USER MOD reduce.3.24.130724 H: found=0, std=0, add=1171, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1171 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 3 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 93 SER OG : rot -89:sc= 1.4 USER MOD Set 2.2: A 95 CYS SG : rot 162:sc= 1.79 USER MOD Set 2.3: A 107 TYR OH : rot -179:sc= 0.752 USER MOD Set 2.4: A 126 GLN :FLIP amide:sc= -0.114 F(o=2.3!,f=3.8) USER MOD Set 3.1: A 76 GLN : amide:sc= 0.98 K(o=2.2,f=-1.4) USER MOD Set 3.2: A 81 SER OG : rot 60:sc= 1.17 USER MOD Set 3.3: A 83 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 66 TYR OH : rot -146:sc= 0.55 USER MOD Set 4.2: A 110 SER OG : rot -86:sc= -1.15! USER MOD Single : A 1 MET CE :methyl -158:sc= -4.24! (180deg=-5.55!) USER MOD Single : A 1 MET N :NH3+ -164:sc= 0.0273 (180deg=0.00901) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 77:sc= 1.24 USER MOD Single : A 11 CYS SG : rot 95:sc= 0.741 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0.0039 USER MOD Single : A 14 THR OG1 : rot 89:sc= 1.26 USER MOD Single : A 15 TYR OH : rot 63:sc= 1.27 USER MOD Single : A 19 LYS NZ :NH3+ -144:sc= 0 (180deg=-1.07) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ -168:sc= 1.2 (180deg=1.05) USER MOD Single : A 23 LYS NZ :NH3+ 162:sc= -0.0557 (180deg=-0.381) USER MOD Single : A 24 HIS : no HD1:sc= -0.493 K(o=-0.49,f=-3.1!) USER MOD Single : A 26 TYR OH : rot -17:sc= -0.414 USER MOD Single : A 30 TYR OH : rot 180:sc= 0.385 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 GLN : amide:sc= 0.381 K(o=0.38,f=-0.41) USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.119 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -1.29! C(o=-1.3!,f=-6.3!) USER MOD Single : A 57 GLN : amide:sc= -0.185 K(o=-0.18,f=-4.7!) USER MOD Single : A 58 LYS NZ :NH3+ -161:sc= -0.128 (180deg=-0.515) USER MOD Single : A 59 CYS SG : rot 180:sc= 0 USER MOD Single : A 64 CYS SG : rot 110:sc= -1.31 USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 MET CE :methyl 156:sc= -0.202 (180deg=-0.845) USER MOD Single : A 75 HIS : no HE2:sc= 0.996 K(o=1,f=-4.7!) USER MOD Single : A 77 CYS SG : rot 180:sc= -0.523 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= 0.517 K(o=0.52,f=-7.5!) USER MOD Single : A 88 LYS NZ :NH3+ -165:sc= 1.64 (180deg=1.2) USER MOD Single : A 92 MET CE :methyl -167:sc= -0.0107 (180deg=-0.244) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.131 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 165:sc= -0.0283 (180deg=-0.287) USER MOD Single : A 103 LYS NZ :NH3+ 163:sc= 1.24 (180deg=1.04) USER MOD Single : A 104 LYS NZ :NH3+ 160:sc= 1.13 (180deg=0.619) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot -63:sc= -2.05! USER MOD Single : A 115 LYS NZ :NH3+ -156:sc= 0.256 (180deg=-0.633) USER MOD Single : A 116 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.02) USER MOD Single : A 117 SER OG : rot -110:sc= -1.98! USER MOD Single : A 122 GLN : amide:sc= -0.576 K(o=-0.58,f=-4.9!) USER MOD Single : A 123 LYS NZ :NH3+ -159:sc= -0.11 (180deg=-0.51) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 180:sc= 0.215 USER MOD Single : A 131 SER OG : rot 81:sc= 0.034 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot -41:sc= 0.735 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.627 -0.790 -0.817 1.00 0.00 N ATOM 2 CA MET A 1 1.704 -0.668 -1.823 1.00 52.33 C ATOM 3 C MET A 1 3.041 -1.096 -1.229 1.00 41.35 C ATOM 4 O MET A 1 3.534 -0.484 -0.282 1.00 33.20 O ATOM 5 CB MET A 1 1.800 0.771 -2.334 1.00 34.21 C ATOM 6 CG MET A 1 2.783 0.972 -3.481 1.00 1.41 C ATOM 7 SD MET A 1 2.202 0.294 -5.053 1.00 11.44 S ATOM 8 CE MET A 1 2.490 -1.463 -4.845 1.00 10.12 C ATOM 0 H1 MET A 1 -0.297 -0.761 -1.293 1.00 0.00 H new ATOM 0 H2 MET A 1 0.727 -1.692 -0.309 1.00 0.00 H new ATOM 0 H3 MET A 1 0.693 -0.003 -0.141 1.00 0.00 H new ATOM 0 HA MET A 1 1.464 -1.324 -2.660 1.00 52.33 H new ATOM 0 HB2 MET A 1 0.811 1.094 -2.659 1.00 34.21 H new ATOM 0 HB3 MET A 1 2.090 1.418 -1.506 1.00 34.21 H new ATOM 0 HG2 MET A 1 2.975 2.038 -3.603 1.00 1.41 H new ATOM 0 HG3 MET A 1 3.733 0.505 -3.221 1.00 1.41 H new ATOM 0 HE1 MET A 1 2.554 -1.939 -5.823 1.00 10.12 H new ATOM 0 HE2 MET A 1 3.424 -1.617 -4.304 1.00 10.12 H new ATOM 0 HE3 MET A 1 1.667 -1.902 -4.281 1.00 10.12 H new ATOM 20 N ALA A 2 3.620 -2.151 -1.786 1.00 34.15 N ATOM 21 CA ALA A 2 4.912 -2.645 -1.332 1.00 73.31 C ATOM 22 C ALA A 2 5.997 -2.369 -2.371 1.00 2.40 C ATOM 23 O ALA A 2 6.983 -3.101 -2.457 1.00 62.02 O ATOM 24 CB ALA A 2 4.828 -4.135 -1.034 1.00 45.01 C ATOM 0 H ALA A 2 3.213 -2.683 -2.556 1.00 34.15 H new ATOM 0 HA ALA A 2 5.179 -2.117 -0.416 1.00 73.31 H new ATOM 0 HB1 ALA A 2 5.800 -4.494 -0.695 1.00 45.01 H new ATOM 0 HB2 ALA A 2 4.085 -4.309 -0.255 1.00 45.01 H new ATOM 0 HB3 ALA A 2 4.538 -4.671 -1.938 1.00 45.01 H new ATOM 30 N SER A 3 5.810 -1.291 -3.135 1.00 5.22 N ATOM 31 CA SER A 3 6.741 -0.896 -4.196 1.00 31.41 C ATOM 32 C SER A 3 6.840 -1.970 -5.282 1.00 64.41 C ATOM 33 O SER A 3 7.627 -2.911 -5.187 1.00 61.32 O ATOM 34 CB SER A 3 8.122 -0.570 -3.615 1.00 1.14 C ATOM 35 OG SER A 3 8.040 0.512 -2.695 1.00 33.30 O ATOM 0 H SER A 3 5.009 -0.667 -3.036 1.00 5.22 H new ATOM 0 HA SER A 3 6.348 0.007 -4.664 1.00 31.41 H new ATOM 0 HB2 SER A 3 8.528 -1.449 -3.114 1.00 1.14 H new ATOM 0 HB3 SER A 3 8.810 -0.316 -4.421 1.00 1.14 H new ATOM 0 HG SER A 3 8.931 0.703 -2.334 1.00 33.30 H new ATOM 41 N GLY A 4 6.022 -1.812 -6.312 1.00 34.42 N ATOM 42 CA GLY A 4 5.947 -2.792 -7.381 1.00 63.21 C ATOM 43 C GLY A 4 4.507 -3.084 -7.730 1.00 3.11 C ATOM 44 O GLY A 4 3.800 -3.752 -6.976 1.00 44.02 O ATOM 0 H GLY A 4 5.400 -1.012 -6.429 1.00 34.42 H new ATOM 0 HA2 GLY A 4 6.472 -2.420 -8.261 1.00 63.21 H new ATOM 0 HA3 GLY A 4 6.447 -3.711 -7.076 1.00 63.21 H new ATOM 48 N VAL A 5 4.068 -2.582 -8.872 1.00 43.32 N ATOM 49 CA VAL A 5 2.649 -2.545 -9.186 1.00 42.52 C ATOM 50 C VAL A 5 2.301 -3.435 -10.376 1.00 10.24 C ATOM 51 O VAL A 5 3.068 -3.543 -11.334 1.00 15.41 O ATOM 52 CB VAL A 5 2.210 -1.097 -9.478 1.00 15.43 C ATOM 53 CG1 VAL A 5 0.706 -0.998 -9.622 1.00 41.45 C ATOM 54 CG2 VAL A 5 2.698 -0.163 -8.386 1.00 74.53 C ATOM 0 H VAL A 5 4.673 -2.195 -9.596 1.00 43.32 H new ATOM 0 HA VAL A 5 2.114 -2.927 -8.316 1.00 42.52 H new ATOM 0 HB VAL A 5 2.660 -0.796 -10.424 1.00 15.43 H new ATOM 0 HG11 VAL A 5 0.427 0.036 -9.827 1.00 41.45 H new ATOM 0 HG12 VAL A 5 0.377 -1.633 -10.444 1.00 41.45 H new ATOM 0 HG13 VAL A 5 0.230 -1.325 -8.698 1.00 41.45 H new ATOM 0 HG21 VAL A 5 2.379 0.855 -8.609 1.00 74.53 H new ATOM 0 HG22 VAL A 5 2.280 -0.473 -7.428 1.00 74.53 H new ATOM 0 HG23 VAL A 5 3.786 -0.199 -8.336 1.00 74.53 H new ATOM 64 N THR A 6 1.137 -4.066 -10.302 1.00 25.11 N ATOM 65 CA THR A 6 0.650 -4.917 -11.374 1.00 71.41 C ATOM 66 C THR A 6 -0.359 -4.174 -12.242 1.00 3.44 C ATOM 67 O THR A 6 -1.352 -3.659 -11.745 1.00 52.33 O ATOM 68 CB THR A 6 -0.010 -6.187 -10.809 1.00 22.11 C ATOM 69 OG1 THR A 6 0.970 -6.991 -10.135 1.00 71.41 O ATOM 70 CG2 THR A 6 -0.673 -6.993 -11.916 1.00 54.44 C ATOM 0 H THR A 6 0.508 -4.002 -9.501 1.00 25.11 H new ATOM 0 HA THR A 6 1.509 -5.199 -11.983 1.00 71.41 H new ATOM 0 HB THR A 6 -0.779 -5.886 -10.097 1.00 22.11 H new ATOM 0 HG1 THR A 6 0.542 -7.797 -9.777 1.00 71.41 H new ATOM 0 HG21 THR A 6 -1.132 -7.886 -11.491 1.00 54.44 H new ATOM 0 HG22 THR A 6 -1.439 -6.386 -12.399 1.00 54.44 H new ATOM 0 HG23 THR A 6 0.076 -7.286 -12.652 1.00 54.44 H new ATOM 78 N VAL A 7 -0.101 -4.114 -13.536 1.00 62.35 N ATOM 79 CA VAL A 7 -0.998 -3.432 -14.456 1.00 25.04 C ATOM 80 C VAL A 7 -2.076 -4.389 -14.965 1.00 61.41 C ATOM 81 O VAL A 7 -1.766 -5.469 -15.465 1.00 13.35 O ATOM 82 CB VAL A 7 -0.223 -2.847 -15.652 1.00 53.32 C ATOM 83 CG1 VAL A 7 -1.127 -1.969 -16.502 1.00 52.30 C ATOM 84 CG2 VAL A 7 0.991 -2.069 -15.169 1.00 63.13 C ATOM 0 H VAL A 7 0.721 -4.528 -13.975 1.00 62.35 H new ATOM 0 HA VAL A 7 -1.471 -2.615 -13.911 1.00 25.04 H new ATOM 0 HB VAL A 7 0.125 -3.672 -16.274 1.00 53.32 H new ATOM 0 HG11 VAL A 7 -0.559 -1.566 -17.341 1.00 52.30 H new ATOM 0 HG12 VAL A 7 -1.960 -2.562 -16.879 1.00 52.30 H new ATOM 0 HG13 VAL A 7 -1.511 -1.148 -15.896 1.00 52.30 H new ATOM 0 HG21 VAL A 7 1.527 -1.662 -16.026 1.00 63.13 H new ATOM 0 HG22 VAL A 7 0.667 -1.253 -14.523 1.00 63.13 H new ATOM 0 HG23 VAL A 7 1.650 -2.733 -14.610 1.00 63.13 H new ATOM 94 N SER A 8 -3.337 -3.993 -14.824 1.00 74.14 N ATOM 95 CA SER A 8 -4.454 -4.811 -15.280 1.00 22.23 C ATOM 96 C SER A 8 -4.530 -4.830 -16.805 1.00 21.14 C ATOM 97 O SER A 8 -4.065 -3.902 -17.476 1.00 32.14 O ATOM 98 CB SER A 8 -5.766 -4.279 -14.703 1.00 33.15 C ATOM 99 OG SER A 8 -5.693 -4.168 -13.293 1.00 25.24 O ATOM 0 H SER A 8 -3.611 -3.108 -14.396 1.00 74.14 H new ATOM 0 HA SER A 8 -4.293 -5.830 -14.929 1.00 22.23 H new ATOM 0 HB2 SER A 8 -5.989 -3.304 -15.137 1.00 33.15 H new ATOM 0 HB3 SER A 8 -6.584 -4.945 -14.977 1.00 33.15 H new ATOM 0 HG SER A 8 -5.177 -3.370 -13.054 1.00 25.24 H new ATOM 105 N ASP A 9 -5.142 -5.878 -17.339 1.00 4.12 N ATOM 106 CA ASP A 9 -5.255 -6.066 -18.781 1.00 44.03 C ATOM 107 C ASP A 9 -6.103 -4.973 -19.421 1.00 13.34 C ATOM 108 O ASP A 9 -5.950 -4.679 -20.607 1.00 64.44 O ATOM 109 CB ASP A 9 -5.857 -7.436 -19.092 1.00 3.43 C ATOM 110 CG ASP A 9 -4.922 -8.579 -18.756 1.00 20.52 C ATOM 111 OD1 ASP A 9 -4.705 -8.849 -17.554 1.00 15.23 O ATOM 112 OD2 ASP A 9 -4.411 -9.229 -19.694 1.00 64.14 O ATOM 0 H ASP A 9 -5.573 -6.620 -16.788 1.00 4.12 H new ATOM 0 HA ASP A 9 -4.251 -6.008 -19.201 1.00 44.03 H new ATOM 0 HB2 ASP A 9 -6.785 -7.555 -18.532 1.00 3.43 H new ATOM 0 HB3 ASP A 9 -6.115 -7.483 -20.150 1.00 3.43 H new ATOM 117 N VAL A 10 -6.986 -4.363 -18.628 1.00 42.42 N ATOM 118 CA VAL A 10 -7.850 -3.288 -19.119 1.00 1.42 C ATOM 119 C VAL A 10 -7.011 -2.135 -19.675 1.00 24.23 C ATOM 120 O VAL A 10 -7.422 -1.439 -20.604 1.00 74.12 O ATOM 121 CB VAL A 10 -8.804 -2.754 -18.014 1.00 13.42 C ATOM 122 CG1 VAL A 10 -9.900 -1.897 -18.627 1.00 1.34 C ATOM 123 CG2 VAL A 10 -9.409 -3.904 -17.224 1.00 23.01 C ATOM 0 H VAL A 10 -7.121 -4.595 -17.644 1.00 42.42 H new ATOM 0 HA VAL A 10 -8.462 -3.711 -19.916 1.00 1.42 H new ATOM 0 HB VAL A 10 -8.222 -2.137 -17.329 1.00 13.42 H new ATOM 0 HG11 VAL A 10 -10.559 -1.531 -17.840 1.00 1.34 H new ATOM 0 HG12 VAL A 10 -9.452 -1.051 -19.147 1.00 1.34 H new ATOM 0 HG13 VAL A 10 -10.476 -2.494 -19.334 1.00 1.34 H new ATOM 0 HG21 VAL A 10 -10.073 -3.508 -16.456 1.00 23.01 H new ATOM 0 HG22 VAL A 10 -9.975 -4.549 -17.896 1.00 23.01 H new ATOM 0 HG23 VAL A 10 -8.613 -4.480 -16.753 1.00 23.01 H new ATOM 133 N CYS A 11 -5.817 -1.960 -19.124 1.00 72.05 N ATOM 134 CA CYS A 11 -4.905 -0.924 -19.585 1.00 44.33 C ATOM 135 C CYS A 11 -4.339 -1.273 -20.961 1.00 72.01 C ATOM 136 O CYS A 11 -4.164 -0.399 -21.809 1.00 74.14 O ATOM 137 CB CYS A 11 -3.767 -0.735 -18.578 1.00 42.13 C ATOM 138 SG CYS A 11 -2.489 0.427 -19.109 1.00 53.01 S ATOM 0 H CYS A 11 -5.457 -2.525 -18.355 1.00 72.05 H new ATOM 0 HA CYS A 11 -5.461 0.010 -19.670 1.00 44.33 H new ATOM 0 HB2 CYS A 11 -4.187 -0.388 -17.634 1.00 42.13 H new ATOM 0 HB3 CYS A 11 -3.304 -1.703 -18.385 1.00 42.13 H new ATOM 0 HG CYS A 11 -2.740 1.603 -18.616 1.00 53.01 H new ATOM 144 N LYS A 12 -4.079 -2.557 -21.183 1.00 3.53 N ATOM 145 CA LYS A 12 -3.487 -3.013 -22.434 1.00 72.30 C ATOM 146 C LYS A 12 -4.473 -2.849 -23.584 1.00 63.34 C ATOM 147 O LYS A 12 -4.139 -2.271 -24.619 1.00 43.53 O ATOM 148 CB LYS A 12 -3.068 -4.482 -22.334 1.00 42.55 C ATOM 149 CG LYS A 12 -2.254 -4.955 -23.526 1.00 2.12 C ATOM 150 CD LYS A 12 -2.344 -6.462 -23.713 1.00 23.10 C ATOM 151 CE LYS A 12 -3.757 -6.883 -24.087 1.00 14.42 C ATOM 152 NZ LYS A 12 -3.821 -8.292 -24.554 1.00 2.41 N ATOM 0 H LYS A 12 -4.269 -3.301 -20.511 1.00 3.53 H new ATOM 0 HA LYS A 12 -2.604 -2.403 -22.625 1.00 72.30 H new ATOM 0 HB2 LYS A 12 -2.485 -4.626 -21.424 1.00 42.55 H new ATOM 0 HB3 LYS A 12 -3.960 -5.102 -22.242 1.00 42.55 H new ATOM 0 HG2 LYS A 12 -2.608 -4.456 -24.428 1.00 2.12 H new ATOM 0 HG3 LYS A 12 -1.211 -4.668 -23.390 1.00 2.12 H new ATOM 0 HD2 LYS A 12 -1.649 -6.777 -24.491 1.00 23.10 H new ATOM 0 HD3 LYS A 12 -2.043 -6.964 -22.794 1.00 23.10 H new ATOM 0 HE2 LYS A 12 -4.411 -6.759 -23.224 1.00 14.42 H new ATOM 0 HE3 LYS A 12 -4.134 -6.226 -24.870 1.00 14.42 H new ATOM 0 HZ1 LYS A 12 -4.803 -8.533 -24.797 1.00 2.41 H new ATOM 0 HZ2 LYS A 12 -3.218 -8.407 -25.394 1.00 2.41 H new ATOM 0 HZ3 LYS A 12 -3.487 -8.924 -23.799 1.00 2.41 H new ATOM 166 N THR A 13 -5.687 -3.350 -23.385 1.00 61.43 N ATOM 167 CA THR A 13 -6.717 -3.311 -24.414 1.00 33.32 C ATOM 168 C THR A 13 -7.049 -1.872 -24.803 1.00 71.23 C ATOM 169 O THR A 13 -7.283 -1.569 -25.973 1.00 71.31 O ATOM 170 CB THR A 13 -7.991 -4.026 -23.934 1.00 34.44 C ATOM 171 OG1 THR A 13 -7.631 -5.246 -23.270 1.00 23.11 O ATOM 172 CG2 THR A 13 -8.914 -4.333 -25.106 1.00 53.21 C ATOM 0 H THR A 13 -5.982 -3.791 -22.514 1.00 61.43 H new ATOM 0 HA THR A 13 -6.328 -3.828 -25.291 1.00 33.32 H new ATOM 0 HB THR A 13 -8.520 -3.370 -23.242 1.00 34.44 H new ATOM 0 HG1 THR A 13 -8.442 -5.702 -22.962 1.00 23.11 H new ATOM 0 HG21 THR A 13 -9.808 -4.839 -24.742 1.00 53.21 H new ATOM 0 HG22 THR A 13 -9.198 -3.403 -25.599 1.00 53.21 H new ATOM 0 HG23 THR A 13 -8.397 -4.977 -25.817 1.00 53.21 H new ATOM 180 N THR A 14 -7.045 -0.981 -23.825 1.00 54.21 N ATOM 181 CA THR A 14 -7.304 0.420 -24.096 1.00 13.21 C ATOM 182 C THR A 14 -6.158 1.032 -24.905 1.00 32.14 C ATOM 183 O THR A 14 -6.389 1.797 -25.844 1.00 74.24 O ATOM 184 CB THR A 14 -7.506 1.217 -22.794 1.00 11.31 C ATOM 185 OG1 THR A 14 -8.521 0.593 -21.992 1.00 41.13 O ATOM 186 CG2 THR A 14 -7.913 2.648 -23.103 1.00 13.14 C ATOM 0 H THR A 14 -6.867 -1.202 -22.845 1.00 54.21 H new ATOM 0 HA THR A 14 -8.224 0.476 -24.678 1.00 13.21 H new ATOM 0 HB THR A 14 -6.564 1.228 -22.246 1.00 11.31 H new ATOM 0 HG1 THR A 14 -8.109 -0.074 -21.403 1.00 41.13 H new ATOM 0 HG21 THR A 14 -8.051 3.196 -22.171 1.00 13.14 H new ATOM 0 HG22 THR A 14 -7.133 3.128 -23.694 1.00 13.14 H new ATOM 0 HG23 THR A 14 -8.847 2.647 -23.666 1.00 13.14 H new ATOM 194 N TYR A 15 -4.926 0.661 -24.558 1.00 62.34 N ATOM 195 CA TYR A 15 -3.751 1.198 -25.231 1.00 43.33 C ATOM 196 C TYR A 15 -3.671 0.701 -26.673 1.00 73.15 C ATOM 197 O TYR A 15 -3.377 1.477 -27.581 1.00 40.42 O ATOM 198 CB TYR A 15 -2.469 0.835 -24.469 1.00 64.43 C ATOM 199 CG TYR A 15 -1.201 1.382 -25.103 1.00 71.00 C ATOM 200 CD1 TYR A 15 -0.750 2.670 -24.826 1.00 15.53 C ATOM 201 CD2 TYR A 15 -0.457 0.608 -25.985 1.00 0.54 C ATOM 202 CE1 TYR A 15 0.403 3.165 -25.410 1.00 11.35 C ATOM 203 CE2 TYR A 15 0.695 1.098 -26.571 1.00 62.20 C ATOM 204 CZ TYR A 15 1.120 2.375 -26.283 1.00 13.12 C ATOM 205 OH TYR A 15 2.269 2.861 -26.867 1.00 73.33 O ATOM 0 H TYR A 15 -4.719 -0.008 -23.816 1.00 62.34 H new ATOM 0 HA TYR A 15 -3.845 2.284 -25.248 1.00 43.33 H new ATOM 0 HB2 TYR A 15 -2.545 1.211 -23.449 1.00 64.43 H new ATOM 0 HB3 TYR A 15 -2.392 -0.250 -24.403 1.00 64.43 H new ATOM 0 HD1 TYR A 15 -1.309 3.293 -24.144 1.00 15.53 H new ATOM 0 HD2 TYR A 15 -0.785 -0.395 -26.217 1.00 0.54 H new ATOM 0 HE1 TYR A 15 0.740 4.166 -25.183 1.00 11.35 H new ATOM 0 HE2 TYR A 15 1.260 0.480 -27.253 1.00 62.20 H new ATOM 0 HH TYR A 15 2.934 3.051 -26.172 1.00 73.33 H new ATOM 215 N GLU A 16 -3.947 -0.583 -26.891 1.00 54.04 N ATOM 216 CA GLU A 16 -3.874 -1.150 -28.237 1.00 32.13 C ATOM 217 C GLU A 16 -4.934 -0.524 -29.142 1.00 75.33 C ATOM 218 O GLU A 16 -4.727 -0.372 -30.348 1.00 65.12 O ATOM 219 CB GLU A 16 -4.012 -2.678 -28.209 1.00 11.32 C ATOM 220 CG GLU A 16 -5.346 -3.176 -27.688 1.00 14.31 C ATOM 221 CD GLU A 16 -5.438 -4.686 -27.688 1.00 51.15 C ATOM 222 OE1 GLU A 16 -4.974 -5.317 -26.715 1.00 24.30 O ATOM 223 OE2 GLU A 16 -5.946 -5.254 -28.675 1.00 43.30 O ATOM 0 H GLU A 16 -4.220 -1.244 -26.164 1.00 54.04 H new ATOM 0 HA GLU A 16 -2.891 -0.916 -28.645 1.00 32.13 H new ATOM 0 HB2 GLU A 16 -3.863 -3.063 -29.218 1.00 11.32 H new ATOM 0 HB3 GLU A 16 -3.216 -3.091 -27.589 1.00 11.32 H new ATOM 0 HG2 GLU A 16 -5.498 -2.805 -26.674 1.00 14.31 H new ATOM 0 HG3 GLU A 16 -6.148 -2.766 -28.301 1.00 14.31 H new ATOM 230 N GLU A 17 -6.061 -0.135 -28.559 1.00 74.00 N ATOM 231 CA GLU A 17 -7.096 0.548 -29.312 1.00 60.51 C ATOM 232 C GLU A 17 -6.715 2.000 -29.573 1.00 70.04 C ATOM 233 O GLU A 17 -6.814 2.474 -30.701 1.00 52.52 O ATOM 234 CB GLU A 17 -8.438 0.493 -28.585 1.00 70.15 C ATOM 235 CG GLU A 17 -9.083 -0.882 -28.586 1.00 23.32 C ATOM 236 CD GLU A 17 -10.534 -0.824 -28.166 1.00 31.15 C ATOM 237 OE1 GLU A 17 -11.352 -0.273 -28.935 1.00 23.43 O ATOM 238 OE2 GLU A 17 -10.868 -1.293 -27.062 1.00 30.11 O ATOM 0 H GLU A 17 -6.278 -0.281 -27.573 1.00 74.00 H new ATOM 0 HA GLU A 17 -7.194 0.031 -30.267 1.00 60.51 H new ATOM 0 HB2 GLU A 17 -8.295 0.816 -27.554 1.00 70.15 H new ATOM 0 HB3 GLU A 17 -9.121 1.204 -29.049 1.00 70.15 H new ATOM 0 HG2 GLU A 17 -9.011 -1.316 -29.583 1.00 23.32 H new ATOM 0 HG3 GLU A 17 -8.536 -1.540 -27.911 1.00 23.32 H new ATOM 245 N ILE A 18 -6.258 2.698 -28.536 1.00 60.13 N ATOM 246 CA ILE A 18 -5.969 4.126 -28.650 1.00 33.24 C ATOM 247 C ILE A 18 -4.749 4.383 -29.543 1.00 44.35 C ATOM 248 O ILE A 18 -4.622 5.452 -30.132 1.00 21.53 O ATOM 249 CB ILE A 18 -5.761 4.792 -27.263 1.00 54.20 C ATOM 250 CG1 ILE A 18 -5.722 6.318 -27.400 1.00 74.12 C ATOM 251 CG2 ILE A 18 -4.488 4.287 -26.598 1.00 44.25 C ATOM 252 CD1 ILE A 18 -5.519 7.042 -26.086 1.00 62.05 C ATOM 0 H ILE A 18 -6.081 2.302 -27.613 1.00 60.13 H new ATOM 0 HA ILE A 18 -6.844 4.581 -29.115 1.00 33.24 H new ATOM 0 HB ILE A 18 -6.605 4.519 -26.630 1.00 54.20 H new ATOM 0 HG12 ILE A 18 -4.918 6.592 -28.084 1.00 74.12 H new ATOM 0 HG13 ILE A 18 -6.654 6.657 -27.851 1.00 74.12 H new ATOM 0 HG21 ILE A 18 -4.368 4.770 -25.628 1.00 44.25 H new ATOM 0 HG22 ILE A 18 -4.553 3.208 -26.460 1.00 44.25 H new ATOM 0 HG23 ILE A 18 -3.630 4.521 -27.229 1.00 44.25 H new ATOM 0 HD11 ILE A 18 -5.502 8.118 -26.262 1.00 62.05 H new ATOM 0 HD12 ILE A 18 -6.336 6.798 -25.406 1.00 62.05 H new ATOM 0 HD13 ILE A 18 -4.573 6.732 -25.642 1.00 62.05 H new ATOM 264 N LYS A 19 -3.868 3.399 -29.663 1.00 14.03 N ATOM 265 CA LYS A 19 -2.678 3.561 -30.489 1.00 34.34 C ATOM 266 C LYS A 19 -3.010 3.374 -31.972 1.00 13.14 C ATOM 267 O LYS A 19 -2.388 3.992 -32.835 1.00 74.54 O ATOM 268 CB LYS A 19 -1.569 2.587 -30.053 1.00 44.31 C ATOM 269 CG LYS A 19 -1.852 1.127 -30.378 1.00 2.41 C ATOM 270 CD LYS A 19 -0.827 0.192 -29.747 1.00 23.21 C ATOM 271 CE LYS A 19 0.594 0.531 -30.169 1.00 21.13 C ATOM 272 NZ LYS A 19 1.583 -0.422 -29.600 1.00 43.11 N ATOM 0 H LYS A 19 -3.952 2.491 -29.206 1.00 14.03 H new ATOM 0 HA LYS A 19 -2.311 4.578 -30.350 1.00 34.34 H new ATOM 0 HB2 LYS A 19 -0.636 2.879 -30.534 1.00 44.31 H new ATOM 0 HB3 LYS A 19 -1.418 2.685 -28.978 1.00 44.31 H new ATOM 0 HG2 LYS A 19 -2.849 0.864 -30.024 1.00 2.41 H new ATOM 0 HG3 LYS A 19 -1.851 0.990 -31.459 1.00 2.41 H new ATOM 0 HD2 LYS A 19 -0.905 0.249 -28.661 1.00 23.21 H new ATOM 0 HD3 LYS A 19 -1.053 -0.836 -30.030 1.00 23.21 H new ATOM 0 HE2 LYS A 19 0.662 0.519 -31.257 1.00 21.13 H new ATOM 0 HE3 LYS A 19 0.837 1.543 -29.845 1.00 21.13 H new ATOM 0 HZ1 LYS A 19 2.458 0.087 -29.362 1.00 43.11 H new ATOM 0 HZ2 LYS A 19 1.191 -0.857 -28.741 1.00 43.11 H new ATOM 0 HZ3 LYS A 19 1.793 -1.163 -30.299 1.00 43.11 H new ATOM 286 N LYS A 20 -3.983 2.514 -32.268 1.00 31.43 N ATOM 287 CA LYS A 20 -4.348 2.230 -33.654 1.00 63.43 C ATOM 288 C LYS A 20 -5.566 3.033 -34.109 1.00 20.40 C ATOM 289 O LYS A 20 -5.494 3.811 -35.061 1.00 10.51 O ATOM 290 CB LYS A 20 -4.639 0.740 -33.836 1.00 54.52 C ATOM 291 CG LYS A 20 -3.433 -0.161 -33.631 1.00 45.33 C ATOM 292 CD LYS A 20 -3.776 -1.607 -33.944 1.00 55.20 C ATOM 293 CE LYS A 20 -4.284 -1.755 -35.370 1.00 62.22 C ATOM 294 NZ LYS A 20 -4.685 -3.151 -35.685 1.00 3.31 N ATOM 0 H LYS A 20 -4.529 2.005 -31.572 1.00 31.43 H new ATOM 0 HA LYS A 20 -3.497 2.524 -34.268 1.00 63.43 H new ATOM 0 HB2 LYS A 20 -5.421 0.446 -33.136 1.00 54.52 H new ATOM 0 HB3 LYS A 20 -5.033 0.578 -34.840 1.00 54.52 H new ATOM 0 HG2 LYS A 20 -2.615 0.169 -34.271 1.00 45.33 H new ATOM 0 HG3 LYS A 20 -3.085 -0.081 -32.601 1.00 45.33 H new ATOM 0 HD2 LYS A 20 -2.894 -2.232 -33.803 1.00 55.20 H new ATOM 0 HD3 LYS A 20 -4.534 -1.963 -33.246 1.00 55.20 H new ATOM 0 HE2 LYS A 20 -5.136 -1.092 -35.520 1.00 62.22 H new ATOM 0 HE3 LYS A 20 -3.507 -1.437 -36.065 1.00 62.22 H new ATOM 0 HZ1 LYS A 20 -5.024 -3.202 -36.667 1.00 3.31 H new ATOM 0 HZ2 LYS A 20 -3.867 -3.782 -35.568 1.00 3.31 H new ATOM 0 HZ3 LYS A 20 -5.445 -3.448 -35.041 1.00 3.31 H new ATOM 308 N ASP A 21 -6.677 2.841 -33.412 1.00 34.22 N ATOM 309 CA ASP A 21 -7.966 3.378 -33.840 1.00 14.54 C ATOM 310 C ASP A 21 -8.294 4.663 -33.086 1.00 23.23 C ATOM 311 O ASP A 21 -8.995 5.532 -33.598 1.00 3.45 O ATOM 312 CB ASP A 21 -9.047 2.316 -33.612 1.00 0.53 C ATOM 313 CG ASP A 21 -10.418 2.744 -34.088 1.00 71.12 C ATOM 314 OD1 ASP A 21 -10.613 2.883 -35.315 1.00 12.21 O ATOM 315 OD2 ASP A 21 -11.312 2.926 -33.236 1.00 11.25 O ATOM 0 H ASP A 21 -6.713 2.313 -32.540 1.00 34.22 H new ATOM 0 HA ASP A 21 -7.923 3.625 -34.901 1.00 14.54 H new ATOM 0 HB2 ASP A 21 -8.761 1.400 -34.128 1.00 0.53 H new ATOM 0 HB3 ASP A 21 -9.096 2.081 -32.549 1.00 0.53 H new ATOM 320 N LYS A 22 -7.756 4.756 -31.869 1.00 4.34 N ATOM 321 CA LYS A 22 -7.851 5.935 -30.998 1.00 43.34 C ATOM 322 C LYS A 22 -9.271 6.484 -30.859 1.00 14.13 C ATOM 323 O LYS A 22 -9.466 7.692 -30.742 1.00 42.43 O ATOM 324 CB LYS A 22 -6.884 7.041 -31.450 1.00 5.33 C ATOM 325 CG LYS A 22 -7.228 7.706 -32.769 1.00 1.04 C ATOM 326 CD LYS A 22 -6.188 8.738 -33.142 1.00 11.23 C ATOM 327 CE LYS A 22 -6.599 9.518 -34.370 1.00 25.15 C ATOM 328 NZ LYS A 22 -5.556 10.503 -34.763 1.00 12.14 N ATOM 0 H LYS A 22 -7.226 3.993 -31.447 1.00 4.34 H new ATOM 0 HA LYS A 22 -7.558 5.591 -30.006 1.00 43.34 H new ATOM 0 HB2 LYS A 22 -6.847 7.807 -30.675 1.00 5.33 H new ATOM 0 HB3 LYS A 22 -5.883 6.616 -31.527 1.00 5.33 H new ATOM 0 HG2 LYS A 22 -7.296 6.952 -33.554 1.00 1.04 H new ATOM 0 HG3 LYS A 22 -8.207 8.180 -32.697 1.00 1.04 H new ATOM 0 HD2 LYS A 22 -6.038 9.423 -32.308 1.00 11.23 H new ATOM 0 HD3 LYS A 22 -5.233 8.245 -33.325 1.00 11.23 H new ATOM 0 HE2 LYS A 22 -6.781 8.830 -35.196 1.00 25.15 H new ATOM 0 HE3 LYS A 22 -7.537 10.038 -34.175 1.00 25.15 H new ATOM 0 HZ1 LYS A 22 -5.945 11.156 -35.473 1.00 12.14 H new ATOM 0 HZ2 LYS A 22 -5.254 11.042 -33.926 1.00 12.14 H new ATOM 0 HZ3 LYS A 22 -4.738 10.001 -35.165 1.00 12.14 H new ATOM 342 N LYS A 23 -10.261 5.600 -30.818 1.00 55.42 N ATOM 343 CA LYS A 23 -11.622 6.026 -30.516 1.00 10.41 C ATOM 344 C LYS A 23 -11.874 5.911 -29.016 1.00 14.42 C ATOM 345 O LYS A 23 -13.013 5.945 -28.546 1.00 21.13 O ATOM 346 CB LYS A 23 -12.651 5.227 -31.317 1.00 55.45 C ATOM 347 CG LYS A 23 -13.438 6.090 -32.296 1.00 75.43 C ATOM 348 CD LYS A 23 -12.531 6.734 -33.338 1.00 0.13 C ATOM 349 CE LYS A 23 -11.951 5.703 -34.289 1.00 44.30 C ATOM 350 NZ LYS A 23 -13.005 4.962 -35.032 1.00 61.21 N ATOM 0 H LYS A 23 -10.151 4.600 -30.987 1.00 55.42 H new ATOM 0 HA LYS A 23 -11.734 7.069 -30.812 1.00 10.41 H new ATOM 0 HB2 LYS A 23 -12.142 4.435 -31.866 1.00 55.45 H new ATOM 0 HB3 LYS A 23 -13.344 4.743 -30.629 1.00 55.45 H new ATOM 0 HG2 LYS A 23 -14.190 5.479 -32.796 1.00 75.43 H new ATOM 0 HG3 LYS A 23 -13.971 6.867 -31.748 1.00 75.43 H new ATOM 0 HD2 LYS A 23 -13.095 7.475 -33.904 1.00 0.13 H new ATOM 0 HD3 LYS A 23 -11.721 7.265 -32.838 1.00 0.13 H new ATOM 0 HE2 LYS A 23 -11.290 6.199 -35.000 1.00 44.30 H new ATOM 0 HE3 LYS A 23 -11.341 4.996 -33.726 1.00 44.30 H new ATOM 0 HZ1 LYS A 23 -12.585 4.503 -35.866 1.00 61.21 H new ATOM 0 HZ2 LYS A 23 -13.423 4.239 -34.413 1.00 61.21 H new ATOM 0 HZ3 LYS A 23 -13.745 5.625 -35.338 1.00 61.21 H new ATOM 364 N HIS A 24 -10.780 5.756 -28.280 1.00 71.34 N ATOM 365 CA HIS A 24 -10.778 5.875 -26.830 1.00 23.33 C ATOM 366 C HIS A 24 -9.860 7.035 -26.477 1.00 55.20 C ATOM 367 O HIS A 24 -8.756 6.829 -25.984 1.00 54.21 O ATOM 368 CB HIS A 24 -10.282 4.584 -26.152 1.00 62.53 C ATOM 369 CG HIS A 24 -11.117 3.370 -26.437 1.00 13.25 C ATOM 370 ND1 HIS A 24 -11.704 2.608 -25.452 1.00 43.51 N ATOM 371 CD2 HIS A 24 -11.435 2.771 -27.607 1.00 52.12 C ATOM 372 CE1 HIS A 24 -12.346 1.597 -26.008 1.00 34.44 C ATOM 373 NE2 HIS A 24 -12.199 1.671 -27.316 1.00 24.33 N ATOM 0 H HIS A 24 -9.865 5.543 -28.676 1.00 71.34 H new ATOM 0 HA HIS A 24 -11.794 6.048 -26.474 1.00 23.33 H new ATOM 0 HB2 HIS A 24 -9.259 4.389 -26.474 1.00 62.53 H new ATOM 0 HB3 HIS A 24 -10.252 4.743 -25.074 1.00 62.53 H new ATOM 0 HD2 HIS A 24 -11.140 3.100 -28.593 1.00 52.12 H new ATOM 0 HE1 HIS A 24 -12.900 0.836 -25.479 1.00 34.44 H new ATOM 0 HE2 HIS A 24 -12.588 1.019 -27.997 1.00 24.33 H new ATOM 382 N ARG A 25 -10.323 8.245 -26.796 1.00 73.23 N ATOM 383 CA ARG A 25 -9.499 9.459 -26.776 1.00 34.15 C ATOM 384 C ARG A 25 -8.653 9.592 -25.511 1.00 53.23 C ATOM 385 O ARG A 25 -7.457 9.887 -25.589 1.00 2.43 O ATOM 386 CB ARG A 25 -10.395 10.688 -26.937 1.00 61.02 C ATOM 387 CG ARG A 25 -9.670 11.916 -27.461 1.00 24.31 C ATOM 388 CD ARG A 25 -8.992 11.628 -28.791 1.00 62.45 C ATOM 389 NE ARG A 25 -8.963 12.805 -29.660 1.00 64.04 N ATOM 390 CZ ARG A 25 -8.132 12.952 -30.692 1.00 62.11 C ATOM 391 NH1 ARG A 25 -7.139 12.089 -30.882 1.00 73.11 N ATOM 392 NH2 ARG A 25 -8.264 13.996 -31.503 1.00 1.22 N ATOM 0 H ARG A 25 -11.289 8.413 -27.078 1.00 73.23 H new ATOM 0 HA ARG A 25 -8.801 9.385 -27.610 1.00 34.15 H new ATOM 0 HB2 ARG A 25 -11.212 10.443 -27.616 1.00 61.02 H new ATOM 0 HB3 ARG A 25 -10.843 10.927 -25.973 1.00 61.02 H new ATOM 0 HG2 ARG A 25 -10.378 12.736 -27.581 1.00 24.31 H new ATOM 0 HG3 ARG A 25 -8.926 12.241 -26.733 1.00 24.31 H new ATOM 0 HD2 ARG A 25 -7.973 11.285 -28.611 1.00 62.45 H new ATOM 0 HD3 ARG A 25 -9.516 10.817 -29.297 1.00 62.45 H new ATOM 0 HE ARG A 25 -9.620 13.560 -29.464 1.00 64.04 H new ATOM 0 HH11 ARG A 25 -7.010 11.310 -30.237 1.00 73.11 H new ATOM 0 HH12 ARG A 25 -6.506 12.206 -31.673 1.00 73.11 H new ATOM 0 HH21 ARG A 25 -9.000 14.682 -31.335 1.00 1.22 H new ATOM 0 HH22 ARG A 25 -7.630 14.111 -32.293 1.00 1.22 H new ATOM 406 N TYR A 26 -9.263 9.394 -24.354 1.00 1.43 N ATOM 407 CA TYR A 26 -8.525 9.460 -23.106 1.00 72.30 C ATOM 408 C TYR A 26 -9.008 8.406 -22.125 1.00 34.25 C ATOM 409 O TYR A 26 -10.210 8.200 -21.937 1.00 53.44 O ATOM 410 CB TYR A 26 -8.587 10.863 -22.485 1.00 22.25 C ATOM 411 CG TYR A 26 -9.975 11.459 -22.361 1.00 30.51 C ATOM 412 CD1 TYR A 26 -10.579 12.085 -23.444 1.00 11.22 C ATOM 413 CD2 TYR A 26 -10.666 11.419 -21.159 1.00 21.54 C ATOM 414 CE1 TYR A 26 -11.831 12.652 -23.334 1.00 51.42 C ATOM 415 CE2 TYR A 26 -11.922 11.981 -21.042 1.00 42.21 C ATOM 416 CZ TYR A 26 -12.497 12.597 -22.133 1.00 2.13 C ATOM 417 OH TYR A 26 -13.745 13.160 -22.021 1.00 20.24 O ATOM 0 H TYR A 26 -10.257 9.188 -24.254 1.00 1.43 H new ATOM 0 HA TYR A 26 -7.480 9.250 -23.336 1.00 72.30 H new ATOM 0 HB2 TYR A 26 -8.138 10.823 -21.493 1.00 22.25 H new ATOM 0 HB3 TYR A 26 -7.974 11.535 -23.086 1.00 22.25 H new ATOM 0 HD1 TYR A 26 -10.058 12.128 -24.389 1.00 11.22 H new ATOM 0 HD2 TYR A 26 -10.215 10.941 -20.302 1.00 21.54 H new ATOM 0 HE1 TYR A 26 -12.285 13.136 -24.186 1.00 51.42 H new ATOM 0 HE2 TYR A 26 -12.451 11.938 -20.101 1.00 42.21 H new ATOM 0 HH TYR A 26 -13.894 13.776 -22.768 1.00 20.24 H new ATOM 427 N VAL A 27 -8.052 7.731 -21.517 1.00 54.15 N ATOM 428 CA VAL A 27 -8.343 6.673 -20.571 1.00 71.42 C ATOM 429 C VAL A 27 -7.920 7.070 -19.159 1.00 42.01 C ATOM 430 O VAL A 27 -6.771 7.451 -18.921 1.00 34.23 O ATOM 431 CB VAL A 27 -7.657 5.351 -20.987 1.00 53.41 C ATOM 432 CG1 VAL A 27 -6.192 5.579 -21.326 1.00 10.03 C ATOM 433 CG2 VAL A 27 -7.787 4.298 -19.896 1.00 32.13 C ATOM 0 H VAL A 27 -7.057 7.900 -21.664 1.00 54.15 H new ATOM 0 HA VAL A 27 -9.421 6.515 -20.575 1.00 71.42 H new ATOM 0 HB VAL A 27 -8.165 4.985 -21.879 1.00 53.41 H new ATOM 0 HG11 VAL A 27 -5.734 4.633 -21.615 1.00 10.03 H new ATOM 0 HG12 VAL A 27 -6.115 6.287 -22.152 1.00 10.03 H new ATOM 0 HG13 VAL A 27 -5.675 5.981 -20.455 1.00 10.03 H new ATOM 0 HG21 VAL A 27 -7.295 3.379 -20.216 1.00 32.13 H new ATOM 0 HG22 VAL A 27 -7.317 4.661 -18.982 1.00 32.13 H new ATOM 0 HG23 VAL A 27 -8.842 4.098 -19.707 1.00 32.13 H new ATOM 443 N ILE A 28 -8.863 6.988 -18.235 1.00 71.51 N ATOM 444 CA ILE A 28 -8.613 7.326 -16.847 1.00 70.43 C ATOM 445 C ILE A 28 -8.291 6.063 -16.061 1.00 24.03 C ATOM 446 O ILE A 28 -9.129 5.164 -15.916 1.00 33.45 O ATOM 447 CB ILE A 28 -9.817 8.046 -16.179 1.00 61.24 C ATOM 448 CG1 ILE A 28 -10.113 9.397 -16.848 1.00 4.31 C ATOM 449 CG2 ILE A 28 -9.562 8.248 -14.689 1.00 53.25 C ATOM 450 CD1 ILE A 28 -10.781 9.296 -18.205 1.00 51.45 C ATOM 0 H ILE A 28 -9.818 6.687 -18.426 1.00 71.51 H new ATOM 0 HA ILE A 28 -7.768 8.014 -16.835 1.00 70.43 H new ATOM 0 HB ILE A 28 -10.690 7.407 -16.309 1.00 61.24 H new ATOM 0 HG12 ILE A 28 -10.751 9.983 -16.186 1.00 4.31 H new ATOM 0 HG13 ILE A 28 -9.178 9.946 -16.958 1.00 4.31 H new ATOM 0 HG21 ILE A 28 -10.416 8.754 -14.239 1.00 53.25 H new ATOM 0 HG22 ILE A 28 -9.420 7.279 -14.210 1.00 53.25 H new ATOM 0 HG23 ILE A 28 -8.667 8.855 -14.552 1.00 53.25 H new ATOM 0 HD11 ILE A 28 -10.952 10.297 -18.602 1.00 51.45 H new ATOM 0 HD12 ILE A 28 -10.137 8.740 -18.887 1.00 51.45 H new ATOM 0 HD13 ILE A 28 -11.735 8.778 -18.103 1.00 51.45 H new ATOM 462 N PHE A 29 -7.073 5.997 -15.570 1.00 30.43 N ATOM 463 CA PHE A 29 -6.627 4.863 -14.791 1.00 21.21 C ATOM 464 C PHE A 29 -6.928 5.100 -13.322 1.00 1.25 C ATOM 465 O PHE A 29 -6.852 6.229 -12.838 1.00 50.32 O ATOM 466 CB PHE A 29 -5.124 4.635 -14.967 1.00 10.41 C ATOM 467 CG PHE A 29 -4.688 4.480 -16.396 1.00 45.15 C ATOM 468 CD1 PHE A 29 -4.738 3.246 -17.019 1.00 34.03 C ATOM 469 CD2 PHE A 29 -4.225 5.570 -17.113 1.00 35.25 C ATOM 470 CE1 PHE A 29 -4.336 3.102 -18.332 1.00 71.30 C ATOM 471 CE2 PHE A 29 -3.821 5.432 -18.424 1.00 40.31 C ATOM 472 CZ PHE A 29 -3.877 4.196 -19.036 1.00 72.31 C ATOM 0 H PHE A 29 -6.368 6.723 -15.698 1.00 30.43 H new ATOM 0 HA PHE A 29 -7.159 3.978 -15.142 1.00 21.21 H new ATOM 0 HB2 PHE A 29 -4.586 5.473 -14.524 1.00 10.41 H new ATOM 0 HB3 PHE A 29 -4.836 3.742 -14.412 1.00 10.41 H new ATOM 0 HD1 PHE A 29 -5.095 2.386 -16.472 1.00 34.03 H new ATOM 0 HD2 PHE A 29 -4.180 6.540 -16.640 1.00 35.25 H new ATOM 0 HE1 PHE A 29 -4.381 2.133 -18.808 1.00 71.30 H new ATOM 0 HE2 PHE A 29 -3.461 6.290 -18.972 1.00 40.31 H new ATOM 0 HZ PHE A 29 -3.562 4.086 -20.063 1.00 72.31 H new ATOM 482 N TYR A 30 -7.267 4.042 -12.622 1.00 15.42 N ATOM 483 CA TYR A 30 -7.472 4.115 -11.193 1.00 45.31 C ATOM 484 C TYR A 30 -6.518 3.145 -10.525 1.00 33.50 C ATOM 485 O TYR A 30 -5.985 2.249 -11.180 1.00 15.52 O ATOM 486 CB TYR A 30 -8.920 3.794 -10.824 1.00 25.43 C ATOM 487 CG TYR A 30 -9.504 4.757 -9.812 1.00 71.44 C ATOM 488 CD1 TYR A 30 -8.995 4.834 -8.522 1.00 52.03 C ATOM 489 CD2 TYR A 30 -10.552 5.603 -10.154 1.00 11.44 C ATOM 490 CE1 TYR A 30 -9.512 5.724 -7.602 1.00 31.53 C ATOM 491 CE2 TYR A 30 -11.071 6.500 -9.241 1.00 64.11 C ATOM 492 CZ TYR A 30 -10.549 6.554 -7.966 1.00 60.34 C ATOM 493 OH TYR A 30 -11.056 7.455 -7.058 1.00 1.44 O ATOM 0 H TYR A 30 -7.408 3.114 -13.022 1.00 15.42 H new ATOM 0 HA TYR A 30 -7.274 5.130 -10.848 1.00 45.31 H new ATOM 0 HB2 TYR A 30 -9.531 3.811 -11.727 1.00 25.43 H new ATOM 0 HB3 TYR A 30 -8.970 2.781 -10.424 1.00 25.43 H new ATOM 0 HD1 TYR A 30 -8.180 4.186 -8.234 1.00 52.03 H new ATOM 0 HD2 TYR A 30 -10.967 5.558 -11.150 1.00 11.44 H new ATOM 0 HE1 TYR A 30 -9.106 5.769 -6.602 1.00 31.53 H new ATOM 0 HE2 TYR A 30 -11.881 7.156 -9.524 1.00 64.11 H new ATOM 0 HH TYR A 30 -11.782 7.965 -7.474 1.00 1.44 H new ATOM 503 N ILE A 31 -6.274 3.324 -9.245 1.00 11.52 N ATOM 504 CA ILE A 31 -5.347 2.459 -8.555 1.00 44.35 C ATOM 505 C ILE A 31 -6.097 1.268 -7.953 1.00 45.41 C ATOM 506 O ILE A 31 -7.070 1.420 -7.210 1.00 11.44 O ATOM 507 CB ILE A 31 -4.521 3.254 -7.512 1.00 53.21 C ATOM 508 CG1 ILE A 31 -3.154 2.597 -7.289 1.00 62.15 C ATOM 509 CG2 ILE A 31 -5.265 3.416 -6.191 1.00 41.04 C ATOM 510 CD1 ILE A 31 -2.170 3.496 -6.588 1.00 74.35 C ATOM 0 H ILE A 31 -6.699 4.051 -8.669 1.00 11.52 H new ATOM 0 HA ILE A 31 -4.624 2.056 -9.264 1.00 44.35 H new ATOM 0 HB ILE A 31 -4.366 4.254 -7.918 1.00 53.21 H new ATOM 0 HG12 ILE A 31 -3.287 1.688 -6.703 1.00 62.15 H new ATOM 0 HG13 ILE A 31 -2.741 2.298 -8.252 1.00 62.15 H new ATOM 0 HG21 ILE A 31 -4.647 3.979 -5.492 1.00 41.04 H new ATOM 0 HG22 ILE A 31 -6.199 3.952 -6.363 1.00 41.04 H new ATOM 0 HG23 ILE A 31 -5.482 2.433 -5.773 1.00 41.04 H new ATOM 0 HD11 ILE A 31 -1.223 2.971 -6.461 1.00 74.35 H new ATOM 0 HD12 ILE A 31 -2.009 4.394 -7.184 1.00 74.35 H new ATOM 0 HD13 ILE A 31 -2.564 3.775 -5.611 1.00 74.35 H new ATOM 522 N ARG A 32 -5.659 0.083 -8.330 1.00 55.22 N ATOM 523 CA ARG A 32 -6.381 -1.142 -8.033 1.00 72.21 C ATOM 524 C ARG A 32 -5.792 -1.836 -6.813 1.00 71.50 C ATOM 525 O ARG A 32 -4.618 -2.205 -6.809 1.00 14.31 O ATOM 526 CB ARG A 32 -6.323 -2.068 -9.252 1.00 71.15 C ATOM 527 CG ARG A 32 -7.205 -3.299 -9.153 1.00 52.11 C ATOM 528 CD ARG A 32 -7.106 -4.143 -10.414 1.00 35.15 C ATOM 529 NE ARG A 32 -8.013 -5.291 -10.376 1.00 74.34 N ATOM 530 CZ ARG A 32 -8.887 -5.596 -11.336 1.00 23.43 C ATOM 531 NH1 ARG A 32 -8.969 -4.856 -12.437 1.00 53.13 N ATOM 532 NH2 ARG A 32 -9.681 -6.650 -11.194 1.00 13.11 N ATOM 0 H ARG A 32 -4.793 -0.060 -8.851 1.00 55.22 H new ATOM 0 HA ARG A 32 -7.419 -0.897 -7.809 1.00 72.21 H new ATOM 0 HB2 ARG A 32 -6.612 -1.501 -10.137 1.00 71.15 H new ATOM 0 HB3 ARG A 32 -5.291 -2.387 -9.401 1.00 71.15 H new ATOM 0 HG2 ARG A 32 -6.910 -3.894 -8.289 1.00 52.11 H new ATOM 0 HG3 ARG A 32 -8.240 -2.997 -8.993 1.00 52.11 H new ATOM 0 HD2 ARG A 32 -7.337 -3.526 -11.282 1.00 35.15 H new ATOM 0 HD3 ARG A 32 -6.081 -4.494 -10.536 1.00 35.15 H new ATOM 0 HE ARG A 32 -7.974 -5.900 -9.559 1.00 74.34 H new ATOM 0 HH11 ARG A 32 -8.360 -4.046 -12.554 1.00 53.13 H new ATOM 0 HH12 ARG A 32 -9.641 -5.098 -13.165 1.00 53.13 H new ATOM 0 HH21 ARG A 32 -9.622 -7.224 -10.353 1.00 13.11 H new ATOM 0 HH22 ARG A 32 -10.351 -6.886 -11.926 1.00 13.11 H new ATOM 546 N ASP A 33 -6.604 -1.969 -5.768 1.00 43.43 N ATOM 547 CA ASP A 33 -6.210 -2.676 -4.539 1.00 3.24 C ATOM 548 C ASP A 33 -4.993 -2.032 -3.875 1.00 22.01 C ATOM 549 O ASP A 33 -4.381 -2.627 -2.985 1.00 52.40 O ATOM 550 CB ASP A 33 -5.912 -4.153 -4.826 1.00 30.11 C ATOM 551 CG ASP A 33 -7.116 -4.903 -5.352 1.00 12.53 C ATOM 552 OD1 ASP A 33 -8.021 -5.224 -4.553 1.00 70.50 O ATOM 553 OD2 ASP A 33 -7.161 -5.183 -6.565 1.00 73.51 O ATOM 0 H ASP A 33 -7.552 -1.593 -5.743 1.00 43.43 H new ATOM 0 HA ASP A 33 -7.054 -2.605 -3.853 1.00 3.24 H new ATOM 0 HB2 ASP A 33 -5.102 -4.221 -5.552 1.00 30.11 H new ATOM 0 HB3 ASP A 33 -5.562 -4.633 -3.912 1.00 30.11 H new ATOM 558 N GLU A 34 -4.651 -0.824 -4.322 1.00 34.54 N ATOM 559 CA GLU A 34 -3.531 -0.057 -3.773 1.00 11.35 C ATOM 560 C GLU A 34 -2.193 -0.733 -4.078 1.00 20.00 C ATOM 561 O GLU A 34 -1.192 -0.484 -3.403 1.00 10.12 O ATOM 562 CB GLU A 34 -3.687 0.136 -2.258 1.00 53.40 C ATOM 563 CG GLU A 34 -4.977 0.835 -1.851 1.00 13.43 C ATOM 564 CD GLU A 34 -5.022 1.160 -0.372 1.00 12.24 C ATOM 565 OE1 GLU A 34 -4.580 0.319 0.442 1.00 23.14 O ATOM 566 OE2 GLU A 34 -5.485 2.263 -0.014 1.00 40.33 O ATOM 0 H GLU A 34 -5.144 -0.348 -5.077 1.00 34.54 H new ATOM 0 HA GLU A 34 -3.540 0.921 -4.253 1.00 11.35 H new ATOM 0 HB2 GLU A 34 -3.645 -0.839 -1.772 1.00 53.40 H new ATOM 0 HB3 GLU A 34 -2.840 0.714 -1.887 1.00 53.40 H new ATOM 0 HG2 GLU A 34 -5.084 1.756 -2.425 1.00 13.43 H new ATOM 0 HG3 GLU A 34 -5.826 0.200 -2.106 1.00 13.43 H new ATOM 573 N LYS A 35 -2.177 -1.582 -5.101 1.00 3.23 N ATOM 574 CA LYS A 35 -0.954 -2.277 -5.492 1.00 12.33 C ATOM 575 C LYS A 35 -0.983 -2.675 -6.966 1.00 3.24 C ATOM 576 O LYS A 35 -0.043 -3.287 -7.475 1.00 22.40 O ATOM 577 CB LYS A 35 -0.745 -3.514 -4.612 1.00 33.13 C ATOM 578 CG LYS A 35 -1.928 -4.470 -4.597 1.00 23.24 C ATOM 579 CD LYS A 35 -1.699 -5.611 -3.625 1.00 23.01 C ATOM 580 CE LYS A 35 -0.533 -6.481 -4.058 1.00 74.12 C ATOM 581 NZ LYS A 35 -0.167 -7.477 -3.020 1.00 1.13 N ATOM 0 H LYS A 35 -2.992 -1.805 -5.672 1.00 3.23 H new ATOM 0 HA LYS A 35 -0.119 -1.591 -5.349 1.00 12.33 H new ATOM 0 HB2 LYS A 35 0.138 -4.050 -4.961 1.00 33.13 H new ATOM 0 HB3 LYS A 35 -0.539 -3.191 -3.592 1.00 33.13 H new ATOM 0 HG2 LYS A 35 -2.833 -3.929 -4.320 1.00 23.24 H new ATOM 0 HG3 LYS A 35 -2.089 -4.869 -5.599 1.00 23.24 H new ATOM 0 HD2 LYS A 35 -1.506 -5.210 -2.630 1.00 23.01 H new ATOM 0 HD3 LYS A 35 -2.602 -6.218 -3.555 1.00 23.01 H new ATOM 0 HE2 LYS A 35 -0.790 -6.998 -4.982 1.00 74.12 H new ATOM 0 HE3 LYS A 35 0.329 -5.850 -4.275 1.00 74.12 H new ATOM 0 HZ1 LYS A 35 0.633 -8.050 -3.356 1.00 1.13 H new ATOM 0 HZ2 LYS A 35 0.104 -6.984 -2.145 1.00 1.13 H new ATOM 0 HZ3 LYS A 35 -0.981 -8.096 -2.831 1.00 1.13 H new ATOM 595 N GLN A 36 -2.064 -2.326 -7.644 1.00 30.11 N ATOM 596 CA GLN A 36 -2.229 -2.643 -9.054 1.00 50.22 C ATOM 597 C GLN A 36 -2.736 -1.418 -9.807 1.00 10.44 C ATOM 598 O GLN A 36 -3.249 -0.480 -9.203 1.00 44.42 O ATOM 599 CB GLN A 36 -3.205 -3.806 -9.253 1.00 74.01 C ATOM 600 CG GLN A 36 -3.010 -4.957 -8.284 1.00 53.22 C ATOM 601 CD GLN A 36 -3.811 -6.182 -8.675 1.00 3.42 C ATOM 602 OE1 GLN A 36 -3.336 -7.035 -9.427 1.00 2.13 O ATOM 603 NE2 GLN A 36 -5.029 -6.283 -8.166 1.00 43.13 N ATOM 0 H GLN A 36 -2.848 -1.818 -7.236 1.00 30.11 H new ATOM 0 HA GLN A 36 -1.256 -2.940 -9.446 1.00 50.22 H new ATOM 0 HB2 GLN A 36 -4.224 -3.431 -9.154 1.00 74.01 H new ATOM 0 HB3 GLN A 36 -3.102 -4.182 -10.271 1.00 74.01 H new ATOM 0 HG2 GLN A 36 -1.952 -5.216 -8.240 1.00 53.22 H new ATOM 0 HG3 GLN A 36 -3.302 -4.639 -7.283 1.00 53.22 H new ATOM 0 HE21 GLN A 36 -5.385 -5.555 -7.547 1.00 43.13 H new ATOM 0 HE22 GLN A 36 -5.611 -7.089 -8.393 1.00 43.13 H new ATOM 612 N ILE A 37 -2.558 -1.415 -11.115 1.00 3.30 N ATOM 613 CA ILE A 37 -3.061 -0.345 -11.962 1.00 13.21 C ATOM 614 C ILE A 37 -4.300 -0.823 -12.695 1.00 24.24 C ATOM 615 O ILE A 37 -4.287 -1.896 -13.294 1.00 20.35 O ATOM 616 CB ILE A 37 -2.013 0.086 -13.000 1.00 73.12 C ATOM 617 CG1 ILE A 37 -0.644 0.211 -12.333 1.00 25.05 C ATOM 618 CG2 ILE A 37 -2.421 1.397 -13.658 1.00 15.43 C ATOM 619 CD1 ILE A 37 0.434 0.784 -13.221 1.00 10.42 C ATOM 0 H ILE A 37 -2.063 -2.150 -11.620 1.00 3.30 H new ATOM 0 HA ILE A 37 -3.295 0.508 -11.324 1.00 13.21 H new ATOM 0 HB ILE A 37 -1.951 -0.673 -13.779 1.00 73.12 H new ATOM 0 HG12 ILE A 37 -0.741 0.840 -11.448 1.00 25.05 H new ATOM 0 HG13 ILE A 37 -0.329 -0.775 -11.990 1.00 25.05 H new ATOM 0 HG21 ILE A 37 -1.667 1.687 -14.390 1.00 15.43 H new ATOM 0 HG22 ILE A 37 -3.382 1.270 -14.157 1.00 15.43 H new ATOM 0 HG23 ILE A 37 -2.507 2.174 -12.898 1.00 15.43 H new ATOM 0 HD11 ILE A 37 1.371 0.837 -12.667 1.00 10.42 H new ATOM 0 HD12 ILE A 37 0.564 0.145 -14.094 1.00 10.42 H new ATOM 0 HD13 ILE A 37 0.146 1.785 -13.544 1.00 10.42 H new ATOM 631 N ASP A 38 -5.363 -0.044 -12.653 1.00 31.53 N ATOM 632 CA ASP A 38 -6.620 -0.460 -13.250 1.00 10.15 C ATOM 633 C ASP A 38 -7.203 0.648 -14.118 1.00 13.31 C ATOM 634 O ASP A 38 -6.778 1.796 -14.041 1.00 1.11 O ATOM 635 CB ASP A 38 -7.606 -0.844 -12.146 1.00 53.00 C ATOM 636 CG ASP A 38 -8.854 -1.514 -12.681 1.00 72.14 C ATOM 637 OD1 ASP A 38 -8.762 -2.204 -13.717 1.00 72.32 O ATOM 638 OD2 ASP A 38 -9.920 -1.379 -12.055 1.00 34.01 O ATOM 0 H ASP A 38 -5.383 0.877 -12.214 1.00 31.53 H new ATOM 0 HA ASP A 38 -6.436 -1.324 -13.888 1.00 10.15 H new ATOM 0 HB2 ASP A 38 -7.113 -1.514 -11.442 1.00 53.00 H new ATOM 0 HB3 ASP A 38 -7.889 0.050 -11.591 1.00 53.00 H new ATOM 643 N VAL A 39 -8.164 0.295 -14.954 1.00 22.14 N ATOM 644 CA VAL A 39 -8.868 1.268 -15.773 1.00 63.23 C ATOM 645 C VAL A 39 -10.334 1.295 -15.377 1.00 41.42 C ATOM 646 O VAL A 39 -11.072 0.337 -15.621 1.00 62.53 O ATOM 647 CB VAL A 39 -8.753 0.952 -17.277 1.00 74.10 C ATOM 648 CG1 VAL A 39 -9.599 1.912 -18.101 1.00 64.14 C ATOM 649 CG2 VAL A 39 -7.303 1.003 -17.724 1.00 54.32 C ATOM 0 H VAL A 39 -8.477 -0.667 -15.084 1.00 22.14 H new ATOM 0 HA VAL A 39 -8.407 2.240 -15.601 1.00 63.23 H new ATOM 0 HB VAL A 39 -9.130 -0.058 -17.440 1.00 74.10 H new ATOM 0 HG11 VAL A 39 -9.500 1.668 -19.159 1.00 64.14 H new ATOM 0 HG12 VAL A 39 -10.644 1.823 -17.804 1.00 64.14 H new ATOM 0 HG13 VAL A 39 -9.259 2.934 -17.931 1.00 64.14 H new ATOM 0 HG21 VAL A 39 -7.242 0.777 -18.789 1.00 54.32 H new ATOM 0 HG22 VAL A 39 -6.901 1.999 -17.541 1.00 54.32 H new ATOM 0 HG23 VAL A 39 -6.724 0.269 -17.164 1.00 54.32 H new ATOM 659 N GLU A 40 -10.754 2.383 -14.758 1.00 74.11 N ATOM 660 CA GLU A 40 -12.100 2.455 -14.222 1.00 14.33 C ATOM 661 C GLU A 40 -12.902 3.588 -14.851 1.00 31.21 C ATOM 662 O GLU A 40 -14.052 3.825 -14.475 1.00 33.32 O ATOM 663 CB GLU A 40 -12.051 2.608 -12.705 1.00 64.01 C ATOM 664 CG GLU A 40 -11.357 1.445 -12.013 1.00 20.44 C ATOM 665 CD GLU A 40 -11.605 1.425 -10.519 1.00 52.00 C ATOM 666 OE1 GLU A 40 -12.785 1.371 -10.111 1.00 74.24 O ATOM 667 OE2 GLU A 40 -10.634 1.472 -9.741 1.00 44.33 O ATOM 0 H GLU A 40 -10.189 3.220 -14.615 1.00 74.11 H new ATOM 0 HA GLU A 40 -12.609 1.524 -14.471 1.00 14.33 H new ATOM 0 HB2 GLU A 40 -11.533 3.534 -12.455 1.00 64.01 H new ATOM 0 HB3 GLU A 40 -13.067 2.698 -12.321 1.00 64.01 H new ATOM 0 HG2 GLU A 40 -11.705 0.508 -12.448 1.00 20.44 H new ATOM 0 HG3 GLU A 40 -10.285 1.504 -12.199 1.00 20.44 H new ATOM 674 N THR A 41 -12.299 4.291 -15.801 1.00 21.12 N ATOM 675 CA THR A 41 -12.988 5.359 -16.511 1.00 10.43 C ATOM 676 C THR A 41 -12.399 5.543 -17.908 1.00 30.34 C ATOM 677 O THR A 41 -11.193 5.697 -18.066 1.00 74.42 O ATOM 678 CB THR A 41 -12.904 6.695 -15.739 1.00 52.52 C ATOM 679 OG1 THR A 41 -13.342 6.511 -14.386 1.00 14.22 O ATOM 680 CG2 THR A 41 -13.762 7.763 -16.403 1.00 33.10 C ATOM 0 H THR A 41 -11.335 4.140 -16.097 1.00 21.12 H new ATOM 0 HA THR A 41 -14.036 5.071 -16.594 1.00 10.43 H new ATOM 0 HB THR A 41 -11.865 7.023 -15.748 1.00 52.52 H new ATOM 0 HG1 THR A 41 -13.284 7.363 -13.905 1.00 14.22 H new ATOM 0 HG21 THR A 41 -13.685 8.693 -15.840 1.00 33.10 H new ATOM 0 HG22 THR A 41 -13.415 7.926 -17.423 1.00 33.10 H new ATOM 0 HG23 THR A 41 -14.801 7.435 -16.422 1.00 33.10 H new ATOM 688 N VAL A 42 -13.250 5.500 -18.918 1.00 33.11 N ATOM 689 CA VAL A 42 -12.829 5.735 -20.292 1.00 41.33 C ATOM 690 C VAL A 42 -13.813 6.672 -20.981 1.00 60.32 C ATOM 691 O VAL A 42 -15.021 6.595 -20.746 1.00 24.14 O ATOM 692 CB VAL A 42 -12.718 4.422 -21.106 1.00 23.44 C ATOM 693 CG1 VAL A 42 -11.565 3.568 -20.599 1.00 25.30 C ATOM 694 CG2 VAL A 42 -14.029 3.644 -21.073 1.00 75.11 C ATOM 0 H VAL A 42 -14.245 5.303 -18.813 1.00 33.11 H new ATOM 0 HA VAL A 42 -11.838 6.187 -20.253 1.00 41.33 H new ATOM 0 HB VAL A 42 -12.513 4.686 -22.144 1.00 23.44 H new ATOM 0 HG11 VAL A 42 -11.506 2.651 -21.185 1.00 25.30 H new ATOM 0 HG12 VAL A 42 -10.631 4.122 -20.697 1.00 25.30 H new ATOM 0 HG13 VAL A 42 -11.730 3.318 -19.551 1.00 25.30 H new ATOM 0 HG21 VAL A 42 -13.923 2.727 -21.652 1.00 75.11 H new ATOM 0 HG22 VAL A 42 -14.278 3.395 -20.042 1.00 75.11 H new ATOM 0 HG23 VAL A 42 -14.825 4.253 -21.501 1.00 75.11 H new ATOM 704 N ALA A 43 -13.298 7.570 -21.808 1.00 11.44 N ATOM 705 CA ALA A 43 -14.146 8.500 -22.538 1.00 32.45 C ATOM 706 C ALA A 43 -13.475 8.949 -23.830 1.00 13.13 C ATOM 707 O ALA A 43 -12.251 8.903 -23.961 1.00 64.52 O ATOM 708 CB ALA A 43 -14.496 9.700 -21.669 1.00 13.10 C ATOM 0 H ALA A 43 -12.300 7.674 -21.990 1.00 11.44 H new ATOM 0 HA ALA A 43 -15.070 7.983 -22.799 1.00 32.45 H new ATOM 0 HB1 ALA A 43 -15.131 10.384 -22.232 1.00 13.10 H new ATOM 0 HB2 ALA A 43 -15.027 9.362 -20.779 1.00 13.10 H new ATOM 0 HB3 ALA A 43 -13.581 10.214 -21.373 1.00 13.10 H new ATOM 714 N ASP A 44 -14.287 9.374 -24.784 1.00 53.23 N ATOM 715 CA ASP A 44 -13.785 9.823 -26.070 1.00 15.43 C ATOM 716 C ASP A 44 -14.161 11.295 -26.286 1.00 31.12 C ATOM 717 O ASP A 44 -14.506 11.991 -25.330 1.00 41.30 O ATOM 718 CB ASP A 44 -14.333 8.915 -27.181 1.00 33.14 C ATOM 719 CG ASP A 44 -13.681 9.164 -28.526 1.00 52.45 C ATOM 720 OD1 ASP A 44 -12.457 8.964 -28.655 1.00 21.51 O ATOM 721 OD2 ASP A 44 -14.388 9.606 -29.448 1.00 65.12 O ATOM 0 H ASP A 44 -15.302 9.417 -24.690 1.00 53.23 H new ATOM 0 HA ASP A 44 -12.697 9.756 -26.095 1.00 15.43 H new ATOM 0 HB2 ASP A 44 -14.183 7.873 -26.898 1.00 33.14 H new ATOM 0 HB3 ASP A 44 -15.408 9.069 -27.271 1.00 33.14 H new ATOM 726 N ARG A 45 -14.122 11.757 -27.534 1.00 30.10 N ATOM 727 CA ARG A 45 -14.265 13.178 -27.855 1.00 44.12 C ATOM 728 C ARG A 45 -15.705 13.660 -27.694 1.00 53.44 C ATOM 729 O ARG A 45 -16.007 14.824 -27.949 1.00 31.14 O ATOM 730 CB ARG A 45 -13.779 13.437 -29.287 1.00 43.11 C ATOM 731 CG ARG A 45 -14.650 12.802 -30.366 1.00 14.45 C ATOM 732 CD ARG A 45 -13.808 12.268 -31.514 1.00 60.11 C ATOM 733 NE ARG A 45 -12.996 11.131 -31.084 1.00 52.00 N ATOM 734 CZ ARG A 45 -11.802 10.817 -31.578 1.00 4.21 C ATOM 735 NH1 ARG A 45 -11.303 11.481 -32.618 1.00 71.33 N ATOM 736 NH2 ARG A 45 -11.128 9.809 -31.041 1.00 54.23 N ATOM 0 H ARG A 45 -13.991 11.160 -28.350 1.00 30.10 H new ATOM 0 HA ARG A 45 -13.653 13.741 -27.150 1.00 44.12 H new ATOM 0 HB2 ARG A 45 -13.737 14.513 -29.456 1.00 43.11 H new ATOM 0 HB3 ARG A 45 -12.762 13.059 -29.388 1.00 43.11 H new ATOM 0 HG2 ARG A 45 -15.235 11.990 -29.933 1.00 14.45 H new ATOM 0 HG3 ARG A 45 -15.359 13.539 -30.744 1.00 14.45 H new ATOM 0 HD2 ARG A 45 -14.457 11.966 -32.336 1.00 60.11 H new ATOM 0 HD3 ARG A 45 -13.161 13.059 -31.893 1.00 60.11 H new ATOM 0 HE ARG A 45 -13.374 10.533 -30.349 1.00 52.00 H new ATOM 0 HH11 ARG A 45 -11.837 12.238 -33.043 1.00 71.33 H new ATOM 0 HH12 ARG A 45 -10.386 11.232 -32.989 1.00 71.33 H new ATOM 0 HH21 ARG A 45 -11.527 9.287 -30.261 1.00 54.23 H new ATOM 0 HH22 ARG A 45 -10.211 9.556 -31.408 1.00 54.23 H new ATOM 750 N ASN A 46 -16.586 12.763 -27.271 1.00 64.52 N ATOM 751 CA ASN A 46 -17.976 13.116 -27.023 1.00 54.30 C ATOM 752 C ASN A 46 -18.078 13.951 -25.749 1.00 53.34 C ATOM 753 O ASN A 46 -19.031 14.703 -25.557 1.00 73.31 O ATOM 754 CB ASN A 46 -18.835 11.853 -26.904 1.00 23.33 C ATOM 755 CG ASN A 46 -20.316 12.161 -26.775 1.00 41.21 C ATOM 756 OD1 ASN A 46 -21.016 12.323 -27.775 1.00 30.33 O ATOM 757 ND2 ASN A 46 -20.810 12.228 -25.548 1.00 22.34 N ATOM 0 H ASN A 46 -16.361 11.784 -27.092 1.00 64.52 H new ATOM 0 HA ASN A 46 -18.347 13.704 -27.862 1.00 54.30 H new ATOM 0 HB2 ASN A 46 -18.674 11.225 -27.780 1.00 23.33 H new ATOM 0 HB3 ASN A 46 -18.511 11.279 -26.036 1.00 23.33 H new ATOM 0 HD21 ASN A 46 -21.802 12.419 -25.407 1.00 22.34 H new ATOM 0 HD22 ASN A 46 -20.199 12.088 -24.744 1.00 22.34 H new ATOM 764 N ALA A 47 -17.077 13.816 -24.889 1.00 55.01 N ATOM 765 CA ALA A 47 -17.029 14.564 -23.644 1.00 64.53 C ATOM 766 C ALA A 47 -15.865 15.548 -23.660 1.00 14.42 C ATOM 767 O ALA A 47 -14.786 15.240 -24.172 1.00 41.51 O ATOM 768 CB ALA A 47 -16.919 13.616 -22.458 1.00 71.22 C ATOM 0 H ALA A 47 -16.284 13.191 -25.034 1.00 55.01 H new ATOM 0 HA ALA A 47 -17.954 15.131 -23.542 1.00 64.53 H new ATOM 0 HB1 ALA A 47 -16.884 14.192 -21.534 1.00 71.22 H new ATOM 0 HB2 ALA A 47 -17.784 12.954 -22.440 1.00 71.22 H new ATOM 0 HB3 ALA A 47 -16.010 13.022 -22.550 1.00 71.22 H new ATOM 774 N GLU A 48 -16.092 16.731 -23.107 1.00 71.14 N ATOM 775 CA GLU A 48 -15.077 17.777 -23.093 1.00 30.24 C ATOM 776 C GLU A 48 -14.334 17.800 -21.757 1.00 43.24 C ATOM 777 O GLU A 48 -14.690 17.069 -20.830 1.00 4.31 O ATOM 778 CB GLU A 48 -15.720 19.134 -23.392 1.00 62.21 C ATOM 779 CG GLU A 48 -16.825 19.525 -22.427 1.00 1.02 C ATOM 780 CD GLU A 48 -17.689 20.644 -22.968 1.00 73.24 C ATOM 781 OE1 GLU A 48 -17.133 21.638 -23.482 1.00 33.04 O ATOM 782 OE2 GLU A 48 -18.929 20.530 -22.897 1.00 72.22 O ATOM 0 H GLU A 48 -16.972 16.992 -22.661 1.00 71.14 H new ATOM 0 HA GLU A 48 -14.344 17.563 -23.871 1.00 30.24 H new ATOM 0 HB2 GLU A 48 -14.947 19.902 -23.372 1.00 62.21 H new ATOM 0 HB3 GLU A 48 -16.126 19.116 -24.404 1.00 62.21 H new ATOM 0 HG2 GLU A 48 -17.448 18.655 -22.220 1.00 1.02 H new ATOM 0 HG3 GLU A 48 -16.384 19.835 -21.479 1.00 1.02 H new ATOM 789 N TYR A 49 -13.321 18.663 -21.651 1.00 32.53 N ATOM 790 CA TYR A 49 -12.432 18.667 -20.494 1.00 55.51 C ATOM 791 C TYR A 49 -13.180 19.070 -19.232 1.00 44.44 C ATOM 792 O TYR A 49 -12.846 18.630 -18.136 1.00 25.42 O ATOM 793 CB TYR A 49 -11.256 19.616 -20.732 1.00 12.43 C ATOM 794 CG TYR A 49 -10.463 19.303 -21.982 1.00 62.50 C ATOM 795 CD1 TYR A 49 -9.451 18.352 -21.964 1.00 62.11 C ATOM 796 CD2 TYR A 49 -10.724 19.962 -23.177 1.00 53.35 C ATOM 797 CE1 TYR A 49 -8.723 18.066 -23.103 1.00 55.12 C ATOM 798 CE2 TYR A 49 -10.000 19.680 -24.320 1.00 25.33 C ATOM 799 CZ TYR A 49 -9.001 18.731 -24.277 1.00 13.21 C ATOM 800 OH TYR A 49 -8.277 18.447 -25.412 1.00 22.41 O ATOM 0 H TYR A 49 -13.098 19.367 -22.354 1.00 32.53 H new ATOM 0 HA TYR A 49 -12.051 17.655 -20.358 1.00 55.51 H new ATOM 0 HB2 TYR A 49 -11.632 20.637 -20.798 1.00 12.43 H new ATOM 0 HB3 TYR A 49 -10.589 19.577 -19.871 1.00 12.43 H new ATOM 0 HD1 TYR A 49 -9.230 17.828 -21.046 1.00 62.11 H new ATOM 0 HD2 TYR A 49 -11.505 20.707 -23.213 1.00 53.35 H new ATOM 0 HE1 TYR A 49 -7.939 17.324 -23.073 1.00 55.12 H new ATOM 0 HE2 TYR A 49 -10.216 20.200 -25.242 1.00 25.33 H new ATOM 0 HH TYR A 49 -8.599 19.002 -26.153 1.00 22.41 H new ATOM 810 N ASP A 50 -14.193 19.906 -19.401 1.00 11.42 N ATOM 811 CA ASP A 50 -15.031 20.339 -18.291 1.00 22.31 C ATOM 812 C ASP A 50 -15.791 19.158 -17.700 1.00 35.44 C ATOM 813 O ASP A 50 -15.813 18.961 -16.484 1.00 71.40 O ATOM 814 CB ASP A 50 -16.016 21.405 -18.769 1.00 1.42 C ATOM 815 CG ASP A 50 -15.324 22.676 -19.216 1.00 65.41 C ATOM 816 OD1 ASP A 50 -14.596 22.641 -20.235 1.00 31.32 O ATOM 817 OD2 ASP A 50 -15.497 23.715 -18.547 1.00 71.12 O ATOM 0 H ASP A 50 -14.457 20.301 -20.304 1.00 11.42 H new ATOM 0 HA ASP A 50 -14.391 20.761 -17.517 1.00 22.31 H new ATOM 0 HB2 ASP A 50 -16.605 21.006 -19.595 1.00 1.42 H new ATOM 0 HB3 ASP A 50 -16.713 21.638 -17.964 1.00 1.42 H new ATOM 822 N GLN A 51 -16.397 18.365 -18.576 1.00 11.44 N ATOM 823 CA GLN A 51 -17.130 17.177 -18.160 1.00 52.13 C ATOM 824 C GLN A 51 -16.175 16.149 -17.561 1.00 22.32 C ATOM 825 O GLN A 51 -16.518 15.446 -16.613 1.00 53.12 O ATOM 826 CB GLN A 51 -17.876 16.573 -19.350 1.00 15.33 C ATOM 827 CG GLN A 51 -18.976 17.466 -19.905 1.00 63.35 C ATOM 828 CD GLN A 51 -19.561 16.921 -21.192 1.00 41.12 C ATOM 829 OE1 GLN A 51 -18.868 16.274 -21.970 1.00 11.45 O ATOM 830 NE2 GLN A 51 -20.836 17.178 -21.423 1.00 5.13 N ATOM 0 H GLN A 51 -16.394 18.525 -19.583 1.00 11.44 H new ATOM 0 HA GLN A 51 -17.856 17.464 -17.400 1.00 52.13 H new ATOM 0 HB2 GLN A 51 -17.161 16.358 -20.144 1.00 15.33 H new ATOM 0 HB3 GLN A 51 -18.312 15.621 -19.048 1.00 15.33 H new ATOM 0 HG2 GLN A 51 -19.768 17.568 -19.163 1.00 63.35 H new ATOM 0 HG3 GLN A 51 -18.576 18.464 -20.084 1.00 63.35 H new ATOM 0 HE21 GLN A 51 -21.377 17.720 -20.750 1.00 5.13 H new ATOM 0 HE22 GLN A 51 -21.279 16.834 -22.275 1.00 5.13 H new ATOM 839 N PHE A 52 -14.977 16.072 -18.132 1.00 71.15 N ATOM 840 CA PHE A 52 -13.918 15.215 -17.609 1.00 13.50 C ATOM 841 C PHE A 52 -13.545 15.633 -16.189 1.00 45.05 C ATOM 842 O PHE A 52 -13.512 14.809 -15.274 1.00 2.41 O ATOM 843 CB PHE A 52 -12.691 15.286 -18.530 1.00 50.22 C ATOM 844 CG PHE A 52 -11.434 14.710 -17.934 1.00 33.32 C ATOM 845 CD1 PHE A 52 -11.271 13.342 -17.807 1.00 32.04 C ATOM 846 CD2 PHE A 52 -10.414 15.546 -17.503 1.00 21.20 C ATOM 847 CE1 PHE A 52 -10.115 12.817 -17.261 1.00 51.55 C ATOM 848 CE2 PHE A 52 -9.257 15.027 -16.957 1.00 14.24 C ATOM 849 CZ PHE A 52 -9.107 13.660 -16.836 1.00 15.44 C ATOM 0 H PHE A 52 -14.714 16.598 -18.965 1.00 71.15 H new ATOM 0 HA PHE A 52 -14.278 14.187 -17.577 1.00 13.50 H new ATOM 0 HB2 PHE A 52 -12.915 14.757 -19.456 1.00 50.22 H new ATOM 