM 1058 O VAL A 69 -8.659 -9.236 35.526 1.00 32.41 O ATOM 1059 CB VAL A 69 -8.958 -12.253 37.252 1.00 73.32 C ATOM 1060 CG1 VAL A 69 -8.877 -12.738 38.692 1.00 12.13 C ATOM 1061 CG2 VAL A 69 -10.399 -11.972 36.856 1.00 63.22 C ATOM 0 H VAL A 69 -9.173 -9.433 37.935 1.00 72.34 H new ATOM 0 HA VAL A 69 -7.039 -11.276 37.134 1.00 71.13 H new ATOM 0 HB VAL A 69 -8.575 -13.043 36.606 1.00 73.32 H new ATOM 0 HG11 VAL A 69 -9.497 -13.626 38.812 1.00 12.13 H new ATOM 0 HG12 VAL A 69 -7.843 -12.981 38.936 1.00 12.13 H new ATOM 0 HG13 VAL A 69 -9.233 -11.954 39.361 1.00 12.13 H new ATOM 0 HG21 VAL A 69 -10.998 -12.871 37.002 1.00 63.22 H new ATOM 0 HG22 VAL A 69 -10.796 -11.167 37.475 1.00 63.22 H new ATOM 0 HG23 VAL A 69 -10.437 -11.676 35.808 1.00 63.22 H new ATOM 1071 N ALA A 70 -8.240 -11.266 34.651 1.00 13.24 N ATOM 1072 CA ALA A 70 -8.471 -10.841 33.275 1.00 3.13 C ATOM 1073 C ALA A 70 -9.802 -11.372 32.753 1.00 32.51 C ATOM 1074 O ALA A 70 -10.359 -12.338 33.273 1.00 43.12 O ATOM 1075 CB ALA A 70 -7.329 -11.303 32.382 1.00 12.50 C ATOM 0 H ALA A 70 -7.988 -12.249 34.752 1.00 13.24 H new ATOM 0 HA ALA A 70 -8.513 -9.752 33.259 1.00 3.13 H new ATOM 0 HB1 ALA A 70 -7.514 -10.979 31.358 1.00 12.50 H new ATOM 0 HB2 ALA A 70 -6.393 -10.871 32.736 1.00 12.50 H new ATOM 0 HB3 ALA A 70 -7.261 -12.390 32.412 1.00 12.50 H new ATOM 1081 N PRO A 71 -10.325 -10.726 31.700 1.00 65.15 N ATOM 1082 CA PRO A 71 -11.597 -11.115 31.085 1.00 1.54 C ATOM 1083 C PRO A 71 -11.499 -12.445 30.345 1.00 12.21 C ATOM 1084 O PRO A 71 -12.506 -12.987 29.889 1.00 20.04 O ATOM 1085 CB PRO A 71 -11.879 -9.976 30.102 1.00 70.44 C ATOM 1086 CG PRO A 71 -10.538 -9.412 29.781 1.00 72.52 C ATOM 1087 CD PRO A 71 -9.715 -9.566 31.030 1.00 22.23 C ATOM 0 HA PRO A 71 -12.382 -11.259 31.828 1.00 1.54 H new ATOM 0 HB2 PRO A 71 -12.380 -10.342 29.205 1.00 70.44 H new ATOM 0 HB3 PRO A 71 -12.530 -9.222 30.545 1.00 70.44 H new ATOM 0 HG2 PRO A 71 -10.082 -9.942 28.945 1.00 72.52 H new ATOM 0 HG3 PRO A 71 -10.615 -8.364 29.491 1.00 72.52 H new ATOM 0 HD2 PRO A 71 -8.664 -9.742 30.800 1.00 22.23 H new ATOM 0 HD3 PRO A 71 -9.760 -8.673 31.653 1.00 22.23 H new ATOM 1095 N GLU A 72 -10.281 -12.965 30.230 1.00 71.53 N ATOM 1096 CA GLU A 72 -10.054 -14.232 29.544 1.00 24.02 C ATOM 1097 C GLU A 72 -10.098 -15.398 30.527 1.00 3.11 C ATOM 1098 O GLU A 72 -10.632 -16.464 30.219 1.00 45.23 O ATOM 1099 CB GLU A 72 -8.706 -14.211 28.820 1.00 63.23 C ATOM 1100 CG GLU A 72 -8.804 -13.789 27.364 1.00 23.41 C ATOM 1101 CD GLU A 72 -8.163 -12.439 27.103 1.00 62.14 C ATOM 1102 OE1 GLU A 72 -6.919 -12.379 27.017 1.00 65.14 O ATOM 1103 OE2 GLU A 72 -8.907 -11.443 26.985 1.00 71.11 O ATOM 0 H GLU A 72 -9.437 -12.529 30.602 1.00 71.53 H new ATOM 0 HA GLU A 72 -10.850 -14.367 28.811 1.00 24.02 H new ATOM 0 HB2 GLU A 72 -8.033 -13.531 29.342 1.00 63.23 H new ATOM 0 HB3 GLU A 72 -8.259 -15.204 28.873 1.00 63.23 H new ATOM 0 HG2 GLU A 72 -8.324 -14.542 26.738 1.00 23.41 H new ATOM 0 HG3 GLU A 72 -9.853 -13.752 27.070 1.00 23.41 H new ATOM 1110 N PHE A 73 -9.532 -15.188 31.711 1.00 42.31 N ATOM 1111 CA PHE A 73 -9.504 -16.222 32.739 1.00 33.33 C ATOM 1112 C PHE A 73 -10.916 -16.687 33.081 1.00 65.15 C ATOM 1113 O PHE A 73 -11.254 -17.858 32.906 1.00 70.42 O ATOM 1114 CB PHE A 73 -8.808 -15.700 33.998 1.00 14.40 C ATOM 1115 CG PHE A 73 -8.541 -16.766 35.021 1.00 4.03 C ATOM 1116 CD1 PHE A 73 -9.583 -17.348 35.724 1.00 3.12 C ATOM 1117 CD2 PHE A 73 -7.246 -17.188 35.279 1.00 31.45 C ATOM 1118 CE1 PHE A 73 -9.339 -18.329 36.666 1.00 71.33 C ATOM 1119 CE2 PHE A 73 -6.996 -18.169 36.220 1.00 33.41 C ATOM 1120 CZ PHE A 73 -8.044 -18.741 36.914 1.00 23.22 C ATOM 0 H PHE A 73 -9.087 -14.311 31.982 1.00 42.31 H new ATOM 0 HA PHE A 73 -8.945 -17.072 32.349 1.00 33.33 H new ATOM 0 HB2 PHE A 73 -7.864 -15.235 33.715 1.00 14.40 H new ATOM 0 HB3 PHE A 73 -9.425 -14.922 34.448 1.00 14.40 H new ATOM 0 HD1 PHE A 73 -10.598 -17.031 35.534 1.00 3.12 H new ATOM 0 HD2 PHE A 73 -6.423 -16.745 34.738 1.00 31.45 H new ATOM 0 HE1 PHE A 73 -10.160 -18.774 37.208 1.00 71.33 H new ATOM 0 HE2 PHE A 73 -5.982 -18.488 36.412 1.00 33.41 H new ATOM 0 HZ PHE A 73 -7.852 -19.509 37.649 1.00 23.22 H new ATOM 1130 N ILE A 74 -11.736 -15.762 33.568 1.00 62.10 N ATOM 1131 CA ILE A 74 -13.111 -16.077 33.934 1.00 11.01 C ATOM 1132 C ILE A 74 -13.783 -16.932 32.864 1.00 71.02 C ATOM 1133 O ILE A 74 -14.083 -18.104 33.089 1.00 44.51 O ATOM 1134 CB ILE A 74 -13.943 -14.799 34.151 1.00 5.51 C ATOM 1135 CG1 ILE A 74 -13.317 -13.623 33.398 1.00 74.21 C ATOM 1136 CG2 ILE A 74 -14.055 -14.485 35.635 1.00 21.41 C ATOM 1137 CD1 ILE A 74 -14.278 -12.481 33.153 1.00 12.51 C ATOM 0 H ILE A 74 -11.472 -14.788 33.718 1.00 62.10 H new ATOM 0 HA ILE A 74 -13.068 -16.636 34.869 1.00 11.01 H new ATOM 0 HB ILE A 74 -14.946 -14.965 33.758 1.00 5.51 H new ATOM 0 HG12 ILE A 74 -12.463 -13.253 33.965 1.00 74.21 H new ATOM 0 HG13 ILE A 74 -12.935 -13.977 32.441 1.00 74.21 H new ATOM 0 HG21 ILE A 74 -14.646 -13.579 35.772 1.00 21.41 H new ATOM 0 HG22 ILE A 74 -14.541 -15.316 36.147 1.00 21.41 H new ATOM 0 HG23 ILE A 74 -13.059 -14.335 36.051 1.00 21.41 H new ATOM 0 HD11 ILE A 74 -13.766 -11.683 32.615 1.00 12.51 H new ATOM 0 HD12 ILE A 74 -15.121 -12.836 32.560 1.00 12.51 H new ATOM 0 HD13 ILE A 74 -14.641 -12.100 34.107 1.00 12.51 H new ATOM 1149 N VAL A 75 -14.014 -16.337 31.698 1.00 13.50 N ATOM 1150 CA VAL A 75 -14.647 -17.044 30.592 1.00 55.20 C ATOM 1151 C VAL A 75 -13.983 -18.395 30.351 1.00 11.40 C ATOM 1152 O VAL A 75 -14.654 -19.386 30.061 1.00 31.02 O ATOM 1153 CB VAL A 75 -14.591 -16.218 29.292 1.00 71.12 C ATOM 1154 CG1 VAL A 75 -15.390 -14.933 29.441 1.00 53.41 C ATOM 1155 CG2 VAL A 75 -13.148 -15.918 28.915 1.00 23.31 C ATOM 0 H VAL A 75 -13.772 -15.367 31.495 1.00 13.50 H new ATOM 0 HA VAL A 75 -15.689 -17.199 30.871 1.00 55.20 H new ATOM 0 HB VAL A 75 -15.039 -16.804 28.489 1.00 71.12 H new ATOM 0 HG11 VAL A 75 -15.339 -14.363 28.513 1.00 53.41 H new ATOM 0 HG12 VAL A 75 -16.430 -15.175 29.662 1.00 53.41 H new ATOM 0 HG13 VAL A 75 -14.975 -14.339 30.255 1.00 53.41 H new ATOM 0 HG21 VAL A 75 -13.126 -15.334 27.995 1.00 23.31 H new ATOM 0 HG22 VAL A 75 -12.673 -15.351 29.716 1.00 23.31 H new ATOM 0 HG23 VAL A 75 -12.609 -16.854 28.764 1.00 23.31 H new ATOM 1165 N LYS A 76 -12.661 -18.429 30.474 1.00 13.12 N ATOM 1166 CA LYS A 76 -11.904 -19.658 30.273 1.00 14.44 C ATOM 1167 C LYS A 76 -12.338 -20.733 31.265 1.00 14.54 C ATOM 1168 O LYS A 76 -12.438 -21.909 30.917 1.00 33.14 O ATOM 1169 CB LYS A 76 -10.405 -19.389 30.419 1.00 13.53 C ATOM 1170 CG LYS A 76 -9.702 -19.128 29.098 1.00 23.41 C ATOM 1171 CD LYS A 76 -8.209 -19.390 29.200 1.00 74.41 C ATOM 1172 CE LYS A 76 -7.491 -18.254 29.914 1.00 34.25 C ATOM 1173 NZ LYS A 76 -6.167 -17.962 29.298 1.00 15.33 N ATOM 0 H LYS A 76 -12.091 -17.618 30.712 1.00 13.12 H new ATOM 0 HA LYS A 76 -12.105 -20.017 29.264 1.00 14.44 H new ATOM 0 HB2 LYS A 76 -10.261 -18.530 31.074 1.00 13.53 H new ATOM 0 HB3 LYS A 76 -9.937 -20.244 30.907 1.00 13.53 H new ATOM 0 HG2 LYS A 76 -10.132 -19.764 28.324 1.00 23.41 H new ATOM 0 HG3 LYS A 76 -9.871 -18.095 28.792 1.00 23.41 H new ATOM 0 HD2 LYS A 76 -8.038 -20.324 29.736 1.00 74.41 H new ATOM 0 HD3 LYS A 76 -7.791 -19.515 28.201 1.00 74.41 H new ATOM 0 HE2 LYS A 76 -8.111 -17.358 29.885 1.00 34.25 H new ATOM 0 HE3 LYS A 76 -7.354 -18.514 30.964 1.00 34.25 H new ATOM 0 HZ1 LYS A 76 -5.709 -17.183 29.812 1.00 15.33 H new ATOM 0 HZ2 LYS A 76 -5.566 -18.810 29.348 1.00 15.33 H new ATOM 0 HZ3 LYS A 76 -6.299 -17.690 28.303 1.00 15.33 H new ATOM 1187 N VAL A 77 -12.594 -20.320 32.502 