USER MOD reduce.3.24.130724 H: found=0, std=0, add=834, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 832 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 84 ASN : amide:sc= 0.207 K(o=0.86,f=0.033) USER MOD Set 1.2: A 102 THR OG1 : rot -50:sc= 0.658 USER MOD Set 2.1: A 81 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 82 ASN : amide:sc= -4.05! C(o=-4!,f=-4.1!) USER MOD Set 3.1: A 63 HIS : no HD1:sc= -5.02! K(o=-8.1!,f=-6.1) USER MOD Set 3.2: A 79 TYR OH : rot -147:sc= -3.13! USER MOD Set 4.1: A 5 SER OG : rot 180:sc= -0.474 USER MOD Set 4.2: A 14 HIS : no HD1:sc= -13.6! C(o=-14!,f=-15!) USER MOD Single : A 1 VAL N :NH3+ -151:sc= -1.53! (180deg=-2.59!) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 8 SER OG : rot 60:sc= 1.11 USER MOD Single : A 10 SER OG : rot -42:sc= 0.429 USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 ASN : amide:sc= -1.29 K(o=-1.3,f=-0.078) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 15:sc= -0.661 USER MOD Single : A 22 THR OG1 : rot 49:sc= -0.574! USER MOD Single : A 25 SER OG : rot -105:sc= -0.367! USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.146 USER MOD Single : A 29 TYR OH : rot 180:sc= -1.27 USER MOD Single : A 30 SER OG : rot 180:sc= 0.115 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0.0897 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -50:sc= -6.67! USER MOD Single : A 40 ASN : amide:sc= -0.183 X(o=-0.18,f=-0.042) USER MOD Single : A 41 SER OG : rot 61:sc= 0.198 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot -95:sc= -0.129 USER MOD Single : A 55 THR OG1 : rot -81:sc= -5.28! USER MOD Single : A 57 GLN : amide:sc= -1.06 K(o=-1.1,f=-0.4) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.0104 USER MOD Single : A 67 SER OG : rot -34:sc= 0.812 USER MOD Single : A 68 ASN : amide:sc= -2.72! C(o=-2.7!,f=-6.3!) USER MOD Single : A 70 TYR OH : rot 180:sc= -0.0423 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot -155:sc= -0.0079 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0.0208 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot -70:sc= 1.06 USER MOD Single : A 98 SER OG : rot -108:sc= -2.19! USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot -5:sc= 0.815 USER MOD Single : A 101 SER OG : rot 92:sc= -0.0515 USER MOD Single : A 104 SER OG : rot 180:sc= -0.13 USER MOD Single : A 107 ASN : amide:sc= -1.02 X(o=-1,f=-0.88) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.697 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 -18.888 32.628 14.192 1.00 0.00 N ATOM 2 CA VAL A 1 -18.583 31.850 12.956 1.00 0.00 C ATOM 3 C VAL A 1 -17.127 31.374 12.975 1.00 0.00 C ATOM 4 O VAL A 1 -16.283 31.954 13.629 1.00 0.00 O ATOM 5 CB VAL A 1 -18.811 32.828 11.803 1.00 0.00 C ATOM 6 CG1 VAL A 1 -20.190 33.476 11.944 1.00 0.00 C ATOM 7 CG2 VAL A 1 -17.733 33.913 11.836 1.00 0.00 C ATOM 0 H1 VAL A 1 -19.897 32.528 14.425 1.00 0.00 H new ATOM 0 H2 VAL A 1 -18.313 32.267 14.980 1.00 0.00 H new ATOM 0 H3 VAL A 1 -18.667 33.632 14.034 1.00 0.00 H new ATOM 0 HA VAL A 1 -19.207 30.961 12.865 1.00 0.00 H new ATOM 0 HB VAL A 1 -18.759 32.290 10.856 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -20.350 34.173 11.121 1.00 0.00 H new ATOM 0 HG12 VAL A 1 -20.959 32.704 11.921 1.00 0.00 H new ATOM 0 HG13 VAL A 1 -20.244 34.014 12.891 1.00 0.00 H new ATOM 0 HG21 VAL A 1 -17.894 34.611 11.015 1.00 0.00 H new ATOM 0 HG22 VAL A 1 -17.785 34.449 12.784 1.00 0.00 H new ATOM 0 HG23 VAL A 1 -16.750 33.453 11.733 1.00 0.00 H new ATOM 19 N LYS A 2 -16.828 30.324 12.260 1.00 0.00 N ATOM 20 CA LYS A 2 -15.427 29.812 12.235 1.00 0.00 C ATOM 21 C LYS A 2 -14.955 29.641 10.788 1.00 0.00 C ATOM 22 O LYS A 2 -15.730 29.732 9.858 1.00 0.00 O ATOM 23 CB LYS A 2 -15.487 28.459 12.946 1.00 0.00 C ATOM 24 CG LYS A 2 -16.344 27.487 12.131 1.00 0.00 C ATOM 25 CD LYS A 2 -17.779 27.500 12.663 1.00 0.00 C ATOM 26 CE LYS A 2 -18.294 26.064 12.778 1.00 0.00 C ATOM 27 NZ LYS A 2 -19.758 26.195 13.023 1.00 0.00 N ATOM 0 H LYS A 2 -17.492 29.798 11.692 1.00 0.00 H new ATOM 0 HA LYS A 2 -14.727 30.494 12.719 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -14.481 28.057 13.070 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -15.907 28.580 13.945 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -16.333 27.770 11.079 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -15.931 26.480 12.194 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -17.813 27.989 13.637 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -18.420 28.075 11.995 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -18.096 25.500 11.867 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -17.804 25.533 13.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -20.181 25.249 13.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -19.917 26.730 13.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -20.200 26.697 12.227 1.00 0.00 H new ATOM 41 N CYS A 3 -13.688 29.393 10.591 1.00 0.00 N ATOM 42 CA CYS A 3 -13.170 29.215 9.203 1.00 0.00 C ATOM 43 C CYS A 3 -12.233 28.009 9.138 1.00 0.00 C ATOM 44 O CYS A 3 -11.056 28.111 9.424 1.00 0.00 O ATOM 45 CB CYS A 3 -12.397 30.498 8.899 1.00 0.00 C ATOM 46 SG CYS A 3 -13.453 31.645 7.983 1.00 0.00 S ATOM 0 H CYS A 3 -12.990 29.306 11.330 1.00 0.00 H new ATOM 0 HA CYS A 3 -13.972 29.038 8.487 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -12.062 30.960 9.827 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -11.505 30.267 8.317 1.00 0.00 H new ATOM 51 N GLN A 4 -12.736 26.869 8.754 1.00 0.00 N ATOM 52 CA GLN A 4 -11.857 25.671 8.664 1.00 0.00 C ATOM 53 C GLN A 4 -10.918 25.817 7.469 1.00 0.00 C ATOM 54 O GLN A 4 -11.006 26.761 6.709 1.00 0.00 O ATOM 55 CB GLN A 4 -12.803 24.487 8.463 1.00 0.00 C ATOM 56 CG GLN A 4 -13.622 24.263 9.736 1.00 0.00 C ATOM 57 CD GLN A 4 -15.110 24.429 9.421 1.00 0.00 C ATOM 58 OE1 GLN A 4 -15.741 25.358 9.885 1.00 0.00 O ATOM 59 NE2 GLN A 4 -15.701 23.563 8.645 1.00 0.00 N ATOM 0 H GLN A 4 -13.712 26.716 8.500 1.00 0.00 H new ATOM 0 HA GLN A 4 -11.239 25.540 9.552 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -13.467 24.678 7.620 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -12.233 23.590 8.223 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -13.432 23.266 10.132 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -13.321 24.974 10.505 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -15.172 22.783 8.255 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -16.692 23.666 8.428 1.00 0.00 H new ATOM 68 N SER A 5 -10.022 24.892 7.296 1.00 0.00 N ATOM 69 CA SER A 5 -9.078 24.981 6.147 1.00 0.00 C ATOM 70 C SER A 5 -9.858 25.224 4.852 1.00 0.00 C ATOM 71 O SER A 5 -10.904 24.643 4.640 1.00 0.00 O ATOM 72 CB SER A 5 -8.368 23.629 6.113 1.00 0.00 C ATOM 73 OG SER A 5 -8.897 22.846 5.051 1.00 0.00 O ATOM 0 H SER A 5 -9.900 24.078 7.898 1.00 0.00 H new ATOM 0 HA SER A 5 -8.369 25.803 6.248 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.296 23.772 5.976 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.501 23.111 7.063 1.00 0.00 H new ATOM 0 HG SER A 5 -8.442 21.978 5.026 1.00 0.00 H new ATOM 79 N PRO A 6 -9.324 26.085 4.030 1.00 0.00 N ATOM 80 CA PRO A 6 -9.983 26.419 2.743 1.00 0.00 C ATOM 81 C PRO A 6 -9.933 25.225 1.791 1.00 0.00 C ATOM 82 O PRO A 6 -9.082 24.371 1.913 1.00 0.00 O ATOM 83 CB PRO A 6 -9.149 27.579 2.209 1.00 0.00 C ATOM 84 CG PRO A 6 -7.812 27.412 2.846 1.00 0.00 C ATOM 85 CD PRO A 6 -8.068 26.822 4.211 1.00 0.00 C ATOM 0 HA PRO A 6 -11.037 26.672 2.852 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -9.076 27.546 1.122 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -9.594 28.539 2.470 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -7.176 26.756 2.251 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -7.296 28.369 2.926 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -7.257 26.164 4.523 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -8.162 27.596 4.973 1.00 0.00 H new ATOM 93 N PRO A 7 -10.852 25.208 0.869 1.00 0.00 N ATOM 94 CA PRO A 7 -10.912 24.105 -0.117 1.00 0.00 C ATOM 95 C PRO A 7 -9.812 24.273 -1.166 1.00 0.00 C ATOM 96 O PRO A 7 -9.188 25.311 -1.264 1.00 0.00 O ATOM 97 CB PRO A 7 -12.289 24.264 -0.749 1.00 0.00 C ATOM 98 CG PRO A 7 -12.641 25.708 -0.565 1.00 0.00 C ATOM 99 CD PRO A 7 -11.911 26.200 0.661 1.00 0.00 C ATOM 0 HA PRO A 7 -10.764 23.121 0.329 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -12.271 23.995 -1.805 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -13.021 23.616 -0.267 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -12.352 26.288 -1.442 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -13.718 25.828 -0.444 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -11.498 27.197 0.506 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -12.575 26.261 1.523 1.00 0.00 H new ATOM 107 N SER A 8 -9.574 23.264 -1.955 1.00 0.00 N ATOM 108 CA SER A 8 -8.517 23.376 -3.001 1.00 0.00 C ATOM 109 C SER A 8 -9.073 24.114 -4.219 1.00 0.00 C ATOM 110 O SER A 8 -9.774 23.547 -5.034 1.00 0.00 O ATOM 111 CB SER A 8 -8.149 21.939 -3.361 1.00 0.00 C ATOM 112 OG SER A 8 -9.244 21.327 -4.030 1.00 0.00 O ATOM 0 H SER A 8 -10.063 22.369 -1.923 1.00 0.00 H new ATOM 0 HA SER A 8 -7.647 23.934 -2.655 1.00 0.00 H new ATOM 0 HB2 SER A 8 -7.265 21.927 -3.999 1.00 0.00 H new ATOM 0 HB3 SER A 8 -7.899 21.379 -2.460 1.00 0.00 H new ATOM 0 HG SER A 8 -9.453 21.831 -4.844 1.00 0.00 H new ATOM 118 N ILE A 9 -8.780 25.379 -4.336 1.00 0.00 N ATOM 119 CA ILE A 9 -9.304 26.167 -5.493 1.00 0.00 C ATOM 120 C ILE A 9 -9.024 25.484 -6.813 1.00 0.00 C ATOM 121 O ILE A 9 -8.616 24.342 -6.881 1.00 0.00 O ATOM 122 CB ILE A 9 -8.592 27.514 -5.475 1.00 0.00 C ATOM 123 CG1 ILE A 9 -7.162 27.364 -4.949 1.00 0.00 C ATOM 124 CG2 ILE A 9 -9.380 28.466 -4.602 1.00 0.00 C ATOM 125 CD1 ILE A 9 -6.210 28.131 -5.867 1.00 0.00 C ATOM 0 H ILE A 9 -8.200 25.904 -3.681 1.00 0.00 H new ATOM 0 HA ILE A 9 -10.385 26.269 -5.399 1.00 0.00 H new ATOM 0 HB ILE A 9 -8.532 27.908 -6.490 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -7.093 27.747 -3.931 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -6.883 26.311 -4.913 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -8.882 29.435 -4.579 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -10.385 28.584 -5.007 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -9.441 28.066 -3.590 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -5.189 28.029 -5.499 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -6.274 27.726 -6.877 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -6.488 29.185 -5.880 1.00 0.00 H new ATOM 137 N SER A 10 -9.264 26.197 -7.868 1.00 0.00 N ATOM 138 CA SER A 10 -9.047 25.633 -9.214 1.00 0.00 C ATOM 139 C SER A 10 -7.578 25.244 -9.421 1.00 0.00 C ATOM 140 O SER A 10 -6.697 26.077 -9.415 1.00 0.00 O ATOM 141 CB SER A 10 -9.458 26.743 -10.180 1.00 0.00 C ATOM 142 OG SER A 10 -8.293 27.345 -10.729 1.00 0.00 O ATOM 0 H SER A 10 -9.605 27.158 -7.853 1.00 0.00 H new ATOM 0 HA SER A 10 -9.624 24.722 -9.369 1.00 0.00 H new ATOM 0 HB2 SER A 10 -10.080 26.335 -10.977 1.00 0.00 H new ATOM 0 HB3 SER A 10 -10.056 27.491 -9.659 1.00 0.00 H new ATOM 0 HG SER A 10 -7.624 27.467 -10.023 1.00 0.00 H new ATOM 148 N ASN A 11 -7.316 23.980 -9.618 1.00 0.00 N ATOM 149 CA ASN A 11 -5.910 23.527 -9.842 1.00 0.00 C ATOM 150 C ASN A 11 -4.946 24.221 -8.875 1.00 0.00 C ATOM 151 O ASN A 11 -3.875 24.649 -9.257 1.00 0.00 O ATOM 152 CB ASN A 11 -5.596 23.923 -11.284 1.00 0.00 C ATOM 153 CG ASN A 11 -6.511 23.149 -12.236 1.00 0.00 C ATOM 154 OD1 ASN A 11 -7.281 23.736 -12.968 1.00 0.00 O ATOM 155 ND2 ASN A 11 -6.459 21.845 -12.255 1.00 0.00 N ATOM 0 H ASN A 11 -8.016 23.238 -9.634 1.00 0.00 H new ATOM 0 HA ASN A 11 -5.798 22.456 -9.671 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -5.738 24.995 -11.417 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -4.552 23.709 -11.512 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -7.065 21.320 -12.885 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -5.812 21.351 -11.640 1.00 0.00 H new ATOM 162 N GLY A 12 -5.308 24.327 -7.626 1.00 0.00 N ATOM 163 CA GLY A 12 -4.399 24.985 -6.642 1.00 0.00 C ATOM 164 C GLY A 12 -4.772 24.535 -5.229 1.00 0.00 C ATOM 165 O GLY A 12 -5.933 24.416 -4.890 1.00 0.00 O ATOM 0 H GLY A 12 -6.191 23.988 -7.244 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -3.362 24.725 -6.857 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -4.479 26.069 -6.724 1.00 0.00 H new ATOM 169 N ARG A 13 -3.797 24.275 -4.403 1.00 0.00 N ATOM 170 CA ARG A 13 -4.097 23.825 -3.014 1.00 0.00 C ATOM 171 C ARG A 13 -4.072 25.000 -2.045 1.00 0.00 C ATOM 172 O ARG A 13 -4.041 26.151 -2.430 1.00 0.00 O ATOM 173 CB ARG A 13 -2.990 22.831 -2.669 1.00 0.00 C ATOM 174 CG ARG A 13 -3.540 21.406 -2.762 1.00 0.00 C ATOM 175 CD ARG A 13 -2.426 20.454 -3.203 1.00 0.00 C ATOM 176 NE ARG A 13 -2.879 19.914 -4.514 1.00 0.00 N ATOM 177 CZ ARG A 13 -2.642 18.668 -4.823 1.00 0.00 C ATOM 178 NH1 ARG A 13 -3.203 17.707 -4.140 1.00 0.00 N ATOM 179 NH2 ARG A 13 -1.843 18.383 -5.814 1.00 0.00 N ATOM 0 H ARG A 13 -2.806 24.354 -4.629 1.00 0.00 H new ATOM 0 HA ARG A 13 -5.089 23.380 -2.940 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -2.150 22.954 -3.352 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -2.614 23.023 -1.664 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -3.937 21.095 -1.796 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -4.366 21.370 -3.473 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -1.475 20.977 -3.299 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -2.279 19.655 -2.476 1.00 0.00 H new ATOM 0 HE ARG A 13 -3.374 20.517 -5.171 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -3.827 17.930 -3.364 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -3.017 16.734 -4.382 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -1.404 19.134 -6.347 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -1.657 17.410 -6.056 1.00 0.00 H new ATOM 193 N HIS A 14 -4.096 24.699 -0.785 1.00 0.00 N ATOM 194 CA HIS A 14 -4.083 25.768 0.254 1.00 0.00 C ATOM 195 C HIS A 14 -3.365 25.263 1.509 1.00 0.00 C ATOM 196 O HIS A 14 -3.757 24.279 2.103 1.00 0.00 O ATOM 197 CB HIS A 14 -5.555 26.037 0.542 1.00 0.00 C ATOM 198 CG HIS A 14 -6.134 24.894 1.327 1.00 0.00 C ATOM 199 ND1 HIS A 14 -6.274 24.951 2.701 1.00 0.00 N ATOM 200 CD2 HIS A 14 -6.652 23.683 0.946 1.00 0.00 C ATOM 201 CE1 HIS A 14 -6.869 23.817 3.096 1.00 0.00 C ATOM 202 NE2 HIS A 14 -7.117 23.001 2.067 1.00 0.00 N ATOM 0 H HIS A 14 -4.124 23.747 -0.420 1.00 0.00 H new ATOM 0 HA HIS A 14 -3.560 26.668 -0.068 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -5.662 26.966 1.101 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -6.101 26.163 -0.393 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -6.693 23.315 -0.068 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -7.118 23.590 4.122 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -7.552 22.079 2.097 1.00 0.00 H new ATOM 210 N ASN A 15 -2.311 25.919 1.914 1.00 0.00 N ATOM 211 CA ASN A 15 -1.573 25.457 3.125 1.00 0.00 C ATOM 212 C ASN A 15 -1.653 26.503 4.241 1.00 0.00 C ATOM 213 O ASN A 15 -2.318 26.306 5.239 1.00 0.00 O ATOM 214 CB ASN A 15 -0.127 25.272 2.655 1.00 0.00 C ATOM 215 CG ASN A 15 0.635 24.398 3.654 1.00 0.00 C ATOM 216 OD1 ASN A 15 1.149 23.358 3.297 1.00 0.00 O ATOM 217 ND2 ASN A 15 0.730 24.779 4.899 1.00 0.00 N ATOM 0 H ASN A 15 -1.931 26.750 1.462 1.00 0.00 H new ATOM 0 HA ASN A 15 -1.991 24.538 3.536 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -0.112 24.810 1.668 1.00 0.00 H new ATOM 0 HB3 ASN A 15 0.361 26.242 2.560 1.00 0.00 H new ATOM 0 HD21 ASN A 15 1.236 24.203 5.571 1.00 0.00 H new ATOM 0 HD22 ASN A 15 0.298 25.653 5.199 1.00 0.00 H new ATOM 224 N GLY A 16 -0.980 27.610 4.087 1.00 0.00 N ATOM 225 CA GLY A 16 -1.022 28.657 5.146 1.00 0.00 C ATOM 226 C GLY A 16 -0.150 28.225 6.329 1.00 0.00 C ATOM 227 O GLY A 16 1.052 28.399 6.320 1.00 0.00 O ATOM 0 H GLY A 16 -0.404 27.834 3.276 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -0.667 29.607 4.747 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -2.049 28.814 5.476 1.00 0.00 H new ATOM 231 N TYR A 17 -0.745 27.664 7.348 1.00 0.00 N ATOM 232 CA TYR A 17 0.057 27.225 8.528 1.00 0.00 C ATOM 233 C TYR A 17 -0.850 26.603 9.594 1.00 0.00 C ATOM 234 O TYR A 17 -0.575 26.683 10.775 1.00 0.00 O ATOM 235 CB TYR A 17 0.708 28.503 9.060 1.00 0.00 C ATOM 236 CG TYR A 17 2.181 28.265 9.289 1.00 0.00 C ATOM 237 CD1 TYR A 17 2.605 27.163 10.042 1.00 0.00 C ATOM 238 CD2 TYR A 17 3.124 29.148 8.750 1.00 0.00 C ATOM 239 CE1 TYR A 17 3.972 26.945 10.255 1.00 0.00 C ATOM 240 CE2 TYR A 17 4.490 28.929 8.963 1.00 0.00 C ATOM 241 CZ TYR A 17 4.915 27.828 9.716 1.00 0.00 C ATOM 242 OH TYR A 17 6.262 27.613 9.926 1.00 0.00 O ATOM 0 H TYR A 17 -1.748 27.491 7.415 1.00 0.00 H new ATOM 0 HA TYR A 17 0.794 26.467 8.263 1.00 0.00 H new ATOM 0 HB2 TYR A 17 0.567 29.317 8.349 1.00 0.00 H new ATOM 0 HB3 TYR A 17 0.229 28.806 9.991 1.00 0.00 H new ATOM 0 HD1 TYR A 17 1.878 26.481 10.458 1.00 0.00 H new ATOM 0 HD2 TYR A 17 2.798 29.998 8.170 1.00 0.00 H new ATOM 0 HE1 TYR A 17 4.299 26.095 10.836 1.00 0.00 H new ATOM 0 HE2 TYR A 17 5.217 29.610 8.546 1.00 0.00 H new ATOM 0 HH TYR A 17 6.779 28.318 9.483 1.00 0.00 H new ATOM 252 N GLU A 18 -1.928 25.985 9.194 1.00 0.00 N ATOM 253 CA GLU A 18 -2.842 25.364 10.196 1.00 0.00 C ATOM 254 C GLU A 18 -4.049 24.731 9.503 1.00 0.00 C ATOM 255 O GLU A 18 -4.105 24.632 8.294 1.00 0.00 O ATOM 256 CB GLU A 18 -3.290 26.516 11.095 1.00 0.00 C ATOM 257 CG GLU A 18 -3.750 27.694 10.232 1.00 0.00 C ATOM 258 CD GLU A 18 -3.026 28.964 10.680 1.00 0.00 C ATOM 259 OE1 GLU A 18 -1.813 29.007 10.555 1.00 0.00 O ATOM 260 OE2 GLU A 18 -3.696 29.873 11.141 1.00 0.00 O ATOM 0 H GLU A 18 -2.215 25.883 8.221 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.349 24.571 10.759 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.102 26.189 11.744 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.469 26.825 11.742 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.540 27.494 9.181 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -4.828 27.826 10.322 1.00 0.00 H new ATOM 267 