0 HB3 PHE A 52 -12.509 16.328 -18.794 1.00 50.22 H new ATOM 0 HD1 PHE A 52 -12.055 12.677 -18.138 1.00 32.04 H new ATOM 0 HD2 PHE A 52 -10.527 16.616 -17.596 1.00 21.20 H new ATOM 0 HE1 PHE A 52 -10.000 11.747 -17.167 1.00 51.55 H new ATOM 0 HE2 PHE A 52 -8.471 15.689 -16.625 1.00 14.24 H new ATOM 0 HZ PHE A 52 -8.203 13.251 -16.410 1.00 15.44 H new ATOM 859 N LEU A 53 -13.279 16.923 -16.023 1.00 61.45 N ATOM 860 CA LEU A 53 -12.912 17.490 -14.731 1.00 43.12 C ATOM 861 C LEU A 53 -13.949 17.158 -13.665 1.00 70.40 C ATOM 862 O LEU A 53 -13.632 16.544 -12.646 1.00 52.20 O ATOM 863 CB LEU A 53 -12.768 19.013 -14.855 1.00 23.05 C ATOM 864 CG LEU A 53 -11.343 19.558 -14.719 1.00 42.31 C ATOM 865 CD1 LEU A 53 -10.818 19.319 -13.316 1.00 53.51 C ATOM 866 CD2 LEU A 53 -10.418 18.924 -15.750 1.00 10.10 C ATOM 0 H LEU A 53 -13.312 17.606 -16.780 1.00 61.45 H new ATOM 0 HA LEU A 53 -11.961 17.053 -14.428 1.00 43.12 H new ATOM 0 HB2 LEU A 53 -13.164 19.319 -15.823 1.00 23.05 H new ATOM 0 HB3 LEU A 53 -13.391 19.482 -14.093 1.00 23.05 H new ATOM 0 HG LEU A 53 -11.370 20.632 -14.903 1.00 42.31 H new ATOM 0 HD11 LEU A 53 -9.804 19.712 -13.235 1.00 53.51 H new ATOM 0 HD12 LEU A 53 -11.462 19.824 -12.596 1.00 53.51 H new ATOM 0 HD13 LEU A 53 -10.810 18.249 -13.108 1.00 53.51 H new ATOM 0 HD21 LEU A 53 -9.412 19.327 -15.633 1.00 10.10 H new ATOM 0 HD22 LEU A 53 -10.395 17.844 -15.603 1.00 10.10 H new ATOM 0 HD23 LEU A 53 -10.784 19.146 -16.752 1.00 10.10 H new ATOM 878 N GLU A 54 -15.191 17.546 -13.930 1.00 65.45 N ATOM 879 CA GLU A 54 -16.273 17.399 -12.965 1.00 42.44 C ATOM 880 C GLU A 54 -16.521 15.932 -12.609 1.00 25.00 C ATOM 881 O GLU A 54 -16.777 15.605 -11.452 1.00 54.14 O ATOM 882 CB GLU A 54 -17.555 18.027 -13.522 1.00 42.55 C ATOM 883 CG GLU A 54 -18.688 18.118 -12.510 1.00 20.32 C ATOM 884 CD GLU A 54 -18.360 19.030 -11.343 1.00 23.11 C ATOM 885 OE1 GLU A 54 -18.618 20.245 -11.441 1.00 65.25 O ATOM 886 OE2 GLU A 54 -17.848 18.534 -10.317 1.00 41.11 O ATOM 0 H GLU A 54 -15.475 17.969 -14.814 1.00 65.45 H new ATOM 0 HA GLU A 54 -15.978 17.915 -12.052 1.00 42.44 H new ATOM 0 HB2 GLU A 54 -17.328 19.028 -13.889 1.00 42.55 H new ATOM 0 HB3 GLU A 54 -17.892 17.442 -14.378 1.00 42.55 H new ATOM 0 HG2 GLU A 54 -19.586 18.482 -13.009 1.00 20.32 H new ATOM 0 HG3 GLU A 54 -18.914 17.120 -12.134 1.00 20.32 H new ATOM 893 N ASP A 55 -16.424 15.049 -13.595 1.00 44.11 N ATOM 894 CA ASP A 55 -16.772 13.645 -13.389 1.00 71.23 C ATOM 895 C ASP A 55 -15.750 12.942 -12.502 1.00 53.31 C ATOM 896 O ASP A 55 -16.114 12.173 -11.614 1.00 34.20 O ATOM 897 CB ASP A 55 -16.885 12.916 -14.727 1.00 71.11 C ATOM 898 CG ASP A 55 -17.675 11.625 -14.617 1.00 24.31 C ATOM 899 OD1 ASP A 55 -18.910 11.668 -14.796 1.00 72.24 O ATOM 900 OD2 ASP A 55 -17.068 10.561 -14.377 1.00 63.34 O ATOM 0 H ASP A 55 -16.110 15.275 -14.539 1.00 44.11 H new ATOM 0 HA ASP A 55 -17.738 13.619 -12.885 1.00 71.23 H new ATOM 0 HB2 ASP A 55 -17.364 13.571 -15.455 1.00 71.11 H new ATOM 0 HB3 ASP A 55 -15.886 12.697 -15.104 1.00 71.11 H new ATOM 905 N ILE A 56 -14.472 13.221 -12.727 1.00 13.52 N ATOM 906 CA ILE A 56 -13.410 12.565 -11.971 1.00 14.45 C ATOM 907 C ILE A 56 -13.443 12.980 -10.501 1.00 20.21 C ATOM 908 O ILE A 56 -13.362 12.135 -9.608 1.00 64.55 O ATOM 909 CB ILE A 56 -12.015 12.865 -12.568 1.00 22.21 C ATOM 910 CG1 ILE A 56 -11.936 12.364 -14.013 1.00 21.01 C ATOM 911 CG2 ILE A 56 -10.918 12.228 -11.723 1.00 3.33 C ATOM 912 CD1 ILE A 56 -12.241 10.889 -14.168 1.00 52.00 C ATOM 0 H ILE A 56 -14.146 13.893 -13.422 1.00 13.52 H new ATOM 0 HA ILE A 56 -13.589 11.492 -12.039 1.00 14.45 H new ATOM 0 HB ILE A 56 -11.865 13.945 -12.564 1.00 22.21 H new ATOM 0 HG12 ILE A 56 -12.634 12.936 -14.624 1.00 21.01 H new ATOM 0 HG13 ILE A 56 -10.937 12.561 -14.402 1.00 21.01 H new ATOM 0 HG21 ILE A 56 -9.945 12.452 -12.161 1.00 3.33 H new ATOM 0 HG22 ILE A 56 -10.960 12.628 -10.710 1.00 3.33 H new ATOM 0 HG23 ILE A 56 -11.063 11.148 -11.693 1.00 3.33 H new ATOM 0 HD11 ILE A 56 -12.165 10.610 -15.219 1.00 52.00 H new ATOM 0 HD12 ILE A 56 -11.527 10.307 -13.585 1.00 52.00 H new ATOM 0 HD13 ILE A 56 -13.251 10.687 -13.811 1.00 52.00 H new ATOM 924 N GLN A 57 -13.590 14.277 -10.251 1.00 62.43 N ATOM 925 CA GLN A 57 -13.646 14.786 -8.882 1.00 13.20 C ATOM 926 C GLN A 57 -14.950 14.373 -8.202 1.00 60.44 C ATOM 927 O GLN A 57 -15.054 14.373 -6.976 1.00 30.22 O ATOM 928 CB GLN A 57 -13.488 16.309 -8.870 1.00 42.12 C ATOM 929 CG GLN A 57 -14.492 17.041 -9.745 1.00 33.55 C ATOM 930 CD GLN A 57 -14.206 18.525 -9.855 1.00 61.23 C ATOM 931 OE1 GLN A 57 -13.061 18.962 -9.752 1.00 72.32 O ATOM 932 NE2 GLN A 57 -15.244 19.311 -10.082 1.00 70.44 N ATOM 0 H GLN A 57 -13.672 14.993 -10.973 1.00 62.43 H new ATOM 0 HA GLN A 57 -12.820 14.350 -8.321 1.00 13.20 H new ATOM 0 HB2 GLN A 57 -13.586 16.666 -7.845 1.00 42.12 H new ATOM 0 HB3 GLN A 57 -12.481 16.562 -9.201 1.00 42.12 H new ATOM 0 HG2 GLN A 57 -14.487 16.600 -10.742 1.00 33.55 H new ATOM 0 HG3 GLN A 57 -15.493 16.898 -9.338 1.00 33.55 H new ATOM 0 HE21 GLN A 57 -16.179 18.911 -10.161 1.00 70.44 H new ATOM 0 HE22 GLN A 57 -15.110 20.318 -10.178 1.00 70.44 H new ATOM 941 N LYS A 58 -15.942 14.027 -9.010 1.00 11.44 N ATOM 942 CA LYS A 58 -17.210 13.524 -8.520 1.00 14.31 C ATOM 943 C LYS A 58 -17.084 12.052 -8.129 1.00 61.32 C ATOM 944 O LYS A 58 -17.708 11.593 -7.170 1.00 23.41 O ATOM 945 CB LYS A 58 -18.251 13.722 -9.621 1.00 22.24 C ATOM 946 CG LYS A 58 -19.431 12.777 -9.581 1.00 34.43 C ATOM 947 CD LYS A 58 -20.193 12.852 -10.888 1.00 14.24 C ATOM 948 CE LYS A 58 -21.265 11.788 -10.985 1.00 62.24 C ATOM 949 NZ LYS A 58 -20.714 10.413 -10.855 1.00 72.41 N ATOM 0 H LYS A 58 -15.886 14.089 -10.027 1.00 11.44 H new ATOM 0 HA LYS A 58 -17.517 14.066 -7.626 1.00 14.31 H new ATOM 0 HB2 LYS A 58 -18.625 14.744 -9.563 1.00 22.24 H new ATOM 0 HB3 LYS A 58 -17.757 13.617 -10.587 1.00 22.24 H new ATOM 0 HG2 LYS A 58 -19.086 11.757 -9.408 1.00 34.43 H new ATOM 0 HG3 LYS A 58 -20.088 13.036 -8.751 1.00 34.43 H new ATOM 0 HD2 LYS A 58 -20.651 13.837 -10.984 1.00 14.24 H new ATOM 0 HD3 LYS A 58 -19.497 12.741 -11.720 1.00 14.24 H new ATOM 0 HE2 LYS A 58 -22.009 11.953 -10.205 1.00 62.24 H new ATOM 0 HE3 LYS A 58 -21.780 11.881 -11.941 1.00 62.24 H new ATOM 0 HZ1 LYS A 58 -21.396 9.728 -11.239 1.00 72.41 H new ATOM 0 HZ2 LYS A 58 -19.821 10.345 -11.384 1.00 72.41 H new ATOM 0 HZ3 LYS A 58 -20.539 10.202 -9.852 1.00 72.41 H new ATOM 963 N CYS A 59 -16.252 11.330 -8.868 1.00 0.10 N ATOM 964 CA CYS A 59 -16.023 9.915 -8.617 1.00 4.54 C ATOM 965 C CYS A 59 -15.255 9.723 -7.313 1.00 11.42 C ATOM 966 O CYS A 59 -15.483 8.756 -6.583 1.00 2.53 O ATOM 967 CB CYS A 59 -15.250 9.291 -9.784 1.00 15.01 C ATOM 968 SG CYS A 59 -15.010 7.502 -9.652 1.00 44.22 S ATOM 0 H CYS A 59 -15.720 11.706 -9.653 1.00 0.10 H new ATOM 0 HA CYS A 59 -16.988 9.416 -8.527 1.00 4.54 H new ATOM 0 HB2 CYS A 59 -15.780 9.506 -10.712 1.00 15.01 H new ATOM 0 HB3 CYS A 59 -14.274 9.772 -9.856 1.00 15.01 H new ATOM 0 HG CYS A 59 -14.349 7.075 -10.687 1.00 44.22 H new ATOM 974 N GLY A 60 -14.346 10.648 -7.028 1.00 0.04 N ATOM 975 CA GLY A 60 -13.579 10.578 -5.804 1.00 32.02 C ATOM 976 C GLY A 60 -12.678 11.783 -5.620 1.00 70.14 C ATOM 977 O GLY A 60 -12.010 12.206 -6.563 1.00 33.12 O ATOM 0 H GLY A 60 -14.128 11.446 -7.625 1.00 0.04 H new ATOM 0 HA2 GLY A 60 -14.259 10.503 -4.956 1.00 32.02 H new ATOM 0 HA3 GLY A 60 -12.973 9.672 -5.809 1.00 32.02 H new ATOM 981 N PRO A 61 -12.645 12.365 -4.415 1.00 11.54 N ATOM 982 CA PRO A 61 -11.813 13.530 -4.118 1.00 21.01 C ATOM 983 C PRO A 61 -10.321 13.196 -4.017 1.00 3.01 C ATOM 984 O PRO A 61 -9.529 13.594 -4.874 1.00 41.25 O ATOM 985 CB PRO A 61 -12.337 14.026 -2.761 1.00 63.53 C ATOM 986 CG PRO A 61 -13.586 13.248 -2.499 1.00 21.02 C ATOM 987 CD PRO A 61 -13.437 11.959 -3.250 1.00 51.22 C ATOM 0 HA PRO A 61 -11.881 14.270 -4.915 1.00 21.01 H new ATOM 0 HB2 PRO A 61 -11.601 13.862 -1.974 1.00 63.53 H new ATOM 0 HB3 PRO A 61 -12.541 15.096 -2.788 1.00 63.53 H new ATOM 0 HG2 PRO A 61 -13.715 13.065 -1.432 1.00 21.02 H new ATOM 0 HG3 PRO A 61 -14.465 13.797 -2.837 1.00 21.02 H new ATOM 0 HD2 PRO A 61 -12.928 11.199 -2.657 1.00 51.22 H new ATOM 0 HD3 PRO A 61 -14.402 11.543 -3.539 1.00 51.22 H new ATOM 995 N GLY A 62 -9.944 12.436 -2.992 1.00 35.13 N ATOM 996 CA GLY A 62 -8.537 12.266 -2.681 1.00 64.33 C ATOM 997 C GLY A 62 -8.044 10.835 -2.789 1.00 24.24 C ATOM 998 O GLY A 62 -7.808 10.179 -1.773 1.00 3.44 O ATOM 0 H GLY A 62 -10.585 11.938 -2.375 1.00 35.13 H new ATOM 0 HA2 GLY A 62 -7.950 12.892 -3.353 1.00 64.33 H new ATOM 0 HA3 GLY A 62 -8.354 12.626 -1.668 1.00 64.33 H new ATOM 1002 N GLU A 63 -7.891 10.358 -4.017 1.00 65.33 N ATOM 1003 CA GLU A 63 -7.285 9.057 -4.284 1.00 55.23 C ATOM 1004 C GLU A 63 -6.408 9.148 -5.526 1.00 20.01 C ATOM 1005 O GLU A 63 -6.291 10.218 -6.124 1.00 50.30 O ATOM 1006 CB GLU A 63 -8.349 7.968 -4.453 1.00 45.45 C ATOM 1007 CG GLU A 63 -8.991 7.541 -3.142 1.00 3.53 C ATOM 1008 CD GLU A 63 -10.082 6.512 -3.330 1.00 71.43 C ATOM 1009 OE1 GLU A 63 -9.766 5.308 -3.374 1.00 5.41 O ATOM 1010 OE2 GLU A 63 -11.265 6.905 -3.429 1.00 20.02 O ATOM 0 H GLU A 63 -8.182 10.860 -4.856 1.00 65.33 H new ATOM 0 HA GLU A 63 -6.670 8.780 -3.428 1.00 55.23 H new ATOM 0 HB2 GLU A 63 -9.125 8.330 -5.128 1.00 45.45 H new ATOM 0 HB3 GLU A 63 -7.895 7.098 -4.927 1.00 45.45 H new ATOM 0 HG2 GLU A 63 -8.224 7.134 -2.483 1.00 3.53 H new ATOM 0 HG3 GLU A 63 -9.407 8.417 -2.644 1.00 3.53 H new ATOM 1017 N CYS A 64 -5.791 8.040 -5.912 1.00 13.42 N ATOM 1018 CA CYS A 64 -4.856 8.053 -7.029 1.00 71.34 C ATOM 1019 C CYS A 64 -5.561 7.749 -8.347 1.00 42.44 C ATOM 1020 O CYS A 64 -6.305 6.774 -8.459 1.00 31.32 O ATOM 1021 CB CYS A 64 -3.748 7.027 -6.789 1.00 73.22 C ATOM 1022 SG CYS A 64 -2.985 7.141 -5.154 1.00 65.44 S ATOM 0 H CYS A 64 -5.919 7.128 -5.473 1.00 13.42 H new ATOM 0 HA CYS A 64 -4.425 9.052 -7.097 1.00 71.34 H new ATOM 0 HB2 CYS A 64 -4.159 6.026 -6.918 1.00 73.22 H new ATOM 0 HB3 CYS A 64 -2.977 7.155 -7.549 1.00 73.22 H new ATOM 0 HG CYS A 64 -3.327 6.108 -4.443 1.00 65.44 H new ATOM 1028 N ARG A 65 -5.316 8.593 -9.339 1.00 41.32 N ATOM 1029 CA ARG A 65 -5.831 8.395 -10.688 1.00 2.53 C ATOM 1030 C ARG A 65 -4.743 8.698 -11.703 1.00 72.12 C ATOM 1031 O ARG A 65 -3.771 9.383 -11.395 1.00 75.54 O ATOM 1032 CB ARG A 65 -7.040 9.298 -10.983 1.00 15.22 C ATOM 1033 CG ARG A 65 -8.369 8.799 -10.433 1.00 61.35 C ATOM 1034 CD ARG A 65 -8.483 9.010 -8.935 1.00 72.44 C ATOM 1035 NE ARG A 65 -8.387 10.418 -8.566 1.00 43.52 N ATOM 1036 CZ ARG A 65 -9.099 10.975 -7.590 1.00 75.52 C ATOM 1037 NH1 ARG A 65 -9.953 10.237 -6.887 1.00 63.21 N ATOM 1038 NH2 ARG A 65 -8.951 12.265 -7.313 1.00 73.23 N ATOM 0 H ARG A 65 -4.753 9.437 -9.232 1.00 41.32 H new ATOM 0 HA ARG A 65 -6.150 7.355 -10.762 1.00 2.53 H new ATOM 0 HB2 ARG A 65 -6.843 10.288 -10.572 1.00 15.22 H new ATOM 0 HB3 ARG A 65 -7.132 9.414 -12.063 1.00 15.22 H new ATOM 0 HG2 ARG A 65 -9.186 9.318 -10.935 1.00 61.35 H new ATOM 0 HG3 ARG A 65 -8.479 7.738 -10.658 1.00 61.35 H new ATOM 0 HD2 ARG A 65 -9.434 8.609 -8.585 1.00 72.44 H new ATOM 0 HD3 ARG A 65 -7.696 8.450 -8.430 1.00 72.44 H new ATOM 0 HE ARG A 65 -7.738 11.009 -9.085 1.00 43.52 H new ATOM 0 HH11 ARG A 65 -10.062 9.245 -7.096 1.00 63.21 H new ATOM 0 HH12 ARG A 65 -10.499 10.663 -6.138 1.00 63.21 H new ATOM 0 HH21 ARG A 65 -8.291 12.829 -7.849 1.00 73.23 H new ATOM 0 HH22 ARG A 65 -9.497 12.692 -6.565 1.00 73.23 H new ATOM 1052 N TYR A 66 -4.913 8.190 -12.908 1.00 21.50 N ATOM 1053 CA TYR A 66 -3.995 8.467 -14.000 1.00 14.31 C ATOM 1054 C TYR A 66 -4.788 8.730 -15.267 1.00 44.15 C ATOM 1055 O TYR A 66 -5.978 8.439 -15.323 1.00 15.41 O ATOM 1056 CB TYR A 66 -3.031 7.297 -14.220 1.00 75.11 C ATOM 1057 CG TYR A 66 -2.100 7.042 -13.058 1.00 41.51 C ATOM 1058 CD1 TYR A 66 -0.887 7.710 -12.963 1.00 14.43 C ATOM 1059 CD2 TYR A 66 -2.432 6.136 -12.059 1.00 70.13 C ATOM 1060 CE1 TYR A 66 -0.033 7.486 -11.903 1.00 11.54 C ATOM 1061 CE2 TYR A 66 -1.581 5.906 -10.996 1.00 11.42 C ATOM 1062 CZ TYR A 66 -0.384 6.584 -10.924 1.00 62.43 C ATOM 1063 OH TYR A 66 0.464 6.367 -9.866 1.00 13.55 O ATOM 0 H TYR A 66 -5.688 7.576 -13.159 1.00 21.50 H new ATOM 0 HA TYR A 66 -3.404 9.346 -13.744 1.00 14.31 H new ATOM 0 HB2 TYR A 66 -3.610 6.394 -14.414 1.00 75.11 H new ATOM 0 HB3 TYR A 66 -2.437 7.492 -15.113 1.00 75.11 H new ATOM 0 HD1 TYR A 66 -0.607 8.416 -13.731 1.00 14.43 H new ATOM 0 HD2 TYR A 66 -3.370 5.603 -12.114 1.00 70.13 H new ATOM 0 HE1 TYR A 66 0.906 8.016 -11.841 1.00 11.54 H new ATOM 0 HE2 TYR A 66 -1.852 5.199 -10.226 1.00 11.42 H new ATOM 0 HH TYR A 66 0.403 5.430 -9.584 1.00 13.55 H new ATOM 1073 N GLY A 67 -4.143 9.283 -16.273 1.00 25.11 N ATOM 1074 CA GLY A 67 -4.830 9.539 -17.519 1.00 61.23 C ATOM 1075 C GLY A 67 -3.895 9.583 -18.701 1.00 24.44 C ATOM 1076 O GLY A 67 -2.960 10.384 -18.727 1.00 70.31 O ATOM 0 H GLY A 67 -3.161 9.559 -16.254 1.00 25.11 H new ATOM 0 HA2 GLY A 67 -5.579 8.764 -17.682 1.00 61.23 H new ATOM 0 HA3 GLY A 67 -5.363 10.487 -17.447 1.00 61.23 H new ATOM 1080 N LEU A 68 -4.137 8.708 -19.666 1.00 42.34 N ATOM 1081 CA LEU A 68 -3.400 8.724 -20.920 1.00 22.10 C ATOM 1082 C LEU A 68 -4.268 9.351 -22.000 1.00 35.43 C ATOM 1083 O LEU A 68 -5.357 8.858 -22.298 1.00 13.41 O ATOM 1084 CB LEU A 68 -2.972 7.309 -21.335 1.00 53.33 C ATOM 1085 CG LEU A 68 -2.250 7.214 -22.684 1.00 51.35 C ATOM 1086 CD1 LEU A 68 -0.900 7.909 -22.623 1.00 5.15 C ATOM 1087 CD2 LEU A 68 -2.089 5.762 -23.102 1.00 21.54 C ATOM 0 H LEU A 68 -4.843 7.974 -19.603 1.00 42.34 H new ATOM 0 HA LEU A 68 -2.494 9.314 -20.786 1.00 22.10 H new ATOM 0 HB2 LEU A 68 -2.319 6.903 -20.562 1.00 53.33 H new ATOM 0 HB3 LEU A 68 -3.858 6.674 -21.370 1.00 53.33 H new ATOM 0 HG LEU A 68 -2.858 7.721 -23.433 1.00 51.35 H new ATOM 0 HD11 LEU A 68 -0.406 7.829 -23.591 1.00 5.15 H new ATOM 0 HD12 LEU A 68 -1.043 8.961 -22.374 1.00 5.15 H new ATOM 0 HD13 LEU A 68 -0.282 7.437 -21.860 1.00 5.15 H new ATOM 0 HD21 LEU A 68 -1.574 5.715 -24.062 1.00 21.54 H new ATOM 0 HD22 LEU A 68 -1.506 5.230 -22.351 1.00 21.54 H new ATOM 0 HD23 LEU A 68 -3.071 5.299 -23.194 1.00 21.54 H new ATOM 1099 N PHE A 69 -3.793 10.445 -22.567 1.00 24.10 N ATOM 1100 CA PHE A 69 -4.572 11.203 -23.531 1.00 41.42 C ATOM 1101 C PHE A 69 -3.824 11.307 -24.854 1.00 50.53 C ATOM 1102 O PHE A 69 -2.715 11.835 -24.895 1.00 21.01 O ATOM 1103 CB PHE A 69 -4.830 12.605 -22.973 1.00 41.02 C ATOM 1104 CG PHE A 69 -6.078 13.274 -23.485 1.00 25.11 C ATOM 1105 CD1 PHE A 69 -6.508 13.093 -24.790 1.00 53.55 C ATOM 1106 CD2 PHE A 69 -6.823 14.091 -22.648 1.00 61.00 C ATOM 1107 CE1 PHE A 69 -7.652 13.712 -25.250 1.00 53.31 C ATOM 1108 CE2 PHE A 69 -7.969 14.713 -23.104 1.00 11.22 C ATOM 1109 CZ PHE A 69 -8.384 14.523 -24.407 1.00 34.42 C ATOM 0 H PHE A 69 -2.868 10.830 -22.376 1.00 24.10 H new ATOM 0 HA PHE A 69 -5.519 10.693 -23.707 1.00 41.42 H new ATOM 0 HB2 PHE A 69 -4.889 12.542 -21.886 1.00 41.02 H new ATOM 0 HB3 PHE A 69 -3.974 13.237 -23.209 1.00 41.02 H new ATOM 0 HD1 PHE A 69 -5.940 12.459 -25.455 1.00 53.55 H new ATOM 0 HD2 PHE A 69 -6.503 14.243 -21.628 1.00 61.00 H new ATOM 0 HE1 PHE A 69 -7.975 13.562 -26.270 1.00 53.31 H new ATOM 0 HE2 PHE A 69 -8.540 15.347 -22.442 1.00 11.22 H new ATOM 0 HZ PHE A 69 -9.280 15.008 -24.766 1.00 34.42 H new ATOM 1119 N ASP A 70 -4.427 10.795 -25.918 1.00 2.15 N ATOM 1120 CA ASP A 70 -3.869 10.934 -27.261 1.00 71.13 C ATOM 1121 C ASP A 70 -4.777 11.821 -28.097 1.00 63.15 C ATOM 1122 O ASP A 70 -5.878 11.417 -28.478 1.00 53.10 O ATOM 1123 CB ASP A 70 -3.699 9.564 -27.934 1.00 74.32 C ATOM 1124 CG ASP A 70 -3.271 9.662 -29.390 1.00 31.25 C ATOM 1125 OD1 ASP A 70 -2.053 9.702 -29.656 1.00 2.55 O ATOM 1126 OD2 ASP A 70 -4.149 9.676 -30.281 1.00 31.10 O ATOM 0 H ASP A 70 -5.305 10.278 -25.879 1.00 2.15 H new ATOM 0 HA ASP A 70 -2.883 11.392 -27.183 1.00 71.13 H new ATOM 0 HB2 ASP A 70 -2.959 8.985 -27.382 1.00 74.32 H new ATOM 0 HB3 ASP A 70 -4.640 9.018 -27.874 1.00 74.32 H new ATOM 1131 N PHE A 71 -4.340 13.046 -28.337 1.00 41.45 N ATOM 1132 CA PHE A 71 -5.140 14.002 -29.088 1.00 75.05 C ATOM 1133 C PHE A 71 -4.273 14.800 -30.051 1.00 30.43 C ATOM 1134 O PHE A 71 -3.086 15.007 -29.801 1.00 72.43 O ATOM 1135 CB PHE A 71 -5.879 14.951 -28.135 1.00 14.54 C ATOM 1136 CG PHE A 71 -4.973 15.794 -27.277 1.00 70.22 C ATOM 1137 CD1 PHE A 71 -4.353 15.257 -26.160 1.00 34.43 C ATOM 1138 CD2 PHE A 71 -4.747 17.123 -27.590 1.00 52.23 C ATOM 1139 CE1 PHE A 71 -3.525 16.029 -25.372 1.00 21.04 C ATOM 1140 CE2 PHE A 71 -3.919 17.901 -26.804 1.00 0.00 C ATOM 1141 CZ PHE A 71 -3.308 17.353 -25.694 1.00 73.42 C ATOM 0 H PHE A 71 -3.437 13.403 -28.024 1.00 41.45 H new ATOM 0 HA PHE A 71 -5.874 13.443 -29.668 1.00 75.05 H new ATOM 0 HB2 PHE A 71 -6.521 15.609 -28.721 1.00 14.54 H new ATOM 0 HB3 PHE A 71 -6.530 14.363 -27.488 1.00 14.54 H new ATOM 0 HD1 PHE A 71 -4.520 14.221 -25.903 1.00 34.43 H new ATOM 0 HD2 PHE A 71 -5.223 17.556 -28.457 1.00 52.23 H new ATOM 0 HE1 PHE A 71 -3.047 15.598 -24.505 1.00 21.04 H new ATOM 0 HE2 PHE A 71 -3.750 18.937 -27.058 1.00 0.00 H new ATOM 0 HZ PHE A 71 -2.661 17.960 -25.078 1.00 73.42 H new ATOM 1151 N GLU A 72 -4.868 15.253 -31.143 1.00 60.25 N ATOM 1152 CA GLU A 72 -4.160 16.091 -32.097 1.00 45.13 C ATOM 1153 C GLU A 72 -4.333 17.554 -31.717 1.00 32.30 C ATOM 1154 O GLU A 72 -5.428 18.105 -31.826 1.00 40.43 O ATOM 1155 CB GLU A 72 -4.674 15.882 -33.528 1.00 25.44 C ATOM 1156 CG GLU A 72 -4.576 14.454 -34.046 1.00 70.25 C ATOM 1157 CD GLU A 72 -5.683 13.562 -33.528 1.00 45.53 C ATOM 1158 OE1 GLU A 72 -6.868 13.906 -33.717 1.00 43.14 O ATOM 1159 OE2 GLU A 72 -5.385 12.517 -32.921 1.00 73.25 O ATOM 0 H GLU A 72 -5.838 15.055 -31.390 1.00 60.25 H new ATOM 0 HA GLU A 72 -3.107 15.811 -32.067 1.00 45.13 H new ATOM 0 HB2 GLU A 72 -5.716 16.198 -33.573 1.00 25.44 H new ATOM 0 HB3 GLU A 72 -4.114 16.534 -34.198 1.00 25.44 H new ATOM 0 HG2 GLU A 72 -4.605 14.465 -35.136 1.00 70.25 H new ATOM 0 HG3 GLU A 72 -3.613 14.034 -33.757 1.00 70.25 H new ATOM 1166 N TYR A 73 -3.262 18.177 -31.261 1.00 24.44 N ATOM 1167 CA TYR A 73 -3.308 19.580 -30.895 1.00 71.30 C ATOM 1168 C TYR A 73 -2.706 20.414 -32.016 1.00 23.23 C ATOM 1169 O TYR A 73 -1.617 20.116 -32.509 1.00 44.34 O ATOM 1170 CB TYR A 73 -2.555 19.822 -29.580 1.00 34.41 C ATOM 1171 CG TYR A 73 -2.938 21.110 -28.872 1.00 51.53 C ATOM 1172 CD1 TYR A 73 -2.336 22.322 -29.199 1.00 21.42 C ATOM 1173 CD2 TYR A 73 -3.902 21.109 -27.869 1.00 44.42 C ATOM 1174 CE1 TYR A 73 -2.687 23.493 -28.547 1.00 21.12 C ATOM 1175 CE2 TYR A 73 -4.257 22.274 -27.214 1.00 31.43 C ATOM 1176 CZ TYR A 73 -3.648 23.463 -27.556 1.00 1.42 C ATOM 1177 OH TYR A 73 -4.002 24.624 -26.902 1.00 3.02 O ATOM 0 H TYR A 73 -2.352 17.735 -31.136 1.00 24.44 H new ATOM 0 HA TYR A 73 -4.346 19.875 -30.745 1.00 71.30 H new ATOM 0 HB2 TYR A 73 -2.739 18.983 -28.909 1.00 34.41 H new ATOM 0 HB3 TYR A 73 -1.485 19.837 -29.785 1.00 34.41 H new ATOM 0 HD1 TYR A 73 -1.583 22.350 -29.973 1.00 21.42 H new ATOM 0 HD2 TYR A 73 -4.382 20.181 -27.597 1.00 44.42 H new ATOM 0 HE1 TYR A 73 -2.211 24.425 -28.813 1.00 21.12 H new ATOM 0 HE2 TYR A 73 -5.008 22.253 -26.438 1.00 31.43 H new ATOM 0 HH TYR A 73 -4.692 24.426 -26.235 1.00 3.02 H new ATOM 1187 N MET A 74 -3.427 21.436 -32.436 1.00 34.34 N ATOM 1188 CA MET A 74 -2.952 22.305 -33.498 1.00 0.31 C ATOM 1189 C MET A 74 -2.180 23.484 -32.913 1.00 73.22 C ATOM 1190 O MET A 74 -2.741 24.327 -32.215 1.00 71.43 O ATOM 1191 CB MET A 74 -4.121 22.786 -34.368 1.00 43.11 C ATOM 1192 CG MET A 74 -5.218 23.511 -33.602 1.00 61.05 C ATOM 1193 SD MET A 74 -6.628 23.931 -34.640 1.00 4.45 S ATOM 1194 CE MET A 74 -7.210 22.300 -35.103 1.00 42.51 C ATOM 0 H MET A 74 -4.342 21.685 -32.060 1.00 34.34 H new ATOM 0 HA MET A 74 -2.274 21.738 -34.135 1.00 0.31 H new ATOM 0 HB2 MET A 74 -3.734 23.451 -35.140 1.00 43.11 H new ATOM 0 HB3 MET A 74 -4.557 21.926 -34.877 1.00 43.11 H new ATOM 0 HG2 MET A 74 -5.554 22.884 -32.776 1.00 61.05 H new ATOM 0 HG3 MET A 74 -4.809 24.422 -33.165 1.00 61.05 H new ATOM 0 HE1 MET A 74 -8.267 22.352 -35.366 1.00 42.51 H new ATOM 0 HE2 MET A 74 -6.640 21.940 -35.960 1.00 42.51 H new ATOM 0 HE3 MET A 74 -7.077 21.615 -34.266 1.00 42.51 H new ATOM 1204 N HIS A 75 -0.884 23.513 -33.173 1.00 62.33 N ATOM 1205 CA HIS A 75 -0.025 24.569 -32.659 1.00 14.13 C ATOM 1206 C HIS A 75 0.374 25.518 -33.788 1.00 53.11 C ATOM 1207 O HIS A 75 1.025 25.113 -34.750 1.00 34.35 O ATOM 1208 CB HIS A 75 1.222 23.959 -32.000 1.00 14.23 C ATOM 1209 CG HIS A 75 2.059 24.932 -31.216 1.00 52.05 C ATOM 1210 ND1 HIS A 75 3.161 24.550 -30.485 1.00 63.42 N ATOM 1211 CD2 HIS A 75 1.952 26.273 -31.047 1.00 4.41 C ATOM 1212 CE1 HIS A 75 3.688 25.607 -29.900 1.00 0.41 C ATOM 1213 NE2 HIS A 75 2.977 26.668 -30.224 1.00 53.50 N ATOM 0 H HIS A 75 -0.401 22.815 -33.739 1.00 62.33 H new ATOM 0 HA HIS A 75 -0.572 25.138 -31.907 1.00 14.13 H new ATOM 0 HB2 HIS A 75 0.908 23.154 -31.336 1.00 14.23 H new ATOM 0 HB3 HIS A 75 1.843 23.509 -32.775 1.00 14.23 H new ATOM 0 HD1 HIS A 75 3.515 23.597 -30.408 1.00 63.42 H new ATOM 0 HD2 HIS A 75 1.198 26.913 -31.481 1.00 4.41 H new ATOM 0 HE1 HIS A 75 4.559 25.604 -29.261 1.00 0.41 H new ATOM 1222 N GLN A 76 -0.040 26.769 -33.676 1.00 3.15 N ATOM 1223 CA GLN A 76 0.326 27.786 -34.651 1.00 53.54 C ATOM 1224 C GLN A 76 1.394 28.700 -34.064 1.00 50.32 C ATOM 1225 O GLN A 76 1.507 28.826 -32.844 1.00 21.33 O ATOM 1226 CB GLN A 76 -0.900 28.595 -35.084 1.00 0.44 C ATOM 1227 CG GLN A 76 -1.631 29.271 -33.936 1.00 41.11 C ATOM 1228 CD GLN A 76 -2.814 30.093 -34.404 1.00 34.24 C ATOM 1229 OE1 GLN A 76 -3.441 29.784 -35.420 1.00 62.22 O ATOM 1230 NE2 GLN A 76 -3.125 31.147 -33.669 1.00 1.23 N ATOM 0 H GLN A 76 -0.632 27.107 -32.917 1.00 3.15 H new ATOM 0 HA GLN A 76 0.728 27.294 -35.536 1.00 53.54 H new ATOM 0 HB2 GLN A 76 -0.587 29.355 -35.800 1.00 0.44 H new ATOM 0 HB3 GLN A 76 -1.594 27.934 -35.604 1.00 0.44 H new ATOM 0 HG2 GLN A 76 -1.975 28.513 -33.232 1.00 41.11 H new ATOM 0 HG3 GLN A 76 -0.936 29.915 -33.396 1.00 41.11 H new ATOM 0 HE21 GLN A 76 -2.579 31.366 -32.836 1.00 1.23 H new ATOM 0 HE22 GLN A 76 -3.911 31.741 -33.935 1.00 1.23 H new ATOM 1239 N CYS A 77 2.172 29.332 -34.929 1.00 45.15 N ATOM 1240 CA CYS A 77 3.298 30.137 -34.486 1.00 3.34 C ATOM 1241 C CYS A 77 3.506 31.324 -35.420 1.00 61.31 C ATOM 1242 O CYS A 77 3.051 31.303 -36.569 1.00 71.42 O ATOM 1243 CB CYS A 77 4.559 29.268 -34.436 1.00 22.04 C ATOM 1244 SG CYS A 77 6.001 30.063 -33.686 1.00 23.35 S ATOM 0 H CYS A 77 2.044 29.303 -35.941 1.00 45.15 H new ATOM 0 HA CYS A 77 3.090 30.523 -33.488 1.00 3.34 H new ATOM 0 HB2 CYS A 77 4.334 28.358 -33.880 1.00 22.04 H new ATOM 0 HB3 CYS A 77 4.816 28.966 -35.452 1.00 22.04 H new ATOM 0 HG CYS A 77 7.005 29.238 -33.695 1.00 23.35 H new ATOM 1250 N GLN A 78 4.161 32.368 -34.905 1.00 54.12 N ATOM 1251 CA GLN A 78 4.523 33.553 -35.692 1.00 72.44 C ATOM 1252 C GLN A 78 3.291 34.313 -36.171 1.00 25.33 C ATOM 1253 O GLN A 78 3.379 35.155 -37.066 1.00 61.21 O ATOM 1254 CB GLN A 78 5.381 33.160 -36.897 1.00 31.21 C ATOM 1255 CG GLN A 78 6.685 32.479 -36.532 1.00 71.42 C ATOM 1256 CD GLN A 78 7.534 32.182 -37.747 1.00 33.22 C ATOM 1257 OE1 GLN A 78 7.442 31.109 -38.342 1.00 51.23 O ATOM 1258 NE2 GLN A 78 8.355 33.143 -38.135 1.00 35.30 N ATOM 0 H GLN A 78 4.456 32.417 -33.930 1.00 54.12 H new ATOM 0 HA GLN A 78 5.096 34.209 -35.036 1.00 72.44 H new ATOM 0 HB2 GLN A 78 4.804 32.495 -37.539 1.00 31.21 H new ATOM 0 HB3 GLN A 78 5.601 34.054 -37.480 1.00 31.21 H new ATOM 0 HG2 GLN A 78 7.245 33.114 -35.846 1.00 71.42 H new ATOM 0 HG3 GLN A 78 6.472 31.550 -36.004 1.00 71.42 H new ATOM 0 HE21 GLN A 78 8.400 34.018 -37.612 1.00 35.30 H new ATOM 0 HE22 GLN A 78 8.944 33.010 -38.957 1.00 35.30 H new ATOM 1267 N GLY A 79 2.143 34.022 -35.578 1.00 4.22 N ATOM 1268 CA GLY A 79 0.912 34.648 -36.012 1.00 52.52 C ATOM 1269 C GLY A 79 0.426 34.072 -37.326 1.00 61.42 C ATOM 1270 O GLY A 79 -0.505 34.591 -37.938 1.00 74.03 O ATOM 0 H GLY A 79 2.042 33.364 -34.805 1.00 4.22 H new ATOM 0 HA2 GLY A 79 0.146 34.512 -35.249 1.00 52.52 H new ATOM 0 HA3 GLY A 79 1.068 35.721 -36.120 1.00 52.52 H new ATOM 1274 N THR A 80 1.072 33.002 -37.764 1.00 34.02 N ATOM 1275 CA THR A 80 0.700 32.325 -38.989 1.00 23.42 C ATOM 1276 C THR A 80 -0.167 31.120 -38.652 1.00 52.04 C ATOM 1277 O THR A 80 0.303 30.154 -38.044 1.00 65.34 O ATOM 1278 CB THR A 80 1.953 31.877 -39.767 1.00 34.14 C ATOM 1279 OG1 THR A 80 2.863 32.979 -39.878 1.00 34.01 O ATOM 1280 CG2 THR A 80 1.584 31.382 -41.157 1.00 31.41 C ATOM 0 H THR A 80 1.866 32.583 -37.280 1.00 34.02 H new ATOM 0 HA THR A 80 0.139 33.014 -39.620 1.00 23.42 H new ATOM 0 HB THR A 80 2.423 31.057 -39.224 1.00 34.14 H new ATOM 0 HG1 THR A 80 3.661 32.696 -40.371 1.00 34.01 H new ATOM 0 HG21 THR A 80 2.486 31.072 -41.684 1.00 31.41 H new ATOM 0 HG22 THR A 80 0.904 30.534 -41.073 1.00 31.41 H new ATOM 0 HG23 THR A 80 1.097 32.184 -41.712 1.00 31.41 H new ATOM 1288 N SER A 81 -1.434 31.180 -39.035 1.00 61.31 N ATOM 1289 CA SER A 81 -2.398 30.174 -38.624 1.00 24.35 C ATOM 1290 C SER A 81 -2.320 28.935 -39.519 1.00 72.31 C ATOM 1291 O SER A 81 -3.323 28.485 -40.073 1.00 13.52 O ATOM 1292 CB SER A 81 -3.811 30.765 -38.635 1.00 0.23 C ATOM 1293 OG SER A 81 -4.707 29.976 -37.867 1.00 75.03 O ATOM 0 H SER A 81 -1.817 31.915 -39.630 1.00 61.31 H new ATOM 0 HA SER A 81 -2.156 29.862 -37.608 1.00 24.35 H new ATOM 0 HB2 SER A 81 -3.786 31.780 -38.239 1.00 0.23 H new ATOM 0 HB3 SER A 81 -4.171 30.833 -39.662 1.00 0.23 H new ATOM 0 HG SER A 81 -4.389 29.927 -36.941 1.00 75.03 H new ATOM 1299 N GLU A 82 -1.117 28.389 -39.657 1.00 14.34 N ATOM 1300 CA GLU A 82 -0.933 27.113 -40.328 1.00 14.44 C ATOM 1301 C GLU A 82 -1.504 26.009 -39.455 1.00 43.24 C ATOM 1302 O GLU A 82 -2.042 25.018 -39.952 1.00 65.01 O ATOM 1303 CB GLU A 82 0.552 26.847 -40.589 1.00 22.03 C ATOM 1304 CG GLU A 82 1.194 27.829 -41.553 1.00 42.32 C ATOM 1305 CD GLU A 82 0.584 27.767 -42.937 1.00 44.21 C ATOM 1306 OE1 GLU A 82 0.940 26.857 -43.709 1.00 23.32 O ATOM 1307 OE2 GLU A 82 -0.256 28.627 -43.260 1.00 41.40 O ATOM 0 H GLU A 82 -0.256 28.813 -39.312 1.00 14.34 H new ATOM 0 HA GLU A 82 -1.451 27.138 -41.287 1.00 14.44 H new ATOM 0 HB2 GLU A 82 1.089 26.880 -39.641 1.00 22.03 H new ATOM 0 HB3 GLU A 82 0.666 25.838 -40.985 1.00 22.03 H new ATOM 0 HG2 GLU A 82 1.090 28.840 -41.159 1.00 42.32 H new ATOM 0 HG3 GLU A 82 2.262 27.621 -41.621 1.00 42.32 H new ATOM 1314 N SER A 83 -1.390 26.220 -38.144 1.00 21.55 N ATOM 1315 CA SER A 83 -1.873 25.283 -37.140 1.00 43.13 C ATOM 1316 C SER A 83 -1.278 23.894 -37.352 1.00 20.23 C ATOM 1317 O SER A 83 -1.890 23.027 -37.983 1.00 34.12 O ATOM 1318 CB SER A 83 -3.403 25.231 -37.149 1.00 21.10 C ATOM 1319 OG SER A 83 -3.950 26.524 -36.959 1.00 22.43 O ATOM 0 H SER A 83 -0.956 27.054 -37.750 1.00 21.55 H new ATOM 0 HA SER A 83 -1.547 25.636 -36.161 1.00 43.13 H new ATOM 0 HB2 SER A 83 -3.752 24.819 -38.096 1.00 21.10 H new ATOM 0 HB3 SER A 83 -3.754 24.563 -36.362 1.00 21.10 H new ATOM 0 HG SER A 83 -4.928 26.470 -36.970 1.00 22.43 H new ATOM 1325 N SER A 84 -0.070 23.698 -36.839 1.00 51.52 N ATOM 1326 CA SER A 84 0.608 22.423 -36.959 1.00 45.04 C ATOM 1327 C SER A 84 -0.130 21.378 -36.135 1.00 42.14 C ATOM 1328 O SER A 84 -0.067 21.382 -34.905 1.00 14.43 O ATOM 1329 CB SER A 84 2.065 22.548 -36.499 1.00 15.24 C ATOM 1330 OG SER A 84 2.789 21.352 -36.740 1.00 51.30 O ATOM 0 H SER A 84 0.458 24.411 -36.335 1.00 51.52 H new ATOM 0 HA SER A 84 0.611 22.112 -38.004 1.00 45.04 H new ATOM 0 HB2 SER A 84 2.543 23.376 -37.022 1.00 15.24 H new ATOM 0 HB3 SER A 84 2.093 22.784 -35.435 1.00 15.24 H new ATOM 0 HG SER A 84 3.715 21.463 -36.438 1.00 51.30 H new ATOM 1336 N LYS A 85 -0.864 20.517 -36.820 1.00 20.52 N ATOM 1337 CA LYS A 85 -1.631 19.483 -36.171 1.00 35.12 C ATOM 1338 C LYS A 85 -0.705 18.371 -35.700 1.00 72.35 C ATOM 1339 O LYS A 85 -0.195 17.586 -36.502 1.00 64.53 O ATOM 1340 CB LYS A 85 -2.685 18.955 -37.141 1.00 72.13 C ATOM 1341 CG LYS A 85 -3.641 17.957 -36.529 1.00 44.11 C ATOM 1342 CD LYS A 85 -4.798 17.670 -37.466 1.00 23.12 C ATOM 1343 CE LYS A 85 -5.715 16.616 -36.887 1.00 24.32 C ATOM 1344 NZ LYS A 85 -6.934 16.421 -37.714 1.00 21.41 N ATOM 0 H LYS A 85 -0.941 20.520 -37.837 1.00 20.52 H new ATOM 0 HA LYS A 85 -2.139 19.888 -35.296 1.00 35.12 H new ATOM 0 HB2 LYS A 85 -3.257 19.796 -37.533 1.00 72.13 H new ATOM 0 HB3 LYS A 85 -2.183 18.488 -37.988 1.00 72.13 H new ATOM 0 HG2 LYS A 85 -3.112 17.031 -36.304 1.00 44.11 H new ATOM 0 HG3 LYS A 85 -4.021 18.344 -35.584 1.00 44.11 H new ATOM 0 HD2 LYS A 85 -5.360 18.586 -37.647 1.00 23.12 H new ATOM 0 HD3 LYS A 85 -4.415 17.335 -38.430 1.00 23.12 H new ATOM 0 HE2 LYS A 85 -5.177 15.672 -36.807 1.00 24.32 H new ATOM 0 HE3 LYS A 85 -6.005 16.904 -35.876 1.00 24.32 H new ATOM 0 HZ1 LYS A 85 -7.534 15.690 -37.281 1.00 21.41 H new ATOM 0 HZ2 LYS A 85 -7.463 17.315 -37.769 1.00 21.41 H new ATOM 0 HZ3 LYS A 85 -6.660 16.121 -38.671 1.00 21.41 H new ATOM 1358 N LYS A 86 -0.460 18.344 -34.404 1.00 64.40 N ATOM 1359 CA LYS A 86 0.443 17.379 -33.812 1.00 13.32 C ATOM 1360 C LYS A 86 -0.299 16.543 -32.780 1.00 21.43 C ATOM 1361 O LYS A 86 -0.767 17.068 -31.769 1.00 12.35 O ATOM 1362 CB LYS A 86 1.610 18.113 -33.143 1.00 35.11 C ATOM 1363 CG LYS A 86 2.716 17.200 -32.635 1.00 32.40 C ATOM 1364 CD LYS A 86 3.430 17.809 -31.434 1.00 72.00 C ATOM 1365 CE LYS A 86 4.022 19.179 -31.739 1.00 11.33 C ATOM 1366 NZ LYS A 86 5.298 19.091 -32.496 1.00 72.52 N ATOM 0 H LYS A 86 -0.880 18.989 -33.735 1.00 64.40 H new ATOM 0 HA LYS A 86 0.829 16.722 -34.591 1.00 13.32 H new ATOM 0 HB2 LYS A 86 2.036 18.819 -33.856 1.00 35.11 H new ATOM 0 HB3 LYS A 86 1.225 18.697 -32.307 1.00 35.11 H new ATOM 0 HG2 LYS A 86 2.294 16.234 -32.358 1.00 32.40 H new ATOM 0 HG3 LYS A 86 3.435 17.017 -33.434 1.00 32.40 H new ATOM 0 HD2 LYS A 86 2.728 17.897 -30.605 1.00 72.00 H new ATOM 0 HD3 LYS A 86 4.225 17.138 -31.109 1.00 72.00 H new ATOM 0 HE2 LYS A 86 3.302 19.763 -32.313 1.00 11.33 H new ATOM 0 HE3 LYS A 86 4.194 19.713 -30.805 1.00 11.33 H new ATOM 0 HZ1 LYS A 86 5.660 20.049 -32.679 1.00 72.52 H new ATOM 0 HZ2 LYS A 86 5.996 18.557 -31.939 1.00 72.52 H new ATOM 0 HZ3 LYS A 86 5.132 18.605 -33.401 1.00 72.52 H new ATOM 1380 N GLN A 87 -0.427 15.254 -33.042 1.00 22.12 N ATOM 1381 CA GLN A 87 -1.038 14.350 -32.085 1.00 55.14 C ATOM 1382 C GLN A 87 -0.048 14.043 -30.971 1.00 44.31 C ATOM 1383 O GLN A 87 1.100 13.669 -31.225 1.00 24.31 O ATOM 1384 CB GLN A 87 -1.518 13.056 -32.757 1.00 25.11 C ATOM 1385 CG GLN A 87 -0.429 12.278 -33.484 1.00 72.41 C ATOM 1386 CD GLN A 87 -0.235 12.713 -34.924 1.00 74.03 C ATOM 1387 OE1 GLN A 87 -0.478 13.862 -35.289 1.00 34.12 O ATOM 1388 NE2 GLN A 87 0.215 11.794 -35.755 1.00 5.52 N ATOM 0 H GLN A 87 -0.117 14.811 -33.907 1.00 22.12 H new ATOM 0 HA GLN A 87 -1.916 14.838 -31.663 1.00 55.14 H new ATOM 0 HB2 GLN A 87 -1.962 12.411 -31.999 1.00 25.11 H new ATOM 0 HB3 GLN A 87 -2.307 13.302 -33.468 1.00 25.11 H new ATOM 0 HG2 GLN A 87 0.512 12.397 -32.947 1.00 72.41 H new ATOM 0 HG3 GLN A 87 -0.676 11.217 -33.463 1.00 72.41 H new ATOM 0 HE21 GLN A 87 0.406 10.851 -35.417 1.00 5.52 H new ATOM 0 HE22 GLN A 87 0.372 12.026 -36.736 1.00 5.52 H new ATOM 1397 N LYS A 88 -0.486 14.237 -29.740 1.00 11.43 N ATOM 1398 CA LYS A 88 0.392 14.117 -28.592 1.00 5.21 C ATOM 1399 C LYS A 88 -0.253 13.267 -27.512 1.00 20.23 C ATOM 1400 O LYS A 88 -1.453 13.379 -27.260 1.00 54.31 O ATOM 1401 CB LYS A 88 0.707 15.503 -28.026 1.00 45.21 C ATOM 1402 CG LYS A 88 1.100 16.522 -29.079 1.00 74.44 C ATOM 1403 CD LYS A 88 1.430 17.869 -28.460 1.00 4.32 C ATOM 1404 CE LYS A 88 2.718 17.804 -27.656 1.00 42.11 C ATOM 1405 NZ LYS A 88 3.064 19.114 -27.051 1.00 54.52 N ATOM 0 H LYS A 88 -1.450 14.480 -29.510 1.00 11.43 H new ATOM 0 HA LYS A 88 1.315 13.637 -28.916 1.00 5.21 H new ATOM 0 HB2 LYS A 88 -0.165 15.871 -27.486 1.00 45.21 H new ATOM 0 HB3 LYS A 88 1.516 15.413 -27.301 1.00 45.21 H new ATOM 0 HG2 LYS A 88 1.963 16.156 -29.636 1.00 74.44 H new ATOM 0 HG3 LYS A 88 0.286 16.639 -29.794 1.00 74.44 H new ATOM 0 HD2 LYS A 88 1.526 18.619 -29.245 1.00 4.32 H new ATOM 0 HD3 LYS A 88 0.611 18.186 -27.814 1.00 4.32 H new ATOM 0 HE2 LYS A 88 2.616 17.057 -26.869 1.00 42.11 H new ATOM 0 HE3 LYS A 88 3.532 17.477 -28.302 1.00 42.11 H new ATOM 0 HZ1 LYS A 88 4.054 19.099 -26.733 1.00 54.52 H new ATOM 0 HZ2 LYS A 88 2.939 19.867 -27.758 1.00 54.52 H new ATOM 0 HZ3 LYS A 88 2.442 19.296 -26.238 1.00 54.52 H new ATOM 1419 N LEU A 89 0.547 12.422 -26.881 1.00 10.31 N ATOM 1420 CA LEU A 89 0.072 11.619 -25.768 1.00 72.01 C ATOM 1421 C LEU A 89 0.666 12.144 -24.471 1.00 74.12 C ATOM 1422 O LEU A 89 1.875 12.381 -24.383 1.00 62.43 O ATOM 1423 CB LEU A 89 0.440 10.137 -25.927 1.00 3.51 C ATOM 1424 CG LEU A 89 0.015 9.465 -27.236 1.00 14.00 C ATOM 1425 CD1 LEU A 89 0.988 9.797 -28.360 1.00 64.14 C ATOM 1426 CD2 LEU A 89 -0.088 7.959 -27.043 1.00 71.32 C ATOM 0 H LEU A 89 1.527 12.275 -27.121 1.00 10.31 H new ATOM 0 HA LEU A 89 -1.015 11.695 -25.749 1.00 72.01 H new ATOM 0 HB2 LEU A 89 1.521 10.041 -25.830 1.00 3.51 H new ATOM 0 HB3 LEU A 89 -0.005 9.584 -25.099 1.00 3.51 H new ATOM 0 HG LEU A 89 -0.965 9.850 -27.517 1.00 14.00 H new ATOM 0 HD11 LEU A 89 0.664 9.308 -29.278 1.00 64.14 H new ATOM 0 HD12 LEU A 89 1.013 10.876 -28.513 1.00 64.14 H new ATOM 0 HD13 LEU A 89 1.985 9.445 -28.094 1.00 64.14 H new ATOM 0 HD21 LEU A 89 -0.391 7.492 -27.980 1.00 71.32 H new ATOM 0 HD22 LEU A 89 0.881 7.564 -26.737 1.00 71.32 H new ATOM 0 HD23 LEU A 89 -0.828 7.741 -26.273 1.00 71.32 H new ATOM 1438 N PHE A 90 -0.178 12.329 -23.472 1.00 2.42 N ATOM 1439 CA PHE A 90 0.267 12.805 -22.171 1.00 54.24 C ATOM 1440 C PHE A 90 -0.267 11.922 -21.064 1.00 53.20 C ATOM 1441 O PHE A 90 -1.388 11.419 -21.144 1.00 24.32 O ATOM 1442 CB PHE A 90 -0.194 14.236 -21.931 1.00 64.24 C ATOM 1443 CG PHE A 90 0.389 15.221 -22.894 1.00 34.41 C ATOM 1444 CD1 PHE A 90 1.678 15.692 -22.719 1.00 61.44 C ATOM 1445 CD2 PHE A 90 -0.348 15.672 -23.973 1.00 40.21 C ATOM 1446 CE1 PHE A 90 2.221 16.595 -23.605 1.00 52.15 C ATOM 1447 CE2 PHE A 90 0.191 16.577 -24.862 1.00 1.34 C ATOM 1448 CZ PHE A 90 1.477 17.038 -24.677 1.00 31.10 C ATOM 0 H PHE A 90 -1.181 12.156 -23.536 1.00 2.42 H new ATOM 0 HA PHE A 90 1.356 12.772 -22.165 1.00 54.24 H new ATOM 0 HB2 PHE A 90 -1.281 14.275 -21.998 1.00 64.24 H new ATOM 0 HB3 PHE A 90 0.074 14.530 -20.916 1.00 64.24 H new ATOM 0 HD1 PHE A 90 2.264 