1.00 74.50 N ATOM 1188 CA VAL A 77 -13.020 -21.247 33.544 1.00 22.40 C ATOM 1189 C VAL A 77 -14.437 -21.747 33.290 1.00 60.02 C ATOM 1190 O VAL A 77 -14.747 -22.914 33.531 1.00 55.21 O ATOM 1191 CB VAL A 77 -12.961 -20.592 34.937 1.00 12.31 C ATOM 1192 CG1 VAL A 77 -13.444 -21.561 36.005 1.00 34.34 C ATOM 1193 CG2 VAL A 77 -11.549 -20.112 35.240 1.00 51.31 C ATOM 0 H VAL A 77 -12.514 -19.350 32.807 1.00 74.50 H new ATOM 0 HA VAL A 77 -12.330 -22.090 33.517 1.00 22.40 H new ATOM 0 HB VAL A 77 -13.624 -19.727 34.940 1.00 12.31 H new ATOM 0 HG11 VAL A 77 -13.395 -21.080 36.982 1.00 34.34 H new ATOM 0 HG12 VAL A 77 -14.474 -21.851 35.795 1.00 34.34 H new ATOM 0 HG13 VAL A 77 -12.810 -22.448 36.005 1.00 34.34 H new ATOM 0 HG21 VAL A 77 -11.525 -19.652 36.228 1.00 51.31 H new ATOM 0 HG22 VAL A 77 -10.864 -20.960 35.218 1.00 51.31 H new ATOM 0 HG23 VAL A 77 -11.245 -19.380 34.492 1.00 51.31 H new ATOM 1203 N ARG A 78 -15.294 -20.857 32.801 1.00 43.20 N ATOM 1204 CA ARG A 78 -16.680 -21.208 32.514 1.00 1.30 C ATOM 1205 C ARG A 78 -16.765 -22.152 31.318 1.00 10.34 C ATOM 1206 O ARG A 78 -17.638 -23.018 31.258 1.00 23.41 O ATOM 1207 CB ARG A 78 -17.501 -19.947 32.241 1.00 40.24 C ATOM 1208 CG ARG A 78 -17.095 -18.758 33.097 1.00 54.23 C ATOM 1209 CD ARG A 78 -18.204 -17.720 33.170 1.00 54.24 C ATOM 1210 NE ARG A 78 -18.839 -17.688 34.484 1.00 2.03 N ATOM 1211 CZ ARG A 78 -19.127 -16.567 35.135 1.00 43.20 C ATOM 1212 NH1 ARG A 78 -18.838 -15.391 34.596 1.00 14.04 N ATOM 1213 NH2 ARG A 78 -19.706 -16.620 36.328 1.00 41.04 N ATOM 0 H ARG A 78 -15.053 -19.887 32.595 1.00 43.20 H new ATOM 0 HA ARG A 78 -17.088 -21.717 33.387 1.00 1.30 H new ATOM 0 HB2 ARG A 78 -17.400 -19.678 31.190 1.00 40.24 H new ATOM 0 HB3 ARG A 78 -18.555 -20.165 32.414 1.00 40.24 H new ATOM 0 HG2 ARG A 78 -16.848 -19.099 34.102 1.00 54.23 H new ATOM 0 HG3 ARG A 78 -16.195 -18.302 32.685 1.00 54.23 H new ATOM 0 HD2 ARG A 78 -17.795 -16.736 32.941 1.00 54.24 H new ATOM 0 HD3 ARG A 78 -18.955 -17.938 32.410 1.00 54.24 H new ATOM 0 HE ARG A 78 -19.075 -18.576 34.927 1.00 2.03 H new ATOM 0 HH11 ARG A 78 -18.393 -15.346 33.679 1.00 14.04 H new ATOM 0 HH12 ARG A 78 -19.060 -14.531 35.098 1.00 14.04 H new ATOM 0 HH21 ARG A 78 -19.930 -17.523 36.746 1.00 41.04 H new ATOM 0 HH22 ARG A 78 -19.926 -15.758 36.827 1.00 41.04 H new ATOM 1227 N LYS A 79 -15.853 -21.979 30.368 1.00 42.32 N ATOM 1228 CA LYS A 79 -15.823 -22.815 29.173 1.00 44.45 C ATOM 1229 C LYS A 79 -14.956 -24.050 29.395 1.00 43.44 C ATOM 1230 O LYS A 79 -15.071 -25.040 28.672 1.00 74.11 O ATOM 1231 CB LYS A 79 -15.296 -22.016 27.979 1.00 13.13 C ATOM 1232 CG LYS A 79 -13.829 -21.642 28.098 1.00 11.32 C ATOM 1233 CD LYS A 79 -13.080 -21.903 26.801 1.00 71.24 C ATOM 1234 CE LYS A 79 -11.696 -21.274 26.820 1.00 52.13 C ATOM 1235 NZ LYS A 79 -11.025 -21.370 25.494 1.00 30.23 N ATOM 0 H LYS A 79 -15.124 -21.267 30.402 1.00 42.32 H new ATOM 0 HA LYS A 79 -16.842 -23.141 28.962 1.00 44.45 H new ATOM 0 HB2 LYS A 79 -15.441 -22.599 27.070 1.00 13.13 H new ATOM 0 HB3 LYS A 79 -15.887 -21.106 27.872 1.00 13.13 H new ATOM 0 HG2 LYS A 79 -13.742 -20.589 28.364 1.00 11.32 H new ATOM 0 HG3 LYS A 79 -13.371 -22.214 28.905 1.00 11.32 H new ATOM 0 HD2 LYS A 79 -12.990 -22.978 26.642 1.00 71.24 H new ATOM 0 HD3 LYS A 79 -13.651 -21.503 25.963 1.00 71.24 H new ATOM 0 HE2 LYS A 79 -11.777 -20.227 27.111 1.00 52.13 H new ATOM 0 HE3 LYS A 79 -11.083 -21.768 27.574 1.00 52.13 H new ATOM 0 HZ1 LYS A 79 -10.084 -20.930 25.548 1.00 30.23 H new ATOM 0 HZ2 LYS A 79 -10.925 -22.370 25.227 1.00 30.23 H new ATOM 0 HZ3 LYS A 79 -11.597 -20.877 24.779 1.00 30.23 H new ATOM 1249 N LYS A 80 -14.089 -23.985 30.400 1.00 33.32 N ATOM 1250 CA LYS A 80 -13.203 -25.099 30.719 1.00 41.11 C ATOM 1251 C LYS A 80 -13.964 -26.211 31.435 1.00 12.24 C ATOM 1252 O LYS A 80 -13.897 -27.376 31.040 1.00 63.41 O ATOM 1253 CB LYS A 80 -12.041 -24.619 31.591 1.00 34.51 C ATOM 1254 CG LYS A 80 -11.310 -25.744 32.304 1.00 71.23 C ATOM 1255 CD LYS A 80 -9.983 -25.273 32.874 1.00 12.35 C ATOM 1256 CE LYS A 80 -9.000 -24.909 31.771 1.00 31.14 C ATOM 1257 NZ LYS A 80 -7.591 -24.942 32.250 1.00 22.21 N ATOM 0 H LYS A 80 -13.981 -23.173 31.008 1.00 33.32 H new ATOM 0 HA LYS A 80 -12.808 -25.496 29.784 1.00 41.11 H new ATOM 0 HB2 LYS A 80 -11.332 -24.073 30.968 1.00 34.51 H new ATOM 0 HB3 LYS A 80 -12.421 -23.916 32.333 1.00 34.51 H new ATOM 0 HG2 LYS A 80 -11.935 -26.133 33.108 1.00 71.23 H new ATOM 0 HG3 LYS A 80 -11.137 -26.565 31.608 1.00 71.23 H new ATOM 0 HD2 LYS A 80 -10.148 -24.408 33.516 1.00 12.35 H new ATOM 0 HD3 LYS A 80 -9.556 -26.057 33.499 1.00 12.35 H new ATOM 0 HE2 LYS A 80 -9.116 -25.602 30.938 1.00 31.14 H new ATOM 0 HE3 LYS A 80 -9.232 -23.913 31.392 1.00 31.14 H new ATOM 0 HZ1 LYS A 80 -7.071 -24.133 31.855 1.00 22.21 H new ATOM 0 HZ2 LYS A 80 -7.576 -24.890 33.289 1.00 22.21 H new ATOM 0 HZ3 LYS A 80 -7.140 -25.827 31.942 1.00 22.21 H new ATOM 1271 N LEU A 81 -14.686 -25.844 32.487 1.00 43.34 N ATOM 1272 CA LEU A 81 -15.461 -26.811 33.257 1.00 31.52 C ATOM 1273 C LEU A 81 -16.888 -26.910 32.728 1.00 41.12 C ATOM 1274 O LEU A 81 -17.769 -27.460 33.389 1.00 43.53 O ATOM 1275 CB LEU A 81 -15.480 -26.418 34.735 1.00 23.04 C ATOM 1276 CG LEU A 81 -14.171 -25.862 35.299 1.00 64.35 C ATOM 1277 CD1 LEU A 81 -14.405 -25.220 36.657 1.00 3.34 C ATOM 1278 CD2 LEU A 81 -13.124 -26.962 35.399 1.00 53.42 C ATOM 0 H LEU A 81 -14.751 -24.884 32.827 1.00 43.34 H new ATOM 0 HA LEU A 81 -14.985 -27.786 33.152 1.00 31.52 H new ATOM 0 HB2 LEU A 81 -16.261 -25.672 34.882 1.00 23.04 H new ATOM 0 HB3 LEU A 81 -15.761 -27.294 35.320 1.00 23.04 H new ATOM 0 HG LEU A 81 -13.800 -25.096 34.618 1.00 64.35 H new ATOM 0 HD11 LEU A 81 -13.463 -24.830 37.042 1.00 3.34 H new ATOM 0 HD12 LEU A 81 -15.121 -24.404 36.555 1.00 3.34 H new ATOM 0 HD13 LEU A 81 -14.800 -25.965 37.348 1.00 3.34 H new ATOM 0 HD21 LEU A 81 -12.199 -26.549 35.802 1.00 53.42 H new ATOM 0 HD22 LEU A 81 -13.487 -27.751 36.058 1.00 53.42 H new ATOM 0 HD23 LEU A 81 -12.935 -27.376 34.408 1.00 53.42 H new ATOM 1290 N SER A 82 -17.108 -26.377 31.530 1.00 54.04 N ATOM 1291 CA SER A 82 -18.428 -26.404 30.912 1.00 32.02 C ATOM 1292 C SER A 82 -19.488 -25.869 31.870 1.00 4.42 C ATOM 1293 O SER A 82 -20.590 -26.412 31.962 1.00 2.21 O ATOM 1294 CB SER A 82 -18.785 -27.829 30.484 1.00 44.20 C ATOM 1295 OG SER A 82 -17.620 -28.621 30.327 1.00 41.30 O ATOM 0 H SER A 82 -16.389 -25.921 30.968 1.00 54.04 H new ATOM 0 HA SER A 82 -18.402 -25.763 30.031 1.00 32.02 H new ATOM 0 HB2 SER A 82 -19.439 -28.283 31.228 1.00 44.20 H new ATOM 0 HB3 SER A 82 -19.340 -27.802 29.546 1.00 44.20 H new ATOM 0 HG SER A 82 -17.875 -29.527 30.055 1.00 41.30 H new ATOM 1301 N LEU A 83 -19.147 -24.801 32.583 1.00 31.43 N ATOM 1302 CA LEU A 83 -20.067 -24.191 33.536 1.00 52.32 C ATOM 1303 C LEU A 83 -21.092 -23.317 32.819 1.00 70.21 C ATOM 1304 O LEU A 83 -20.901 -22.110 32.672 1.00 41.32 O ATOM 1305 CB LEU A 83 -19.295 -23.356 34.558 1.00 52.31 C ATOM 1306 CG LEU A 83 -19.126 -23.980 35.944 1.00 14.21 C ATOM 1307 CD1 LEU A 83 -20.437 -23.937 36.712 1.00 64.01 C ATOM 1308 CD2 LEU A 83 -18.621 -25.411 35.826 1.00 23.20 C ATOM 0 H LEU A 83 -18.240 -24.340 32.519 1.00 31.43 H new ATOM 0 HA LEU A 83 -20.596 -24.990 34.055 1.00 52.32 H new ATOM 0 HB2 LEU A 83 -18.305 -23.146 34.153 1.00 52.31 H new ATOM 0 HB3 LEU A 83 -19.802 -22.398 34.672 1.00 52.31 H new ATOM 0 HG LEU A 83 -18.387 -23.399 36.496 1.00 14.21 H new ATOM 0 HD11 LEU A 83 -20.297 -24.385 37.696 1.00 64.01 H new ATOM 0 HD12 LEU A 83 -20.757 -22.902 36.827 1.00 64.01 H new ATOM 0 HD13 LEU A 83 -21.198 -24.493 36.164 1.00 64.01 H new ATOM 0 HD21 LEU A 83 -18.506 -25.840 36.822 1.00 23.20 H new ATOM 0 HD22 LEU A 83 -19.337 -26.004 35.256 1.00 23.20 H new ATOM 0 HD23 LEU A 83 -17.658 -25.416 35.316 1.00 23.20 H new ATOM 1320 N THR A 84 -22.183 -23.935 32.376 1.00 32.40 N ATOM 1321 CA THR A 84 -23.238 -23.215 31.676 1.00 2.43 C ATOM 1322 C THR A 84 -23.589 -21.917 32.395 1.00 35.23 C ATOM 1323 O THR A 84 -23.366 -21.785 33.598 1.00 63.52 O ATOM 1324 CB THR A 84 -24.510 -24.073 31.540 1.00 53.14 C ATOM 1325 OG1 THR A 84 -25.642 -23.235 31.285 1.00 11.15 O ATOM 1326 CG2 THR A 84 -24.750 -24.887 32.802 1.00 31.43 C ATOM 0 H THR A 84 -22.358 -24.933 32.490 1.00 32.40 H new ATOM 0 HA THR A 84 -22.856 -22.985 30.681 1.00 2.43 H new ATOM 0 HB THR A 84 -24.371 -24.759 30.704 1.00 53.14 H new ATOM 0 HG1 THR A 84 -26.446 -23.789 31.198 1.00 11.15 H new ATOM 0 HG21 THR A 84 -25.653 -25.485 32.683 1.00 31.43 H new ATOM 0 HG22 THR A 84 -23.899 -25.546 32.977 1.00 31.43 H new ATOM 0 HG23 THR A 84 -24.869 -24.215 33.651 1.00 31.43 H new ATOM 1334 N GLN A 85 -24.140 -20.964 31.651 1.00 61.05 N ATOM 1335 CA GLN A 85 -24.521 -19.676 32.220 1.00 30.02 C ATOM 1336 C GLN A 85 -25.556 -19.855 33.326 1.00 51.25 C ATOM 1337 O GLN A 85 -25.747 -18.970 34.161 1.00 62.23 O ATOM 1338 CB GLN A 85 -25.076 -18.758 31.130 1.00 33.01 C ATOM 1339 CG GLN A 85 -26.256 -19.350 30.377 1.00 22.32 C ATOM 1340 CD GLN A 85 -25.889 -19.796 28.975 1.00 75.24 C ATOM 1341 OE1 GLN A 85 -25.018 -19.208 28.332 1.00 65.33 O ATOM 1342 NE2 GLN A 85 -26.554 -20.839 28.492 1.00 1.01 N ATOM 0 H GLN A 85 -24.333 -21.059 30.654 1.00 61.05 H new ATOM 0 HA GLN A 85 -23.630 -19.219 32.651 1.00 30.02 H new ATOM 0 HB2 GLN A 85 -25.381 -17.814 31.582 1.00 33.01 H new ATOM 0 HB3 GLN A 85 -24.281 -18.529 30.420 1.00 33.01 H new ATOM 0 HG2 GLN A 85 -26.648 -20.201 30.934 1.00 22.32 H new ATOM 0 HG3 GLN A 85 -27.055 -18.610 30.322 1.00 22.32 H new ATOM 0 HE21 GLN A 85 -27.268 -21.296 29.060 1.00 1.01 H new ATOM 0 HE22 GLN A 85 -26.351 -21.183 27.553 1.00 1.01 H new ATOM 1351 N LYS A 86 -26.222 -21.005 33.326 1.00 3.22 N ATOM 1352 CA LYS A 86 -27.237 -21.301 34.330 1.00 43.32 C ATOM 1353 C LYS A 86 -26.598 -21.818 35.614 1.00 33.35 C ATOM 1354 O LYS A 86 -26.850 -21.293 36.698 1.00 2.31 O ATOM 1355 CB LYS A 86 -28.231 -22.333 33.790 1.00 42.53 C ATOM 1356 CG LYS A 86 -29.599 -21.754 33.477 1.00 22.51 C ATOM 1357 CD LYS A 86 -29.785 -21.536 31.985 1.00 0.30 C ATOM 1358 CE LYS A 86 -30.820 -20.457 31.704 1.00 73.01 C ATOM 1359 NZ LYS A 86 -30.201 -19.106 31.613 1.00 61.34 N ATOM 0 H LYS A 86 -26.077 -21.747 32.642 1.00 3.22 H new ATOM 0 HA LYS A 86 -27.769 -20.377 34.557 1.00 43.32 H new ATOM 0 HB2 LYS A 86 -27.820 -22.782 32.886 1.00 42.53 H new ATOM 0 HB3 LYS A 86 -28.343 -23.134 34.521 1.00 42.53 H new ATOM 0 HG2 LYS A 86 -30.373 -22.427 33.846 1.00 22.51 H new ATOM 0 HG3 LYS A 86 -29.723 -20.807 34.002 1.00 22.51 H new ATOM 0 HD2 LYS A 86 -28.833 -21.254 31.536 1.00 0.30 H new ATOM 0 HD3 LYS A 86 -30.095 -22.470 31.516 1.00 0.30 H new ATOM 0 HE2 LYS A 86 -31.337 -20.683 30.771 1.00 73.01 H new ATOM 0 HE3 LYS A 86 -31.571 -20.460 32.494 1.00 73.01 H new ATOM 0 HZ1 LYS A 86 -30.939 -18.398 31.421 1.00 61.34 H new ATOM 0 HZ2 LYS A 86 -29.729 -18.879 32.512 1.00 61.34 H new ATOM 0 HZ3 LYS A 86 -29.502 -19.096 30.843 1.00 61.34 H new ATOM 1373 N GLU A 87 -25.769 -22.849 35.484 1.00 25.13 N ATOM 1374 CA GLU A 87 -25.093 -23.435 36.635 1.00 64.10 C ATOM 1375 C GLU A 87 -24.165 -22.421 37.297 1.00 61.34 C ATOM 1376 O GLU A 87 -24.198 -22.233 38.512 1.00 51.34 O ATOM 1377 CB GLU A 87 -24.297 -24.672 36.213 1.00 24.35 C ATOM 1378 CG GLU A 87 -24.117 -25.690 37.326 1.00 52.04 C ATOM 1379 CD GLU A 87 -24.539 -27.087 36.913 1.00 42.14 C ATOM 1380 OE1 GLU A 87 -23.724 -27.791 36.282 1.00 24.32 O ATOM 1381 OE2 GLU A 87 -25.685 -27.475 37.223 1.00 1.31 O ATOM 0 H GLU A 87 -25.550 -23.295 34.593 1.00 25.13 H new ATOM 0 HA GLU A 87 -25.854 -23.731 37.358 1.00 64.10 H new ATOM 0 HB2 GLU A 87 -24.802 -25.150 35.374 1.00 24.35 H new ATOM 0 HB3 GLU A 87 -23.316 -24.358 35.857 1.00 24.35 H new ATOM 0 HG2 GLU A 87 -23.071 -25.706 37.633 1.00 52.04 H new ATOM 0 HG3 GLU A 87 -24.699 -25.380 38.194 1.00 52.04 H new ATOM 1388 N ALA A 88 -23.336 -21.770 36.486 1.00 41.24 N ATOM 1389 CA ALA A 88 -22.400 -20.774 36.991 1.00 23.05 C ATOM 1390 C ALA A 88 -23.125 -19.685 37.775 1.00 73.15 C ATOM 1391 O ALA A 88 -22.578 -19.118 38.720 1.00 64.23 O ATOM 1392 CB ALA A 88 -21.609 -20.163 35.844 1.00 51.41 C ATOM 0 H ALA A 88 -23.294 -21.915 35.477 1.00 41.24 H new ATOM 0 HA ALA A 88 -21.709 -21.274 37.669 1.00 23.05 H new ATOM 0 HB1 ALA A 88 -20.914 -19.421 36.236 1.00 51.41 H new ATOM 0 HB2 ALA A 88 -21.052 -20.945 35.329 1.00 51.41 H new ATOM 0 HB3 ALA A 88 -22.294 -19.684 35.144 1.00 51.41 H new ATOM 1398 N SER A 89 -24.360 -19.398 37.375 1.00 61.34 N ATOM 1399 CA SER A 89 -25.159 -18.374 38.037 1.00 5.31 C ATOM 1400 C SER A 89 -25.781 -18.915 39.321 1.00 62.40 C ATOM 1401 O SER A 89 -25.909 -18.196 40.311 1.00 62.31 O ATOM 1402 CB SER A 89 -26.257 -17.868 37.099 1.00 53.23 C ATOM 1403 OG SER A 89 -27.346 -18.773 37.055 1.00 43.53 O ATOM 0 H SER A 89 -24.829 -19.860 36.596 1.00 61.34 H new ATOM 0 HA SER A 89 -24.500 -17.545 38.295 1.00 5.31 H new ATOM 0 HB2 SER A 89 -26.605 -16.891 37.435 1.00 53.23 H new ATOM 0 HB3 SER A 89 -25.850 -17.734 36.097 1.00 53.23 H new ATOM 0 HG SER A 89 -27.009 -19.685 36.931 1.00 43.53 H new ATOM 1409 N GLU A 90 -26.164 -20.188 39.294 1.00 22.40 N ATOM 1410 CA GLU A 90 -26.773 -20.826 40.455 1.00 40.30 C ATOM 1411 C GLU A 90 -25.725 -21.129 41.522 1.00 23.32 C ATOM 1412 O GLU A 90 -26.047 -21.270 42.702 1.00 30.31 O ATOM 1413 CB GLU A 90 -27.484 -22.116 40.042 1.00 43.23 C ATOM 1414 CG GLU A 90 -28.732 -21.883 39.207 1.00 62.12 C ATOM 1415 CD GLU A 90 -29.133 -23.104 38.403 1.00 63.23 C ATOM 1416 OE1 GLU A 90 -29.131 -24.216 38.972 1.00 35.12 O ATOM 1417 OE2 GLU A 90 -29.449 -22.949 37.205 1.00 54.43 O ATOM 0 H GLU A 90 -26.063 -20.797 38.482 1.00 22.40 H new ATOM 0 HA GLU A 90 -27.504 -20.135 40.875 1.00 40.30 H new ATOM 0 HB2 GLU A 90 -26.790 -22.738 39.477 1.00 43.23 H new ATOM 0 HB3 GLU A 90 -27.756 -22.674 40.938 1.00 43.23 H new ATOM 0 HG2 GLU A 90 -29.555 -21.598 39.862 1.00 62.12 H new ATOM 0 HG3 GLU A 90 -28.560 -21.047 38.529 1.00 62.12 H new ATOM 1424 N ILE A 91 -24.470 -21.229 41.097 1.00 41.24 N ATOM 1425 CA ILE A 91 -23.374 -21.515 42.015 1.00 12.34 C ATOM 1426 C ILE A 91 -22.564 -20.258 42.313 1.00 1.25 C ATOM 1427 O ILE A 91 -22.502 -19.802 43.455 1.00 44.51 O ATOM 1428 CB ILE A 91 -22.434 -22.597 41.450 1.00 14.23 C ATOM 1429 CG1 ILE A 91 -23.234 -23.832 41.034 1.00 35.20 C ATOM 1430 CG2 ILE A 91 -21.374 -22.966 42.477 1.00 61.13 C ATOM 1431 CD1 ILE A 91 -22.411 -24.866 40.297 1.00 42.41 C ATOM 0 H ILE A 91 -24.187 -21.116 40.124 1.00 41.24 H new ATOM 0 HA ILE A 91 -23.823 -21.882 42.938 1.00 12.34 H new ATOM 0 HB ILE A 91 -21.934 -22.198 40.568 1.00 14.23 H new ATOM 0 HG12 ILE A 91 -23.667 -24.291 41.923 1.00 35.20 H new ATOM 0 HG13 ILE A 91 -24.064 -23.521 40.400 1.00 35.20 H new ATOM 0 HG21 ILE A 91 -20.717 -23.731 42.063 1.00 61.13 H new ATOM 0 HG22 ILE A 91 -20.788 -22.082 42.728 1.00 61.13 H new ATOM 0 HG23 ILE A 91 -21.856 -23.349 43.376 1.00 61.13 H new ATOM 0 HD11 ILE A 91 -23.043 -25.714 40.033 1.00 42.41 H new ATOM 0 HD12 ILE A 91 -21.999 -24.424 39.390 1.00 42.41 H new ATOM 0 HD13 ILE A 91 -21.597 -25.206 40.937 1.00 42.41 H new ATOM 1443 N PHE A 92 -21.945 -19.701 41.277 1.00 75.43 N ATOM 1444 CA PHE A 92 -21.139 -18.495 41.427 1.00 13.24 C ATOM 1445 C