USER MOD reduce.3.24.130724 H: found=0, std=0, add=595, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 164 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 Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc=0.000319 USER MOD Single : A 16 LYS NZ :NH3+ 167:sc= -0.0212 (180deg=-0.229) USER MOD Single : A 18 GLN : amide:sc= -0.0401 X(o=-0.04,f=-0.45) USER MOD Single : A 20 LYS NZ :NH3+ 131:sc= 1.26 (180deg=0.758) USER MOD Single : A 26 TYR OH : rot 180:sc= 0.943 USER MOD Single : A 28 THR OG1 : rot 65:sc= 0.972 USER MOD Single : A 29 ASN : amide:sc=-0.00448 K(o=-0.0045,f=-1.2) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot -179:sc= -0.0359 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 163:sc= 1.13 (180deg=0.489) USER MOD Single : A 41 SER OG : rot -70:sc= 1.1 USER MOD Single : A 43 THR OG1 : rot 74:sc= 1.27 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.035 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -0.261 X(o=-0.26,f=-0.55) USER MOD Single : A 52 THR OG1 : rot 71:sc= 1.45 USER MOD Single : A 56 GLN : amide:sc= -0.66 K(o=-0.66,f=-2.7) USER MOD Single : A 57 ASN : amide:sc= -0.25 K(o=-0.25,f=-1.9!) USER MOD Single : A 61 LYS NZ :NH3+ -170:sc=-0.00827 (180deg=-0.117) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -0.517 K(o=-0.52,f=-6.3!) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ -148:sc= 0.0375 (180deg=-0.173) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot -44:sc= 0.68 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 36 N LYS A 10 -9.235 -7.819 8.718 1.00 10.00 N ATOM 37 CA LYS A 10 -10.451 -7.598 7.952 1.00 10.00 C ATOM 38 C LYS A 10 -10.273 -8.076 6.518 1.00 10.00 C ATOM 39 O LYS A 10 -10.390 -9.271 6.241 1.00 10.00 O ATOM 40 CB LYS A 10 -10.869 -6.126 8.002 1.00 10.00 C ATOM 41 CG LYS A 10 -10.802 -5.504 9.390 1.00 10.00 C ATOM 42 CD LYS A 10 -11.664 -6.252 10.399 1.00 10.00 C ATOM 43 CE LYS A 10 -13.122 -5.822 10.335 1.00 10.00 C ATOM 44 NZ LYS A 10 -13.885 -6.287 11.526 1.00 10.00 N ATOM 0 HA LYS A 10 -11.253 -8.182 8.403 1.00 10.00 H new ATOM 0 HB2 LYS A 10 -10.229 -5.555 7.329 1.00 10.00 H new ATOM 0 HB3 LYS A 10 -11.888 -6.036 7.625 1.00 10.00 H new ATOM 0 HG2 LYS A 10 -9.768 -5.497 9.733 1.00 10.00 H new ATOM 0 HG3 LYS A 10 -11.127 -4.465 9.337 1.00 10.00 H new ATOM 0 HD2 LYS A 10 -11.594 -7.323 10.212 1.00 10.00 H new ATOM 0 HD3 LYS A 10 -11.279 -6.078 11.404 1.00 10.00 H new ATOM 0 HE2 LYS A 10 -13.179 -4.736 10.268 1.00 10.00 H new ATOM 0 HE3 LYS A 10 -13.580 -6.222 9.430 1.00 10.00 H new ATOM 0 HZ1 LYS A 10 -14.874 -5.976 11.448 1.00 10.00 H new ATOM 0 HZ2 LYS A 10 -13.852 -7.325 11.576 1.00 10.00 H new ATOM 0 HZ3 LYS A 10 -13.463 -5.885 12.387 1.00 10.00 H new ATOM 49 N ARG A 11 -9.953 -7.153 5.621 1.00 10.00 N ATOM 50 CA ARG A 11 -9.759 -7.486 4.218 1.00 10.00 C ATOM 51 C ARG A 11 -8.503 -8.332 4.034 1.00 10.00 C ATOM 52 O ARG A 11 -7.515 -8.161 4.749 1.00 10.00 O ATOM 53 CB ARG A 11 -9.668 -6.213 3.374 1.00 10.00 C ATOM 54 CG ARG A 11 -9.869 -6.436 1.884 1.00 10.00 C ATOM 55 CD ARG A 11 -9.733 -5.140 1.107 1.00 10.00 C ATOM 56 NE ARG A 11 -10.165 -5.282 -0.285 1.00 10.00 N ATOM 57 CZ ARG A 11 -9.555 -4.699 -1.323 1.00 10.00 C ATOM 58 NH1 ARG A 11 -8.511 -3.896 -1.124 1.00 10.00 N ATOM 59 NH2 ARG A 11 -10.003 -4.902 -2.557 1.00 10.00 N ATOM 0 H ARG A 11 -9.822 -6.166 5.842 1.00 10.00 H new ATOM 0 HA ARG A 11 -10.619 -8.067 3.883 1.00 10.00 H new ATOM 0 HB2 ARG A 11 -10.415 -5.502 3.727 1.00 10.00 H new ATOM 0 HB3 ARG A 11 -8.692 -5.755 3.533 1.00 10.00 H new ATOM 0 HG2 ARG A 11 -9.138 -7.158 1.521 1.00 10.00 H new ATOM 0 HG3 ARG A 11 -10.855 -6.865 1.709 1.00 10.00 H new ATOM 0 HD2 ARG A 11 -10.325 -4.364 1.592 1.00 10.00 H new ATOM 0 HD3 ARG A 11 -8.694 -4.811 1.132 1.00 10.00 H new ATOM 0 HE ARG A 11 -10.982 -5.862 -0.475 1.00 10.00 H new ATOM 0 HH11 ARG A 11 -8.174 -3.723 -0.177 1.00 10.00 H new ATOM 0 HH12 ARG A 11 -8.049 -3.454 -1.919 1.00 10.00 H new ATOM 0 HH21 ARG A 11 -10.812 -5.503 -2.713 1.00 10.00 H new ATOM 0 HH22 ARG A 11 -9.538 -4.457 -3.348 1.00 10.00 H new ATOM 66 N VAL A 12 -8.550 -9.254 3.087 1.00 10.00 N ATOM 67 CA VAL A 12 -7.412 -10.121 2.816 1.00 10.00 C ATOM 68 C VAL A 12 -6.407 -9.427 1.901 1.00 10.00 C ATOM 69 O VAL A 12 -6.792 -8.738 0.955 1.00 10.00 O ATOM 70 CB VAL A 12 -7.841 -11.469 2.196 1.00 10.00 C ATOM 71 CG1 VAL A 12 -8.609 -12.301 3.212 1.00 10.00 C ATOM 72 CG2 VAL A 12 -8.674 -11.254 0.941 1.00 10.00 C ATOM 0 H VAL A 12 -9.362 -9.423 2.493 1.00 10.00 H new ATOM 0 HA VAL A 12 -6.940 -10.330 3.776 1.00 10.00 H new ATOM 0 HB VAL A 12 -6.940 -12.012 1.912 1.00 10.00 H new ATOM 0 HG11 VAL A 12 -8.904 -13.247 2.759 1.00 10.00 H new ATOM 0 HG12 VAL A 12 -7.975 -12.495 4.077 1.00 10.00 H new ATOM 0 HG13 VAL A 12 -9.499 -11.758 3.529 1.00 10.00 H new ATOM 0 HG21 VAL A 12 -8.962 -12.220 0.526 1.00 10.00 H new ATOM 0 HG22 VAL A 12 -9.569 -10.685 1.192 1.00 10.00 H new ATOM 0 HG23 VAL A 12 -8.088 -10.703 0.205 1.00 10.00 H new ATOM 74 N PRO A 13 -5.109 -9.575 2.192 1.00 10.00 N ATOM 75 CA PRO A 13 -4.047 -8.967 1.395 1.00 10.00 C ATOM 76 C PRO A 13 -3.661 -9.838 0.198 1.00 10.00 C ATOM 77 O PRO A 13 -4.245 -10.905 -0.024 1.00 10.00 O ATOM 78 CB PRO A 13 -2.891 -8.900 2.388 1.00 10.00 C ATOM 79 CG PRO A 13 -3.088 -10.091 3.266 1.00 10.00 C ATOM 80 CD PRO A 13 -4.574 -10.334 3.335 1.00 10.00 C ATOM 0 HA PRO A 13 -4.336 -8.005 0.972 1.00 10.00 H new ATOM 0 HB2 PRO A 13 -1.928 -8.936 1.880 1.00 10.00 H new ATOM 0 HB3 PRO A 13 -2.914 -7.974 2.963 1.00 10.00 H new ATOM 0 HG2 PRO A 13 -2.572 -10.961 2.860 1.00 10.00 H new ATOM 0 HG3 PRO A 13 -2.678 -9.912 4.260 1.00 10.00 H new ATOM 0 HD2 PRO A 13 -4.810 -11.395 3.256 1.00 10.00 H new ATOM 0 HD3 PRO A 13 -4.993 -9.984 4.279 1.00 10.00 H new ATOM 81 N TYR A 14 -2.683 -9.375 -0.572 1.00 10.00 N ATOM 82 CA TYR A 14 -2.209 -10.104 -1.741 1.00 10.00 C ATOM 83 C TYR A 14 -1.248 -11.229 -1.347 1.00 10.00 C ATOM 84 O TYR A 14 -1.391 -11.846 -0.287 1.00 10.00 O ATOM 85 CB TYR A 14 -1.531 -9.147 -2.730 1.00 10.00 C ATOM 86 CG TYR A 14 -2.400 -8.737 -3.905 1.00 10.00 C ATOM 87 CD1 TYR A 14 -3.594 -8.056 -3.709 1.00 10.00 C ATOM 88 CD2 TYR A 14 -2.016 -9.020 -5.213 1.00 10.00 C ATOM 89 CE1 TYR A 14 -4.380 -7.664 -4.777 1.00 10.00 C ATOM 90 CE2 TYR A 14 -2.799 -8.634 -6.285 1.00 10.00 C ATOM 91 CZ TYR A 14 -3.978 -7.955 -6.062 1.00 10.00 C ATOM 92 OH TYR A 14 -4.753 -7.556 -7.128 1.00 10.00 O ATOM 0 H TYR A 14 -2.200 -8.492 -0.405 1.00 10.00 H new ATOM 0 HA TYR A 14 -3.075 -10.557 -2.224 1.00 10.00 H new ATOM 0 HB2 TYR A 14 -1.221 -8.250 -2.194 1.00 10.00 H new ATOM 0 HB3 TYR A 14 -0.626 -9.620 -3.111 1.00 10.00 H new ATOM 0 HD1 TYR A 14 -3.915 -7.828 -2.703 1.00 10.00 H new ATOM 0 HD2 TYR A 14 -1.092 -9.549 -5.393 1.00 10.00 H new ATOM 0 HE1 TYR A 14 -5.304 -7.132 -4.605 1.00 10.00 H new ATOM 0 HE2 TYR A 14 -2.488 -8.864 -7.294 1.00 10.00 H new ATOM 0 HH TYR A 14 -4.328 -7.838 -7.965 1.00 10.00 H new ATOM 95 N THR A 15 -0.272 -11.489 -2.205 1.00 10.00 N ATOM 96 CA THR A 15 0.712 -12.536 -1.966 1.00 10.00 C ATOM 97 C THR A 15 1.637 -12.162 -0.805 1.00 10.00 C ATOM 98 O THR A 15 2.296 -11.125 -0.837 1.00 10.00 O ATOM 99 CB THR A 15 1.540 -12.787 -3.241 1.00 10.00 C ATOM 100 OG1 THR A 15 0.651 -12.804 -4.365 1.00 10.00 O ATOM 101 CG2 THR A 15 2.265 -14.120 -3.163 1.00 10.00 C ATOM 0 H THR A 15 -0.140 -10.984 -3.081 1.00 10.00 H new ATOM 0 HA THR A 15 0.180 -13.449 -1.700 1.00 10.00 H new ATOM 0 HB THR A 15 2.282 -11.995 -3.344 1.00 10.00 H new ATOM 0 HG1 THR A 15 1.164 -12.961 -5.185 1.00 10.00 H new ATOM 0 HG21 THR A 15 2.842 -14.274 -4.075 1.00 10.00 H new ATOM 0 HG22 THR A 15 2.936 -14.119 -2.304 1.00 10.00 H new ATOM 0 HG23 THR A 15 1.537 -14.924 -3.054 1.00 10.00 H new ATOM 104 N LYS A 16 1.688 -13.019 0.209 1.00 10.00 N ATOM 105 CA LYS A 16 2.518 -12.776 1.392 1.00 10.00 C ATOM 106 C LYS A 16 4.000 -12.625 1.051 1.00 10.00 C ATOM 107 O LYS A 16 4.709 -11.840 1.680 1.00 10.00 O ATOM 108 CB LYS A 16 2.311 -13.864 2.450 1.00 10.00 C ATOM 109 CG LYS A 16 2.612 -15.275 1.968 1.00 10.00 C ATOM 110 CD LYS A 16 2.207 -16.320 2.997 1.00 10.00 C ATOM 111 CE LYS A 16 0.699 -16.350 3.209 1.00 10.00 C ATOM 112 NZ LYS A 16 -0.040 -16.707 1.967 1.00 10.00 