N ASP A 19 -5.019 24.306 10.265 1.00 0.00 N ATOM 268 CA ASP A 19 -6.227 23.684 9.657 1.00 0.00 C ATOM 269 C ASP A 19 -7.405 24.658 9.719 1.00 0.00 C ATOM 270 O ASP A 19 -8.066 24.911 8.732 1.00 0.00 O ATOM 271 CB ASP A 19 -6.506 22.445 10.508 1.00 0.00 C ATOM 272 CG ASP A 19 -5.589 21.305 10.063 1.00 0.00 C ATOM 273 OD1 ASP A 19 -4.390 21.425 10.258 1.00 0.00 O ATOM 274 OD2 ASP A 19 -6.099 20.332 9.533 1.00 0.00 O ATOM 0 H ASP A 19 -5.026 24.363 11.283 1.00 0.00 H new ATOM 0 HA ASP A 19 -6.080 23.429 8.607 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -6.340 22.669 11.562 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -7.550 22.148 10.406 1.00 0.00 H new ATOM 279 N PHE A 20 -7.672 25.210 10.872 1.00 0.00 N ATOM 280 CA PHE A 20 -8.807 26.169 10.993 1.00 0.00 C ATOM 281 C PHE A 20 -8.333 27.592 10.689 1.00 0.00 C ATOM 282 O PHE A 20 -7.229 27.804 10.230 1.00 0.00 O ATOM 283 CB PHE A 20 -9.274 26.054 12.443 1.00 0.00 C ATOM 284 CG PHE A 20 -10.474 25.141 12.511 1.00 0.00 C ATOM 285 CD1 PHE A 20 -10.324 23.772 12.263 1.00 0.00 C ATOM 286 CD2 PHE A 20 -11.737 25.663 12.819 1.00 0.00 C ATOM 287 CE1 PHE A 20 -11.435 22.923 12.324 1.00 0.00 C ATOM 288 CE2 PHE A 20 -12.848 24.814 12.880 1.00 0.00 C ATOM 289 CZ PHE A 20 -12.697 23.444 12.632 1.00 0.00 C ATOM 0 H PHE A 20 -7.154 25.039 11.734 1.00 0.00 H new ATOM 0 HA PHE A 20 -9.610 25.947 10.290 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -8.470 25.663 13.066 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -9.530 27.039 12.834 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -9.350 23.370 12.024 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -11.853 26.720 13.009 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -11.319 21.866 12.133 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -13.822 25.215 13.118 1.00 0.00 H new ATOM 0 HZ PHE A 20 -13.555 22.789 12.678 1.00 0.00 H new ATOM 299 N TYR A 21 -9.164 28.568 10.937 1.00 0.00 N ATOM 300 CA TYR A 21 -8.760 29.981 10.652 1.00 0.00 C ATOM 301 C TYR A 21 -9.757 30.996 11.244 1.00 0.00 C ATOM 302 O TYR A 21 -9.455 32.167 11.366 1.00 0.00 O ATOM 303 CB TYR A 21 -8.741 30.074 9.133 1.00 0.00 C ATOM 304 CG TYR A 21 -7.332 29.813 8.643 1.00 0.00 C ATOM 305 CD1 TYR A 21 -6.247 30.463 9.246 1.00 0.00 C ATOM 306 CD2 TYR A 21 -7.109 28.916 7.591 1.00 0.00 C ATOM 307 CE1 TYR A 21 -4.944 30.219 8.795 1.00 0.00 C ATOM 308 CE2 TYR A 21 -5.807 28.673 7.141 1.00 0.00 C ATOM 309 CZ TYR A 21 -4.725 29.324 7.742 1.00 0.00 C ATOM 310 OH TYR A 21 -3.441 29.084 7.296 1.00 0.00 O ATOM 0 H TYR A 21 -10.101 28.452 11.323 1.00 0.00 H new ATOM 0 HA TYR A 21 -7.797 30.220 11.103 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -9.430 29.348 8.702 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -9.075 31.060 8.812 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -6.416 31.153 10.060 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -7.943 28.411 7.127 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -4.108 30.721 9.260 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -5.637 27.982 6.329 1.00 0.00 H new ATOM 0 HH TYR A 21 -2.798 29.418 7.956 1.00 0.00 H new ATOM 320 N THR A 22 -10.934 30.563 11.610 1.00 0.00 N ATOM 321 CA THR A 22 -11.946 31.494 12.194 1.00 0.00 C ATOM 322 C THR A 22 -12.112 32.766 11.357 1.00 0.00 C ATOM 323 O THR A 22 -12.852 32.793 10.396 1.00 0.00 O ATOM 324 CB THR A 22 -11.441 31.827 13.603 1.00 0.00 C ATOM 325 OG1 THR A 22 -10.024 31.912 13.602 1.00 0.00 O ATOM 326 CG2 THR A 22 -11.886 30.734 14.575 1.00 0.00 C ATOM 0 H THR A 22 -11.241 29.594 11.529 1.00 0.00 H new ATOM 0 HA THR A 22 -12.931 31.028 12.214 1.00 0.00 H new ATOM 0 HB THR A 22 -11.856 32.785 13.915 1.00 0.00 H new ATOM 0 HG1 THR A 22 -9.731 32.481 12.860 1.00 0.00 H new ATOM 0 HG21 THR A 22 -11.527 30.970 15.577 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.974 30.676 14.584 1.00 0.00 H new ATOM 0 HG23 THR A 22 -11.474 29.776 14.258 1.00 0.00 H new ATOM 334 N ASP A 23 -11.466 33.830 11.728 1.00 0.00 N ATOM 335 CA ASP A 23 -11.634 35.094 10.960 1.00 0.00 C ATOM 336 C ASP A 23 -10.324 35.878 10.935 1.00 0.00 C ATOM 337 O ASP A 23 -9.458 35.686 11.764 1.00 0.00 O ATOM 338 CB ASP A 23 -12.714 35.851 11.727 1.00 0.00 C ATOM 339 CG ASP A 23 -12.723 37.318 11.292 1.00 0.00 C ATOM 340 OD1 ASP A 23 -11.750 38.001 11.563 1.00 0.00 O ATOM 341 OD2 ASP A 23 -13.704 37.733 10.697 1.00 0.00 O ATOM 0 H ASP A 23 -10.832 33.882 12.525 1.00 0.00 H new ATOM 0 HA ASP A 23 -11.907 34.927 9.918 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.689 35.401 11.541 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -12.529 35.781 12.799 1.00 0.00 H new ATOM 346 N GLY A 24 -10.162 36.747 9.977 1.00 0.00 N ATOM 347 CA GLY A 24 -8.896 37.521 9.894 1.00 0.00 C ATOM 348 C GLY A 24 -7.771 36.558 9.522 1.00 0.00 C ATOM 349 O GLY A 24 -6.603 36.876 9.622 1.00 0.00 O ATOM 0 H GLY A 24 -10.849 36.953 9.252 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -8.982 38.311 9.148 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -8.683 38.004 10.847 1.00 0.00 H new ATOM 353 N SER A 25 -8.124 35.376 9.092 1.00 0.00 N ATOM 354 CA SER A 25 -7.092 34.376 8.710 1.00 0.00 C ATOM 355 C SER A 25 -6.784 34.484 7.225 1.00 0.00 C ATOM 356 O SER A 25 -7.559 35.016 6.455 1.00 0.00 O ATOM 357 CB SER A 25 -7.726 33.020 9.009 1.00 0.00 C ATOM 358 OG SER A 25 -9.139 33.165 9.071 1.00 0.00 O ATOM 0 H SER A 25 -9.089 35.061 8.989 1.00 0.00 H new ATOM 0 HA SER A 25 -6.157 34.525 9.250 1.00 0.00 H new ATOM 0 HB2 SER A 25 -7.456 32.301 8.235 1.00 0.00 H new ATOM 0 HB3 SER A 25 -7.347 32.629 9.953 1.00 0.00 H new ATOM 0 HG SER A 25 -9.431 33.126 10.006 1.00 0.00 H new ATOM 364 N VAL A 26 -5.667 33.971 6.812 1.00 0.00 N ATOM 365 CA VAL A 26 -5.326 34.031 5.372 1.00 0.00 C ATOM 366 C VAL A 26 -4.669 32.730 4.945 1.00 0.00 C ATOM 367 O VAL A 26 -4.065 32.037 5.739 1.00 0.00 O ATOM 368 CB VAL A 26 -4.358 35.204 5.227 1.00 0.00 C ATOM 369 CG1 VAL A 26 -3.763 35.207 3.819 1.00 0.00 C ATOM 370 CG2 VAL A 26 -5.111 36.511 5.457 1.00 0.00 C ATOM 0 H VAL A 26 -4.976 33.514 7.407 1.00 0.00 H new ATOM 0 HA VAL A 26 -6.206 34.167 4.744 1.00 0.00 H new ATOM 0 HB VAL A 26 -3.557 35.106 5.960 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -3.073 36.044 3.717 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -3.228 34.273 3.648 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -4.564 35.306 3.086 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -4.423 37.350 5.354 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -5.910 36.605 4.722 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -5.539 36.513 6.460 1.00 0.00 H new ATOM 380 N VAL A 27 -4.794 32.381 3.702 1.00 0.00 N ATOM 381 CA VAL A 27 -4.186 31.107 3.245 1.00 0.00 C ATOM 382 C VAL A 27 -3.517 31.267 1.899 1.00 0.00 C ATOM 383 O VAL A 27 -4.159 31.522 0.900 1.00 0.00 O ATOM 384 CB VAL A 27 -5.353 30.141 3.141 1.00 0.00 C ATOM 385 CG1 VAL A 27 -4.951 28.915 2.317 1.00 0.00 C ATOM 386 CG2 VAL A 27 -5.728 29.707 4.540 1.00 0.00 C ATOM 0 H VAL A 27 -5.286 32.916 2.987 1.00 0.00 H new ATOM 0 HA VAL A 27 -3.412 30.761 3.930 1.00 0.00 H new ATOM 0 HB VAL A 27 -6.196 30.627 2.651 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -5.796 28.229 2.249 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -4.658 29.230 1.315 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -4.113 28.412 2.799 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -6.566 29.011 4.493 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.875 29.217 5.010 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -6.014 30.580 5.127 1.00 0.00 H new ATOM 396 N THR A 28 -2.235 31.083 1.850 1.00 0.00 N ATOM 397 CA THR A 28 -1.563 31.190 0.547 1.00 0.00 C ATOM 398 C THR A 28 -1.975 29.983 -0.281 1.00 0.00 C ATOM 399 O THR A 28 -1.526 28.876 -0.058 1.00 0.00 O ATOM 400 CB THR A 28 -0.061 31.184 0.839 1.00 0.00 C ATOM 401 OG1 THR A 28 0.153 31.132 2.243 1.00 0.00 O ATOM 402 CG2 THR A 28 0.565 32.455 0.271 1.00 0.00 C ATOM 0 H THR A 28 -1.635 30.866 2.646 1.00 0.00 H new ATOM 0 HA THR A 28 -1.826 32.092 -0.005 1.00 0.00 H new ATOM 0 HB THR A 28 0.398 30.311 0.375 1.00 0.00 H new ATOM 0 HG1 THR A 28 1.116 31.127 2.427 1.00 0.00 H new ATOM 0 HG21 THR A 28 1.636 32.456 0.476 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.402 32.491 -0.806 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.105 33.327 0.737 1.00 0.00 H new ATOM 410 N TYR A 29 -2.857 30.182 -1.212 1.00 0.00 N ATOM 411 CA TYR A 29 -3.337 29.042 -2.032 1.00 0.00 C ATOM 412 C TYR A 29 -2.209 28.521 -2.925 1.00 0.00 C ATOM 413 O TYR A 29 -1.604 29.261 -3.675 1.00 0.00 O ATOM 414 CB TYR A 29 -4.461 29.629 -2.891 1.00 0.00 C ATOM 415 CG TYR A 29 -5.805 29.465 -2.213 1.00 0.00 C ATOM 416 CD1 TYR A 29 -5.901 28.967 -0.905 1.00 0.00 C ATOM 417 CD2 TYR A 29 -6.966 29.819 -2.909 1.00 0.00 C ATOM 418 CE1 TYR A 29 -7.156 28.821 -0.303 1.00 0.00 C ATOM 419 CE2 TYR A 29 -8.218 29.674 -2.306 1.00 0.00 C ATOM 420 CZ TYR A 29 -8.315 29.174 -1.002 1.00 0.00 C ATOM 421 OH TYR A 29 -9.552 29.029 -0.409 1.00 0.00 O ATOM 0 H TYR A 29 -3.268 31.087 -1.442 1.00 0.00 H new