PHE A 92 -22.026 -17.263 41.580 1.00 1.41 C ATOM 1446 O PHE A 92 -22.015 -16.602 42.617 1.00 52.15 O ATOM 1447 CB PHE A 92 -20.211 -18.323 40.222 1.00 40.32 C ATOM 1448 CG PHE A 92 -19.549 -19.600 39.788 1.00 0.11 C ATOM 1449 CD1 PHE A 92 -18.914 -20.415 40.711 1.00 53.13 C ATOM 1450 CD2 PHE A 92 -19.562 -19.985 38.457 1.00 60.21 C ATOM 1451 CE1 PHE A 92 -18.304 -21.590 40.314 1.00 52.55 C ATOM 1452 CE2 PHE A 92 -18.954 -21.159 38.054 1.00 52.21 C ATOM 1453 CZ PHE A 92 -18.325 -21.963 38.984 1.00 74.52 C ATOM 0 H PHE A 92 -21.986 -20.065 40.325 1.00 75.43 H new ATOM 0 HA PHE A 92 -20.536 -18.601 42.329 1.00 13.24 H new ATOM 0 HB2 PHE A 92 -20.783 -17.918 39.388 1.00 40.32 H new ATOM 0 HB3 PHE A 92 -19.443 -17.590 40.467 1.00 40.32 H new ATOM 0 HD1 PHE A 92 -18.895 -20.129 41.752 1.00 53.13 H new ATOM 0 HD2 PHE A 92 -20.053 -19.360 37.726 1.00 60.21 H new ATOM 0 HE1 PHE A 92 -17.811 -22.216 41.043 1.00 52.55 H new ATOM 0 HE2 PHE A 92 -18.971 -21.447 37.013 1.00 52.21 H new ATOM 0 HZ PHE A 92 -17.850 -22.882 38.672 1.00 74.52 H new ATOM 1463 N GLY A 93 -22.793 -16.960 40.537 1.00 40.11 N ATOM 1464 CA GLY A 93 -23.675 -15.809 40.575 1.00 2.52 C ATOM 1465 C GLY A 93 -23.432 -14.854 39.422 1.00 34.55 C ATOM 1466 O GLY A 93 -23.563 -13.640 39.574 1.00 44.31 O ATOM 0 H GLY A 93 -22.819 -17.491 39.667 1.00 40.11 H new ATOM 0 HA2 GLY A 93 -24.711 -16.148 40.550 1.00 2.52 H new ATOM 0 HA3 GLY A 93 -23.536 -15.279 41.517 1.00 2.52 H new ATOM 1470 N GLY A 94 -23.076 -15.404 38.265 1.00 14.50 N ATOM 1471 CA GLY A 94 -22.818 -14.579 37.100 1.00 23.21 C ATOM 1472 C GLY A 94 -23.954 -13.620 36.805 1.00 41.52 C ATOM 1473 O GLY A 94 -23.735 -12.424 36.620 1.00 13.33 O ATOM 0 H GLY A 94 -22.962 -16.406 38.114 1.00 14.50 H new ATOM 0 HA2 GLY A 94 -21.900 -14.013 37.256 1.00 23.21 H new ATOM 0 HA3 GLY A 94 -22.654 -15.220 36.234 1.00 23.21 H new ATOM 1477 N GLY A 95 -25.174 -14.147 36.759 1.00 4.14 N ATOM 1478 CA GLY A 95 -26.331 -13.316 36.482 1.00 22.33 C ATOM 1479 C GLY A 95 -26.902 -13.558 35.099 1.00 33.32 C ATOM 1480 O GLY A 95 -27.022 -14.703 34.661 1.00 71.53 O ATOM 0 H GLY A 95 -25.382 -15.134 36.909 1.00 4.14 H new ATOM 0 HA2 GLY A 95 -27.101 -13.510 37.229 1.00 22.33 H new ATOM 0 HA3 GLY A 95 -26.052 -12.267 36.578 1.00 22.33 H new ATOM 1484 N VAL A 96 -27.256 -12.479 34.409 1.00 51.33 N ATOM 1485 CA VAL A 96 -27.817 -12.580 33.067 1.00 62.22 C ATOM 1486 C VAL A 96 -26.760 -12.294 32.006 1.00 15.23 C ATOM 1487 O VAL A 96 -26.290 -13.204 31.324 1.00 21.34 O ATOM 1488 CB VAL A 96 -28.995 -11.606 32.877 1.00 30.51 C ATOM 1489 CG1 VAL A 96 -30.101 -12.258 32.062 1.00 41.11 C ATOM 1490 CG2 VAL A 96 -29.521 -11.137 34.226 1.00 34.34 C ATOM 0 H VAL A 96 -27.164 -11.525 34.757 1.00 51.33 H new ATOM 0 HA VAL A 96 -28.177 -13.602 32.951 1.00 62.22 H new ATOM 0 HB VAL A 96 -28.638 -10.734 32.328 1.00 30.51 H new ATOM 0 HG11 VAL A 96 -30.925 -11.555 31.938 1.00 41.11 H new ATOM 0 HG12 VAL A 96 -29.714 -12.539 31.083 1.00 41.11 H new ATOM 0 HG13 VAL A 96 -30.458 -13.148 32.580 1.00 41.11 H new ATOM 0 HG21 VAL A 96 -30.353 -10.450 34.073 1.00 34.34 H new ATOM 0 HG22 VAL A 96 -29.862 -11.997 34.802 1.00 34.34 H new ATOM 0 HG23 VAL A 96 -28.725 -10.628 34.770 1.00 34.34 H new ATOM 1500 N ASN A 97 -26.392 -11.024 31.873 1.00 32.04 N ATOM 1501 CA ASN A 97 -25.390 -10.618 30.894 1.00 71.14 C ATOM 1502 C ASN A 97 -23.982 -10.774 31.460 1.00 32.40 C ATOM 1503 O ASN A 97 -23.119 -9.921 31.250 1.00 63.43 O ATOM 1504 CB ASN A 97 -25.622 -9.168 30.466 1.00 13.34 C ATOM 1505 CG ASN A 97 -25.573 -8.205 31.637 1.00 5.25 C ATOM 1506 OD1 ASN A 97 -24.512 -7.964 32.213 1.00 22.32 O ATOM 1507 ND2 ASN A 97 -26.725 -7.650 31.995 1.00 33.43 N ATOM 0 H ASN A 97 -26.772 -10.259 32.430 1.00 32.04 H new ATOM 0 HA ASN A 97 -25.486 -11.266 30.023 1.00 71.14 H new ATOM 0 HB2 ASN A 97 -24.867 -8.883 29.733 1.00 13.34 H new ATOM 0 HB3 ASN A 97 -26.591 -9.088 29.973 1.00 13.34 H new ATOM 0 HD21 ASN A 97 -26.754 -6.995 32.776 1.00 33.43 H new ATOM 0 HD22 ASN A 97 -27.580 -7.879 31.489 1.00 33.43 H new ATOM 1514 N ALA A 98 -23.756 -11.869 32.179 1.00 41.14 N ATOM 1515 CA ALA A 98 -22.453 -12.137 32.774 1.00 55.14 C ATOM 1516 C ALA A 98 -21.372 -12.238 31.703 1.00 44.22 C ATOM 1517 O ALA A 98 -20.574 -11.318 31.524 1.00 5.54 O ATOM 1518 CB ALA A 98 -22.503 -13.415 33.599 1.00 14.50 C ATOM 0 H ALA A 98 -24.459 -12.585 32.363 1.00 41.14 H new ATOM 0 HA ALA A 98 -22.201 -11.304 33.430 1.00 55.14 H new ATOM 0 HB1 ALA A 98 -21.523 -13.603 34.038 1.00 14.50 H new ATOM 0 HB2 ALA A 98 -23.242 -13.307 34.393 1.00 14.50 H new ATOM 0 HB3 ALA A 98 -22.780 -14.252 32.958 1.00 14.50 H new ATOM 1524 N PHE A 99 -21.350 -13.362 30.994 1.00 71.43 N ATOM 1525 CA PHE A 99 -20.365 -13.584 29.942 1.00 73.42 C ATOM 1526 C PHE A 99 -20.068 -12.288 29.194 1.00 75.24 C ATOM 1527 O PHE A 99 -18.909 -11.945 28.960 1.00 52.03 O ATOM 1528 CB PHE A 99 -20.865 -14.649 28.963 1.00 54.41 C ATOM 1529 CG PHE A 99 -20.660 -16.055 29.451 1.00 15.32 C ATOM 1530 CD1 PHE A 99 -21.430 -16.562 30.486 1.00 23.44 C ATOM 1531 CD2 PHE A 99 -19.699 -16.869 28.875 1.00 41.11 C ATOM 1532 CE1 PHE A 99 -21.244 -17.855 30.937 1.00 55.24 C ATOM 1533 CE2 PHE A 99 -19.508 -18.163 29.322 1.00 51.12 C ATOM 1534 CZ PHE A 99 -20.282 -18.657 30.354 1.00 25.04 C ATOM 0 H PHE A 99 -22.003 -14.133 31.129 1.00 71.43 H new ATOM 0 HA PHE A 99 -19.444 -13.933 30.408 1.00 73.42 H new ATOM 0 HB2 PHE A 99 -21.927 -14.489 28.776 1.00 54.41 H new ATOM 0 HB3 PHE A 99 -20.351 -14.525 28.010 1.00 54.41 H new ATOM 0 HD1 PHE A 99 -22.184 -15.940 30.945 1.00 23.44 H new ATOM 0 HD2 PHE A 99 -19.092 -16.488 28.067 1.00 41.11 H new ATOM 0 HE1 PHE A 99 -21.850 -18.238 31.745 1.00 55.24 H new ATOM 0 HE2 PHE A 99 -18.754 -18.787 28.865 1.00 51.12 H new ATOM 0 HZ PHE A 99 -20.135 -19.668 30.704 1.00 25.04 H new ATOM 1544 N SER A 100 -21.124 -11.573 28.819 1.00 74.31 N ATOM 1545 CA SER A 100 -20.977 -10.317 28.093 1.00 73.34 C ATOM 1546 C SER A 100 -20.123 -9.329 28.882 1.00 3.45 C ATOM 1547 O SER A 100 -18.954 -9.112 28.566 1.00 42.00 O ATOM 1548 CB SER A 100 -22.350 -9.706 27.806 1.00 2.41 C ATOM 1549 OG SER A 100 -22.870 -10.176 26.574 1.00 15.54 O ATOM 0 H SER A 100 -22.090 -11.842 29.006 1.00 74.31 H new ATOM 0 HA SER A 100 -20.476 -10.529 27.148 1.00 73.34 H new ATOM 0 HB2 SER A 100 -23.038 -9.955 28.614 1.00 2.41 H new ATOM 0 HB3 SER A 100 -22.270 -8.619 27.780 1.00 2.41 H new ATOM 0 HG SER A 100 -23.749 -9.772 26.414 1.00 15.54 H new ATOM 1555 N ARG A 101 -20.718 -8.734 29.911 1.00 60.12 N ATOM 1556 CA ARG A 101 -20.013 -7.768 30.746 1.00 23.13 C ATOM 1557 C ARG A 101 -18.641 -8.299 31.151 1.00 1.31 C ATOM 1558 O ARG A 101 -17.624 -7.631 30.958 1.00 51.31 O ATOM 1559 CB ARG A 101 -20.836 -7.446 31.995 1.00 1.31 C ATOM 1560 CG ARG A 101 -21.923 -6.410 31.757 1.00 1.01 C ATOM 1561 CD ARG A 101 -22.437 -5.831 33.066 1.00 52.04 C ATOM 1562 NE ARG A 101 -22.529 -4.375 33.022 1.00 64.23 N ATOM 1563 CZ ARG A 101 -22.974 -3.635 34.032 1.00 11.31 C ATOM 1564 NH1 ARG A 101 -23.364 -4.213 35.159 1.00 33.52 N ATOM 1565 NH2 ARG A 101 -23.028 -2.315 33.915 1.00 23.10 N ATOM 0 H ARG A 101 -21.685 -8.904 30.186 1.00 60.12 H new ATOM 0 HA ARG A 101 -19.874 -6.856 30.165 1.00 23.13 H new ATOM 0 HB2 ARG A 101 -21.295 -8.363 32.364 1.00 1.31 H new ATOM 0 HB3 ARG A 101 -20.168 -7.086 32.777 1.00 1.31 H new ATOM 0 HG2 ARG A 101 -21.532 -5.608 31.132 1.00 1.01 H new ATOM 0 HG3 ARG A 101 -22.749 -6.866 31.211 1.00 1.01 H new ATOM 0 HD2 ARG A 101 -23.419 -6.250 33.287 1.00 52.04 H new ATOM 0 HD3 ARG A 101 -21.774 -6.128 33.879 1.00 52.04 H new ATOM 0 HE ARG A 101 -22.235 -3.899 