N ATOM 0 H LYS A 16 1.163 -13.893 0.239 1.00 10.00 H new ATOM 0 HA LYS A 16 2.189 -11.824 1.808 1.00 10.00 H new ATOM 0 HB2 LYS A 16 2.945 -13.644 3.309 1.00 10.00 H new ATOM 0 HB3 LYS A 16 1.279 -13.824 2.797 1.00 10.00 H new ATOM 0 HG2 LYS A 16 2.083 -15.461 1.033 1.00 10.00 H new ATOM 0 HG3 LYS A 16 3.677 -15.367 1.755 1.00 10.00 H new ATOM 0 HD2 LYS A 16 2.548 -17.303 2.671 1.00 10.00 H new ATOM 0 HD3 LYS A 16 2.703 -16.109 3.944 1.00 10.00 H new ATOM 0 HE2 LYS A 16 0.459 -17.070 3.991 1.00 10.00 H new ATOM 0 HE3 LYS A 16 0.364 -15.374 3.560 1.00 10.00 H new ATOM 0 HZ1 LYS A 16 -1.028 -16.930 2.203 1.00 10.00 H new ATOM 0 HZ2 LYS A 16 -0.014 -15.905 1.305 1.00 10.00 H new ATOM 0 HZ3 LYS A 16 0.406 -17.536 1.524 1.00 10.00 H new ATOM 117 N VAL A 17 4.462 -13.361 0.042 1.00 10.00 N ATOM 118 CA VAL A 17 5.866 -13.298 -0.360 1.00 10.00 C ATOM 119 C VAL A 17 6.209 -11.940 -0.972 1.00 10.00 C ATOM 120 O VAL A 17 7.372 -11.536 -1.007 1.00 10.00 O ATOM 121 CB VAL A 17 6.261 -14.441 -1.326 1.00 10.00 C ATOM 122 CG1 VAL A 17 5.754 -15.779 -0.809 1.00 10.00 C ATOM 123 CG2 VAL A 17 5.759 -14.179 -2.740 1.00 10.00 C ATOM 0 H VAL A 17 3.891 -14.003 -0.508 1.00 10.00 H new ATOM 0 HA VAL A 17 6.450 -13.428 0.551 1.00 10.00 H new ATOM 0 HB VAL A 17 7.350 -14.478 -1.368 1.00 10.00 H new ATOM 0 HG11 VAL A 17 6.042 -16.570 -1.502 1.00 10.00 H new ATOM 0 HG12 VAL A 17 6.189 -15.979 0.170 1.00 10.00 H new ATOM 0 HG13 VAL A 17 4.668 -15.748 -0.724 1.00 10.00 H new ATOM 0 HG21 VAL A 17 6.055 -15.003 -3.390 1.00 10.00 H new ATOM 0 HG22 VAL A 17 4.672 -14.097 -2.731 1.00 10.00 H new ATOM 0 HG23 VAL A 17 6.190 -13.250 -3.113 1.00 10.00 H new ATOM 125 N GLN A 18 5.184 -11.233 -1.432 1.00 10.00 N ATOM 126 CA GLN A 18 5.363 -9.924 -2.035 1.00 10.00 C ATOM 127 C GLN A 18 5.669 -8.890 -0.961 1.00 10.00 C ATOM 128 O GLN A 18 6.656 -8.163 -1.051 1.00 10.00 O ATOM 129 CB GLN A 18 4.105 -9.532 -2.810 1.00 10.00 C ATOM 130 CG GLN A 18 4.206 -8.209 -3.546 1.00 10.00 C ATOM 131 CD GLN A 18 2.993 -7.937 -4.408 1.00 10.00 C ATOM 132 OE1 GLN A 18 1.884 -8.375 -4.102 1.00 10.00 O ATOM 133 NE2 GLN A 18 3.198 -7.214 -5.494 1.00 10.00 N ATOM 0 H GLN A 18 4.215 -11.550 -1.397 1.00 10.00 H new ATOM 0 HA GLN A 18 6.204 -9.963 -2.728 1.00 10.00 H new ATOM 0 HB2 GLN A 18 3.878 -10.318 -3.531 1.00 10.00 H new ATOM 0 HB3 GLN A 18 3.266 -9.484 -2.116 1.00 10.00 H new ATOM 0 HG2 GLN A 18 4.323 -7.402 -2.823 1.00 10.00 H new ATOM 0 HG3 GLN A 18 5.100 -8.210 -4.170 1.00 10.00 H new ATOM 0 HE21 GLN A 18 4.134 -6.871 -5.709 1.00 10.00 H new ATOM 0 HE22 GLN A 18 2.420 -6.998 -6.118 1.00 10.00 H new ATOM 137 N LEU A 19 4.825 -8.852 0.065 1.00 10.00 N ATOM 138 CA LEU A 19 4.997 -7.917 1.170 1.00 10.00 C ATOM 139 C LEU A 19 6.284 -8.219 1.928 1.00 10.00 C ATOM 140 O LEU A 19 6.967 -7.309 2.397 1.00 10.00 O ATOM 141 CB LEU A 19 3.792 -7.958 2.120 1.00 10.00 C ATOM 142 CG LEU A 19 2.535 -7.197 1.678 1.00 10.00 C ATOM 143 CD1 LEU A 19 2.881 -5.783 1.231 1.00 10.00 C ATOM 144 CD2 LEU A 19 1.784 -7.948 0.586 1.00 10.00 C ATOM 0 H LEU A 19 4.012 -9.461 0.154 1.00 10.00 H new ATOM 0 HA LEU A 19 5.065 -6.912 0.754 1.00 10.00 H new ATOM 0 HB2 LEU A 19 3.519 -9.001 2.278 1.00 10.00 H new ATOM 0 HB3 LEU A 19 4.107 -7.562 3.085 1.00 10.00 H new ATOM 0 HG LEU A 19 1.874 -7.125 2.541 1.00 10.00 H new ATOM 0 HD11 LEU A 19 1.972 -5.266 0.923 1.00 10.00 H new ATOM 0 HD12 LEU A 19 3.343 -5.243 2.057 1.00 10.00 H new ATOM 0 HD13 LEU A 19 3.576 -5.826 0.392 1.00 10.00 H new ATOM 0 HD21 LEU A 19 0.899 -7.381 0.297 1.00 10.00 H new ATOM 0 HD22 LEU A 19 2.433 -8.075 -0.280 1.00 10.00 H new ATOM 0 HD23 LEU A 19 1.482 -8.926 0.959 1.00 10.00 H new ATOM 146 N LYS A 20 6.610 -9.508 2.030 1.00 10.00 N ATOM 147 CA LYS A 20 7.820 -9.960 2.711 1.00 10.00 C ATOM 148 C LYS A 20 9.064 -9.317 2.101 1.00 10.00 C ATOM 149 O LYS A 20 9.928 -8.802 2.818 1.00 10.00 O ATOM 150 CB LYS A 20 7.920 -11.488 2.623 1.00 10.00 C ATOM 151 CG LYS A 20 9.227 -12.075 3.130 1.00 10.00 C ATOM 152 CD LYS A 20 9.264 -13.580 2.922 1.00 10.00 C ATOM 153 CE LYS A 20 10.596 -14.159 3.367 1.00 10.00 C ATOM 154 NZ LYS A 20 11.666 -13.934 2.362 1.00 10.00 N ATOM 0 H LYS A 20 6.044 -10.264 1.644 1.00 10.00 H new ATOM 0 HA LYS A 20 7.762 -9.659 3.757 1.00 10.00 H new ATOM 0 HB2 LYS A 20 7.098 -11.924 3.191 1.00 10.00 H new ATOM 0 HB3 LYS A 20 7.783 -11.787 1.584 1.00 10.00 H new ATOM 0 HG2 LYS A 20 10.065 -11.611 2.609 1.00 10.00 H new ATOM 0 HG3 LYS A 20 9.345 -11.847 4.189 1.00 10.00 H new ATOM 0 HD2 LYS A 20 8.455 -14.048 3.482 1.00 10.00 H new ATOM 0 HD3 LYS A 20 9.097 -13.809 1.870 1.00 10.00 H new ATOM 0 HE2 LYS A 20 10.889 -13.707 4.315 1.00 10.00 H new ATOM 0 HE3 LYS A 20 10.485 -15.229 3.544 1.00 10.00 H new ATOM 0 HZ1 LYS A 20 12.507 -13.543 2.832 1.00 10.00 H new ATOM 0 HZ2 LYS A 20 11.911 -14.837 1.908 1.00 10.00 H new ATOM 0 HZ3 LYS A 20 11.330 -13.264 1.641 1.00 10.00 H new ATOM 159 N GLU A 21 9.138 -9.338 0.780 1.00 10.00 N ATOM 160 CA GLU A 21 10.265 -8.757 0.070 1.00 10.00 C ATOM 161 C GLU A 21 10.121 -7.242 -0.031 1.00 10.00 C ATOM 162 O GLU A 21 11.113 -6.514 0.007 1.00 10.00 O ATOM 163 CB GLU A 21 10.425 -9.390 -1.311 1.00 10.00 C ATOM 164 CG GLU A 21 10.686 -10.889 -1.268 1.00 10.00 C ATOM 165 CD GLU A 21 11.808 -11.255 -0.317 1.00 10.00 C ATOM 166 OE1 GLU A 21 12.981 -10.973 -0.640 1.00 10.00 O ATOM 167 OE2 GLU A 21 11.531 -11.834 0.751 1.00 10.00 O ATOM 0 H GLU A 21 8.428 -9.753 0.176 1.00 10.00 H new ATOM 0 HA GLU A 21 11.170 -8.969 0.640 1.00 10.00 H new ATOM 0 HB2 GLU A 21 9.523 -9.203 -1.894 1.00 10.00 H new ATOM 0 HB3 GLU A 21 11.248 -8.901 -1.832 1.00 10.00 H new ATOM 0 HG2 GLU A 21 9.775 -11.405 -0.965 1.00 10.00 H new ATOM 0 HG3 GLU A 21 10.934 -11.240 -2.270 1.00 10.00 H new ATOM 169 N LEU A 22 8.881 -6.774 -0.137 1.00 10.00 N ATOM 170 CA LEU A 22 8.599 -5.346 -0.231 1.00 10.00 C ATOM 171 C LEU A 22 9.139 -4.617 0.999 1.00 10.00 C ATOM 172 O LEU A 22 9.785 -3.577 0.886 1.00 10.00 O ATOM 173 CB LEU A 22 7.089 -5.106 -0.368 1.00 10.00 C ATOM 174 CG LEU A 22 6.646 -4.126 -1.460 1.00 10.00 C ATOM 175 CD1 LEU A 22 7.074 -2.704 -1.126 1.00 10.00 C ATOM 176 CD2 LEU A 22 7.180 -4.550 -2.821 1.00 10.00 C ATOM 0 H LEU A 22 8.051 -7.367 -0.160 1.00 10.00 H new ATOM 0 HA LEU A 22 9.096 -4.953 -1.118 1.00 10.00 H new ATOM 0 HB2 LEU A 22 6.607 -6.066 -0.556 1.00 10.00 H new ATOM 0 HB3 LEU A 22 6.714 -4.743 0.589 1.00 10.00 H new ATOM 0 HG LEU A 22 5.557 -4.145 -1.505 1.00 10.00 H new ATOM 0 HD11 LEU A 22 6.747 -2.030 -1.918 1.00 10.00 H new ATOM 0 HD12 LEU A 22 6.623 -2.401 -0.181 1.00 10.00 H new ATOM 0 HD13 LEU A 22 8.160 -2.662 -1.039 1.00 10.00 H new ATOM 0 HD21 LEU A 22 6.852 -3.838 -3.578 1.00 10.00 H new ATOM 0 HD22 LEU A 22 8.269 -4.574 -2.793 1.00 10.00 H new ATOM 0 HD23 LEU A 22 6.802 -5.542 -3.067 1.00 10.00 H new ATOM 178 N GLU A 23 8.873 -5.180 2.174 1.00 10.00 N ATOM 179 CA GLU A 23 9.342 -4.596 3.425 1.00 10.00 C ATOM 180 C GLU A 23 10.861 -4.679 3.528 1.00 10.00 C ATOM 181 O GLU A 23 11.495 -3.838 4.159 1.00 10.00 O ATOM 182 CB GLU A 23 8.689 -5.279 4.628 1.00 10.00 C ATOM 183 CG GLU A 23 7.197 -5.019 4.751 1.00 10.00 C ATOM 184 CD GLU A 23 6.649 -5.389 6.114 1.00 10.00 C ATOM 185 OE1 GLU A 23 6.713 -4.547 7.035 1.00 10.00 O ATOM 186 OE2 GLU A 23 6.147 -6.516 6.272 1.00 10.00 O ATOM 0 H GLU A 23 8.335 -6.040 2.285 1.00 10.00 H new ATOM 0 HA GLU A 23 9.053 -3.545 3.430 1.00 10.00 H new ATOM 0 HB2 GLU A 23 8.856 -6.354 4.557 1.00 10.00 H new ATOM 0 HB3 GLU A 23 9.183 -4.939 5.538 1.00 10.00 H new ATOM 0 HG2 GLU A 23 6.999 -3.965 4.559 1.00 10.00 H new ATOM 0 HG3 GLU A 23 6.669 -5.587 3.985 1.00 10.00 H new ATOM 188 N ARG A 24 11.435 -5.695 2.897 1.00 10.00 N ATOM 189 CA ARG A 24 12.878 -5.886 2.912 1.00 10.00 C ATOM 190 C ARG A 24 13.566 -4.782 2.117 1.00 10.00 C ATOM 191 O ARG A 24 14.511 -4.155 2.596 1.00 10.00 O ATOM 192 CB ARG A 24 13.246 -7.259 2.347 1.00 10.00 C ATOM 193 CG ARG A 24 14.139 -8.084 3.260 1.00 10.00 C ATOM 194 CD ARG A 24 13.414 -9.317 3.785 1.00 10.00 C ATOM 195 NE ARG A 24 12.168 -8.984 4.479 1.00 10.00 N ATOM 196 CZ ARG A 24 12.092 -8.678 5.774 1.00 10.00 C ATOM 197 NH1 ARG A 24 13.189 -8.646 6.523 1.00 10.00 N ATOM 198 NH2 ARG A 24 10.915 -8.408 6.326 