ATOM 0 HA TYR A 29 -3.674 28.205 -1.421 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -4.269 30.686 -3.074 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -4.477 29.135 -3.862 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -5.007 28.696 -0.363 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -6.894 30.205 -3.915 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -7.230 28.435 0.703 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -9.112 29.948 -2.847 1.00 0.00 H new ATOM 0 HH TYR A 29 -10.250 29.321 -1.032 1.00 0.00 H new ATOM 431 N SER A 30 -1.925 27.249 -2.854 1.00 0.00 N ATOM 432 CA SER A 30 -0.842 26.681 -3.702 1.00 0.00 C ATOM 433 C SER A 30 -1.376 26.393 -5.106 1.00 0.00 C ATOM 434 O SER A 30 -2.554 26.164 -5.297 1.00 0.00 O ATOM 435 CB SER A 30 -0.431 25.382 -3.010 1.00 0.00 C ATOM 436 OG SER A 30 -0.913 25.387 -1.673 1.00 0.00 O ATOM 0 H SER A 30 -2.397 26.580 -2.245 1.00 0.00 H new ATOM 0 HA SER A 30 -0.000 27.365 -3.811 1.00 0.00 H new ATOM 0 HB2 SER A 30 -0.834 24.526 -3.551 1.00 0.00 H new ATOM 0 HB3 SER A 30 0.654 25.281 -3.017 1.00 0.00 H new ATOM 0 HG SER A 30 -0.652 24.554 -1.228 1.00 0.00 H new ATOM 442 N CYS A 31 -0.521 26.406 -6.089 1.00 0.00 N ATOM 443 CA CYS A 31 -0.980 26.135 -7.481 1.00 0.00 C ATOM 444 C CYS A 31 -0.230 24.931 -8.056 1.00 0.00 C ATOM 445 O CYS A 31 0.963 24.787 -7.874 1.00 0.00 O ATOM 446 CB CYS A 31 -0.632 27.402 -8.262 1.00 0.00 C ATOM 447 SG CYS A 31 -1.843 27.652 -9.584 1.00 0.00 S ATOM 0 H CYS A 31 0.477 26.593 -5.990 1.00 0.00 H new ATOM 0 HA CYS A 31 -2.044 25.903 -7.530 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -0.625 28.263 -7.594 1.00 0.00 H new ATOM 0 HB3 CYS A 31 0.370 27.318 -8.684 1.00 0.00 H new ATOM 452 N ASN A 32 -0.915 24.065 -8.750 1.00 0.00 N ATOM 453 CA ASN A 32 -0.231 22.876 -9.332 1.00 0.00 C ATOM 454 C ASN A 32 0.997 23.317 -10.133 1.00 0.00 C ATOM 455 O ASN A 32 1.101 24.452 -10.555 1.00 0.00 O ATOM 456 CB ASN A 32 -1.269 22.230 -10.249 1.00 0.00 C ATOM 457 CG ASN A 32 -0.858 20.786 -10.543 1.00 0.00 C ATOM 458 OD1 ASN A 32 -0.453 20.469 -11.644 1.00 0.00 O ATOM 459 ND2 ASN A 32 -0.943 19.891 -9.596 1.00 0.00 N ATOM 0 H ASN A 32 -1.915 24.128 -8.939 1.00 0.00 H new ATOM 0 HA ASN A 32 0.120 22.183 -8.567 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -2.251 22.251 -9.777 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -1.350 22.793 -11.179 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -0.669 18.926 -9.780 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -1.283 20.157 -8.672 1.00 0.00 H new ATOM 466 N SER A 33 1.929 22.430 -10.345 1.00 0.00 N ATOM 467 CA SER A 33 3.151 22.800 -11.118 1.00 0.00 C ATOM 468 C SER A 33 2.776 23.189 -12.550 1.00 0.00 C ATOM 469 O SER A 33 2.044 22.490 -13.221 1.00 0.00 O ATOM 470 CB SER A 33 4.015 21.540 -11.116 1.00 0.00 C ATOM 471 OG SER A 33 3.173 20.396 -11.170 1.00 0.00 O ATOM 0 H SER A 33 1.899 21.465 -10.017 1.00 0.00 H new ATOM 0 HA SER A 33 3.671 23.654 -10.684 1.00 0.00 H new ATOM 0 HB2 SER A 33 4.693 21.548 -11.970 1.00 0.00 H new ATOM 0 HB3 SER A 33 4.633 21.510 -10.219 1.00 0.00 H new ATOM 0 HG SER A 33 3.723 19.585 -11.171 1.00 0.00 H new ATOM 477 N GLY A 34 3.275 24.298 -13.023 1.00 0.00 N ATOM 478 CA GLY A 34 2.949 24.729 -14.412 1.00 0.00 C ATOM 479 C GLY A 34 1.877 25.818 -14.371 1.00 0.00 C ATOM 480 O GLY A 34 1.856 26.714 -15.190 1.00 0.00 O ATOM 0 H GLY A 34 3.894 24.924 -12.508 1.00 0.00 H new ATOM 0 HA2 GLY A 34 3.845 25.104 -14.907 1.00 0.00 H new ATOM 0 HA3 GLY A 34 2.596 23.878 -14.994 1.00 0.00 H new ATOM 484 N TYR A 35 0.987 25.748 -13.421 1.00 0.00 N ATOM 485 CA TYR A 35 -0.083 26.781 -13.326 1.00 0.00 C ATOM 486 C TYR A 35 0.390 27.945 -12.451 1.00 0.00 C ATOM 487 O TYR A 35 0.986 27.748 -11.411 1.00 0.00 O ATOM 488 CB TYR A 35 -1.270 26.066 -12.680 1.00 0.00 C ATOM 489 CG TYR A 35 -2.172 25.516 -13.759 1.00 0.00 C ATOM 490 CD1 TYR A 35 -1.617 24.958 -14.917 1.00 0.00 C ATOM 491 CD2 TYR A 35 -3.562 25.567 -13.603 1.00 0.00 C ATOM 492 CE1 TYR A 35 -2.453 24.450 -15.919 1.00 0.00 C ATOM 493 CE2 TYR A 35 -4.398 25.059 -14.605 1.00 0.00 C ATOM 494 CZ TYR A 35 -3.843 24.501 -15.763 1.00 0.00 C ATOM 495 OH TYR A 35 -4.667 24.001 -16.751 1.00 0.00 O ATOM 0 H TYR A 35 0.954 25.021 -12.706 1.00 0.00 H new ATOM 0 HA TYR A 35 -0.345 27.199 -14.298 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -0.917 25.258 -12.039 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -1.824 26.758 -12.045 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -0.544 24.919 -15.037 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -3.990 25.998 -12.710 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -2.025 24.019 -16.812 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -5.471 25.098 -14.485 1.00 0.00 H new ATOM 0 HH TYR A 35 -5.603 24.113 -16.484 1.00 0.00 H new ATOM 505 N SER A 36 0.135 29.155 -12.867 1.00 0.00 N ATOM 506 CA SER A 36 0.579 30.328 -12.060 1.00 0.00 C ATOM 507 C SER A 36 -0.498 30.735 -11.058 1.00 0.00 C ATOM 508 O SER A 36 -1.680 30.661 -11.333 1.00 0.00 O ATOM 509 CB SER A 36 0.804 31.450 -13.071 1.00 0.00 C ATOM 510 OG SER A 36 2.158 31.872 -12.996 1.00 0.00 O ATOM 0 H SER A 36 -0.361 29.383 -13.729 1.00 0.00 H new ATOM 0 HA SER A 36 1.478 30.102 -11.486 1.00 0.00 H new ATOM 0 HB2 SER A 36 0.573 31.102 -14.078 1.00 0.00 H new ATOM 0 HB3 SER A 36 0.136 32.286 -12.861 1.00 0.00 H new ATOM 0 HG SER A 36 2.394 32.048 -12.061 1.00 0.00 H new ATOM 516 N LEU A 37 -0.096 31.182 -9.902 1.00 0.00 N ATOM 517 CA LEU A 37 -1.093 31.613 -8.889 1.00 0.00 C ATOM 518 C LEU A 37 -1.275 33.129 -8.971 1.00 0.00 C ATOM 519 O LEU A 37 -0.470 33.889 -8.473 1.00 0.00 O ATOM 520 CB LEU A 37 -0.504 31.214 -7.537 1.00 0.00 C ATOM 521 CG LEU A 37 -1.447 31.673 -6.425 1.00 0.00 C ATOM 522 CD1 LEU A 37 -2.368 30.517 -6.031 1.00 0.00 C ATOM 523 CD2 LEU A 37 -0.630 32.114 -5.208 1.00 0.00 C ATOM 0 H LEU A 37 0.880 31.267 -9.617 1.00 0.00 H new ATOM 0 HA LEU A 37 -2.070 31.155 -9.044 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.366 30.134 -7.491 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.479 31.667 -7.407 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.046 32.512 -6.780 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.041 30.842 -5.238 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.951 30.205 -6.897 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.768 29.679 -5.677 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.304 32.441 -4.416 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.029 31.278 -4.851 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.026 32.938 -5.489 1.00 0.00 H new ATOM 535 N ILE A 38 -2.325 33.574 -9.600 1.00 0.00 N ATOM 536 CA ILE A 38 -2.551 35.046 -9.715 1.00 0.00 C ATOM 537 C ILE A 38 -3.460 35.515 -8.577 1.00 0.00 C ATOM 538 O ILE A 38 -4.308 34.788 -8.112 1.00 0.00 O ATOM 539 CB ILE A 38 -3.226 35.305 -11.082 1.00 0.00 C ATOM 540 CG1 ILE A 38 -3.114 34.089 -12.014 1.00 0.00 C ATOM 541 CG2 ILE A 38 -2.535 36.485 -11.758 1.00 0.00 C ATOM 542 CD1 ILE A 38 -1.644 33.702 -12.170 1.00 0.00 C ATOM 0 H ILE A 38 -3.035 32.988 -10.039 1.00 0.00 H new ATOM 0 HA ILE A 38 -1.611 35.593 -9.647 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.281 35.508 -10.900 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -3.681 33.252 -11.607 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -3.545 34.322 -12.988 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -3.003 36.677 -12.723 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -2.627 37.370 -11.128 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -1.480 36.253 -11.906 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -1.563 32.839 -12.831 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -1.091 34.539 -12.596 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -1.228 33.452 -11.194 1.00 0.00 H new ATOM 554 N GLY A 39 -3.292 36.723 -8.121 1.00 0.00 N ATOM 555 CA GLY A 39 -4.156 37.217 -7.013 1.00 0.00 C ATOM 556 C GLY A 39 -3.316 37.429 -5.754 1.00 0.00 C ATOM 557 O GLY A 39 -2.102 37.402 -5.791 1.00 0.00 O ATOM 0 H GLY A 39 -2.598 37.387 -8.464 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -4.635 38.152 -7.303 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -4.952 36.500 -6.813 1.00 0.00 H new ATOM 561 N ASN A 40 -3.956 37.640 -4.636 1.00 0.00 N ATOM 562 CA ASN A 40 -3.199 37.852 -3.370 1.00 0.00 C ATOM 563 C ASN A 40 -2.580 36.534 -2.899 1.00 0.00 C ATOM 564 O ASN A 40 -3.226 35.505 -2.881 1.00 0.00 O ATOM 565 CB ASN A 40 -4.240 38.344 -2.363 1.00 0.00 C ATOM 566 CG ASN A 40 -3.571 39.278 -1.353 1.00 0.00 C ATOM 567 OD1 ASN A 40 -3.672 39.074 -0.159 1.00 0.00 O ATOM 568 ND2 ASN A 40 -2.888 40.302 -1.784 1.00 0.00 N ATOM 0 H ASN A 40 -4.971 37.675 -4.545 1.00 0.00 H new ATOM 0 HA ASN A 40 -2.382 38.563 -3.491 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -5.044 38.867 -2.881 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -4.692 37.497 -1.847 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -2.439 40.932 -1.119 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -2.803 40.473 -2.786 1.00 