USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1118 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 135 ASN : amide:sc= 0.121 K(o=1.4,f=0.77) USER MOD Set 1.2: A 136 THR OG1 : rot 67:sc= 1.28 USER MOD Set 2.1: A 92 THR OG1 : rot 180:sc= -0.448 USER MOD Set 2.2: A 116 MET CE :methyl 152:sc= -0.579 (180deg=-0.782) USER MOD Set 3.1: A 41 GLN : amide:sc= -5.15! C(o=-4.9!,f=-6.8!) USER MOD Set 3.2: A 105 THR OG1 : rot -170:sc= 0.281 USER MOD Set 4.1: A 8 HIS : no HD1:sc= -0.556 X(o=-0.84,f=-0.97) USER MOD Set 4.2: A 137 HIS : no HD1:sc= -0.286 X(o=-0.84,f=-1.2) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -170:sc= 0 (180deg=-0.0851) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 5 HIS : no HD1:sc= -0.145 X(o=-0.15,f=-0.15) USER MOD Single : A 6 HIS : no HE2:sc= 0.0571 K(o=0.057,f=-0.54) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 14 HIS : no HD1:sc= -0.0594 X(o=-0.059,f=0.0014) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 CYS SG : rot 180:sc= -0.295 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 CYS SG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= -1.98! K(o=-2!,f=-0.29) USER MOD Single : A 60 CYS SG : rot 180:sc= -1.37 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 144:sc= 1.27 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.0549) USER MOD Single : A 81 MET CE :methyl -114:sc= -1.87 (180deg=-7.91!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 72:sc= -1.66! USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 161:sc= -0.198 (180deg=-0.615) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00938) USER MOD Single : A 104 SER OG : rot -153:sc= -0.843 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 TYR OH : rot 130:sc= -0.231 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.186) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 87:sc= 0.376 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 THR OG1 : rot -85:sc= 0.149 USER MOD Single : A 138 HIS : no HD1:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.575 18.237 3.508 1.00 60.13 N ATOM 2 CA MET A 1 2.233 17.913 4.768 1.00 12.44 C ATOM 3 C MET A 1 3.124 16.685 4.617 1.00 32.41 C ATOM 4 O MET A 1 4.309 16.722 4.946 1.00 30.44 O ATOM 5 CB MET A 1 1.192 17.672 5.864 1.00 64.43 C ATOM 6 CG MET A 1 0.280 18.863 6.109 1.00 25.33 C ATOM 7 SD MET A 1 -0.228 19.005 7.833 1.00 22.44 S ATOM 8 CE MET A 1 -0.192 20.782 8.052 1.00 72.03 C ATOM 0 H1 MET A 1 1.112 19.165 3.587 1.00 60.13 H new ATOM 0 H2 MET A 1 2.281 18.266 2.745 1.00 60.13 H new ATOM 0 H3 MET A 1 0.862 17.511 3.292 1.00 60.13 H new ATOM 0 HA MET A 1 2.858 18.760 5.051 1.00 12.44 H new ATOM 0 HB2 MET A 1 0.584 16.809 5.593 1.00 64.43 H new ATOM 0 HB3 MET A 1 1.705 17.421 6.792 1.00 64.43 H new ATOM 0 HG2 MET A 1 0.793 19.777 5.809 1.00 25.33 H new ATOM 0 HG3 MET A 1 -0.605 18.773 5.480 1.00 25.33 H new ATOM 0 HE1 MET A 1 -0.484 21.029 9.073 1.00 72.03 H new ATOM 0 HE2 MET A 1 0.816 21.152 7.863 1.00 72.03 H new ATOM 0 HE3 MET A 1 -0.886 21.249 7.354 1.00 72.03 H new ATOM 18 N ALA A 2 2.545 15.598 4.117 1.00 23.43 N ATOM 19 CA ALA A 2 3.288 14.359 3.921 1.00 33.43 C ATOM 20 C ALA A 2 3.424 14.029 2.439 1.00 73.32 C ATOM 21 O ALA A 2 3.728 12.894 2.070 1.00 22.23 O ATOM 22 CB ALA A 2 2.608 13.214 4.659 1.00 45.04 C ATOM 0 H ALA A 2 1.564 15.550 3.840 1.00 23.43 H new ATOM 0 HA ALA A 2 4.290 14.496 4.329 1.00 33.43 H new ATOM 0 HB1 ALA A 2 3.173 12.295 4.504 1.00 45.04 H new ATOM 0 HB2 ALA A 2 2.568 13.441 5.724 1.00 45.04 H new ATOM 0 HB3 ALA A 2 1.595 13.086 4.277 1.00 45.04 H new ATOM 28 N HIS A 3 3.195 15.027 1.592 1.00 43.34 N ATOM 29 CA HIS A 3 3.292 14.843 0.148 1.00 24.40 C ATOM 30 C HIS A 3 4.724 14.511 -0.262 1.00 60.21 C ATOM 31 O HIS A 3 5.671 14.786 0.475 1.00 64.20 O ATOM 32 CB HIS A 3 2.819 16.100 -0.581 1.00 50.23 C ATOM 33 CG HIS A 3 1.685 15.853 -1.528 1.00 30.41 C ATOM 34 ND1 HIS A 3 1.760 16.119 -2.879 1.00 23.03 N ATOM 35 CD2 HIS A 3 0.444 15.358 -1.312 1.00 55.21 C ATOM 36 CE1 HIS A 3 0.614 15.801 -3.453 1.00 33.14 C ATOM 37 NE2 HIS A 3 -0.202 15.336 -2.524 1.00 13.33 N ATOM 0 H HIS A 3 2.941 15.972 1.880 1.00 43.34 H new ATOM 0 HA HIS A 3 2.650 14.008 -0.131 1.00 24.40 H new ATOM 0 HB2 HIS A 3 2.511 16.843 0.155 1.00 50.23 H new ATOM 0 HB3 HIS A 3 3.656 16.526 -1.133 1.00 50.23 H new ATOM 0 HD2 HIS A 3 0.037 15.040 -0.363 1.00 55.21 H new ATOM 0 HE1 HIS A 3 0.383 15.904 -4.503 1.00 33.14 H new ATOM 0 HE2 HIS A 3 -1.157 15.013 -2.681 1.00 13.33 H new ATOM 45 N HIS A 4 4.874 13.918 -1.442 1.00 61.42 N ATOM 46 CA HIS A 4 6.190 13.548 -1.950 1.00 45.02 C ATOM 47 C HIS A 4 6.248 13.695 -3.468 1.00 22.03 C ATOM 48 O HIS A 4 5.257 14.052 -4.105 1.00 72.23 O ATOM 49 CB HIS A 4 6.529 12.111 -1.552 1.00 41.20 C ATOM 50 CG HIS A 4 7.673 12.010 -0.590 1.00 73.23 C ATOM 51 ND1 HIS A 4 8.960 11.709 -0.981 1.00 64.11 N ATOM 52 CD2 HIS A 4 7.717 12.173 0.753 1.00 42.23 C ATOM 53 CE1 HIS A 4 9.747 11.690 0.080 1.00 61.20 C ATOM 54 NE2 HIS A 4 9.017 11.969 1.145 1.00 63.11 N ATOM 0 H HIS A 4 4.101 13.683 -2.064 1.00 61.42 H new ATOM 0 HA HIS A 4 6.924 14.222 -1.509 1.00 45.02 H new ATOM 0 HB2 HIS A 4 5.648 11.649 -1.106 1.00 41.20 H new ATOM 0 HB3 HIS A 4 6.768 11.541 -2.450 1.00 41.20 H new ATOM 0 HD2 HIS A 4 6.885 12.418 1.396 1.00 42.23 H new ATOM 0 HE1 HIS A 4 10.807 11.482 0.077 1.00 61.20 H new ATOM 0 HE2 HIS A 4 9.363 12.024 2.103 1.00 63.11 H new ATOM 62 N HIS A 5 7.415 13.418 -4.040 1.00 45.44 N ATOM 63 CA HIS A 5 7.602 13.520 -5.483 1.00 43.24 C ATOM 64 C HIS A 5 8.804 12.695 -5.935 1.00 55.12 C ATOM 65 O HIS A 5 9.737 12.466 -5.165 1.00 71.44 O ATOM 66 CB HIS A 5 7.789 14.981 -5.893 1.00 3.31 C ATOM 67 CG HIS A 5 7.827 15.188 -7.376 1.00 32.31 C ATOM 68 ND1 HIS A 5 6.710 15.089 -8.178 1.00 35.10 N ATOM 69 CD2 HIS A 5 8.855 15.491 -8.202 1.00 25.32 C ATOM 70 CE1 HIS A 5 7.050 15.321 -9.433 1.00 74.43 C ATOM 71 NE2 HIS A 5 8.347 15.567 -9.475 1.00 15.51 N ATOM 0 H HIS A 5 8.245 13.121 -3.527 1.00 45.44 H new ATOM 0 HA HIS A 5 6.709 13.126 -5.968 1.00 43.24 H new ATOM 0 HB2 HIS A 5 6.977 15.574 -5.473 1.00 3.31 H new ATOM 0 HB3 HIS A 5 8.716 15.356 -5.458 1.00 3.31 H new ATOM 0 HD2 HIS A 5 9.884 15.645 -7.913 1.00 25.32 H new ATOM 0 HE1 HIS A 5 6.381 15.311 -10.281 1.00 74.43 H new ATOM 0 HE2 HIS A 5 8.884 15.779 -10.316 1.00 15.51 H new ATOM 79 N HIS A 6 8.773 12.251 -7.188 1.00 10.02 N ATOM 80 CA HIS A 6 9.860 11.451 -7.742 1.00 14.20 C ATOM 81 C HIS A 6 9.622 11.163 -9.221 1.00 44.44 C ATOM 82 O HIS A 6 8.713 11.723 -9.835 1.00 61.23 O ATOM 83 CB HIS A 6 9.999 10.138 -6.971 1.00 42.31 C ATOM 84 CG HIS A 6 11.397 9.859 -6.512 1.00 63.11 C ATOM 85 ND1 HIS A 6 12.135 10.749 -5.761 1.00 13.35 N ATOM 86 CD2 HIS A 6 12.192 8.780 -6.701 1.00 21.30 C ATOM 87 CE1 HIS A 6 13.323 10.231 -5.508 1.00 62.45 C ATOM 88 NE2 HIS A 6 13.383 9.036 -6.068 1.00 24.53 N ATOM 0 H HIS A 6 8.008 12.431 -7.838 1.00 10.02 H new ATOM 0 HA HIS A 6 10.784 12.020 -7.644 1.00 14.20 H new ATOM 0 HB2 HIS A 6 9.339 10.164 -6.104 1.00 42.31 H new ATOM 0 HB3 HIS A 6 9.662 9.317 -7.604 1.00 42.31 H new ATOM 0 HD1 HIS A 6 11.813 11.665 -5.449 1.00 13.35 H new ATOM 0 HD2 HIS A 6 11.937 7.884 -7.248 1.00 21.30 H new ATOM 0 HE1 HIS A 6 14.111 10.704 -4.940 1.00 62.45 H new ATOM 96 N HIS A 7 10.447 10.288 -9.789 1.00 15.23 N ATOM 97 CA HIS A 7 10.326 9.926 -11.197 1.00 3.44 C ATOM 98 C HIS A 7 9.299 8.814 -11.386 1.00 4.11 C ATOM 99 O HIS A 7 8.911 8.144 -10.428 1.00 62.15 O ATOM 100 CB HIS A 7 11.682 9.484 -11.749 1.00 12.41 C ATOM 101 CG HIS A 7 12.530 10.620 -12.235 1.00 34.53 C ATOM 102 ND1 HIS A 7 12.291 11.284 -13.419 1.00 53.11 N ATOM 103 CD2 HIS A 7 13.619 11.208 -11.688 1.00 11.22 C ATOM 104 CE1 HIS A 7 13.197 12.231 -13.580 1.00 44.25 C ATOM 105 NE2 HIS A 7 14.015 12.207 -12.543 1.00 70.54 N ATOM 0 H HIS A 7 11.206 9.817 -9.296 1.00 15.23 H new ATOM 0 HA HIS A 7 9.988 10.805 -11.745 1.00 3.44 H new ATOM 0 HB2 HIS A 7 12.223 8.944 -10.972 1.00 12.41 H new ATOM 0 HB3 HIS A 7 11.521 8.785 -12.569 1.00 12.41 H new ATOM 0 HD2 HIS A 7 14.089 10.941 -10.753 1.00 11.22 H new ATOM 0 HE1 HIS A 7 13.259 12.910 -14.418 1.00 44.25 H new ATOM 0 HE2 HIS A 7 14.811 12.829 -12.401 1.00 70.54 H new ATOM 113 N HIS A 8 8.862 8.623 -12.627 1.00 4.52 N ATOM 114 CA HIS A 8 7.880 7.592 -12.941 1.00 50.24 C ATOM 115 C HIS A 8 7.785 7.374 -14.448 1.00 40.15 C ATOM 116 O HIS A 8 7.388 8.271 -15.191 1.00 52.13 O ATOM 117 CB HIS A 8 6.510 7.976 -12.383 1.00 14.14 C ATOM 118 CG HIS A 8 6.356 9.444 -12.128 1.00 43.12 C ATOM 119 ND1 HIS A 8 6.035 9.964 -10.892 1.00 52.12 N ATOM 120 CD2 HIS A 8 6.484 10.505 -12.959 1.00 60.33 C ATOM 121 CE1 HIS A 8 5.970 11.281 -10.975 1.00 13.05 C ATOM 122 NE2 HIS A 8 6.239 11.635 -12.218 1.00 73.44 N ATOM 0 H HIS A 8 9.173 9.169 -13.431 1.00 4.52 H new ATOM 0 HA HIS A 8 8.205 6.661 -12.476 1.00 50.24 H new ATOM 0 HB2 HIS A 8 5.739 7.655 -13.083 1.00 14.14 H new ATOM 0 HB3 HIS A 8 6.341 7.434 -11.452 1.00 14.14 H new ATOM 0 HD2 HIS A 8 6.733 10.469 -14.009 1.00 60.33 H new ATOM 0 HE1 HIS A 8 5.736 11.954 -10.163 1.00 13.05 H new ATOM 0 HE2 HIS A 8 6.261 12.592 -12.571 1.00 73.44 H new ATOM 130 N ALA A 9 8.153 6.177 -14.893 1.00 21.25 N ATOM 131 CA ALA A 9 8.108 5.841 -16.310 1.00 63.22 C ATOM 132 C ALA A 9 8.341 4.350 -16.529 1.00 24.23 C ATOM 133 O ALA A 9 7.606 3.699 -17.270 1.00 52.34 O ATOM 134 CB ALA A 9 9.138 6.656 -17.079 1.00 12.14 C ATOM 0 H ALA A 9 8.486 5.423 -14.292 1.00 21.25 H new ATOM 0 HA ALA A 9 7.114 6.086 -16.684 1.00 63.22 H new ATOM 0 HB1 ALA A 9 9.093 6.395 -18.136 1.00 12.14 H new ATOM 0 HB2 ALA A 9 8.925 7.718 -16.958 1.00 12.14 H new ATOM 0 HB3 ALA A 9 10.134 6.440 -16.694 1.00 12.14 H new ATOM 140 N MET A 10 9.370 3.815 -15.879 1.00 31.13 N ATOM 141 CA MET A 10 9.699 2.400 -16.002 1.00 60.45 C ATOM 142 C MET A 10 8.795 1.551 -15.113 1.00 44.51 C ATOM 143 O MET A 10 8.287 0.513 -15.537 1.00 45.44 O ATOM 144 CB MET A 10 11.165 2.161 -15.635 1.00 71.03 C ATOM 145 CG MET A 10 12.146 2.802 -16.603 1.00 60.03 C ATOM 146 SD MET A 10 12.418 1.803 -18.080 1.00 14.41 S ATOM 147 CE MET A 10 11.676 2.845 -19.334 1.00 43.12 C ATOM 0 H MET A 10 9.990 4.340 -15.262 1.00 31.13 H new ATOM 0 HA MET A 10 9.539 2.105 -17.039 1.00 60.45 H new ATOM 0 HB2 MET A 10 11.348 2.550 -14.634 1.00 71.03 H new ATOM 0 HB3 MET A 10 11.352 1.088 -15.599 1.00 71.03 H new ATOM 0 HG2 MET A 10 11.772 3.783 -16.896 1.00 60.03 H new ATOM 0 HG3 MET A 10 13.098 2.962 -16.097 1.00 60.03 H new ATOM 0 HE1 MET A 10 11.765 2.362 -20.307 1.00 43.12 H new ATOM 0 HE2 MET A 10 10.623 3.001 -19.101 1.00 43.12 H new ATOM 0 HE3 MET A 10 12.188 3.807 -19.358 1.00 43.12 H new ATOM 157 N VAL A 11 8.599 2.000 -13.877 1.00 40.03 N ATOM 158 CA VAL A 11 7.756 1.282 -12.928 1.00 40.55 C ATOM 159 C VAL A 11 6.309 1.754 -13.013 1.00 73.03 C ATOM 160 O VAL A 11 5.393 1.062 -12.567 1.00 51.31 O ATOM 161 CB VAL A 11 8.259 1.462 -11.484 1.00 31.43 C ATOM 162 CG1 VAL A 11 9.594 0.758 -11.292 1.00 11.22 C ATOM 163 CG2 VAL A 11 8.371 2.939 -11.138 1.00 73.23 C ATOM 0 H VAL A 11 9.012 2.857 -13.510 1.00 40.03 H new ATOM 0 HA VAL A 11 7.807 0.226 -13.194 1.00 40.55 H new ATOM 0 HB VAL A 11 7.535 1.008 -10.807 1.00 31.43 H new ATOM 0 HG11 VAL A 11 9.934 0.896 -10.266 1.00 11.22 H new ATOM 0 HG12 VAL A 11 9.477 -0.306 -11.495 1.00 11.22 H new ATOM 0 HG13 VAL A 11 10.329 1.179 -11.977 1.00 11.22 H new ATOM 0 HG21 VAL A 11 8.728 3.047 -10.114 1.00 73.23 H new ATOM 0 HG22 VAL A 11 9.073 3.420 -11.819 1.00 73.23 H new ATOM 0 HG23 VAL A 11 7.393 3.410 -11.233 1.00 73.23 H new ATOM 173 N ILE A 12 6.110 2.935 -13.589 1.00 72.21 N ATOM 174 CA ILE A 12 4.773 3.498 -13.734 1.00 62.01 C ATOM 175 C ILE A 12 4.075 2.945 -14.972 1.00 31.23 C ATOM 176 O ILE A 12 2.848 2.852 -15.015 1.00 61.33 O ATOM 177 CB ILE A 12 4.817 5.035 -13.827 1.00 32.32 C ATOM 178 CG1 ILE A 12 3.518 5.637 -13.286 1.00 45.00 C ATOM 179 CG2 ILE A 12 5.051 5.472 -15.265 1.00 43.00 C ATOM 180 CD1 ILE A 12 3.668 6.265 -11.918 1.00 14.10 C ATOM 0 H ILE A 12 6.857 3.520 -13.963 1.00 72.21 H new ATOM 0 HA ILE A 12 4.212 3.211 -12.845 1.00 62.01 H new ATOM 0 HB ILE A 12 5.645 5.398 -13.218 1.00 32.32 H new ATOM 0 HG12 ILE A 12 3.157 6.391 -13.986 1.00 45.00 H new ATOM 0 HG13 ILE A 12 2.758 4.857 -13.238 1.00 45.00 H new ATOM 0 HG21 ILE A 12 5.080 6.561 -15.314 1.00 43.00 H new ATOM 0 HG22 ILE A 12 6.000 5.068 -15.618 1.00 43.00 H new ATOM 0 HG23 ILE A 12 4.242 5.101 -15.894 1.00 43.00 H new ATOM 0 HD11 ILE A 12 2.709 6.671 -11.597 1.00 14.10 H new ATOM 0 HD12 ILE A 12 3.999 5.510 -11.205 1.00 14.10 H new ATOM 0 HD13 ILE A 12 4.404 7.067 -11.965 1.00 14.10 H new ATOM 192 N ASP A 13 4.864 2.577 -15.975 1.00 3.41 N ATOM 193 CA ASP A 13 4.322 2.030 -17.213 1.00 65.22 C ATOM 194 C ASP A 13 3.554 0.739 -16.946 1.00 52.52 C ATOM 195 O ASP A 13 2.523 0.479 -17.567 1.00 14.01 O ATOM 196 CB ASP A 13 5.448 1.770 -18.216 1.00 75.31 C ATOM 197 CG ASP A 13 5.265 0.464 -18.965 1.00 25.15 C ATOM 198 OD1 ASP A 13 4.323 0.374 -19.779 1.00 21.43 O ATOM 199 OD2 ASP A 13 6.065 -0.468 -18.736 1.00 31.15 O ATOM 0 H ASP A 13 5.881 2.648 -15.955 1.00 3.41 H new ATOM 0 HA ASP A 13 3.632 2.762 -17.634 1.00 65.22 H new ATOM 0 HB2 ASP A 13 5.492 2.592 -18.930 1.00 75.31 H new ATOM 0 HB3 ASP A 13 6.403 1.753 -17.690 1.00 75.31 H new ATOM 204 N HIS A 14 4.063 -0.066 -16.019 1.00 42.05 N ATOM 205 CA HIS A 14 3.425 -1.330 -15.671 1.00 32.24 C ATOM 206 C HIS A 14 2.100 -1.090 -14.954 1.00 14.13 C ATOM 207 O HIS A 14 1.211 -1.942 -14.970 1.00 53.15 O ATOM 208 CB HIS A 14 4.351 -2.167 -14.788 1.00 21.10 C ATOM 209 CG HIS A 14 5.465 -2.825 -15.543 1.00 52.00 C ATOM 210 ND1 HIS A 14 5.492 -4.176 -15.819 1.00 51.31 N ATOM 211 CD2 HIS A 14 6.594 -2.309 -16.082 1.00 62.54 C ATOM 212 CE1 HIS A 14 6.591 -4.463 -16.494 1.00 54.11 C ATOM 213 NE2 HIS A 14 7.277 -3.348 -16.667 1.00 53.44 N ATOM 0 H HIS A 14 4.915 0.135 -15.496 1.00 42.05 H new ATOM 0 HA HIS A 14 3.226 -1.874 -16.594 1.00 32.24 H new ATOM 0 HB2 HIS A 14 4.776 -1.529 -14.013 1.00 21.10 H new ATOM 0 HB3 HIS A 14 3.763 -2.933 -14.283 1.00 21.10 H new ATOM 0 HD2 HIS A 14 6.901 -1.274 -16.057 1.00 62.54 H new ATOM 0 HE1 HIS A 14 6.879 -5.443 -16.845 1.00 54.11 H new ATOM 0 HE2 HIS A 14 8.169 -3.271 -17.156 1.00 53.44 H new ATOM 221 N ILE A 15 1.975 0.074 -14.325 1.00 23.12 N ATOM 222 CA ILE A 15 0.759 0.425 -13.603 1.00 12.33 C ATOM 223 C ILE A 15 -0.394 0.690 -14.565 1.00 13.55 C ATOM 224 O ILE A 15 -1.564 0.551 -14.203 1.00 64.00 O ATOM 225 CB ILE A 15 0.969 1.667 -12.716 1.00 42.03 C ATOM 226 CG1 ILE A 15 2.283 1.550 -11.940 1.00 53.23 C ATOM 227 CG2 ILE A 15 -0.203 1.841 -11.762 1.00 24.03 C ATOM 228 CD1 ILE A 15 2.496 2.666 -10.942 1.00 1.40 C ATOM 0 H ILE A 15 2.701 0.790 -14.301 1.00 23.12 H new ATOM 0 HA ILE A 15 0.512 -0.426 -12.969 1.00 12.33 H new ATOM 0 HB ILE A 15 1.024 2.548 -13.356 1.00 42.03 H new ATOM 0 HG12 ILE A 15 2.302 0.595 -11.415 1.00 53.23 H new ATOM 0 HG13 ILE A 15 3.113 1.542 -12.646 1.00 53.23 H new ATOM 0 HG21 ILE A 15 -0.040 2.723 -11.142 1.00 24.03 H new ATOM 0 HG22 ILE A 15 -1.123 1.965 -12.334 1.00 24.03 H new ATOM 0 HG23 ILE A 15 -0.288 0.960 -11.125 1.00 24.03 H new ATOM 0 HD11 ILE A 15 3.446 2.519 -10.429 1.00 1.40 H new ATOM 0 HD12 ILE A 15 2.510 3.623 -11.464 1.00 1.40 H new ATOM 0 HD13 ILE A 15 1.686 2.662 -10.213 1.00 1.40 H new ATOM 240 N LEU A 16 -0.058 1.072 -15.792 1.00 21.03 N ATOM 241 CA LEU A 16 -1.065 1.355 -16.808 1.00 53.21 C ATOM 242 C LEU A 16 -1.993 0.160 -17.003 1.00 12.41 C ATOM 243 O LEU A 16 -3.194 0.322 -17.222 1.00 21.12 O ATOM 244 CB LEU A 16 -0.393 1.715 -18.134 1.00 51.12 C ATOM 245 CG LEU A 16 -1.323 1.868 -19.338 1.00 52.52 C ATOM 246 CD1 LEU A 16 -2.546 2.692 -18.966 1.00 51.45 C ATOM 247 CD2 LEU A 16 -0.584 2.505 -20.506 1.00 5.33 C ATOM 0 H LEU A 16 0.904 1.193 -16.107 1.00 21.03 H new ATOM 0 HA LEU A 16 -1.661 2.202 -16.468 1.00 53.21 H new ATOM 0 HB2 LEU A 16 0.152 2.649 -18.000 1.00 51.12 H new ATOM 0 HB3 LEU A 16 0.344 0.946 -18.365 1.00 51.12 H new ATOM 0 HG LEU A 16 -1.657 0.876 -19.643 1.00 52.52 H new ATOM 0 HD11 LEU A 16 -3.196 2.790 -19.835 1.00 51.45 H new ATOM 0 HD12 LEU A 16 -3.088 2.195 -18.161 1.00 51.45 H new ATOM 0 HD13 LEU A 16 -2.231 3.681 -18.635 1.00 51.45 H new ATOM 0 HD21 LEU A 16 -1.262 2.606 -21.354 1.00 5.33 H new ATOM 