1.00 10.00 N ATOM 0 H ARG A 24 10.922 -6.400 2.368 1.00 10.00 H new ATOM 0 HA ARG A 24 13.221 -5.838 3.945 1.00 10.00 H new ATOM 0 HB2 ARG A 24 12.330 -7.817 2.150 1.00 10.00 H new ATOM 0 HB3 ARG A 24 13.749 -7.124 1.389 1.00 10.00 H new ATOM 0 HG2 ARG A 24 15.033 -8.390 2.717 1.00 10.00 H new ATOM 0 HG3 ARG A 24 14.470 -7.471 4.098 1.00 10.00 H new ATOM 0 HD2 ARG A 24 13.195 -9.987 2.953 1.00 10.00 H new ATOM 0 HD3 ARG A 24 14.071 -9.858 4.465 1.00 10.00 H new ATOM 0 HE ARG A 24 11.304 -8.986 3.937 1.00 10.00 H new ATOM 0 HH11 ARG A 24 14.096 -8.856 6.108 1.00 10.00 H new ATOM 0 HH12 ARG A 24 13.124 -8.411 7.513 1.00 10.00 H new ATOM 0 HH21 ARG A 24 10.068 -8.435 5.759 1.00 10.00 H new ATOM 0 HH22 ARG A 24 10.858 -8.174 7.317 1.00 10.00 H new ATOM 205 N GLU A 25 13.077 -4.541 0.905 1.00 10.00 N ATOM 206 CA GLU A 25 13.635 -3.501 0.048 1.00 10.00 C ATOM 207 C GLU A 25 13.409 -2.123 0.670 1.00 10.00 C ATOM 208 O GLU A 25 14.262 -1.236 0.581 1.00 10.00 O ATOM 209 CB GLU A 25 13.013 -3.568 -1.349 1.00 10.00 C ATOM 210 CG GLU A 25 13.215 -4.903 -2.056 1.00 10.00 C ATOM 211 CD GLU A 25 14.633 -5.114 -2.557 1.00 10.00 C ATOM 212 OE1 GLU A 25 15.537 -4.350 -2.156 1.00 10.00 O ATOM 213 OE2 GLU A 25 14.856 -6.055 -3.352 1.00 10.00 O ATOM 0 H GLU A 25 12.296 -5.052 0.494 1.00 10.00 H new ATOM 0 HA GLU A 25 14.708 -3.667 -0.046 1.00 10.00 H new ATOM 0 HB2 GLU A 25 11.944 -3.369 -1.269 1.00 10.00 H new ATOM 0 HB3 GLU A 25 13.440 -2.775 -1.964 1.00 10.00 H new ATOM 0 HG2 GLU A 25 12.956 -5.711 -1.371 1.00 10.00 H new ATOM 0 HG3 GLU A 25 12.527 -4.967 -2.899 1.00 10.00 H new ATOM 215 N TYR A 26 12.252 -1.959 1.308 1.00 10.00 N ATOM 216 CA TYR A 26 11.900 -0.706 1.968 1.00 10.00 C ATOM 217 C TYR A 26 12.847 -0.435 3.134 1.00 10.00 C ATOM 218 O TYR A 26 13.310 0.686 3.323 1.00 10.00 O ATOM 219 CB TYR A 26 10.449 -0.765 2.462 1.00 10.00 C ATOM 220 CG TYR A 26 10.025 0.382 3.360 1.00 10.00 C ATOM 221 CD1 TYR A 26 9.590 1.591 2.827 1.00 10.00 C ATOM 222 CD2 TYR A 26 10.043 0.247 4.745 1.00 10.00 C ATOM 223 CE1 TYR A 26 9.190 2.632 3.649 1.00 10.00 C ATOM 224 CE2 TYR A 26 9.645 1.282 5.570 1.00 10.00 C ATOM 225 CZ TYR A 26 9.220 2.472 5.020 1.00 10.00 C ATOM 226 OH TYR A 26 8.815 3.501 5.844 1.00 10.00 O ATOM 0 H TYR A 26 11.539 -2.684 1.381 1.00 10.00 H new ATOM 0 HA TYR A 26 11.995 0.109 1.250 1.00 10.00 H new ATOM 0 HB2 TYR A 26 9.788 -0.791 1.596 1.00 10.00 H new ATOM 0 HB3 TYR A 26 10.304 -1.701 3.002 1.00 10.00 H new ATOM 0 HD1 TYR A 26 9.564 1.720 1.755 1.00 10.00 H new ATOM 0 HD2 TYR A 26 10.374 -0.683 5.183 1.00 10.00 H new ATOM 0 HE1 TYR A 26 8.856 3.565 3.219 1.00 10.00 H new ATOM 0 HE2 TYR A 26 9.667 1.159 6.643 1.00 10.00 H new ATOM 0 HH TYR A 26 8.898 3.223 6.780 1.00 10.00 H new ATOM 229 N ALA A 27 13.150 -1.483 3.896 1.00 10.00 N ATOM 230 CA ALA A 27 14.044 -1.369 5.043 1.00 10.00 C ATOM 231 C ALA A 27 15.468 -1.066 4.596 1.00 10.00 C ATOM 232 O ALA A 27 16.285 -0.568 5.371 1.00 10.00 O ATOM 233 CB ALA A 27 14.011 -2.643 5.871 1.00 10.00 C ATOM 0 H ALA A 27 12.788 -2.423 3.738 1.00 10.00 H new ATOM 0 HA ALA A 27 13.697 -0.541 5.661 1.00 10.00 H new ATOM 0 HB1 ALA A 27 14.684 -2.541 6.723 1.00 10.00 H new ATOM 0 HB2 ALA A 27 12.996 -2.818 6.229 1.00 10.00 H new ATOM 0 HB3 ALA A 27 14.329 -3.485 5.256 1.00 10.00 H new ATOM 235 N THR A 28 15.756 -1.366 3.339 1.00 10.00 N ATOM 236 CA THR A 28 17.071 -1.122 2.779 1.00 10.00 C ATOM 237 C THR A 28 17.298 0.377 2.558 1.00 10.00 C ATOM 238 O THR A 28 18.434 0.853 2.594 1.00 10.00 O ATOM 239 CB THR A 28 17.255 -1.902 1.460 1.00 10.00 C ATOM 240 OG1 THR A 28 17.034 -3.299 1.710 1.00 10.00 O ATOM 241 CG2 THR A 28 18.655 -1.715 0.895 1.00 10.00 C ATOM 0 H THR A 28 15.091 -1.781 2.686 1.00 10.00 H new ATOM 0 HA THR A 28 17.815 -1.477 3.492 1.00 10.00 H new ATOM 0 HB THR A 28 16.539 -1.521 0.732 1.00 10.00 H new ATOM 0 HG1 THR A 28 16.099 -3.442 1.966 1.00 10.00 H new ATOM 0 HG21 THR A 28 18.751 -2.278 -0.034 1.00 10.00 H new ATOM 0 HG22 THR A 28 18.830 -0.657 0.698 1.00 10.00 H new ATOM 0 HG23 THR A 28 19.389 -2.076 1.615 1.00 10.00 H new ATOM 244 N ASN A 29 16.210 1.119 2.363 1.00 10.00 N ATOM 245 CA ASN A 29 16.289 2.564 2.142 1.00 10.00 C ATOM 246 C ASN A 29 14.902 3.195 2.172 1.00 10.00 C ATOM 247 O ASN A 29 14.522 3.830 3.152 1.00 10.00 O ATOM 248 CB ASN A 29 16.989 2.880 0.808 1.00 10.00 C ATOM 249 CG ASN A 29 16.960 4.356 0.447 1.00 10.00 C ATOM 250 OD1 ASN A 29 16.086 4.814 -0.295 1.00 10.00 O ATOM 251 ND2 ASN A 29 17.923 5.107 0.961 1.00 10.00 N ATOM 0 H ASN A 29 15.261 0.744 2.353 1.00 10.00 H new ATOM 0 HA ASN A 29 16.881 2.992 2.951 1.00 10.00 H new ATOM 0 HB2 ASN A 29 18.025 2.547 0.862 1.00 10.00 H new ATOM 0 HB3 ASN A 29 16.512 2.309 0.011 1.00 10.00 H new ATOM 0 HD21 ASN A 29 17.961 6.104 0.748 1.00 10.00 H new ATOM 0 HD22 ASN A 29 18.626 4.688 1.570 1.00 10.00 H new ATOM 255 N LYS A 30 14.151 2.988 1.094 1.00 10.00 N ATOM 256 CA LYS A 30 12.802 3.522 0.940 1.00 10.00 C ATOM 257 C LYS A 30 12.279 3.093 -0.419 1.00 10.00 C ATOM 258 O LYS A 30 11.233 2.461 -0.532 1.00 10.00 O ATOM 259 CB LYS A 30 12.804 5.057 1.035 1.00 10.00 C ATOM 260 CG LYS A 30 11.486 5.723 0.650 1.00 10.00 C ATOM 261 CD LYS A 30 11.511 7.220 0.927 1.00 10.00 C ATOM 262 CE LYS A 30 12.609 7.922 0.143 1.00 10.00 C ATOM 263 NZ LYS A 30 12.314 7.982 -1.315 1.00 10.00 N ATOM 0 H LYS A 30 14.466 2.439 0.294 1.00 10.00 H new ATOM 0 HA LYS A 30 12.165 3.139 1.737 1.00 10.00 H new ATOM 0 HB2 LYS A 30 13.055 5.344 2.056 1.00 10.00 H new ATOM 0 HB3 LYS A 30 13.593 5.446 0.392 1.00 10.00 H new ATOM 0 HG2 LYS A 30 11.287 5.552 -0.408 1.00 10.00 H new ATOM 0 HG3 LYS A 30 10.669 5.263 1.207 1.00 10.00 H new ATOM 0 HD2 LYS A 30 10.545 7.654 0.668 1.00 10.00 H new ATOM 0 HD3 LYS A 30 11.661 7.390 1.993 1.00 10.00 H new ATOM 0 HE2 LYS A 30 12.736 8.934 0.527 1.00 10.00 H new ATOM 0 HE3 LYS A 30 13.553 7.401 0.299 1.00 10.00 H new ATOM 0 HZ1 LYS A 30 13.090 8.469 -1.807 1.00 10.00 H new ATOM 0 HZ2 LYS A 30 12.218 7.017 -1.690 1.00 10.00 H new ATOM 0 HZ3 LYS A 30 11.427 8.502 -1.469 1.00 10.00 H new ATOM 268 N PHE A 31 13.042 3.427 -1.448 1.00 10.00 N ATOM 269 CA PHE A 31 12.691 3.077 -2.808 1.00 10.00 C ATOM 270 C PHE A 31 13.946 2.635 -3.545 1.00 10.00 C ATOM 271 O PHE A 31 14.958 3.336 -3.535 1.00 10.00 O ATOM 272 CB PHE A 31 12.042 4.268 -3.521 1.00 10.00 C ATOM 273 CG PHE A 31 11.512 3.941 -4.888 1.00 10.00 C ATOM 274 CD1 PHE A 31 10.585 2.926 -5.061 1.00 10.00 C ATOM 275 CD2 PHE A 31 11.944 4.643 -6.001 1.00 10.00 C ATOM 276 CE1 PHE A 31 10.098 2.621 -6.316 1.00 10.00 C ATOM 277 CE2 PHE A 31 11.463 4.342 -7.259 1.00 10.00 C ATOM 278 CZ PHE A 31 10.539 3.329 -7.416 1.00 10.00 C ATOM 0 H PHE A 31 13.916 3.945 -1.361 1.00 10.00 H new ATOM 0 HA PHE A 31 11.969 2.260 -2.796 1.00 10.00 H new ATOM 0 HB2 PHE A 31 11.226 4.647 -2.906 1.00 10.00 H new ATOM 0 HB3 PHE A 31 12.774 5.071 -3.608 1.00 10.00 H new ATOM 0 HD1 PHE A 31 10.239 2.367 -4.204 1.00 10.00 H new ATOM 0 HD2 PHE A 31 12.667 5.437 -5.883 1.00 10.00 H new ATOM 0 HE1 PHE A 31 9.373 1.830 -6.437 1.00 10.00 H new ATOM 0 HE2 PHE A 31 11.809 4.898 -8.118 1.00 10.00 H new ATOM 0 HZ PHE A 31 10.161 3.090 -8.399 1.00 10.00 H new ATOM 280 N ILE A 32 13.885 1.469 -4.157 1.00 10.00 N ATOM 281 CA ILE A 32 15.029 0.934 -4.885 1.00 10.00 C ATOM 282 C ILE A 32 15.015 1.352 -6.355 1.00 10.00 C ATOM 283 O ILE A 32 14.140 2.103 -6.791 1.00 10.00 O ATOM 284 CB ILE A 32 15.139 -0.600 -4.755 1.00 10.00 C ATOM 285 CG1 ILE A 32 13.755 -1.243 -4.584 1.00 10.00 C ATOM 286 CG2 ILE A 32 16.039 -0.963 -3.584 1.00 10.00 C ATOM 287 CD1 ILE A 32 12.912 -1.241 -5.840 1.00 10.00 C ATOM 0 H ILE A 32 13.059 0.871 -4.167 1.00 10.00 H new ATOM 0 HA ILE A 32 15.915 1.367 -4.421 1.00 10.00 H new ATOM 0 HB ILE A 32 15.578 -0.988 -5.674 1.00 10.00 H new ATOM 0 HG12 ILE A 32 13.884 -2.272 -4.248 1.00 10.00 H new ATOM 0 HG13 ILE A 32 13.216 -0.715 -3.797 1.00 10.00 H new ATOM 0 HG21 ILE A 32 16.109 -2.048 -3.502 1.00 10.00 H new ATOM 0 HG22 ILE A 32 17.033 -0.546 -3.746 1.00 10.00 H new ATOM 0 HG23 ILE A 32 15.621 -0.556 -2.664 1.00 10.00 H new ATOM 0 HD11 ILE A 32 11.951 -1.713 -5.634 1.00 10.00 H new ATOM 0 HD12 ILE A 32 12.749 -0.214 -6.167 1.00 10.00 H new ATOM 0 