15.348 -21.879 1.00 61.44 H new ATOM 0 HD2 PHE A 90 -1.355 15.312 -24.121 1.00 40.21 H new ATOM 0 HE1 PHE A 90 3.229 16.956 -23.460 1.00 52.15 H new ATOM 0 HE2 PHE A 90 -0.393 16.924 -25.702 1.00 1.34 H new ATOM 0 HZ PHE A 90 1.902 17.747 -25.373 1.00 31.10 H new ATOM 1458 N LEU A 91 0.546 11.740 -20.042 1.00 2.25 N ATOM 1459 CA LEU A 91 0.142 11.009 -18.859 1.00 41.02 C ATOM 1460 C LEU A 91 0.021 11.976 -17.692 1.00 71.10 C ATOM 1461 O LEU A 91 0.942 12.743 -17.418 1.00 2.14 O ATOM 1462 CB LEU A 91 1.159 9.909 -18.537 1.00 25.44 C ATOM 1463 CG LEU A 91 0.879 9.111 -17.261 1.00 43.11 C ATOM 1464 CD1 LEU A 91 -0.452 8.382 -17.362 1.00 10.43 C ATOM 1465 CD2 LEU A 91 2.011 8.132 -16.991 1.00 61.21 C ATOM 0 H LEU A 91 1.502 12.094 -20.009 1.00 2.25 H new ATOM 0 HA LEU A 91 -0.823 10.536 -19.039 1.00 41.02 H new ATOM 0 HB2 LEU A 91 1.198 9.216 -19.378 1.00 25.44 H new ATOM 0 HB3 LEU A 91 2.146 10.363 -18.452 1.00 25.44 H new ATOM 0 HG LEU A 91 0.819 9.808 -16.425 1.00 43.11 H new ATOM 0 HD11 LEU A 91 -0.630 7.822 -16.444 1.00 10.43 H new ATOM 0 HD12 LEU A 91 -1.254 9.106 -17.506 1.00 10.43 H new ATOM 0 HD13 LEU A 91 -0.427 7.695 -18.208 1.00 10.43 H new ATOM 0 HD21 LEU A 91 1.798 7.572 -16.081 1.00 61.21 H new ATOM 0 HD22 LEU A 91 2.102 7.441 -17.829 1.00 61.21 H new ATOM 0 HD23 LEU A 91 2.945 8.680 -16.869 1.00 61.21 H new ATOM 1477 N MET A 92 -1.122 11.973 -17.032 1.00 42.31 N ATOM 1478 CA MET A 92 -1.328 12.851 -15.891 1.00 23.50 C ATOM 1479 C MET A 92 -1.811 12.070 -14.678 1.00 53.22 C ATOM 1480 O MET A 92 -2.765 11.300 -14.757 1.00 34.01 O ATOM 1481 CB MET A 92 -2.297 13.988 -16.241 1.00 35.20 C ATOM 1482 CG MET A 92 -3.610 13.531 -16.854 1.00 43.41 C ATOM 1483 SD MET A 92 -4.629 14.921 -17.387 1.00 42.34 S ATOM 1484 CE MET A 92 -5.098 15.623 -15.806 1.00 62.14 C ATOM 0 H MET A 92 -1.918 11.378 -17.262 1.00 42.31 H new ATOM 0 HA MET A 92 -0.368 13.298 -15.635 1.00 23.50 H new ATOM 0 HB2 MET A 92 -2.512 14.557 -15.336 1.00 35.20 H new ATOM 0 HB3 MET A 92 -1.804 14.668 -16.936 1.00 35.20 H new ATOM 0 HG2 MET A 92 -3.406 12.884 -17.707 1.00 43.41 H new ATOM 0 HG3 MET A 92 -4.162 12.935 -16.127 1.00 43.41 H new ATOM 0 HE1 MET A 92 -5.906 16.340 -15.952 1.00 62.14 H new ATOM 0 HE2 MET A 92 -5.434 14.828 -15.140 1.00 62.14 H new ATOM 0 HE3 MET A 92 -4.240 16.128 -15.363 1.00 62.14 H new ATOM 1494 N SER A 93 -1.123 12.260 -13.564 1.00 13.13 N ATOM 1495 CA SER A 93 -1.465 11.589 -12.325 1.00 3.04 C ATOM 1496 C SER A 93 -2.338 12.490 -11.465 1.00 11.41 C ATOM 1497 O SER A 93 -1.871 13.490 -10.933 1.00 61.11 O ATOM 1498 CB SER A 93 -0.194 11.194 -11.570 1.00 5.15 C ATOM 1499 OG SER A 93 -0.493 10.449 -10.400 1.00 73.54 O ATOM 0 H SER A 93 -0.316 12.881 -13.495 1.00 13.13 H new ATOM 0 HA SER A 93 -2.025 10.683 -12.557 1.00 3.04 H new ATOM 0 HB2 SER A 93 0.450 10.605 -12.223 1.00 5.15 H new ATOM 0 HB3 SER A 93 0.363 12.091 -11.299 1.00 5.15 H new ATOM 0 HG SER A 93 -0.629 11.062 -9.648 1.00 73.54 H new ATOM 1505 N TRP A 94 -3.606 12.146 -11.350 1.00 62.33 N ATOM 1506 CA TRP A 94 -4.527 12.913 -10.531 1.00 1.05 C ATOM 1507 C TRP A 94 -4.571 12.306 -9.134 1.00 74.41 C ATOM 1508 O TRP A 94 -5.264 11.314 -8.901 1.00 4.23 O ATOM 1509 CB TRP A 94 -5.927 12.911 -11.163 1.00 52.31 C ATOM 1510 CG TRP A 94 -6.890 13.893 -10.553 1.00 32.41 C ATOM 1511 CD1 TRP A 94 -6.990 14.256 -9.239 1.00 33.30 C ATOM 1512 CD2 TRP A 94 -7.906 14.627 -11.246 1.00 3.02 C ATOM 1513 NE1 TRP A 94 -8.001 15.169 -9.076 1.00 51.04 N ATOM 1514 CE2 TRP A 94 -8.578 15.414 -10.292 1.00 15.15 C ATOM 1515 CE3 TRP A 94 -8.312 14.694 -12.582 1.00 65.52 C ATOM 1516 CZ2 TRP A 94 -9.633 16.255 -10.633 1.00 0.34 C ATOM 1517 CZ3 TRP A 94 -9.357 15.533 -12.919 1.00 3.23 C ATOM 1518 CH2 TRP A 94 -10.007 16.303 -11.947 1.00 75.51 C ATOM 0 H TRP A 94 -4.023 11.339 -11.814 1.00 62.33 H new ATOM 0 HA TRP A 94 -4.186 13.946 -10.465 1.00 1.05 H new ATOM 0 HB2 TRP A 94 -5.832 13.129 -12.227 1.00 52.31 H new ATOM 0 HB3 TRP A 94 -6.348 11.909 -11.079 1.00 52.31 H new ATOM 0 HD1 TRP A 94 -6.364 13.879 -8.444 1.00 33.30 H new ATOM 0 HE1 TRP A 94 -8.278 15.596 -8.192 1.00 51.04 H new ATOM 0 HE3 TRP A 94 -7.818 14.101 -13.337 1.00 65.52 H new ATOM 0 HZ2 TRP A 94 -10.138 16.849 -9.886 1.00 0.34 H new ATOM 0 HZ3 TRP A 94 -9.677 15.596 -13.948 1.00 3.23 H new ATOM 0 HH2 TRP A 94 -10.821 16.949 -12.242 1.00 75.51 H new ATOM 1529 N CYS A 95 -3.824 12.893 -8.214 1.00 64.14 N ATOM 1530 CA CYS A 95 -3.740 12.372 -6.861 1.00 53.11 C ATOM 1531 C CYS A 95 -3.221 13.435 -5.899 1.00 13.40 C ATOM 1532 O CYS A 95 -2.126 13.976 -6.083 1.00 41.22 O ATOM 1533 CB CYS A 95 -2.837 11.134 -6.828 1.00 64.10 C ATOM 1534 SG CYS A 95 -1.204 11.382 -7.564 1.00 41.35 S ATOM 0 H CYS A 95 -3.267 13.731 -8.380 1.00 64.14 H new ATOM 0 HA CYS A 95 -4.742 12.087 -6.540 1.00 53.11 H new ATOM 0 HB2 CYS A 95 -2.711 10.818 -5.792 1.00 64.10 H new ATOM 0 HB3 CYS A 95 -3.338 10.319 -7.351 1.00 64.10 H new ATOM 0 HG CYS A 95 -0.397 10.450 -7.153 1.00 41.35 H new ATOM 1540 N PRO A 96 -4.016 13.771 -4.874 1.00 70.24 N ATOM 1541 CA PRO A 96 -3.613 14.719 -3.839 1.00 15.11 C ATOM 1542 C PRO A 96 -2.495 14.164 -2.962 1.00 41.32 C ATOM 1543 O PRO A 96 -2.743 13.417 -2.013 1.00 31.21 O ATOM 1544 CB PRO A 96 -4.888 14.941 -3.012 1.00 4.11 C ATOM 1545 CG PRO A 96 -5.996 14.373 -3.835 1.00 44.21 C ATOM 1546 CD PRO A 96 -5.380 13.276 -4.653 1.00 64.13 C ATOM 0 HA PRO A 96 -3.217 15.640 -4.268 1.00 15.11 H new ATOM 0 HB2 PRO A 96 -4.821 14.443 -2.045 1.00 4.11 H new ATOM 0 HB3 PRO A 96 -5.049 16.001 -2.814 1.00 4.11 H new ATOM 0 HG2 PRO A 96 -6.795 13.987 -3.202 1.00 44.21 H new ATOM 0 HG3 PRO A 96 -6.438 15.136 -4.475 1.00 44.21 H new ATOM 0 HD2 PRO A 96 -5.385 12.323 -4.123 1.00 64.13 H new ATOM 0 HD3 PRO A 96 -5.913 13.122 -5.591 1.00 64.13 H new ATOM 1554 N ASP A 97 -1.264 14.519 -3.306 1.00 3.15 N ATOM 1555 CA ASP A 97 -0.087 14.084 -2.558 1.00 1.40 C ATOM 1556 C ASP A 97 -0.065 14.720 -1.173 1.00 61.04 C ATOM 1557 O ASP A 97 0.525 14.187 -0.234 1.00 11.41 O ATOM 1558 CB ASP A 97 1.185 14.454 -3.326 1.00 10.44 C ATOM 1559 CG ASP A 97 2.444 14.004 -2.618 1.00 31.12 C ATOM 1560 OD1 ASP A 97 2.717 12.792 -2.606 1.00 3.32 O ATOM 1561 OD2 ASP A 97 3.175 14.861 -2.083 1.00 44.14 O ATOM 0 H ASP A 97 -1.051 15.114 -4.107 1.00 3.15 H new ATOM 0 HA ASP A 97 -0.132 13.001 -2.439 1.00 1.40 H new ATOM 0 HB2 ASP A 97 1.150 14.004 -4.318 1.00 10.44 H new ATOM 0 HB3 ASP A 97 1.218 15.534 -3.467 1.00 10.44 H new ATOM 1566 N THR A 98 -0.739 15.850 -1.058 1.00 52.12 N ATOM 1567 CA THR A 98 -0.804 16.601 0.184 1.00 74.01 C ATOM 1568 C THR A 98 -1.718 15.931 1.212 1.00 21.34 C ATOM 1569 O THR A 98 -1.789 16.359 2.368 1.00 31.12 O ATOM 1570 CB THR A 98 -1.300 18.024 -0.107 1.00 64.52 C ATOM 1571 OG1 THR A 98 -2.236 17.980 -1.197 1.00 4.05 O ATOM 1572 CG2 THR A 98 -0.140 18.943 -0.458 1.00 64.51 C ATOM 0 H THR A 98 -1.259 16.275 -1.826 1.00 52.12 H new ATOM 0 HA THR A 98 0.199 16.633 0.611 1.00 74.01 H new ATOM 0 HB THR A 98 -1.785 18.419 0.786 1.00 64.52 H new ATOM 0 HG1 THR A 98 -2.559 18.885 -1.388 1.00 4.05 H new ATOM 0 HG21 THR A 98 -0.518 19.945 -0.660 1.00 64.51 H new ATOM 0 HG22 THR A 98 0.560 18.980 0.377 1.00 64.51 H new ATOM 0 HG23 THR A 98 0.371 18.563 -1.343 1.00 64.51 H new ATOM 1580 N ALA A 99 -2.400 14.871 0.794 1.00 23.54 N ATOM 1581 CA ALA A 99 -3.327 14.159 1.662 1.00 42.21 C ATOM 1582 C ALA A 99 -2.624 13.025 2.411 1.00 31.10 C ATOM 1583 O ALA A 99 -1.401 13.033 2.560 1.00 41.14 O ATOM 1584 CB ALA A 99 -4.493 13.620 0.844 1.00 25.21 C ATOM 0 H ALA A 99 -2.327 14.485 -0.147 1.00 23.54 H new ATOM 0 HA ALA A 99 -3.709 14.859 2.405 1.00 42.21 H new ATOM 0 HB1 ALA A 99 -5.183 13.088 1.500 1.00 25.21 H new ATOM 0 HB2 ALA A 99 -5.014 14.448 0.364 1.00 25.21 H new ATOM 0 HB3 ALA A 99 -4.118 12.937 0.082 1.00 25.21 H new ATOM 1590 N LYS A 100 -3.423 12.075 2.893 1.00 72.40 N ATOM 1591 CA LYS A 100 -2.942 10.917 3.649 1.00 54.13 C ATOM 1592 C LYS A 100 -1.735 10.256 2.981 1.00 63.13 C ATOM 1593 O LYS A 100 -1.757 9.952 1.785 1.00 60.33 O ATOM 1594 CB LYS A 100 -4.084 9.905 3.791 1.00 54.15 C ATOM 1595 CG LYS A 100 -3.717 8.644 4.557 1.00 74.25 C ATOM 1596 CD LYS A 100 -4.918 7.727 4.717 1.00 4.51 C ATOM 1597 CE LYS A 100 -6.006 8.367 5.571 1.00 74.21 C ATOM 1598 NZ LYS A 100 -7.228 7.522 5.640 1.00 74.41 N ATOM 0 H LYS A 100 -4.435 12.087 2.769 1.00 72.40 H new ATOM 0 HA LYS A 100 -2.617 11.261 4.631 1.00 54.13 H new ATOM 0 HB2 LYS A 100 -4.921 10.389 4.293 1.00 54.15 H new ATOM 0 HB3 LYS A 100 -4.429 9.623 2.796 1.00 54.15 H new ATOM 0 HG2 LYS A 100 -2.921 8.116 4.032 1.00 74.25 H new ATOM 0 HG3 LYS A 100 -3.328 8.913 5.539 1.00 74.25 H new ATOM 0 HD2 LYS A 100 -5.323 7.483 3.735 1.00 4.51 H new ATOM 0 HD3 LYS A 100 -4.602 6.789 5.174 1.00 4.51 H new ATOM 0 HE2 LYS A 100 -5.624 8.536 6.578 1.00 74.21 H new ATOM 0 HE3 LYS A 100 -6.263 9.343 5.160 1.00 74.21 H new ATOM 0 HZ1 LYS A 100 -7.943 7.993 6.230 1.00 74.41 H new ATOM 0 HZ2 LYS A 100 -7.608 7.382 4.682 1.00 74.41 H new ATOM 0 HZ3 LYS A 100 -6.989 6.599 6.056 1.00 74.41 H new ATOM 1612 N VAL A 101 -0.692 10.015 3.774 1.00 33.42 N ATOM 1613 CA VAL A 101 0.557 9.467 3.257 1.00 61.13 C ATOM 1614 C VAL A 101 0.364 8.040 2.741 1.00 71.14 C ATOM 1615 O VAL A 101 1.046 7.609 1.809 1.00 60.33 O ATOM 1616 CB VAL A 101 1.680 9.500 4.326 1.00 63.21 C ATOM 1617 CG1 VAL A 101 1.368 8.582 5.495 1.00 54.45 C ATOM 1618 CG2 VAL A 101 3.025 9.141 3.715 1.00 44.34 C ATOM 0 H VAL A 101 -0.689 10.192 4.779 1.00 33.42 H new ATOM 0 HA VAL A 101 0.862 10.099 2.423 1.00 61.13 H new ATOM 0 HB VAL A 101 1.733 10.520 4.707 1.00 63.21 H new ATOM 0 HG11 VAL A 101 2.178 8.632 6.223 1.00 54.45 H new ATOM 0 HG12 VAL A 101 0.437 8.896 5.966 1.00 54.45 H new ATOM 0 HG13 VAL A 101 1.266 7.558 5.136 1.00 54.45 H new ATOM 0 HG21 VAL A 101 3.795 9.172 4.486 1.00 44.34 H new ATOM 0 HG22 VAL A 101 2.976 8.138 3.291 1.00 44.34 H new ATOM 0 HG23 VAL A 101 3.270 9.856 2.929 1.00 44.34 H new ATOM 1628 N LYS A 102 -0.589 7.322 3.330 1.00 30.13 N ATOM 1629 CA LYS A 102 -0.914 5.966 2.895 1.00 44.15 C ATOM 1630 C LYS A 102 -1.395 5.959 1.449 1.00 4.42 C ATOM 1631 O LYS A 102 -1.278 4.954 0.749 1.00 45.35 O ATOM 1632 CB LYS A 102 -1.999 5.349 3.786 1.00 15.34 C ATOM 1633 CG LYS A 102 -1.477 4.661 5.040 1.00 31.03 C ATOM 1634 CD LYS A 102 -0.804 5.632 5.996 1.00 34.32 C ATOM 1635 CE LYS A 102 -0.296 4.917 7.238 1.00 4.02 C ATOM 1636 NZ LYS A 102 0.694 3.862 6.902 1.00 42.05 N ATOM 0 H LYS A 102 -1.151 7.658 4.112 1.00 30.13 H new ATOM 0 HA LYS A 102 -0.003 5.373 2.975 1.00 44.15 H new ATOM 0 HB2 LYS A 102 -2.696 6.133 4.082 1.00 15.34 H new ATOM 0 HB3 LYS A 102 -2.564 4.625 3.199 1.00 15.34 H new ATOM 0 HG2 LYS A 102 -2.303 4.167 5.551 1.00 31.03 H new ATOM 0 HG3 LYS A 102 -0.767 3.884 4.756 1.00 31.03 H new ATOM 0 HD2 LYS A 102 0.027 6.126 5.492 1.00 34.32 H new ATOM 0 HD3 LYS A 102 -1.510 6.411 6.285 1.00 34.32 H new ATOM 0 HE2 LYS A 102 0.160 5.641 7.913 1.00 4.02 H new ATOM 0 HE3 LYS A 102 -1.136 4.471 7.770 1.00 4.02 H new ATOM 0 HZ1 LYS A 102 1.201 3.575 7.763 1.00 42.05 H new ATOM 0 HZ2 LYS A 102 0.201 3.039 6.499 1.00 42.05 H new ATOM 0 HZ3 LYS A 102 1.374 4.232 6.207 1.00 42.05 H new ATOM 1650 N LYS A 103 -1.931 7.089 1.009 1.00 24.14 N ATOM 1651 CA LYS A 103 -2.487 7.195 -0.327 1.00 24.41 C ATOM 1652 C LYS A 103 -1.397 7.543 -1.338 1.00 33.24 C ATOM 1653 O LYS A 103 -1.337 6.960 -2.420 1.00 51.23 O ATOM 1654 CB LYS A 103 -3.602 8.247 -0.360 1.00 71.20 C ATOM 1655 CG LYS A 103 -4.602 8.055 -1.496 1.00 2.44 C ATOM 1656 CD LYS A 103 -5.748 7.116 -1.110 1.00 65.12 C ATOM 1657 CE LYS A 103 -5.261 5.718 -0.749 1.00 74.00 C ATOM 1658 NZ LYS A 103 -6.383 4.769 -0.509 1.00 61.52 N ATOM 0 H LYS A 103 -1.991 7.945 1.561 1.00 24.14 H new ATOM 0 HA LYS A 103 -2.912 6.229 -0.599 1.00 24.41 H new ATOM 0 HB2 LYS A 103 -4.137 8.224 0.589 1.00 71.20 H new ATOM 0 HB3 LYS A 103 -3.152 9.236 -0.449 1.00 71.20 H new ATOM 0 HG2 LYS A 103 -5.011 9.023 -1.785 1.00 2.44 H new ATOM 0 HG3 LYS A 103 -4.085 7.654 -2.368 1.00 2.44 H new ATOM 0 HD2 LYS A 103 -6.290 7.538 -0.264 1.00 65.12 H new ATOM 0 HD3 LYS A 103 -6.453 7.049 -1.939 1.00 65.12 H new ATOM 0 HE2 LYS A 103 -4.632 5.337 -1.553 1.00 74.00 H new ATOM 0 HE3 LYS A 103 -4.638 5.773 0.144 1.00 74.00 H new ATOM 0 HZ1 LYS A 103 -6.027 3.793 -0.553 1.00 61.52 H new ATOM 0 HZ2 LYS A 103 -6.793 4.946 0.430 1.00 61.52 H new ATOM 0 HZ3 LYS A 103 -7.114 4.904 -1.237 1.00 61.52 H new ATOM 1672 N LYS A 104 -0.516 8.478 -0.982 1.00 21.13 N ATOM 1673 CA LYS A 104 0.529 8.913 -1.908 1.00 61.54 C ATOM 1674 C LYS A 104 1.625 7.859 -2.053 1.00 21.54 C ATOM 1675 O LYS A 104 2.407 7.891 -3.002 1.00 63.13 O ATOM 1676 CB LYS A 104 1.119 10.282 -1.505 1.00 45.22 C ATOM 1677 CG LYS A 104 1.742 10.370 -0.111 1.00 54.51 C ATOM 1678 CD LYS A 104 3.106 9.684 -0.013 1.00 53.52 C ATOM 1679 CE LYS A 104 4.099 10.175 -1.067 1.00 51.42 C ATOM 1680 NZ LYS A 104 4.344 11.639 -0.989 1.00 30.21 N ATOM 0 H LYS A 104 -0.504 8.942 -0.074 1.00 21.13 H new ATOM 0 HA LYS A 104 0.059 9.036 -2.884 1.00 61.54 H new ATOM 0 HB2 LYS A 104 1.879 10.555 -2.237 1.00 45.22 H new ATOM 0 HB3 LYS A 104 0.328 11.029 -1.573 1.00 45.22 H new ATOM 0 HG2 LYS A 104 1.850 11.419 0.166 1.00 54.51 H new ATOM 0 HG3 LYS A 104 1.063 9.918 0.612 1.00 54.51 H new ATOM 0 HD2 LYS A 104 3.523 9.857 0.979 1.00 53.52 H new ATOM 0 HD3 LYS A 104 2.974 8.607 -0.120 1.00 53.52 H new ATOM 0 HE2 LYS A 104 5.044 9.646 -0.944 1.00 51.42 H new ATOM 0 HE3 LYS A 104 3.722 9.927 -2.059 1.00 51.42 H new ATOM 0 HZ1 LYS A 104 5.239 11.867 -1.466 1.00 30.21 H new ATOM 0 HZ2 LYS A 104 3.565 12.147 -1.454 1.00 30.21 H new ATOM 0 HZ3 LYS A 104 4.400 11.929 0.008 1.00 30.21 H new ATOM 1694 N MET A 105 1.683 6.927 -1.112 1.00 21.33 N ATOM 1695 CA MET A 105 2.650 5.839 -1.184 1.00 75.52 C ATOM 1696 C MET A 105 2.290 4.921 -2.348 1.00 72.04 C ATOM 1697 O MET A 105 3.157 4.349 -3.007 1.00 62.14 O ATOM 1698 CB MET A 105 2.666 5.058 0.138 1.00 63.12 C ATOM 1699 CG MET A 105 3.953 4.277 0.392 1.00 5.24 C ATOM 1700 SD MET A 105 4.131 2.813 -0.646 1.00 41.13 S ATOM 1701 CE MET A 105 5.787 2.288 -0.210 1.00 11.24 C ATOM 0 H MET A 105 1.075 6.901 -0.293 1.00 21.33 H new ATOM 0 HA MET A 105 3.647 6.247 -1.349 1.00 75.52 H new ATOM 0 HB2 MET A 105 2.510 5.756 0.961 1.00 63.12 H new ATOM 0 HB3 MET A 105 1.826 4.363 0.146 1.00 63.12 H new ATOM 0 HG2 MET A 105 4.806 4.935 0.225 1.00 5.24 H new ATOM 0 HG3 MET A 105 3.983 3.975 1.439 1.00 5.24 H new ATOM 0 HE1 MET A 105 6.044 1.390 -0.772 1.00 11.24 H new ATOM 0 HE2 MET A 105 6.495 3.081 -0.450 1.00 11.24 H new ATOM 0 HE3 MET A 105 5.831 2.073 0.858 1.00 11.24 H new ATOM 1711 N LEU A 106 0.996 4.838 -2.624 1.00 34.42 N ATOM 1712 CA LEU A 106 0.472 3.933 -3.637 1.00 25.43 C ATOM 1713 C LEU A 106 0.879 4.372 -5.039 1.00 51.54 C ATOM 1714 O LEU A 106 1.411 3.582 -5.824 1.00 63.31 O ATOM 1715 CB LEU A 106 -1.048 3.890 -3.545 1.00 44.44 C ATOM 1716 CG LEU A 106 -1.618 3.692 -2.147 1.00 61.14 C ATOM 1717 CD1 LEU A 106 -3.131 3.691 -2.206 1.00 73.34 C ATOM 1718 CD2 LEU A 106 -1.107 2.401 -1.535 1.00 43.32 C ATOM 0 H LEU A 106 0.282 5.394 -2.154 1.00 34.42 H new ATOM 0 HA LEU A 106 0.889 2.943 -3.453 1.00 25.43 H new ATOM 0 HB2 LEU A 106 -1.445 4.820 -3.951 1.00 44.44 H new ATOM 0 HB3 LEU A 106 -1.410 3.084 -4.183 1.00 44.44 H new ATOM 0 HG LEU A 106 -1.289 4.516 -1.514 1.00 61.14 H new ATOM 0 HD11 LEU A 106 -3.534 3.549 -1.203 1.00 73.34 H new ATOM 0 HD12 LEU A 106 -3.480 4.643 -2.606 1.00 73.34 H new ATOM 0 HD13 LEU A 106 -3.469 2.880 -2.851 1.00 73.34 H new ATOM 0 HD21 LEU A 106 -1.527 2.280 -0.537 1.00 43.32 H new ATOM 0 HD22 LEU A 106 -1.407 1.559 -2.159 1.00 43.32 H new ATOM 0 HD23 LEU A 106 -0.020 2.435 -1.469 1.00 43.32 H new ATOM 1730 N TYR A 107 0.623 5.636 -5.357 1.00 62.21 N ATOM 1731 CA TYR A 107 0.910 6.150 -6.690 1.00 51.02 C ATOM 1732 C TYR A 107 2.417 6.271 -6.888 1.00 21.23 C ATOM 1733 O TYR A 107 2.906 6.333 -8.014 1.00 14.11 O ATOM 1734 CB TYR A 107 0.212 7.501 -6.926 1.00 65.21 C ATOM 1735 CG TYR A 107 1.054 8.722 -6.610 1.00 4.43 C ATOM 1736 CD1 TYR A 107 1.855 9.303 -7.587 1.00 54.14 C ATOM 1737 CD2 TYR A 107 1.043 9.296 -5.347 1.00 62.32 C ATOM 1738 CE1 TYR A 107 2.623 10.415 -7.312 1.00 45.21 C ATOM 1739 CE2 TYR A 107 1.808 10.413 -5.066 1.00 23.42 C ATOM 1740 CZ TYR A 107 2.596 10.967 -6.051 1.00 33.12 C ATOM 1741 OH TYR A 107 3.355 12.082 -5.779 1.00 2.30 O ATOM 0 H TYR A 107 0.220 6.319 -4.715 1.00 62.21 H new ATOM 0 HA TYR A 107 0.517 5.447 -7.424 1.00 51.02 H new ATOM 0 HB2 TYR A 107 -0.101 7.554 -7.969 1.00 65.21 H new ATOM 0 HB3 TYR A 107 -0.693 7.536 -6.320 1.00 65.21 H new ATOM 0 HD1 TYR A 107 1.876 8.876 -8.579 1.00 54.14 H new ATOM 0 HD2 TYR A 107 0.428 8.864 -4.572 1.00 62.32 H new ATOM 0 HE1 TYR A 107 3.243 10.851 -8.082 1.00 45.21 H new ATOM 0 HE2 TYR A 107 1.788 10.849 -4.078 1.00 23.42 H new ATOM 0 HH TYR A 107 3.236 12.338 -4.841 1.00 2.30 H new ATOM 1751 N SER A 108 3.142 6.265 -5.779 1.00 51.24 N ATOM 1752 CA SER A 108 4.586 6.455 -5.799 1.00 61.15 C ATOM 1753 C SER A 108 5.252 5.374 -6.651 1.00 71.14 C ATOM 1754 O SER A 108 6.161 5.652 -7.434 1.00 74.41 O ATOM 1755 CB SER A 108 5.139 6.431 -4.369 1.00 13.35 C ATOM 1756 OG SER A 108 6.508 6.804 -4.326 1.00 33.32 O ATOM 0 H SER A 108 2.751 6.130 -4.847 1.00 