0 HD22 LEU A 16 -0.220 3.490 -20.213 1.00 5.33 H new ATOM 0 HD23 LEU A 16 0.260 1.876 -20.789 1.00 5.33 H new ATOM 259 N LYS A 17 -1.429 -1.040 -16.920 1.00 11.21 N ATOM 260 CA LYS A 17 -2.205 -2.263 -17.083 1.00 71.44 C ATOM 261 C LYS A 17 -3.225 -2.415 -15.959 1.00 63.32 C ATOM 262 O LYS A 17 -4.192 -3.167 -16.083 1.00 72.35 O ATOM 263 CB LYS A 17 -1.277 -3.480 -17.113 1.00 33.03 C ATOM 264 CG LYS A 17 -1.074 -4.057 -18.503 1.00 51.30 C ATOM 265 CD LYS A 17 0.076 -3.377 -19.226 1.00 44.21 C ATOM 266 CE LYS A 17 -0.009 -3.587 -20.730 1.00 42.42 C ATOM 267 NZ LYS A 17 0.781 -2.569 -21.478 1.00 31.23 N ATOM 0 H LYS A 17 -0.436 -1.192 -16.741 1.00 11.21 H new ATOM 0 HA LYS A 17 -2.742 -2.200 -18.030 1.00 71.44 H new ATOM 0 HB2 LYS A 17 -0.308 -3.198 -16.701 1.00 33.03 H new ATOM 0 HB3 LYS A 17 -1.686 -4.254 -16.464 1.00 33.03 H new ATOM 0 HG2 LYS A 17 -0.877 -5.126 -18.429 1.00 51.30 H new ATOM 0 HG3 LYS A 17 -1.989 -3.941 -19.083 1.00 51.30 H new ATOM 0 HD2 LYS A 17 0.065 -2.310 -19.005 1.00 44.21 H new ATOM 0 HD3 LYS A 17 1.023 -3.770 -18.856 1.00 44.21 H new ATOM 0 HE2 LYS A 17 0.355 -4.584 -20.979 1.00 42.42 H new ATOM 0 HE3 LYS A 17 -1.052 -3.541 -21.045 1.00 42.42 H new ATOM 0 HZ1 LYS A 17 0.697 -2.746 -22.499 1.00 31.23 H new ATOM 0 HZ2 LYS A 17 0.417 -1.619 -21.261 1.00 31.23 H new ATOM 0 HZ3 LYS A 17 1.780 -2.630 -21.197 1.00 31.23 H new ATOM 281 N CYS A 18 -3.003 -1.697 -14.864 1.00 44.33 N ATOM 282 CA CYS A 18 -3.903 -1.752 -13.718 1.00 50.40 C ATOM 283 C CYS A 18 -5.163 -0.932 -13.977 1.00 0.14 C ATOM 284 O CYS A 18 -6.266 -1.335 -13.606 1.00 64.23 O ATOM 285 CB CYS A 18 -3.196 -1.240 -12.463 1.00 4.55 C ATOM 286 SG CYS A 18 -1.612 -2.046 -12.127 1.00 14.34 S ATOM 0 H CYS A 18 -2.207 -1.070 -14.746 1.00 44.33 H new ATOM 0 HA CYS A 18 -4.193 -2.791 -13.564 1.00 50.40 H new ATOM 0 HB2 CYS A 18 -3.031 -0.167 -12.564 1.00 4.55 H new ATOM 0 HB3 CYS A 18 -3.853 -1.382 -11.605 1.00 4.55 H new ATOM 0 HG CYS A 18 -1.090 -1.544 -11.047 1.00 14.34 H new ATOM 292 N VAL A 19 -4.992 0.222 -14.613 1.00 44.24 N ATOM 293 CA VAL A 19 -6.115 1.100 -14.921 1.00 64.32 C ATOM 294 C VAL A 19 -6.743 0.738 -16.262 1.00 51.13 C ATOM 295 O VAL A 19 -7.933 0.963 -16.483 1.00 52.42 O ATOM 296 CB VAL A 19 -5.680 2.577 -14.952 1.00 14.21 C ATOM 297 CG1 VAL A 19 -5.705 3.112 -16.376 1.00 22.42 C ATOM 298 CG2 VAL A 19 -6.571 3.413 -14.045 1.00 21.33 C ATOM 0 H VAL A 19 -4.086 0.571 -14.925 1.00 44.24 H new ATOM 0 HA VAL A 19 -6.851 0.963 -14.129 1.00 64.32 H new ATOM 0 HB VAL A 19 -4.657 2.644 -14.582 1.00 14.21 H new ATOM 0 HG11 VAL A 19 -5.395 4.157 -16.378 1.00 22.42 H new ATOM 0 HG12 VAL A 19 -5.023 2.530 -16.995 1.00 22.42 H new ATOM 0 HG13 VAL A 19 -6.716 3.033 -16.777 1.00 22.42 H new ATOM 0 HG21 VAL A 19 -6.250 4.454 -14.079 1.00 21.33 H new ATOM 0 HG22 VAL A 19 -7.605 3.341 -14.384 1.00 21.33 H new ATOM 0 HG23 VAL A 19 -6.498 3.044 -13.022 1.00 21.33 H new ATOM 308 N PHE A 20 -5.936 0.175 -17.155 1.00 43.43 N ATOM 309 CA PHE A 20 -6.412 -0.218 -18.476 1.00 54.42 C ATOM 310 C PHE A 20 -7.130 -1.563 -18.417 1.00 51.13 C ATOM 311 O PHE A 20 -7.894 -1.911 -19.318 1.00 15.34 O ATOM 312 CB PHE A 20 -5.244 -0.293 -19.462 1.00 14.33 C ATOM 313 CG PHE A 20 -5.620 0.082 -20.867 1.00 15.23 C ATOM 314 CD1 PHE A 20 -6.357 -0.786 -21.656 1.00 32.20 C ATOM 315 CD2 PHE A 20 -5.237 1.303 -21.398 1.00 62.13 C ATOM 316 CE1 PHE A 20 -6.705 -0.444 -22.949 1.00 73.12 C ATOM 317 CE2 PHE A 20 -5.582 1.651 -22.691 1.00 33.54 C ATOM 318 CZ PHE A 20 -6.316 0.776 -23.467 1.00 73.54 C ATOM 0 H PHE A 20 -4.949 -0.019 -16.988 1.00 43.43 H new ATOM 0 HA PHE A 20 -7.119 0.537 -18.819 1.00 54.42 H new ATOM 0 HB2 PHE A 20 -4.447 0.367 -19.119 1.00 14.33 H new ATOM 0 HB3 PHE A 20 -4.842 -1.306 -19.460 1.00 14.33 H new ATOM 0 HD1 PHE A 20 -6.663 -1.741 -21.256 1.00 32.20 H new ATOM 0 HD2 PHE A 20 -4.662 1.991 -20.795 1.00 62.13 H new ATOM 0 HE1 PHE A 20 -7.280 -1.130 -23.554 1.00 73.12 H new ATOM 0 HE2 PHE A 20 -5.278 2.606 -23.093 1.00 33.54 H new ATOM 0 HZ PHE A 20 -6.586 1.045 -24.478 1.00 73.54 H new ATOM 328 N ASP A 21 -6.878 -2.315 -17.352 1.00 3.02 N ATOM 329 CA ASP A 21 -7.499 -3.622 -17.174 1.00 33.10 C ATOM 330 C ASP A 21 -8.991 -3.480 -16.887 1.00 62.11 C ATOM 331 O ASP A 21 -9.820 -4.141 -17.512 1.00 72.51 O ATOM 332 CB ASP A 21 -6.819 -4.384 -16.036 1.00 4.45 C ATOM 333 CG ASP A 21 -7.625 -5.583 -15.578 1.00 11.14 C ATOM 334 OD1 ASP A 21 -7.953 -6.438 -16.428 1.00 4.35 O ATOM 335 OD2 ASP A 21 -7.928 -5.667 -14.369 1.00 71.23 O ATOM 0 H ASP A 21 -6.247 -2.042 -16.598 1.00 3.02 H new ATOM 0 HA ASP A 21 -7.377 -4.183 -18.100 1.00 33.10 H new ATOM 0 HB2 ASP A 21 -5.834 -4.716 -16.363 1.00 4.45 H new ATOM 0 HB3 ASP A 21 -6.665 -3.710 -15.193 1.00 4.45 H new ATOM 340 N LYS A 22 -9.325 -2.614 -15.937 1.00 15.21 N ATOM 341 CA LYS A 22 -10.717 -2.384 -15.566 1.00 3.11 C ATOM 342 C LYS A 22 -11.565 -2.082 -16.797 1.00 33.11 C ATOM 343 O LYS A 22 -12.661 -2.621 -16.954 1.00 71.40 O ATOM 344 CB LYS A 22 -10.816 -1.227 -14.569 1.00 44.00 C ATOM 345 CG LYS A 22 -9.945 -1.409 -13.338 1.00 11.13 C ATOM 346 CD LYS A 22 -10.732 -2.001 -12.181 1.00 13.23 C ATOM 347 CE LYS A 22 -11.256 -3.389 -12.515 1.00 53.14 C ATOM 348 NZ LYS A 22 -11.322 -4.262 -11.311 1.00 33.21 N ATOM 0 H LYS A 22 -8.651 -2.059 -15.409 1.00 15.21 H new ATOM 0 HA LYS A 22 -11.097 -3.292 -15.098 1.00 3.11 H new ATOM 0 HB2 LYS A 22 -10.533 -0.301 -15.070 1.00 44.00 H new ATOM 0 HB3 LYS A 22 -11.854 -1.116 -14.256 1.00 44.00 H new ATOM 0 HG2 LYS A 22 -9.105 -2.060 -13.579 1.00 11.13 H new ATOM 0 HG3 LYS A 22 -9.528 -0.447 -13.041 1.00 11.13 H new ATOM 0 HD2 LYS A 22 -10.097 -2.054 -11.297 1.00 13.23 H new ATOM 0 HD3 LYS A 22 -11.567 -1.345 -11.935 1.00 13.23 H new ATOM 0 HE2 LYS A 22 -12.249 -3.306 -12.958 1.00 53.14 H new ATOM 0 HE3 LYS A 22 -10.611 -3.850 -13.263 1.00 53.14 H new ATOM 0 HZ1 LYS A 22 -11.684 -5.199 -11.581 1.00 33.21 H new ATOM 0 HZ2 LYS A 22 -10.371 -4.363 -10.903 1.00 33.21 H new ATOM 0 HZ3 LYS A 22 -11.957 -3.835 -10.607 1.00 33.21 H new ATOM 362 N ILE A 23 -11.052 -1.219 -17.667 1.00 24.20 N ATOM 363 CA ILE A 23 -11.762 -0.849 -18.885 1.00 2.22 C ATOM 364 C ILE A 23 -12.178 -2.084 -19.676 1.00 33.34 C ATOM 365 O ILE A 23 -13.260 -2.122 -20.264 1.00 3.12 O ATOM 366 CB ILE A 23 -10.901 0.057 -19.785 1.00 50.00 C ATOM 367 CG1 ILE A 23 -10.577 1.368 -19.066 1.00 23.15 C ATOM 368 CG2 ILE A 23 -11.616 0.331 -21.099 1.00 74.15 C ATOM 369 CD1 ILE A 23 -9.225 1.940 -19.432 1.00 32.10 C ATOM 0 H ILE A 23 -10.147 -0.763 -17.551 1.00 24.20 H new ATOM 0 HA ILE A 23 -12.652 -0.301 -18.577 1.00 2.22 H new ATOM 0 HB ILE A 23 -9.965 -0.457 -20.003 1.00 50.00 H new ATOM 0 HG12 ILE A 23 -11.348 2.102 -19.300 1.00 23.15 H new ATOM 0 HG13 ILE A 23 -10.612 1.201 -17.989 1.00 23.15 H new ATOM 0 HG21 ILE A 23 -10.995 0.973 -21.724 1.00 74.15 H new ATOM 0 HG22 ILE A 23 -11.801 -0.611 -21.616 1.00 74.15 H new ATOM 0 HG23 ILE A 23 -12.566 0.828 -20.900 1.00 74.15 H new ATOM 0 HD11 ILE A 23 -9.063 2.869 -18.885 1.00 32.10 H new ATOM 0 HD12 ILE A 23 -8.445 1.225 -19.172 1.00 32.10 H new ATOM 0 HD13 ILE A 23 -9.192 2.139 -20.503 1.00 32.10 H new ATOM 381 N CYS A 24 -11.315 -3.093 -19.684 1.00 25.41 N ATOM 382 CA CYS A 24 -11.593 -4.332 -20.402 1.00 21.32 C ATOM 383 C CYS A 24 -12.502 -5.243 -19.583 1.00 10.32 C ATOM 384 O CYS A 24 -13.175 -6.119 -20.127 1.00 3.23 O ATOM 385 CB CYS A 24 -10.288 -5.058 -20.733 1.00 73.30 C ATOM 386 SG CYS A 24 -9.319 -4.274 -22.042 1.00 62.03 S ATOM 0 H CYS A 24 -10.417 -3.078 -19.201 1.00 25.41 H new ATOM 0 HA CYS A 24 -12.105 -4.078 -21.330 1.00 21.32 H new ATOM 0 HB2 CYS A 24 -9.679 -5.118 -19.831 1.00 73.30 H new ATOM 0 HB3 CYS A 24 -10.519 -6.081 -21.030 1.00 73.30 H new ATOM 0 HG CYS A 24 -8.234 -4.959 -22.248 1.00 62.03 H new ATOM 392 N LYS A 25 -12.516 -5.031 -18.271 1.00 54.22 N ATOM 393 CA LYS A 25 -13.342 -5.832 -17.375 1.00 41.12 C ATOM 394 C LYS A 25 -14.788 -5.348 -17.390 1.00 14.01 C ATOM 395 O LYS A 25 -15.703 -6.105 -17.717 1.00 65.31 O ATOM 396 CB LYS A 25 -12.788 -5.774 -15.950 1.00 30.02 C ATOM 397 CG LYS A 25 -12.973 -7.066 -15.172 1.00 40.25 C ATOM 398 CD LYS A 25 -11.638 -7.697 -14.815 1.00 31.40 C ATOM 399 CE LYS A 25 -10.875 -8.129 -16.058 1.00 3.51 C ATOM 400 NZ LYS A 25 -10.444 -9.552 -15.978 1.00 42.34 N ATOM 0 H LYS A 25 -11.964 -4.311 -17.805 1.00 54.22 H new ATOM 0 HA LYS A 25 -13.319 -6.864 -17.725 1.00 41.12 H new ATOM 0 HB2 LYS A 25 -11.726 -5.534 -15.992 1.00 30.02 H new ATOM 0 HB3 LYS A 25 -13.277 -4.962 -15.412 1.00 30.02 H new ATOM 0 HG2 LYS A 25 -13.537 -6.866 -14.261 1.00 40.25 H new ATOM 0 HG3 LYS A 25 -13.561 -7.767 -15.764 1.00 40.25 H new ATOM 0 HD2 LYS A 25 -11.038 -6.985 -14.248 1.00 31.40 H new ATOM 0 HD3 LYS A 25 -11.803 -8.560 -14.170 1.00 31.40 H new ATOM 0 HE2 LYS A 25 -11.504 -7.989 -16.937 1.00 3.51 H new ATOM 0 HE3 LYS A 25 -10.000 -7.491 -16.187 1.00 3.51 H new ATOM 0 HZ1 LYS A 25 -9.928 -9.808 -16.844 1.00 42.34 H new ATOM 0 HZ2 LYS A 25 -9.823 -9.681 -15.154 1.00 42.34 H new ATOM 0 HZ3 LYS A 25 -11.280 -10.163 -15.881 1.00 42.34 H new ATOM 414 N ILE A 26 -14.988 -4.083 -17.035 1.00 61.12 N ATOM 415 CA ILE A 26 -16.323 -3.499 -17.011 1.00 0.33 C ATOM 416 C ILE A 26 -17.005 -3.628 -18.369 1.00 5.33 C ATOM 417 O ILE A 26 -18.231 -3.628 -18.462 1.00 12.51 O ATOM 418 CB ILE A 26 -16.280 -2.012 -16.610 1.00 25.31 C ATOM 419 CG1 ILE A 26 -15.246 -1.264 -17.455 1.00 14.34 C ATOM 420 CG2 ILE A 26 -15.962 -1.872 -15.129 1.00 33.24 C ATOM 421 CD1 ILE A 26 -15.785 0.000 -18.088 1.00 1.01 C ATOM 0 H ILE A 26 -14.243 -3.443 -16.760 1.00 61.12 H new ATOM 0 HA ILE A 26 -16.895 -4.052 -16.266 1.00 0.33 H new ATOM 0 HB ILE A 26 -17.260 -1.572 -16.794 1.00 25.31 H new ATOM 0 HG12 ILE A 26 -14.391 -1.011 -16.828 1.00 14.34 H new ATOM 0 HG13 ILE A 26 -14.881 -1.927 -18.240 1.00 14.34 H new ATOM 0 HG21 ILE A 26 -15.935 -0.816 -14.861 1.00 33.24 H new ATOM 0 HG22 ILE A 26 -16.730 -2.376 -14.543 1.00 33.24 H new ATOM 0 HG23 ILE A 26 -14.992 -2.324 -14.921 1.00 33.24 H new ATOM 0 HD11 ILE A 26 -14.999 0.478 -18.672 1.00 1.01 H new ATOM 0 HD12 ILE A 26 -16.622 -0.248 -18.741 1.00 1.01 H new ATOM 0 HD13 ILE A 26 -16.123 0.682 -17.308 1.00 1.01 H new ATOM 433 N GLY A 27 -16.199 -3.740 -19.421 1.00 12.41 N ATOM 434 CA GLY A 27 -16.742 -3.870 -20.760 1.00 55.33 C ATOM 435 C GLY A 27 -17.388 -5.221 -20.995 1.00 40.14 C ATOM 436 O GLY A 27 -18.143 -5.399 -21.952 1.00 30.51 O ATOM 0 H GLY A 27 -15.180 -3.743 -19.369 1.00 12.41 H new ATOM 0 HA2 GLY A 27 -17.479 -3.084 -20.928 1.00 55.33 H new ATOM 0 HA3 GLY A 27 -15.945 -3.720 -21.488 1.00 55.33 H new ATOM 440 N THR A 28 -17.090 -6.178 -20.122 1.00 10.44 N ATOM 441 CA THR A 28 -17.644 -7.520 -20.240 1.00 71.40 C ATOM 442 C THR A 28 -19.026 -7.603 -19.602 1.00 22.35 C ATOM 443 O THR A 28 -19.839 -8.451 -19.968 1.00 65.32 O ATOM 444 CB THR A 28 -16.724 -8.567 -19.584 1.00 73.51 C ATOM 445 OG1 THR A 28 -16.828 -9.815 -20.279 1.00 50.14 O ATOM 446 CG2 THR A 28 -17.087 -8.765 -18.120 1.00 73.41 C ATOM 0 H THR A 28 -16.467 -6.048 -19.325 1.00 10.44 H new ATOM 0 HA THR A 28 -17.726 -7.735 -21.305 1.00 71.40 H new ATOM 0 HB THR A 28 -15.698 -8.204 -19.642 1.00 73.51 H new ATOM 0 HG1 THR A 28 -16.239 -10.475 -19.857 1.00 50.14 H new ATOM 0 HG21 THR A 28 -16.424 -9.509 -17.678 1.00 73.41 H new ATOM 0 HG22 THR A 28 -16.979 -7.820 -17.587 1.00 73.41 H new ATOM 0 HG23 THR A 28 -18.119 -9.108 -18.044 1.00 73.41 H new ATOM 454 N GLU A 29 -19.285 -6.717 -18.645 1.00 50.02 N ATOM 455 CA GLU A 29 -20.570 -6.692 -17.956 1.00 42.51 C ATOM 456 C GLU A 29 -21.602 -5.904 -18.758 1.00 3.40 C ATOM 457 O GLU A 29 -22.764 -6.297 -18.850 1.00 15.02 O ATOM 458 CB GLU A 29 -20.414 -6.079 -16.563 1.00 13.33 C ATOM 459 CG GLU A 29 -19.703 -6.987 -15.574 1.00 61.22 C ATOM 460 CD GLU A 29 -20.257 -6.866 -14.168 1.00 24.22 C ATOM 461 OE1 GLU A 29 -20.632 -5.743 -13.772 1.00 21.11 O ATOM 462 OE2 GLU A 29 -20.315 -7.896 -13.463 1.00 43.21 O ATOM 0 H GLU A 29 -18.623 -6.008 -18.330 1.00 50.02 H new ATOM 0 HA GLU A 29 -20.920 -7.719 -17.856 1.00 42.51 H new ATOM 0 HB2 GLU A 29 -19.861 -5.144 -16.647 1.00 13.33 H new ATOM 0 HB3 GLU A 29 -21.401 -5.832 -16.172 1.00 13.33 H new ATOM 0 HG2 GLU A 29 -19.791 -8.021 -15.907 1.00 61.22 H new ATOM 0 HG3 GLU A 29 -18.640 -6.745 -15.564 1.00 61.22 H new ATOM 469 N SER A 30 -21.167 -4.788 -19.336 1.00 73.43 N ATOM 470 CA SER A 30 -22.053 -3.942 -20.127 1.00 13.02 C ATOM 471 C SER A 30 -22.588 -4.698 -21.339 1.00 60.22 C ATOM 472 O SER A 30 -23.583 -4.300 -21.944 1.00 74.03 O ATOM 473 CB SER A 30 -21.316 -2.681 -20.582 1.00 54.02 C ATOM 474 OG SER A 30 -22.121 -1.528 -20.406 1.00 35.20 O ATOM 0 H SER A 30 -20.207 -4.449 -19.271 1.00 73.43 H new ATOM 0 HA SER A 30 -22.897 -3.655 -19.499 1.00 13.02 H new ATOM 0 HB2 SER A 30 -20.391 -2.572 -20.016 1.00 54.02 H new ATOM 0 HB3 SER A 30 -21.038 -2.777 -21.631 1.00 54.02 H new ATOM 0 HG SER A 30 -21.627 -0.735 -20.703 1.00 35.20 H new ATOM 480 N VAL A 31 -21.919 -5.792 -21.689 1.00 22.33 N ATOM 481 CA VAL A 31 -22.326 -6.606 -22.828 1.00 22.11 C ATOM 482 C VAL A 31 -23.743 -7.138 -22.645 1.00 40.32 C ATOM 483 O VAL A 31 -24.404 -7.514 -23.612 1.00 53.22 O ATOM 484 CB VAL A 31 -21.368 -7.793 -23.041 1.00 24.14 C ATOM 485 CG1 VAL A 31 -21.799 -8.619 -24.243 1.00 42.21 C ATOM 486 CG2 VAL A 31 -19.938 -7.300 -23.207 1.00 71.00 C ATOM 0 H VAL A 31 -21.092 -6.135 -21.200 1.00 22.33 H new ATOM 0 HA VAL A 31 -22.294 -5.960 -23.706 1.00 22.11 H new ATOM 0 HB VAL A 31 -21.408 -8.432 -22.159 1.00 24.14 H new ATOM 0 HG11 VAL A 31 -21.110 -9.453 -24.377 1.00 42.21 H new ATOM 0 HG12 VAL A 31 -22.806 -9.003 -24.078 1.00 42.21 H new ATOM 0 HG13 VAL A 31 -21.791 -7.994 -25.136 1.00 42.21 H new ATOM 0 HG21 VAL A 31 -19.275 -8.152 -23.356 1.00 71.00 H new ATOM 0 HG22 VAL A 31 -19.879 -6.638 -24.071 1.00 71.00 H new ATOM 0 HG23 VAL A 31 -19.634 -6.756 -22.312 1.00 71.00 H new ATOM 496 N GLU A 32 -24.203 -7.165 -21.398 1.00 62.11 N ATOM 497 CA GLU A 32 -25.542 -7.651 -21.089 1.00 73.21 C ATOM 498 C GLU A 32 -26.570 -6.530 -21.214 1.00 32.21 C ATOM 499 O GLU A 32 -27.540 -6.644 -21.963 1.00 0.41 O ATOM 500 CB GLU A 32 -25.582 -8.240 -19.677 1.00 53.23 C ATOM 501 CG GLU A 32 -25.208 -9.711 -19.621 1.00 33.45 C ATOM 502 CD GLU A 32 -23.728 -9.928 -19.370 1.00 55.01 C ATOM 503 OE1 GLU A 32 -22.933 -9.748 -20.316 1.00 75.20 O ATOM 504 OE2 GLU A 32 -23.366 -10.277 -18.227 1.00 62.31 O ATOM 0 H GLU A 32 -23.668 -6.856 -20.586 1.00 62.11 H new ATOM 0 HA GLU A 32 -25.792 -8.432 -21.807 1.00 73.21 H new ATOM 0 HB2 GLU A 32 -24.902 -7.676 -19.038 1.00 53.23 H new ATOM 0 HB3 GLU A 32 -26.584 -8.113 -19.267 1.00 53.23 H new ATOM 0 HG2 GLU A 32 -25.782 -10.198 -18.832 1.00 33.45 H new ATOM 0 HG3 GLU A 32 -25.487 -10.189 -20.560 1.00 33.45 H new ATOM 511 N ALA A 33 -26.350 -5.449 -20.474 1.00 10.52 N ATOM 512 CA ALA A 33 -27.255 -4.306 -20.502 1.00 72.41 C ATOM 513 C ALA A 33 -27.427 -3.777 -21.922 1.00 4.22 C ATOM 514 O ALA A 33 -28.425 -3.131 -22.238 1.00 30.23 O ATOM 515 CB ALA A 33 -26.745 -3.206 -19.584 1.00 43.52 C ATOM 0 H ALA A 33 -25.553 -5.340 -19.847 1.00 10.52 H new ATOM 0 HA ALA A 33 -28.230 -4.637 -20.145 1.00 72.41 H new ATOM 0 HB1 ALA A 33 -27.431 -2.359 -19.615 1.00 43.52 H new ATOM 0 HB2 ALA A 33 -26.681 -3.584 -18.564 1.00 43.52 H new ATOM 0 HB3 ALA A 33 -25.757 -2.885 -19.914 1.00 43.52 H new ATOM 521 N GLY A 34 -26.445 -4.054 -22.775 1.00 22.13 N ATOM 522 CA GLY A 34 -26.506 -3.597 -24.151 1.00 34.03 C ATOM 523 C GLY A 34 -27.503 -4.384 -24.979 1.00 11.52 C ATOM 524 O GLY A 34 -28.230 -3.814 -25.793 1.00 33.03 O ATOM 0 H GLY A 34 -25.608 -4.587 -22.537 1.00 22.13 H new ATOM 0 HA2 GLY A 34 -26.777 -2.541 -24.168 1.00 34.03 H new ATOM 0 HA3 GLY A 34 -25.517 -3.680 -24.603 1.00 34.03 H new ATOM 528 N ARG A 35 -27.536 -5.696 -24.773 1.00 33.03 N ATOM 529 CA ARG A 35 -28.449 -6.562 -25.509 1.00 31.21 C ATOM 530 C ARG A 35 -29.789 -6.677 -24.788 1.00 72.44 C ATOM 531 O ARG A 35 -30.807 -7.012 -25.397 1.00 2.42 O ATOM 532 CB ARG A 35 -27.834 -7.951 -25.689 1.00 61.24 C ATOM 533 CG ARG A 35 -26.425 -7.924 -26.258 1.00 4.11 C ATOM 534 CD ARG A 35 -26.281 -6.865 -27.340 1.00 4.34 C ATOM 535 NE ARG A 35 -27.315 -6.984 -28.364 1.00 23.41 N ATOM 536 CZ ARG A 35 -27.288 -7.893 -29.332 1.00 70.24 C ATOM 537 NH1 ARG A 35 -26.285 -8.757 -29.408 1.00 33.32 N ATOM 538 NH2 ARG A 35 -28.266 -7.939 -30.228 1.00 32.11 N ATOM 0 H ARG A 35 -26.941 -6.183 -24.103 1.00 33.03 H new ATOM 0 HA ARG A 35 -28.620 -6.118 -26.490 1.00 31.21 H new ATOM 0 HB2 ARG A 35 -27.818 -8.460 -24.725 1.00 61.24 H new ATOM 0 HB3 ARG A 35 -28.472 -8.539 -26.349 1.00 61.24 H new ATOM 0 HG2 ARG A 35 -25.712 -7.727 -25.457 1.00 4.11 H new ATOM 0 HG3 ARG A 35 -26.179 -8.903 -26.670 1.00 4.11 H new ATOM 0 HD2 ARG A 35 -26.332 -5.875 -26.887 1.00 4.34 H new ATOM 0 HD3 ARG A 35 -25.299 -6.953 -27.805 1.00 4.34 H new ATOM 0 HE ARG A 35 -28.100 -6.334 -28.334 1.00 23.41 H new ATOM 0 HH11 ARG A 35 -25.531 -8.725 -28.722 1.00 33.32 H new ATOM 0 HH12 ARG A 35 -26.267 -9.454 -30.153 1.00 33.32 H new ATOM 0 HH21 ARG A 35 -29.039 -7.276 -30.174 1.00 32.11 H new ATOM 0 HH22 ARG A 35 -28.244 -8.637 -30.971 1.00 32.11 H new ATOM 552 N LEU A 36 -29.782 -6.399 -23.489 1.00 73.24 N ATOM 553 CA LEU A 36 -30.997 -6.472 -22.685 1.00 11.11 C ATOM 554 C LEU A 36 -31.864 -5.234 -22.894 1.00 64.21 C ATOM 555 O LEU A 36 -33.092 -5.319 -22.905 1.00 30.15 O ATOM 556 CB LEU A 36 -30.644 -6.617 -21.204 1.00 4.43 C ATOM 557 CG LEU A 36 -30.743 -8.028 -20.625 1.00 22.32 C ATOM 558 CD1 LEU A 36 -29.665 -8.924 -21.215 1.00 20.31 C ATOM 559 CD2 LEU A 36 -30.636 -7.991 -19.107 1.00 71.22 C ATOM 0 H LEU A 36 -28.949 -6.121 -22.970 1.00 73.24 H new ATOM 0 HA LEU A 36 -31.563 -7.347 -23.005 1.00 11.11 H new ATOM 0 HB2 LEU A 36 -29.626 -6.256 -21.057 1.00 4.43 H new ATOM 0 HB3 LEU A 36 -31.300 -5.963 -20.629 1.00 4.43 H new ATOM 0 HG LEU A 36 -31.716 -8.441 -20.891 1.00 22.32 H new ATOM 0 HD11 LEU A 36 -29.751 -9.924 -20.791 1.00 20.31 H new ATOM 0 HD12 LEU A 36 -29.787 -8.977 -22.297 1.00 20.31 H new ATOM 0 HD13 LEU A 36 -28.683 -8.514 -20.981 1.00 20.31 H new ATOM 0 HD21 LEU A 36 -30.709 -9.004 -18.712 1.00 71.22 H new ATOM 0 HD22 LEU A 36 -29.678 -7.558 -18.820 1.00 71.22 H new ATOM 0 HD23 LEU A 36 -31.445 -7.384 -18.700 1.00 71.22 H new ATOM 571 N ILE A 37 -31.216 -4.086 -23.062 1.00 62.43 N ATOM 572 CA ILE A 37 -31.927 -2.832 -23.275 1.00 34.22 C ATOM 573 C ILE A 37 -32.527 -2.771 -24.676 1.00 1.35 C ATOM 574 O ILE A 37 -33.648 -2.298 -24.861 1.00 21.42 O ATOM 575 CB ILE A 37 -31.002 -1.618 -23.071 1.00 22.20 C ATOM 576 CG1 ILE A 37 -31.030 -1.168 -21.609 1.00 50.41 C ATOM 577 CG2 ILE A 37 -31.413 -0.478 -23.990 1.00 74.14 C ATOM 578 CD1 ILE A 37 -31.004 -2.314 -20.623 1.00 32.13 C ATOM 0 H ILE A 37 -30.200 -3.999 -23.055 1.00 62.43 H new ATOM 0 HA ILE A 37 -32.729 -2.795 -22.537 1.00 34.22 H new ATOM 0 HB ILE A 37 -29.982 -1.911 -23.322 1.00 22.20 H new ATOM 0 HG12 ILE A 37 -30.175 -0.518 -21.421 1.00 50.41 H new ATOM 0 HG13 ILE A 37 -31.927 -0.572 -21.438 1.00 50.41 H new ATOM 0 HG21 ILE A 37 -30.750 0.373 -23.834 1.00 74.14 H new ATOM 0 HG22 ILE A 37 -31.346 -0.805 -25.028 1.00 74.14 H new ATOM 0 HG23 ILE A 37 -32.439 -0.184 -23.768 1.00 74.14 H new ATOM 0 HD11 ILE A 37 -31.026 -1.920 -19.607 1.00 32.13 H new ATOM 0 HD12 ILE A 37 -31.873 -2.952 -20.784 1.00 32.13 H new ATOM 0 HD13 ILE A 37 -30.094 -2.897 -20.767 1.00 32.13 H new ATOM 590 N GLU A 38 -31.772 -3.253 -25.658 1.00 74.10 N ATOM 591 CA GLU A 38 -32.230 -3.253 -27.042 1.00 75.54 C ATOM 592 C GLU A 38 -33.347 -4.274 -27.246 1.00 3.13 C ATOM 593 O GLU A 38 -34.366 -3.979 -27.871 1.00 72.52 O ATOM 594 CB GLU A 38 -31.067 -3.559 -27.988 1.00 1.11 C ATOM 595 CG GLU A 38 -31.392 -4.614 -29.032 1.00 41.42 C ATOM 596 CD GLU A 38 -30.309 -4.745 -30.085 1.00 62.22 C ATOM 597 OE1 GLU A 38 -29.224 -4.156 -29.896 1.00 61.03 O ATOM 598 OE2 GLU A 38 -30.546 -5.437 -31.098 1.00 3.53 O ATOM 0 H GLU A 38 -30.842 -3.648 -25.521 1.00 74.10 H new ATOM 0 HA GLU A 38 -32.621 -2.261 -27.268 1.00 75.54 H new ATOM 0 HB2 GLU A 38 -30.769 -2.640 -28.493 1.00 1.11 H new ATOM 0 HB3 GLU A 38 -30.211 -3.892 -27.401 1.00 1.11 H new ATOM 0 HG2 GLU A 38 -31.533 -5.576 -28.539 1.00 41.42 H new ATOM 0 HG3 GLU A 38 -32.336 -4.362 -29.516 1.00 41.42 H new ATOM 605 N LEU A 39 -33.147 -5.475 -26.714 1.00 5.42 N ATOM 606 CA LEU A 39 -34.135 -6.540 -26.836 1.00 72.24 C ATOM 607 C LEU A 39 -35.512 -6.059 -26.390 1.00 73.42 C ATOM 608 O LEU A 39 -36.536 -6.518 -26.898 1.00 44.22 O ATOM 609 CB LEU A 39 -33.712 -7.753 -26.006 1.00 72.31 C ATOM 610 CG LEU A 39 -32.979 -8.862 -26.762 1.00 51.33 C ATOM 611 CD1 LEU A 39 -32.043 -8.268 -27.804 1.00 22.45 C ATOM 612 CD2 LEU A 39 -32.210 -9.749 -25.794 1.00 41.05 C ATOM 0 H LEU A 39 -32.309 -5.735 -26.194 1.00 5.42 H new ATOM 0 HA LEU A 39 -34.194 -6.829 -27.885 1.00 72.24 H new ATOM 0 HB2 LEU A 39 -33.070 -7.407 -25.196 1.00 72.31 H new ATOM 0 HB3 LEU A 39 -34.602 -8.182 -25.546 1.00 72.31 H new ATOM 0 HG LEU A 39 -33.718 -9.476 -27.276 1.00 51.33 H new ATOM 0 HD11 LEU A 39 -31.530 -9.072 -28.332 1.00 22.45 H new ATOM 0 HD12 LEU A 39 -32.619 -7.676 -28.515 1.00 22.45 H new ATOM 0 HD13 LEU A 39 -31.309 -7.630 -27.312 1.00 22.45 H new ATOM 0 HD21 LEU A 39 -31.695 -10.533 -26.349 1.00 41.05 H new ATOM 0 HD22 LEU A 39 -31.480 -9.148 -25.252 1.00 41.05 H new ATOM 0 HD23 LEU A 39 -32.904 -10.202 -25.086 1.00 41.05 H new ATOM 624 N SER A 40 -35.530 -5.131 -25.439 1.00 22.43 N ATOM 625 CA SER A 40 -36.781 -4.589 -24.923 1.00 32.12 C ATOM 626 C SER A 40 -37.375 -3.574 -25.895 1.00 2.24 C ATOM 627 O SER A 40 -38.593 -3.476 -26.038 1.00 51.02 O ATOM 628 CB SER A 40 -36.554 -3.934 -23.559 1.00 61.10 C ATOM 629 OG SER A 40 -36.860 -4.831 -22.505 1.00 53.33 O ATOM 0 H SER A 40 -34.692 -4.739 -25.010 1.00 22.43 H new ATOM 0 HA SER A 40 -37.486 -5.413 -24.809 1.00 32.12 H new ATOM 0 HB2 SER A 40 -35.516 -3.610 -23.476 1.00 61.10 H new ATOM 0 HB3 SER A 40 -37.174 -3.042 -23.473 1.00 61.10 H new ATOM 0 HG SER A 40 -36.705 -4.389 -21.644 1.00 53.33 H new ATOM 635 N GLN A 41 -36.504 -2.821 -26.559 1.00 11.21 N ATOM 636 CA GLN A 41 -36.942 -1.812 -27.517 1.00 23.23 C ATOM 637 C GLN A 41 -37.925 -2.405 -28.520 1.00 73.13 C ATOM 638 O GLN A 41 -37.531 -3.123 -29.439 1.00 54.40 O ATOM 639 CB GLN A 41 -35.738 -1.221 -28.253 1.00 30.14 C ATOM 640 CG GLN A 41 -34.787 -0.456 -27.347 1.00 23.13 C ATOM 641 CD GLN A 41 -35.511 0.462 -26.382 1.00 50.11 C ATOM 642 OE1 GLN A 41 -35.994 1.528 -26.765 1.00 43.05 O ATOM 643 NE2 GLN A 41 -35.591 0.052 -25.121 1.00 51.55 N ATOM 0 H GLN A 41 -35.492 -2.890 -26.452 1.00 11.21 H new ATOM 0 HA GLN A 41 -37.447 -1.019 -26.966 1.00 23.23 H new ATOM 0 HB2 GLN A 41 -35.191 -2.026 -28.743 1.00 30.14 H new ATOM 0 HB3 GLN A 41 -36.094 -0.554 -29.038 1.00 30.14 H new ATOM 0 HG2 GLN A 41 -34.180 -1.164 -26.783 1.00 23.13 H new ATOM 0 HG3 GLN A 41 -34.103 0.133 -27.959 1.00 23.13 H new ATOM 0 HE21 GLN A 41 -35.176 -0.839 -24.847 1.00 51.55 H new ATOM 0 HE22 GLN A 41 -36.067 0.628 -24.427 1.00 51.55 H new ATOM 652 N GLU A 42 -39.206 -2.100 -28.337 1.00 72.20 N ATOM 653 CA GLU A 42 -40.246 -2.605 -29.227 1.00 4.44 C ATOM 654 C GLU A 42 -41.236 -1.501 -29.588 1.00 3.14 C ATOM 655 O GLU A 42 -42.318 -1.769 -30.107 1.00 52.52 O ATOM 656 CB GLU A 42 -40.985 -3.774 -28.572 1.00 43.23 C ATOM 657 CG GLU A 42 -41.342 -3.529 -27.116 1.00 32.30 C ATOM 658 CD GLU A 42 -42.803 -3.808 -26.819 1.00 40.22 C ATOM 659 OE1 GLU A 42 -43.383 -4.698 -27.475 1.00 50.01 O ATOM 660 OE2 GLU A 42 -43.366 -3.135 -25.930 1.00 62.01 O ATOM 0 H GLU A 42 -39.549 -1.506 -27.582 1.00 72.20 H new ATOM 0 HA GLU A 42 -39.768 -2.954 -30.142 1.00 4.44 H new ATOM 0 HB2 GLU A 42 -41.898 -3.975 -29.132 1.00 43.23 H new ATOM 0 HB3 GLU A 42 -40.366 -4.668 -28.640 1.00 43.23 H new ATOM 0 HG2 GLU A 42 -40.719 -4.160 -26.482 1.00 32.30 H new ATOM 0 HG3 GLU A 42 -41.114 -2.495 -26.859 1.00 32.30 H new ATOM 667 N GLY A 43 -40.856 -0.258 -29.307 1.00 44.10 N ATOM 668 CA GLY A 43 -41.721 0.868 -29.608 1.00 24.14 C ATOM 669 C GLY A 43 -41.523 1.391 -31.016 1.00 41.14 C ATOM 670 O GLY A 43 -42.462 1.883 -31.641 1.00 62.51 O ATOM 0 H GLY A 43 -39.965 -0.011 -28.876 1.00 44.10 H new ATOM 0 HA2 GLY A 43 -42.761 0.568 -29.478 1.00 24.14 H new ATOM 0 HA3 GLY A 43 -41.529 1.670 -28.895 1.00 24.14 H new ATOM 674 N GLY A 44 -40.296 1.287 -31.518 1.00 61.12 N ATOM 675 CA GLY A 44 -40.000 1.759 -32.858 1.00 42.40 C ATOM 676 C GLY A 44 -39.175 0.767 -33.654 1.00 4.45 C ATOM 677 O GLY A 44 -39.686 -0.258 -34.101 1.00 61.04 O ATOM 0 H GLY A 44 -39.502 0.884 -31.020 1.00 61.12 H new ATOM 0 HA2 GLY A 44 -40.934 1.956 -33.385 1.00 42.40 H new ATOM 0 HA3 GLY A 44 -39.463 2.706 -32.796 1.00 42.40 H new ATOM 681 N GLY A 45 -37.893 1.074 -33.831 1.00 70.24 N ATOM 682 CA GLY A 45 -37.017 0.192 -34.580 1.00 45.21 C ATOM 683 C GLY A 45 -35.980 0.951 -35.384 1.00 51.45 C ATOM 684 O GLY A 45 -36.321 1.713 -36.288 1.00 73.04 O ATOM 0 H GLY A 45 -37.446 1.917 -33.469 1.00 70.24 H new ATOM 0 HA2 GLY A 45 -36.513 -0.486 -33.891 1.00 45.21 H new ATOM 0 HA3 GLY A 45 -37.615 -0.423 -35.252 1.00 45.21 H new ATOM 688 N GLY A 46 -34.709 0.745 -35.054 1.00 62.11 N ATOM 689 CA GLY A 46 -33.639 1.424 -35.761 1.00 2.53 C ATOM 690 C GLY A 46 -32.486 0.499 -36.096 1.00 72.03 C ATOM 691 O GLY A 46 -32.696 -0.648 -36.487 1.00 62.52 O ATOM 0 H GLY A 46 -34.401 0.120 -34.309 1.00 62.11 H new ATOM 0 HA2 GLY A 46 -34.033 1.856 -36.681 1.00 2.53 H new ATOM 0 HA3 GLY A 46 -33.272 2.250 -35.152 1.00 2.53 H new ATOM 695 N GLY A 47 -31.264 1.000 -35.945 1.00 24.41 N ATOM 696 CA GLY A 47 -30.091 0.197 -36.241 1.00 35.20 C ATOM 697 C GLY A 47 -30.020 -1.059 -35.396 1.00 34.34 C ATOM 698 O GLY A 47 -30.971 -1.397 -34.692 1.00 12.14 O ATOM 0 H GLY A 47 -31.065 1.947 -35.623 1.00 24.41 H new ATOM 0 HA2 GLY A 47 -30.100 -0.078 -37.296 1.00 35.20 H new ATOM 0 HA3 GLY A 47 -29.194 0.794 -36.075 1.00 35.20 H new ATOM 702 N GLY A 48 -28.890 -1.755 -35.466 1.00 64.31 N ATOM 703 CA GLY A 48 -28.720 -2.975 -34.698 1.00 1.33 C ATOM 704 C GLY A 48 -27.876 -2.765 -33.456 1.00 51.11 C ATOM 705 O GLY A 48 -27.640 -1.637 -33.024 1.00 4.25 O ATOM 0 H GLY A 48 -28.088 -1.496 -36.041 1.00 64.31 H new ATOM 0 HA2 GLY A 48 -29.699 -3.358 -34.408 1.00 1.33 H new ATOM 0 HA3 GLY A 48 -28.254 -3.734 -35.326 1.00 1.33 H new ATOM 709 N PRO A 49 -27.408 -3.872 -32.860 1.00 45.44 N ATOM 710 CA PRO A 49 -26.579 -3.830 -31.652 1.00 1.30 C ATOM 711 C PRO A 49 -25.187 -3.268 -31.922 1.00 53.15 C ATOM 712 O PRO A 49 -24.427 -2.991 -30.994 1.00 21.33 O ATOM 713 CB PRO A 49 -26.490 -5.299 -31.232 1.00 1.02 C ATOM 714 CG PRO A 49 -26.699 -6.067 -32.491 1.00 54.53 C ATOM 715 CD PRO A 49 -27.650 -5.249 -33.321 1.00 72.02 C ATOM 0 HA PRO A 49 -27.005 -3.179 -30.889 1.00 1.30 H new ATOM 0 HB2 PRO A 49 -25.521 -5.525 -30.787 1.00 1.02 H new ATOM 0 HB3 PRO A 49 -27.248 -5.545 -30.488 1.00 1.02 H new ATOM 0 HG2 PRO A 49 -25.756 -6.221 -33.016 1.00 54.53 H new ATOM 0 HG3 PRO A 49 -27.112 -7.054 -32.282 1.00 54.53 H new ATOM 0 HD2 PRO A 49 -27.448 -5.357 -34.387 1.00 72.02 H new ATOM 0 HD3 PRO A 49 -28.685 -5.550 -33.160 1.00 72.02 H new ATOM 723 N LEU A 50 -24.860 -3.101 -33.199 1.00 2.10 N ATOM 724 CA LEU A 50 -23.559 -2.571 -33.592 1.00 24.00 C ATOM 725 C LEU A 50 -23.472 -1.074 -33.310 1.00 75.44 C ATOM 726 O LEU A 50 -22.386 -0.532 -33.108 1.00 62.00 O ATOM 727 CB LEU A 50 -23.305 -2.838 -35.077 1.00 3.33 C ATOM 728 CG LEU A 50 -23.341 -4.303 -35.511 1.00 60.32 C ATOM 729 CD1 LEU A 50 -23.886 -4.427 -36.925 1.00 71.45 C ATOM 730 CD2 LEU A 50 -21.954 -4.922 -35.416 1.00 31.30 C ATOM 0 H LEU A 50 -25.478 -3.325 -33.979 1.00 2.10 H new ATOM 0 HA LEU A 50 -22.795 -3.077 -33.002 1.00 24.00 H new ATOM 0 HB2 LEU A 50 -24.048 -2.290 -35.656 1.00 3.33 H new ATOM 0 HB3 LEU A 50 -22.330 -2.426 -35.338 1.00 3.33 H new ATOM 0 HG LEU A 50 -24.006 -4.845 -34.838 1.00 60.32 H new ATOM 0 HD11 LEU A 50 -23.904 -5.477 -37.217 1.00 71.45 H new ATOM 0 HD12 LEU A 50 -24.897 -4.022 -36.962 1.00 71.45 H new ATOM 0 HD13 LEU A 50 -23.247 -3.871 -37.611 1.00 71.45 H new ATOM 0 HD21 LEU A 50 -21.999 -5.965 -35.729 1.00 31.30 H new ATOM 0 HD22 LEU A 50 -21.268 -4.378 -36.065 1.00 31.30 H new ATOM 0 HD23 LEU A 50 -21.601 -4.867 -34.386 1.00 31.30 H new ATOM 742 N TYR A 51 -24.624 -0.413 -33.297 1.00 74.10 N ATOM 743 CA TYR A 51 -24.679 1.021 -33.040 1.00 54.10 C ATOM 744 C TYR A 51 -24.340 1.327 -31.584 1.00 40.15 C ATOM 745 O TYR A 51 -23.758 2.367 -31.276 1.00 10.31 O ATOM 746 CB TYR A 51 -26.067 1.568 -33.378 1.00 14.14 C ATOM 747 CG TYR A 51 -26.735 2.281 -32.223 1.00 24.20 C ATOM 748 CD1 TYR A 51 -26.420 3.599 -31.919 1.00 44.42 C ATOM 749 CD2 TYR A 51 -27.681 1.635 -31.436 1.00 50.54 C ATOM 750 CE1 TYR A 51 -27.026 4.254 -30.865 1.00 32.12 C ATOM 751 CE2 TYR A 51 -28.294 2.283 -30.381 1.00 22.31 C ATOM 752 CZ TYR A 51 -27.963 3.592 -30.099 1.00 23.42 C ATOM 753 OH TYR A 51 -28.570 4.241 -29.048 1.00 72.35 O ATOM 0 H TYR A 51 -25.532 -0.847 -33.461 1.00 74.10 H new ATOM 0 HA TYR A 51 -23.939 1.507 -33.676 1.00 54.10 H new ATOM 0 HB2 TYR A 51 -25.982 2.256 -34.219 1.00 14.14 H new ATOM 0 HB3 TYR A 51 -26.703 0.745 -33.703 1.00 14.14 H new ATOM 0 HD1 TYR A 51 -25.688 4.121 -32.518 1.00 44.42 H new ATOM 0 HD2 TYR A 51 -27.941 0.609 -31.653 1.00 50.54 H new ATOM 0 HE1 TYR A 51 -26.768 5.279 -30.642 1.00 32.12 H new ATOM 0 HE2 TYR A 51 -29.029 1.767 -29.780 1.00 22.31 H new ATOM 0 HH TYR A 51 -29.205 3.635 -28.612 1.00 72.35 H new ATOM 763 N PHE A 52 -24.708 0.413 -30.693 1.00 63.42 N ATOM 764 CA PHE A 52 -24.443 0.583 -29.269 1.00 53.13 C ATOM 765 C PHE A 52 -22.943 0.586 -28.991 1.00 61.22 C ATOM 766 O PHE A 52 -22.437 1.438 -28.261 1.00 41.21 O ATOM 767 CB PHE A 52 -25.120 -0.530 -28.466 1.00 51.34 C ATOM 768 CG PHE A 52 -24.316 -0.991 -27.285 1.00 4.22 C ATOM 769 CD1 PHE A 52 -24.099 -0.148 -26.206 1.00 63.34 C ATOM 770 CD2 PHE A 52 -23.777 -2.267 -27.252 1.00 43.22 C ATOM 771 CE1 PHE A 52 -23.358 -0.570 -25.118 1.00 51.13 C ATOM 772 CE2 PHE A 52 -23.035 -2.694 -26.167 1.00 35.24 C ATOM 773 CZ PHE A 52 -22.827 -1.845 -25.098 1.00 1.22 C ATOM 0 H PHE A 52 -25.191 -0.453 -30.932 1.00 63.42 H new ATOM 0 HA PHE A 52 -24.853 1.545 -28.961 1.00 53.13 H new ATOM 0 HB2 PHE A 52 -26.091 -0.177 -28.119 1.00 51.34 H new ATOM 0 HB3 PHE A 52 -25.306 -1.380 -29.123 1.00 51.34 H new ATOM 0 HD1 PHE A 52 -24.513 0.849 -26.216 1.00 63.34 H new ATOM 0 HD2 PHE A 52 -23.939 -2.936 -28.084 1.00 43.22 H new ATOM 0 HE1 PHE A 52 -23.194 0.097 -24.284 1.00 51.13 H new ATOM 0 HE2 PHE A 52 -22.618 -3.690 -26.155 1.00 35.24 H new ATOM 0 HZ PHE A 52 -22.250 -2.177 -24.248 1.00 1.22 H new ATOM 783 N VAL A 53 -22.236 -0.375 -29.578 1.00 55.05 N ATOM 784 CA VAL A 53 -20.794 -0.484 -29.395 1.00 72.14 C ATOM 785 C VAL A 53 -20.054 0.552 -30.234 1.00 22.31 C ATOM 786 O VAL A 53 -18.957 0.985 -29.879 1.00 73.23 O ATOM 787 CB VAL A 53 -20.286 -1.889 -29.769 1.00 23.22 C ATOM 788 CG1 VAL A 53 -18.766 -1.907 -29.835 1.00 32.43 C ATOM 789 CG2 VAL A 53 -20.797 -2.922 -28.775 1.00 41.34 C ATOM 0 H VAL A 53 -22.639 -1.089 -30.184 1.00 55.05 H new ATOM 0 HA VAL A 53 -20.594 -0.302 -28.339 1.00 72.14 H new ATOM 0 HB VAL A 53 -20.672 -2.146 -30.756 1.00 23.22 H new ATOM 0 HG11 VAL A 53 -18.425 -2.908 -30.101 1.00 32.43 H new ATOM 0 HG12 VAL A 53 -18.426 -1.196 -30.588 1.00 32.43 H new ATOM 0 HG13 VAL A 53 -18.356 -1.630 -28.864 1.00 32.43 H new ATOM 0 HG21 VAL A 53 -20.429 -3.909 -29.054 1.00 41.34 H new ATOM 0 HG22 VAL A 53 -20.442 -2.672 -27.775 1.00 41.34 H new ATOM 0 HG23 VAL A 53 -21.887 -2.926 -28.782 1.00 41.34 H new ATOM 799 N VAL A 54 -20.661 0.946 -31.349 1.00 1.12 N ATOM 800 CA VAL A 54 -20.060 1.933 -32.238 1.00 55.22 C ATOM 801 C VAL A 54 -20.217 3.343 -31.680 1.00 54.22 C ATOM 802 O VAL A 54 -19.370 4.207 -31.901 1.00 25.34 O ATOM 803 CB VAL A 54 -20.687 1.877 -33.644 1.00 60.51 C ATOM 804 CG1 VAL A 54 -20.459 3.186 -34.384 1.00 2.04 C ATOM 805 CG2 VAL A 54 -20.122 0.704 -34.432 1.00 2.31 C ATOM 0 H VAL A 54 -21.568 0.597 -31.658 1.00 1.12 H new ATOM 0 HA VAL A 54 -19.000 1.690 -32.310 1.00 55.22 H new ATOM 0 HB VAL A 54 -21.762 1.731 -33.538 1.00 60.51 H new ATOM 0 HG11 VAL A 54 -20.909 3.127 -35.375 1.00 2.04 H new ATOM 0 HG12 VAL A 54 -20.916 4.004 -33.826 1.00 2.04 H new ATOM 0 HG13 VAL A 54 -19.389 3.367 -34.482 1.00 2.04 H new ATOM 0 HG21 VAL A 54 -20.576 0.679 -35.423 1.00 2.31 H new ATOM 0 HG22 VAL A 54 -19.042 0.818 -34.530 1.00 2.31 H new ATOM 0 HG23 VAL A 54 -20.343 -0.226 -33.908 1.00 2.31 