0.00 H new ATOM 575 N SER A 41 -1.335 36.557 -2.513 1.00 0.00 N ATOM 576 CA SER A 41 -0.679 35.307 -2.038 1.00 0.00 C ATOM 577 C SER A 41 -1.187 34.958 -0.639 1.00 0.00 C ATOM 578 O SER A 41 -0.425 34.821 0.296 1.00 0.00 O ATOM 579 CB SER A 41 0.814 35.630 -2.006 1.00 0.00 C ATOM 580 OG SER A 41 1.046 36.681 -1.077 1.00 0.00 O ATOM 0 H SER A 41 -0.743 37.388 -2.506 1.00 0.00 H new ATOM 0 HA SER A 41 -0.892 34.452 -2.680 1.00 0.00 H new ATOM 0 HB2 SER A 41 1.384 34.745 -1.722 1.00 0.00 H new ATOM 0 HB3 SER A 41 1.156 35.924 -2.998 1.00 0.00 H new ATOM 0 HG SER A 41 0.767 36.394 -0.182 1.00 0.00 H new ATOM 586 N GLY A 42 -2.475 34.825 -0.491 1.00 0.00 N ATOM 587 CA GLY A 42 -3.043 34.495 0.845 1.00 0.00 C ATOM 588 C GLY A 42 -4.541 34.787 0.847 1.00 0.00 C ATOM 589 O GLY A 42 -4.960 35.924 0.757 1.00 0.00 O ATOM 0 H GLY A 42 -3.160 34.931 -1.239 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -2.866 33.445 1.078 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -2.546 35.081 1.618 1.00 0.00 H new ATOM 593 N VAL A 43 -5.356 33.776 0.970 1.00 0.00 N ATOM 594 CA VAL A 43 -6.826 34.025 0.999 1.00 0.00 C ATOM 595 C VAL A 43 -7.134 34.828 2.256 1.00 0.00 C ATOM 596 O VAL A 43 -6.240 35.153 3.008 1.00 0.00 O ATOM 597 CB VAL A 43 -7.512 32.653 1.060 1.00 0.00 C ATOM 598 CG1 VAL A 43 -8.929 32.770 0.493 1.00 0.00 C ATOM 599 CG2 VAL A 43 -6.740 31.632 0.224 1.00 0.00 C ATOM 0 H VAL A 43 -5.073 32.799 1.051 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.174 34.576 0.125 1.00 0.00 H new ATOM 0 HB VAL A 43 -7.540 32.325 2.099 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -9.419 31.797 0.535 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -9.498 33.489 1.082 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -8.880 33.107 -0.542 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.240 30.665 0.278 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.704 31.964 -0.814 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -5.725 31.538 0.610 1.00 0.00 H new ATOM 609 N LEU A 44 -8.370 35.147 2.506 1.00 0.00 N ATOM 610 CA LEU A 44 -8.685 35.922 3.737 1.00 0.00 C ATOM 611 C LEU A 44 -10.041 35.502 4.300 1.00 0.00 C ATOM 612 O LEU A 44 -11.076 35.955 3.853 1.00 0.00 O ATOM 613 CB LEU A 44 -8.718 37.389 3.303 1.00 0.00 C ATOM 614 CG LEU A 44 -9.267 38.250 4.446 1.00 0.00 C ATOM 615 CD1 LEU A 44 -8.109 38.847 5.246 1.00 0.00 C ATOM 616 CD2 LEU A 44 -10.122 39.379 3.868 1.00 0.00 C ATOM 0 H LEU A 44 -9.169 34.908 1.919 1.00 0.00 H new ATOM 0 HA LEU A 44 -7.948 35.750 4.521 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.716 37.722 3.033 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -9.342 37.503 2.416 1.00 0.00 H new ATOM 0 HG LEU A 44 -9.876 37.630 5.103 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.504 39.458 6.057 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.501 38.043 5.660 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.495 39.466 4.591 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.513 39.992 4.680 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -9.512 39.996 3.209 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.951 38.954 3.302 1.00 0.00 H new ATOM 628 N CYS A 45 -10.048 34.657 5.293 1.00 0.00 N ATOM 629 CA CYS A 45 -11.346 34.239 5.889 1.00 0.00 C ATOM 630 C CYS A 45 -11.756 35.242 6.961 1.00 0.00 C ATOM 631 O CYS A 45 -11.147 35.332 8.010 1.00 0.00 O ATOM 632 CB CYS A 45 -11.106 32.865 6.507 1.00 0.00 C ATOM 633 SG CYS A 45 -12.550 31.819 6.186 1.00 0.00 S ATOM 0 H CYS A 45 -9.218 34.241 5.715 1.00 0.00 H new ATOM 0 HA CYS A 45 -12.143 34.199 5.147 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -10.210 32.412 6.083 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -10.939 32.958 7.580 1.00 0.00 H new ATOM 638 N SER A 46 -12.776 36.005 6.703 1.00 0.00 N ATOM 639 CA SER A 46 -13.215 37.013 7.707 1.00 0.00 C ATOM 640 C SER A 46 -14.685 36.800 8.078 1.00 0.00 C ATOM 641 O SER A 46 -15.580 37.203 7.363 1.00 0.00 O ATOM 642 CB SER A 46 -13.027 38.363 7.016 1.00 0.00 C ATOM 643 OG SER A 46 -12.435 39.278 7.929 1.00 0.00 O ATOM 0 H SER A 46 -13.325 35.977 5.844 1.00 0.00 H new ATOM 0 HA SER A 46 -12.646 36.942 8.634 1.00 0.00 H new ATOM 0 HB2 SER A 46 -12.395 38.249 6.135 1.00 0.00 H new ATOM 0 HB3 SER A 46 -13.988 38.745 6.671 1.00 0.00 H new ATOM 0 HG SER A 46 -12.311 40.145 7.489 1.00 0.00 H new ATOM 649 N GLY A 47 -14.939 36.177 9.196 1.00 0.00 N ATOM 650 CA GLY A 47 -16.350 35.947 9.619 1.00 0.00 C ATOM 651 C GLY A 47 -16.896 34.677 8.962 1.00 0.00 C ATOM 652 O GLY A 47 -18.004 34.654 8.462 1.00 0.00 O ATOM 0 H GLY A 47 -14.230 35.817 9.835 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -16.402 35.856 10.704 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -16.965 36.803 9.341 1.00 0.00 H new ATOM 656 N GLY A 48 -16.136 33.616 8.963 1.00 0.00 N ATOM 657 CA GLY A 48 -16.626 32.351 8.344 1.00 0.00 C ATOM 658 C GLY A 48 -16.874 32.567 6.851 1.00 0.00 C ATOM 659 O GLY A 48 -17.773 31.988 6.273 1.00 0.00 O ATOM 0 H GLY A 48 -15.199 33.570 9.364 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -15.894 31.557 8.489 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -17.546 32.029 8.832 1.00 0.00 H new ATOM 663 N GLU A 49 -16.090 33.396 6.222 1.00 0.00 N ATOM 664 CA GLU A 49 -16.292 33.647 4.765 1.00 0.00 C ATOM 665 C GLU A 49 -14.951 33.900 4.069 1.00 0.00 C ATOM 666 O GLU A 49 -14.453 35.008 4.051 1.00 0.00 O ATOM 667 CB GLU A 49 -17.167 34.900 4.700 1.00 0.00 C ATOM 668 CG GLU A 49 -18.567 34.578 5.226 1.00 0.00 C ATOM 669 CD GLU A 49 -19.474 35.794 5.032 1.00 0.00 C ATOM 670 OE1 GLU A 49 -18.975 36.818 4.594 1.00 0.00 O ATOM 671 OE2 GLU A 49 -20.653 35.682 5.324 1.00 0.00 O ATOM 0 H GLU A 49 -15.320 33.910 6.650 1.00 0.00 H new ATOM 0 HA GLU A 49 -16.750 32.794 4.264 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -16.720 35.699 5.292 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -17.228 35.260 3.673 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -18.977 33.717 4.698 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -18.519 34.311 6.282 1.00 0.00 H new ATOM 678 N TRP A 50 -14.369 32.888 3.484 1.00 0.00 N ATOM 679 CA TRP A 50 -13.069 33.087 2.778 1.00 0.00 C ATOM 680 C TRP A 50 -13.254 34.112 1.656 1.00 0.00 C ATOM 681 O TRP A 50 -14.239 34.091 0.945 1.00 0.00 O ATOM 682 CB TRP A 50 -12.717 31.711 2.208 1.00 0.00 C ATOM 683 CG TRP A 50 -12.120 30.863 3.287 1.00 0.00 C ATOM 684 CD1 TRP A 50 -12.737 29.820 3.891 1.00 0.00 C ATOM 685 CD2 TRP A 50 -10.803 30.970 3.899 1.00 0.00 C ATOM 686 NE1 TRP A 50 -11.881 29.282 4.836 1.00 0.00 N ATOM 687 CE2 TRP A 50 -10.677 29.957 4.878 1.00 0.00 C ATOM 688 CE3 TRP A 50 -9.718 31.841 3.703 1.00 0.00 C ATOM 689 CZ2 TRP A 50 -9.516 29.813 5.635 1.00 0.00 C ATOM 690 CZ3 TRP A 50 -8.545 31.698 4.461 1.00 0.00 C ATOM 691 CH2 TRP A 50 -8.445 30.687 5.426 1.00 0.00 C ATOM 0 H TRP A 50 -14.735 31.936 3.464 1.00 0.00 H new ATOM 0 HA TRP A 50 -12.282 33.462 3.432 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -13.610 31.232 1.807 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -12.013 31.817 1.382 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -13.733 29.466 3.671 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -12.111 28.485 5.429 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -9.787 32.626 2.964 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -9.444 29.032 6.378 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -7.716 32.371 4.300 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -7.541 30.583 6.008 1.00 0.00 H new ATOM 702 N SER A 51 -12.329 35.020 1.495 1.00 0.00 N ATOM 703 CA SER A 51 -12.488 36.044 0.423 1.00 0.00 C ATOM 704 C SER A 51 -11.159 36.320 -0.288 1.00 0.00 C ATOM 705 O SER A 51 -10.132 35.756 0.034 1.00 0.00 O ATOM 706 CB SER A 51 -12.975 37.298 1.149 1.00 0.00 C ATOM 707 OG SER A 51 -13.293 38.301 0.193 1.00 0.00 O ATOM 0 H SER A 51 -11.479 35.097 2.053 1.00 0.00 H new ATOM 0 HA SER A 51 -13.182 35.712 -0.350 1.00 0.00 H new ATOM 0 HB2 SER A 51 -13.851 37.065 1.754 1.00 0.00 H new ATOM 0 HB3 SER A 51 -12.205 37.660 1.830 1.00 0.00 H new ATOM 0 HG SER A 51 -12.524 38.897 0.076 1.00 0.00 H new ATOM 713 N ASP A 52 -11.189 37.193 -1.259 1.00 0.00 N ATOM 714 CA ASP A 52 -9.955 37.543 -2.025 1.00 0.00 C ATOM 715 C ASP A 52 -9.079 36.314 -2.270 1.00 0.00 C ATOM 716 O ASP A 52 -7.962 36.235 -1.798 1.00 0.00 O ATOM 717 CB ASP A 52 -9.223 38.569 -1.160 1.00 0.00 C ATOM 718 CG ASP A 52 -9.885 39.938 -1.322 1.00 0.00 C ATOM 719 OD1 ASP A 52 -9.493 40.660 -2.224 1.00 0.00 O ATOM 720 OD2 ASP A 52 -10.772 40.242 -0.541 1.00 0.00 O ATOM 0 H ASP A 52 -12.029 37.687 -1.559 1.00 0.00 H new ATOM 0 HA ASP A 52 -10.198 37.937 -3.012 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -9.248 38.263 -0.114 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -8.174 38.624 -1.451 1.00 0.00 H new ATOM 725 N PRO A 53 -9.620 35.407 -3.028 1.00 0.00 N ATOM 726 CA PRO A 53 -8.908 34.170 -3.393 1.00 0.00 C ATOM 727 C PRO A 53 -8.161 34.379 -4.714 1.00 0.00 C ATOM 728 O PRO A 53 -8.685 34.984 -5.628 1.00 0.00 O ATOM 729 CB PRO A 53 -10.042 33.170 -3.578 1.00 0.00 C ATOM 730 CG PRO A 53 -11.255 33.994 -3.927 1.00 0.00 C ATOM 731 CD PRO A 53 -10.954 35.445 -3.610 1.00 0.00 C ATOM 0 HA PRO A 53 -8.169 33.851 -2.658 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -9.811 32.457 -4.370 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -10.208 32.593 -2.668 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -11.501 33.879 -4.983 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.121 33.653 -3.360 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -10.981 36.064 -4.507 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -11.682 35.861 -2.914 1.00 0.00 H new ATOM 739 N PRO A 54 -6.962 33.872 -4.775 1.00 0.00 N ATOM 740 CA PRO A 54 -6.146 34.011 -6.001 1.00 0.00 C ATOM 741 C PRO A 54 -6.589 32.997 -7.057 1.00 0.00 C ATOM 742 O PRO A 54 -7.518 32.240 -6.860 1.00 0.00 O ATOM 743 CB PRO A 54 -4.729 33.727 -5.519 1.00 0.00 C ATOM 744 CG PRO A 54 -4.889 32.868 -4.299 1.00 0.00 C ATOM 745 CD PRO A 54 -6.261 33.133 -3.722 1.00 0.00 C ATOM 0 HA PRO A 54 -6.238 34.989 -6.473 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -4.148 33.216 -6.286 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -4.202 34.651 -5.283 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -4.780 31.815 -4.557 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -4.116 33.098 -3.566 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -6.776 32.204 -3.478 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -6.200 33.714 -2.802 1.00 0.00 H new ATOM 753 N THR A 55 -5.938 32.996 -8.184 1.00 0.00 N ATOM 754 CA THR A 55 -6.320 32.054 -9.274 1.00 0.00 C ATOM 755 C THR A 55 -5.207 31.052 -9.551 1.00 0.00 C ATOM 756 O THR A 55 -4.109 31.159 -9.044 1.00 0.00 O ATOM 757 CB THR A 55 -6.514 32.942 -10.504 1.00 0.00 C ATOM 758 OG1 THR A 55 -5.454 33.883 -10.573 1.00 0.00 O ATOM 759 CG2 THR A 55 -7.840 33.685 -10.392 1.00 0.00 C ATOM 0 H THR A 55 -5.153 33.610 -8.400 1.00 0.00 H new ATOM 0 HA THR A 55 -7.209 31.481 -9.011 1.00 0.00 H new ATOM 0 HB THR A 55 -6.518 32.325 -11.402 1.00 0.00 H new ATOM 0 HG1 THR A 55 -5.641 34.632 -9.969 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.978 34.318 -11.269 1.00 0.00 H new ATOM 0 HG22 THR A 55 -8.656 32.965 -10.332 1.00 0.00 H new ATOM 0 HG23 THR A 55 -7.836 34.304 -9.495 1.00 0.00 H new ATOM 767 N CYS A 56 -5.490 30.094 -10.383 1.00 0.00 N ATOM 768 CA CYS A 56 -4.469 29.081 -10.748 1.00 0.00 C ATOM 769 C CYS A 56 -4.559 28.834 -12.244 1.00 0.00 C ATOM 770 O CYS A 56 -5.121 27.858 -12.699 1.00 0.00 O ATOM 771 CB CYS A 56 -4.840 27.829 -9.956 1.00 0.00 C ATOM 772 SG CYS A 56 -3.626 27.560 -8.641 1.00 0.00 S ATOM 0 H CYS A 56 -6.398 29.969 -10.831 1.00 0.00 H new ATOM 0 HA CYS A 56 -3.449 29.390 -10.521 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -5.836 27.939 -9.528 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -4.872 26.964 -10.618 1.00 0.00 H new ATOM 777 N GLN A 57 -4.026 29.735 -13.012 1.00 0.00 N ATOM 778 CA GLN A 57 -4.095 29.587 -14.487 1.00 0.00 C ATOM 779 C GLN A 57 -2.701 29.322 -15.063 1.00 0.00 C ATOM 780 O GLN A 57 -1.777 28.993 -14.348 1.00 0.00 O ATOM 781 CB GLN A 57 -4.648 30.918 -15.029 1.00 0.00 C ATOM 782 CG GLN A 57 -4.892 31.939 -13.906 1.00 0.00 C ATOM 783 CD GLN A 57 -5.598 33.170 -14.482 1.00 0.00 C ATOM 784 OE1 GLN A 57 -5.252 33.638 -15.548 1.00 0.00 O ATOM 785 NE2 GLN A 57 -6.580 33.718 -13.818 1.00 0.00 N ATOM 0 H GLN A 57 -3.544 30.571 -12.681 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.730 28.747 -14.769 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -3.947 31.335 -15.752 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -5.582 30.733 -15.561 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -5.500 31.492 -13.119 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -3.945 32.229 -13.451 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -6.872 33.326 -12.923 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -7.055 34.538 -14.195 1.00 0.00 H new ATOM 794 N ILE A 58 -2.539 29.480 -16.351 1.00 0.00 N ATOM 795 CA ILE A 58 -1.201 29.260 -16.972 1.00 0.00 C ATOM 796 C ILE A 58 -0.669 30.610 -17.445 1.00 0.00 C ATOM 797 O ILE A 58 -1.371 31.369 -18.082 1.00 0.00 O ATOM 798 CB ILE A 58 -1.400 28.314 -18.174 1.00 0.00 C ATOM 799 CG1 ILE A 58 -2.805 27.693 -18.174 1.00 0.00 C ATOM 800 CG2 ILE A 58 -0.364 27.193 -18.104 1.00 0.00 C ATOM 801 CD1 ILE A 58 -3.774 28.631 -18.896 1.00 0.00 C ATOM 0 H ILE A 58 -3.277 29.752 -17.000 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.493 28.822 -16.269 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.281 28.895 -19.088 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.785 26.722 -18.668 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -3.140 27.523 -17.151 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -0.498 26.520 -18.951 1.00 0.00 H new ATOM 0 HG22 ILE A 58 0.638 27.621 -18.136 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.491 26.637 -17.175 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.772 28.192 -18.897 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.801 29.592 -18.382 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -3.441 28.778 -19.923 1.00 0.00 H new ATOM 813 N VAL A 59 0.548 30.937 -17.123 1.00 0.00 N ATOM 814 CA VAL A 59 1.077 32.262 -17.547 1.00 0.00 C ATOM 815 C VAL A 59 2.370 32.121 -18.321 1.00 0.00 C ATOM 816 O VAL A 59 3.335 32.818 -18.080 1.00 0.00 O ATOM 817 CB VAL A 59 1.320 33.003 -16.247 1.00 0.00 C ATOM 818 CG1 VAL A 59 0.049 32.962 -15.402 1.00 0.00 C ATOM 819 CG2 VAL A 59 2.456 32.325 -15.491 1.00 0.00 C ATOM 0 H VAL A 59 1.194 30.353 -16.591 1.00 0.00 H new ATOM 0 HA VAL A 59 0.385 32.781 -18.210 1.00 0.00 H new ATOM 0 HB VAL A 59 1.587 34.039 -16.454 1.00 0.00 H new ATOM 0 HG11 VAL A 59 0.217 33.493 -14.465 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.766 33.438 -15.948 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -0.213 31.926 -15.189 1.00 0.00 H new ATOM 0 HG21 VAL A 59 2.636 32.853 -14.555 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.185 31.291 -15.278 1.00 0.00 H new ATOM 0 HG23 VAL A 59 3.361 32.345 -16.099 1.00 0.00 H new ATOM 829 N LYS A 60 2.397 31.250 -19.264 1.00 0.00 N ATOM 830 CA LYS A 60 3.644 31.098 -20.056 1.00 0.00 C ATOM 831 C LYS A 60 3.777 32.294 -21.004 1.00 0.00 C ATOM 832 O LYS A 60 2.844 33.046 -21.185 1.00 0.00 O ATOM 833 CB LYS A 60 3.486 29.787 -20.828 1.00 0.00 C ATOM 834 CG LYS A 60 3.702 28.605 -19.880 1.00 0.00 C ATOM 835 CD LYS A 60 4.107 27.371 -20.688 1.00 0.00 C ATOM 836 CE LYS A 60 4.471 26.231 -19.734 1.00 0.00 C ATOM 837 NZ LYS A 60 3.494 25.148 -20.036 1.00 0.00 N ATOM 0 H LYS A 60 1.625 30.638 -19.528 1.00 0.00 H new ATOM 0 HA LYS A 60 4.541 31.071 -19.438 1.00 0.00 H new ATOM 0 HB2 LYS A 60 2.493 29.733 -21.273 1.00 0.00 H new ATOM 0 HB3 LYS A 60 4.205 29.746 -21.646 1.00 0.00 H new ATOM 0 HG2 LYS A 60 4.476 28.846 -19.151 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.789 28.403 -19.320 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.289 27.066 -21.340 1.00 0.00 H new ATOM 0 HD3 LYS A 60 4.956 27.607 -21.330 1.00 0.00 H new ATOM 0 HE2 LYS A 60 5.495 25.894 -19.894 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.399 26.549 -18.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.680 24.331 -19.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.528 25.495 -19.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.590 24.861 -21.031 1.00 0.00 H new ATOM 851 N CYS A 61 4.922 32.504 -21.593 1.00 0.00 N ATOM 852 CA CYS A 61 5.063 33.689 -22.491 1.00 0.00 C ATOM 853 C CYS A 61 5.544 33.314 -23.888 1.00 0.00 C ATOM 854 O CYS A 61 5.946 32.197 -24.145 1.00 0.00 O ATOM 855 CB CYS A 61 6.111 34.568 -21.821 1.00 0.00 C ATOM 856 SG CYS A 61 5.305 35.991 -21.068 1.00 0.00 S ATOM 0 H CYS A 61 5.753 31.920 -21.496 1.00 0.00 H new ATOM 0 HA CYS A 61 4.099 34.179 -22.623 1.00 0.00 H new ATOM 0 HB2 CYS A 61 6.649 33.998 -21.064 1.00 0.00 H new ATOM 0 HB3 CYS A 61 6.847 34.899 -22.554 1.00 0.00 H new ATOM 861 N PRO A 62 5.496 34.303 -24.739 1.00 0.00 N ATOM 862 CA PRO A 62 5.942 34.150 -26.136 1.00 0.00 C ATOM 863 C PRO A 62 7.445 34.395 -26.226 1.00 0.00 C ATOM 864 O PRO A 62 8.208 33.563 -26.675 1.00 0.00 O ATOM 865 CB PRO A 62 5.196 35.264 -26.863 1.00 0.00 C ATOM 866 CG PRO A 62 4.909 36.308 -25.826 1.00 0.00 C ATOM 867 CD PRO A 62 5.012 35.660 -24.467 1.00 0.00 C ATOM 0 HA PRO A 62 5.749 33.159 -26.546 1.00 0.00 H new ATOM 0 HB2 PRO A 62 5.798 35.674 -27.674 1.00 0.00 H new ATOM 0 HB3 PRO A 62 4.274 34.891 -27.308 1.00 0.00 H new ATOM 0 HG2 PRO A 62 5.618 37.132 -25.909 1.00 0.00 H new ATOM 0 HG3 PRO A 62 3.914 36.727 -25.973 1.00 0.00 H new ATOM 0 HD2 PRO A 62 5.700 36.204 -23.820 1.00 0.00 H new ATOM 0 HD3 PRO A 62 4.046 35.642 -23.962 1.00 0.00 H new ATOM 875 N HIS A 63 7.856 35.556 -25.802 1.00 0.00 N ATOM 876 CA HIS A 63 9.294 35.937 -25.843 1.00 0.00 C ATOM 877 C HIS A 63 9.395 37.453 -25.723 1.00 0.00 C ATOM 878 O HIS A 63 8.816 38.171 -26.514 1.00 0.00 O ATOM 879 CB HIS A 63 9.797 35.505 -27.211 1.00 0.00 C ATOM 880 CG HIS A 63 10.758 34.359 -27.065 1.00 0.00 C ATOM 881 ND1 HIS