32.169 1.00 64.23 H new ATOM 0 HH11 ARG A 101 -23.323 -5.228 35.252 1.00 33.52 H new ATOM 0 HH12 ARG A 101 -23.705 -3.643 35.933 1.00 33.52 H new ATOM 0 HH21 ARG A 101 -22.728 -1.867 33.049 1.00 23.10 H new ATOM 0 HH22 ARG A 101 -23.370 -1.748 34.691 1.00 23.10 H new ATOM 1579 N TYR A 102 -18.620 -9.502 31.714 1.00 4.12 N ATOM 1580 CA TYR A 102 -17.373 -10.120 32.149 1.00 31.30 C ATOM 1581 C TYR A 102 -16.324 -10.067 31.043 1.00 62.30 C ATOM 1582 O TYR A 102 -15.141 -9.855 31.306 1.00 22.44 O ATOM 1583 CB TYR A 102 -17.618 -11.571 32.566 1.00 62.25 C ATOM 1584 CG TYR A 102 -17.968 -11.730 34.029 1.00 64.35 C ATOM 1585 CD1 TYR A 102 -17.017 -11.511 35.018 1.00 41.42 C ATOM 1586 CD2 TYR A 102 -19.249 -12.099 34.421 1.00 14.34 C ATOM 1587 CE1 TYR A 102 -17.332 -11.656 36.355 1.00 62.14 C ATOM 1588 CE2 TYR A 102 -19.573 -12.245 35.756 1.00 2.53 C ATOM 1589 CZ TYR A 102 -18.611 -12.023 36.719 1.00 23.41 C ATOM 1590 OH TYR A 102 -18.929 -12.167 38.050 1.00 42.42 O ATOM 0 H TYR A 102 -19.452 -10.068 31.880 1.00 4.12 H new ATOM 0 HA TYR A 102 -16.999 -9.560 33.006 1.00 31.30 H new ATOM 0 HB2 TYR A 102 -18.426 -11.983 31.961 1.00 62.25 H new ATOM 0 HB3 TYR A 102 -16.726 -12.158 32.349 1.00 62.25 H new ATOM 0 HD1 TYR A 102 -16.015 -11.223 34.737 1.00 41.42 H new ATOM 0 HD2 TYR A 102 -20.004 -12.275 33.669 1.00 14.34 H new ATOM 0 HE1 TYR A 102 -16.581 -11.483 37.112 1.00 62.14 H new ATOM 0 HE2 TYR A 102 -20.574 -12.531 36.044 1.00 2.53 H new ATOM 0 HH TYR A 102 -19.040 -11.283 38.457 1.00 42.42 H new ATOM 1600 N GLU A 103 -16.768 -10.262 29.805 1.00 64.35 N ATOM 1601 CA GLU A 103 -15.867 -10.237 28.659 1.00 34.24 C ATOM 1602 C GLU A 103 -15.068 -8.937 28.623 1.00 60.24 C ATOM 1603 O GLU A 103 -13.883 -8.932 28.289 1.00 74.53 O ATOM 1604 CB GLU A 103 -16.657 -10.399 27.358 1.00 11.23 C ATOM 1605 CG GLU A 103 -15.786 -10.703 26.151 1.00 52.02 C ATOM 1606 CD GLU A 103 -16.430 -11.696 25.202 1.00 31.41 C ATOM 1607 OE1 GLU A 103 -16.824 -12.787 25.664 1.00 22.20 O ATOM 1608 OE2 GLU A 103 -16.539 -11.382 23.999 1.00 54.24 O ATOM 0 H GLU A 103 -17.745 -10.439 29.571 1.00 64.35 H new ATOM 0 HA GLU A 103 -15.170 -11.069 28.759 1.00 34.24 H new ATOM 0 HB2 GLU A 103 -17.384 -11.201 27.482 1.00 11.23 H new ATOM 0 HB3 GLU A 103 -17.220 -9.485 27.168 1.00 11.23 H new ATOM 0 HG2 GLU A 103 -15.578 -9.777 25.615 1.00 52.02 H new ATOM 0 HG3 GLU A 103 -14.828 -11.098 26.489 1.00 52.02 H new ATOM 1615 N LYS A 104 -15.726 -7.836 28.968 1.00 21.35 N ATOM 1616 CA LYS A 104 -15.080 -6.529 28.977 1.00 2.40 C ATOM 1617 C LYS A 104 -14.548 -6.194 30.367 1.00 31.43 C ATOM 1618 O LYS A 104 -13.710 -5.308 30.525 1.00 30.45 O ATOM 1619 CB LYS A 104 -16.062 -5.448 28.521 1.00 24.52 C ATOM 1620 CG LYS A 104 -16.218 -5.365 27.012 1.00 61.22 C ATOM 1621 CD LYS A 104 -17.233 -6.373 26.500 1.00 54.50 C ATOM 1622 CE LYS A 104 -18.652 -5.975 26.877 1.00 53.52 C ATOM 1623 NZ LYS A 104 -19.003 -4.622 26.365 1.00 14.44 N ATOM 0 H LYS A 104 -16.707 -7.823 29.245 1.00 21.35 H new ATOM 0 HA LYS A 104 -14.239 -6.563 28.284 1.00 2.40 H new ATOM 0 HB2 LYS A 104 -17.037 -5.642 28.968 1.00 24.52 H new ATOM 0 HB3 LYS A 104 -15.726 -4.482 28.897 1.00 24.52 H new ATOM 0 HG2 LYS A 104 -16.530 -4.359 26.732 1.00 61.22 H new ATOM 0 HG3 LYS A 104 -15.254 -5.544 26.535 1.00 61.22 H new ATOM 0 HD2 LYS A 104 -17.152 -6.454 25.416 1.00 54.50 H new ATOM 0 HD3 LYS A 104 -17.009 -7.358 26.911 1.00 54.50 H new ATOM 0 HE2 LYS A 104 -19.353 -6.708 26.477 1.00 53.52 H new ATOM 0 HE3 LYS A 104 -18.758 -5.992 27.962 1.00 53.52 H new ATOM 0 HZ1 LYS A 104 -20.037 -4.532 26.303 1.00 14.44 H new ATOM 0 HZ2 LYS A 104 -18.631 -3.898 27.013 1.00 14.44 H new ATOM 0 HZ3 LYS A 104 -18.587 -4.489 25.421 1.00 14.44 H new ATOM 1637 N GLY A 105 -15.042 -6.910 31.373 1.00 13.35 N ATOM 1638 CA GLY A 105 -14.604 -6.675 32.736 1.00 73.05 C ATOM 1639 C GLY A 105 -15.501 -5.699 33.473 1.00 34.25 C ATOM 1640 O GLY A 105 -15.063 -5.025 34.404 1.00 51.12 O ATOM 0 H GLY A 105 -15.738 -7.648 31.268 1.00 13.35 H new ATOM 0 HA2 GLY A 105 -14.582 -7.622 33.276 1.00 73.05 H new ATOM 0 HA3 GLY A 105 -13.584 -6.290 32.725 1.00 73.05 H new ATOM 1644 N ASN A 106 -16.759 -5.622 33.053 1.00 71.23 N ATOM 1645 CA ASN A 106 -17.720 -4.720 33.678 1.00 4.22 C ATOM 1646 C ASN A 106 -18.522 -5.441 34.757 1.00 23.54 C ATOM 1647 O ASN A 106 -19.035 -4.817 35.685 1.00 31.50 O ATOM 1648 CB ASN A 106 -18.666 -4.140 32.625 1.00 32.01 C ATOM 1649 CG ASN A 106 -17.936 -3.316 31.582 1.00 32.34 C ATOM 1650 OD1 ASN A 106 -17.308 -2.306 31.901 1.00 21.40 O ATOM 1651 ND2 ASN A 106 -18.016 -3.744 30.328 1.00 70.21 N ATOM 0 H ASN A 106 -17.137 -6.173 32.283 1.00 71.23 H new ATOM 0 HA ASN A 106 -17.165 -3.907 34.146 1.00 4.22 H new ATOM 0 HB2 ASN A 106 -19.200 -4.953 32.133 1.00 32.01 H new ATOM 0 HB3 ASN A 106 -19.415 -3.518 33.116 1.00 32.01 H new ATOM 0 HD21 ASN A 106 -17.546 -3.230 29.583 1.00 70.21 H new ATOM 0 HD22 ASN A 106 -18.548 -4.587 30.110 1.00 70.21 H new ATOM 1658 N ALA A 107 -18.624 -6.760 34.628 1.00 21.40 N ATOM 1659 CA ALA A 107 -19.361 -7.567 35.593 1.00 22.02 C ATOM 1660 C ALA A 107 -18.411 -8.336 36.504 1.00 1.32 C ATOM 1661 O ALA A 107 -18.804 -9.312 37.142 1.00 14.15 O ATOM 1662 CB ALA A 107 -20.297 -8.526 34.873 1.00 13.52 C ATOM 0 H ALA A 107 -18.206 -7.292 33.865 1.00 21.40 H new ATOM 0 HA ALA A 107 -19.954 -6.896 36.214 1.00 22.02 H new ATOM 0 HB1 ALA A 107 -20.841 -9.122 35.606 1.00 13.52 H new ATOM 0 HB2 ALA A 107 -21.005 -7.959 34.269 1.00 13.52 H new ATOM 0 HB3 ALA A 107 -19.716 -9.185 34.228 1.00 13.52 H new ATOM 1668 N GLN A 108 -17.160 -7.889 36.560 1.00 64.41 N ATOM 1669 CA GLN A 108 -16.154 -8.537 37.393 1.00 1.22 C ATOM 1670 C GLN A 108 -15.592 -7.565 38.424 1.00 61.41 C ATOM 1671 O GLN A 108 -14.385 -7.336 38.505 1.00 25.24 O ATOM 1672 CB GLN A 108 -15.022 -9.090 36.525 1.00 23.10 C ATOM 1673 CG GLN A 108 -14.155 -10.115 37.237 1.00 50.00 C ATOM 1674 CD GLN A 108 -12.839 -9.535 37.716 1.00 53.24 C ATOM 1675 OE1 GLN A 108 -12.704 -9.377 39.028 1.00 71.14 O flip ATOM 1676 NE2 GLN A 108 -11.953 -9.233 36.917 1.00 61.50 N flip ATOM 0 H GLN A 108 -16.819 -7.081 36.039 1.00 64.41 H new ATOM 0 HA GLN A 108 -16.633 -9.361 37.922 1.00 1.22 H new ATOM 0 HB2 GLN A 108 -15.450 -9.546 35.632 1.00 23.10 H new ATOM 0 HB3 GLN A 108 -14.394 -8.264 36.192 1.00 23.10 H new ATOM 0 HG2 GLN A 108 -14.702 -10.518 38.090 1.00 50.00 H new ATOM 0 HG3 GLN A 108 -13.956 -10.948 36.563 1.00 50.00 H new ATOM 0 HE21 GLN A 108 -12.099 -9.371 35.917 1.00 61.50 H new ATOM 0 HE22 GLN A 108 -11.072 -8.844 37.255 1.00 61.50 H new ATOM 1685 N PRO A 109 -16.487 -6.976 39.232 1.00 53.11 N ATOM 1686 CA PRO A 109 -16.103 -6.018 40.273 1.00 54.40 C ATOM 1687 C PRO A 109 -15.354 -6.682 41.424 1.00 54.44 C ATOM 1688 O PRO A 109 -15.408 -6.217 42.563 1.00 55.32 O ATOM 1689 CB PRO A 109 -17.446 -5.465 40.758 1.00 64.45 C ATOM 1690 CG PRO A 109 -18.432 -6.538 40.449 1.00 11.42 C ATOM 1691 CD PRO A 109 -17.942 -7.201 39.192 1.00 63.50 C ATOM 0 HA PRO A 109 -15.423 -5.255 39.894 1.00 54.40 H new ATOM 0 HB2 PRO A 109 -17.421 -5.246 41.825 1.00 64.45 H new ATOM 0 HB3 PRO A 109 -17.699 -4.536 40.247 1.00 64.45 H new ATOM 0 HG2 PRO A 109 -18.498 -7.255 41.268 1.00 11.42 H new ATOM 0 HG3 PRO A 109 -19.430 -6.122 40.308 1.00 11.42 H new ATOM 0 HD2 PRO A 109 -18.184 -8.264 39.178 1.00 63.50 H new ATOM 0 HD3 PRO A 109 -18.393 -6.760 38.303 1.00 63.50 H new ATOM 1699 N HIS A 110 -14.655 -7.770 41.119 1.00 71.04 N ATOM 1700 CA HIS A 110 -13.893 -8.497 42.129 1.00 54.14 C ATOM 1701 C HIS A 110 -14.826 -9.198 43.113 1.00 34.13 C ATOM 1702 O HIS A 110 -14.567 -9.258 44.315 1.00 40.12 