HD13 ILE A 32 13.427 -1.795 -6.625 1.00 10.00 H new ATOM 289 N THR A 33 15.989 0.872 -7.111 1.00 10.00 N ATOM 290 CA THR A 33 16.098 1.201 -8.521 1.00 10.00 C ATOM 291 C THR A 33 15.118 0.385 -9.361 1.00 10.00 C ATOM 292 O THR A 33 14.457 -0.524 -8.854 1.00 10.00 O ATOM 293 CB THR A 33 17.525 0.926 -9.013 1.00 10.00 C ATOM 294 OG1 THR A 33 18.008 -0.277 -8.399 1.00 10.00 O ATOM 295 CG2 THR A 33 18.443 2.080 -8.643 1.00 10.00 C ATOM 0 H THR A 33 16.720 0.249 -6.768 1.00 10.00 H new ATOM 0 HA THR A 33 15.858 2.258 -8.634 1.00 10.00 H new ATOM 0 HB THR A 33 17.514 0.817 -10.097 1.00 10.00 H new ATOM 0 HG1 THR A 33 18.925 -0.451 -8.698 1.00 10.00 H new ATOM 0 HG21 THR A 33 19.452 1.871 -8.998 1.00 10.00 H new ATOM 0 HG22 THR A 33 18.078 2.997 -9.105 1.00 10.00 H new ATOM 0 HG23 THR A 33 18.458 2.200 -7.560 1.00 10.00 H new ATOM 298 N LYS A 34 15.034 0.705 -10.646 1.00 10.00 N ATOM 299 CA LYS A 34 14.140 -0.003 -11.552 1.00 10.00 C ATOM 300 C LYS A 34 14.621 -1.434 -11.743 1.00 10.00 C ATOM 301 O LYS A 34 13.823 -2.358 -11.866 1.00 10.00 O ATOM 302 CB LYS A 34 14.039 0.725 -12.893 1.00 10.00 C ATOM 303 CG LYS A 34 12.859 1.683 -13.001 1.00 10.00 C ATOM 304 CD LYS A 34 12.661 2.489 -11.724 1.00 10.00 C ATOM 305 CE LYS A 34 11.622 3.580 -11.911 1.00 10.00 C ATOM 306 NZ LYS A 34 12.215 4.814 -12.488 1.00 10.00 N ATOM 0 H LYS A 34 15.575 1.451 -11.084 1.00 10.00 H new ATOM 0 HA LYS A 34 13.143 -0.028 -11.113 1.00 10.00 H new ATOM 0 HB2 LYS A 34 14.961 1.282 -13.060 1.00 10.00 H new ATOM 0 HB3 LYS A 34 13.965 -0.015 -13.690 1.00 10.00 H new ATOM 0 HG2 LYS A 34 13.019 2.363 -13.838 1.00 10.00 H new ATOM 0 HG3 LYS A 34 11.952 1.118 -13.218 1.00 10.00 H new ATOM 0 HD2 LYS A 34 12.351 1.825 -10.917 1.00 10.00 H new ATOM 0 HD3 LYS A 34 13.609 2.935 -11.423 1.00 10.00 H new ATOM 0 HE2 LYS A 34 10.829 3.218 -12.565 1.00 10.00 H new ATOM 0 HE3 LYS A 34 11.162 3.813 -10.950 1.00 10.00 H new ATOM 0 HZ1 LYS A 34 11.474 5.535 -12.601 1.00 10.00 H new ATOM 0 HZ2 LYS A 34 12.955 5.174 -11.852 1.00 10.00 H new ATOM 0 HZ3 LYS A 34 12.632 4.598 -13.416 1.00 10.00 H new ATOM 311 N ASP A 35 15.935 -1.605 -11.742 1.00 10.00 N ATOM 312 CA ASP A 35 16.539 -2.924 -11.877 1.00 10.00 C ATOM 313 C ASP A 35 16.225 -3.763 -10.643 1.00 10.00 C ATOM 314 O ASP A 35 16.011 -4.974 -10.734 1.00 10.00 O ATOM 315 CB ASP A 35 18.055 -2.815 -12.078 1.00 10.00 C ATOM 316 CG ASP A 35 18.702 -1.776 -11.182 1.00 10.00 C ATOM 317 OD1 ASP A 35 18.569 -0.571 -11.474 1.00 10.00 O ATOM 318 OD2 ASP A 35 19.347 -2.153 -10.182 1.00 10.00 O ATOM 0 H ASP A 35 16.607 -0.843 -11.649 1.00 10.00 H new ATOM 0 HA ASP A 35 16.118 -3.411 -12.757 1.00 10.00 H new ATOM 0 HB2 ASP A 35 18.511 -3.786 -11.886 1.00 10.00 H new ATOM 0 HB3 ASP A 35 18.260 -2.566 -13.119 1.00 10.00 H new ATOM 320 N LYS A 36 16.170 -3.100 -9.493 1.00 10.00 N ATOM 321 CA LYS A 36 15.862 -3.768 -8.240 1.00 10.00 C ATOM 322 C LYS A 36 14.381 -4.123 -8.178 1.00 10.00 C ATOM 323 O LYS A 36 14.013 -5.207 -7.727 1.00 10.00 O ATOM 324 CB LYS A 36 16.246 -2.886 -7.056 1.00 10.00 C ATOM 325 CG LYS A 36 17.470 -3.363 -6.293 1.00 10.00 C ATOM 326 CD LYS A 36 17.109 -4.454 -5.301 1.00 10.00 C ATOM 327 CE LYS A 36 18.213 -4.654 -4.278 1.00 10.00 C ATOM 328 NZ LYS A 36 17.742 -5.428 -3.103 1.00 10.00 N ATOM 0 H LYS A 36 16.336 -2.097 -9.406 1.00 10.00 H new ATOM 0 HA LYS A 36 16.443 -4.689 -8.188 1.00 10.00 H new ATOM 0 HB2 LYS A 36 16.428 -1.874 -7.416 1.00 10.00 H new ATOM 0 HB3 LYS A 36 15.402 -2.833 -6.369 1.00 10.00 H new ATOM 0 HG2 LYS A 36 18.215 -3.738 -6.994 1.00 10.00 H new ATOM 0 HG3 LYS A 36 17.923 -2.523 -5.765 1.00 10.00 H new ATOM 0 HD2 LYS A 36 16.181 -4.194 -4.792 1.00 10.00 H new ATOM 0 HD3 LYS A 36 16.929 -5.388 -5.833 1.00 10.00 H new ATOM 0 HE2 LYS A 36 19.050 -5.174 -4.744 1.00 10.00 H new ATOM 0 HE3 LYS A 36 18.584 -3.683 -3.949 1.00 10.00 H new ATOM 0 HZ1 LYS A 36 18.561 -5.790 -2.575 1.00 10.00 H new ATOM 0 HZ2 LYS A 36 17.177 -4.811 -2.485 1.00 10.00 H new ATOM 0 HZ3 LYS A 36 17.157 -6.226 -3.424 1.00 10.00 H new ATOM 333 N ARG A 37 13.530 -3.206 -8.641 1.00 10.00 N ATOM 334 CA ARG A 37 12.090 -3.445 -8.645 1.00 10.00 C ATOM 335 C ARG A 37 11.747 -4.564 -9.622 1.00 10.00 C ATOM 336 O ARG A 37 10.783 -5.305 -9.425 1.00 10.00 O ATOM 337 CB ARG A 37 11.293 -2.169 -8.962 1.00 10.00 C ATOM 338 CG ARG A 37 11.111 -1.882 -10.442 1.00 10.00 C ATOM 339 CD ARG A 37 10.144 -0.734 -10.671 1.00 10.00 C ATOM 340 NE ARG A 37 10.031 -0.411 -12.091 1.00 10.00 N ATOM 341 CZ ARG A 37 9.340 0.616 -12.576 1.00 10.00 C ATOM 342 NH1 ARG A 37 8.633 1.395 -11.772 1.00 10.00 N ATOM 343 NH2 ARG A 37 9.334 0.840 -13.879 1.00 10.00 N ATOM 0 H ARG A 37 13.812 -2.300 -9.014 1.00 10.00 H new ATOM 0 HA ARG A 37 11.801 -3.754 -7.641 1.00 10.00 H new ATOM 0 HB2 ARG A 37 10.310 -2.247 -8.498 1.00 10.00 H new ATOM 0 HB3 ARG A 37 11.796 -1.319 -8.501 1.00 10.00 H new ATOM 0 HG2 ARG A 37 12.076 -1.641 -10.888 1.00 10.00 H new ATOM 0 HG3 ARG A 37 10.742 -2.776 -10.944 1.00 10.00 H new ATOM 0 HD2 ARG A 37 9.163 -0.998 -10.277 1.00 10.00 H new ATOM 0 HD3 ARG A 37 10.482 0.145 -10.122 1.00 10.00 H new ATOM 0 HE ARG A 37 10.515 -1.014 -12.756 1.00 10.00 H new ATOM 0 HH11 ARG A 37 8.615 1.210 -10.769 1.00 10.00 H new ATOM 0 HH12 ARG A 37 8.107 2.180 -12.156 1.00 10.00 H new ATOM 0 HH21 ARG A 37 9.857 0.227 -14.504 1.00 10.00 H new ATOM 0 HH22 ARG A 37 8.806 1.626 -14.259 1.00 10.00 H new ATOM 350 N ARG A 38 12.559 -4.682 -10.672 1.00 10.00 N ATOM 351 CA ARG A 38 12.374 -5.715 -11.681 1.00 10.00 C ATOM 352 C ARG A 38 12.587 -7.088 -11.057 1.00 10.00 C ATOM 353 O ARG A 38 11.918 -8.055 -11.417 1.00 10.00 O ATOM 354 CB ARG A 38 13.339 -5.503 -12.850 1.00 10.00 C ATOM 355 CG ARG A 38 13.029 -6.348 -14.078 1.00 10.00 C ATOM 356 CD ARG A 38 13.901 -5.950 -15.258 1.00 10.00 C ATOM 357 NE ARG A 38 15.310 -6.257 -15.026 1.00 10.00 N ATOM 358 CZ ARG A 38 16.220 -6.346 -15.989 1.00 10.00 C ATOM 359 NH1 ARG A 38 15.875 -6.149 -17.254 1.00 10.00 N ATOM 360 NH2 ARG A 38 17.476 -6.631 -15.685 1.00 10.00 N ATOM 0 H ARG A 38 13.356 -4.068 -10.843 1.00 10.00 H new ATOM 0 HA ARG A 38 11.356 -5.654 -12.066 1.00 10.00 H new ATOM 0 HB2 ARG A 38 13.322 -4.451 -13.134 1.00 10.00 H new ATOM 0 HB3 ARG A 38 14.352 -5.727 -12.515 1.00 10.00 H new ATOM 0 HG2 ARG A 38 13.186 -7.401 -13.846 1.00 10.00 H new ATOM 0 HG3 ARG A 38 11.978 -6.234 -14.345 1.00 10.00 H new ATOM 0 HD2 ARG A 38 13.559 -6.470 -16.153 1.00 10.00 H new ATOM 0 HD3 ARG A 38 13.789 -4.882 -15.448 1.00 10.00 H new ATOM 0 HE ARG A 38 15.614 -6.413 -14.065 1.00 10.00 H new ATOM 0 HH11 ARG A 38 14.908 -5.928 -17.490 1.00 10.00 H new ATOM 0 HH12 ARG A 38 16.577 -6.218 -17.991 1.00 10.00 H new ATOM 0 HH21 ARG A 38 17.744 -6.782 -14.712 1.00 10.00 H new ATOM 0 HH22 ARG A 38 18.176 -6.700 -16.423 1.00 10.00 H new ATOM 367 N ARG A 39 13.512 -7.152 -10.098 1.00 10.00 N ATOM 368 CA ARG A 39 13.811 -8.394 -9.393 1.00 10.00 C ATOM 369 C ARG A 39 12.566 -8.872 -8.655 1.00 10.00 C ATOM 370 O ARG A 39 12.182 -10.037 -8.745 1.00 10.00 O ATOM 371 CB ARG A 39 14.973 -8.179 -8.407 1.00 10.00 C ATOM 372 CG ARG A 39 15.165 -9.295 -7.389 1.00 10.00 C ATOM 373 CD ARG A 39 14.816 -8.827 -5.982 1.00 10.00 C ATOM 374 NE ARG A 39 14.410 -9.940 -5.123 1.00 10.00 N ATOM 375 CZ ARG A 39 14.096 -9.817 -3.834 1.00 10.00 C ATOM 376 NH1 ARG A 39 14.164 -8.638 -3.224 1.00 10.00 N ATOM 377 NH2 ARG A 39 13.723 -10.887 -3.154 1.00 10.00 N ATOM 0 H ARG A 39 14.068 -6.353 -9.793 1.00 10.00 H new ATOM 0 HA ARG A 39 14.111 -9.155 -10.114 1.00 10.00 H new ATOM 0 HB2 ARG A 39 15.896 -8.063 -8.975 1.00 10.00 H new ATOM 0 HB3 ARG A 39 14.808 -7.244 -7.872 1.00 10.00 H new ATOM 0 HG2 ARG A 39 14.539 -10.146 -7.657 1.00 10.00 H new ATOM 0 HG3 ARG A 39 16.199 -9.639 -7.414 1.00 10.00 H new ATOM 0 HD2 ARG A 39 15.677 -8.324 -5.542 1.00 10.00 H new ATOM 0 HD3 ARG A 39 14.011 -8.094 -6.032 1.00 10.00 H new ATOM 0 HE ARG A 39 14.364 -10.871 -5.538 1.00 10.00 H new ATOM 0 HH11 ARG A 39 14.460 -7.811 -3.743 1.00 10.00 H new ATOM 0 HH12 ARG A 39 13.920 -8.560 -2.237 1.00 10.00 H new ATOM 0 HH21 ARG A 39 13.678 -11.795 -3.616 1.00 10.00 H new ATOM 0 HH22 ARG A 39 13.480 -10.805 -2.167 1.00 10.00 H new ATOM 384 N ILE A 40 11.927 -7.955 -7.942 1.00 10.00 N ATOM 385 CA ILE A 40 10.719 -8.274 -7.194 1.00 10.00 C ATOM 386 C ILE A 40 9.578 -8.578 -8.158 1.00 10.00 C ATOM 387 O ILE A 40 8.827 -9.538 -7.972 1.00 10.00 O ATOM 388 CB ILE A 40 10.296 -7.105 -6.283 1.00 10.00 C ATOM 389 CG1 ILE A 40 11.517 -6.478 -5.607 1.00 10.00 C ATOM 390 CG2 ILE A 40 9.294 -7.581 -5.241 1.00 10.00 C ATOM 391 CD1 ILE A 40 11.258 -5.089 -5.060 1.00 10.00 C ATOM 0 H ILE A 40 12.226 -6.983 -7.866 1.00 10.00 H new ATOM 0 HA ILE A 40 10.935 -9.144 -6.574 1.00 10.00 H new ATOM 0 HB ILE A 40 9.819 -6.343 -6.900 1.00 10.00 H new ATOM 0 HG12 ILE A 40 11.844 -7.125 -4.793 1.00 10.00 H new ATOM 0 HG13 ILE A 40 12.336 -6.430 -6.325 1.00 10.00 H new ATOM 0 HG21 ILE A 40 9.005 -6.744 -4.605 1.00 10.00 H new ATOM 0 HG22 ILE A 40 8.411 -7.979 -5.741 1.00 10.00 H new ATOM 0 HG23 ILE A 40 9.748 -8.361 -4.630 1.00 10.00 H new ATOM 0 HD11 ILE A 40 12.166 -4.706 -4.595 1.00 10.00 H new ATOM 0 HD12 ILE A 40 10.960 -4.427 -5.873 1.00 10.00 H new ATOM 0 HD13 ILE A 40 10.461 -5.133 -4.318 1.00 10.00 H new ATOM 393 N SER A 41 9.475 -7.754 -9.193 1.00 10.00 N ATOM 394 CA SER A 41 8.445 -7.898 -10.211 1.00 10.00 C ATOM 395 C SER A 41 8.492 -9.279 -10.865 1.00 10.00 C ATOM 396 O SER A 41 7.460 -9.920 -11.042 1.00 10.00 O ATOM 397 CB SER A 41 8.606 -6.802 -11.271 1.00 10.00 C ATOM 398 OG SER A 41 7.427 -6.644 -12.041 1.00 10.00 O ATOM 0 H SER A 41 10.104 -6.967 -9.349 1.00 10.00 H new ATOM 0 HA SER A 41 7.473 -7.795 -9.728 1.00 10.00 H new ATOM 0 HB2 SER A 41 8.853 -5.858 -10.785 1.00 10.00 H new ATOM 0 HB3 SER A 41 9.440 -7.050 -11.928 1.00 10.00 H new ATOM 0 HG SER A 41 7.308 -7.425 -12.622 1.00 10.00 H new ATOM 401 N ALA A 42 9.691 -9.739 -11.196 1.00 10.00 N ATOM 402 CA ALA A 42 9.864 -11.039 -11.831 1.00 10.00 C ATOM 403 C ALA A 42 9.595 -12.182 -10.856 1.00 10.00 C ATOM 404 O ALA A 42 9.375 -13.320 -11.270 1.00 10.00 O ATOM 405 CB ALA A 42 11.260 -11.157 -12.424 1.00 10.00 C ATOM 0 H ALA A 42 10.560 -9.230 -11.035 1.00 10.00 H new ATOM 0 HA ALA A 42 9.133 -11.116 -12.635 1.00 10.00 H new ATOM 0 HB1 ALA A 42 11.374 -12.133 -12.895 1.00 10.00 H new ATOM 0 HB2 ALA A 42 11.406 -10.375 -13.170 1.00 10.00 H new ATOM 0 HB3 ALA A 42 12.002 -11.047 -11.633 1.00 10.00 H new ATOM 407 N THR A 43 9.600 -11.873 -9.562 1.00 10.00 N ATOM 408 CA THR A 43 9.353 -12.879 -8.538 1.00 10.00 C ATOM 409 C THR A 43 7.852 -13.076 -8.318 1.00 10.00 C ATOM 410 O THR A 43 7.386 -14.196 -8.110 1.00 10.00 O ATOM 411 CB THR A 43 10.027 -12.498 -7.204 1.00 10.00 C ATOM 412 OG1 THR A 43 11.406 -12.192 -7.448 1.00 10.00 O ATOM 413 CG2 THR A 43 9.939 -13.638 -6.200 1.00 10.00 C ATOM 0 H THR A 43 9.772 -10.935 -9.200 1.00 10.00 H new ATOM 0 HA THR A 43 9.786 -13.815 -8.892 1.00 10.00 H new ATOM 0 HB THR A 43 9.510 -11.633 -6.789 1.00 10.00 H new ATOM 0 HG1 THR A 43 11.474 -11.319 -7.889 1.00 10.00 H new ATOM 0 HG21 THR A 43 10.422 -13.341 -5.269 1.00 10.00 H new ATOM 0 HG22 THR A 43 8.892 -13.873 -6.007 1.00 10.00 H new ATOM 0 HG23 THR A 43 10.439 -14.518 -6.604 1.00 10.00 H new ATOM 416 N THR A 44 7.095 -11.987 -8.381 1.00 10.00 N ATOM 417 CA THR A 44 5.653 -12.053 -8.181 1.00 10.00 C ATOM 418 C THR A 44 4.903 -12.059 -9.511 1.00 10.00 C ATOM 419 O THR A 44 3.671 -12.069 -9.538 1.00 10.00 O ATOM 420 CB THR A 44 5.157 -10.884 -7.306 1.00 10.00 C ATOM 421 OG1 THR A 44 6.064 -9.776 -7.422 1.00 10.00 O ATOM 422 CG2 THR A 44 5.060 -11.311 -5.849 1.00 10.00 C ATOM 0 H THR A 44 7.454 -11.051 -8.568 1.00 10.00 H new ATOM 0 HA THR A 44 5.446 -12.990 -7.664 1.00 10.00 H new ATOM 0 HB THR A 44 4.167 -10.586 -7.651 1.00 10.00 H new ATOM 0 HG1 THR A 44 5.746 -9.034 -6.867 1.00 10.00 H new ATOM 0 HG21 THR A 44 4.708 -10.473 -5.247 1.00 10.00 H new ATOM 0 HG22 THR A 44 4.360 -12.141 -5.759 1.00 10.00 H new ATOM 0 HG23 THR A 44 6.042 -11.625 -5.496 1.00 10.00 H new ATOM 425 N ASN A 45 5.661 -12.053 -10.607 1.00 10.00 N ATOM 426 CA ASN A 45 5.098 -12.059 -11.958 1.00 10.00 C ATOM 427 C ASN A 45 4.273 -10.809 -12.234 1.00 10.00 C ATOM 428 O ASN A 45 3.165 -10.879 -12.766 1.00 10.00 O ATOM 429 CB ASN A 45 4.296 -13.335 -12.237 1.00 10.00 C ATOM 430 CG ASN A 45 5.170 -14.458 -12.746 1.00 10.00 C ATOM 431 OD1 ASN A 45 5.778 -15.189 -11.965 1.00 10.00 O ATOM 432 ND2 ASN A 45 5.242 -14.604 -14.059 1.00 10.00 N ATOM 0 H ASN A 45 6.681 -12.044 -10.584 1.00 10.00 H new ATOM 0 HA ASN A 45 5.940 -12.050 -12.651 1.00 10.00 H new ATOM 0 HB2 ASN A 45 3.793 -13.653 -11.324 1.00 10.00 H new ATOM 0 HB3 ASN A 45 3.519 -13.121 -12.970 1.00 10.00 H new ATOM 0 HD21 ASN A 45 5.818 -15.345 -14.459 1.00 10.00 H new ATOM 0 HD22 ASN A 45 4.721 -13.976 -14.671 1.00 10.00 H new ATOM 436 N LEU A 46 4.828 -9.664 -11.874 1.00 10.00 N ATOM 437 CA LEU A 46 4.156 -8.393 -12.085 1.00 10.00 C ATOM 438 C LEU A 46 4.788 -7.651 -13.257 1.00 10.00 C ATOM 439 O LEU A 46 5.786 -8.104 -13.818 1.00 10.00 O ATOM 440 CB LEU A 46 4.198 -7.536 -10.816 1.00 10.00 C ATOM 441 CG LEU A 46 2.924 -7.524 -9.964 1.00 10.00 C ATOM 442 CD1 LEU A 46 2.552 -8.929 -9.513 1.00 10.00 C ATOM 443 CD2 LEU A 46 3.093 -6.610 -8.764 1.00 10.00 C ATOM 0 H LEU A 46 5.745 -9.589 -11.433 1.00 10.00 H new ATOM 0 HA LEU A 46 3.111 -8.591 -12.322 1.00 10.00 H new ATOM 0 HB2 LEU A 46 5.022 -7.885 -10.194 1.00 10.00 H new ATOM 0 HB3 LEU A 46 4.428 -6.510 -11.103 1.00 10.00 H new ATOM 0 HG LEU A 46 2.112 -7.141 -10.582 1.00 10.00 H new ATOM 0 HD11 LEU A 46 1.645 -8.889 -8.911 1.00 10.00 H new ATOM 0 HD12 LEU A 46 2.381 -9.558 -10.386 1.00 10.00 H new ATOM 0 HD13 LEU A 46 3.364 -9.347 -8.918 1.00 10.00 H new ATOM 0 HD21 LEU A 46 2.178 -6.615 -8.171 1.00 10.00 H new ATOM 0 HD22 LEU A 46 3.923 -6.962 -8.152 1.00 10.00 H new ATOM 0 HD23 LEU A 46 3.299 -5.596 -9.105 1.00 10.00 H new ATOM 445 N SER A 47 4.213 -6.516 -13.621 1.00 10.00 N ATOM 446 CA SER A 47 4.726 -5.728 -14.733 1.00 10.00 C ATOM 447 C SER A 47 5.313 -4.392 -14.275 1.00 10.00 C ATOM 448 O SER A 47 5.071 -3.358 -14.897 1.00 10.00 O ATOM 449 CB SER A 47 3.623 -5.514 -15.771 1.00 10.00 C ATOM 450 OG SER A 47 2.846 -6.693 -15.917 1.00 10.00 O ATOM 0 H SER A 47 3.392 -6.119 -13.164 1.00 10.00 H new ATOM 0 HA SER A 47 5.543 -6.288 -15.189 1.00 10.00 H new ATOM 0 HB2 SER A 47 2.984 -4.685 -15.467 1.00 10.00 H new ATOM 0 HB3 SER A 47 4.065 -5.241 -16.729 1.00 10.00 H new ATOM 0 HG SER A 47 2.143 -6.541 -16.583 1.00 10.00 H new ATOM 453 N GLU A 48 6.073 -4.426 -13.176 1.00 10.00 N ATOM 454 CA GLU A 48 6.738 -3.239 -12.615 1.00 10.00 C ATOM 455 C GLU A 48 5.793 -2.178 -12.037 1.00 10.00 C ATOM 456 O GLU A 48 5.967 -1.751 -10.895 1.00 10.00 O ATOM 457 CB GLU A 48 7.739 -2.620 -13.596 1.00 10.00 C ATOM 458 CG GLU A 48 9.067 -3.357 -13.666 1.00 10.00 C ATOM 459 CD GLU A 48 10.017 -2.755 -14.681 1.00 10.00 C ATOM 460 OE1 GLU A 48 10.667 -1.732 -14.365 1.00 10.00 O ATOM 461 OE2 GLU A 48 10.119 -3.301 -15.800 1.00 10.00 O ATOM 0 H GLU A 48 6.247 -5.280 -12.646 1.00 10.00 H new ATOM 0 HA GLU A 48 7.290 -3.624 -11.757 1.00 10.00 H new ATOM 0 HB2 GLU A 48 7.293 -2.599 -14.590 1.00 10.00 H new ATOM 0 HB3 GLU A 48 7.923 -1.585 -13.308 1.00 10.00 H new ATOM 0 HG2 GLU A 48 9.537 -3.345 -12.683 1.00 10.00 H new ATOM 0 HG3 GLU A 48 8.885 -4.401 -13.919 1.00 10.00 H new ATOM 463 N ARG A 49 4.803 -1.757 -12.819 1.00 10.00 N ATOM 464 CA ARG A 49 3.849 -0.729 -12.397 1.00 10.00 C ATOM 465 C ARG A 49 3.238 -1.028 -11.029 1.00 10.00 C ATOM 466 O ARG A 49 3.425 -0.266 -10.080 1.00 10.00 O ATOM 467 CB ARG A 49 2.741 -0.555 -13.440 1.00 10.00 C ATOM 468 CG ARG A 49 1.982 0.761 -13.328 1.00 10.00 C ATOM 469 CD ARG A 49 0.815 0.812 -14.302 1.00 10.00 C ATOM 470 NE ARG A 49 0.338 2.178 -14.517 1.00 10.00 N ATOM 471 CZ ARG A 49 -0.927 2.491 -14.806 1.00 10.00 C ATOM 472 NH1 ARG A 49 -1.863 1.555 -14.826 1.00 10.00 N ATOM 473 NH2 ARG A 49 -1.258 3.751 -15.046 1.00 10.00 N ATOM 0 H ARG A 49 4.637 -2.115 -13.760 1.00 10.00 H new ATOM 0 HA ARG A 49 4.409 0.202 -12.309 1.00 10.00 H new ATOM 0 HB2 ARG A 49 3.180 -0.625 -14.435 1.00 10.00 H new ATOM 0 HB3 ARG A 49 2.034 -1.379 -13.344 1.00 10.00 H new ATOM 0 HG2 ARG A 49 1.614 0.885 -12.310 1.00 10.00 H new ATOM 0 HG3 ARG A 49 2.660 1.592 -13.525 1.00 10.00 H new ATOM 0 HD2 ARG A 49 1.120 0.380 -15.255 1.00 10.00 H new ATOM 0 