51.24 H new ATOM 0 HA SER A 108 4.808 7.426 -6.242 1.00 61.15 H new ATOM 0 HB2 SER A 108 4.558 7.109 -3.743 1.00 13.35 H new ATOM 0 HB3 SER A 108 5.021 5.431 -3.951 1.00 13.35 H new ATOM 0 HG SER A 108 6.825 6.779 -3.399 1.00 33.32 H new ATOM 1762 N SER A 109 4.777 4.146 -6.510 1.00 31.01 N ATOM 1763 CA SER A 109 5.313 3.037 -7.275 1.00 54.45 C ATOM 1764 C SER A 109 4.646 2.940 -8.650 1.00 43.33 C ATOM 1765 O SER A 109 5.309 2.663 -9.653 1.00 4.33 O ATOM 1766 CB SER A 109 5.109 1.731 -6.510 1.00 55.12 C ATOM 1767 OG SER A 109 5.540 1.848 -5.166 1.00 44.40 O ATOM 0 H SER A 109 4.022 3.895 -5.872 1.00 31.01 H new ATOM 0 HA SER A 109 6.379 3.211 -7.423 1.00 54.45 H new ATOM 0 HB2 SER A 109 4.055 1.455 -6.533 1.00 55.12 H new ATOM 0 HB3 SER A 109 5.660 0.929 -7.002 1.00 55.12 H new ATOM 0 HG SER A 109 6.504 2.025 -5.146 1.00 44.40 H new ATOM 1773 N SER A 110 3.340 3.186 -8.696 1.00 4.01 N ATOM 1774 CA SER A 110 2.563 2.958 -9.910 1.00 21.22 C ATOM 1775 C SER A 110 2.804 4.030 -10.972 1.00 15.12 C ATOM 1776 O SER A 110 2.637 3.763 -12.162 1.00 53.33 O ATOM 1777 CB SER A 110 1.074 2.859 -9.569 1.00 40.34 C ATOM 1778 OG SER A 110 0.682 3.895 -8.689 1.00 62.31 O ATOM 0 H SER A 110 2.798 3.542 -7.909 1.00 4.01 H new ATOM 0 HA SER A 110 2.899 2.014 -10.338 1.00 21.22 H new ATOM 0 HB2 SER A 110 0.484 2.913 -10.484 1.00 40.34 H new ATOM 0 HB3 SER A 110 0.866 1.892 -9.112 1.00 40.34 H new ATOM 0 HG SER A 110 0.845 3.617 -7.763 1.00 62.31 H new ATOM 1784 N PHE A 111 3.208 5.227 -10.547 1.00 12.53 N ATOM 1785 CA PHE A 111 3.460 6.333 -11.473 1.00 33.23 C ATOM 1786 C PHE A 111 4.495 5.937 -12.526 1.00 72.20 C ATOM 1787 O PHE A 111 4.335 6.227 -13.709 1.00 60.32 O ATOM 1788 CB PHE A 111 3.931 7.579 -10.705 1.00 65.31 C ATOM 1789 CG PHE A 111 4.117 8.803 -11.565 1.00 73.21 C ATOM 1790 CD1 PHE A 111 5.332 9.050 -12.188 1.00 0.43 C ATOM 1791 CD2 PHE A 111 3.080 9.708 -11.750 1.00 41.20 C ATOM 1792 CE1 PHE A 111 5.509 10.171 -12.977 1.00 24.33 C ATOM 1793 CE2 PHE A 111 3.252 10.829 -12.539 1.00 51.15 C ATOM 1794 CZ PHE A 111 4.467 11.061 -13.154 1.00 5.42 C ATOM 0 H PHE A 111 3.368 5.457 -9.566 1.00 12.53 H new ATOM 0 HA PHE A 111 2.526 6.568 -11.983 1.00 33.23 H new ATOM 0 HB2 PHE A 111 3.206 7.805 -9.923 1.00 65.31 H new ATOM 0 HB3 PHE A 111 4.874 7.351 -10.209 1.00 65.31 H new ATOM 0 HD1 PHE A 111 6.150 8.357 -12.055 1.00 0.43 H new ATOM 0 HD2 PHE A 111 2.128 9.533 -11.271 1.00 41.20 H new ATOM 0 HE1 PHE A 111 6.461 10.351 -13.455 1.00 24.33 H new ATOM 0 HE2 PHE A 111 2.437 11.524 -12.675 1.00 51.15 H new ATOM 0 HZ PHE A 111 4.602 11.936 -13.772 1.00 5.42 H new ATOM 1804 N ASP A 112 5.561 5.282 -12.094 1.00 13.03 N ATOM 1805 CA ASP A 112 6.593 4.827 -13.019 1.00 32.12 C ATOM 1806 C ASP A 112 6.219 3.479 -13.635 1.00 33.03 C ATOM 1807 O ASP A 112 6.676 3.133 -14.724 1.00 70.12 O ATOM 1808 CB ASP A 112 7.946 4.739 -12.309 1.00 0.01 C ATOM 1809 CG ASP A 112 9.096 4.499 -13.269 1.00 31.02 C ATOM 1810 OD1 ASP A 112 9.267 5.299 -14.213 1.00 33.51 O ATOM 1811 OD2 ASP A 112 9.855 3.528 -13.069 1.00 1.31 O ATOM 0 H ASP A 112 5.736 5.053 -11.115 1.00 13.03 H new ATOM 0 HA ASP A 112 6.672 5.555 -13.826 1.00 32.12 H new ATOM 0 HB2 ASP A 112 8.124 5.663 -11.759 1.00 0.01 H new ATOM 0 HB3 ASP A 112 7.915 3.933 -11.576 1.00 0.01 H new ATOM 1816 N ALA A 113 5.369 2.730 -12.940 1.00 0.11 N ATOM 1817 CA ALA A 113 4.968 1.398 -13.386 1.00 4.00 C ATOM 1818 C ALA A 113 4.156 1.428 -14.683 1.00 73.34 C ATOM 1819 O ALA A 113 4.439 0.666 -15.607 1.00 25.51 O ATOM 1820 CB ALA A 113 4.180 0.695 -12.293 1.00 64.25 C ATOM 0 H ALA A 113 4.942 3.024 -12.061 1.00 0.11 H new ATOM 0 HA ALA A 113 5.883 0.844 -13.595 1.00 4.00 H new ATOM 0 HB1 ALA A 113 3.886 -0.297 -12.637 1.00 64.25 H new ATOM 0 HB2 ALA A 113 4.799 0.601 -11.401 1.00 64.25 H new ATOM 0 HB3 ALA A 113 3.288 1.276 -12.056 1.00 64.25 H new ATOM 1826 N LEU A 114 3.151 2.302 -14.765 1.00 31.44 N ATOM 1827 CA LEU A 114 2.269 2.313 -15.936 1.00 13.44 C ATOM 1828 C LEU A 114 2.971 2.924 -17.139 1.00 54.25 C ATOM 1829 O LEU A 114 2.559 2.712 -18.279 1.00 22.12 O ATOM 1830 CB LEU A 114 0.932 3.028 -15.662 1.00 32.40 C ATOM 1831 CG LEU A 114 0.913 4.553 -15.811 1.00 24.42 C ATOM 1832 CD1 LEU A 114 -0.520 5.055 -15.806 1.00 34.15 C ATOM 1833 CD2 LEU A 114 1.695 5.220 -14.697 1.00 12.10 C ATOM 0 H LEU A 114 2.929 2.997 -14.052 1.00 31.44 H new ATOM 0 HA LEU A 114 2.032 1.273 -16.161 1.00 13.44 H new ATOM 0 HB2 LEU A 114 0.182 2.613 -16.335 1.00 32.40 H new ATOM 0 HB3 LEU A 114 0.619 2.783 -14.647 1.00 32.40 H new ATOM 0 HG LEU A 114 1.385 4.808 -16.760 1.00 24.42 H new ATOM 0 HD11 LEU A 114 -0.526 6.140 -15.912 1.00 34.15 H new ATOM 0 HD12 LEU A 114 -1.066 4.606 -16.636 1.00 34.15 H new ATOM 0 HD13 LEU A 114 -0.999 4.780 -14.866 1.00 34.15 H new ATOM 0 HD21 LEU A 114 1.664 6.302 -14.828 1.00 12.10 H new ATOM 0 HD22 LEU A 114 1.253 4.958 -13.735 1.00 12.10 H new ATOM 0 HD23 LEU A 114 2.730 4.880 -14.725 1.00 12.10 H new ATOM 1845 N LYS A 115 4.043 3.670 -16.881 1.00 71.41 N ATOM 1846 CA LYS A 115 4.883 4.217 -17.947 1.00 20.34 C ATOM 1847 C LYS A 115 5.431 3.092 -18.821 1.00 53.20 C ATOM 1848 O LYS A 115 5.747 3.292 -19.990 1.00 74.54 O ATOM 1849 CB LYS A 115 6.042 5.011 -17.348 1.00 54.20 C ATOM 1850 CG LYS A 115 5.615 6.280 -16.632 1.00 1.55 C ATOM 1851 CD LYS A 115 6.747 6.889 -15.810 1.00 3.53 C ATOM 1852 CE LYS A 115 7.993 7.172 -16.638 1.00 74.12 C ATOM 1853 NZ LYS A 115 8.869 5.976 -16.785 1.00 64.32 N ATOM 0 H LYS A 115 4.352 3.911 -15.939 1.00 71.41 H new ATOM 0 HA LYS A 115 4.273 4.879 -18.561 1.00 20.34 H new ATOM 0 HB2 LYS A 115 6.581 4.374 -16.647 1.00 54.20 H new ATOM 0 HB3 LYS A 115 6.740 5.272 -18.144 1.00 54.20 H new ATOM 0 HG2 LYS A 115 5.268 7.009 -17.365 1.00 1.55 H new ATOM 0 HG3 LYS A 115 4.772 6.059 -15.978 1.00 1.55 H new ATOM 0 HD2 LYS A 115 6.401 7.817 -15.355 1.00 3.53 H new ATOM 0 HD3 LYS A 115 7.004 6.211 -14.996 1.00 3.53 H new ATOM 0 HE2 LYS A 115 7.696 7.523 -17.626 1.00 74.12 H new ATOM 0 HE3 LYS A 115 8.560 7.977 -16.171 1.00 74.12 H new ATOM 0 HZ1 LYS A 115 9.844 6.282 -16.979 1.00 64.32 H new ATOM 0 HZ2 LYS A 115 8.849 5.421 -15.906 1.00 64.32 H new ATOM 0 HZ3 LYS A 115 8.527 5.390 -17.573 1.00 64.32 H new ATOM 1867 N LYS A 116 5.531 1.913 -18.228 1.00 42.44 N ATOM 1868 CA LYS A 116 6.000 0.723 -18.919 1.00 11.45 C ATOM 1869 C LYS A 116 4.899 0.149 -19.815 1.00 44.03 C ATOM 1870 O LYS A 116 5.174 -0.455 -20.852 1.00 72.31 O ATOM 1871 CB LYS A 116 6.470 -0.295 -17.864 1.00 50.14 C ATOM 1872 CG LYS A 116 6.695 -1.719 -18.362 1.00 44.12 C ATOM 1873 CD LYS A 116 5.425 -2.559 -18.274 1.00 21.20 C ATOM 1874 CE LYS A 116 4.824 -2.544 -16.871 1.00 25.32 C ATOM 1875 NZ LYS A 116 5.769 -3.057 -15.843 1.00 62.10 N ATOM 0 H LYS A 116 5.288 1.754 -17.250 1.00 42.44 H new ATOM 0 HA LYS A 116 6.837 0.970 -19.573 1.00 11.45 H new ATOM 0 HB2 LYS A 116 7.401 0.067 -17.428 1.00 50.14 H new ATOM 0 HB3 LYS A 116 5.732 -0.324 -17.062 1.00 50.14 H new ATOM 0 HG2 LYS A 116 7.042 -1.692 -19.395 1.00 44.12 H new ATOM 0 HG3 LYS A 116 7.483 -2.189 -17.774 1.00 44.12 H new ATOM 0 HD2 LYS A 116 4.691 -2.182 -18.986 1.00 21.20 H new ATOM 0 HD3 LYS A 116 5.649 -3.586 -18.561 1.00 21.20 H new ATOM 0 HE2 LYS A 116 4.531 -1.526 -16.615 1.00 25.32 H new ATOM 0 HE3 LYS A 116 3.917 -3.149 -16.861 1.00 25.32 H new ATOM 0 HZ1 LYS A 116 5.283 -3.123 -14.926 1.00 62.10 H new ATOM 0 HZ2 LYS A 116 6.108 -3.999 -16.123 1.00 62.10 H new ATOM 0 HZ3 LYS A 116 6.578 -2.408 -15.760 1.00 62.10 H new ATOM 1889 N SER A 117 3.654 0.356 -19.416 1.00 1.51 N ATOM 1890 CA SER A 117 2.517 -0.184 -20.148 1.00 42.12 C ATOM 1891 C SER A 117 2.101 0.757 -21.278 1.00 11.24 C ATOM 1892 O SER A 117 1.957 0.337 -22.428 1.00 60.23 O ATOM 1893 CB SER A 117 1.356 -0.415 -19.185 1.00 32.35 C ATOM 1894 OG SER A 117 1.814 -1.052 -18.003 1.00 52.40 O ATOM 0 H SER A 117 3.404 0.895 -18.587 1.00 1.51 H new ATOM 0 HA SER A 117 2.804 -1.135 -20.597 1.00 42.12 H new ATOM 0 HB2 SER A 117 0.888 0.537 -18.935 1.00 32.35 H new ATOM 0 HB3 SER A 117 0.594 -1.029 -19.665 1.00 32.35 H new ATOM 0 HG SER A 117 1.478 -1.972 -17.976 1.00 52.40 H new ATOM 1900 N LEU A 118 1.933 2.035 -20.953 1.00 62.43 N ATOM 1901 CA LEU A 118 1.568 3.038 -21.947 1.00 64.02 C ATOM 1902 C LEU A 118 2.817 3.706 -22.516 1.00 23.13 C ATOM 1903 O LEU A 118 2.787 4.873 -22.916 1.00 20.21 O ATOM 1904 CB LEU A 118 0.604 4.075 -21.346 1.00 44.44 C ATOM 1905 CG LEU A 118 0.954 4.623 -19.956 1.00 52.41 C ATOM 1906 CD1 LEU A 118 2.130 5.587 -20.007 1.00 11.12 C ATOM 1907 CD2 LEU A 118 -0.259 5.304 -19.352 1.00 25.41 C ATOM 0 H LEU A 118 2.044 2.401 -20.007 1.00 62.43 H new ATOM 0 HA LEU A 118 1.050 2.541 -22.767 1.00 64.02 H new ATOM 0 HB2 LEU A 118 0.538 4.916 -22.036 1.00 44.44 H new ATOM 0 HB3 LEU A 118 -0.388 3.626 -21.294 1.00 44.44 H new ATOM 0 HG LEU A 118 1.250 3.782 -19.329 1.00 52.41 H new ATOM 0 HD11 LEU A 118 2.345 5.952 -19.003 1.00 11.12 H new ATOM 0 HD12 LEU A 118 3.006 5.072 -20.401 1.00 11.12 H new ATOM 0 HD13 LEU A 118 1.883 6.429 -20.654 1.00 11.12 H new ATOM 0 HD21 LEU A 118 -0.005 5.691 -18.365 1.00 25.41 H new ATOM 0 HD22 LEU A 118 -0.572 6.126 -19.995 1.00 25.41 H new ATOM 0 HD23 LEU A 118 -1.073 4.584 -19.261 1.00 25.41 H new ATOM 1919 N VAL A 119 3.905 2.939 -22.566 1.00 54.03 N ATOM 1920 CA VAL A 119 5.188 3.429 -23.053 1.00 45.12 C ATOM 1921 C VAL A 119 5.042 4.089 -24.426 1.00 71.05 C ATOM 1922 O VAL A 119 4.375 3.562 -25.322 1.00 61.34 O ATOM 1923 CB VAL A 119 6.238 2.290 -23.111 1.00 71.12 C ATOM 1924 CG1 VAL A 119 5.781 1.165 -24.029 1.00 2.51 C ATOM 1925 CG2 VAL A 119 7.596 2.823 -23.548 1.00 3.22 C ATOM 0 H VAL A 119 3.919 1.963 -22.270 1.00 54.03 H new ATOM 0 HA VAL A 119 5.539 4.181 -22.347 1.00 45.12 H new ATOM 0 HB VAL A 119 6.339 1.882 -22.105 1.00 71.12 H new ATOM 0 HG11 VAL A 119 6.538 0.381 -24.049 1.00 2.51 H new ATOM 0 HG12 VAL A 119 4.842 0.753 -23.660 1.00 2.51 H new ATOM 0 HG13 VAL A 119 5.635 1.554 -25.037 1.00 2.51 H new ATOM 0 HG21 VAL A 119 8.315 2.004 -23.581 1.00 3.22 H new ATOM 0 HG22 VAL A 119 7.510 3.270 -24.538 1.00 3.22 H new ATOM 0 HG23 VAL A 119 7.937 3.577 -22.838 1.00 3.22 H new ATOM 1935 N GLY A 120 5.647 5.256 -24.568 1.00 13.11 N ATOM 1936 CA GLY A 120 5.528 6.014 -25.795 1.00 50.53 C ATOM 1937 C GLY A 120 4.939 7.383 -25.543 1.00 52.42 C ATOM 1938 O GLY A 120 5.025 8.271 -26.393 1.00 23.22 O ATOM 0 H GLY A 120 6.223 5.695 -23.850 1.00 13.11 H new ATOM 0 HA2 GLY A 120 6.510 6.118 -26.257 1.00 50.53 H new ATOM 0 HA3 GLY A 120 4.900 5.470 -26.501 1.00 50.53 H new ATOM 1942 N VAL A 121 4.326 7.545 -24.375 1.00 61.30 N ATOM 1943 CA VAL A 121 3.792 8.835 -23.957 1.00 14.44 C ATOM 1944 C VAL A 121 4.918 9.872 -23.856 1.00 10.13 C ATOM 1945 O VAL A 121 6.051 9.540 -23.499 1.00 23.22 O ATOM 1946 CB VAL A 121 3.041 8.720 -22.606 1.00 32.41 C ATOM 1947 CG1 VAL A 121 3.996 8.480 -21.447 1.00 4.52 C ATOM 1948 CG2 VAL A 121 2.200 9.952 -22.350 1.00 4.42 C ATOM 0 H VAL A 121 4.187 6.794 -23.699 1.00 61.30 H new ATOM 0 HA VAL A 121 3.078 9.164 -24.712 1.00 14.44 H new ATOM 0 HB VAL A 121 2.382 7.855 -22.677 1.00 32.41 H new ATOM 0 HG11 VAL A 121 3.430 8.405 -20.519 1.00 4.52 H new ATOM 0 HG12 VAL A 121 4.544 7.553 -21.613 1.00 4.52 H new ATOM 0 HG13 VAL A 121 4.699 9.310 -21.377 1.00 4.52 H new ATOM 0 HG21 VAL A 121 1.683 9.848 -21.396 1.00 4.42 H new ATOM 0 HG22 VAL A 121 2.843 10.832 -22.320 1.00 4.42 H new ATOM 0 HG23 VAL A 121 1.468 10.065 -23.149 1.00 4.42 H new ATOM 1958 N GLN A 122 4.606 11.121 -24.181 1.00 3.23 N ATOM 1959 CA GLN A 122 5.619 12.168 -24.235 1.00 25.41 C ATOM 1960 C GLN A 122 5.950 12.694 -22.842 1.00 32.11 C ATOM 1961 O GLN A 122 7.085 12.578 -22.379 1.00 12.13 O ATOM 1962 CB GLN A 122 5.143 13.315 -25.129 1.00 11.23 C ATOM 1963 CG GLN A 122 4.852 12.887 -26.556 1.00 43.13 C ATOM 1964 CD GLN A 122 4.446 14.048 -27.439 1.00 42.31 C ATOM 1965 OE1 GLN A 122 3.862 15.026 -26.973 1.00 73.32 O ATOM 1966 NE2 GLN A 122 4.748 13.948 -28.723 1.00 74.02 N ATOM 0 H GLN A 122 3.662 11.433 -24.411 1.00 3.23 H new ATOM 0 HA GLN A 122 6.526 11.735 -24.656 1.00 25.41 H new ATOM 0 HB2 GLN A 122 4.242 13.752 -24.698 1.00 11.23 H new ATOM 0 HB3 GLN A 122 5.903 14.097 -25.140 1.00 11.23 H new ATOM 0 HG2 GLN A 122 5.737 12.408 -26.976 1.00 43.13 H new ATOM 0 HG3 GLN A 122 4.057 12.142 -26.553 1.00 43.13 H new ATOM 0 HE21 GLN A 122 5.233 13.120 -29.070 1.00 74.02 H new ATOM 0 HE22 GLN A 122 4.496 14.699 -29.366 1.00 74.02 H new ATOM 1975 N LYS A 123 4.956 13.270 -22.182 1.00 34.21 N ATOM 1976 CA LYS A 123 5.149 13.843 -20.861 1.00 50.01 C ATOM 1977 C LYS A 123 4.249 13.179 -19.825 1.00 33.30 C ATOM 1978 O LYS A 123 3.090 12.855 -20.101 1.00 30.11 O ATOM 1979 CB LYS A 123 4.873 15.346 -20.894 1.00 2.25 C ATOM 1980 CG LYS A 123 4.669 15.957 -19.517 1.00 21.14 C ATOM 1981 CD LYS A 123 4.306 17.422 -19.606 1.00 51.44 C ATOM 1982 CE LYS A 123 5.514 18.279 -19.942 1.00 44.04 C ATOM 1983 NZ LYS A 123 6.557 18.215 -18.884 1.00 11.14 N ATOM 0 H LYS A 123 4.005 13.352 -22.542 1.00 34.21 H new ATOM 0 HA LYS A 123 6.185 13.667 -20.573 1.00 50.01 H new ATOM 0 HB2 LYS A 123 5.705 15.849 -21.386 1.00 2.25 H new ATOM 0 HB3 LYS A 123 3.986 15.531 -21.500 1.00 2.25 H new ATOM 0 HG2 LYS A 123 3.881 15.418 -18.992 1.00 21.14 H new ATOM 0 HG3 LYS A 123 5.580 15.842 -18.929 1.00 21.14 H new ATOM 0 HD2 LYS A 123 3.538 17.561 -20.367 1.00 51.44 H new ATOM 0 HD3 LYS A 123 3.879 17.750 -18.658 1.00 51.44 H new ATOM 0 HE2 LYS A 123 5.939 17.950 -20.890 1.00 44.04 H new ATOM 0 HE3 LYS A 123 5.198 19.313 -20.077 1.00 44.04 H new ATOM 0 HZ1 LYS A 123 7.177 19.047 -18.957 1.00 11.14 H new ATOM 0 HZ2 LYS A 123 6.102 18.203 -17.949 1.00 11.14 H new ATOM 0 HZ3 LYS A 123 7.122 17.350 -19.006 1.00 11.14 H new ATOM 1997 N TYR A 124 4.798 12.989 -18.635 1.00 14.31 N ATOM 1998 CA TYR A 124 4.039 12.500 -17.497 1.00 31.23 C ATOM 1999 C TYR A 124 4.105 13.515 -16.355 1.00 14.03 C ATOM 2000 O TYR A 124 5.178 13.809 -15.832 1.00 34.41 O ATOM 2001 CB TYR A 124 4.553 11.121 -17.054 1.00 43.40 C ATOM 2002 CG TYR A 124 6.035 10.899 -17.286 1.00 43.54 C ATOM 2003 CD1 TYR A 124 6.493 10.370 -18.489 1.00 73.41 C ATOM 2004 CD2 TYR A 124 6.973 11.207 -16.308 1.00 53.00 C ATOM 2005 CE1 TYR A 124 7.840 10.157 -18.710 1.00 44.12 C ATOM 2006 CE2 TYR A 124 8.324 10.995 -16.522 1.00 1.32 C ATOM 2007 CZ TYR A 124 8.752 10.470 -17.725 1.00 75.01 C ATOM 2008 OH TYR A 124 10.093 10.254 -17.943 1.00 63.14 O ATOM 0 H TYR A 124 5.781 13.170 -18.432 1.00 14.31 H new ATOM 0 HA TYR A 124 2.996 12.381 -17.789 1.00 31.23 H new ATOM 0 HB2 TYR A 124 4.341 10.992 -15.993 1.00 43.40 H new ATOM 0 HB3 TYR A 124 3.995 10.351 -17.587 1.00 43.40 H new ATOM 0 HD1 TYR A 124 5.783 10.122 -19.264 1.00 73.41 H new ATOM 0 HD2 TYR A 124 6.643 11.618 -15.366 1.00 53.00 H new ATOM 0 HE1 TYR A 124 8.177 9.747 -19.651 1.00 44.12 H new ATOM 0 HE2 TYR A 124 9.040 11.239 -15.751 1.00 1.32 H new ATOM 0 HH TYR A 124 10.601 10.528 -17.151 1.00 63.14 H new ATOM 2018 N ILE A 125 2.951 14.070 -16.003 1.00 42.33 N ATOM 2019 CA ILE A 125 2.865 15.101 -14.974 1.00 33.44 C ATOM 2020 C ILE A 125 1.788 14.736 -13.951 1.00 71.31 C ATOM 2021 O ILE A 125 0.809 14.070 -14.285 1.00 41.14 O ATOM 2022 CB ILE A 125 2.557 16.488 -15.591 1.00 21.04 C ATOM 2023 CG1 ILE A 125 2.528 17.563 -14.498 1.00 61.34 C ATOM 2024 CG2 ILE A 125 1.240 16.456 -16.358 1.00 1.32 C ATOM 2025 CD1 ILE A 125 2.355 18.969 -15.026 1.00 53.51 C ATOM 0 H ILE A 125 2.054 13.821 -16.419 1.00 42.33 H new ATOM 0 HA ILE A 125 3.833 15.158 -14.476 1.00 33.44 H new ATOM 0 HB ILE A 125 3.350 16.738 -16.296 1.00 21.04 H new ATOM 0 HG12 ILE A 125 1.715 17.342 -13.807 1.00 61.34 H new ATOM 0 HG13 ILE A 125 3.455 17.511 -13.927 1.00 61.34 H new ATOM 0 HG21 ILE A 125 1.043 17.440 -16.783 1.00 1.32 H new ATOM 0 HG22 ILE A 125 1.304 15.720 -17.160 1.00 1.32 H new ATOM 0 HG23 ILE A 125 0.431 16.185 -15.680 1.00 1.32 H new ATOM 0 HD11 ILE A 125 2.344 19.672 -14.193 1.00 53.51 H new ATOM 0 HD12 ILE A 125 3.181 19.211 -15.694 1.00 53.51 H new ATOM 0 HD13 ILE A 125 1.414 19.039 -15.572 1.00 53.51 H new ATOM 2037 N GLN A 126 1.977 15.147 -12.708 1.00 64.33 N ATOM 2038 CA GLN A 126 1.002 14.879 -11.660 1.00 33.33 C ATOM 2039 C GLN A 126 0.240 16.147 -11.285 1.00 10.12 C ATOM 2040 O GLN A 126 0.807 17.239 -11.226 1.00 11.32 O ATOM 2041 CB GLN A 126 1.695 14.309 -10.421 1.00 20.25 C ATOM 2042 CG GLN A 126 0.768 14.051 -9.242 1.00 72.34 C ATOM 2043 CD GLN A 126 1.526 13.868 -7.945 1.00 42.10 C ATOM 2044 OE1 GLN A 126 0.853 14.086 -6.828 1.00 71.12 O flip ATOM 2045 NE2 GLN A 126 2.700 13.501 -7.946 1.00 12.20 N flip ATOM 0 H GLN A 126 2.797 15.668 -12.398 1.00 64.33 H new ATOM 0 HA GLN A 126 0.291 14.147 -12.043 1.00 33.33 H new ATOM 0 HB2 GLN A 126 2.186 13.374 -10.692 1.00 20.25 H new ATOM 0 HB3 GLN A 126 2.477 15.000 -10.107 1.00 20.25 H new ATOM 0 HG2 GLN A 126 0.073 14.885 -9.140 1.00 72.34 H new ATOM 0 HG3 GLN A 126 0.171 13.161 -9.440 1.00 72.34 H new ATOM 0 HE21 GLN A 126 3.184 13.344 -8.830 1.00 12.20 H new ATOM 0 HE22 GLN A 126 3.189 13.354 -7.063 1.00 12.20 H new ATOM 2054 N ALA A 127 -1.044 15.982 -11.033 1.00 72.34 N ATOM 2055 CA ALA A 127 -1.896 17.057 -10.560 1.00 72.12 C ATOM 2056 C ALA A 127 -2.543 16.628 -9.253 1.00 42.44 C ATOM 2057 O ALA A 127 -3.315 15.670 -9.220 1.00 2.23 