H new ATOM 815 N ASN A 55 -21.309 3.569 -30.955 1.00 65.25 N ATOM 816 CA ASN A 55 -21.577 4.875 -30.365 1.00 54.02 C ATOM 817 C ASN A 55 -20.955 4.983 -28.976 1.00 74.32 C ATOM 818 O ASN A 55 -20.661 6.079 -28.499 1.00 34.20 O ATOM 819 CB ASN A 55 -23.085 5.119 -30.281 1.00 54.32 C ATOM 820 CG ASN A 55 -23.685 5.498 -31.622 1.00 12.35 C ATOM 821 OD1 ASN A 55 -24.462 6.448 -31.720 1.00 75.11 O ATOM 822 ND2 ASN A 55 -23.326 4.755 -32.662 1.00 20.03 N ATOM 0 H ASN A 55 -22.021 2.865 -30.763 1.00 65.25 H new ATOM 0 HA ASN A 55 -21.127 5.634 -31.005 1.00 54.02 H new ATOM 0 HB2 ASN A 55 -23.576 4.220 -29.908 1.00 54.32 H new ATOM 0 HB3 ASN A 55 -23.282 5.913 -29.560 1.00 54.32 H new ATOM 0 HD21 ASN A 55 -23.697 4.962 -33.589 1.00 20.03 H new ATOM 0 HD22 ASN A 55 -22.679 3.977 -32.534 1.00 20.03 H new ATOM 829 N VAL A 56 -20.757 3.837 -28.332 1.00 61.12 N ATOM 830 CA VAL A 56 -20.168 3.801 -26.999 1.00 11.42 C ATOM 831 C VAL A 56 -18.645 3.794 -27.071 1.00 33.24 C ATOM 832 O VAL A 56 -17.976 4.517 -26.332 1.00 65.24 O ATOM 833 CB VAL A 56 -20.640 2.566 -26.210 1.00 30.24 C ATOM 834 CG1 VAL A 56 -19.697 2.280 -25.051 1.00 63.52 C ATOM 835 CG2 VAL A 56 -22.064 2.764 -25.712 1.00 22.11 C ATOM 0 H VAL A 56 -20.996 2.921 -28.712 1.00 61.12 H new ATOM 0 HA VAL A 56 -20.500 4.701 -26.482 1.00 11.42 H new ATOM 0 HB VAL A 56 -20.629 1.704 -26.878 1.00 30.24 H new ATOM 0 HG11 VAL A 56 -20.047 1.404 -24.505 1.00 63.52 H new ATOM 0 HG12 VAL A 56 -18.695 2.092 -25.435 1.00 63.52 H new ATOM 0 HG13 VAL A 56 -19.673 3.139 -24.381 1.00 63.52 H new ATOM 0 HG21 VAL A 56 -22.381 1.881 -25.157 1.00 22.11 H new ATOM 0 HG22 VAL A 56 -22.103 3.637 -25.060 1.00 22.11 H new ATOM 0 HG23 VAL A 56 -22.729 2.916 -26.562 1.00 22.11 H new ATOM 845 N ILE A 57 -18.105 2.972 -27.964 1.00 43.53 N ATOM 846 CA ILE A 57 -16.660 2.872 -28.133 1.00 55.15 C ATOM 847 C ILE A 57 -16.110 4.080 -28.885 1.00 23.44 C ATOM 848 O ILE A 57 -14.927 4.403 -28.777 1.00 15.04 O ATOM 849 CB ILE A 57 -16.270 1.589 -28.891 1.00 11.04 C ATOM 850 CG1 ILE A 57 -16.740 0.353 -28.120 1.00 41.32 C ATOM 851 CG2 ILE A 57 -14.766 1.542 -29.112 1.00 63.41 C ATOM 852 CD1 ILE A 57 -16.062 0.184 -26.778 1.00 54.23 C ATOM 0 H ILE A 57 -18.645 2.366 -28.581 1.00 43.53 H new ATOM 0 HA ILE A 57 -16.226 2.840 -27.134 1.00 55.15 H new ATOM 0 HB ILE A 57 -16.761 1.595 -29.864 1.00 11.04 H new ATOM 0 HG12 ILE A 57 -17.817 0.417 -27.968 1.00 41.32 H new ATOM 0 HG13 ILE A 57 -16.556 -0.535 -28.725 1.00 41.32 H new ATOM 0 HG21 ILE A 57 -14.505 0.630 -29.649 1.00 63.41 H new ATOM 0 HG22 ILE A 57 -14.457 2.408 -29.697 1.00 63.41 H new ATOM 0 HG23 ILE A 57 -14.256 1.554 -28.149 1.00 63.41 H new ATOM 0 HD11 ILE A 57 -16.444 -0.712 -26.288 1.00 54.23 H new ATOM 0 HD12 ILE A 57 -14.986 0.087 -26.924 1.00 54.23 H new ATOM 0 HD13 ILE A 57 -16.267 1.054 -26.155 1.00 54.23 H new ATOM 864 N GLU A 58 -16.976 4.743 -29.644 1.00 70.11 N ATOM 865 CA GLU A 58 -16.576 5.916 -30.412 1.00 64.23 C ATOM 866 C GLU A 58 -15.858 6.929 -29.525 1.00 21.44 C ATOM 867 O GLU A 58 -14.697 7.273 -29.746 1.00 40.43 O ATOM 868 CB GLU A 58 -17.797 6.568 -31.064 1.00 31.41 C ATOM 869 CG GLU A 58 -17.772 6.526 -32.583 1.00 23.25 C ATOM 870 CD GLU A 58 -16.868 7.586 -33.180 1.00 43.43 C ATOM 871 OE1 GLU A 58 -15.720 7.723 -32.706 1.00 72.33 O ATOM 872 OE2 GLU A 58 -17.307 8.280 -34.121 1.00 71.10 O ATOM 0 H GLU A 58 -17.959 4.488 -29.744 1.00 70.11 H new ATOM 0 HA GLU A 58 -15.888 5.590 -31.192 1.00 64.23 H new ATOM 0 HB2 GLU A 58 -18.698 6.067 -30.710 1.00 31.41 H new ATOM 0 HB3 GLU A 58 -17.861 7.606 -30.739 1.00 31.41 H new ATOM 0 HG2 GLU A 58 -17.437 5.542 -32.910 1.00 23.25 H new ATOM 0 HG3 GLU A 58 -18.785 6.661 -32.963 1.00 23.25 H new ATOM 879 N PRO A 59 -16.565 7.418 -28.495 1.00 23.21 N ATOM 880 CA PRO A 59 -16.016 8.398 -27.553 1.00 31.32 C ATOM 881 C PRO A 59 -14.938 7.799 -26.656 1.00 32.13 C ATOM 882 O PRO A 59 -14.053 8.508 -26.175 1.00 34.13 O ATOM 883 CB PRO A 59 -17.234 8.812 -26.723 1.00 24.34 C ATOM 884 CG PRO A 59 -18.163 7.650 -26.807 1.00 43.24 C ATOM 885 CD PRO A 59 -17.954 7.051 -28.171 1.00 4.52 C ATOM 0 HA PRO A 59 -15.530 9.228 -28.065 1.00 31.32 H new ATOM 0 HB2 PRO A 59 -16.956 9.023 -25.690 1.00 24.34 H new ATOM 0 HB3 PRO A 59 -17.695 9.717 -27.120 1.00 24.34 H new ATOM 0 HG2 PRO A 59 -17.949 6.922 -26.024 1.00 43.24 H new ATOM 0 HG3 PRO A 59 -19.197 7.967 -26.674 1.00 43.24 H new ATOM 0 HD2 PRO A 59 -18.092 5.970 -28.161 1.00 4.52 H new ATOM 0 HD3 PRO A 59 -18.657 7.455 -28.899 1.00 4.52 H new ATOM 893 N CYS A 60 -15.018 6.492 -26.435 1.00 30.51 N ATOM 894 CA CYS A 60 -14.049 5.797 -25.595 1.00 4.43 C ATOM 895 C CYS A 60 -12.684 5.740 -26.273 1.00 3.22 C ATOM 896 O CYS A 60 -11.650 5.925 -25.630 1.00 12.13 O ATOM 897 CB CYS A 60 -14.535 4.382 -25.281 1.00 75.00 C ATOM 898 SG CYS A 60 -15.033 4.137 -23.560 1.00 60.20 S ATOM 0 H CYS A 60 -15.744 5.892 -26.826 1.00 30.51 H new ATOM 0 HA CYS A 60 -13.949 6.353 -24.663 1.00 4.43 H new ATOM 0 HB2 CYS A 60 -15.379 4.147 -25.929 1.00 75.00 H new ATOM 0 HB3 CYS A 60 -13.741 3.675 -25.523 1.00 75.00 H new ATOM 0 HG CYS A 60 -15.430 2.910 -23.394 1.00 60.20 H new ATOM 904 N LYS A 61 -12.687 5.481 -27.576 1.00 42.20 N ATOM 905 CA LYS A 61 -11.450 5.399 -28.343 1.00 64.42 C ATOM 906 C LYS A 61 -10.593 6.642 -28.129 1.00 44.22 C ATOM 907 O LYS A 61 -9.445 6.551 -27.692 1.00 72.43 O ATOM 908 CB LYS A 61 -11.759 5.230 -29.832 1.00 70.54 C ATOM 909 CG LYS A 61 -12.381 3.887 -30.176 1.00 0.12 C ATOM 910 CD LYS A 61 -11.506 3.096 -31.134 1.00 32.02 C ATOM 911 CE LYS A 61 -10.268 2.553 -30.438 1.00 64.41 C ATOM 912 NZ LYS A 61 -10.366 1.087 -30.196 1.00 22.53 N ATOM 0 H LYS A 61 -13.533 5.324 -28.123 1.00 42.20 H new ATOM 0 HA LYS A 61 -10.892 4.530 -27.993 1.00 64.42 H new ATOM 0 HB2 LYS A 61 -12.435 6.025 -30.147 1.00 70.54 H new ATOM 0 HB3 LYS A 61 -10.838 5.351 -30.402 1.00 70.54 H new ATOM 0 HG2 LYS A 61 -12.535 3.312 -29.263 1.00 0.12 H new ATOM 0 HG3 LYS A 61 -13.363 4.044 -30.623 1.00 0.12 H new ATOM 0 HD2 LYS A 61 -12.080 2.270 -31.555 1.00 32.02 H new ATOM 0 HD3 LYS A 61 -11.207 3.733 -31.966 1.00 32.02 H new ATOM 0 HE2 LYS A 61 -9.388 2.763 -31.046 1.00 64.41 H new ATOM 0 HE3 LYS A 61 -10.129 3.069 -29.488 1.00 64.41 H new ATOM 0 HZ1 LYS A 61 -9.503 0.755 -29.720 1.00 22.53 H new ATOM 0 HZ2 LYS A 61 -11.191 0.889 -29.595 1.00 22.53 H new ATOM 0 HZ3 LYS A 61 -10.473 0.592 -31.104 1.00 22.53 H new ATOM 926 N LYS A 62 -11.157 7.805 -28.438 1.00 73.52 N ATOM 927 CA LYS A 62 -10.447 9.068 -28.277 1.00 61.43 C ATOM 928 C LYS A 62 -9.954 9.236 -26.844 1.00 23.44 C ATOM 929 O LYS A 62 -8.978 9.943 -26.591 1.00 53.10 O ATOM 930 CB LYS A 62 -11.356 10.239 -28.656 1.00 5.31 C ATOM 931 CG LYS A 62 -11.167 10.718 -30.085 1.00 2.31 C ATOM 932 CD LYS A 62 -11.431 12.209 -30.213 1.00 11.22 C ATOM 933 CE LYS A 62 -10.321 12.908 -30.982 1.00 43.12 C ATOM 934 NZ LYS A 62 -10.278 14.368 -30.691 1.00 21.13 N ATOM 0 H LYS A 62 -12.105 7.899 -28.802 1.00 73.52 H new ATOM 0 HA LYS A 62 -9.582 9.058 -28.941 1.00 61.43 H new ATOM 0 HB2 LYS A 62 -12.395 9.941 -28.516 1.00 5.31 H new ATOM 0 HB3 LYS A 62 -11.168 11.069 -27.975 1.00 5.31 H new ATOM 0 HG2 LYS A 62 -10.151 10.498 -30.412 1.00 2.31 H new ATOM 0 HG3 LYS A 62 -11.840 10.170 -30.745 1.00 2.31 H new ATOM 0 HD2 LYS A 62 -12.383 12.369 -30.720 1.00 11.22 H new ATOM 0 HD3 LYS A 62 -11.521 12.650 -29.220 1.00 11.22 H new ATOM 0 HE2 LYS A 62 -9.362 12.458 -30.725 1.00 43.12 H new ATOM 0 HE3 LYS A 62 -10.468 12.755 -32.051 1.00 43.12 H new ATOM 0 HZ1 LYS A 62 -9.508 14.808 -31.234 1.00 21.13 H new ATOM 0 HZ2 LYS A 62 -11.184 14.802 -30.960 1.00 21.13 H new ATOM 0 HZ3 LYS A 62 -10.112 14.515 -29.675 1.00 21.13 H new ATOM 948 N PHE A 63 -10.633 8.580 -25.908 1.00 61.24 N ATOM 949 CA PHE A 63 -10.263 8.656 -24.500 1.00 12.41 C ATOM 950 C PHE A 63 -9.156 7.659 -24.173 1.00 62.33 C ATOM 951 O PHE A 63 -8.397 7.846 -23.222 1.00 52.42 O ATOM 952 CB PHE A 63 -11.483 8.389 -23.615 1.00 42.54 C ATOM 953 CG PHE A 63 -11.390 9.027 -22.258 1.00 73.15 C ATOM 954 CD1 PHE A 63 -10.741 8.382 -21.218 1.00 43.14 C ATOM 955 CD2 PHE A 63 -11.953 10.271 -22.023 1.00 75.21 C ATOM 956 CE1 PHE A 63 -10.653 8.966 -19.969 1.00 14.14 C ATOM 957 CE2 PHE A 63 -11.869 10.860 -20.776 1.00 20.23 C ATOM 958 CZ PHE A 63 -11.219 10.206 -19.747 1.00 13.22 C ATOM 0 H PHE A 63 -11.443 7.990 -26.100 1.00 61.24 H new ATOM 0 HA PHE A 63 -9.892 9.662 -24.302 1.00 12.41 H new ATOM 0 HB2 PHE A 63 -12.376 8.757 -24.120 1.00 42.54 H new ATOM 0 HB3 PHE A 63 -11.606 7.313 -23.494 1.00 42.54 H new ATOM 0 HD1 PHE A 63 -10.299 7.411 -21.385 1.00 43.14 H new ATOM 0 HD2 PHE A 63 -12.463 10.786 -22.824 1.00 75.21 H new ATOM 0 HE1 PHE A 63 -10.142 8.453 -19.167 1.00 14.14 H new ATOM 0 HE2 PHE A 63 -12.311 11.831 -20.606 1.00 20.23 H new ATOM 0 HZ PHE A 63 -11.154 10.664 -18.771 1.00 13.22 H new ATOM 968 N SER A 64 -9.070 6.597 -24.969 1.00 12.32 N ATOM 969 CA SER A 64 -8.059 5.567 -24.763 1.00 10.13 C ATOM 970 C SER A 64 -6.658 6.170 -24.779 1.00 43.33 C ATOM 971 O SER A 64 -5.803 5.801 -23.975 1.00 44.13 O ATOM 972 CB SER A 64 -8.174 4.487 -25.840 1.00 33.33 C ATOM 973 OG SER A 64 -8.266 3.197 -25.260 1.00 74.24 O ATOM 0 H SER A 64 -9.689 6.428 -25.762 1.00 12.32 H new ATOM 0 HA SER A 64 -8.230 5.115 -23.786 1.00 10.13 H new ATOM 0 HB2 SER A 64 -9.053 4.676 -26.456 1.00 33.33 H new ATOM 0 HB3 SER A 64 -7.307 4.532 -26.499 1.00 33.33 H new ATOM 0 HG SER A 64 -8.340 2.524 -25.969 1.00 74.24 H new ATOM 979 N GLU A 65 -6.432 7.101 -25.702 1.00 24.53 N ATOM 980 CA GLU A 65 -5.134 7.755 -25.824 1.00 31.32 C ATOM 981 C GLU A 65 -4.776 8.496 -24.539 1.00 44.21 C ATOM 982 O GLU A 65 -3.600 8.672 -24.218 1.00 25.44 O ATOM 983 CB GLU A 65 -5.138 8.729 -27.004 1.00 32.23 C ATOM 984 CG GLU A 65 -5.586 8.099 -28.312 1.00 34.33 C ATOM 985 CD GLU A 65 -4.602 8.335 -29.440 1.00 63.35 C ATOM 986 OE1 GLU A 65 -3.384 8.189 -29.205 1.00 21.13 O ATOM 987 OE2 GLU A 65 -5.048 8.665 -30.559 1.00 13.13 O ATOM 0 H GLU A 65 -7.130 7.418 -26.375 1.00 24.53 H new ATOM 0 HA GLU A 65 -4.383 6.985 -26.001 1.00 31.32 H new ATOM 0 HB2 GLU A 65 -5.795 9.567 -26.770 1.00 32.23 H new ATOM 0 HB3 GLU A 65 -4.135 9.136 -27.131 1.00 32.23 H new ATOM 0 HG2 GLU A 65 -5.718 7.027 -28.168 1.00 34.33 H new ATOM 0 HG3 GLU A 65 -6.558 8.505 -28.592 1.00 34.33 H new ATOM 994 N LEU A 66 -5.797 8.930 -23.809 1.00 20.21 N ATOM 995 CA LEU A 66 -5.591 9.653 -22.559 1.00 12.31 C ATOM 996 C LEU A 66 -4.994 8.740 -21.493 1.00 42.12 C ATOM 997 O LEU A 66 -4.135 9.155 -20.714 1.00 12.21 O ATOM 998 CB LEU A 66 -6.914 10.239 -22.062 1.00 31.22 C ATOM 999 CG LEU A 66 -7.729 11.024 -23.090 1.00 73.53 C ATOM 1000 CD1 LEU A 66 -9.037 11.503 -22.481 1.00 14.52 C ATOM 1001 CD2 LEU A 66 -6.924 12.199 -23.624 1.00 53.50 C ATOM 0 H LEU A 66 -6.776 8.794 -24.061 1.00 20.21 H new ATOM 0 HA LEU A 66 -4.889 10.465 -22.749 1.00 12.31 H new ATOM 0 HB2 LEU A 66 -7.531 9.423 -21.685 1.00 31.22 H new ATOM 0 HB3 LEU A 66 -6.703 10.895 -21.218 1.00 31.22 H new ATOM 0 HG LEU A 66 -7.962 10.361 -23.923 1.00 73.53 H new ATOM 0 HD11 LEU A 66 -9.604 12.060 -23.227 1.00 14.52 H new ATOM 0 HD12 LEU A 66 -9.620 10.644 -22.149 1.00 14.52 H new ATOM 0 HD13 LEU A 66 -8.826 12.149 -21.629 1.00 14.52 H new ATOM 0 HD21 LEU A 66 -7.520 12.746 -24.354 1.00 53.50 H new ATOM 0 HD22 LEU A 66 -6.659 12.863 -22.801 1.00 53.50 H new ATOM 0 HD23 LEU A 66 -6.015 11.831 -24.100 1.00 53.50 H new ATOM 1013 N THR A 67 -5.452 7.492 -21.466 1.00 11.44 N ATOM 1014 CA THR A 67 -4.963 6.520 -20.497 1.00 22.32 C ATOM 1015 C THR A 67 -3.476 6.249 -20.693 1.00 25.21 C ATOM 1016 O THR A 67 -2.813 5.701 -19.813 1.00 31.21 O ATOM 1017 CB THR A 67 -5.733 5.190 -20.598 1.00 70.41 C ATOM 1018 OG1 THR A 67 -5.340 4.485 -21.781 1.00 72.11 O ATOM 1019 CG2 THR A 67 -7.234 5.434 -20.622 1.00 53.23 C ATOM 0 H THR A 67 -6.161 7.131 -22.104 1.00 11.44 H new ATOM 0 HA THR A 67 -5.124 6.950 -19.509 1.00 22.32 H new ATOM 0 HB THR A 67 -5.493 4.589 -19.721 1.00 70.41 H new ATOM 0 HG1 THR A 67 -5.330 3.522 -21.600 1.00 72.11 H new ATOM 0 HG21 THR A 67 -7.757 4.480 -20.694 1.00 53.23 H new ATOM 0 HG22 THR A 67 -7.534 5.944 -19.707 1.00 53.23 H new ATOM 0 HG23 THR A 67 -7.488 6.053 -21.483 1.00 53.23 H new ATOM 1027 N GLY A 68 -2.956 6.637 -21.853 1.00 43.34 N ATOM 1028 CA GLY A 68 -1.549 6.428 -22.143 1.00 52.04 C ATOM 1029 C GLY A 68 -0.721 7.680 -21.933 1.00 54.32 C ATOM 1030 O GLY A 68 0.508 7.621 -21.894 1.00 44.41 O ATOM 0 H GLY A 68 -3.484 7.092 -22.598 1.00 43.34 H new ATOM 0 HA2 GLY A 68 -1.165 5.631 -21.506 1.00 52.04 H new ATOM 0 HA3 GLY A 68 -1.440 6.093 -23.174 1.00 52.04 H new ATOM 1034 N LEU A 69 -1.395 8.817 -21.799 1.00 51.31 N ATOM 1035 CA LEU A 69 -0.714 10.091 -21.593 1.00 62.34 C ATOM 1036 C LEU A 69 -0.537 10.380 -20.106 1.00 62.42 C ATOM 1037 O LEU A 69 0.201 11.287 -19.723 1.00 4.12 O ATOM 1038 CB LEU A 69 -1.499 11.225 -22.255 1.00 32.51 C ATOM 1039 CG LEU A 69 -0.668 12.378 -22.817 1.00 2.34 C ATOM 1040 CD1 LEU A 69 0.307 11.871 -23.868 1.00 52.43 C ATOM 1041 CD2 LEU A 69 -1.573 13.454 -23.400 1.00 30.52 C ATOM 0 H LEU A 69 -2.412 8.883 -21.829 1.00 51.31 H new ATOM 0 HA LEU A 69 0.273 10.025 -22.051 1.00 62.34 H new ATOM 0 HB2 LEU A 69 -2.093 10.803 -23.066 1.00 32.51 H new ATOM 0 HB3 LEU A 69 -2.199 11.630 -21.524 1.00 32.51 H new ATOM 0 HG LEU A 69 -0.094 12.818 -22.001 1.00 2.34 H new ATOM 0 HD11 LEU A 69 0.890 12.706 -24.257 1.00 52.43 H new ATOM 0 HD12 LEU A 69 0.978 11.138 -23.419 1.00 52.43 H new ATOM 0 HD13 LEU A 69 -0.247 11.405 -24.683 1.00 52.43 H new ATOM 0 HD21 LEU A 69 -0.964 14.267 -23.795 1.00 30.52 H new ATOM 0 HD22 LEU A 69 -2.175 13.028 -24.203 1.00 30.52 H new ATOM 0 HD23 LEU A 69 -2.230 13.839 -22.620 1.00 30.52 H new ATOM 1053 N VAL A 70 -1.218 9.600 -19.272 1.00 44.00 N ATOM 1054 CA VAL A 70 -1.133 9.770 -17.826 1.00 73.34 C ATOM 1055 C VAL A 70 -0.092 8.833 -17.223 1.00 14.40 C ATOM 1056 O VAL A 70 0.550 9.162 -16.225 1.00 72.02 O ATOM 1057 CB VAL A 70 -2.493 9.511 -17.151 1.00 11.43 C ATOM 1058 CG1 VAL A 70 -2.298 9.079 -15.706 1.00 21.15 C ATOM 1059 CG2 VAL A 70 -3.371 10.751 -17.231 1.00 33.02 C ATOM 0 H VAL A 70 -1.834 8.845 -19.573 1.00 44.00 H new ATOM 0 HA VAL A 70 -0.836 10.803 -17.645 1.00 73.34 H new ATOM 0 HB VAL A 70 -2.995 8.702 -17.682 1.00 11.43 H new ATOM 0 HG11 VAL A 70 -3.270 8.901 -15.245 1.00 21.15 H new ATOM 0 HG12 VAL A 70 -1.709 8.163 -15.677 1.00 21.15 H new ATOM 0 HG13 VAL A 70 -1.776 9.864 -15.159 1.00 21.15 H new ATOM 0 HG21 VAL A 70 -4.328 10.551 -16.749 1.00 33.02 H new ATOM 0 HG22 VAL A 70 -2.877 11.580 -16.725 1.00 33.02 H new ATOM 0 HG23 VAL A 70 -3.538 11.012 -18.276 1.00 33.02 H new ATOM 1069 N PHE A 71 0.070 7.665 -17.835 1.00 42.21 N ATOM 1070 CA PHE A 71 1.033 6.680 -17.358 1.00 64.31 C ATOM 1071 C PHE A 71 2.348 6.788 -18.126 1.00 33.03 C ATOM 1072 O PHE A 71 3.285 6.027 -17.884 1.00 71.22 O ATOM 1073 CB PHE A 71 0.462 5.267 -17.499 1.00 43.23 C ATOM 1074 CG PHE A 71 -0.649 4.971 -16.534 1.00 33.24 C ATOM 1075 CD1 PHE A 71 -1.929 5.450 -16.762 1.00 32.31 C ATOM 1076 CD2 PHE A 71 -0.414 4.214 -15.397 1.00 71.33 C ATOM 1077 CE1 PHE A 71 -2.955 5.178 -15.875 1.00 44.54 C ATOM 1078 CE2 PHE A 71 -1.435 3.939 -14.508 1.00 34.14 C ATOM 1079 CZ PHE A 71 -2.707 4.423 -14.746 1.00 61.13 C ATOM 0 H PHE A 71 -0.453 7.378 -18.662 1.00 42.21 H new ATOM 0 HA PHE A 71 1.230 6.882 -16.305 1.00 64.31 H new ATOM 0 HB2 PHE A 71 0.095 5.132 -18.516 1.00 43.23 H new ATOM 0 HB3 PHE A 71 1.264 4.543 -17.351 1.00 43.23 H new ATOM 0 HD1 PHE A 71 -2.128 6.043 -17.643 1.00 32.31 H new ATOM 0 HD2 PHE A 71 0.579 3.835 -15.204 1.00 71.33 H new ATOM 0 HE1 PHE A 71 -3.949 5.556 -16.065 1.00 44.54 H new ATOM 0 HE2 PHE A 71 -1.239 3.346 -13.627 1.00 34.14 H new ATOM 0 HZ PHE A 71 -3.506 4.211 -14.050 1.00 61.13 H new ATOM 1089 N TYR A 72 2.408 7.739 -19.052 1.00 23.54 N ATOM 1090 CA TYR A 72 3.606 7.945 -19.857 1.00 52.53 C ATOM 1091 C TYR A 72 4.064 9.399 -19.788 1.00 64.12 C ATOM 1092 O TYR A 72 5.243 9.681 -19.568 1.00 61.12 O ATOM 1093 CB TYR A 72 3.342 7.551 -21.311 1.00 61.33 C ATOM 1094 CG TYR A 72 4.602 7.339 -22.119 1.00 65.33 C ATOM 1095 CD1 TYR A 72 5.519 6.355 -21.768 1.00 2.45 C ATOM 1096 CD2 TYR A 72 4.877 8.122 -23.233 1.00 62.25 C ATOM 1097 CE1 TYR A 