O ATOM 1703 CB HIS A 110 -12.963 -7.545 42.880 1.00 70.23 C ATOM 1704 CG HIS A 110 -11.845 -8.240 43.595 1.00 70.20 C ATOM 1705 ND1 HIS A 110 -11.779 -9.610 43.737 1.00 15.41 N ATOM 1706 CD2 HIS A 110 -10.745 -7.746 44.211 1.00 41.33 C ATOM 1707 CE1 HIS A 110 -10.687 -9.928 44.409 1.00 31.20 C ATOM 1708 NE2 HIS A 110 -10.042 -8.815 44.708 1.00 74.34 N ATOM 0 H HIS A 110 -14.600 -8.168 40.181 1.00 71.04 H new ATOM 0 HA HIS A 110 -13.294 -9.253 41.622 1.00 54.14 H new ATOM 0 HB2 HIS A 110 -12.542 -6.829 42.174 1.00 70.23 H new ATOM 0 HB3 HIS A 110 -13.547 -6.975 43.603 1.00 70.23 H new ATOM 0 HD2 HIS A 110 -10.472 -6.705 44.296 1.00 41.33 H new ATOM 0 HE1 HIS A 110 -10.375 -10.928 44.670 1.00 31.20 H new ATOM 0 HE2 HIS A 110 -9.164 -8.759 45.224 1.00 74.34 H new ATOM 1716 N PRO A 111 -15.937 -9.739 42.593 1.00 24.44 N ATOM 1717 CA PRO A 111 -16.930 -10.445 43.408 1.00 31.41 C ATOM 1718 C PRO A 111 -16.408 -11.778 43.933 1.00 32.23 C ATOM 1719 O PRO A 111 -15.206 -12.043 43.896 1.00 74.13 O ATOM 1720 CB PRO A 111 -18.091 -10.670 42.437 1.00 15.14 C ATOM 1721 CG PRO A 111 -17.461 -10.669 41.087 1.00 62.43 C ATOM 1722 CD PRO A 111 -16.309 -9.706 41.168 1.00 35.24 C ATOM 0 HA PRO A 111 -17.204 -9.878 44.297 1.00 31.41 H new ATOM 0 HB2 PRO A 111 -18.597 -11.614 42.637 1.00 15.14 H new ATOM 0 HB3 PRO A 111 -18.839 -9.882 42.525 1.00 15.14 H new ATOM 0 HG2 PRO A 111 -17.117 -11.667 40.816 1.00 62.43 H new ATOM 0 HG3 PRO A 111 -18.175 -10.360 40.323 1.00 62.43 H new ATOM 0 HD2 PRO A 111 -15.481 -10.015 40.529 1.00 35.24 H new ATOM 0 HD3 PRO A 111 -16.599 -8.704 40.851 1.00 35.24 H new ATOM 1730 N SER A 112 -17.319 -12.614 44.421 1.00 21.23 N ATOM 1731 CA SER A 112 -16.949 -13.919 44.957 1.00 21.52 C ATOM 1732 C SER A 112 -16.769 -14.936 43.834 1.00 63.14 C ATOM 1733 O SER A 112 -15.920 -15.824 43.914 1.00 35.41 O ATOM 1734 CB SER A 112 -18.014 -14.411 45.939 1.00 12.20 C ATOM 1735 OG SER A 112 -18.319 -13.415 46.900 1.00 31.44 O ATOM 0 H SER A 112 -18.318 -12.411 44.456 1.00 21.23 H new ATOM 0 HA SER A 112 -16.001 -13.812 45.483 1.00 21.52 H new ATOM 0 HB2 SER A 112 -18.918 -14.684 45.394 1.00 12.20 H new ATOM 0 HB3 SER A 112 -17.661 -15.311 46.443 1.00 12.20 H new ATOM 0 HG SER A 112 -19.003 -13.753 47.515 1.00 31.44 H new ATOM 1741 N THR A 113 -17.575 -14.800 42.785 1.00 22.52 N ATOM 1742 CA THR A 113 -17.506 -15.706 41.646 1.00 22.33 C ATOM 1743 C THR A 113 -16.070 -15.878 41.165 1.00 51.05 C ATOM 1744 O THR A 113 -15.639 -16.988 40.852 1.00 13.12 O ATOM 1745 CB THR A 113 -18.371 -15.202 40.474 1.00 73.42 C ATOM 1746 OG1 THR A 113 -19.759 -15.376 40.779 1.00 62.24 O ATOM 1747 CG2 THR A 113 -18.030 -15.945 39.192 1.00 60.51 C ATOM 0 H THR A 113 -18.283 -14.071 42.701 1.00 22.52 H new ATOM 0 HA THR A 113 -17.890 -16.668 41.985 1.00 22.33 H new ATOM 0 HB THR A 113 -18.163 -14.142 40.327 1.00 73.42 H new ATOM 0 HG1 THR A 113 -20.302 -15.052 40.030 1.00 62.24 H new ATOM 0 HG21 THR A 113 -18.653 -15.572 38.379 1.00 60.51 H new ATOM 0 HG22 THR A 113 -16.980 -15.785 38.947 1.00 60.51 H new ATOM 0 HG23 THR A 113 -18.212 -17.011 39.330 1.00 60.51 H new ATOM 1755 N ILE A 114 -15.333 -14.773 41.111 1.00 21.51 N ATOM 1756 CA ILE A 114 -13.944 -14.804 40.670 1.00 62.53 C ATOM 1757 C ILE A 114 -13.101 -15.700 41.571 1.00 10.43 C ATOM 1758 O ILE A 114 -12.289 -16.492 41.092 1.00 32.25 O ATOM 1759 CB ILE A 114 -13.329 -13.392 40.649 1.00 10.22 C ATOM 1760 CG1 ILE A 114 -14.136 -12.474 39.729 1.00 13.23 C ATOM 1761 CG2 ILE A 114 -11.876 -13.453 40.203 1.00 13.31 C ATOM 1762 CD1 ILE A 114 -14.410 -13.073 38.367 1.00 1.21 C ATOM 0 H ILE A 114 -15.674 -13.847 41.367 1.00 21.51 H new ATOM 0 HA ILE A 114 -13.943 -15.207 39.657 1.00 62.53 H new ATOM 0 HB ILE A 114 -13.362 -12.983 41.659 1.00 10.22 H new ATOM 0 HG12 ILE A 114 -15.085 -12.235 40.209 1.00 13.23 H new ATOM 0 HG13 ILE A 114 -13.597 -11.535 39.602 1.00 13.23 H new ATOM 0 HG21 ILE A 114 -11.456 -12.447 40.193 1.00 13.31 H new ATOM 0 HG22 ILE A 114 -11.309 -14.077 40.894 1.00 13.31 H new ATOM 0 HG23 ILE A 114 -11.820 -13.879 39.201 1.00 13.31 H new ATOM 0 HD11 ILE A 114 -14.986 -12.367 37.768 1.00 1.21 H new ATOM 0 HD12 ILE A 114 -13.465 -13.287 37.867 1.00 1.21 H new ATOM 0 HD13 ILE A 114 -14.976 -13.997 38.483 1.00 1.21 H new ATOM 1774 N LYS A 115 -13.301 -15.571 42.878 1.00 73.22 N ATOM 1775 CA LYS A 115 -12.562 -16.371 43.848 1.00 30.40 C ATOM 1776 C LYS A 115 -12.894 -17.853 43.696 1.00 65.01 C ATOM 1777 O LYS A 115 -12.065 -18.717 43.985 1.00 41.25 O ATOM 1778 CB LYS A 115 -12.882 -15.909 45.271 1.00 13.30 C ATOM 1779 CG LYS A 115 -13.526 -16.984 46.129 1.00 4.33 C ATOM 1780 CD LYS A 115 -12.492 -17.953 46.678 1.00 3.55 C ATOM 1781 CE LYS A 115 -13.005 -19.384 46.662 1.00 63.10 C ATOM 1782 NZ LYS A 115 -11.953 -20.356 47.072 1.00 41.22 N ATOM 0 H LYS A 115 -13.969 -14.920 43.290 1.00 73.22 H new ATOM 0 HA LYS A 115 -11.497 -16.234 43.659 1.00 30.40 H new ATOM 0 HB2 LYS A 115 -11.962 -15.575 45.751 1.00 13.30 H new ATOM 0 HB3 LYS A 115 -13.547 -15.047 45.223 1.00 13.30 H new ATOM 0 HG2 LYS A 115 -14.064 -16.518 46.955 1.00 4.33 H new ATOM 0 HG3 LYS A 115 -14.261 -17.531 45.538 1.00 4.33 H new ATOM 0 HD2 LYS A 115 -11.579 -17.886 46.086 1.00 3.55 H new ATOM 0 HD3 LYS A 115 -12.232 -17.670 47.698 1.00 3.55 H new ATOM 0 HE2 LYS A 115 -13.860 -19.471 47.332 1.00 63.10 H new ATOM 0 HE3 LYS A 115 -13.358 -19.632 45.661 1.00 63.10 H new ATOM 0 HZ1 LYS A 115 -12.208 -21.306 46.735 1.00 41.22 H new ATOM 0 HZ2 LYS A 115 -11.041 -20.075 46.658 1.00 41.22 H new ATOM 0 HZ3 LYS A 115 -11.874 -20.366 48.109 1.00 41.22 H new ATOM 1796 N LEU A 116 -14.108 -18.139 43.241 1.00 31.55 N ATOM 1797 CA LEU A 116 -14.549 -19.516 43.050 1.00 15.21 C ATOM 1798 C LEU A 116 -14.032 -20.074 41.728 1.00 74.02 C ATOM 1799 O LEU A 116 -13.575 -21.216 41.660 1.00 3.40 O ATOM 1800 CB LEU A 116 -16.076 -19.594 43.087 1.00 42.10 C ATOM 1801 CG LEU A 116 -16.697 -19.966 44.434 1.00 74.04 C ATOM 1802 CD1 LEU A 116 -16.364 -18.917 45.483 1.00 2.30 C ATOM 1803 CD2 LEU A 116 -18.204 -20.130 44.299 1.00 21.31 C ATOM 0 H LEU A 116 -14.805 -17.436 42.997 1.00 31.55 H new ATOM 0 HA LEU A 116 -14.141 -20.118 43.862 1.00 15.21 H new ATOM 0 HB2 LEU A 116 -16.477 -18.628 42.779 1.00 42.10 H new ATOM 0 HB3 LEU A 116 -16.401 -20.324 42.346 1.00 42.10 H new ATOM 0 HG LEU A 116 -16.276 -20.918 44.757 1.00 74.04 H new ATOM 0 HD11 LEU A 116 -16.814 -19.199 46.435 1.00 2.30 H new ATOM 0 HD12 LEU A 116 -15.282 -18.849 45.599 1.00 2.30 H new ATOM 0 HD13 LEU A 116 -16.756 -17.950 45.168 1.00 2.30 H new ATOM 0 HD21 LEU A 116 -18.629 -20.395 45.267 1.00 21.31 H new ATOM 0 HD22 LEU A 116 -18.642 -19.194 43.954 1.00 21.31 H new ATOM 0 HD23 LEU A 116 -18.421 -20.919 43.579 1.00 21.31 H new ATOM 1815 N LEU A 117 -14.105 -19.262 40.679 1.00 52.10 N ATOM 1816 CA LEU A 117 -13.642 -19.674 39.359 1.00 40.53 C ATOM 1817 C LEU A 117 -12.153 -20.002 39.382 1.00 3.24 C ATOM 1818 O LEU A 117 -11.732 -21.055 38.901 1.00 12.31 O ATOM 1819 CB LEU A 117 -13.917 -18.572 38.334 1.00 14.40 C ATOM 1820 CG LEU A 117 -15.372 -18.415 37.891 1.00 65.23 C ATOM 1821 CD1 LEU A 117 -15.593 -17.051 37.254 1.00 52.31 C ATOM 1822 CD2 LEU A 117 -15.758 -19.525 36.924 1.00 51.25 C ATOM 0 H LEU A 117 -14.481 -18.314 40.717 1.00 52.10 H new ATOM 0 HA LEU A 117 -14.189 -20.573 39.073 1.00 40.53 H new ATOM 0 HB2 LEU A 117 -13.581 -17.623 38.752 1.00 14.40 H new ATOM 0 HB3 LEU A 117 -13.308 -18.765 37.451 1.00 14.40 H new ATOM 0 HG LEU A 117 -16.009 -18.489 38.772 1.00 65.23 H new ATOM 0 HD11 LEU A 117 -16.634 -16.958 36.945 1.00 52.31 H new ATOM 0 HD12 LEU A 117 -15.358 -16.270 37.977 