HD3 ARG A 49 -0.002 0.199 -13.921 1.00 10.00 H new ATOM 0 HE ARG A 49 1.014 2.938 -14.441 1.00 10.00 H new ATOM 0 HH11 ARG A 49 -1.620 0.586 -14.620 1.00 10.00 H new ATOM 0 HH12 ARG A 49 -2.827 1.803 -15.048 1.00 10.00 H new ATOM 0 HH21 ARG A 49 -0.546 4.481 -15.010 1.00 10.00 H new ATOM 0 HH22 ARG A 49 -2.224 3.991 -15.267 1.00 10.00 H new ATOM 480 N GLN A 50 2.535 -2.152 -10.930 1.00 10.00 N ATOM 481 CA GLN A 50 1.878 -2.544 -9.686 1.00 10.00 C ATOM 482 C GLN A 50 2.865 -2.740 -8.535 1.00 10.00 C ATOM 483 O GLN A 50 2.573 -2.379 -7.396 1.00 10.00 O ATOM 484 CB GLN A 50 1.023 -3.800 -9.886 1.00 10.00 C ATOM 485 CG GLN A 50 -0.255 -3.562 -10.679 1.00 10.00 C ATOM 486 CD GLN A 50 -1.196 -2.593 -9.990 1.00 10.00 C ATOM 487 OE1 GLN A 50 -1.103 -1.381 -10.181 1.00 10.00 O ATOM 488 NE2 GLN A 50 -2.108 -3.118 -9.189 1.00 10.00 N ATOM 0 H GLN A 50 2.405 -2.810 -11.699 1.00 10.00 H new ATOM 0 HA GLN A 50 1.224 -1.718 -9.407 1.00 10.00 H new ATOM 0 HB2 GLN A 50 1.620 -4.555 -10.397 1.00 10.00 H new ATOM 0 HB3 GLN A 50 0.761 -4.208 -8.910 1.00 10.00 H new ATOM 0 HG2 GLN A 50 0.001 -3.175 -11.666 1.00 10.00 H new ATOM 0 HG3 GLN A 50 -0.766 -4.513 -10.832 1.00 10.00 H new ATOM 0 HE21 GLN A 50 -2.151 -4.129 -9.058 1.00 10.00 H new ATOM 0 HE22 GLN A 50 -2.768 -2.512 -8.702 1.00 10.00 H new ATOM 492 N VAL A 51 4.041 -3.289 -8.832 1.00 10.00 N ATOM 493 CA VAL A 51 5.045 -3.527 -7.797 1.00 10.00 C ATOM 494 C VAL A 51 5.580 -2.217 -7.220 1.00 10.00 C ATOM 495 O VAL A 51 5.994 -2.156 -6.066 1.00 10.00 O ATOM 496 CB VAL A 51 6.200 -4.448 -8.273 1.00 10.00 C ATOM 497 CG1 VAL A 51 7.355 -3.660 -8.878 1.00 10.00 C ATOM 498 CG2 VAL A 51 6.683 -5.334 -7.136 1.00 10.00 C ATOM 0 H VAL A 51 4.320 -3.575 -9.770 1.00 10.00 H new ATOM 0 HA VAL A 51 4.534 -4.063 -6.997 1.00 10.00 H new ATOM 0 HB VAL A 51 5.801 -5.083 -9.064 1.00 10.00 H new ATOM 0 HG11 VAL A 51 8.138 -4.348 -9.196 1.00 10.00 H new ATOM 0 HG12 VAL A 51 6.998 -3.094 -9.738 1.00 10.00 H new ATOM 0 HG13 VAL A 51 7.756 -2.973 -8.133 1.00 10.00 H new ATOM 0 HG21 VAL A 51 7.493 -5.972 -7.491 1.00 10.00 H new ATOM 0 HG22 VAL A 51 7.044 -4.711 -6.317 1.00 10.00 H new ATOM 0 HG23 VAL A 51 5.859 -5.955 -6.784 1.00 10.00 H new ATOM 500 N THR A 52 5.545 -1.166 -8.027 1.00 10.00 N ATOM 501 CA THR A 52 6.008 0.141 -7.597 1.00 10.00 C ATOM 502 C THR A 52 4.957 0.794 -6.705 1.00 10.00 C ATOM 503 O THR A 52 5.286 1.423 -5.698 1.00 10.00 O ATOM 504 CB THR A 52 6.303 1.049 -8.806 1.00 10.00 C ATOM 505 OG1 THR A 52 7.184 0.360 -9.704 1.00 10.00 O ATOM 506 CG2 THR A 52 6.954 2.354 -8.365 1.00 10.00 C ATOM 0 H THR A 52 5.199 -1.196 -8.986 1.00 10.00 H new ATOM 0 HA THR A 52 6.933 0.008 -7.035 1.00 10.00 H new ATOM 0 HB THR A 52 5.362 1.285 -9.302 1.00 10.00 H new ATOM 0 HG1 THR A 52 6.697 -0.365 -10.148 1.00 10.00 H new ATOM 0 HG21 THR A 52 7.151 2.976 -9.238 1.00 10.00 H new ATOM 0 HG22 THR A 52 6.285 2.883 -7.687 1.00 10.00 H new ATOM 0 HG23 THR A 52 7.892 2.138 -7.854 1.00 10.00 H new ATOM 509 N ILE A 53 3.692 0.606 -7.069 1.00 10.00 N ATOM 510 CA ILE A 53 2.576 1.166 -6.314 1.00 10.00 C ATOM 511 C ILE A 53 2.582 0.658 -4.873 1.00 10.00 C ATOM 512 O ILE A 53 2.258 1.396 -3.940 1.00 10.00 O ATOM 513 CB ILE A 53 1.223 0.830 -6.982 1.00 10.00 C ATOM 514 CG1 ILE A 53 1.139 1.447 -8.383 1.00 10.00 C ATOM 515 CG2 ILE A 53 0.052 1.282 -6.119 1.00 10.00 C ATOM 516 CD1 ILE A 53 1.309 2.953 -8.411 1.00 10.00 C ATOM 0 H ILE A 53 3.413 0.066 -7.888 1.00 10.00 H new ATOM 0 HA ILE A 53 2.700 2.249 -6.307 1.00 10.00 H new ATOM 0 HB ILE A 53 1.162 -0.254 -7.082 1.00 10.00 H new ATOM 0 HG12 ILE A 53 1.905 0.995 -9.013 1.00 10.00 H new ATOM 0 HG13 ILE A 53 0.174 1.193 -8.822 1.00 10.00 H new ATOM 0 HG21 ILE A 53 -0.885 1.031 -6.617 1.00 10.00 H new ATOM 0 HG22 ILE A 53 0.096 0.778 -5.153 1.00 10.00 H new ATOM 0 HG23 ILE A 53 0.106 2.360 -5.969 1.00 10.00 H new ATOM 0 HD11 ILE A 53 1.236 3.308 -9.439 1.00 10.00 H new ATOM 0 HD12 ILE A 53 0.528 3.419 -7.810 1.00 10.00 H new ATOM 0 HD13 ILE A 53 2.285 3.217 -8.004 1.00 10.00 H new ATOM 518 N TRP A 54 2.983 -0.596 -4.686 1.00 10.00 N ATOM 519 CA TRP A 54 3.031 -1.183 -3.357 1.00 10.00 C ATOM 520 C TRP A 54 4.048 -0.487 -2.460 1.00 10.00 C ATOM 521 O TRP A 54 3.944 -0.547 -1.237 1.00 10.00 O ATOM 522 CB TRP A 54 3.256 -2.688 -3.404 1.00 10.00 C ATOM 523 CG TRP A 54 2.011 -3.460 -3.097 1.00 10.00 C ATOM 524 CD1 TRP A 54 1.414 -3.599 -1.876 1.00 10.00 C ATOM 525 CD2 TRP A 54 1.201 -4.191 -4.024 1.00 10.00 C ATOM 526 NE1 TRP A 54 0.285 -4.372 -1.985 1.00 10.00 N ATOM 527 CE2 TRP A 54 0.134 -4.750 -3.293 1.00 10.00 C ATOM 528 CE3 TRP A 54 1.275 -4.430 -5.398 1.00 10.00 C ATOM 529 CZ2 TRP A 54 -0.848 -5.531 -3.893 1.00 10.00 C ATOM 530 CZ3 TRP A 54 0.299 -5.205 -5.990 1.00 10.00 C ATOM 531 CH2 TRP A 54 -0.747 -5.745 -5.238 1.00 10.00 C ATOM 0 H TRP A 54 3.278 -1.221 -5.437 1.00 10.00 H new ATOM 0 HA TRP A 54 2.050 -1.022 -2.910 1.00 10.00 H new ATOM 0 HB2 TRP A 54 3.619 -2.968 -4.393 1.00 10.00 H new ATOM 0 HB3 TRP A 54 4.034 -2.959 -2.690 1.00 10.00 H new ATOM 0 HD1 TRP A 54 1.778 -3.163 -0.957 1.00 10.00 H new ATOM 0 HE1 TRP A 54 -0.339 -4.624 -1.218 1.00 10.00 H new ATOM 0 HE3 TRP A 54 2.081 -4.016 -5.986 1.00 10.00 H new ATOM 0 HZ2 TRP A 54 -1.659 -5.952 -3.317 1.00 10.00 H new ATOM 0 HZ3 TRP A 54 0.344 -5.397 -7.052 1.00 10.00 H new ATOM 0 HH2 TRP A 54 -1.495 -6.347 -5.733 1.00 10.00 H new ATOM 534 N PHE A 55 5.023 0.185 -3.066 1.00 10.00 N ATOM 535 CA PHE A 55 6.023 0.914 -2.299 1.00 10.00 C ATOM 536 C PHE A 55 5.366 2.115 -1.632 1.00 10.00 C ATOM 537 O PHE A 55 5.652 2.433 -0.479 1.00 10.00 O ATOM 538 CB PHE A 55 7.200 1.354 -3.174 1.00 10.00 C ATOM 539 CG PHE A 55 8.271 0.309 -3.307 1.00 10.00 C ATOM 540 CD1 PHE A 55 9.270 0.196 -2.351 1.00 10.00 C ATOM 541 CD2 PHE A 55 8.278 -0.563 -4.383 1.00 10.00 C ATOM 542 CE1 PHE A 55 10.252 -0.766 -2.468 1.00 10.00 C ATOM 543 CE2 PHE A 55 9.259 -1.527 -4.506 1.00 10.00 C ATOM 544 CZ PHE A 55 10.248 -1.630 -3.546 1.00 10.00 C ATOM 0 H PHE A 55 5.140 0.239 -4.078 1.00 10.00 H new ATOM 0 HA PHE A 55 6.427 0.249 -1.536 1.00 10.00 H new ATOM 0 HB2 PHE A 55 6.829 1.611 -4.166 1.00 10.00 H new ATOM 0 HB3 PHE A 55 7.637 2.259 -2.753 1.00 10.00 H new ATOM 0 HD1 PHE A 55 9.279 0.868 -1.506 1.00 10.00 H new ATOM 0 HD2 PHE A 55 7.507 -0.488 -5.135 1.00 10.00 H new ATOM 0 HE1 PHE A 55 11.024 -0.844 -1.717 1.00 10.00 H new ATOM 0 HE2 PHE A 55 9.253 -2.199 -5.351 1.00 10.00 H new ATOM 0 HZ PHE A 55 11.016 -2.384 -3.638 1.00 10.00 H new ATOM 546 N GLN A 56 4.466 2.769 -2.360 1.00 10.00 N ATOM 547 CA GLN A 56 3.742 3.913 -1.821 1.00 10.00 C ATOM 548 C GLN A 56 2.655 3.413 -0.881 1.00 10.00 C ATOM 549 O GLN A 56 2.348 4.043 0.134 1.00 10.00 O ATOM 550 CB GLN A 56 3.135 4.763 -2.940 1.00 10.00 C ATOM 551 CG GLN A 56 4.157 5.555 -3.742 1.00 10.00 C ATOM 552 CD GLN A 56 4.732 4.772 -4.907 1.00 10.00 C ATOM 553 OE1 GLN A 56 4.040 3.973 -5.532 1.00 10.00 O ATOM 554 NE2 GLN A 56 6.004 4.996 -5.204 1.00 10.00 N ATOM 0 H GLN A 56 4.222 2.527 -3.320 1.00 10.00 H new ATOM 0 HA GLN A 56 4.439 4.547 -1.273 1.00 10.00 H new ATOM 0 HB2 GLN A 56 2.583 4.112 -3.618 1.00 10.00 H new ATOM 0 HB3 GLN A 56 2.414 5.456 -2.505 1.00 10.00 H new ATOM 0 HG2 GLN A 56 3.689 6.465 -4.118 1.00 10.00 H new ATOM 0 HG3 GLN A 56 4.968 5.863 -3.083 1.00 10.00 H new ATOM 0 HE21 GLN A 56 6.544 5.668 -4.659 1.00 10.00 H new ATOM 0 HE22 GLN A 56 6.443 4.496 -5.977 1.00 10.00 H new ATOM 558 N ASN A 57 2.105 2.249 -1.223 1.00 10.00 N ATOM 559 CA ASN A 57 1.064 1.611 -0.427 1.00 10.00 C ATOM 560 C ASN A 57 1.609 1.222 0.939 1.00 10.00 C ATOM 561 O ASN A 57 0.866 1.119 1.916 1.00 10.00 O ATOM 562 CB ASN A 57 0.531 0.364 -1.136 1.00 10.00 C ATOM 563 CG ASN A 57 -0.934 0.482 -1.495 1.00 10.00 C ATOM 564 OD1 ASN A 57 -1.668 1.261 -0.894 1.00 10.00 O ATOM 565 ND2 ASN A 57 -1.370 -0.297 -2.472 1.00 10.00 N ATOM 0 H ASN A 57 2.369 1.725 -2.057 1.00 10.00 H new ATOM 0 HA ASN A 57 0.249 2.323 -0.301 1.00 10.00 H new ATOM 0 HB2 ASN A 57 1.111 0.190 -2.042 1.00 10.00 H new ATOM 0 HB3 ASN A 57 0.675 -0.505 -0.494 1.00 10.00 H new ATOM 0 HD21 ASN A 57 -2.350 -0.264 -2.752 1.00 10.00 H new ATOM 0 HD22 ASN A 57 -0.726 -0.930 -2.945 1.00 10.00 H new ATOM 569 N ARG A 58 2.917 