72 6.672 6.158 -22.502 1.00 44.32 C ATOM 1098 CE2 TYR A 72 6.027 7.931 -23.975 1.00 21.22 C ATOM 1099 CZ TYR A 72 6.922 6.948 -23.605 1.00 54.22 C ATOM 1100 OH TYR A 72 8.069 6.756 -24.340 1.00 71.22 O ATOM 0 H TYR A 72 1.642 8.378 -19.263 1.00 23.54 H new ATOM 0 HA TYR A 72 4.398 7.313 -19.454 1.00 52.53 H new ATOM 0 HB2 TYR A 72 2.751 6.636 -21.329 1.00 61.33 H new ATOM 0 HB3 TYR A 72 2.742 8.327 -21.786 1.00 61.33 H new ATOM 0 HD1 TYR A 72 5.326 5.734 -20.906 1.00 2.45 H new ATOM 0 HD2 TYR A 72 4.180 8.894 -23.524 1.00 62.25 H new ATOM 0 HE1 TYR A 72 7.374 5.390 -22.214 1.00 44.32 H new ATOM 0 HE2 TYR A 72 6.224 8.548 -24.840 1.00 21.22 H new ATOM 0 HH TYR A 72 8.092 7.394 -25.084 1.00 71.22 H new ATOM 1110 N LEU A 73 3.124 10.318 -19.977 1.00 44.42 N ATOM 1111 CA LEU A 73 3.430 11.744 -19.936 1.00 14.31 C ATOM 1112 C LEU A 73 2.672 12.431 -18.804 1.00 24.33 C ATOM 1113 O LEU A 73 1.771 13.239 -19.027 1.00 72.23 O ATOM 1114 CB LEU A 73 3.077 12.400 -21.272 1.00 12.30 C ATOM 1115 CG LEU A 73 3.506 13.858 -21.438 1.00 4.40 C ATOM 1116 CD1 LEU A 73 5.008 13.950 -21.662 1.00 12.42 C ATOM 1117 CD2 LEU A 73 2.753 14.509 -22.589 1.00 71.31 C ATOM 0 H LEU A 73 2.144 10.102 -20.160 1.00 44.42 H new ATOM 0 HA LEU A 73 4.499 11.856 -19.754 1.00 14.31 H new ATOM 0 HB2 LEU A 73 3.531 11.815 -22.072 1.00 12.30 H new ATOM 0 HB3 LEU A 73 1.997 12.342 -21.408 1.00 12.30 H new ATOM 0 HG LEU A 73 3.262 14.395 -20.521 1.00 4.40 H new ATOM 0 HD11 LEU A 73 5.295 14.995 -21.778 1.00 12.42 H new ATOM 0 HD12 LEU A 73 5.530 13.523 -20.806 1.00 12.42 H new ATOM 0 HD13 LEU A 73 5.276 13.398 -22.563 1.00 12.42 H new ATOM 0 HD21 LEU A 73 3.072 15.546 -22.692 1.00 71.31 H new ATOM 0 HD22 LEU A 73 2.965 13.971 -23.513 1.00 71.31 H new ATOM 0 HD23 LEU A 73 1.682 14.477 -22.388 1.00 71.31 H new ATOM 1129 N PRO A 74 3.047 12.104 -17.558 1.00 0.52 N ATOM 1130 CA PRO A 74 2.418 12.680 -16.366 1.00 12.34 C ATOM 1131 C PRO A 74 2.757 14.156 -16.186 1.00 44.03 C ATOM 1132 O PRO A 74 3.925 14.545 -16.224 1.00 64.44 O ATOM 1133 CB PRO A 74 3.006 11.853 -15.220 1.00 12.24 C ATOM 1134 CG PRO A 74 4.310 11.357 -15.741 1.00 4.51 C ATOM 1135 CD PRO A 74 4.114 11.149 -17.217 1.00 61.30 C ATOM 0 HA PRO A 74 1.330 12.644 -16.422 1.00 12.34 H new ATOM 0 HB2 PRO A 74 3.142 12.459 -14.324 1.00 12.24 H new ATOM 0 HB3 PRO A 74 2.348 11.027 -14.949 1.00 12.24 H new ATOM 0 HG2 PRO A 74 5.106 12.077 -15.551 1.00 4.51 H new ATOM 0 HG3 PRO A 74 4.598 10.427 -15.251 1.00 4.51 H new ATOM 0 HD2 PRO A 74 5.028 11.351 -17.776 1.00 61.30 H new ATOM 0 HD3 PRO A 74 3.822 10.123 -17.443 1.00 61.30 H new ATOM 1143 N THR A 75 1.729 14.976 -15.990 1.00 62.31 N ATOM 1144 CA THR A 75 1.919 16.409 -15.805 1.00 73.14 C ATOM 1145 C THR A 75 1.641 16.819 -14.364 1.00 31.13 C ATOM 1146 O THR A 75 1.996 17.920 -13.942 1.00 73.11 O ATOM 1147 CB THR A 75 1.006 17.222 -16.743 1.00 63.32 C ATOM 1148 OG1 THR A 75 1.174 16.779 -18.095 1.00 32.24 O ATOM 1149 CG2 THR A 75 1.319 18.707 -16.649 1.00 1.44 C ATOM 0 H THR A 75 0.756 14.672 -15.955 1.00 62.31 H new ATOM 0 HA THR A 75 2.960 16.624 -16.046 1.00 73.14 H new ATOM 0 HB THR A 75 -0.028 17.064 -16.435 1.00 63.32 H new ATOM 0 HG1 THR A 75 0.589 17.299 -18.685 1.00 32.24 H new ATOM 0 HG21 THR A 75 0.662 19.260 -17.320 1.00 1.44 H new ATOM 0 HG22 THR A 75 1.163 19.048 -15.625 1.00 1.44 H new ATOM 0 HG23 THR A 75 2.357 18.879 -16.934 1.00 1.44 H new ATOM 1157 N ASP A 76 1.005 15.927 -13.612 1.00 24.11 N ATOM 1158 CA ASP A 76 0.682 16.196 -12.216 1.00 35.33 C ATOM 1159 C ASP A 76 -0.003 14.992 -11.575 1.00 50.32 C ATOM 1160 O ASP A 76 -0.066 13.914 -12.166 1.00 51.31 O ATOM 1161 CB ASP A 76 -0.218 17.428 -12.107 1.00 33.33 C ATOM 1162 CG ASP A 76 0.099 18.270 -10.887 1.00 11.21 C ATOM 1163 OD1 ASP A 76 1.111 19.001 -10.918 1.00 31.11 O ATOM 1164 OD2 ASP A 76 -0.664 18.198 -9.901 1.00 14.22 O ATOM 0 H ASP A 76 0.703 15.012 -13.946 1.00 24.11 H new ATOM 0 HA ASP A 76 1.614 16.388 -11.683 1.00 35.33 H new ATOM 0 HB2 ASP A 76 -0.106 18.037 -13.004 1.00 33.33 H new ATOM 0 HB3 ASP A 76 -1.260 17.111 -12.065 1.00 33.33 H new ATOM 1169 N SER A 77 -0.514 15.184 -10.363 1.00 65.00 N ATOM 1170 CA SER A 77 -1.189 14.113 -9.640 1.00 30.11 C ATOM 1171 C SER A 77 -2.442 13.662 -10.384 1.00 33.52 C ATOM 1172 O SER A 77 -2.984 12.590 -10.116 1.00 54.14 O ATOM 1173 CB SER A 77 -1.558 14.575 -8.229 1.00 54.31 C ATOM 1174 OG SER A 77 -2.636 15.495 -8.260 1.00 1.24 O ATOM 0 H SER A 77 -0.473 16.071 -9.861 1.00 65.00 H new ATOM 0 HA SER A 77 -0.505 13.267 -9.570 1.00 30.11 H new ATOM 0 HB2 SER A 77 -1.829 13.713 -7.620 1.00 54.31 H new ATOM 0 HB3 SER A 77 -0.692 15.040 -7.757 1.00 54.31 H new ATOM 0 HG SER A 77 -2.854 15.774 -7.346 1.00 1.24 H new ATOM 1180 N GLY A 78 -2.897 14.489 -11.320 1.00 74.32 N ATOM 1181 CA GLY A 78 -4.083 14.158 -12.089 1.00 12.41 C ATOM 1182 C GLY A 78 -4.425 15.222 -13.113 1.00 51.30 C ATOM 1183 O GLY A 78 -5.597 15.528 -13.332 1.00 22.41 O ATOM 0 H GLY A 78 -2.466 15.382 -11.560 1.00 74.32 H new ATOM 0 HA2 GLY A 78 -3.929 13.206 -12.596 1.00 12.41 H new ATOM 0 HA3 GLY A 78 -4.926 14.026 -11.411 1.00 12.41 H new ATOM 1187 N GLU A 79 -3.399 15.789 -13.741 1.00 32.04 N ATOM 1188 CA GLU A 79 -3.598 16.827 -14.745 1.00 72.03 C ATOM 1189 C GLU A 79 -4.326 16.271 -15.966 1.00 31.44 C ATOM 1190 O GLU A 79 -5.487 16.598 -16.213 1.00 60.42 O ATOM 1191 CB GLU A 79 -2.254 17.423 -15.168 1.00 2.33 C ATOM 1192 CG GLU A 79 -1.990 18.802 -14.586 1.00 50.13 C ATOM 1193 CD GLU A 79 -2.931 19.857 -15.136 1.00 22.32 C ATOM 1194 OE1 GLU A 79 -3.749 19.521 -16.017 1.00 51.32 O ATOM 1195 OE2 GLU A 79 -2.848 21.018 -14.683 1.00 74.05 O ATOM 0 H GLU A 79 -2.423 15.547 -13.572 1.00 32.04 H new ATOM 0 HA GLU A 79 -4.212 17.611 -14.302 1.00 72.03 H new ATOM 0 HB2 GLU A 79 -1.454 16.749 -14.861 1.00 2.33 H new ATOM 0 HB3 GLU A 79 -2.219 17.484 -16.256 1.00 2.33 H new ATOM 0 HG2 GLU A 79 -2.091 18.760 -13.502 1.00 50.13 H new ATOM 0 HG3 GLU A 79 -0.961 19.091 -14.799 1.00 50.13 H new ATOM 1202 N LYS A 80 -3.635 15.428 -16.726 1.00 33.22 N ATOM 1203 CA LYS A 80 -4.214 14.824 -17.920 1.00 43.35 C ATOM 1204 C LYS A 80 -5.498 14.073 -17.583 1.00 42.24 C ATOM 1205 O LYS A 80 -6.392 13.948 -18.420 1.00 21.45 O ATOM 1206 CB LYS A 80 -3.209 13.872 -18.573 1.00 34.30 C ATOM 1207 CG LYS A 80 -2.428 14.500 -19.713 1.00 45.15 C ATOM 1208 CD LYS A 80 -3.331 14.847 -20.885 1.00 33.32 C ATOM 1209 CE LYS A 80 -2.849 16.093 -21.611 1.00 14.43 C ATOM 1210 NZ LYS A 80 -3.515 16.258 -22.932 1.00 75.14 N ATOM 0 H LYS A 80 -2.673 15.148 -16.536 1.00 33.22 H new ATOM 0 HA LYS A 80 -4.456 15.623 -18.620 1.00 43.35 H new ATOM 0 HB2 LYS A 80 -2.509 13.520 -17.815 1.00 34.30 H new ATOM 0 HB3 LYS A 80 -3.740 12.997 -18.947 1.00 34.30 H new ATOM 0 HG2 LYS A 80 -1.928 15.401 -19.359 1.00 45.15 H new ATOM 0 HG3 LYS A 80 -1.650 13.812 -20.044 1.00 45.15 H new ATOM 0 HD2 LYS A 80 -3.363 14.009 -21.581 1.00 33.32 H new ATOM 0 HD3 LYS A 80 -4.349 15.004 -20.527 1.00 33.32 H new ATOM 0 HE2 LYS A 80 -3.043 16.971 -20.994 1.00 14.43 H new ATOM 0 HE3 LYS A 80 -1.770 16.036 -21.753 1.00 14.43 H new ATOM 0 HZ1 LYS A 80 -2.964 16.917 -23.519 1.00 75.14 H new ATOM 0 HZ2 LYS A 80 -3.574 15.336 -23.409 1.00 75.14 H new ATOM 0 HZ3 LYS A 80 -4.473 16.637 -22.793 1.00 75.14 H new ATOM 1224 N MET A 81 -5.582 13.577 -16.353 1.00 53.33 N ATOM 1225 CA MET A 81 -6.759 12.841 -15.906 1.00 21.02 C ATOM 1226 C MET A 81 -7.944 13.780 -15.704 1.00 41.23 C ATOM 1227 O MET A 81 -8.978 13.642 -16.359 1.00 62.00 O ATOM 1228 CB MET A 81 -6.456 12.096 -14.604 1.00 53.40 C ATOM 1229 CG MET A 81 -5.140 11.336 -14.631 1.00 13.14 C ATOM 1230 SD MET A 81 -4.757 10.556 -13.051 1.00 3.22 S ATOM 1231 CE MET A 81 -2.981 10.779 -12.986 1.00 3.14 C ATOM 0 H MET A 81 -4.850 13.671 -15.649 1.00 53.33 H new ATOM 0 HA MET A 81 -7.020 12.118 -16.679 1.00 21.02 H new ATOM 0 HB2 MET A 81 -6.436 12.811 -13.782 1.00 53.40 H new ATOM 0 HB3 MET A 81 -7.266 11.396 -14.398 1.00 53.40 H new ATOM 0 HG2 MET A 81 -5.181 10.573 -15.408 1.00 13.14 H new ATOM 0 HG3 MET A 81 -4.335 12.020 -14.899 1.00 13.14 H new ATOM 0 HE1 MET A 81 -2.490 9.807 -13.038 1.00 3.14 H new ATOM 0 HE2 MET A 81 -2.660 11.393 -13.828 1.00 3.14 H new ATOM 0 HE3 MET A 81 -2.710 11.273 -12.053 1.00 3.14 H new ATOM 1241 N THR A 82 -7.788 14.736 -14.794 1.00 5.41 N ATOM 1242 CA THR A 82 -8.845 15.697 -14.505 1.00 43.24 C ATOM 1243 C THR A 82 -9.181 16.531 -15.736 1.00 44.24 C ATOM 1244 O THR A 82 -10.301 17.020 -15.879 1.00 21.22 O ATOM 1245 CB THR A 82 -8.448 16.640 -13.353 1.00 71.34 C ATOM 1246 OG1 THR A 82 -9.618 17.237 -12.784 1.00 35.41 O ATOM 1247 CG2 THR A 82 -7.506 17.728 -13.845 1.00 25.03 C ATOM 0 H THR A 82 -6.939 14.865 -14.244 1.00 5.41 H new ATOM 0 HA THR A 82 -9.722 15.122 -14.208 1.00 43.24 H new ATOM 0 HB THR A 82 -7.934 16.053 -12.592 1.00 71.34 H new ATOM 0 HG1 THR A 82 -9.358 17.834 -12.052 1.00 35.41 H new ATOM 0 HG21 THR A 82 -7.239 18.382 -13.014 1.00 25.03 H new ATOM 0 HG22 THR A 82 -6.604 17.271 -14.252 1.00 25.03 H new ATOM 0 HG23 THR A 82 -7.999 18.312 -14.622 1.00 25.03 H new ATOM 1255 N GLU A 83 -8.203 16.689 -16.623 1.00 51.15 N ATOM 1256 CA GLU A 83 -8.397 17.465 -17.843 1.00 30.12 C ATOM 1257 C GLU A 83 -9.166 16.657 -18.885 1.00 4.51 C ATOM 1258 O GLU A 83 -9.750 17.217 -19.813 1.00 3.54 O ATOM 1259 CB GLU A 83 -7.047 17.903 -18.415 1.00 53.10 C ATOM 1260 CG GLU A 83 -7.146 19.073 -19.380 1.00 20.23 C ATOM 1261 CD GLU A 83 -5.875 19.277 -20.182 1.00 32.44 C ATOM 1262 OE1 GLU A 83 -5.398 18.300 -20.796 1.00 50.25 O ATOM 1263 OE2 GLU A 83 -5.358 20.413 -20.194 1.00 52.41 O ATOM 0 H GLU A 83 -7.270 16.291 -16.520 1.00 51.15 H new ATOM 0 HA GLU A 83 -8.981 18.350 -17.592 1.00 30.12 H new ATOM 0 HB2 GLU A 83 -6.385 18.176 -17.593 1.00 53.10 H new ATOM 0 HB3 GLU A 83 -6.588 17.058 -18.928 1.00 53.10 H new ATOM 0 HG2 GLU A 83 -7.979 18.906 -20.063 1.00 20.23 H new ATOM 0 HG3 GLU A 83 -7.369 19.982 -18.821 1.00 20.23 H new ATOM 1270 N SER A 84 -9.160 15.338 -18.725 1.00 22.02 N ATOM 1271 CA SER A 84 -9.852 14.452 -19.653 1.00 52.25 C ATOM 1272 C SER A 84 -11.327 14.325 -19.285 1.00 53.03 C ATOM 1273 O SER A 84 -12.175 14.076 -20.143 1.00 64.22 O ATOM 1274 CB SER A 84 -9.195 13.071 -19.659 1.00 73.53 C ATOM 1275 OG SER A 84 -7.945 13.103 -20.325 1.00 5.35 O ATOM 0 H SER A 84 -8.683 14.859 -17.961 1.00 22.02 H new ATOM 0 HA SER A 84 -9.781 14.884 -20.651 1.00 52.25 H new ATOM 0 HB2 SER A 84 -9.056 12.727 -18.634 1.00 73.53 H new ATOM 0 HB3 SER A 84 -9.853 12.354 -20.149 1.00 73.53 H new ATOM 0 HG SER A 84 -7.290 13.575 -19.769 1.00 5.35 H new ATOM 1281 N LYS A 85 -11.627 14.498 -18.003 1.00 14.04 N ATOM 1282 CA LYS A 85 -12.999 14.404 -17.518 1.00 13.31 C ATOM 1283 C LYS A 85 -13.860 15.519 -18.103 1.00 14.21 C ATOM 1284 O LYS A 85 -15.087 15.421 -18.127 1.00 12.34 O ATOM 1285 CB LYS A 85 -13.028 14.472 -15.989 1.00 43.33 C ATOM 1286 CG LYS A 85 -14.348 14.027 -15.385 1.00 52.01 C ATOM 1287 CD LYS A 85 -14.395 14.294 -13.890 1.00 34.21 C ATOM 1288 CE LYS A 85 -15.546 15.219 -13.525 1.00 10.21 C ATOM 1289 NZ LYS A 85 -15.194 16.123 -12.395 1.00 31.55 N ATOM 0 H LYS A 85 -10.938 14.704 -17.280 1.00 14.04 H new ATOM 0 HA LYS A 85 -13.407 13.446 -17.841 1.00 13.31 H new ATOM 0 HB2 LYS A 85 -12.227 13.849 -15.591 1.00 43.33 H new ATOM 0 HB3 LYS A 85 -12.821 15.495 -15.675 1.00 43.33 H new ATOM 0 HG2 LYS A 85 -15.169 14.551 -15.875 1.00 52.01 H new ATOM 0 HG3 LYS A 85 -14.494 12.963 -15.570 1.00 52.01 H new ATOM 0 HD2 LYS A 85 -14.501 13.351 -13.354 1.00 34.21 H new ATOM 0 HD3 LYS A 85 -13.453 14.739 -13.569 1.00 34.21 H new ATOM 0 HE2 LYS A 85 -15.823 15.815 -14.395 1.00 10.21 H new ATOM 0 HE3 LYS A 85 -16.419 14.624 -13.256 1.00 10.21 H new ATOM 0 HZ1 LYS A 85 -16.004 16.737 -12.177 1.00 31.55 H new ATOM 0 HZ2 LYS A 85 -14.955 15.555 -11.557 1.00 31.55 H new ATOM 0 HZ3 LYS A 85 -14.377 16.709 -12.661 1.00 31.55 H new ATOM 1303 N SER A 86 -13.210 16.578 -18.575 1.00 64.53 N ATOM 1304 CA SER A 86 -13.916 17.712 -19.158 1.00 73.14 C ATOM 1305 C SER A 86 -14.307 17.423 -20.605 1.00 12.34 C ATOM 1306 O SER A 86 -15.175 18.089 -21.170 1.00 71.30 O ATOM 1307 CB SER A 86 -13.047 18.969 -19.094 1.00 41.14 C ATOM 1308 OG SER A 86 -12.877 19.538 -20.381 1.00 71.22 O ATOM 0 H SER A 86 -12.195 16.674 -18.565 1.00 64.53 H new ATOM 0 HA SER A 86 -14.825 17.878 -18.580 1.00 73.14 H new ATOM 0 HB2 SER A 86 -13.507 19.699 -18.428 1.00 41.14 H new ATOM 0 HB3 SER A 86 -12.073 18.721 -18.671 1.00 41.14 H new ATOM 0 HG SER A 86 -12.319 20.341 -20.313 1.00 71.22 H new ATOM 1314 N VAL A 87 -13.660 16.426 -21.198 1.00 63.42 N ATOM 1315 CA VAL A 87 -13.939 16.047 -22.578 1.00 70.31 C ATOM 1316 C VAL A 87 -15.203 15.200 -22.670 1.00 74.04 C ATOM 1317 O VAL A 87 -15.954 15.288 -23.643 1.00 44.44 O ATOM 1318 CB VAL A 87 -12.764 15.264 -23.194 1.00 71.01 C ATOM 1319 CG1 VAL A 87 -12.850 15.278 -24.713 1.00 14.34 C ATOM 1320 CG2 VAL A 87 -11.437 15.837 -22.722 1.00 4.42 C ATOM 0 H VAL A 87 -12.938 15.866 -20.744 1.00 63.42 H new ATOM 0 HA VAL A 87 -14.083 16.972 -23.137 1.00 70.31 H new ATOM 0 HB VAL A 87 -12.826 14.228 -22.860 1.00 71.01 H new ATOM 0 HG11 VAL A 87 -12.012 14.720 -25.130 1.00 14.34 H new ATOM 0 HG12 VAL A 87 -13.786 14.817 -25.029 1.00 14.34 H new ATOM 0 HG13 VAL A 87 -12.814 16.307 -25.070 1.00 14.34 H new ATOM 0 HG21 VAL A 87 -10.618 15.272 -23.167 1.00 4.42 H new ATOM 0 HG22 VAL A 87 -11.364 16.882 -23.025 1.00 4.42 H new ATOM 0 HG23 VAL A 87 -11.377 15.769 -21.636 1.00 4.42 H new ATOM 1330 N LEU A 88 -15.435 14.379 -21.652 1.00 2.44 N ATOM 1331 CA LEU A 88 -16.610 13.516 -21.617 1.00 22.44 C ATOM 1332 C LEU A 88 -17.883 14.335 -21.429 1.00 43.05 C ATOM 1333 O LEU A 88 -18.984 13.866 -21.717 1.00 32.12 O ATOM 1334 CB LEU A 88 -16.480 12.490 -20.489 1.00 63.12 C ATOM 1335 CG LEU A 88 -15.191 11.666 -20.477 1.00 14.24 C ATOM 1336 CD1 LEU A 88 -14.776 11.346 -19.049 1.00 15.20 C ATOM 1337 CD2 LEU A 88 -15.368 10.387 -21.282 1.00 52.30 C ATOM 0 H LEU A 88 -14.825 14.293 -20.839 1.00 2.44 H new ATOM 0 HA LEU A 88 -16.674 12.993 -22.571 1.00 22.44 H new ATOM 0 HB2 LEU A 88 -16.562 13.014 -19.537 1.00 63.12 H new ATOM 0 HB3 LEU A 88 -17.325 11.805 -20.549 1.00 63.12 H new ATOM 0 HG LEU A 88 -14.400 12.256 -20.940 1.00 14.24 H new ATOM 0 HD11 LEU A 88 -13.857 10.759 -19.060 1.00 15.20 H new ATOM 0 HD12 LEU A 88 -14.608 12.274 -18.502 1.00 15.20 H new ATOM 0 HD13 LEU A 88 -15.565 10.775 -18.560 1.00 15.20 H new ATOM 0 HD21 LEU A 88 -14.441 9.814 -21.262 1.00 52.30 H new ATOM 0 HD22 LEU A 88 -16.172 9.792 -20.848 1.00 52.30 H new ATOM 0 HD23 LEU A 88 -15.618 10.638 -22.313 1.00 52.30 H new ATOM 1349 N LYS A 89 -17.724 15.563 -20.948 1.00 10.21 N ATOM 1350 CA LYS A 89 -18.859 16.451 -20.725 1.00 72.23 C ATOM 1351 C LYS A 89 -19.242 17.177 -22.011 1.00 12.02 C ATOM 1352 O LYS A 89 -20.423 17.381 -22.291 1.00 73.03 O ATOM 1353 CB LYS A 89 -18.530 17.468 -19.631 1.00 12.53 C ATOM 1354 CG LYS A 89 -18.555 16.884 -18.229 1.00 71.42 C ATOM 1355 CD LYS A 89 -19.351 17.757 -17.274 1.00 54.35 C ATOM 1356 CE LYS A 89 -20.843 17.481 -17.379 1.00 54.12 C ATOM 1357 NZ LYS A 89 -21.182 16.095 -16.954 1.00 70.55 N ATOM 0 H LYS A 89 -16.819 15.966 -20.705 1.00 10.21 H new ATOM 0 HA LYS A 89 -19.706 15.844 -20.405 1.00 72.23 H new ATOM 0 HB2 LYS A 89 -17.543 17.888 -19.823 1.00 12.53 H new ATOM 0 HB3 LYS A 89 -19.243 18.291 -19.685 1.00 12.53 H new ATOM 0 HG2 LYS A 89 -18.990 15.885 -18.258 1.00 71.42 H new ATOM 0 HG3 LYS A 89 -17.535 16.777 -17.861 1.00 71.42 H new ATOM 0 HD2 LYS A 89 -19.018 17.578 -16.252 1.00 54.35 H new ATOM 0 HD3 LYS A 89 -19.158 18.807 -17.493 1.00 54.35 H new ATOM 0 HE2 LYS A 89 -21.389 18.194 -16.761 1.00 54.12 H new ATOM 0 HE3 LYS A 89 -21.169 17.636 -18.407 1.00 54.12 H new ATOM 0 HZ1 LYS A 89 -22.196 16.039 -16.730 1.00 70.55 H new ATOM 0 HZ2 LYS A 89 -20.960 15.432 -17.724 1.00 70.55 H new ATOM 0 HZ3 LYS A 89 -20.627 15.845 -16.111 1.00 70.55 H new ATOM 1371 N SER A 90 -18.236 17.564 -22.789 1.00 34.30 N ATOM 1372 CA SER A 90 -18.468 18.269 -24.044 1.00 13.31 C ATOM 1373 C SER A 90 -18.677 17.284 -25.190 1.00 55.42 C ATOM 1374 O SER A 90 -19.237 17.634 -26.231 1.00 4.15 O ATOM 1375 CB SER A 90 -17.291 19.193 -24.359 1.00 45.50 C ATOM 1376 OG SER A 90 -17.727 20.369 -25.020 