1.00 52.31 H new ATOM 0 HD13 LEU A 117 -14.946 -16.947 36.383 1.00 52.31 H new ATOM 0 HD21 LEU A 117 -16.797 -19.397 36.619 1.00 51.25 H new ATOM 0 HD22 LEU A 117 -15.114 -19.482 36.045 1.00 51.25 H new ATOM 0 HD23 LEU A 117 -15.640 -20.492 37.414 1.00 51.25 H new ATOM 1834 N ARG A 118 -11.361 -19.096 39.945 1.00 34.51 N ATOM 1835 CA ARG A 118 -9.919 -19.291 40.032 1.00 13.32 C ATOM 1836 C ARG A 118 -9.589 -20.645 40.653 1.00 40.32 C ATOM 1837 O ARG A 118 -8.660 -21.328 40.221 1.00 14.22 O ATOM 1838 CB ARG A 118 -9.280 -18.171 40.856 1.00 14.52 C ATOM 1839 CG ARG A 118 -9.823 -18.071 42.272 1.00 32.23 C ATOM 1840 CD ARG A 118 -9.133 -16.966 43.056 1.00 53.14 C ATOM 1841 NE ARG A 118 -9.206 -15.680 42.369 1.00 60.54 N ATOM 1842 CZ ARG A 118 -8.388 -14.664 42.623 1.00 42.21 C ATOM 1843 NH1 ARG A 118 -7.441 -14.785 43.543 1.00 30.20 N ATOM 1844 NH2 ARG A 118 -8.517 -13.524 41.955 1.00 42.41 N ATOM 0 H ARG A 118 -11.693 -18.220 40.348 1.00 34.51 H new ATOM 0 HA ARG A 118 -9.513 -19.266 39.021 1.00 13.32 H new ATOM 0 HB2 ARG A 118 -8.203 -18.333 40.900 1.00 14.52 H new ATOM 0 HB3 ARG A 118 -9.439 -17.221 40.347 1.00 14.52 H new ATOM 0 HG2 ARG A 118 -10.896 -17.880 42.239 1.00 32.23 H new ATOM 0 HG3 ARG A 118 -9.684 -19.023 42.784 1.00 32.23 H new ATOM 0 HD2 ARG A 118 -9.593 -16.878 44.040 1.00 53.14 H new ATOM 0 HD3 ARG A 118 -8.088 -17.233 43.216 1.00 53.14 H new ATOM 0 HE ARG A 118 -9.924 -15.554 41.655 1.00 60.54 H new ATOM 0 HH11 ARG A 118 -7.339 -15.660 44.058 1.00 30.20 H new ATOM 0 HH12 ARG A 118 -6.815 -14.004 43.736 1.00 30.20 H new ATOM 0 HH21 ARG A 118 -9.244 -13.428 41.246 1.00 42.41 H new ATOM 0 HH22 ARG A 118 -7.889 -12.744 42.150 1.00 42.41 H new ATOM 1858 N VAL A 119 -10.356 -21.027 41.669 1.00 20.11 N ATOM 1859 CA VAL A 119 -10.146 -22.299 42.350 1.00 73.22 C ATOM 1860 C VAL A 119 -10.921 -23.421 41.668 1.00 25.13 C ATOM 1861 O VAL A 119 -10.693 -24.601 41.939 1.00 33.13 O ATOM 1862 CB VAL A 119 -10.570 -22.221 43.828 1.00 65.44 C ATOM 1863 CG1 VAL A 119 -9.754 -21.170 44.564 1.00 2.43 C ATOM 1864 CG2 VAL A 119 -12.059 -21.927 43.940 1.00 21.23 C ATOM 0 H VAL A 119 -11.129 -20.473 42.039 1.00 20.11 H new ATOM 0 HA VAL A 119 -9.079 -22.514 42.298 1.00 73.22 H new ATOM 0 HB VAL A 119 -10.377 -23.187 44.294 1.00 65.44 H new ATOM 0 HG11 VAL A 119 -10.068 -21.130 45.607 1.00 2.43 H new ATOM 0 HG12 VAL A 119 -8.696 -21.429 44.513 1.00 2.43 H new ATOM 0 HG13 VAL A 119 -9.911 -20.196 44.100 1.00 2.43 H new ATOM 0 HG21 VAL A 119 -12.342 -21.875 44.991 1.00 21.23 H new ATOM 0 HG22 VAL A 119 -12.279 -20.975 43.458 1.00 21.23 H new ATOM 0 HG23 VAL A 119 -12.624 -22.720 43.451 1.00 21.23 H new ATOM 1874 N LEU A 120 -11.837 -23.046 40.782 1.00 4.33 N ATOM 1875 CA LEU A 120 -12.647 -24.022 40.060 1.00 43.13 C ATOM 1876 C LEU A 120 -11.860 -24.634 38.906 1.00 54.43 C ATOM 1877 O LEU A 120 -11.932 -25.839 38.663 1.00 15.32 O ATOM 1878 CB LEU A 120 -13.922 -23.363 39.531 1.00 14.23 C ATOM 1879 CG LEU A 120 -15.240 -23.923 40.068 1.00 2.25 C ATOM 1880 CD1 LEU A 120 -15.397 -25.384 39.680 1.00 72.21 C ATOM 1881 CD2 LEU A 120 -15.311 -23.760 41.580 1.00 12.24 C ATOM 0 H LEU A 120 -12.038 -22.074 40.546 1.00 4.33 H new ATOM 0 HA LEU A 120 -12.918 -24.818 40.753 1.00 43.13 H new ATOM 0 HB2 LEU A 120 -13.881 -22.299 39.764 1.00 14.23 H new ATOM 0 HB3 LEU A 120 -13.929 -23.451 38.445 1.00 14.23 H new ATOM 0 HG LEU A 120 -16.060 -23.360 39.622 1.00 2.25 H new ATOM 0 HD11 LEU A 120 -16.340 -25.765 40.071 1.00 72.21 H new ATOM 0 HD12 LEU A 120 -15.391 -25.475 38.594 1.00 72.21 H new ATOM 0 HD13 LEU A 120 -14.572 -25.962 40.097 1.00 72.21 H new ATOM 0 HD21 LEU A 120 -16.255 -24.164 41.946 1.00 12.24 H new ATOM 0 HD22 LEU A 120 -14.483 -24.297 42.043 1.00 12.24 H new ATOM 0 HD23 LEU A 120 -15.245 -22.702 41.835 1.00 12.24 H new ATOM 1893 N ASP A 121 -11.109 -23.798 38.199 1.00 63.32 N ATOM 1894 CA ASP A 121 -10.306 -24.257 37.072 1.00 72.41 C ATOM 1895 C ASP A 121 -9.487 -25.487 37.453 1.00 23.10 C ATOM 1896 O ASP A 121 -9.236 -26.361 36.624 1.00 52.45 O ATOM 1897 CB ASP A 121 -9.378 -23.141 36.590 1.00 12.40 C ATOM 1898 CG ASP A 121 -8.613 -23.523 35.338 1.00 51.12 C ATOM 1899 OD1 ASP A 121 -7.887 -24.539 35.374 1.00 14.34 O ATOM 1900 OD2 ASP A 121 -8.741 -22.807 34.323 1.00 41.31 O ATOM 0 H ASP A 121 -11.039 -22.798 38.386 1.00 63.32 H new ATOM 0 HA ASP A 121 -10.984 -24.530 36.263 1.00 72.41 H new ATOM 0 HB2 ASP A 121 -9.965 -22.244 36.394 1.00 12.40 H new ATOM 0 HB3 ASP A 121 -8.672 -22.893 37.382 1.00 12.40 H new ATOM 1905 N LYS A 122 -9.073 -25.547 38.714 1.00 23.43 N ATOM 1906 CA LYS A 122 -8.283 -26.669 39.208 1.00 41.12 C ATOM 1907 C LYS A 122 -9.172 -27.703 39.890 1.00 73.22 C ATOM 1908 O LYS A 122 -8.798 -28.868 40.022 1.00 64.41 O ATOM 1909 CB LYS A 122 -7.214 -26.175 40.186 1.00 60.14 C ATOM 1910 CG LYS A 122 -6.167 -25.282 39.543 1.00 63.53 C ATOM 1911 CD LYS A 122 -6.349 -23.829 39.949 1.00 31.14 C ATOM 1912 CE LYS A 122 -6.058 -23.622 41.428 1.00 51.44 C ATOM 1913 NZ LYS A 122 -5.055 -22.545 41.650 1.00 2.33 N ATOM 0 H LYS A 122 -9.272 -24.831 39.413 1.00 23.43 H new ATOM 0 HA LYS A 122 -7.796 -27.141 38.355 1.00 41.12 H new ATOM 0 HB2 LYS A 122 -7.699 -25.628 40.995 1.00 60.14 H new ATOM 0 HB3 LYS A 122 -6.719 -27.036 40.635 1.00 60.14 H new ATOM 0 HG2 LYS A 122 -5.172 -25.620 39.832 1.00 63.53 H new ATOM 0 HG3 LYS A 122 -6.230 -25.368 38.458 1.00 63.53 H new ATOM 0 HD2 LYS A 122 -5.687 -23.199 39.355 1.00 31.14 H new ATOM 0 HD3 LYS A 122 -7.369 -23.514 39.730 1.00 31.14 H new ATOM 0 HE2 LYS A 122 -6.982 -23.370 41.948 1.00 51.44 H new ATOM 0 HE3 LYS A 122 -5.692 -24.554 41.860 1.00 51.44 H new ATOM 0 HZ1 LYS A 122 -4.884 -22.435 42.670 1.00 2.33 H new ATOM 0 HZ2 LYS A 122 -4.165 -22.796 41.175 1.00 2.33 H new ATOM 0 HZ3 LYS A 122 -5.414 -21.650 41.260 1.00 2.33 H new ATOM 1927 N HIS A 123 -10.353 -27.270 40.320 1.00 20.32 N ATOM 1928 CA HIS A 123 -11.297 -28.159 40.987 1.00 4.45 C ATOM 1929 C HIS A 123 -12.662 -28.112 40.306 1.00 35.01 C ATOM 1930 O HIS A 123 -13.542 -27.337 40.680 1.00 52.04 O ATOM 1931 CB HIS A 123 -11.436 -27.778 42.461 1.00 23.45 C ATOM 1932 CG HIS A 123 -10.141 -27.810 43.212 1.00 2.01 C ATOM 1933 ND1 HIS A 123 -9.826 -28.794 44.126 1.00 32.23 N ATOM 1934 CD2 HIS A 123 -9.078 -26.973 43.180 1.00 2.20 C ATOM 1935 CE1 HIS A 123 -8.625 -28.559 44.625 1.00 45.01 C ATOM 1936 NE2 HIS A 123 -8.149 -27.461 44.067 1.00 61.53 N ATOM 0 H HIS A 123 -10.679 -26.309 40.218 1.00 20.32 H new ATOM 0 HA HIS A 123 -10.911 -29.176 40.918 1.00 4.45 H new ATOM 0 HB2 HIS A 123 -11.862 -26.777 42.531 1.00 23.45 H new ATOM 0 HB3 HIS A 123 -12.141 -28.459 42.939 1.00 23.45 H new ATOM 0 HD2 HIS A 123 -8.978 -26.087 42.571 1.00 2.20 H new ATOM 0 HE1 HIS A 123 -8.119 -29.163 45.364 1.00 45.01 H new ATOM 0 HE2 HIS A 123 -7.239 -27.043 44.263 1.00 61.53 H new ATOM 1944 N PRO A 124 -12.843 -28.959 39.282 1.00 3.53 N ATOM 1945 CA PRO A 124 -14.098 -29.033 38.528 1.00 5.05 C ATOM 1946 C PRO A 124 -15.235 -29.629 39.350 1.00 63.34 C ATOM 1947 O PRO A 124 -16.342 -29.820 38.848 1.00 63.12 O ATOM 1948 CB PRO A 124 -13.751 -29.948 37.351 1.00 22.14 C ATOM 1949 CG PRO A 124 -12.621 -30.785 37.842 1.00 0.32 C ATOM 1950 CD PRO A 124 -11.837 -29.911 38.782 1.00 10.41 C ATOM 0 HA PRO A 124 -14.452 -28.047 38.229 1.00 5.05 H new ATOM 0 HB2 PRO A 124 -14.603 -30.563 37.063 1.00 22.14 H new ATOM 0 HB3 PRO A 124 -13.463 -29.371 36.472 1.00 22.14 H new ATOM 0 HG2 PRO A 124 -12.988 -31.676 38.352 1.00 0.32 H new ATOM 0 HG3 PRO A 124 -11.999 -31.125 37.014 1.00 0.32 H new ATOM 0 HD2 PRO A 124 -11.393 -30.489 39.592 1.00 10.41 H new ATOM 0 HD3 PRO