A 63 11.938 34.284 -27.789 1.00 0.00 N ATOM 882 CD2 HIS A 63 10.725 33.234 -26.284 1.00 0.00 C ATOM 883 CE1 HIS A 63 12.561 33.146 -27.430 1.00 0.00 C ATOM 884 NE2 HIS A 63 11.863 32.468 -26.515 1.00 0.00 N ATOM 0 H HIS A 63 7.240 36.274 -25.420 1.00 0.00 H new ATOM 0 HA HIS A 63 9.870 35.477 -25.040 1.00 0.00 H new ATOM 0 HB2 HIS A 63 8.957 35.209 -27.840 1.00 0.00 H new ATOM 0 HB3 HIS A 63 10.288 36.342 -27.708 1.00 0.00 H new ATOM 0 HD2 HIS A 63 9.935 32.980 -25.593 1.00 0.00 H new ATOM 0 HE1 HIS A 63 13.509 32.821 -27.832 1.00 0.00 H new ATOM 0 HE2 HIS A 63 12.111 31.580 -26.079 1.00 0.00 H new ATOM 892 N PRO A 64 10.109 37.899 -24.738 1.00 0.00 N ATOM 893 CA PRO A 64 10.252 39.350 -24.531 1.00 0.00 C ATOM 894 C PRO A 64 11.230 39.927 -25.553 1.00 0.00 C ATOM 895 O PRO A 64 12.300 40.390 -25.214 1.00 0.00 O ATOM 896 CB PRO A 64 10.807 39.455 -23.121 1.00 0.00 C ATOM 897 CG PRO A 64 11.518 38.159 -22.884 1.00 0.00 C ATOM 898 CD PRO A 64 10.844 37.116 -23.739 1.00 0.00 C ATOM 0 HA PRO A 64 9.320 39.902 -24.653 1.00 0.00 H new ATOM 0 HB2 PRO A 64 11.488 40.301 -23.027 1.00 0.00 H new ATOM 0 HB3 PRO A 64 10.009 39.606 -22.394 1.00 0.00 H new ATOM 0 HG2 PRO A 64 12.573 38.246 -23.144 1.00 0.00 H new ATOM 0 HG3 PRO A 64 11.471 37.882 -21.831 1.00 0.00 H new ATOM 0 HD2 PRO A 64 11.571 36.453 -24.207 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.174 36.489 -23.151 1.00 0.00 H new ATOM 906 N THR A 65 10.864 39.903 -26.801 1.00 0.00 N ATOM 907 CA THR A 65 11.764 40.456 -27.855 1.00 0.00 C ATOM 908 C THR A 65 11.536 41.955 -27.974 1.00 0.00 C ATOM 909 O THR A 65 10.804 42.545 -27.204 1.00 0.00 O ATOM 910 CB THR A 65 11.357 39.772 -29.166 1.00 0.00 C ATOM 911 OG1 THR A 65 10.312 40.515 -29.778 1.00 0.00 O ATOM 912 CG2 THR A 65 10.873 38.352 -28.892 1.00 0.00 C ATOM 0 H THR A 65 9.980 39.524 -27.141 1.00 0.00 H new ATOM 0 HA THR A 65 12.814 40.282 -27.621 1.00 0.00 H new ATOM 0 HB THR A 65 12.221 39.731 -29.829 1.00 0.00 H new ATOM 0 HG1 THR A 65 10.050 40.082 -30.617 1.00 0.00 H new ATOM 0 HG21 THR A 65 10.587 37.878 -29.831 1.00 0.00 H new ATOM 0 HG22 THR A 65 11.674 37.779 -28.425 1.00 0.00 H new ATOM 0 HG23 THR A 65 10.012 38.384 -28.224 1.00 0.00 H new ATOM 920 N ILE A 66 12.142 42.580 -28.940 1.00 0.00 N ATOM 921 CA ILE A 66 11.933 44.041 -29.105 1.00 0.00 C ATOM 922 C ILE A 66 12.808 44.580 -30.247 1.00 0.00 C ATOM 923 O ILE A 66 13.649 43.885 -30.782 1.00 0.00 O ATOM 924 CB ILE A 66 12.297 44.680 -27.745 1.00 0.00 C ATOM 925 CG1 ILE A 66 12.845 46.097 -27.948 1.00 0.00 C ATOM 926 CG2 ILE A 66 13.348 43.837 -27.014 1.00 0.00 C ATOM 927 CD1 ILE A 66 13.264 46.672 -26.595 1.00 0.00 C ATOM 0 H ILE A 66 12.769 42.146 -29.618 1.00 0.00 H new ATOM 0 HA ILE A 66 10.904 44.280 -29.374 1.00 0.00 H new ATOM 0 HB ILE A 66 11.389 44.724 -27.143 1.00 0.00 H new ATOM 0 HG12 ILE A 66 13.697 46.076 -28.628 1.00 0.00 H new ATOM 0 HG13 ILE A 66 12.086 46.731 -28.407 1.00 0.00 H new ATOM 0 HG21 ILE A 66 13.590 44.305 -26.060 1.00 0.00 H new ATOM 0 HG22 ILE A 66 12.954 42.836 -26.838 1.00 0.00 H new ATOM 0 HG23 ILE A 66 14.249 43.770 -27.624 1.00 0.00 H new ATOM 0 HD11 ILE A 66 13.655 47.680 -26.733 1.00 0.00 H new ATOM 0 HD12 ILE A 66 12.400 46.706 -25.931 1.00 0.00 H new ATOM 0 HD13 ILE A 66 14.036 46.041 -26.155 1.00 0.00 H new ATOM 939 N SER A 67 12.595 45.809 -30.633 1.00 0.00 N ATOM 940 CA SER A 67 13.389 46.397 -31.752 1.00 0.00 C ATOM 941 C SER A 67 14.772 46.855 -31.277 1.00 0.00 C ATOM 942 O SER A 67 14.902 47.816 -30.544 1.00 0.00 O ATOM 943 CB SER A 67 12.565 47.594 -32.225 1.00 0.00 C ATOM 944 OG SER A 67 13.070 48.778 -31.623 1.00 0.00 O ATOM 0 H SER A 67 11.903 46.434 -30.220 1.00 0.00 H new ATOM 0 HA SER A 67 13.567 45.670 -32.544 1.00 0.00 H new ATOM 0 HB2 SER A 67 12.611 47.676 -33.311 1.00 0.00 H new ATOM 0 HB3 SER A 67 11.517 47.456 -31.960 1.00 0.00 H new ATOM 0 HG SER A 67 13.391 48.574 -30.720 1.00 0.00 H new ATOM 950 N ASN A 68 15.804 46.179 -31.712 1.00 0.00 N ATOM 951 CA ASN A 68 17.194 46.566 -31.320 1.00 0.00 C ATOM 952 C ASN A 68 17.244 47.059 -29.872 1.00 0.00 C ATOM 953 O ASN A 68 17.575 48.194 -29.608 1.00 0.00 O ATOM 954 CB ASN A 68 17.567 47.699 -32.277 1.00 0.00 C ATOM 955 CG ASN A 68 18.366 47.133 -33.454 1.00 0.00 C ATOM 956 OD1 ASN A 68 18.891 46.041 -33.378 1.00 0.00 O ATOM 957 ND2 ASN A 68 18.481 47.837 -34.547 1.00 0.00 N ATOM 0 H ASN A 68 15.743 45.368 -32.328 1.00 0.00 H new ATOM 0 HA ASN A 68 17.880 45.721 -31.381 1.00 0.00 H new ATOM 0 HB2 ASN A 68 16.666 48.194 -32.640 1.00 0.00 H new ATOM 0 HB3 ASN A 68 18.155 48.452 -31.753 1.00 0.00 H new ATOM 0 HD21 ASN A 68 19.012 47.470 -35.337 1.00 0.00 H new ATOM 0 HD22 ASN A 68 18.040 48.755 -34.611 1.00 0.00 H new ATOM 964 N GLY A 69 16.925 46.214 -28.933 1.00 0.00 N ATOM 965 CA GLY A 69 16.959 46.638 -27.503 1.00 0.00 C ATOM 966 C GLY A 69 17.178 45.414 -26.621 1.00 0.00 C ATOM 967 O GLY A 69 17.964 45.429 -25.696 1.00 0.00 O ATOM 0 H GLY A 69 16.642 45.247 -29.092 1.00 0.00 H new ATOM 0 HA2 GLY A 69 17.758 47.362 -27.345 1.00 0.00 H new ATOM 0 HA3 GLY A 69 16.025 47.131 -27.235 1.00 0.00 H new ATOM 971 N TYR A 70 16.476 44.360 -26.909 1.00 0.00 N ATOM 972 CA TYR A 70 16.597 43.109 -26.103 1.00 0.00 C ATOM 973 C TYR A 70 16.716 43.416 -24.626 1.00 0.00 C ATOM 974 O TYR A 70 16.532 44.529 -24.179 1.00 0.00 O ATOM 975 CB TYR A 70 17.854 42.386 -26.589 1.00 0.00 C ATOM 976 CG TYR A 70 19.098 43.111 -26.128 1.00 0.00 C ATOM 977 CD1 TYR A 70 19.646 42.834 -24.869 1.00 0.00 C ATOM 978 CD2 TYR A 70 19.711 44.049 -26.965 1.00 0.00 C ATOM 979 CE1 TYR A 70 20.805 43.498 -24.449 1.00 0.00 C ATOM 980 CE2 TYR A 70 20.871 44.712 -26.546 1.00 0.00 C ATOM 981 CZ TYR A 70 21.418 44.437 -25.287 1.00 0.00 C ATOM 982 OH TYR A 70 22.561 45.091 -24.874 1.00 0.00 O ATOM 0 H TYR A 70 15.811 44.307 -27.681 1.00 0.00 H new ATOM 0 HA TYR A 70 15.707 42.492 -26.232 1.00 0.00 H new ATOM 0 HB2 TYR A 70 17.861 41.364 -26.210 1.00 0.00 H new ATOM 0 HB3 TYR A 70 17.846 42.323 -27.677 1.00 0.00 H new ATOM 0 HD1 TYR A 70 19.175 42.109 -24.222 1.00 0.00 H new ATOM 0 HD2 TYR A 70 19.289 44.262 -27.936 1.00 0.00 H new ATOM 0 HE1 TYR A 70 21.226 43.286 -23.478 1.00 0.00 H new ATOM 0 HE2 TYR A 70 21.344 45.435 -27.194 1.00 0.00 H new ATOM 0 HH TYR A 70 22.857 45.708 -25.576 1.00 0.00 H new ATOM 992 N LEU A 71 17.026 42.415 -23.874 1.00 0.00 N ATOM 993 CA LEU A 71 17.174 42.598 -22.405 1.00 0.00 C ATOM 994 C LEU A 71 18.428 41.875 -21.912 1.00 0.00 C ATOM 995 O LEU A 71 18.907 40.941 -22.522 1.00 0.00 O ATOM 996 CB LEU A 71 15.879 42.042 -21.767 1.00 0.00 C ATOM 997 CG LEU A 71 15.478 40.677 -22.352 1.00 0.00 C ATOM 998 CD1 LEU A 71 14.873 40.868 -23.737 1.00 0.00 C ATOM 999 CD2 LEU A 71 16.686 39.746 -22.444 1.00 0.00 C ATOM 0 H LEU A 71 17.186 41.465 -24.210 1.00 0.00 H new ATOM 0 HA LEU A 71 17.302 43.645 -22.128 1.00 0.00 H new ATOM 0 HB2 LEU A 71 16.020 41.946 -20.690 1.00 0.00 H new ATOM 0 HB3 LEU A 71 15.067 42.753 -21.920 1.00 0.00 H new ATOM 0 HG LEU A 71 14.742 40.223 -21.689 1.00 0.00 H new ATOM 0 HD11 LEU A 71 14.590 39.899 -24.147 1.00 0.00 H new ATOM 0 HD12 LEU A 71 13.990 41.502 -23.664 1.00 0.00 H new ATOM 0 HD13 LEU A 71 15.605 41.340 -24.392 1.00 0.00 H new ATOM 0 HD21 LEU A 71 16.376 38.788 -22.861 1.00 0.00 H new ATOM 0 HD22 LEU A 71 17.442 40.194 -23.088 1.00 0.00 H new ATOM 0 HD23 LEU A 71 17.103 39.591 -21.449 1.00 0.00 H new ATOM 1011 N SER A 72 18.986 42.319 -20.826 1.00 0.00 N ATOM 1012 CA SER A 72 20.222 41.668 -20.320 1.00 0.00 C ATOM 1013 C SER A 72 19.918 40.874 -19.046 1.00 0.00 C ATOM 1014 O SER A 72 20.684 40.025 -18.634 1.00 0.00 O ATOM 1015 CB SER A 72 21.177 42.825 -20.023 1.00 0.00 C ATOM 1016 OG SER A 72 21.671 42.703 -18.696 1.00 0.00 O ATOM 0 H SER A 72 18.643 43.101 -20.268 1.00 0.00 H new ATOM 0 HA SER A 72 20.645 40.963 -21.035 1.00 0.00 H new ATOM 0 HB2 SER A 72 22.004 42.819 -20.732 1.00 0.00 H new ATOM 0 HB3 SER A 72 20.660 43.777 -20.144 1.00 0.00 H new ATOM 0 HG SER A 72 22.284 43.443 -18.506 1.00 0.00 H new ATOM 1022 N SER A 73 18.808 41.149 -18.418 1.00 0.00 N ATOM 1023 CA SER A 73 18.455 40.417 -17.167 1.00 0.00 C ATOM 1024 C SER A 73 18.593 38.905 -17.374 1.00 0.00 C ATOM 1025 O SER A 73 19.666 38.350 -17.244 1.00 0.00 O ATOM 1026 CB SER A 73 17.002 40.794 -16.885 1.00 0.00 C ATOM 1027 OG SER A 73 16.524 40.029 -15.787 1.00 0.00 O ATOM 0 H SER A 73 18.129 41.849 -18.717 1.00 0.00 H new ATOM 0 HA SER A 73 19.112 40.679 -16.337 1.00 0.00 H new ATOM 0 HB2 SER A 73 16.927 41.858 -16.662 1.00 0.00 H new ATOM 0 HB3 SER A 73 16.388 40.609 -17.767 1.00 0.00 H new ATOM 0 HG SER A 73 15.549 39.950 -15.843 1.00 0.00 H new ATOM 1033 N GLY A 74 17.520 38.230 -17.691 1.00 0.00 N ATOM 1034 CA GLY A 74 17.609 36.759 -17.897 1.00 0.00 C ATOM 1035 C GLY A 74 16.441 36.279 -18.756 1.00 0.00 C ATOM 1036 O GLY A 74 15.402 35.898 -18.255 1.00 0.00 O ATOM 0 H GLY A 74 16.591 38.633 -17.815 1.00 0.00 H new ATOM 0 HA2 GLY A 74 18.553 36.508 -18.380 1.00 0.00 H new ATOM 0 HA3 GLY A 74 17.597 36.248 -16.935 1.00 0.00 H new ATOM 1040 N PHE A 75 16.609 36.285 -20.049 1.00 0.00 N ATOM 1041 CA PHE A 75 15.517 35.819 -20.946 1.00 0.00 C ATOM 1042 C