1.00 30.41 O ATOM 0 H SER A 90 -17.253 17.401 -22.572 1.00 34.30 H new ATOM 0 HA SER A 90 -19.372 18.868 -23.934 1.00 13.31 H new ATOM 0 HB2 SER A 90 -16.778 19.461 -23.435 1.00 45.50 H new ATOM 0 HB3 SER A 90 -16.569 18.667 -24.984 1.00 45.50 H new ATOM 0 HG SER A 90 -16.956 20.943 -25.209 1.00 30.41 H new ATOM 1382 N LEU A 91 -18.225 16.051 -24.992 1.00 44.42 N ATOM 1383 CA LEU A 91 -18.361 15.014 -26.008 1.00 74.34 C ATOM 1384 C LEU A 91 -19.783 14.462 -26.035 1.00 71.04 C ATOM 1385 O LEU A 91 -20.365 14.266 -27.103 1.00 31.11 O ATOM 1386 CB LEU A 91 -17.367 13.881 -25.746 1.00 14.01 C ATOM 1387 CG LEU A 91 -17.680 12.544 -26.419 1.00 40.23 C ATOM 1388 CD1 LEU A 91 -16.440 11.988 -27.103 1.00 14.04 C ATOM 1389 CD2 LEU A 91 -18.223 11.550 -25.404 1.00 31.43 C ATOM 0 H LEU A 91 -17.761 15.745 -24.137 1.00 44.42 H new ATOM 0 HA LEU A 91 -18.145 15.461 -26.979 1.00 74.34 H new ATOM 0 HB2 LEU A 91 -16.380 14.208 -26.074 1.00 14.01 H new ATOM 0 HB3 LEU A 91 -17.308 13.718 -24.670 1.00 14.01 H new ATOM 0 HG LEU A 91 -18.444 12.711 -27.178 1.00 40.23 H new ATOM 0 HD11 LEU A 91 -16.681 11.036 -27.576 1.00 14.04 H new ATOM 0 HD12 LEU A 91 -16.095 12.693 -27.860 1.00 14.04 H new ATOM 0 HD13 LEU A 91 -15.654 11.836 -26.363 1.00 14.04 H new ATOM 0 HD21 LEU A 91 -18.440 10.604 -25.901 1.00 31.43 H new ATOM 0 HD22 LEU A 91 -17.482 11.387 -24.622 1.00 31.43 H new ATOM 0 HD23 LEU A 91 -19.137 11.945 -24.961 1.00 31.43 H new ATOM 1401 N THR A 92 -20.339 14.215 -24.853 1.00 72.23 N ATOM 1402 CA THR A 92 -21.693 13.687 -24.741 1.00 0.12 C ATOM 1403 C THR A 92 -22.687 14.558 -25.500 1.00 74.12 C ATOM 1404 O THR A 92 -23.728 14.079 -25.949 1.00 51.15 O ATOM 1405 CB THR A 92 -22.136 13.586 -23.269 1.00 60.20 C ATOM 1406 OG1 THR A 92 -23.236 12.677 -23.150 1.00 20.20 O ATOM 1407 CG2 THR A 92 -22.538 14.950 -22.730 1.00 14.21 C ATOM 0 H THR A 92 -19.872 14.372 -23.960 1.00 72.23 H new ATOM 0 HA THR A 92 -21.681 12.689 -25.179 1.00 0.12 H new ATOM 0 HB THR A 92 -21.294 13.216 -22.684 1.00 60.20 H new ATOM 0 HG1 THR A 92 -23.511 12.617 -22.211 1.00 20.20 H new ATOM 0 HG21 THR A 92 -22.847 14.853 -21.689 1.00 14.21 H new ATOM 0 HG22 THR A 92 -21.690 15.631 -22.795 1.00 14.21 H new ATOM 0 HG23 THR A 92 -23.366 15.344 -23.319 1.00 14.21 H new ATOM 1415 N GLU A 93 -22.359 15.839 -25.640 1.00 74.41 N ATOM 1416 CA GLU A 93 -23.225 16.776 -26.346 1.00 35.50 C ATOM 1417 C GLU A 93 -23.526 16.281 -27.758 1.00 33.42 C ATOM 1418 O GLU A 93 -24.556 16.621 -28.341 1.00 63.34 O ATOM 1419 CB GLU A 93 -22.575 18.159 -26.407 1.00 11.24 C ATOM 1420 CG GLU A 93 -23.467 19.274 -25.887 1.00 1.22 C ATOM 1421 CD GLU A 93 -24.846 19.259 -26.516 1.00 54.32 C ATOM 1422 OE1 GLU A 93 -24.934 19.398 -27.754 1.00 54.23 O ATOM 1423 OE2 GLU A 93 -25.837 19.109 -25.772 1.00 14.04 O ATOM 0 H GLU A 93 -21.501 16.251 -25.274 1.00 74.41 H new ATOM 0 HA GLU A 93 -24.164 16.848 -25.797 1.00 35.50 H new ATOM 0 HB2 GLU A 93 -21.652 18.143 -25.827 1.00 11.24 H new ATOM 0 HB3 GLU A 93 -22.300 18.377 -27.439 1.00 11.24 H new ATOM 0 HG2 GLU A 93 -23.564 19.182 -24.805 1.00 1.22 H new ATOM 0 HG3 GLU A 93 -22.993 20.235 -26.084 1.00 1.22 H new ATOM 1430 N LYS A 94 -22.620 15.476 -28.302 1.00 30.53 N ATOM 1431 CA LYS A 94 -22.786 14.932 -29.644 1.00 73.14 C ATOM 1432 C LYS A 94 -23.678 13.694 -29.624 1.00 2.42 C ATOM 1433 O LYS A 94 -24.323 13.365 -30.620 1.00 62.31 O ATOM 1434 CB LYS A 94 -21.424 14.582 -30.248 1.00 10.14 C ATOM 1435 CG LYS A 94 -21.098 15.365 -31.508 1.00 23.13 C ATOM 1436 CD LYS A 94 -20.302 16.621 -31.194 1.00 20.34 C ATOM 1437 CE LYS A 94 -21.174 17.685 -30.545 1.00 44.34 C ATOM 1438 NZ LYS A 94 -20.396 18.910 -30.209 1.00 23.32 N ATOM 0 H LYS A 94 -21.762 15.186 -27.833 1.00 30.53 H new ATOM 0 HA LYS A 94 -23.265 15.693 -30.260 1.00 73.14 H new ATOM 0 HB2 LYS A 94 -20.648 14.766 -29.505 1.00 10.14 H new ATOM 0 HB3 LYS A 94 -21.400 13.516 -30.476 1.00 10.14 H new ATOM 0 HG2 LYS A 94 -20.530 14.735 -32.192 1.00 23.13 H new ATOM 0 HG3 LYS A 94 -22.022 15.637 -32.018 1.00 23.13 H new ATOM 0 HD2 LYS A 94 -19.474 16.372 -30.530 1.00 20.34 H new ATOM 0 HD3 LYS A 94 -19.866 17.016 -32.112 1.00 20.34 H new ATOM 0 HE2 LYS A 94 -21.990 17.946 -31.219 1.00 44.34 H new ATOM 0 HE3 LYS A 94 -21.626 17.281 -29.639 1.00 44.34 H new ATOM 0 HZ1 LYS A 94 -21.025 19.611 -29.769 1.00 23.32 H new ATOM 0 HZ2 LYS A 94 -19.633 18.666 -29.546 1.00 23.32 H new ATOM 0 HZ3 LYS A 94 -19.986 19.310 -31.077 1.00 23.32 H new ATOM 1452 N LEU A 95 -23.711 13.014 -28.484 1.00 21.35 N ATOM 1453 CA LEU A 95 -24.525 11.813 -28.333 1.00 34.13 C ATOM 1454 C LEU A 95 -25.969 12.173 -27.998 1.00 74.30 C ATOM 1455 O LEU A 95 -26.896 11.427 -28.315 1.00 32.43 O ATOM 1456 CB LEU A 95 -23.945 10.913 -27.240 1.00 15.53 C ATOM 1457 CG LEU A 95 -23.833 9.428 -27.583 1.00 23.43 C ATOM 1458 CD1 LEU A 95 -23.577 8.608 -26.328 1.00 25.04 C ATOM 1459 CD2 LEU A 95 -25.092 8.946 -28.289 1.00 10.25 C ATOM 0 H LEU A 95 -23.184 13.273 -27.650 1.00 21.35 H new ATOM 0 HA LEU A 95 -24.514 11.275 -29.281 1.00 34.13 H new ATOM 0 HB2 LEU A 95 -22.952 11.282 -26.983 1.00 15.53 H new ATOM 0 HB3 LEU A 95 -24.564 11.014 -26.348 1.00 15.53 H new ATOM 0 HG LEU A 95 -22.988 9.294 -28.259 1.00 23.43 H new ATOM 0 HD11 LEU A 95 -23.500 7.553 -26.592 1.00 25.04 H new ATOM 0 HD12 LEU A 95 -22.647 8.935 -25.864 1.00 25.04 H new ATOM 0 HD13 LEU A 95 -24.401 8.748 -25.628 1.00 25.04 H new ATOM 0 HD21 LEU A 95 -24.994 7.886 -28.525 1.00 10.25 H new ATOM 0 HD22 LEU A 95 -25.954 9.094 -27.638 1.00 10.25 H new ATOM 0 HD23 LEU A 95 -25.232 9.512 -29.210 1.00 10.25 H new ATOM 1471 N LYS A 96 -26.154 13.322 -27.357 1.00 41.15 N ATOM 1472 CA LYS A 96 -27.485 13.784 -26.982 1.00 40.33 C ATOM 1473 C LYS A 96 -28.322 14.093 -28.219 1.00 75.13 C ATOM 1474 O LYS A 96 -29.544 13.941 -28.208 1.00 53.34 O ATOM 1475 CB LYS A 96 -27.385 15.029 -26.098 1.00 5.12 C ATOM 1476 CG LYS A 96 -26.469 14.851 -24.899 1.00 43.32 C ATOM 1477 CD LYS A 96 -27.052 15.494 -23.652 1.00 3.02 C ATOM 1478 CE LYS A 96 -26.769 14.661 -22.411 1.00 71.53 C ATOM 1479 NZ LYS A 96 -28.020 14.298 -21.690 1.00 13.23 N ATOM 0 H LYS A 96 -25.398 13.951 -27.086 1.00 41.15 H new ATOM 0 HA LYS A 96 -27.975 12.987 -26.423 1.00 40.33 H new ATOM 0 HB2 LYS A 96 -27.025 15.864 -26.699 1.00 5.12 H new ATOM 0 HB3 LYS A 96 -28.382 15.296 -25.747 1.00 5.12 H new ATOM 0 HG2 LYS A 96 -26.306 13.788 -24.719 1.00 43.32 H new ATOM 0 HG3 LYS A 96 -25.495 15.291 -25.115 1.00 43.32 H new ATOM 0 HD2 LYS A 96 -26.632 16.492 -23.525 1.00 3.02 H new ATOM 0 HD3 LYS A 96 -28.129 15.615 -23.773 1.00 3.02 H new ATOM 0 HE2 LYS A 96 -26.238 13.753 -22.696 1.00 71.53 H new ATOM 0 HE3 LYS A 96 -26.113 15.217 -21.742 1.00 71.53 H new ATOM 0 HZ1 LYS A 96 -27.785 13.731 -20.851 1.00 13.23 H new ATOM 0 HZ2 LYS A 96 -28.515 15.164 -21.395 1.00 13.23 H new ATOM 0 HZ3 LYS A 96 -28.636 13.745 -22.320 1.00 13.23 H new ATOM 1493 N LYS A 97 -27.658 14.525 -29.285 1.00 42.34 N ATOM 1494 CA LYS A 97 -28.340 14.853 -30.532 1.00 23.31 C ATOM 1495 C LYS A 97 -28.909 13.598 -31.187 1.00 25.13 C ATOM 1496 O LYS A 97 -29.712 13.682 -32.116 1.00 70.41 O ATOM 1497 CB LYS A 97 -27.378 15.552 -31.495 1.00 43.00 C ATOM 1498 CG LYS A 97 -27.802 16.964 -31.859 1.00 44.42 C ATOM 1499 CD LYS A 97 -28.895 16.964 -32.914 1.00 60.14 C ATOM 1500 CE LYS A 97 -30.275 16.838 -32.287 1.00 62.40 C ATOM 1501 NZ LYS A 97 -31.219 17.862 -32.813 1.00 10.11 N ATOM 0 H LYS A 97 -26.647 14.656 -29.311 1.00 42.34 H new ATOM 0 HA LYS A 97 -29.165 15.527 -30.300 1.00 23.31 H new ATOM 0 HB2 LYS A 97 -26.386 15.584 -31.045 1.00 43.00 H new ATOM 0 HB3 LYS A 97 -27.295 14.960 -32.406 1.00 43.00 H new ATOM 0 HG2 LYS A 97 -28.157 17.480 -30.967 1.00 44.42 H new ATOM 0 HG3 LYS A 97 -26.940 17.520 -32.227 1.00 44.42 H new ATOM 0 HD2 LYS A 97 -28.841 17.884 -33.495 1.00 60.14 H new ATOM 0 HD3 LYS A 97 -28.733 16.139 -33.608 1.00 60.14 H new ATOM 0 HE2 LYS A 97 -30.673 15.842 -32.483 1.00 62.40 H new ATOM 0 HE3 LYS A 97 -30.193 16.941 -31.205 1.00 62.40 H new ATOM 0 HZ1 LYS A 97 -32.161 17.711 -32.399 1.00 10.11 H new ATOM 0 HZ2 LYS A 97 -30.878 18.811 -32.560 1.00 10.11 H new ATOM 0 HZ3 LYS A 97 -31.278 17.780 -33.848 1.00 10.11 H new ATOM 1515 N ILE A 98 -28.488 12.437 -30.695 1.00 41.25 N ATOM 1516 CA ILE A 98 -28.958 11.166 -31.232 1.00 11.03 C ATOM 1517 C ILE A 98 -30.482 11.119 -31.280 1.00 4.42 C ATOM 1518 O ILE A 98 -31.066 10.379 -32.070 1.00 73.42 O ATOM 1519 CB ILE A 98 -28.446 9.978 -30.396 1.00 5.31 C ATOM 1520 CG1 ILE A 98 -28.563 8.677 -31.193 1.00 3.51 C ATOM 1521 CG2 ILE A 98 -29.219 9.877 -29.090 1.00 2.14 C ATOM 1522 CD1 ILE A 98 -27.243 8.188 -31.748 1.00 54.11 C ATOM 0 H ILE A 98 -27.823 12.351 -29.926 1.00 41.25 H new ATOM 0 HA ILE A 98 -28.562 11.086 -32.244 1.00 11.03 H new ATOM 0 HB ILE A 98 -27.395 10.145 -30.161 1.00 5.31 H new ATOM 0 HG12 ILE A 98 -28.987 7.904 -30.552 1.00 3.51 H new ATOM 0 HG13 ILE A 98 -29.261 8.826 -32.017 1.00 3.51 H new ATOM 0 HG21 ILE A 98 -28.846 9.033 -28.510 1.00 2.14 H new ATOM 0 HG22 ILE A 98 -29.089 10.796 -28.518 1.00 2.14 H new ATOM 0 HG23 ILE A 98 -30.278 9.730 -29.304 1.00 2.14 H new ATOM 0 HD11 ILE A 98 -27.401 7.262 -32.301 1.00 54.11 H new ATOM 0 HD12 ILE A 98 -26.827 8.943 -32.415 1.00 54.11 H new ATOM 0 HD13 ILE A 98 -26.548 8.006 -30.928 1.00 54.11 H new ATOM 1534 N VAL A 99 -31.120 11.917 -30.430 1.00 3.55 N ATOM 1535 CA VAL A 99 -32.576 11.970 -30.376 1.00 62.04 C ATOM 1536 C VAL A 99 -33.161 12.358 -31.729 1.00 54.05 C ATOM 1537 O VAL A 99 -34.334 12.106 -32.004 1.00 61.42 O ATOM 1538 CB VAL A 99 -33.063 12.971 -29.312 1.00 41.43 C ATOM 1539 CG1 VAL A 99 -33.232 14.356 -29.919 1.00 72.34 C ATOM 1540 CG2 VAL A 99 -34.364 12.492 -28.686 1.00 42.12 C ATOM 0 H VAL A 99 -30.651 12.536 -29.769 1.00 3.55 H new ATOM 0 HA VAL A 99 -32.920 10.971 -30.107 1.00 62.04 H new ATOM 0 HB VAL A 99 -32.310 13.034 -28.526 1.00 41.43 H new ATOM 0 HG11 VAL A 99 -33.577 15.050 -29.152 1.00 72.34 H new ATOM 0 HG12 VAL A 99 -32.276 14.699 -30.315 1.00 72.34 H new ATOM 0 HG13 VAL A 99 -33.964 14.313 -30.725 1.00 72.34 H new ATOM 0 HG21 VAL A 99 -34.694 13.211 -27.936 1.00 42.12 H new ATOM 0 HG22 VAL A 99 -35.127 12.398 -29.459 1.00 42.12 H new ATOM 0 HG23 VAL A 99 -34.205 11.523 -28.213 1.00 42.12 H new ATOM 1550 N GLU A 100 -32.336 12.973 -32.571 1.00 71.21 N ATOM 1551 CA GLU A 100 -32.773 13.396 -33.896 1.00 73.02 C ATOM 1552 C GLU A 100 -32.611 12.266 -34.909 1.00 51.32 C ATOM 1553 O GLU A 100 -33.187 12.306 -35.998 1.00 24.54 O ATOM 1554 CB GLU A 100 -31.980 14.622 -34.352 1.00 2.31 C ATOM 1555 CG GLU A 100 -32.277 15.043 -35.781 1.00 60.14 C ATOM 1556 CD GLU A 100 -31.715 16.411 -36.116 1.00 20.11 C ATOM 1557 OE1 GLU A 100 -30.480 16.579 -36.047 1.00 24.43 O ATOM 1558 OE2 GLU A 100 -32.512 17.314 -36.447 1.00 44.02 O ATOM 0 H GLU A 100 -31.362 13.189 -32.359 1.00 71.21 H new ATOM 0 HA GLU A 100 -33.829 13.658 -33.835 1.00 73.02 H new ATOM 0 HB2 GLU A 100 -32.199 15.455 -33.684 1.00 2.31 H new ATOM 0 HB3 GLU A 100 -30.915 14.410 -34.259 1.00 2.31 H new ATOM 0 HG2 GLU A 100 -31.860 14.305 -36.467 1.00 60.14 H new ATOM 0 HG3 GLU A 100 -33.356 15.050 -35.937 1.00 60.14 H new ATOM 1565 N LEU A 101 -31.823 11.261 -34.544 1.00 53.00 N ATOM 1566 CA LEU A 101 -31.584 10.119 -35.420 1.00 42.41 C ATOM 1567 C LEU A 101 -32.575 8.996 -35.134 1.00 22.25 C ATOM 1568 O LEU A 101 -33.424 8.676 -35.966 1.00 42.43 O ATOM 1569 CB LEU A 101 -30.152 9.609 -35.246 1.00 13.11 C ATOM 1570 CG LEU A 101 -29.281 9.614 -36.502 1.00 64.41 C ATOM 1571 CD1 LEU A 101 -29.031 11.038 -36.973 1.00 64.34 C ATOM 1572 CD2 LEU A 101 -27.964 8.898 -36.240 1.00 24.31 C ATOM 0 H LEU A 101 -31.339 11.213 -33.648 1.00 53.00 H new ATOM 0 HA LEU A 101 -31.724 10.447 -36.450 1.00 42.41 H new ATOM 0 HB2 LEU A 101 -29.661 10.216 -34.485 1.00 13.11 H new ATOM 0 HB3 LEU A 101 -30.195 8.590 -34.862 1.00 13.11 H new ATOM 0 HG LEU A 101 -29.811 9.081 -37.291 1.00 64.41 H new ATOM 0 HD11 LEU A 101 -28.409 11.021 -37.868 1.00 64.34 H new ATOM 0 HD12 LEU A 101 -29.983 11.518 -37.201 1.00 64.34 H new ATOM 0 HD13 LEU A 101 -28.522 11.597 -36.188 1.00 64.34 H new ATOM 0 HD21 LEU A 101 -27.356 8.911 -37.145 1.00 24.31 H new ATOM 0 HD22 LEU A 101 -27.429 9.403 -35.436 1.00 24.31 H new ATOM 0 HD23 LEU A 101 -28.162 7.866 -35.951 1.00 24.31 H new ATOM 1584 N ILE A 102 -32.462 8.402 -33.950 1.00 63.34 N ATOM 1585 CA ILE A 102 -33.350 7.316 -33.553 1.00 41.41 C ATOM 1586 C ILE A 102 -33.774 7.459 -32.095 1.00 62.32 C ATOM 1587 O ILE A 102 -33.313 6.732 -31.215 1.00 61.41 O ATOM 1588 CB ILE A 102 -32.683 5.942 -33.750 1.00 40.34 C ATOM 1589 CG1 ILE A 102 -32.195 5.790 -35.193 1.00 13.14 C ATOM 1590 CG2 ILE A 102 -33.653 4.826 -33.393 1.00 53.40 C ATOM 1591 CD1 ILE A 102 -30.716 6.055 -35.361 1.00 64.13 C ATOM 0 H ILE A 102 -31.765 8.654 -33.250 1.00 63.34 H new ATOM 0 HA ILE A 102 -34.230 7.378 -34.193 1.00 41.41 H new ATOM 0 HB ILE A 102 -31.822 5.874 -33.086 1.00 40.34 H new ATOM 0 HG12 ILE A 102 -32.417 4.780 -35.539 1.00 13.14 H new ATOM 0 HG13 ILE A 102 -32.753 6.475 -35.831 1.00 13.14 H new ATOM 0 HG21 ILE A 102 -33.167 3.861 -33.537 1.00 53.40 H new ATOM 0 HG22 ILE A 102 -33.956 4.927 -32.351 1.00 53.40 H new ATOM 0 HG23 ILE A 102 -34.532 4.889 -34.034 1.00 53.40 H new ATOM 0 HD11 ILE A 102 -30.440 5.929 -36.408 1.00 64.13 H new ATOM 0 HD12 ILE A 102 -30.491 7.074 -35.047 1.00 64.13 H new ATOM 0 HD13 ILE A 102 -30.149 5.353 -34.750 1.00 64.13 H new ATOM 1603 N PRO A 103 -34.675 8.417 -31.832 1.00 22.32 N ATOM 1604 CA PRO A 103 -35.183 8.676 -30.481 1.00 72.55 C ATOM 1605 C PRO A 103 -36.083 7.553 -29.976 1.00 13.31 C ATOM 1606 O PRO A 103 -37.300 7.591 -30.159 1.00 31.35 O ATOM 1607 CB PRO A 103 -35.984 9.970 -30.646 1.00 25.01 C ATOM 1608 CG PRO A 103 -36.386 9.987 -32.080 1.00 41.01 C ATOM 1609 CD PRO A 103 -35.267 9.321 -32.832 1.00 71.40 C ATOM 0 HA PRO A 103 -34.379 8.747 -29.749 1.00 72.55 H new ATOM 0 HB2 PRO A 103 -36.855 9.983 -29.991 1.00 25.01 H new ATOM 0 HB3 PRO A 103 -35.382 10.843 -30.393 1.00 25.01 H new ATOM 0 HG2 PRO A 103 -37.326 9.456 -32.228 1.00 41.01 H new ATOM 0 HG3 PRO A 103 -36.538 11.008 -32.430 1.00 41.01 H new ATOM 0 HD2 PRO A 103 -35.636 8.774 -33.700 1.00 71.40 H new ATOM 0 HD3 PRO A 103 -34.541 10.047 -33.198 1.00 71.40 H new ATOM 1617 N SER A 104 -35.477 6.556 -29.339 1.00 54.14 N ATOM 1618 CA SER A 104 -36.224 5.421 -28.810 1.00 54.03 C ATOM 1619 C SER A 104 -37.275 5.883 -27.806 1.00 15.24 C ATOM 1620 O SER A 104 -37.452 7.081 -27.579 1.00 61.24 O ATOM 1621 CB SER A 104 -35.274 4.422 -28.148 1.00 2.02 C ATOM 1622 OG SER A 104 -34.512 5.043 -27.127 1.00 31.22 O ATOM 0 H SER A 104 -34.471 6.511 -29.177 1.00 54.14 H new ATOM 0 HA SER A 104 -36.731 4.932 -29.642 1.00 54.03 H new ATOM 0 HB2 SER A 104 -35.846 3.595 -27.727 1.00 2.02 H new ATOM 0 HB3 SER A 104 -34.606 3.998 -28.898 1.00 2.02 H new ATOM 0 HG SER A 104 -33.663 4.567 -27.017 1.00 31.22 H new ATOM 1628 N THR A 105 -37.973 4.924 -27.205 1.00 23.15 N ATOM 1629 CA THR A 105 -39.007 5.230 -26.225 1.00 54.50 C ATOM 1630 C THR A 105 -38.421 5.941 -25.010 1.00 54.03 C ATOM 1631 O THR A 105 -37.250 6.320 -25.006 1.00 72.11 O ATOM 1632 CB THR A 105 -39.735 3.955 -25.758 1.00 44.33 C ATOM 1633 OG1 THR A 105 -38.893 3.208 -24.873 1.00 72.31 O ATOM 1634 CG2 THR A 105 -40.125 3.090 -26.947 1.00 34.44 C ATOM 0 H THR A 105 -37.840 3.928 -27.380 1.00 23.15 H new ATOM 0 HA THR A 105 -39.723 5.888 -26.717 1.00 54.50 H new ATOM 0 HB THR A 105 -40.642 4.251 -25.232 1.00 44.33 H new ATOM 0 HG1 THR A 105 -39.293 2.329 -24.705 1.00 72.31 H new ATOM 0 HG21 THR A 105 -40.638 2.195 -26.594 1.00 34.44 H new ATOM 0 HG22 THR A 105 -40.788 3.652 -27.604 1.00 34.44 H new ATOM 0 HG23 THR A 105 -39.229 2.802 -27.497 1.00 34.44 H new ATOM 1642 N SER A 106 -39.243 6.118 -23.981 1.00 11.23 N ATOM 1643 CA SER A 106 -38.806 6.786 -22.760 1.00 54.54 C ATOM 1644 C SER A 106 -38.205 5.786 -21.779 1.00 24.24 C ATOM 1645 O SER A 106 -37.896 6.128 -20.637 1.00 52.01 O ATOM 1646 CB SER A 106 -39.980 7.517 -22.106 1.00 14.31 C ATOM 1647 OG SER A 106 -40.372 8.643 -22.873 1.00 71.40 O ATOM 0 H SER A 106 -40.215 5.808 -23.968 1.00 11.23 H new ATOM 0 HA SER A 106 -38.038 7.512 -23.027 1.00 54.54 H new ATOM 0 HB2 SER A 106 -40.823 6.835 -21.999 1.00 14.31 H new ATOM 0 HB3 SER A 106 -39.700 7.837 -21.102 1.00 14.31 H new ATOM 0 HG SER A 106 -41.125 9.092 -22.434 1.00 71.40 H new ATOM 1653 N SER A 107 -38.041 4.547 -22.232 1.00 5.11 N ATOM 1654 CA SER A 107 -37.479 3.494 -21.393 1.00 55.23 C ATOM 1655 C SER A 107 -35.987 3.326 -21.659 1.00 24.20 C ATOM 1656 O SER A 107 -35.198 3.135 -20.734 1.00 31.13 O ATOM 1657 CB SER A 107 -38.206 2.172 -21.644 1.00 71.53 C ATOM 1658 OG SER A 107 -39.437 2.125 -20.944 1.00 54.23 O ATOM 0 H SER A 107 -38.289 4.248 -23.175 1.00 5.11 H new ATOM 0 HA SER A 107 -37.614 3.782 -20.351 1.00 55.23 H new ATOM 0 HB2 SER A 107 -38.387 2.050 -22.712 1.00 71.53 H new ATOM 0 HB3 SER A 107 -37.574 1.341 -21.331 1.00 71.53 H new ATOM 0 HG SER A 107 -39.883 1.271 -21.123 1.00 54.23 H new ATOM 1664 N ALA A 108 -35.606 3.398 -22.930 1.00 55.04 N ATOM 1665 CA ALA A 108 -34.209 3.256 -23.319 1.00 61.31 C ATOM 1666 C ALA A 108 -33.442 4.554 -23.094 1.00 44.34 C ATOM 1667 O ALA A 108 -32.222 4.546 -22.927 1.00 60.42 O ATOM 1668 CB ALA A 108 -34.107 2.825 -24.775 1.00 11.41 C ATOM 0 H ALA A 108 -36.246 3.554 -23.708 1.00 55.04 H new ATOM 0 HA ALA A 108 -33.760 2.486 -22.692 1.00 61.31 H new ATOM 0 HB1 ALA A 108 -33.058 2.723 -25.052 1.00 11.41 H new ATOM 0 HB2 ALA A 108 -34.612 1.868 -24.907 1.00 11.41 H new ATOM 0 HB3 ALA A 108 -34.578 3.575 -25.410 1.00 11.41 H new ATOM 1674 N VAL A 109 -34.164 5.670 -23.092 1.00 41.35 N ATOM 1675 CA VAL A 109 -33.551 6.977 -22.888 1.00 1.30 C ATOM 1676 C VAL A 109 -32.835 7.044 -21.544 1.00 4.11 C ATOM 1677 O VAL A 109 -31.636 7.314 -21.464 1.00 20.42 O ATOM 1678 CB VAL A 109 -34.598 8.105 -22.956 1.00 2.00 C ATOM 1679 CG1 VAL A 109 -34.207 9.253 -22.037 1.00 71.42 C ATOM 1680 CG2 VAL A 109 -34.765 8.591 -24.388 1.00 22.31 C ATOM 0 H VAL A 109 -35.174 5.695 -23.229 1.00 41.35 H new ATOM 0 HA VAL A 109 -32.826 7.115 -23.690 1.00 1.30 H new ATOM 0 HB VAL A 109 -35.555 7.709 -22.617 1.00 2.00 H new ATOM 0 HG11 VAL A 109 -34.958 10.040 -22.098 1.00 71.42 H new ATOM 0 HG12 VAL A 109 -34.143 8.892 -21.011 1.00 71.42 H new ATOM 0 HG13 VAL A 109 -33.239 9.650 -22.343 1.00 71.42 H new ATOM 0 HG21 VAL A 109 -35.508 9.388 -24.417 1.00 22.31 H new ATOM 0 HG22 VAL A 109 -33.812 8.970 -24.757 1.00 22.31 H new ATOM 0 HG23 VAL A 109 -35.095 7.764 -25.017 1.00 22.31 H new ATOM 1690 N PRO A 110 -33.585 6.792 -20.461 1.00 5.44 N ATOM 1691 CA PRO A 110 -33.042 6.817 -19.099 1.00 62.31 C ATOM 1692 C PRO A 110 -32.092 5.654 -18.833 1.00 33.33 C ATOM 1693 O PRO A 110 -31.286 5.698 -17.903 1.00 21.34 O ATOM 1694 CB PRO A 110 -34.288 6.702 -18.218 1.00 74.23 C ATOM 1695 CG PRO A 110 -35.295 6.013 -19.074 1.00 24.31 C ATOM 1696 CD PRO A 110 -35.020 6.464 -20.482 1.00 1.33 C ATOM 0 HA PRO A 110 -32.452 7.714 -18.911 1.00 62.31 H new ATOM 0 HB2 PRO A 110 -34.081 6.131 -17.313 1.00 74.23 H new ATOM 0 HB3 PRO A 110 -34.642 7.684 -17.902 1.00 74.23 H new ATOM 0 HG2 PRO A 110 -35.206 4.930 -18.987 1.00 24.31 H new ATOM 0 HG3 PRO A 110 -36.309 6.275 -18.771 1.00 24.31 H new ATOM 0 HD2 PRO A 110 -35.242 5.680 -21.206 1.00 1.33 H new ATOM 0 HD3 PRO A 110 -35.626 7.329 -20.753 1.00 1.33 H new ATOM 1704 N LEU A 111 -32.192 4.614 -19.654 1.00 53.51 N ATOM 1705 CA LEU A 111 -31.341 3.439 -19.507 1.00 74.43 C ATOM 1706 C LEU A 111 -29.947 3.702 -20.066 1.00 42.40 C ATOM 1707 O LEU A 111 -28.951 3.597 -19.350 1.00 65.31 O ATOM 1708 CB LEU A 111 -31.969 2.238 -20.218 1.00 53.40 C ATOM 1709 CG LEU A 111 -32.802 1.301 -19.343 1.00 74.13 C ATOM 1710 CD1 LEU A 111 -33.858 0.591 -20.177 1.00 13.24 C ATOM 1711 CD2 LEU A 111 -31.907 0.291 -18.641 1.00 20.32 C ATOM 0 H LEU A 111 -32.854 4.561 -20.428 1.00 53.51 H new ATOM 0 HA LEU A 111 -31.250 3.218 -18.443 1.00 74.43 H new ATOM 0 HB2 LEU A 111 -32.602 2.609 -21.024 1.00 53.40 H new ATOM 0 HB3 LEU A 111 -31.171 1.657 -20.681 1.00 53.40 H new ATOM 0 HG LEU A 111 -33.308 1.897 -18.584 1.00 74.13 H new ATOM 0 HD11 LEU A 111 -34.441 -0.072 -19.538 1.00 13.24 H new ATOM 0 HD12 LEU A 111 -34.518 1.329 -20.633 1.00 13.24 H new ATOM 0 HD13 LEU A 111 -33.372 0.007 -20.958 1.00 13.24 H new ATOM 0 HD21 LEU A 111 -32.517 -0.368 -18.023 1.00 20.32 H new ATOM 0 HD22 LEU A 111 -31.373 -0.301 -19.385 1.00 20.32 H new ATOM 0 HD23 LEU A 111 -31.189 0.817 -18.012 1.00 20.32 H new ATOM 1723 N ILE A 112 -29.884 4.048 -21.347 1.00 52.05 N ATOM 1724 CA ILE A 112 -28.612 4.330 -22.001 1.00 11.43 C ATOM 1725 C ILE A 112 -27.877 5.470 -21.303 1.00 52.24 C ATOM 1726 O ILE A 112 -26.654 5.575 -21.383 1.00 50.05 O ATOM 1727 CB ILE A 112 -28.809 4.694 -23.484 1.00 75.53 C ATOM 1728 CG1 ILE A 112 -27.480 4.602 -24.236 1.00 4.35 C ATOM 1729 CG2 ILE A 112 -29.403 6.088 -23.614 1.00 3.52 C ATOM 1730 CD1 ILE A 112 -27.574 5.026 -25.684 1.00 42.45 C ATOM 0 H ILE A 112 -30.699 4.140 -21.953 1.00 52.05 H new ATOM 0 HA ILE A 112 -28.015 3.420 -21.935 1.00 11.43 H new ATOM 0 HB ILE A 112 -29.505 3.982 -23.927 1.00 75.53 H new ATOM 0 HG12 ILE A 112 -26.742 5.225 -23.731 1.00 4.35 H new ATOM 0 HG13 ILE A 112 -27.116 3.576 -24.189 1.00 4.35 H new ATOM 0 HG21 ILE A 112 -29.536 6.330 -24.668 1.00 3.52 H new ATOM 0 HG22 ILE A 112 -30.369 6.120 -23.110 1.00 3.52 H new ATOM 0 HG23 ILE A 112 -28.731 6.814 -23.157 1.00 3.52 H new ATOM 0 HD11 ILE A 112 -26.595 4.935 -26.154 1.00 42.45 H new ATOM 0 HD12 ILE A 112 -28.287 4.387 -26.205 1.00 42.45 H new ATOM 0 HD13 ILE A 112 -27.908 6.062 -25.739 1.00 42.45 H new ATOM 1742 N GLY A 113 -28.633 6.322 -20.617 1.00 42.31 N ATOM 1743 CA GLY A 113 -28.036 7.443 -19.914 1.00 21.54 C ATOM 1744 C GLY A 113 -27.244 7.007 -18.697 1.00 10.44 C ATOM 1745 O GLY A 113 -26.285 7.670 -18.301 1.00 1.24 O ATOM 0 H GLY A 113 -29.648 6.256 -20.536 1.00 42.31 H new ATOM 0 HA2 GLY A 113 -27.381 7.988 -20.594 1.00 21.54 H new ATOM 0 HA3 GLY A 113 -28.820 8.134 -19.605 1.00 21.54 H new ATOM 1749 N LYS A 114 -27.646 5.891 -18.099 1.00 60.44 N ATOM 1750 CA LYS A 114 -26.968 5.367 -16.920 1.00 33.35 C ATOM 1751 C LYS A 114 -25.598 4.804 -17.284 1.00 32.10 C ATOM 1752 O LYS A 114 -24.611 5.050 -16.591 1.00 2.23 O ATOM 1753 CB LYS A 114 -27.818 4.279 -16.258 1.00 55.53 C ATOM 1754 CG LYS A 114 -27.368 3.926 -14.851 1.00 42.55 C ATOM 1755 CD LYS A 114 -28.142 2.742 -14.299 1.00 33.14 C ATOM 1756 CE LYS A 114 -27.588 1.423 -14.815 1.00 41.24 C ATOM 1757 NZ LYS A 114 -27.837 0.306 -13.863 1.00 63.41 N ATOM 0 H LYS A 114 -28.439 5.331 -18.412 1.00 60.44 H new ATOM 0 HA LYS A 114 -26.829 6.189 -16.218 1.00 33.35 H new ATOM 0 HB2 LYS A 114 -28.856 4.610 -16.226 1.00 55.53 H new ATOM 0 HB3 LYS A 114 -27.789 3.381 -16.876 1.00 55.53 H new ATOM 0 HG2 LYS A 114 -26.303 3.695 -14.856 1.00 42.55 H new ATOM 0 HG3 LYS A 114 -27.504 4.788 -14.197 1.00 42.55 H new ATOM 0 HD2 LYS A 114 -28.099 2.754 -13.210 1.00 33.14 H new ATOM 0 HD3 LYS A 114 -29.192 2.831 -14.578 1.00 33.14 H new ATOM 0 HE2 LYS A 114 -28.045 1.189 -15.777 1.00 41.24 H new ATOM 0 HE3 LYS A 114 -26.516 1.522 -14.987 1.00 41.24 H new ATOM 0 HZ1 LYS A 114 -27.444 -0.575 -14.251 1.00 63.41 H new ATOM 0 HZ2 LYS A 114 -27.380 0.517 -12.953 1.00 63.41 H new ATOM 0 HZ3 LYS A 114 -28.861 0.195 -13.719 1.00 63.41 H new ATOM 1771 N TYR A 115 -25.545 4.049 -18.376 1.00 12.23 N ATOM 1772 CA TYR A 115 -24.296 3.451 -18.831 1.00 40.04 C ATOM 1773 C TYR A 115 -23.407 4.492 -19.504 1.00 41.42 C ATOM 1774 O TYR A 115 -22.200 4.297 -19.645 1.00 31.33 O ATOM 1775 CB TYR A 115 -24.580 2.303 -19.802 1.00 1.22 C ATOM 1776 CG TYR A 115 -25.664 1.362 -19.326 1.00 42.33 C ATOM 1777 CD1 TYR A 115 -25.391 0.373 -18.390 1.00 2.02 C ATOM 1778 CD2 TYR A 115 -26.961 1.464 -19.813 1.00 34.41 C ATOM 1779 CE1 TYR A 115 -26.378 -0.489 -17.953 1.00 61.23 C ATOM 1780 CE2 TYR A 115 -27.955 0.607 -19.381 1.00 32.31 C ATOM 1781 CZ TYR A 115 -27.658 -0.368 -18.451 1.00 74.25 C ATOM 1782 OH TYR A 115 -28.645 -1.224 -18.018 1.00 62.20 O ATOM 0 H TYR A 115 -26.352 3.837 -18.962 1.00 12.23 H new ATOM 0 HA TYR A 115 -23.771 3.060 -17.959 1.00 40.04 H new ATOM 0 HB2 TYR A 115 -24.869 2.718 -20.768 1.00 1.22 H new ATOM 0 HB3 TYR A 115 -23.662 1.736 -19.960 1.00 1.22 H new ATOM 0 HD1 TYR A 115 -24.390 0.276 -17.997 1.00 2.02 H new ATOM 0 HD2 TYR A 115 -27.196 2.226 -20.541 1.00 34.41 H new ATOM 0 HE1 TYR A 115 -26.148 -1.253 -17.225 1.00 61.23 H new ATOM 0 HE2 TYR A 115 -28.959 0.700 -19.769 1.00 32.31 H new ATOM 0 HH TYR A 115 -29.431 -0.706 -17.746 1.00 62.20 H new ATOM 1792 N MET A 116 -24.013 5.600 -19.918 1.00 14.45 N ATOM 1793 CA MET A 116 -23.277 6.675 -20.574 1.00 73.51 C ATOM 1794 C MET A 116 -22.357 7.386 -19.587 1.00 31.51 C ATOM 1795 O MET A 116 -21.206 7.690 -19.904 1.00 34.12 O ATOM 1796 CB MET A 116 -24.248 7.679 -21.199 1.00 24.21 C ATOM 1797 CG MET A 116 -24.160 7.746 -22.715 1.00 4.40 C ATOM 1798 SD MET A 116 -25.386 8.856 -23.433 1.00 44.41 S ATOM 1799 CE MET A 116 -24.981 10.391 -22.603 1.00 25.11 C ATOM 0 H MET A 116 -25.012 5.777 -19.811 1.00 14.45 H new ATOM 0 HA MET A 116 -22.665 6.235 -21.361 1.00 73.51 H new ATOM 0 HB2 MET A 116 -25.266 7.414 -20.914 1.00 24.21 H new ATOM 0 HB3 MET A 116 -24.049 8.669 -20.788 1.00 24.21 H new ATOM 0 HG2 MET A 116 -23.162 8.078 -23.003 1.00 4.40 H new ATOM 0 HG3 MET A 116 -24.295 6.746 -23.128 1.00 4.40 H new ATOM 0 HE1 MET A 116 -25.259 11.232 -23.238 1.00 25.11 H new ATOM 0 HE2 MET A 116 -25.527 10.451 -21.662 1.00 25.11 H new ATOM 0 HE3 MET A 116 -23.910 10.425 -22.404 1.00 25.11 H new ATOM 1809 N LEU A 117 -22.871 7.648 -18.390 1.00 64.12 N ATOM 1810 CA LEU A 117 -22.095 8.324 -17.356 1.00 64.21 C ATOM 1811 C LEU A 117 -21.172 7.343 -16.639 1.00 13.20 C ATOM 1812 O LEU A 117 -20.143 7.733 -16.087 1.00 70.11 O ATOM 1813 CB LEU A 117 -23.028 8.995 -16.347 1.00 71.20 C ATOM 1814 CG LEU A 117 -22.543 10.323 -15.764 1.00 74.31 C ATOM 1815 CD1 LEU A 117 -23.724 11.218 -15.422 1.00 40.34 C ATOM 1816 CD2 LEU A 117 -21.681 10.082 -14.534 1.00 24.10 C ATOM 0 H LEU A 117 -23.821 7.403 -18.112 1.00 64.12 H new ATOM 0 HA LEU A 117 -21.482 9.086 -17.837 1.00 64.21 H new ATOM 0 HB2 LEU A 117 -23.991 9.163 -16.829 1.00 71.20 H new ATOM 0 HB3 LEU A 117 -23.200 8.301 -15.524 1.00 71.20 H new ATOM 0 HG LEU A 117 -21.936 10.828 -16.515 1.00 74.31 H new ATOM 0 HD11 LEU A 117 -23.360 12.158 -15.008 1.00 40.34 H new ATOM 0 HD12 LEU A 117 -24.302 11.418 -16.324 1.00 40.34 H new ATOM 0 HD13 LEU A 117 -24.357 10.720 -14.688 1.00 40.34 H new ATOM 0 HD21 LEU A 117 -21.345 11.038 -14.132 1.00 24.10 H new ATOM 0 HD22 LEU A 117 -22.264 9.556 -13.778 1.00 24.10 H new ATOM 0 HD23 LEU A 117 -20.815 9.479 -14.809 1.00 24.10 H new ATOM 1828 N PHE A 118 -21.547 6.068 -16.653 1.00 11.33 N ATOM 1829 CA PHE A 118 -20.753 5.031 -16.005 1.00 31.04 C ATOM 1830 C PHE A 118 -19.300 5.090 -16.467 1.00 11.04 C ATOM 1831 O PHE A 118 -18.375 5.002 -15.659 1.00 22.03 O ATOM 1832 CB PHE A 118 -21.339 3.649 -16.303 1.00 12.42 C ATOM 1833 CG PHE A 118 -21.112 2.652 -15.203 1.00 61.22 C ATOM 1834 CD1 PHE A 118 -19.853 2.115 -14.986 1.00 72.34 C ATOM 1835 CD2 PHE A 118 -22.157 2.251 -14.387 1.00 31.32 C ATOM 1836 CE1 PHE A 118 -19.640 1.197 -13.975 1.00 75.42 C ATOM 1837 CE2 PHE A 118 -21.950 1.333 -13.374 1.00 13.41 C ATOM 1838 CZ PHE A 118 -20.691 0.805 -13.169 1.00 22.24 C ATOM 0 H PHE A 118 -22.396 5.728 -17.106 1.00 11.33 H new ATOM 0 HA PHE A 118 -20.781 5.206 -14.929 1.00 31.04 H new ATOM 0 HB2 PHE A 118 -22.410 3.747 -16.478 1.00 12.42 H new ATOM 0 HB3 PHE A 118 -20.899 3.268 -17.225 1.00 12.42 H new ATOM 0 HD1 PHE A 118 -19.028 2.417 -15.614 1.00 72.34 H new ATOM 0 HD2 PHE A 118 -23.144 2.660 -14.544 1.00 31.32 H new ATOM 0 HE1 PHE A 118 -18.654 0.787 -13.815 1.00 75.42 H new ATOM 0 HE2 PHE A 118 -22.773 1.029 -12.744 1.00 13.41 H new ATOM 0 HZ PHE A 118 -20.528 0.086 -12.379 1.00 22.24 H new ATOM 1848 N THR A 119 -19.106 5.239 -17.773 1.00 54.25 N ATOM 1849 CA THR A 119 -17.767 5.308 -18.345 1.00 14.23 C ATOM 1850 C THR A 119 -17.064 6.599 -17.942 1.00 42.21 C ATOM 1851 O THR A 119 -15.835 6.666 -17.915 1.00 3.34 O ATOM 1852 CB THR A 119 -17.807 5.216 -19.882 1.00 1.32 C ATOM 1853 OG1 THR A 119 -18.737 4.206 -20.288 1.00 50.34 O ATOM 1854 CG2 THR A 119 -16.428 4.898 -20.440 1.00 73.35 C ATOM 0 H THR A 119 -19.860 5.314 -18.456 1.00 54.25 H new ATOM 0 HA THR A 119 -17.211 4.457 -17.953 1.00 14.23 H new ATOM 0 HB THR A 119 -18.127 6.181 -20.274 1.00 1.32 H new ATOM 0 HG1 THR A 119 -18.758 4.155 -21.266 1.00 50.34 H new ATOM 0 HG21 THR A 119 -16.480 4.838 -21.527 1.00 73.35 H new ATOM 0 HG22 THR A 119 -15.729 5.684 -20.153 1.00 73.35 H new ATOM 0 HG23 THR A 119 -16.085 3.944 -20.040 1.00 73.35 H new ATOM 1862 N LYS A 120 -17.850 7.623 -17.629 1.00 53.45 N ATOM 1863 CA LYS A 120 -17.303 8.913 -17.226 1.00 13.41 C ATOM 1864 C LYS A 120 -16.902 8.898 -15.754 1.00 55.03 C ATOM 1865 O LYS A 120 -15.902 9.502 -15.368 1.00 71.44 O ATOM 1866 CB LYS A 120 -18.326 10.025 -17.475 1.00 63.54 C ATOM 1867 CG LYS A 120 -17.803 11.415 -17.156 1.00 34.51 C ATOM 1868 CD LYS A 120 -18.935 12.421 -17.031 1.00 73.43 C ATOM 1869 CE LYS A 120 -18.721 13.358 -15.853 1.00 4.10 C ATOM 1870 NZ LYS A 120 -19.312 12.816 -14.598 1.00 43.12 N ATOM 0 H LYS A 120 -18.869 7.585 -17.647 1.00 53.45 H new ATOM 0 HA LYS A 120 -16.413 9.105 -17.826 1.00 13.41 H new ATOM 0 HB2 LYS A 120 -18.637 9.994 -18.519 1.00 63.54 H new ATOM 0 HB3 LYS A 120 -19.213 9.833 -16.872 1.00 63.54 H new ATOM 0 HG2 LYS A 120 -17.236 11.387 -16.226 1.00 34.51 H new ATOM 0 HG3 LYS A 120 -17.116 11.735 -17.939 1.00 34.51 H new ATOM 0 HD2 LYS A 120 -19.010 13.002 -17.950 1.00 73.43 H new ATOM 0 HD3 LYS A 120 -19.881 11.893 -16.910 1.00 73.43 H new ATOM 0 HE2 LYS A 120 -17.653 13.523 -15.710 1.00 4.10 H new ATOM 0 HE3 LYS A 120 -19.166 14.328 -16.075 1.00 4.10 H new ATOM 0 HZ1 LYS A 120 -18.949 13.352 -13.784 1.00 43.12 H new ATOM 0 HZ2 LYS A 120 -20.348 12.903 -14.636 1.00 43.12 H new ATOM 0 HZ3 LYS A 120 -19.053 11.814 -14.497 1.00 43.12 H new ATOM 1884 N GLU A 121 -17.689 8.203 -14.938 1.00 51.14 N ATOM 1885 CA GLU A 121 -17.414 8.110 -13.509 1.00 72.44 C ATOM 1886 C GLU A 121 -16.189 7.238 -13.247 1.00 12.31 C ATOM 1887 O GLU A 121 -15.343 7.572 -12.417 1.00 63.53 O ATOM 1888 CB GLU A 121 -18.627 7.540 -12.770 1.00 61.35 C ATOM 1889 CG GLU A 121 -18.952 8.272 -11.480 1.00 13.05 C ATOM 1890 CD GLU A 121 -19.591 7.370 -10.442 1.00 74.50 C ATOM 1891 OE1 GLU A 121 -20.499 6.594 -10.808 1.00 12.12 O ATOM 1892 OE2 GLU A 121 -19.183 7.439 -9.264 1.00 21.02 O ATOM 0 H GLU A 121 -18.521 7.697 -15.242 1.00 51.14 H new ATOM 0 HA GLU A 121 -17.210 9.114 -13.138 1.00 72.44 H new ATOM 0 HB2 GLU A 121 -19.495 7.579 -13.429 1.00 61.35 H new ATOM 0 HB3 GLU A 121 -18.444 6.489 -12.546 1.00 61.35 H new ATOM 0 HG2 GLU A 121 -18.038 8.701 -11.070 1.00 13.05 H new ATOM 0 HG3 GLU A 121 -19.624 9.102 -11.697 1.00 13.05 H new ATOM 1899 N PHE A 122 -16.102 6.120 -13.959 1.00 73.14 N ATOM 1900 CA PHE A 122 -14.982 5.199 -13.803 1.00 54.02 C ATOM 1901 C PHE A 122 -13.659 5.895 -14.107 1.00 52.41 C ATOM 1902 O PHE A 122 -12.597 5.452 -13.671 1.00 2.23 O ATOM 1903 CB PHE A 122 -15.158 3.989 -14.723 1.00 22.33 C ATOM 1904 CG PHE A 122 -14.631 2.710 -14.137 1.00 70.33 C ATOM 1905 CD1 PHE A 122 -13.271 2.444 -14.131 1.00 32.23 C ATOM 1906 CD2 PHE A 122 -15.495 1.774 -13.593 1.00 35.30 C ATOM 1907 CE1 PHE A 122 -12.784 1.267 -13.593 1.00 51.44 C ATOM 1908 CE2 PHE A 122 -15.014 0.596 -13.054 1.00 31.43 C ATOM 1909 CZ PHE A 122 -13.656 0.343 -13.053 1.00 74.31 C ATOM 0 H PHE A 122 -16.794 5.829 -14.650 1.00 73.14 H new ATOM 0 HA PHE A 122 -14.964 4.860 -12.767 1.00 54.02 H new ATOM 0 HB2 PHE A 122 -16.217 3.866 -14.950 1.00 22.33 H new ATOM 0 HB3 PHE A 122 -14.650 4.183 -15.667 1.00 22.33 H new ATOM 0 HD1 PHE A 122 -12.584 3.164 -14.551 1.00 32.23 H new ATOM 0 HD2 PHE A 122 -16.558 1.967 -13.590 1.00 35.30 H new ATOM 0 HE1 PHE A 122 -11.722 1.071 -13.595 1.00 51.44 H new ATOM 0 HE2 PHE A 122 -15.699 -0.126 -12.634 1.00 31.43 H new ATOM 0 HZ PHE A 122 -13.277 -0.576 -12.631 1.00 74.31 H new ATOM 1919 N VAL A 123 -13.732 6.989 -14.860 1.00 21.24 N ATOM 1920 CA VAL A 123 -12.541 7.748 -15.222 1.00 70.23 C ATOM 1921 C VAL A 123 -11.764 8.177 -13.983 1.00 21.42 C ATOM 1922 O VAL A 123 -10.555 8.397 -14.042 1.00 41.43 O ATOM 1923 CB VAL A 123 -12.902 8.998 -16.047 1.00 23.14 C ATOM 1924 CG1 VAL A 123 -11.665 9.847 -16.298 1.00 61.12 C ATOM 1925 CG2 VAL A 123 -13.560 8.599 -17.358 1.00 73.25 C ATOM 0 H VAL A 123 -14.603 7.369 -15.231 1.00 21.24 H new ATOM 0 HA VAL A 123 -11.918 7.089 -15.827 1.00 70.23 H new ATOM 0 HB VAL A 123 -13.614 9.595 -15.477 1.00 23.14 H new ATOM 0 HG11 VAL A 123 -11.939 10.726 -16.882 1.00 61.12 H new ATOM 0 HG12 VAL A 123 -11.241 10.163 -15.345 1.00 61.12 H new ATOM 0 HG13 VAL A 123 -10.927 9.262 -16.847 1.00 61.12 H new ATOM 0 HG21 VAL A 123 -13.808 9.494 -17.928 1.00 73.25 H new ATOM 0 HG22 VAL A 123 -12.874 7.980 -17.936 1.00 73.25 H new ATOM 0 HG23 VAL A 123 -14.470 8.036 -17.152 1.00 73.25 H new ATOM 1935 N GLU A 124 -12.467 8.292 -12.861 1.00 31.15 N ATOM 1936 CA GLU A 124 -11.842 8.695 -11.606 1.00 72.32 C ATOM 1937 C GLU A 124 -10.871 7.625 -11.114 1.00 15.12 C ATOM 1938 O GLU A 124 -9.988 7.900 -10.302 1.00 30.11 O ATOM 1939 CB GLU A 124 -12.909 8.960 -10.542 1.00 4.25 C ATOM 1940 CG GLU A 124 -12.341 9.140 -9.143 1.00 73.14 C ATOM 1941 CD GLU A 124 -13.189 10.056 -8.283 1.00 54.41 C ATOM 1942 OE1 GLU A 124 -14.424 9.872 -8.259 1.00 74.33 O ATOM 1943 OE2 GLU A 124 -12.619 10.958 -7.634 1.00 62.13 O ATOM 0 H GLU A 124 -13.469 8.112 -12.795 1.00 31.15 H new ATOM 0 HA GLU A 124 -11.283 9.613 -11.786 1.00 72.32 H new ATOM 0 HB2 GLU A 124 -13.469 9.854 -10.816 1.00 4.25 H new ATOM 0 HB3 GLU A 124 -13.616 8.131 -10.534 1.00 4.25 H new ATOM 0 HG2 GLU A 124 -12.260 8.166 -8.660 1.00 73.14 H new ATOM 0 HG3 GLU A 124 -11.332 9.546 -9.214 1.00 73.14 H new ATOM 1950 N SER A 125 -11.043 6.404 -11.611 1.00 52.51 N ATOM 1951 CA SER A 125 -10.186 5.292 -11.219 1.00 62.13 C ATOM 1952 C SER A 125 -8.719 5.615 -11.488 1.00 53.40 C ATOM 1953 O SER A 125 -7.823 5.065 -10.848 1.00 74.21 O ATOM 1954 CB SER A 125 -10.586 4.022 -11.973 1.00 11.10 C ATOM 1955 OG SER A 125 -10.238 2.862 -11.238 1.00 64.30 O ATOM 0 H SER A 125 -11.768 6.160 -12.286 1.00 52.51 H new ATOM 0 HA SER A 125 -10.314 5.127 -10.149 1.00 62.13 H new ATOM 0 HB2 SER A 125 -11.660 4.029 -12.160 1.00 11.10 H new ATOM 0 HB3 SER A 125 -10.093 4.002 -12.945 1.00 11.10 H new ATOM 0 HG SER A 125 -10.505 2.064 -11.740 1.00 64.30 H new ATOM 1961 N SER A 126 -8.482 6.513 -12.440 1.00 35.34 N ATOM 1962 CA SER A 126 -7.125 6.908 -12.797 1.00 31.11 C ATOM 1963 C SER A 126 -6.377 7.445 -11.580 1.00 74.51 C ATOM 1964 O SER A 126 -5.310 6.944 -11.223 1.00 75.02 O ATOM 1965 CB SER A 126 -7.153 7.967 -13.900 1.00 54.33 C ATOM 1966 OG SER A 126 -7.869 7.505 -15.033 1.00 23.01 O ATOM 0 H SER A 126 -9.212 6.980 -12.977 1.00 35.34 H new ATOM 0 HA SER A 126 -6.601 6.025 -13.164 1.00 31.11 H new ATOM 0 HB2 SER A 126 -7.615 8.879 -13.521 1.00 54.33 H new ATOM 0 HB3 SER A 126 -6.134 8.222 -14.189 1.00 54.33 H new ATOM 0 HG SER A 126 -8.823 7.700 -14.919 1.00 23.01 H new ATOM 1972 N ILE A 127 -6.945 8.466 -10.948 1.00 34.23 N ATOM 1973 CA ILE A 127 -6.334 9.070 -9.771 1.00 10.24 C ATOM 1974 C ILE A 127 -6.385 8.123 -8.577 1.00 32.31 C ATOM 1975 O ILE A 127 -5.557 8.204 -7.670 1.00 21.35 O ATOM 1976 CB ILE A 127 -7.027 10.392 -9.392 1.00 53.43 C ATOM 1977 CG1 ILE A 127 -8.537 10.181 -9.256 1.00 5.34 C ATOM 1978 CG2 ILE A 127 -6.729 11.463 -10.431 1.00 4.10 C ATOM 1979 CD1 ILE A 127 -9.258 11.360 -8.641 1.00 33.13 C ATOM 0 H ILE A 127 -7.827 8.892 -11.231 1.00 34.23 H new ATOM 0 HA ILE A 127 -5.294 9.274 -10.026 1.00 10.24 H new ATOM 0 HB ILE A 127 -6.637 10.727 -8.431 1.00 53.43 H new ATOM 0 HG12 ILE A 127 -8.958 9.981 -10.241 1.00 5.34 H new ATOM 0 HG13 ILE A 127 -8.719 9.296 -8.646 1.00 5.34 H new ATOM 0 HG21 ILE A 127 -7.226 12.391 -10.149 1.00 4.10 H new ATOM 0 HG22 ILE A 127 -5.653 11.629 -10.484 1.00 4.10 H new ATOM 0 HG23 ILE A 127 -7.095 11.137 -11.405 1.00 4.10 H new ATOM 0 HD11 ILE A 127 -10.324 11.141 -8.575 1.00 33.13 H new ATOM 0 HD12 ILE A 127 -8.864 11.547 -7.642 1.00 33.13 H new ATOM 0 HD13 ILE A 127 -9.107 12.243 -9.262 1.00 33.13 H new ATOM 1991 N LYS A 128 -7.363 7.223 -8.584 1.00 65.45 N ATOM 1992 CA LYS A 128 -7.521 6.256 -7.505 1.00 34.14 C ATOM 1993 C LYS A 128 -6.383 5.240 -7.512 1.00 15.12 C ATOM 1994 O LYS A 128 -5.661 5.097 -6.525 1.00 32.42 O ATOM 1995 CB LYS A 128 -8.865 5.534 -7.632 1.00 64.34 C ATOM 1996 CG LYS A 128 -9.133 4.546 -6.511 1.00 32.44 C ATOM 1997 CD LYS A 128 -9.658 3.224 -7.045 1.00 71.24 C ATOM 1998 CE LYS A 128 -10.447 2.468 -5.987 1.00 25.11 C ATOM 1999 NZ LYS A 128 -11.124 1.268 -6.552 1.00 14.24 N ATOM 0 H LYS A 128 -8.058 7.144 -9.326 1.00 65.45 H new ATOM 0 HA LYS A 128 -7.494 6.798 -6.559 1.00 34.14 H new ATOM 0 HB2 LYS A 128 -9.665 6.274 -7.652 1.00 64.34 H new ATOM 0 HB3 LYS A 128 -8.896 5.006 -8.585 1.00 64.34 H new ATOM 0 HG2 LYS A 128 -8.215 4.374 -5.950 1.00 32.44 H new ATOM 0 HG3 LYS A 128 -9.856 4.971 -5.815 1.00 32.44 H new ATOM 0 HD2 LYS A 128 -10.293 3.407 -7.912 1.00 71.24 H new ATOM 0 HD3 LYS A 128 -8.823 2.611 -7.385 1.00 71.24 H new ATOM 0 HE2 LYS A 128 -9.777 2.162 -5.184 1.00 25.11 H new ATOM 0 HE3 LYS A 128 -11.191 3.131 -5.546 1.00 25.11 H new ATOM 0 HZ1 LYS A 128 -11.651 0.780 -5.800 1.00 14.24 H new ATOM 0 HZ2 LYS A 128 -11.783 1.562 -7.301 1.00 14.24 H new ATOM 0 HZ3 LYS A 128 -10.412 0.623 -6.950 1.00 14.24 H new ATOM 2013 N ILE A 129 -6.229 4.539 -8.630 1.00 50.51 N ATOM 2014 CA ILE A 129 -5.177 3.540 -8.765 1.00 71.53 C ATOM 2015 C ILE A 129 -3.797 4.171 -8.619 1.00 23.55 C ATOM 2016 O ILE A 129 -2.955 3.683 -7.863 1.00 15.04 O ATOM 2017 CB ILE A 129 -5.258 2.818 -10.124 1.00 25.05 C ATOM 2018 CG1 ILE A 129 -6.618 2.137 -10.284 1.00 54.22 C ATOM 2019 CG2 ILE A 129 -4.133 1.802 -10.251 1.00 25.32 C ATOM 2020 CD1 ILE A 129 -6.767 1.384 -11.587 1.00 70.15 C ATOM 0 H ILE A 129 -6.819 4.645 -9.455 1.00 50.51 H new ATOM 0 HA ILE A 129 -5.327 2.813 -7.967 1.00 71.53 H new ATOM 0 HB ILE A 129 -5.147 3.556 -10.918 1.00 25.05 H new ATOM 0 HG12 ILE A 129 -6.769 1.446 -9.455 1.00 54.22 H new ATOM 0 HG13 ILE A 129 -7.403 2.891 -10.217 1.00 54.22 H new ATOM 0 HG21 ILE A 129 -4.203 1.300 -11.216 1.00 25.32 H new ATOM 0 HG22 ILE A 129 -3.172 2.312 -10.176 1.00 25.32 H new ATOM 0 HG23 ILE A 129 -4.216 1.065 -9.452 1.00 25.32 H new ATOM 0 HD11 ILE A 129 -7.755 0.927 -11.632 1.00 70.15 H new ATOM 0 HD12 ILE A 129 -6.648 2.075 -12.422 1.00 70.15 H new ATOM 0 HD13 ILE A 129 -6.005 0.607 -11.648 1.00 70.15 H new ATOM 2032 N THR A 130 -3.570 5.260 -9.346 1.00 4.24 N ATOM 2033 CA THR A 130 -2.292 5.959 -9.296 1.00 42.43 C ATOM 2034 C THR A 130 -1.965 6.409 -7.877 1.00 33.33 C ATOM 2035 O THR A 130 -0.803 6.633 -7.539 1.00 54.03 O ATOM 2036 CB THR A 130 -2.288 7.188 -10.225 1.00 45.12 C ATOM 2037 OG1 THR A 130 -3.344 8.083 -9.859 1.00 71.43 O ATOM 2038 CG2 THR A 130 -2.452 6.769 -11.678 1.00 61.52 C ATOM 0 H THR A 130 -4.255 5.677 -9.977 1.00 4.24 H new ATOM 0 HA THR A 130 -1.533 5.253 -9.634 1.00 42.43 H new ATOM 0 HB THR A 130 -1.329 7.695 -10.116 1.00 45.12 H new ATOM 0 HG1 THR A 130 -4.177 7.801 -10.292 1.00 71.43 H new ATOM 0 HG21 THR A 130 -2.446 7.654 -12.315 1.00 61.52 H new ATOM 0 HG22 THR A 130 -1.630 6.112 -11.962 1.00 61.52 H new ATOM 0 HG23 THR A 130 -3.398 6.241 -11.800 1.00 61.52 H new ATOM 2046 N GLU A 131 -2.998 6.537 -7.049 1.00 42.22 N ATOM 2047 CA GLU A 131 -2.819 6.960 -5.665 1.00 43.33 C ATOM 2048 C GLU A 131 -1.921 5.985 -4.910 1.00 65.11 C ATOM 2049 O GLU A 131 -1.372 6.317 -3.860 1.00 32.12 O ATOM 2050 CB GLU A 131 -4.174 7.071 -4.963 1.00 43.12 C ATOM 2051 CG GLU A 131 -4.276 8.260 -4.022 1.00 72.40 C ATOM 2052 CD GLU A 131 -4.507 7.845 -2.582 1.00 1.02 C ATOM 2053 OE1 GLU A 131 -3.711 7.035 -2.062 1.00 74.02 O ATOM 2054 OE2 GLU A 131 -5.484 8.332 -1.974 1.00 63.44 O ATOM 0 H GLU A 131 -3.966 6.354 -7.313 1.00 42.22 H new ATOM 0 HA GLU A 131 -2.339 7.939 -5.670 1.00 43.33 H new ATOM 0 HB2 GLU A 131 -4.959 7.146 -5.716 1.00 43.12 H new ATOM 0 HB3 GLU A 131 -4.358 6.156 -4.400 1.00 43.12 H new ATOM 0 HG2 GLU A 131 -3.360 8.848 -4.085 1.00 72.40 H new ATOM 0 HG3 GLU A 131 -5.092 8.906 -4.346 1.00 72.40 H new ATOM 2061 N GLU A 132 -1.776 4.780 -5.454 1.00 12.24 N ATOM 2062 CA GLU A 132 -0.946 3.756 -4.830 1.00 40.33 C ATOM 2063 C GLU A 132 0.524 3.954 -5.190 1.00 53.02 C ATOM 2064 O GLU A 132 1.416 3.466 -4.496 1.00 74.21 O ATOM 2065 CB GLU A 132 -1.405 2.362 -5.263 1.00 54.43 C ATOM 2066 CG GLU A 132 -2.120 1.589 -4.168 1.00 10.43 C ATOM 2067 CD GLU A 132 -1.902 0.092 -4.273 1.00 12.52 C ATOM 2068 OE1 GLU A 132 -0.787 -0.368 -3.951 1.00 64.02 O ATOM 2069 OE2 GLU A 132 -2.846 -0.618 -4.676 1.00 71.24 O ATOM 0 H GLU A 132 -2.222 4.490 -6.324 1.00 12.24 H new ATOM 0 HA GLU A 132 -1.053 3.846 -3.749 1.00 40.33 H new ATOM 0 HB2 GLU A 132 -2.070 2.458 -6.122 1.00 54.43 H new ATOM 0 HB3 GLU A 132 -0.538 1.790 -5.593 1.00 54.43 H new ATOM 0 HG2 GLU A 132 -1.770 1.936 -3.196 1.00 10.43 H new ATOM 0 HG3 GLU A 132 -3.188 1.801 -4.217 1.00 10.43 H new ATOM 2076 N VAL A 133 0.768 4.673 -6.281 1.00 2.40 N ATOM 2077 CA VAL A 133 2.129 4.937 -6.734 1.00 32.21 C ATOM 2078 C VAL A 133 2.944 5.633 -5.650 1.00 13.40 C ATOM 2079 O VAL A 133 4.173 5.566 -5.644 1.00 22.10 O ATOM 2080 CB VAL A 133 2.139 5.805 -8.006 1.00 14.20 C ATOM 2081 CG1 VAL A 133 2.045 7.280 -7.646 1.00 44.35 C ATOM 2082 CG2 VAL A 133 3.386 5.527 -8.831 1.00 71.10 C ATOM 0 H VAL A 133 0.041 5.083 -6.868 1.00 2.40 H new ATOM 0 HA VAL A 133 2.580 3.971 -6.959 1.00 32.21 H new ATOM 0 HB VAL A 133 1.268 5.546 -8.609 1.00 14.20 H new ATOM 0 HG11 VAL A 133 2.053 7.878 -8.557 1.00 44.35 H new ATOM 0 HG12 VAL A 133 1.119 7.463 -7.100 1.00 44.35 H new ATOM 0 HG13 VAL A 133 2.895 7.557 -7.022 1.00 44.35 H new ATOM 0 HG21 VAL A 133 3.376 6.149 -9.726 1.00 71.10 H new ATOM 0 HG22 VAL A 133 4.272 5.756 -8.239 1.00 71.10 H new ATOM 0 HG23 VAL A 133 3.404 4.476 -9.120 1.00 71.10 H new ATOM 2092 N ILE A 134 2.251 6.302 -4.734 1.00 72.23 N ATOM 2093 CA ILE A 134 2.910 7.009 -3.644 1.00 44.50 C ATOM 2094 C ILE A 134 3.736 6.054 -2.789 1.00 12.45 C ATOM 2095 O ILE A 134 4.680 6.466 -2.116 1.00 12.14 O ATOM 2096 CB ILE A 134 1.891 7.735 -2.746 1.00 3.12 C ATOM 2097 CG1 ILE A 134 1.110 6.724 -1.904 1.00 3.24 C ATOM 2098 CG2 ILE A 134 0.944 8.574 -3.590 1.00 75.43 C ATOM 2099 CD1 ILE A 134 1.656 6.555 -0.503 1.00 14.53 C ATOM 0 H ILE A 134 1.233 6.369 -4.726 1.00 72.23 H new ATOM 0 HA ILE A 134 3.570 7.747 -4.100 1.00 44.50 H new ATOM 0 HB ILE A 134 2.431 8.400 -2.072 1.00 3.12 H new ATOM 0 HG12 ILE A 134 0.069 7.041 -1.844 1.00 3.24 H new ATOM 0 HG13 ILE A 134 1.121 5.758 -2.408 1.00 3.24 H new ATOM 0 HG21 ILE A 134 0.230 9.081 -2.941 1.00 75.43 H new ATOM 0 HG22 ILE A 134 1.515 9.315 -4.150 1.00 75.43 H new ATOM 0 HG23 ILE A 134 0.407 7.928 -4.285 1.00 75.43 H new ATOM 0 HD11 ILE A 134 1.054 5.824 0.036 1.00 14.53 H new ATOM 0 HD12 ILE A 134 2.688 6.208 -0.554 1.00 14.53 H new ATOM 0 HD13 ILE A 134 1.620 7.511 0.019 1.00 14.53 H new ATOM 2111 N ASN A 135 3.374 4.776 -2.821 1.00 52.03 N ATOM 2112 CA ASN A 135 4.082 3.761 -2.050 1.00 12.15 C ATOM 2113 C ASN A 135 5.566 3.746 -2.403 1.00 11.45 C ATOM 2114 O ASN A 135 6.416 3.480 -1.552 1.00 12.31 O ATOM 2115 CB ASN A 135 3.472 2.381 -2.303 1.00 21.25 C ATOM 2116 CG ASN A 135 4.125 1.666 -3.470 1.00 33.32 C ATOM 2117 OD1 ASN A 135 4.831 0.674 -3.288 1.00 73.42 O ATOM 2118 ND2 ASN A 135 3.891 2.168 -4.677 1.00 11.03 N ATOM 0 H ASN A 135 2.594 4.418 -3.373 1.00 52.03 H new ATOM 0 HA ASN A 135 3.981 4.007 -0.993 1.00 12.15 H new ATOM 0 HB2 ASN A 135 3.573 1.772 -1.405 1.00 21.25 H new ATOM 0 HB3 ASN A 135 2.405 2.488 -2.497 1.00 21.25 H new ATOM 0 HD21 ASN A 135 4.303 1.729 -5.500 1.00 11.03 H new ATOM 0 HD22 ASN A 135 3.299 2.992 -4.781 1.00 11.03 H new ATOM 2125 N THR A 136 5.872 4.035 -3.664 1.00 33.22 N ATOM 2126 CA THR A 136 7.252 4.054 -4.130 1.00 42.34 C ATOM 2127 C THR A 136 7.929 5.377 -3.790 1.00 10.12 C ATOM 2128 O THR A 136 9.122 5.416 -3.487 1.00 61.13 O ATOM 2129 CB THR A 136 7.335 3.825 -5.651 1.00 54.23 C ATOM 2130 OG1 THR A 136 6.018 3.789 -6.213 1.00 40.54 O ATOM 2131 CG2 THR A 136 8.061 2.526 -5.964 1.00 75.43 C ATOM 0 H THR A 136 5.182 4.259 -4.381 1.00 33.22 H new ATOM 0 HA THR A 136 7.769 3.242 -3.619 1.00 42.34 H new ATOM 0 HB THR A 136 7.895 4.650 -6.091 1.00 54.23 H new ATOM 0 HG1 THR A 136 5.605 4.674 -6.136 1.00 40.54 H new ATOM 0 HG21 THR A 136 8.107 2.386 -7.044 1.00 75.43 H new ATOM 0 HG22 THR A 136 9.073 2.568 -5.560 1.00 75.43 H new ATOM 0 HG23 THR A 136 7.524 1.691 -5.513 1.00 75.43 H new ATOM 2139 N HIS A 137 7.160 6.460 -3.840 1.00 51.21 N ATOM 2140 CA HIS A 137 7.686 7.786 -3.535 1.00 51.13 C ATOM 2141 C HIS A 137 7.954 7.934 -2.041 1.00 32.24 C ATOM 2142 O HIS A 137 8.684 8.830 -1.616 1.00 21.11 O ATOM 2143 CB HIS A 137 6.707 8.865 -3.999 1.00 11.22 C ATOM 2144 CG HIS A 137 6.650 9.023 -5.487 1.00 70.12 C ATOM 2145 ND1 HIS A 137 6.785 7.965 -6.362 1.00 15.33 N ATOM 2146 CD2 HIS A 137 6.470 10.123 -6.255 1.00 10.24 C ATOM 2147 CE1 HIS A 137 6.692 8.408 -7.603 1.00 15.53 C ATOM 2148 NE2 HIS A 137 6.500 9.715 -7.565 1.00 60.24 N ATOM 0 H HIS A 137 6.171 6.446 -4.089 1.00 51.21 H new ATOM 0 HA HIS A 137 8.629 7.907 -4.069 1.00 51.13 H new ATOM 0 HB2 HIS A 137 5.711 8.623 -3.629 1.00 11.22 H new ATOM 0 HB3 HIS A 137 6.990 9.818 -3.551 1.00 11.22 H new ATOM 0 HD2 HIS A 137 6.329 11.134 -5.902 1.00 10.24 H new ATOM 0 HE1 HIS A 137 6.761 7.805 -8.496 1.00 15.53 H new ATOM 0 HE2 HIS A 137 6.392 10.322 -8.378 1.00 60.24 H new ATOM 2156 N HIS A 138 7.358 7.049 -1.247 1.00 53.51 N ATOM 2157 CA HIS A 138 7.532 7.082 0.201 1.00 62.33 C ATOM 2158 C HIS A 138 8.748 6.261 0.620 1.00 71.42 C ATOM 2159 O HIS A 138 9.524 6.678 1.480 1.00 61.54 O ATOM 2160 CB HIS A 138 6.279 6.552 0.899 1.00 62.15 C ATOM 2161 CG HIS A 138 6.175 6.962 2.335 1.00 10.12 C ATOM 2162 ND1 HIS A 138 6.206 6.062 3.379 1.00 31.31 N ATOM 2163 CD2 HIS A 138 6.041 8.185 2.899 1.00 4.32 C ATOM 2164 CE1 HIS A 138 6.094 6.713 4.523 1.00 40.11 C ATOM 2165 NE2 HIS A 138 5.993 8.003 4.259 1.00 2.45 N ATOM 0 H HIS A 138 6.751 6.301 -1.582 1.00 53.51 H new ATOM 0 HA HIS A 138 7.694 8.118 0.500 1.00 62.33 H new ATOM 0 HB2 HIS A 138 5.398 6.906 0.364 1.00 62.15 H new ATOM 0 HB3 HIS A 138 6.273 5.464 0.839 1.00 62.15 H new ATOM 0 HD2 HIS A 138 5.983 9.128 2.377 1.00 4.32 H new ATOM 0 HE1 HIS A 138 6.086 6.266 5.506 1.00 40.11 H new ATOM 0 HE2 HIS A 138 5.895 8.744 4.953 1.00 2.45 H new ATOM 2173 N ARG A 139 8.906 5.092 0.007 1.00 22.23 N ATOM 2174 CA ARG A 139 10.026 4.212 0.318 1.00 20.35 C ATOM 2175 C ARG A 139 11.351 4.961 0.214 1.00 64.52 C ATOM 2176 O ARG A 139 12.015 5.212 1.220 1.00 70.33 O ATOM 2177 CB ARG A 139 10.033 3.007 -0.624 1.00 52.04 C ATOM 2178 CG ARG A 139 9.126 1.874 -0.172 1.00 54.52 C ATOM 2179 CD ARG A 139 8.484 1.168 -1.356 1.00 53.31 C ATOM 2180 NE ARG A 139 7.201 0.565 -1.004 1.00 1.10 N ATOM 2181 CZ ARG A 139 7.085 -0.592 -0.361 1.00 54.43 C ATOM 2182 NH1 ARG A 139 8.168 -1.266 -0.002 1.00 60.11 N ATOM 2183 NH2 ARG A 139 5.882 -1.076 -0.076 1.00 44.53 N ATOM 0 H ARG A 139 8.273 4.733 -0.707 1.00 22.23 H new ATOM 0 HA ARG A 139 9.906 3.862 1.343 1.00 20.35 H new ATOM 0 HB2 ARG A 139 9.726 3.332 -1.618 1.00 52.04 H new ATOM 0 HB3 ARG A 139 11.053 2.632 -0.712 1.00 52.04 H new ATOM 0 HG2 ARG A 139 9.702 1.156 0.412 1.00 54.52 H new ATOM 0 HG3 ARG A 139 8.349 2.268 0.483 1.00 54.52 H new ATOM 0 HD2 ARG A 139 8.339 1.881 -2.168 1.00 53.31 H new ATOM 0 HD3 ARG A 139 9.158 0.396 -1.726 1.00 53.31 H new ATOM 0 HE ARG A 139 6.348 1.059 -1.266 1.00 1.10 H new ATOM 0 HH11 ARG A 139 9.094 -0.897 -0.219 1.00 60.11 H new ATOM 0 HH12 ARG A 139 8.076 -2.154 0.492 1.00 60.11 H new ATOM 0 HH21 ARG A 139 5.046 -0.560 -0.351 1.00 44.53 H new ATOM 0 HH22 ARG A 139 5.793 -1.964 0.418 1.00 44.53 H new ATOM 2197 N SER A 140 11.731 5.314 -1.010 1.00 74.32 N ATOM 2198 CA SER A 140 12.979 6.030 -1.247 1.00 34.10 C ATOM 2199 C SER A 140 12.706 7.464 -1.690 1.00 2.22 C ATOM 2200 O SER A 140 11.876 8.158 -1.105 1.00 31.33 O ATOM 2201 CB SER A 140 13.813 5.307 -2.306 1.00 60.10 C ATOM 2202 OG SER A 140 15.163 5.183 -1.894 1.00 63.12 O ATOM 0 H SER A 140 11.192 5.116 -1.853 1.00 74.32 H new ATOM 0 HA SER A 140 13.538 6.057 -0.311 1.00 34.10 H new ATOM 0 HB2 SER A 140 13.394 4.318 -2.491 1.00 60.10 H new ATOM 0 HB3 SER A 140 13.765 5.855 -3.247 1.00 60.10 H new ATOM 0 HG SER A 140 15.675 4.716 -2.587 1.00 63.12 H new TER 2208 SER A 140