1.009 0.997 1.00 10.00 N ATOM 570 CA ARG A 58 3.582 0.648 2.235 1.00 10.00 C ATOM 571 C ARG A 58 3.461 1.782 3.244 1.00 10.00 C ATOM 572 O ARG A 58 3.300 1.545 4.440 1.00 10.00 O ATOM 573 CB ARG A 58 5.054 0.336 1.971 1.00 10.00 C ATOM 574 CG ARG A 58 5.528 -0.958 2.602 1.00 10.00 C ATOM 575 CD ARG A 58 6.716 -0.720 3.518 1.00 10.00 C ATOM 576 NE ARG A 58 6.324 -0.137 4.802 1.00 10.00 N ATOM 577 CZ ARG A 58 6.091 -0.851 5.898 1.00 10.00 C ATOM 578 NH1 ARG A 58 6.141 -2.171 5.851 1.00 10.00 N ATOM 579 NH2 ARG A 58 5.804 -0.242 7.037 1.00 10.00 N ATOM 0 H ARG A 58 3.540 1.082 0.192 1.00 10.00 H new ATOM 0 HA ARG A 58 3.102 -0.241 2.644 1.00 10.00 H new ATOM 0 HB2 ARG A 58 5.218 0.286 0.895 1.00 10.00 H new ATOM 0 HB3 ARG A 58 5.663 1.158 2.348 1.00 10.00 H new ATOM 0 HG2 ARG A 58 4.713 -1.409 3.169 1.00 10.00 H new ATOM 0 HG3 ARG A 58 5.804 -1.667 1.821 1.00 10.00 H new ATOM 0 HD2 ARG A 58 7.231 -1.665 3.693 1.00 10.00 H new ATOM 0 HD3 ARG A 58 7.426 -0.057 3.023 1.00 10.00 H new ATOM 0 HE ARG A 58 6.224 0.876 4.859 1.00 10.00 H new ATOM 0 HH11 ARG A 58 6.359 -2.642 4.973 1.00 10.00 H new ATOM 0 HH12 ARG A 58 5.962 -2.718 6.693 1.00 10.00 H new ATOM 0 HH21 ARG A 58 5.761 0.776 7.074 1.00 10.00 H new ATOM 0 HH22 ARG A 58 5.625 -0.791 7.878 1.00 10.00 H new ATOM 586 N ARG A 59 3.520 3.014 2.744 1.00 10.00 N ATOM 587 CA ARG A 59 3.412 4.194 3.592 1.00 10.00 C ATOM 588 C ARG A 59 2.023 4.274 4.207 1.00 10.00 C ATOM 589 O ARG A 59 1.850 4.751 5.327 1.00 10.00 O ATOM 590 CB ARG A 59 3.708 5.462 2.793 1.00 10.00 C ATOM 591 CG ARG A 59 5.168 5.878 2.804 1.00 10.00 C ATOM 592 CD ARG A 59 5.509 6.653 4.067 1.00 10.00 C ATOM 593 NE ARG A 59 6.718 6.147 4.709 1.00 10.00 N ATOM 594 CZ ARG A 59 7.892 6.767 4.682 1.00 10.00 C ATOM 595 NH1 ARG A 59 8.013 7.945 4.079 1.00 10.00 N ATOM 596 NH2 ARG A 59 8.947 6.213 5.263 1.00 10.00 N ATOM 0 H ARG A 59 3.642 3.219 1.752 1.00 10.00 H new ATOM 0 HA ARG A 59 4.148 4.111 4.391 1.00 10.00 H new ATOM 0 HB2 ARG A 59 3.393 5.309 1.761 1.00 10.00 H new ATOM 0 HB3 ARG A 59 3.106 6.278 3.192 1.00 10.00 H new ATOM 0 HG2 ARG A 59 5.801 4.994 2.735 1.00 10.00 H new ATOM 0 HG3 ARG A 59 5.381 6.492 1.929 1.00 10.00 H new ATOM 0 HD2 ARG A 59 5.643 7.706 3.821 1.00 10.00 H new ATOM 0 HD3 ARG A 59 4.675 6.592 4.766 1.00 10.00 H new ATOM 0 HE ARG A 59 6.657 5.261 5.210 1.00 10.00 H new ATOM 0 HH11 ARG A 59 7.202 8.376 3.635 1.00 10.00 H new ATOM 0 HH12 ARG A 59 8.916 8.418 4.060 1.00 10.00 H new ATOM 0 HH21 ARG A 59 8.857 5.311 5.730 1.00 10.00 H new ATOM 0 HH22 ARG A 59 9.849 6.689 5.243 1.00 10.00 H new ATOM 603 N VAL A 60 1.035 3.786 3.469 1.00 10.00 N ATOM 604 CA VAL A 60 -0.342 3.782 3.943 1.00 10.00 C ATOM 605 C VAL A 60 -0.496 2.766 5.068 1.00 10.00 C ATOM 606 O VAL A 60 -1.217 2.999 6.037 1.00 10.00 O ATOM 607 CB VAL A 60 -1.327 3.426 2.808 1.00 10.00 C ATOM 608 CG1 VAL A 60 -2.763 3.654 3.251 1.00 10.00 C ATOM 609 CG2 VAL A 60 -1.016 4.226 1.554 1.00 10.00 C ATOM 0 H VAL A 60 1.162 3.387 2.539 1.00 10.00 H new ATOM 0 HA VAL A 60 -0.574 4.784 4.304 1.00 10.00 H new ATOM 0 HB VAL A 60 -1.208 2.368 2.573 1.00 10.00 H new ATOM 0 HG11 VAL A 60 -3.440 3.397 2.436 1.00 10.00 H new ATOM 0 HG12 VAL A 60 -2.981 3.027 4.116 1.00 10.00 H new ATOM 0 HG13 VAL A 60 -2.899 4.702 3.519 1.00 10.00 H new ATOM 0 HG21 VAL A 60 -1.722 3.959 0.768 1.00 10.00 H new ATOM 0 HG22 VAL A 60 -1.100 5.291 1.771 1.00 10.00 H new ATOM 0 HG23 VAL A 60 -0.002 4.003 1.222 1.00 10.00 H new ATOM 611 N LYS A 61 0.202 1.643 4.934 1.00 10.00 N ATOM 612 CA LYS A 61 0.154 0.583 5.933 1.00 10.00 C ATOM 613 C LYS A 61 0.685 1.054 7.280 1.00 10.00 C ATOM 614 O LYS A 61 0.016 0.903 8.304 1.00 10.00 O ATOM 615 CB LYS A 61 0.935 -0.645 5.469 1.00 10.00 C ATOM 616 CG LYS A 61 0.195 -1.514 4.468 1.00 10.00 C ATOM 617 CD LYS A 61 0.830 -2.890 4.370 1.00 10.00 C ATOM 618 CE LYS A 61 0.114 -3.766 3.355 1.00 10.00 C ATOM 619 NZ LYS A 61 -1.299 -4.036 3.730 1.00 10.00 N ATOM 0 H LYS A 61 0.810 1.444 4.140 1.00 10.00 H new ATOM 0 HA LYS A 61 -0.894 0.310 6.056 1.00 10.00 H new ATOM 0 HB2 LYS A 61 1.874 -0.317 5.023 1.00 10.00 H new ATOM 0 HB3 LYS A 61 1.189 -1.250 6.339 1.00 10.00 H new ATOM 0 HG2 LYS A 61 -0.849 -1.611 4.767 1.00 10.00 H new ATOM 0 HG3 LYS A 61 0.203 -1.035 3.489 1.00 10.00 H new ATOM 0 HD2 LYS A 61 1.878 -2.788 4.089 1.00 10.00 H new ATOM 0 HD3 LYS A 61 0.808 -3.372 5.347 1.00 10.00 H new ATOM 0 HE2 LYS A 61 0.141 -3.281 2.379 1.00 10.00 H new ATOM 0 HE3 LYS A 61 0.647 -4.712 3.256 1.00 10.00 H new ATOM 0 HZ1 LYS A 61 -1.691 -4.768 3.103 1.00 10.00 H new ATOM 0 HZ2 LYS A 61 -1.340 -4.366 4.715 1.00 10.00 H new ATOM 0 HZ3 LYS A 61 -1.856 -3.163 3.634 1.00 10.00 H new ATOM 624 N GLU A 62 1.885 1.624 7.278 1.00 10.00 N ATOM 625 CA GLU A 62 2.492 2.114 8.510 1.00 10.00 C ATOM 626 C GLU A 62 1.638 3.207 9.146 1.00 10.00 C ATOM 627 O GLU A 62 1.447 3.228 10.364 1.00 10.00 O ATOM 628 CB GLU A 62 3.943 2.570 8.294 1.00 10.00 C ATOM 629 CG GLU A 62 4.183 3.377 7.027 1.00 10.00 C ATOM 630 CD GLU A 62 5.630 3.344 6.578 1.00 10.00 C ATOM 631 OE1 GLU A 62 6.085 2.284 6.109 1.00 10.00 O ATOM 632 OE2 GLU A 62 6.319 4.379 6.685 1.00 10.00 O ATOM 0 H GLU A 62 2.454 1.758 6.442 1.00 10.00 H new ATOM 0 HA GLU A 62 2.531 1.280 9.211 1.00 10.00 H new ATOM 0 HB2 GLU A 62 4.251 3.168 9.151 1.00 10.00 H new ATOM 0 HB3 GLU A 62 4.585 1.689 8.273 1.00 10.00 H new ATOM 0 HG2 GLU A 62 3.550 2.989 6.229 1.00 10.00 H new ATOM 0 HG3 GLU A 62 3.883 4.411 7.197 1.00 10.00 H new ATOM 634 N LYS A 63 1.104 4.090 8.308 1.00 10.00 N ATOM 635 CA LYS A 63 0.248 5.180 8.765 1.00 10.00 C ATOM 636 C LYS A 63 -0.992 4.617 9.460 1.00 10.00 C ATOM 637 O LYS A 63 -1.390 5.080 10.532 1.00 10.00 O ATOM 638 CB LYS A 63 -0.160 6.050 7.567 1.00 10.00 C ATOM 639 CG LYS A 63 -1.299 7.026 7.832 1.00 10.00 C ATOM 640 CD LYS A 63 -1.611 7.847 6.590 1.00 10.00 C ATOM 641 CE LYS A 63 -2.931 8.588 6.725 1.00 10.00 C ATOM 642 NZ LYS A 63 -3.144 9.548 5.611 1.00 10.00 N ATOM 0 H LYS A 63 1.251 4.071 7.299 1.00 10.00 H new ATOM 0 HA LYS A 63 0.796 5.794 9.480 1.00 10.00 H new ATOM 0 HB2 LYS A 63 0.711 6.615 7.235 1.00 10.00 H new ATOM 0 HB3 LYS A 63 -0.448 5.395 6.744 1.00 10.00 H new ATOM 0 HG2 LYS A 63 -2.188 6.478 8.143 1.00 10.00 H new ATOM 0 HG3 LYS A 63 -1.030 7.690 8.654 1.00 10.00 H new ATOM 0 HD2 LYS A 63 -0.808 8.563 6.415 1.00 10.00 H new ATOM 0 HD3 LYS A 63 -1.649 7.191 5.720 1.00 10.00 H new ATOM 0 HE2 LYS A 63 -3.750 7.869 6.747 1.00 10.00 H new ATOM 0 HE3 LYS A 63 -2.951 9.123 7.674 1.00 10.00 H new ATOM 0 HZ1 LYS A 63 -4.055 10.033 5.740 1.00 10.00 H new ATOM 0 HZ2 LYS A 63 -2.376 10.249 5.606 1.00 10.00 H new ATOM 0 HZ3 LYS A 63 -3.150 9.035 4.707 1.00 10.00 H new ATOM 647 N LYS A 64 -1.583 3.597 8.844 1.00 10.00 N ATOM 648 CA LYS A 64 -2.773 2.950 9.377 1.00 10.00 C ATOM 649 C LYS A 64 -2.496 2.301 10.736 1.00 10.00 C ATOM 650 O LYS A 64 -3.288 2.437 11.674 1.00 10.00 O ATOM 651 CB LYS A 64 -3.289 1.907 8.376 1.00 10.00 C ATOM 652 CG LYS A 64 -4.269 0.898 8.955 1.00 10.00 C ATOM 653 CD LYS A 64 -3.697 -0.510 8.909 1.00 10.00 C ATOM 654 CE LYS A 64 -4.456 -1.436 9.841 1.00 10.00 C ATOM 655 NZ LYS A 64 -4.020 -2.851 9.704 1.00 10.00 N ATOM 0 H LYS A 64 -1.251 3.199 7.966 1.00 10.00 H new ATOM 0 HA LYS A 64 -3.538 3.711 9.528 1.00 10.00 H new ATOM 0 HB2 LYS A 64 -3.771 2.426 7.548 1.00 10.00 H new ATOM 0 HB3 LYS A 64 -2.437 1.368 7.962 1.00 10.00 H new ATOM 0 HG2 LYS A 64 -4.504 1.165 9.985 1.00 10.00 H new ATOM 0 HG3 LYS A 64 -5.204 0.932 8.396 1.00 10.00 H new ATOM 0 HD2 LYS A 64 -3.747 -0.893 7.890 1.00 10.00 H new ATOM 0 HD3 LYS A 64 -2.644 -0.488 9.190 1.00 10.00 H new ATOM 0 HE2 LYS A 64 -4.311 -1.111 10.871 1.00 10.00 H new ATOM 0 HE3 LYS A 64 -5.523 -1.364 9.632 1.00 10.00 H new ATOM 0 HZ1 LYS A 64 -4.565 -3.447 10.359 1.00 10.00 H new ATOM 0 HZ2 LYS A 64 -4.182 -3.171 8.728 1.00 10.00 H new ATOM 0 HZ3 LYS A 64 -3.007 -2.926 9.929 1.00 10.00 H new ATOM 660 N VAL A 65 -1.372 1.596 10.839 1.00 10.00 N ATOM 661 CA VAL A 65 -0.998 0.922 12.082 1.00 10.00 C ATOM 662 C VAL A 65 -0.823 1.927 13.221 1.00 10.00 C ATOM 663 O VAL A 65 -1.306 1.710 14.333 1.00 10.00 O ATOM 664 CB VAL A 65 0.292 0.083 11.913 1.00 10.00 C ATOM 665 CG1 VAL A 65 0.705 -0.547 