O ATOM 2058 CB ALA A 127 -2.949 17.401 -11.603 1.00 10.11 C ATOM 0 H ALA A 127 -1.529 15.093 -11.151 1.00 72.34 H new ATOM 0 HA ALA A 127 -1.299 17.953 -10.389 1.00 72.12 H new ATOM 0 HB1 ALA A 127 -3.579 18.209 -11.231 1.00 10.11 H new ATOM 0 HB2 ALA A 127 -2.459 17.717 -12.524 1.00 10.11 H new ATOM 0 HB3 ALA A 127 -3.564 16.524 -11.802 1.00 10.11 H new ATOM 2064 N THR A 128 -2.206 17.314 -8.176 1.00 74.44 N ATOM 2065 CA THR A 128 -2.621 16.887 -6.853 1.00 11.33 C ATOM 2066 C THR A 128 -4.095 17.192 -6.577 1.00 12.25 C ATOM 2067 O THR A 128 -4.948 16.306 -6.647 1.00 24.42 O ATOM 2068 CB THR A 128 -1.737 17.531 -5.766 1.00 55.44 C ATOM 2069 OG1 THR A 128 -1.783 18.961 -5.862 1.00 54.12 O ATOM 2070 CG2 THR A 128 -0.298 17.070 -5.898 1.00 2.12 C ATOM 0 H THR A 128 -1.647 18.167 -8.192 1.00 74.44 H new ATOM 0 HA THR A 128 -2.498 15.804 -6.821 1.00 11.33 H new ATOM 0 HB THR A 128 -2.125 17.220 -4.796 1.00 55.44 H new ATOM 0 HG1 THR A 128 -1.218 19.354 -5.164 1.00 54.12 H new ATOM 0 HG21 THR A 128 0.307 17.537 -5.121 1.00 2.12 H new ATOM 0 HG22 THR A 128 -0.252 15.986 -5.791 1.00 2.12 H new ATOM 0 HG23 THR A 128 0.087 17.355 -6.877 1.00 2.12 H new ATOM 2078 N ASP A 129 -4.387 18.444 -6.271 1.00 41.14 N ATOM 2079 CA ASP A 129 -5.735 18.848 -5.902 1.00 75.13 C ATOM 2080 C ASP A 129 -6.437 19.513 -7.084 1.00 1.41 C ATOM 2081 O ASP A 129 -5.822 19.750 -8.124 1.00 31.33 O ATOM 2082 CB ASP A 129 -5.675 19.796 -4.694 1.00 53.13 C ATOM 2083 CG ASP A 129 -7.043 20.249 -4.229 1.00 14.34 C ATOM 2084 OD1 ASP A 129 -7.879 19.391 -3.898 1.00 2.01 O ATOM 2085 OD2 ASP A 129 -7.291 21.471 -4.209 1.00 13.43 O ATOM 0 H ASP A 129 -3.706 19.203 -6.271 1.00 41.14 H new ATOM 0 HA ASP A 129 -6.312 17.965 -5.627 1.00 75.13 H new ATOM 0 HB2 ASP A 129 -5.165 19.295 -3.871 1.00 53.13 H new ATOM 0 HB3 ASP A 129 -5.078 20.670 -4.954 1.00 53.13 H new ATOM 2090 N LEU A 130 -7.720 19.816 -6.913 1.00 12.54 N ATOM 2091 CA LEU A 130 -8.530 20.448 -7.951 1.00 3.34 C ATOM 2092 C LEU A 130 -7.939 21.795 -8.368 1.00 11.43 C ATOM 2093 O LEU A 130 -8.179 22.273 -9.474 1.00 41.04 O ATOM 2094 CB LEU A 130 -9.961 20.646 -7.444 1.00 20.23 C ATOM 2095 CG LEU A 130 -10.599 19.412 -6.801 1.00 5.32 C ATOM 2096 CD1 LEU A 130 -12.011 19.726 -6.338 1.00 72.12 C ATOM 2097 CD2 LEU A 130 -10.603 18.240 -7.768 1.00 73.24 C ATOM 0 H LEU A 130 -8.229 19.630 -6.049 1.00 12.54 H new ATOM 0 HA LEU A 130 -8.537 19.793 -8.823 1.00 3.34 H new ATOM 0 HB2 LEU A 130 -9.963 21.458 -6.716 1.00 20.23 H new ATOM 0 HB3 LEU A 130 -10.585 20.965 -8.279 1.00 20.23 H new ATOM 0 HG LEU A 130 -10.003 19.133 -5.932 1.00 5.32 H new ATOM 0 HD11 LEU A 130 -12.451 18.838 -5.883 1.00 72.12 H new ATOM 0 HD12 LEU A 130 -11.983 20.533 -5.606 1.00 72.12 H new ATOM 0 HD13 LEU A 130 -12.614 20.033 -7.192 1.00 72.12 H new ATOM 0 HD21 LEU A 130 -11.061 17.375 -7.289 1.00 73.24 H new ATOM 0 HD22 LEU A 130 -11.172 18.505 -8.659 1.00 73.24 H new ATOM 0 HD23 LEU A 130 -9.578 17.998 -8.051 1.00 73.24 H new ATOM 2109 N SER A 131 -7.174 22.404 -7.472 1.00 60.45 N ATOM 2110 CA SER A 131 -6.493 23.657 -7.764 1.00 72.42 C ATOM 2111 C SER A 131 -5.422 23.462 -8.837 1.00 12.04 C ATOM 2112 O SER A 131 -5.137 24.371 -9.614 1.00 11.43 O ATOM 2113 CB SER A 131 -5.852 24.207 -6.492 1.00 54.31 C ATOM 2114 OG SER A 131 -6.827 24.446 -5.489 1.00 75.13 O ATOM 0 H SER A 131 -7.009 22.047 -6.531 1.00 60.45 H new ATOM 0 HA SER A 131 -7.230 24.367 -8.139 1.00 72.42 H new ATOM 0 HB2 SER A 131 -5.110 23.500 -6.121 1.00 54.31 H new ATOM 0 HB3 SER A 131 -5.325 25.134 -6.719 1.00 54.31 H new ATOM 0 HG SER A 131 -7.044 23.604 -5.036 1.00 75.13 H new ATOM 2120 N GLU A 132 -4.845 22.270 -8.879 1.00 40.02 N ATOM 2121 CA GLU A 132 -3.769 21.980 -9.813 1.00 52.14 C ATOM 2122 C GLU A 132 -4.312 21.264 -11.043 1.00 12.41 C ATOM 2123 O GLU A 132 -3.739 21.344 -12.127 1.00 25.34 O ATOM 2124 CB GLU A 132 -2.695 21.125 -9.140 1.00 62.23 C ATOM 2125 CG GLU A 132 -2.201 21.693 -7.817 1.00 70.21 C ATOM 2126 CD GLU A 132 -1.785 23.146 -7.920 1.00 42.22 C ATOM 2127 OE1 GLU A 132 -0.869 23.455 -8.706 1.00 52.40 O ATOM 2128 OE2 GLU A 132 -2.380 23.989 -7.211 1.00 21.14 O ATOM 0 H GLU A 132 -5.104 21.489 -8.277 1.00 40.02 H new ATOM 0 HA GLU A 132 -3.321 22.923 -10.126 1.00 52.14 H new ATOM 0 HB2 GLU A 132 -3.093 20.125 -8.970 1.00 62.23 H new ATOM 0 HB3 GLU A 132 -1.849 21.020 -9.819 1.00 62.23 H new ATOM 0 HG2 GLU A 132 -2.988 21.598 -7.069 1.00 70.21 H new ATOM 0 HG3 GLU A 132 -1.355 21.102 -7.466 1.00 70.21 H new ATOM 2135 N ALA A 133 -5.421 20.562 -10.867 1.00 32.11 N ATOM 2136 CA ALA A 133 -6.050 19.855 -11.968 1.00 54.02 C ATOM 2137 C ALA A 133 -7.258 20.621 -12.483 1.00 63.41 C ATOM 2138 O ALA A 133 -8.345 20.538 -11.920 1.00 51.32 O ATOM 2139 CB ALA A 133 -6.455 18.450 -11.551 1.00 5.23 C ATOM 0 H ALA A 133 -5.902 20.468 -9.973 1.00 32.11 H new ATOM 0 HA ALA A 133 -5.321 19.777 -12.774 1.00 54.02 H new ATOM 0 HB1 ALA A 133 -6.924 17.941 -12.393 1.00 5.23 H new ATOM 0 HB2 ALA A 133 -5.571 17.894 -11.238 1.00 5.23 H new ATOM 0 HB3 ALA A 133 -7.161 18.506 -10.722 1.00 5.23 H new ATOM 2145 N SER A 134 -7.046 21.390 -13.535 1.00 71.22 N ATOM 2146 CA SER A 134 -8.121 22.113 -14.194 1.00 32.22 C ATOM 2147 C SER A 134 -7.862 22.107 -15.698 1.00 54.33 C ATOM 2148 O SER A 134 -6.738 21.833 -16.117 1.00 61.30 O ATOM 2149 CB SER A 134 -8.197 23.545 -13.659 1.00 54.15 C ATOM 2150 OG SER A 134 -9.541 23.932 -13.425 1.00 22.41 O ATOM 0 H SER A 134 -6.128 21.532 -13.956 1.00 71.22 H new ATOM 0 HA SER A 134 -9.077 21.630 -13.991 1.00 32.22 H new ATOM 0 HB2 SER A 134 -7.627 23.621 -12.733 1.00 54.15 H new ATOM 0 HB3 SER A 134 -7.738 24.228 -14.373 1.00 54.15 H new ATOM 0 HG SER A 134 -9.562 24.850 -13.082 1.00 22.41 H new ATOM 2156 N ARG A 135 -8.883 22.398 -16.504 1.00 22.43 N ATOM 2157 CA ARG A 135 -8.750 22.347 -17.962 1.00 24.34 C ATOM 2158 C ARG A 135 -7.586 23.214 -18.442 1.00 64.12 C ATOM 2159 O ARG A 135 -6.779 22.781 -19.267 1.00 14.23 O ATOM 2160 CB ARG A 135 -10.055 22.785 -18.643 1.00 50.24 C ATOM 2161 CG ARG A 135 -9.982 22.799 -20.161 1.00 64.53 C ATOM 2162 CD ARG A 135 -11.172 23.525 -20.770 1.00 64.13 C ATOM 2163 NE ARG A 135 -11.136 24.961 -20.489 1.00 25.40 N ATOM 2164 CZ ARG A 135 -12.200 25.678 -20.118 1.00 44.22 C ATOM 2165 NH1 ARG A 135 -13.385 25.102 -19.969 1.00 0.32 N ATOM 2166 NH2 ARG A 135 -12.079 26.980 -19.890 1.00 41.32 N ATOM 0 H ARG A 135 -9.809 22.671 -16.175 1.00 22.43 H new ATOM 0 HA ARG A 135 -8.541 21.314 -18.239 1.00 24.34 H new ATOM 0 HB2 ARG A 135 -10.857 22.115 -18.334 1.00 50.24 H new ATOM 0 HB3 ARG A 135 -10.319 23.783 -18.292 1.00 50.24 H new ATOM 0 HG2 ARG A 135 -9.058 23.283 -20.477 1.00 64.53 H new ATOM 0 HG3 ARG A 135 -9.949 21.775 -20.534 1.00 64.53 H new ATOM 0 HD2 ARG A 135 -11.182 23.366 -21.848 1.00 64.13 H new ATOM 0 HD3 ARG A 135 -12.096 23.101 -20.377 1.00 64.13 H new ATOM 0 HE ARG A 135 -10.243 25.444 -20.582 1.00 25.40 H new ATOM 0 HH11 ARG A 135 -13.491 24.102 -20.138 1.00 0.32 H new ATOM 0 HH12 ARG A 135 -14.191 25.659 -19.685 1.00 0.32 H new ATOM 0 HH21 ARG A 135 -11.172 27.435 -19.998 1.00 41.32 H new ATOM 0 HH22 ARG A 135 -12.893 27.526 -19.607 1.00 41.32 H new ATOM 2180 N GLU A 136 -7.492 24.425 -17.908 1.00 55.23 N ATOM 2181 CA GLU A 136 -6.415 25.335 -18.273 1.00 75.15 C ATOM 2182 C GLU A 136 -5.066 24.779 -17.827 1.00 75.13 C ATOM 2183 O GLU A 136 -4.097 24.800 -18.577 1.00 34.34 O ATOM 2184 CB GLU A 136 -6.644 26.711 -17.651 1.00 20.30 C ATOM 2185 CG GLU A 136 -5.664 27.762 -18.135 1.00 33.13 C ATOM 2186 CD GLU A 136 -5.835 29.085 -17.425 1.00 50.42 C ATOM 2187 OE1 GLU A 136 -6.839 29.776 -17.680 1.00 22.21 O ATOM 2188 OE2 GLU A 136 -4.965 29.443 -16.604 1.00 20.43 O ATOM 0 H GLU A 136 -8.148 24.799 -17.222 1.00 55.23 H new ATOM 0 HA GLU A 136 -6.409 25.436 -19.358 1.00 75.15 H new ATOM 0 HB2 GLU A 136 -7.658 27.039 -17.877 1.00 20.30 H new ATOM 0 HB3 GLU A 136 -6.570 26.628 -16.567 1.00 20.30 H new ATOM 0 HG2 GLU A 136 -4.646 27.402 -17.984 1.00 33.13 H new ATOM 0 HG3 GLU A 136 -5.795 27.909 -19.207 1.00 33.13 H new ATOM 2195 N ALA A 137 -5.011 24.259 -16.612 1.00 73.31 N ATOM 2196 CA ALA A 137 -3.777 23.694 -16.086 1.00 2.14 C ATOM 2197 C ALA A 137 -3.330 22.495 -16.920 1.00 24.04 C ATOM 2198 O ALA A 137 -2.143 22.162 -16.968 1.00 3.11 O ATOM 2199 CB ALA A 137 -3.954 23.298 -14.631 1.00 22.30 C ATOM 0 H ALA A 137 -5.804 24.216 -15.972 1.00 73.31 H new ATOM 0 HA ALA A 137 -2.999 24.455 -16.145 1.00 2.14 H new ATOM 0 HB1 ALA A 137 -3.022 22.877 -14.253 1.00 22.30 H new ATOM 0 HB2 ALA A 137 -4.220 24.177 -14.044 1.00 22.30 H new ATOM 0 HB3 ALA A 137 -4.747 22.555 -14.550 1.00 22.30 H new ATOM 2205 N VAL A 138 -4.288 21.858 -17.583 1.00 42.11 N ATOM 2206 CA VAL A 138 -3.999 20.732 -18.456 1.00 32.31 C ATOM 2207 C VAL A 138 -3.362 21.199 -19.770 1.00 41.33 C ATOM 2208 O VAL A 138 -2.401 20.589 -20.249 1.00 41.30 O ATOM 2209 CB VAL A 138 -5.272 19.898 -18.746 1.00 64.23 C ATOM 2210 CG1 VAL A 138 -5.025 18.868 -19.841 1.00 4.15 C ATOM 2211 CG2 VAL A 138 -5.753 19.209 -17.477 1.00 52.10 C ATOM 0 H VAL A 138 -5.276 22.106 -17.530 1.00 42.11 H new ATOM 0 HA VAL A 138 -3.286 20.095 -17.933 1.00 32.31 H new ATOM 0 HB VAL A 138 -6.045 20.582 -19.096 1.00 64.23 H new ATOM 0 HG11 VAL A 138 -5.938 18.300 -20.019 1.00 4.15 H new ATOM 0 HG12 VAL A 138 -4.729 19.376 -20.759 1.00 4.15 H new ATOM 0 HG13 VAL A 138 -4.231 18.189 -19.530 1.00 4.15 H new ATOM 0 HG21 VAL A 138 -6.648 18.627 -17.696 1.00 52.10 H new ATOM 0 HG22 VAL A 138 -4.972 18.547 -17.104 1.00 52.10 H new ATOM 0 HG23 VAL A 138 -5.984 19.959 -16.721 1.00 52.10 H new ATOM 2221 N GLU A 139 -3.877 22.284 -20.345 1.00 32.13 N ATOM 2222 CA GLU A 139 -3.336 22.796 -21.602 1.00 31.13 C ATOM 2223 C GLU A 139 -1.955 23.415 -21.390 1.00 40.43 C ATOM 2224 O GLU A 139 -1.114 23.397 -22.290 1.00 51.05 O ATOM 2225 CB GLU A 139 -4.288 23.809 -22.260 1.00 41.10 C ATOM 2226 CG GLU A 139 -4.564 25.044 -21.422 1.00 55.44 C ATOM 2227 CD GLU A 139 -5.385 26.085 -22.155 1.00 52.43 C ATOM 2228 OE1 GLU A 139 -6.616 25.923 -22.250 1.00 4.42 O ATOM 2229 OE2 GLU A 139 -4.797 27.081 -22.634 1.00 64.11 O ATOM 0 H GLU A 139 -4.658 22.820 -19.966 1.00 32.13 H new ATOM 0 HA GLU A 139 -3.234 21.949 -22.280 1.00 31.13 H new ATOM 0 HB2 GLU A 139 -3.865 24.120 -23.215 1.00 41.10 H new ATOM 0 HB3 GLU A 139 -5.234 23.313 -22.477 1.00 41.10 H new ATOM 0 HG2 GLU A 139 -5.088 24.750 -20.513 1.00 55.44 H new ATOM 0 HG3 GLU A 139 -3.617 25.487 -21.114 1.00 55.44 H new ATOM 2236 N GLU A 140 -1.711 23.931 -20.193 1.00 61.43 N ATOM 2237 CA GLU A 140 -0.435 24.563 -19.886 1.00 73.01 C ATOM 2238 C GLU A 140 0.711 23.551 -19.904 1.00 71.14 C ATOM 2239 O GLU A 140 1.764 23.814 -20.489 1.00 64.11 O ATOM 2240 CB GLU A 140 -0.494 25.281 -18.536 1.00 12.31 C ATOM 2241 CG GLU A 140 -1.568 26.353 -18.479 1.00 64.40 C ATOM 2242 CD GLU A 140 -1.521 27.178 -17.213 1.00 23.00 C ATOM 2243 OE1 GLU A 140 -1.794 26.635 -16.124 1.00 43.44 O ATOM 2244 OE2 GLU A 140 -1.224 28.385 -17.303 1.00 72.55 O ATOM 0 H GLU A 140 -2.377 23.925 -19.421 1.00 61.43 H new ATOM 0 HA GLU A 140 -0.240 25.302 -20.664 1.00 73.01 H new ATOM 0 HB2 GLU A 140 -0.677 24.549 -17.749 1.00 12.31 H new ATOM 0 HB3 GLU A 140 0.475 25.735 -18.330 1.00 12.31 H new ATOM 0 HG2 GLU A 140 -1.459 27.013 -19.339 1.00 64.40 H new ATOM 0 HG3 GLU A 140 -2.547 25.882 -18.561 1.00 64.40 H new ATOM 2251 N LYS A 141 0.505 22.385 -19.294 1.00 61.44 N ATOM 2252 CA LYS A 141 1.563 21.377 -19.231 1.00 71.44 C ATOM 2253 C LYS A 141 1.761 20.672 -20.571 1.00 35.51 C ATOM 2254 O LYS A 141 2.817 20.090 -20.815 1.00 21.41 O ATOM 2255 CB LYS A 141 1.321 20.350 -18.106 1.00 74.45 C ATOM 2256 CG LYS A 141 -0.091 19.781 -18.028 1.00 72.30 C ATOM 2257 CD LYS A 141 -0.292 18.604 -18.971 1.00 42.32 C ATOM 2258 CE LYS A 141 -1.627 17.920 -18.717 1.00 51.32 C ATOM 2259 NZ LYS A 141 -1.860 16.777 -19.642 1.00 32.14 N ATOM 0 H LYS A 141 -0.370 22.117 -18.843 1.00 61.44 H new ATOM 0 HA LYS A 141 2.482 21.914 -18.997 1.00 71.44 H new ATOM 0 HB2 LYS A 141 2.020 19.524 -18.236 1.00 74.45 H new ATOM 0 HB3 LYS A 141 1.557 20.820 -17.152 1.00 74.45 H new ATOM 0 HG2 LYS A 141 -0.297 19.464 -17.006 1.00 72.30 H new ATOM 0 HG3 LYS A 141 -0.810 20.564 -18.269 1.00 72.30 H new ATOM 0 HD2 LYS A 141 -0.248 18.950 -20.004 1.00 42.32 H new ATOM 0 HD3 LYS A 141 0.518 17.887 -18.840 1.00 42.32 H new ATOM 0 HE2 LYS A 141 -1.660 17.564 -17.687 1.00 51.32 H new ATOM 0 HE3 LYS A 141 -2.432 18.646 -18.830 1.00 51.32 H new ATOM 0 HZ1 LYS A 141 -2.781 16.342 -19.432 1.00 32.14 H new ATOM 0 HZ2 LYS A 141 -1.855 17.119 -20.624 1.00 32.14 H new ATOM 0 HZ3 LYS A 141 -1.107 16.070 -19.517 1.00 32.14 H new ATOM 2273 N LEU A 142 0.764 20.722 -21.448 1.00 24.22 N ATOM 2274 CA LEU A 142 0.888 20.046 -22.733 1.00 63.23 C ATOM 2275 C LEU A 142 1.640 20.914 -23.743 1.00 24.20 C ATOM 2276 O LEU A 142 2.308 20.393 -24.639 1.00 31.21 O ATOM 2277 CB LEU A 142 -0.484 19.591 -23.273 1.00 22.13 C ATOM 2278 CG LEU A 142 -1.519 20.679 -23.596 1.00 63.34 C ATOM 2279 CD1 LEU A 142 -1.264 21.301 -24.964 1.00 21.53 C ATOM 2280 CD2 LEU A 142 -2.923 20.094 -23.536 1.00 62.24 C ATOM 0 H LEU A 142 -0.118 21.211 -21.298 1.00 24.22 H new ATOM 0 HA LEU A 142 1.479 19.144 -22.576 1.00 63.23 H new ATOM 0 HB2 LEU A 142 -0.312 19.011 -24.180 1.00 22.13 H new ATOM 0 HB3 LEU A 142 -0.925 18.915 -22.541 1.00 22.13 H new ATOM 0 HG LEU A 142 -1.425 21.468 -22.850 1.00 63.34 H new ATOM 0 HD11 LEU A 142 -2.014 22.067 -25.161 1.00 21.53 H new ATOM 0 HD12 LEU A 142 -0.272 21.752 -24.979 1.00 21.53 H new ATOM 0 HD13 LEU A 142 -1.323 20.529 -25.731 1.00 21.53 H new ATOM 0 HD21 LEU A 142 -3.651 20.872 -23.766 1.00 62.24 H new ATOM 0 HD22 LEU A 142 -3.012 19.287 -24.263 1.00 62.24 H new ATOM 0 HD23 LEU A 142 -3.112 19.704 -22.536 1.00 62.24 H new ATOM 2292 N ARG A 143 1.534 22.231 -23.599 1.00 41.02 N ATOM 2293 CA ARG A 143 2.246 23.148 -24.484 1.00 22.30 C ATOM 2294 C ARG A 143 3.642 23.459 -23.948 1.00 70.15 C ATOM 2295 O ARG A 143 4.518 23.897 -24.692 1.00 60.24 O ATOM 2296 CB ARG A 143 1.451 24.441 -24.698 1.00 20.33 C ATOM 2297 CG ARG A 143 1.234 25.265 -23.439 1.00 30.01 C ATOM 2298 CD ARG A 143 0.455 26.534 -23.743 1.00 12.12 C ATOM 2299 NE ARG A 143 0.138 27.298 -22.537 1.00 73.43 N ATOM 2300 CZ ARG A 143 -1.102 27.654 -22.195 1.00 32.12 C ATOM 2301 NH1 ARG A 143 -2.128 27.270 -22.946 1.00 32.13 N ATOM 2302 NH2 ARG A 143 -1.313 28.393 -21.109 1.00 3.51 N ATOM 0 H ARG A 143 0.966 22.685 -22.884 1.00 41.02 H new ATOM 0 HA ARG A 143 2.355 22.653 -25.449 1.00 22.30 H new ATOM 0 HB2 ARG A 143 1.971 25.055 -25.433 1.00 20.33 H new ATOM 0 HB3 ARG A 143 0.480 24.189 -25.124 1.00 20.33 H new ATOM 0 HG2 ARG A 143 0.695 24.672 -22.701 1.00 30.01 H new ATOM 0 HG3 ARG A 143 2.197 25.523 -22.999 1.00 30.01 H new ATOM 0 HD2 ARG A 143 1.035 27.158 -24.423 1.00 12.12 H new ATOM 0 HD3 ARG A 143 -0.470 26.274 -24.258 1.00 12.12 H new ATOM 0 HE ARG A 143 0.906 27.574 -21.924 1.00 73.43 H new ATOM 0 HH11 ARG A 143 -1.966 26.705 -23.780 1.00 32.13 H new ATOM 0 HH12 ARG A 143 -3.077 27.540 -22.689 1.00 32.13 H new ATOM 0 HH21 ARG A 143 -0.525 28.690 -20.533 1.00 3.51 H new ATOM 0 HH22 ARG A 143 -2.263 28.662 -20.852 1.00 3.51 H new ATOM 2316 N ALA A 144 3.850 23.226 -22.655 1.00 34.05 N ATOM 2317 CA ALA A 144 5.149 23.473 -22.032 1.00 2.02 C ATOM 2318 C ALA A 144 6.218 22.556 -22.621 1.00 65.55 C ATOM 2319 O ALA A 144 7.399 22.899 -22.661 1.00 22.21 O ATOM 2320 CB ALA A 144 5.062 23.276 -20.527 1.00 2.44 C ATOM 0 H ALA A 144 3.138 22.867 -22.019 1.00 34.05 H new ATOM 0 HA ALA A 144 5.431 24.506 -22.236 1.00 2.02 H new ATOM 0 HB1 ALA A 144 6.038 23.464 -20.078 1.00 2.44 H new ATOM 0 HB2 ALA A 144 4.332 23.970 -20.111 1.00 2.44 H new ATOM 0 HB3 ALA A 144 4.754 22.253 -20.311 1.00 2.44 H new ATOM 2326 N THR A 145 5.790 21.391 -23.086 1.00 41.11 N ATOM 2327 CA THR A 145 6.701 20.415 -23.661 1.00 71.13 C ATOM 2328 C THR A 145 6.651 20.463 -25.190 1.00 41.30 C ATOM 2329 O THR A 145 7.144 19.562 -25.870 1.00 41.04 O ATOM 2330 CB THR A 145 6.363 18.989 -23.166 1.00 14.33 C ATOM 2331 OG1 THR A 145 7.346 18.050 -23.615 1.00 21.35 O ATOM 2332 CG2 THR A 145 4.986 18.554 -23.648 1.00 21.21 C ATOM 0 H THR A 145 4.813 21.099 -23.075 1.00 41.11 H new ATOM 0 HA THR A 145 7.710 20.667 -23.335 1.00 71.13 H new ATOM 0 HB THR A 145 6.362 19.012 -22.076 1.00 14.33 H new ATOM 0 HG1 THR A 145 7.588 18.249 -24.544 1.00 21.35 H new ATOM 0 HG21 THR A 145 4.775 17.548 -23.285 1.00 21.21 H new ATOM 0 HG22 THR A 145 4.233 19.243 -23.266 1.00 21.21 H new ATOM 0 HG23 THR A 145 4.964 18.559 -24.738 1.00 21.21 H new ATOM 2340 N ASP A 146 6.053 21.518 -25.727 1.00 1.44 N ATOM 2341 CA ASP A 146 5.947 21.673 -27.171 1.00 22.22 C ATOM 2342 C ASP A 146 7.025 22.625 -27.665 1.00 24.51 C ATOM 2343 O ASP A 146 7.840 23.114 -26.879 1.00 73.23 O ATOM 2344 CB ASP A 146 4.564 22.204 -27.559 1.00 43.11 C ATOM 2345 CG ASP A 146 4.131 21.744 -28.938 1.00 72.14 C ATOM 2346 OD1 ASP A 146 4.561 22.346 -29.942 1.00 43.25 O ATOM 2347 OD2 ASP A 146 3.357 20.772 -29.015 1.00 55.21 O ATOM 0 H ASP A 146 5.636 22.276 -25.187 1.00 1.44 H new ATOM 0 HA ASP A 146 6.084 20.697 -27.637 1.00 22.22 H new ATOM 0 HB2 ASP A 146 3.832 21.873 -26.823 1.00 43.11 H new ATOM 0 HB3 ASP A 146 4.575 23.294 -27.530 1.00 43.11 H new