A 124 -11.021 -29.401 38.270 1.00 10.41 H new ATOM 1958 N GLU A 125 -14.953 -29.921 40.616 1.00 13.12 N ATOM 1959 CA GLU A 125 -15.954 -30.496 41.508 1.00 20.23 C ATOM 1960 C GLU A 125 -16.249 -29.556 42.673 1.00 33.21 C ATOM 1961 O GLU A 125 -17.218 -29.747 43.409 1.00 24.25 O ATOM 1962 CB GLU A 125 -15.478 -31.850 42.038 1.00 74.33 C ATOM 1963 CG GLU A 125 -14.404 -31.742 43.108 1.00 12.10 C ATOM 1964 CD GLU A 125 -13.467 -32.934 43.118 1.00 24.31 C ATOM 1965 OE1 GLU A 125 -12.691 -33.086 42.152 1.00 34.54 O ATOM 1966 OE2 GLU A 125 -13.511 -33.714 44.092 1.00 74.54 O ATOM 0 H GLU A 125 -14.041 -29.769 41.047 1.00 13.12 H new ATOM 0 HA GLU A 125 -16.872 -30.639 40.939 1.00 20.23 H new ATOM 0 HB2 GLU A 125 -16.332 -32.392 42.445 1.00 74.33 H new ATOM 0 HB3 GLU A 125 -15.093 -32.441 41.207 1.00 74.33 H new ATOM 0 HG2 GLU A 125 -13.826 -30.832 42.947 1.00 12.10 H new ATOM 0 HG3 GLU A 125 -14.878 -31.649 44.085 1.00 12.10 H new ATOM 1973 N LEU A 126 -15.407 -28.542 42.835 1.00 13.14 N ATOM 1974 CA LEU A 126 -15.576 -27.572 43.911 1.00 71.22 C ATOM 1975 C LEU A 126 -16.975 -26.964 43.882 1.00 13.54 C ATOM 1976 O LEU A 126 -17.643 -26.866 44.912 1.00 11.51 O ATOM 1977 CB LEU A 126 -14.525 -26.466 43.797 1.00 55.31 C ATOM 1978 CG LEU A 126 -13.921 -25.976 45.114 1.00 51.03 C ATOM 1979 CD1 LEU A 126 -13.136 -27.090 45.788 1.00 70.55 C ATOM 1980 CD2 LEU A 126 -13.032 -24.764 44.874 1.00 30.35 C ATOM 0 H LEU A 126 -14.600 -28.370 42.235 1.00 13.14 H new ATOM 0 HA LEU A 126 -15.446 -28.093 44.860 1.00 71.22 H new ATOM 0 HB2 LEU A 126 -13.716 -26.825 43.161 1.00 55.31 H new ATOM 0 HB3 LEU A 126 -14.976 -25.614 43.288 1.00 55.31 H new ATOM 0 HG LEU A 126 -14.734 -25.680 45.777 1.00 51.03 H new ATOM 0 HD11 LEU A 126 -12.714 -26.723 46.723 1.00 70.55 H new ATOM 0 HD12 LEU A 126 -13.800 -27.930 45.994 1.00 70.55 H new ATOM 0 HD13 LEU A 126 -12.331 -27.417 45.130 1.00 70.55 H new ATOM 0 HD21 LEU A 126 -12.611 -24.429 45.822 1.00 30.35 H new ATOM 0 HD22 LEU A 126 -12.225 -25.034 44.193 1.00 30.35 H new ATOM 0 HD23 LEU A 126 -13.623 -23.960 44.435 1.00 30.35 H new ATOM 1992 N LEU A 127 -17.414 -26.560 42.695 1.00 0.44 N ATOM 1993 CA LEU A 127 -18.735 -25.964 42.530 1.00 64.00 C ATOM 1994 C LEU A 127 -19.807 -26.825 43.192 1.00 43.31 C ATOM 1995 O LEU A 127 -20.831 -26.317 43.646 1.00 23.40 O ATOM 1996 CB LEU A 127 -19.054 -25.785 41.045 1.00 60.13 C ATOM 1997 CG LEU A 127 -19.314 -27.068 40.255 1.00 20.33 C ATOM 1998 CD1 LEU A 127 -20.216 -26.788 39.063 1.00 5.55 C ATOM 1999 CD2 LEU A 127 -18.001 -27.688 39.798 1.00 25.23 C ATOM 0 H LEU A 127 -16.874 -26.634 41.833 1.00 0.44 H new ATOM 0 HA LEU A 127 -18.729 -24.987 43.014 1.00 64.00 H new ATOM 0 HB2 LEU A 127 -19.931 -25.144 40.957 1.00 60.13 H new ATOM 0 HB3 LEU A 127 -18.224 -25.256 40.577 1.00 60.13 H new ATOM 0 HG LEU A 127 -19.821 -27.778 40.909 1.00 20.33 H new ATOM 0 HD11 LEU A 127 -20.390 -27.713 38.513 1.00 5.55 H new ATOM 0 HD12 LEU A 127 -21.168 -26.390 39.413 1.00 5.55 H new ATOM 0 HD13 LEU A 127 -19.737 -26.061 38.407 1.00 5.55 H new ATOM 0 HD21 LEU A 127 -18.205 -28.600 39.237 1.00 25.23 H new ATOM 0 HD22 LEU A 127 -17.468 -26.982 39.161 1.00 25.23 H new ATOM 0 HD23 LEU A 127 -17.389 -27.926 40.668 1.00 25.23 H new ATOM 2011 N ASN A 128 -19.562 -28.130 43.244 1.00 24.14 N ATOM 2012 CA ASN A 128 -20.506 -29.061 43.852 1.00 50.40 C ATOM 2013 C ASN A 128 -20.268 -29.173 45.355 1.00 11.11 C ATOM 2014 O ASN A 128 -21.188 -29.463 46.118 1.00 51.21 O ATOM 2015 CB ASN A 128 -20.384 -30.441 43.201 1.00 30.34 C ATOM 2016 CG ASN A 128 -20.370 -30.366 41.686 1.00 60.51 C ATOM 2017 OD1 ASN A 128 -19.203 -30.087 41.118 1.00 73.41 O flip ATOM 2018 ND2 ASN A 128 -21.397 -30.558 41.035 1.00 52.11 N flip ATOM 0 H ASN A 128 -18.718 -28.567 42.873 1.00 24.14 H new ATOM 0 HA ASN A 128 -21.513 -28.677 43.689 1.00 50.40 H new ATOM 0 HB2 ASN A 128 -19.470 -30.923 43.547 1.00 30.34 H new ATOM 0 HB3 ASN A 128 -21.216 -31.067 43.524 1.00 30.34 H new ATOM 0 HD21 ASN A 128 -22.272 -30.770 41.514 1.00 52.11 H new ATOM 0 HD22 ASN A 128 -21.373 -30.505 40.017 1.00 52.11 H new ATOM 2025 N GLU A 129 -19.028 -28.938 45.771 1.00 64.15 N ATOM 2026 CA GLU A 129 -18.670 -29.013 47.183 1.00 34.41 C ATOM 2027 C GLU A 129 -18.739 -27.635 47.835 1.00 4.22 C ATOM 2028 O GLU A 129 -18.384 -27.471 49.003 1.00 41.41 O ATOM 2029 CB GLU A 129 -17.265 -29.596 47.345 1.00 64.14 C ATOM 2030 CG GLU A 129 -16.159 -28.558 47.246 1.00 70.51 C ATOM 2031 CD GLU A 129 -15.684 -28.081 48.605 1.00 11.43 C ATOM 2032 OE1 GLU A 129 -15.646 -28.905 49.543 1.00 30.30 O ATOM 2033 OE2 GLU A 129 -15.350 -26.884 48.730 1.00 71.44 O ATOM 0 H GLU A 129 -18.255 -28.694 45.152 1.00 64.15 H new ATOM 0 HA GLU A 129 -19.387 -29.667 47.679 1.00 34.41 H new ATOM 0 HB2 GLU A 129 -17.197 -30.095 48.312 1.00 64.14 H new ATOM 0 HB3 GLU A 129 -17.107 -30.357 46.581 1.00 64.14 H new ATOM 0 HG2 GLU A 129 -15.317 -28.981 46.699 1.00 70.51 H new ATOM 0 HG3 GLU A 129 -16.517 -27.705 46.670 1.00 70.51 H new ATOM 2040 N ILE A 130 -19.198 -26.649 47.073 1.00 32.13 N ATOM 2041 CA ILE A 130 -19.314 -25.286 47.576 1.00 40.54 C ATOM 2042 C ILE A 130 -20.738 -24.762 47.420 1.00 24.44 C ATOM 2043 O ILE A 130 -21.229 -24.009 48.262 1.00 43.33 O ATOM 2044 CB ILE A 130 -18.346 -24.333 46.850 1.00 75.14 C ATOM 2045 CG1 ILE A 130 -18.816 -24.090 45.414 1.00 35.03 C ATOM 2046 CG2 ILE A 130 -16.935 -24.901 46.862 1.00 62.02 C ATOM 2047 CD1 ILE A 130 -17.858 -23.251 44.598 1.00 53.15 C ATOM 0 H ILE A 130 -19.496 -26.768 46.105 1.00 32.13 H new ATOM 0 HA ILE A 130 -19.054 -25.317 48.634 1.00 40.54 H new ATOM 0 HB ILE A 130 -18.337 -23.378 47.376 1.00 75.14 H new ATOM 0 HG12 ILE A 130 -18.957 -25.051 44.919 1.00 35.03 H new ATOM 0 HG13 ILE A 130 -19.788 -23.598 45.437 1.00 35.03 H new ATOM 0 HG21 ILE A 130 -16.263 -24.216 46.345 1.00 62.02 H new ATOM 0 HG22 ILE A 130 -16.602 -25.028 47.892 1.00 62.02 H new ATOM 0 HG23 ILE A 130 -16.927 -25.867 46.357 1.00 62.02 H new ATOM 0 HD11 ILE A 130 -18.256 -23.120 43.592 1.00 53.15 H new ATOM 0 HD12 ILE A 130 -17.736 -22.276 45.070 1.00 53.15 H new ATOM 0 HD13 ILE A 130 -16.891 -23.752 44.544 1.00 53.15 H new ATOM 2059 N ARG A 131 -21.396 -25.166 46.339 1.00 54.13 N ATOM 2060 CA ARG A 131 -22.764 -24.738 46.073 1.00 11.34 C ATOM 2061 C ARG A 131 -23.653 -24.968 47.292 1.00 63.43 C ATOM 2062 O ARG A 131 -24.817 -24.567 47.308 1.00 2.33 O ATOM 2063 CB ARG A 131 -23.331 -25.488 44.866 1.00 53.10 C ATOM 2064 CG ARG A 131 -23.422 -26.992 45.072 1.00 44.22 C ATOM 2065 CD ARG A 131 -24.753 -27.541 44.585 1.00 24.34 C ATOM 2066 NE ARG A 131 -24.911 -28.957 44.904 1.00 50.40 N ATOM 2067 CZ ARG A 131 -24.403 -29.938 44.166 1.00 65.42 C ATOM 2068 NH1 ARG A 131 -23.708 -29.657 43.072 1.00 12.41 N ATOM 2069 NH2 ARG A 131 -24.589 -31.203 44.521 1.00 62.25 N ATOM 0 H ARG A 131 -21.004 -25.789 45.633 1.00 54.13 H new ATOM 0 HA ARG A 131 -22.747 -23.670 45.853 1.00 11.34 H new ATOM 0 HB2 ARG A 131 -24.324 -25.100 44.641 1.00 53.10 H new ATOM 0 HB3 ARG A 131 -22.706 -25.286 43.996 1.00 53.10 H new ATOM 0 HG2 ARG A 131 -22.608 -27.483 44.539 1.00 44.22 H new ATOM 0 HG3 ARG A 131 -23.297 -27.224 46.130 1.00 44.22 H new ATOM 0 HD2 ARG A 131 -25.566 -26.974 45.038 1.00 24.34 H new ATOM 0 HD3 ARG A 131 -24.830 -27.402 43.507 1.00 24.34 H new ATOM 0 HE ARG A 131 -25.440 -29.207 45.739 1.00 50.40 H new ATOM 0 HH11 ARG A 131 -23.562 -28.686 42.796 1.00 12.41 H new ATOM 0 HH12 ARG A 131 -23.319 -30.412 42.507 1.00 12.41 H new ATOM 0 HH21 ARG A 131 -25.123 -31.424 45.362 1.00 62.25 H new ATOM 0 HH22 ARG A 131 -24.198 -31.955 43.953 1.00 62.25 H new TER 2083 ARG A 131