13.236 1.00 10.00 C ATOM 666 CG2 VAL A 65 0.092 -0.997 10.861 1.00 10.00 C ATOM 0 H VAL A 65 -0.704 1.476 10.078 1.00 10.00 H new ATOM 0 HA VAL A 65 -1.813 0.244 12.334 1.00 10.00 H new ATOM 0 HB VAL A 65 1.088 0.751 11.584 1.00 10.00 H new ATOM 0 HG11 VAL A 65 1.614 -1.132 13.093 1.00 10.00 H new ATOM 0 HG12 VAL A 65 0.890 0.237 13.970 1.00 10.00 H new ATOM 0 HG13 VAL A 65 -0.093 -1.198 13.594 1.00 10.00 H new ATOM 0 HG21 VAL A 65 1.009 -1.577 10.756 1.00 10.00 H new ATOM 0 HG22 VAL A 65 -0.721 -1.656 11.166 1.00 10.00 H new ATOM 0 HG23 VAL A 65 -0.156 -0.533 9.906 1.00 10.00 H new ATOM 668 N ILE A 66 -0.158 3.038 12.920 1.00 10.00 N ATOM 669 CA ILE A 66 0.097 4.088 13.906 1.00 10.00 C ATOM 670 C ILE A 66 -1.207 4.668 14.460 1.00 10.00 C ATOM 671 O ILE A 66 -1.295 5.013 15.640 1.00 10.00 O ATOM 672 CB ILE A 66 0.956 5.225 13.302 1.00 10.00 C ATOM 673 CG1 ILE A 66 2.362 4.712 12.977 1.00 10.00 C ATOM 674 CG2 ILE A 66 1.035 6.424 14.238 1.00 10.00 C ATOM 675 CD1 ILE A 66 3.194 5.681 12.168 1.00 10.00 C ATOM 0 H ILE A 66 0.218 3.237 11.993 1.00 10.00 H new ATOM 0 HA ILE A 66 0.647 3.626 14.726 1.00 10.00 H new ATOM 0 HB ILE A 66 0.474 5.553 12.381 1.00 10.00 H new ATOM 0 HG12 ILE A 66 2.882 4.491 13.909 1.00 10.00 H new ATOM 0 HG13 ILE A 66 2.278 3.774 12.429 1.00 10.00 H new ATOM 0 HG21 ILE A 66 1.646 7.203 13.781 1.00 10.00 H new ATOM 0 HG22 ILE A 66 0.032 6.810 14.420 1.00 10.00 H new ATOM 0 HG23 ILE A 66 1.484 6.119 15.183 1.00 10.00 H new ATOM 0 HD11 ILE A 66 4.176 5.247 11.978 1.00 10.00 H new ATOM 0 HD12 ILE A 66 2.697 5.884 11.219 1.00 10.00 H new ATOM 0 HD13 ILE A 66 3.310 6.612 12.723 1.00 10.00 H new ATOM 677 N ASN A 67 -2.221 4.756 13.613 1.00 10.00 N ATOM 678 CA ASN A 67 -3.507 5.307 14.025 1.00 10.00 C ATOM 679 C ASN A 67 -4.342 4.298 14.817 1.00 10.00 C ATOM 680 O ASN A 67 -5.017 4.656 15.781 1.00 10.00 O ATOM 681 CB ASN A 67 -4.287 5.832 12.815 1.00 10.00 C ATOM 682 CG ASN A 67 -5.264 6.933 13.186 1.00 10.00 C ATOM 683 OD1 ASN A 67 -5.081 7.626 14.186 1.00 10.00 O ATOM 684 ND2 ASN A 67 -6.301 7.106 12.380 1.00 10.00 N ATOM 0 H ASN A 67 -2.181 4.455 12.639 1.00 10.00 H new ATOM 0 HA ASN A 67 -3.299 6.143 14.693 1.00 10.00 H new ATOM 0 HB2 ASN A 67 -3.586 6.209 12.070 1.00 10.00 H new ATOM 0 HB3 ASN A 67 -4.831 5.009 12.352 1.00 10.00 H new ATOM 0 HD21 ASN A 67 -6.985 7.836 12.579 1.00 10.00 H new ATOM 0 HD22 ASN A 67 -6.415 6.509 11.561 1.00 10.00 H new ATOM 688 N LYS A 68 -4.269 3.033 14.430 1.00 10.00 N ATOM 689 CA LYS A 68 -5.034 1.983 15.101 1.00 10.00 C ATOM 690 C LYS A 68 -4.435 1.607 16.455 1.00 10.00 C ATOM 691 O LYS A 68 -5.159 1.230 17.380 1.00 10.00 O ATOM 692 CB LYS A 68 -5.154 0.742 14.214 1.00 10.00 C ATOM 693 CG LYS A 68 -6.570 0.201 14.107 1.00 10.00 C ATOM 694 CD LYS A 68 -7.444 1.122 13.271 1.00 10.00 C ATOM 695 CE LYS A 68 -8.863 0.595 13.156 1.00 10.00 C ATOM 696 NZ LYS A 68 -9.518 1.059 11.906 1.00 10.00 N ATOM 0 H LYS A 68 -3.690 2.705 13.657 1.00 10.00 H new ATOM 0 HA LYS A 68 -6.030 2.387 15.282 1.00 10.00 H new ATOM 0 HB2 LYS A 68 -4.791 0.984 13.215 1.00 10.00 H new ATOM 0 HB3 LYS A 68 -4.505 -0.040 14.609 1.00 10.00 H new ATOM 0 HG2 LYS A 68 -6.550 -0.793 13.659 1.00 10.00 H new ATOM 0 HG3 LYS A 68 -6.998 0.093 15.104 1.00 10.00 H new ATOM 0 HD2 LYS A 68 -7.460 2.115 13.719 1.00 10.00 H new ATOM 0 HD3 LYS A 68 -7.013 1.228 12.275 1.00 10.00 H new ATOM 0 HE2 LYS A 68 -8.850 -0.495 13.178 1.00 10.00 H new ATOM 0 HE3 LYS A 68 -9.445 0.924 14.017 1.00 10.00 H new ATOM 0 HZ1 LYS A 68 -10.486 0.681 11.860 1.00 10.00 H new ATOM 0 HZ2 LYS A 68 -9.552 2.098 11.897 1.00 10.00 H new ATOM 0 HZ3 LYS A 68 -8.976 0.723 11.085 1.00 10.00 H new ATOM 701 N LEU A 69 -3.117 1.730 16.570 1.00 10.00 N ATOM 702 CA LEU A 69 -2.406 1.391 17.805 1.00 10.00 C ATOM 703 C LEU A 69 -2.818 2.269 18.983 1.00 10.00 C ATOM 704 O LEU A 69 -2.489 1.974 20.133 1.00 10.00 O ATOM 705 CB LEU A 69 -0.894 1.451 17.594 1.00 10.00 C ATOM 706 CG LEU A 69 -0.166 0.104 17.578 1.00 10.00 C ATOM 707 CD1 LEU A 69 -0.865 -0.875 16.647 1.00 10.00 C ATOM 708 CD2 LEU A 69 1.288 0.282 17.173 1.00 10.00 C ATOM 0 H LEU A 69 -2.513 2.064 15.819 1.00 10.00 H new ATOM 0 HA LEU A 69 -2.689 0.369 18.058 1.00 10.00 H new ATOM 0 HB2 LEU A 69 -0.699 1.959 16.649 1.00 10.00 H new ATOM 0 HB3 LEU A 69 -0.461 2.067 18.382 1.00 10.00 H new ATOM 0 HG LEU A 69 -0.191 -0.307 18.587 1.00 10.00 H new ATOM 0 HD11 LEU A 69 -0.331 -1.825 16.651 1.00 10.00 H new ATOM 0 HD12 LEU A 69 -1.889 -1.033 16.987 1.00 10.00 H new ATOM 0 HD13 LEU A 69 -0.877 -0.470 15.635 1.00 10.00 H new ATOM 0 HD21 LEU A 69 1.786 -0.688 17.168 1.00 10.00 H new ATOM 0 HD22 LEU A 69 1.337 0.720 16.176 1.00 10.00 H new ATOM 0 HD23 LEU A 69 1.786 0.942 17.884 1.00 10.00 H new ATOM 710 N LYS A 70 -3.533 3.348 18.698 1.00 10.00 N ATOM 711 CA LYS A 70 -3.993 4.248 19.743 1.00 10.00 C ATOM 712 C LYS A 70 -5.122 3.603 20.539 1.00 10.00 C ATOM 713 O LYS A 70 -5.166 3.712 21.762 1.00 10.00 O ATOM 714 CB LYS A 70 -4.452 5.577 19.146 1.00 10.00 C ATOM 715 CG LYS A 70 -3.432 6.214 18.220 1.00 10.00 C ATOM 716 CD LYS A 70 -3.929 7.541 17.675 1.00 10.00 C ATOM 717 CE LYS A 70 -3.059 8.029 16.529 1.00 10.00 C ATOM 718 NZ LYS A 70 -1.612 7.997 16.873 1.00 10.00 N ATOM 0 H LYS A 70 -3.806 3.620 17.754 1.00 10.00 H new ATOM 0 HA LYS A 70 -3.160 4.446 20.418 1.00 10.00 H new ATOM 0 HB2 LYS A 70 -5.379 5.417 18.596 1.00 10.00 H new ATOM 0 HB3 LYS A 70 -4.677 6.271 19.956 1.00 10.00 H new ATOM 0 HG2 LYS A 70 -2.496 6.368 18.758 1.00 10.00 H new ATOM 0 HG3 LYS A 70 -3.217 5.537 17.393 1.00 10.00 H new ATOM 0 HD2 LYS A 70 -4.958 7.433 17.332 1.00 10.00 H new ATOM 0 HD3 LYS A 70 -3.935 8.285 18.472 1.00 10.00 H new ATOM 0 HE2 LYS A 70 -3.236 7.409 15.650 1.00 10.00 H new ATOM 0 HE3 LYS A 70 -3.346 9.047 16.264 1.00 10.00 H new ATOM 0 HZ1 LYS A 70 -1.121 8.770 16.381 1.00 10.00 H new ATOM 0 HZ2 LYS A 70 -1.497 8.112 17.900 1.00 10.00 H new ATOM 0 HZ3 LYS A 70 -1.205 7.086 16.579 1.00 10.00 H new ATOM 723 N THR A 71 -6.025 2.921 19.825 1.00 10.00 N ATOM 724 CA THR A 71 -7.163 2.235 20.443 1.00 10.00 C ATOM 725 C THR A 71 -7.973 3.174 21.343 1.00 10.00 C ATOM 726 O THR A 71 -7.916 3.087 22.573 1.00 10.00 O ATOM 727 CB THR A 71 -6.706 0.994 21.238 1.00 10.00 C ATOM 728 OG1 THR A 71 -5.679 0.310 20.497 1.00 10.00 O ATOM 729 CG2 THR A 71 -7.870 0.039 21.463 1.00 10.00 C ATOM 0 H THR A 71 -5.987 2.830 18.810 1.00 10.00 H new ATOM 0 HA THR A 71 -7.812 1.905 19.631 1.00 10.00 H new ATOM 0 HB THR A 71 -6.325 1.321 22.206 1.00 10.00 H new ATOM 0 HG1 THR A 71 -5.384 -0.479 20.998 1.00 10.00 H new ATOM 0 HG21 THR A 71 -7.525 -0.829 22.025 1.00 10.00 H new ATOM 0 HG22 THR A 71 -8.654 0.547 22.024 1.00 10.00 H new ATOM 0 HG23 THR A 71 -8.265 -0.286 20.501 1.00 10.00 H new ATOM 732 N THR A 72 -8.726 4.072 20.721 1.00 10.00 N ATOM 733 CA THR A 72 -9.530 5.032 21.454 1.00 10.00 C ATOM 734 C THR A 72 -10.951 5.109 20.885 1.00 10.00 C ATOM 735 O THR A 72 -11.643 6.119 21.025 1.00 10.00 O ATOM 736 CB THR A 72 -8.857 6.425 21.452 1.00 10.00 C ATOM 737 OG1 THR A 72 -9.570 7.332 22.308 1.00 10.00 O ATOM 738 CG2 THR A 72 -8.763 6.996 20.043 1.00 10.00 C ATOM 0 H THR A 72 -8.794 4.153 19.707 1.00 10.00 H new ATOM 0 HA THR A 72 -9.603 4.692 22.487 1.00 10.00 H new ATOM 0 HB THR A 72 -7.844 6.302 21.834 1.00 10.00 H new ATOM 0 HG1 THR A 72 -10.534 7.230 22.162 1.00 10.00 H new ATOM 0 HG21 THR A 72 -8.285 7.975 20.078 1.00 10.00 H new ATOM 0 HG22 THR A 72 -8.172 6.326 19.418 1.00 10.00 H new ATOM 0 HG23 THR A 72 -9.764 7.096 19.623 1.00 10.00 H new ATOM 741 N SER A 73 -11.384 4.027 20.256 1.00 10.00 N ATOM 742 CA SER A 73 -12.715 3.958 19.674 1.00 10.00 C ATOM 743 C SER A 73 -13.402 2.669 20.113 1.00 10.00 C ATOM 744 O SER A 73 -14.635 2.675 20.301 1.00 10.00 O ATOM 745 CB SER A 73 -12.626 4.026 18.147 1.00 10.00 C ATOM 746 OG SER A 73 -11.762 5.078 17.735 1.00 10.00 O ATOM 747 OXT SER A 73 -12.692 1.656 20.293 1.00 10.00 O ATOM 0 H SER A 73 -10.829 3.180 20.135 1.00 10.00 H new ATOM 0 HA SER A 73 -13.304 4.806 20.022 1.00 10.00 H new ATOM 0 HB2 SER A 73 -12.260 3.076 17.757 1.00 10.00 H new ATOM 0 HB3 SER A 73 -13.620 4.181 17.727 1.00 10.00 H new ATOM 0 HG SER A 73 -11.719 5.102 16.756 1.00 10.00 H new