PHE A 75 15.490 34.284 -20.965 1.00 0.00 C ATOM 1043 O PHE A 75 16.274 33.646 -21.637 1.00 0.00 O ATOM 1044 CB PHE A 75 15.864 36.419 -22.325 1.00 0.00 C ATOM 1045 CG PHE A 75 15.674 35.399 -23.429 1.00 0.00 C ATOM 1046 CD1 PHE A 75 14.400 35.176 -23.960 1.00 0.00 C ATOM 1047 CD2 PHE A 75 16.771 34.675 -23.914 1.00 0.00 C ATOM 1048 CE1 PHE A 75 14.219 34.229 -24.974 1.00 0.00 C ATOM 1049 CE2 PHE A 75 16.590 33.728 -24.929 1.00 0.00 C ATOM 1050 CZ PHE A 75 15.314 33.504 -25.459 1.00 0.00 C ATOM 0 H PHE A 75 17.458 36.593 -20.523 1.00 0.00 H new ATOM 0 HA PHE A 75 14.524 36.133 -20.626 1.00 0.00 H new ATOM 0 HB2 PHE A 75 15.233 37.287 -22.516 1.00 0.00 H new ATOM 0 HB3 PHE A 75 16.896 36.769 -22.323 1.00 0.00 H new ATOM 0 HD1 PHE A 75 13.555 35.735 -23.587 1.00 0.00 H new ATOM 0 HD2 PHE A 75 17.756 34.847 -23.505 1.00 0.00 H new ATOM 0 HE1 PHE A 75 13.234 34.057 -25.383 1.00 0.00 H new ATOM 0 HE2 PHE A 75 17.435 33.170 -25.303 1.00 0.00 H new ATOM 0 HZ PHE A 75 15.174 32.773 -26.241 1.00 0.00 H new ATOM 1060 N LYS A 76 14.597 33.690 -20.226 1.00 0.00 N ATOM 1061 CA LYS A 76 14.525 32.202 -20.201 1.00 0.00 C ATOM 1062 C LYS A 76 13.598 31.706 -21.314 1.00 0.00 C ATOM 1063 O LYS A 76 12.515 32.220 -21.503 1.00 0.00 O ATOM 1064 CB LYS A 76 13.952 31.855 -18.826 1.00 0.00 C ATOM 1065 CG LYS A 76 13.965 30.337 -18.633 1.00 0.00 C ATOM 1066 CD LYS A 76 13.012 29.956 -17.498 1.00 0.00 C ATOM 1067 CE LYS A 76 13.817 29.643 -16.233 1.00 0.00 C ATOM 1068 NZ LYS A 76 12.987 30.160 -15.109 1.00 0.00 N ATOM 0 H LYS A 76 13.914 34.169 -19.639 1.00 0.00 H new ATOM 0 HA LYS A 76 15.497 31.735 -20.363 1.00 0.00 H new ATOM 0 HB2 LYS A 76 14.539 32.336 -18.044 1.00 0.00 H new ATOM 0 HB3 LYS A 76 12.934 32.234 -18.739 1.00 0.00 H new ATOM 0 HG2 LYS A 76 13.665 29.840 -19.556 1.00 0.00 H new ATOM 0 HG3 LYS A 76 14.975 29.998 -18.403 1.00 0.00 H new ATOM 0 HD2 LYS A 76 12.316 30.772 -17.305 1.00 0.00 H new ATOM 0 HD3 LYS A 76 12.416 29.090 -17.785 1.00 0.00 H new ATOM 0 HE2 LYS A 76 13.994 28.572 -16.133 1.00 0.00 H new ATOM 0 HE3 LYS A 76 14.794 30.126 -16.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 13.474 29.982 -14.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 12.841 31.183 -15.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 12.066 29.677 -15.107 1.00 0.00 H new ATOM 1082 N ARG A 77 14.018 30.715 -22.051 1.00 0.00 N ATOM 1083 CA ARG A 77 13.163 30.188 -23.155 1.00 0.00 C ATOM 1084 C ARG A 77 11.698 30.135 -22.715 1.00 0.00 C ATOM 1085 O ARG A 77 10.792 30.316 -23.504 1.00 0.00 O ATOM 1086 CB ARG A 77 13.692 28.780 -23.421 1.00 0.00 C ATOM 1087 CG ARG A 77 14.037 28.641 -24.903 1.00 0.00 C ATOM 1088 CD ARG A 77 14.515 27.216 -25.188 1.00 0.00 C ATOM 1089 NE ARG A 77 15.308 27.320 -26.445 1.00 0.00 N ATOM 1090 CZ ARG A 77 16.392 26.608 -26.595 1.00 0.00 C ATOM 1091 NH1 ARG A 77 17.520 27.023 -26.088 1.00 0.00 N ATOM 1092 NH2 ARG A 77 16.347 25.481 -27.253 1.00 0.00 N ATOM 0 H ARG A 77 14.917 30.246 -21.937 1.00 0.00 H new ATOM 0 HA ARG A 77 13.203 30.817 -24.044 1.00 0.00 H new ATOM 0 HB2 ARG A 77 14.575 28.590 -22.811 1.00 0.00 H new ATOM 0 HB3 ARG A 77 12.944 28.039 -23.139 1.00 0.00 H new ATOM 0 HG2 ARG A 77 13.163 28.871 -25.513 1.00 0.00 H new ATOM 0 HG3 ARG A 77 14.813 29.357 -25.175 1.00 0.00 H new ATOM 0 HD2 ARG A 77 15.123 26.832 -24.369 1.00 0.00 H new ATOM 0 HD3 ARG A 77 13.673 26.534 -25.307 1.00 0.00 H new ATOM 0 HE ARG A 77 15.004 27.948 -27.189 1.00 0.00 H new ATOM 0 HH11 ARG A 77 17.555 27.904 -25.574 1.00 0.00 H new ATOM 0 HH12 ARG A 77 18.367 26.467 -26.205 1.00 0.00 H new ATOM 0 HH21 ARG A 77 15.465 25.157 -27.650 1.00 0.00 H new ATOM 0 HH22 ARG A 77 17.194 24.925 -27.370 1.00 0.00 H new ATOM 1106 N SER A 78 11.465 29.892 -21.457 1.00 0.00 N ATOM 1107 CA SER A 78 10.062 29.830 -20.951 1.00 0.00 C ATOM 1108 C SER A 78 9.901 30.746 -19.733 1.00 0.00 C ATOM 1109 O SER A 78 10.720 30.751 -18.835 1.00 0.00 O ATOM 1110 CB SER A 78 9.848 28.369 -20.559 1.00 0.00 C ATOM 1111 OG SER A 78 9.444 27.630 -21.705 1.00 0.00 O ATOM 0 H SER A 78 12.186 29.733 -20.753 1.00 0.00 H new ATOM 0 HA SER A 78 9.337 30.161 -21.695 1.00 0.00 H new ATOM 0 HB2 SER A 78 10.768 27.952 -20.149 1.00 0.00 H new ATOM 0 HB3 SER A 78 9.090 28.297 -19.779 1.00 0.00 H new ATOM 0 HG SER A 78 9.307 26.692 -21.458 1.00 0.00 H new ATOM 1117 N TYR A 79 8.853 31.525 -19.698 1.00 0.00 N ATOM 1118 CA TYR A 79 8.641 32.448 -18.540 1.00 0.00 C ATOM 1119 C TYR A 79 7.342 32.080 -17.815 1.00 0.00 C ATOM 1120 O TYR A 79 6.847 30.979 -17.948 1.00 0.00 O ATOM 1121 CB TYR A 79 8.543 33.852 -19.148 1.00 0.00 C ATOM 1122 CG TYR A 79 9.475 33.968 -20.337 1.00 0.00 C ATOM 1123 CD1 TYR A 79 9.054 33.542 -21.606 1.00 0.00 C ATOM 1124 CD2 TYR A 79 10.760 34.500 -20.170 1.00 0.00 C ATOM 1125 CE1 TYR A 79 9.915 33.649 -22.700 1.00 0.00 C ATOM 1126 CE2 TYR A 79 11.620 34.607 -21.268 1.00 0.00 C ATOM 1127 CZ TYR A 79 11.195 34.181 -22.533 1.00 0.00 C ATOM 1128 OH TYR A 79 12.038 34.284 -23.617 1.00 0.00 O ATOM 0 H TYR A 79 8.134 31.564 -20.420 1.00 0.00 H new ATOM 0 HA TYR A 79 9.447 32.387 -17.809 1.00 0.00 H new ATOM 0 HB2 TYR A 79 7.517 34.052 -19.458 1.00 0.00 H new ATOM 0 HB3 TYR A 79 8.801 34.601 -18.399 1.00 0.00 H new ATOM 0 HD1 TYR A 79 8.064 33.131 -21.737 1.00 0.00 H new ATOM 0 HD2 TYR A 79 11.087 34.827 -19.194 1.00 0.00 H new ATOM 0 HE1 TYR A 79 9.591 33.320 -23.676 1.00 0.00 H new ATOM 0 HE2 TYR A 79 12.611 35.018 -21.141 1.00 0.00 H new ATOM 0 HH TYR A 79 12.964 34.152 -23.325 1.00 0.00 H new ATOM 1138 N SER A 80 6.778 32.982 -17.051 1.00 0.00 N ATOM 1139 CA SER A 80 5.511 32.639 -16.339 1.00 0.00 C ATOM 1140 C SER A 80 4.712 33.904 -15.955 1.00 0.00 C ATOM 1141 O SER A 80 4.166 34.576 -16.800 1.00 0.00 O ATOM 1142 CB SER A 80 5.954 31.873 -15.092 1.00 0.00 C ATOM 1143 OG SER A 80 6.681 32.745 -14.237 1.00 0.00 O ATOM 0 H SER A 80 7.133 33.925 -16.892 1.00 0.00 H new ATOM 0 HA SER A 80 4.844 32.051 -16.970 1.00 0.00 H new ATOM 0 HB2 SER A 80 5.085 31.474 -14.569 1.00 0.00 H new ATOM 0 HB3 SER A 80 6.574 31.023 -15.375 1.00 0.00 H new ATOM 0 HG SER A 80 6.965 32.257 -13.436 1.00 0.00 H new ATOM 1149 N TYR A 81 4.601 34.217 -14.686 1.00 0.00 N ATOM 1150 CA TYR A 81 3.803 35.416 -14.284 1.00 0.00 C ATOM 1151 C TYR A 81 4.707 36.483 -13.636 1.00 0.00 C ATOM 1152 O TYR A 81 4.228 37.427 -13.041 1.00 0.00 O ATOM 1153 CB TYR A 81 2.754 34.858 -13.299 1.00 0.00 C ATOM 1154 CG TYR A 81 2.806 35.575 -11.968 1.00 0.00 C ATOM 1155 CD1 TYR A 81 2.027 36.718 -11.758 1.00 0.00 C ATOM 1156 CD2 TYR A 81 3.633 35.093 -10.949 1.00 0.00 C ATOM 1157 CE1 TYR A 81 2.076 37.381 -10.526 1.00 0.00 C ATOM 1158 CE2 TYR A 81 3.683 35.755 -9.718 1.00 0.00 C ATOM 1159 CZ TYR A 81 2.905 36.900 -9.506 1.00 0.00 C ATOM 1160 OH TYR A 81 2.954 37.553 -8.291 1.00 0.00 O ATOM 0 H TYR A 81 5.025 33.698 -13.917 1.00 0.00 H new ATOM 0 HA TYR A 81 3.332 35.920 -15.128 1.00 0.00 H new ATOM 0 HB2 TYR A 81 1.758 34.961 -13.730 1.00 0.00 H new ATOM 0 HB3 TYR A 81 2.927 33.793 -13.147 1.00 0.00 H new ATOM 0 HD1 TYR A 81 1.388 37.089 -12.546 1.00 0.00 H new ATOM 0 HD2 TYR A 81 4.233 34.210 -11.112 1.00 0.00 H new ATOM 0 HE1 TYR A 81 1.475 38.263 -10.363 1.00 0.00 H new ATOM 0 HE2 TYR A 81 4.322 35.383 -8.931 1.00 0.00 H new ATOM 0 HH TYR A 81 3.578 37.088 -7.695 1.00 0.00 H new ATOM 1170 N ASN A 82 6.006 36.339 -13.729 1.00 0.00 N ATOM 1171 CA ASN A 82 6.904 37.358 -13.090 1.00 0.00 C ATOM 1172 C ASN A 82 8.311 37.365 -13.683 1.00 0.00 C ATOM 1173 O ASN A 82 9.132 38.172 -13.304 1.00 0.00 O ATOM 1174 CB ASN A 82 6.980 36.931 -11.646 1.00 0.00 C ATOM 1175 CG ASN A 82 6.298 37.973 -10.758 1.00 0.00 C ATOM 1176 OD1 ASN A 82 5.097 37.941 -10.578 1.00 0.00 O ATOM 1177 ND2 ASN A 82 7.017 38.904 -10.192 1.00 0.00 N ATOM 0 H ASN A 82 6.480 35.575 -14.210 1.00 0.00 H new ATOM 0 HA ASN A 82 6.512 38.364 -13.241 1.00 0.00 H new ATOM 0 HB2 ASN A 82 6.499 35.961 -11.519 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.021 36.812 -11.347 1.00 0.00 H new ATOM 0 HD21 ASN A 82 6.570 39.604 -9.599 1.00 0.00 H new ATOM 0 HD22 ASN A 82 8.025 38.932 -10.342 1.00 0.00 H new ATOM 1184 N ASP A 83 8.610 36.489 -14.587 1.00 0.00 N ATOM 1185 CA ASP A 83 9.976 36.494 -15.183 1.00 0.00 C ATOM 1186 C ASP A 83 10.261 37.890 -15.747 1.00 0.00 C ATOM 1187 O ASP A 83 10.010 38.167 -16.902 1.00 0.00 O ATOM 1188 CB ASP A 83 9.931 35.450 -16.300 1.00 0.00 C ATOM 1189 CG ASP A 83 11.253 34.681 -16.335 1.00 0.00 C ATOM 1190 OD1 ASP A 83 12.017 34.811 -15.393 1.00 0.00 O ATOM 1191 OD2 ASP A 83 11.477 33.973 -17.303 1.00 0.00 O ATOM 0 H ASP A 83 7.978 35.772 -14.942 1.00 0.00 H new ATOM 0 HA ASP A 83 10.760 36.262 -14.462 1.00 0.00 H new ATOM 0 HB2 ASP A 83 9.102 34.762 -16.135 1.00 0.00 H new ATOM 0 HB3 ASP A 83 9.756 35.936 -17.260 1.00 0.00 H new ATOM 1196 N ASN A 84 10.750 38.778 -14.925 1.00 0.00 N ATOM 1197 CA ASN A 84 11.014 40.170 -15.387 1.00 0.00 C ATOM 1198 C ASN A 84 12.233 40.241 -16.309 1.00 0.00 C ATOM 1199 O ASN A 84 13.303 39.767 -15.980 1.00 0.00 O ATOM 1200 CB ASN A 84 11.279 40.962 -14.106 1.00 0.00 C ATOM 1201 CG ASN A 84 11.517 42.432 -14.455 1.00 0.00 C ATOM 1202 OD1 ASN A 84 10.737 43.035 -15.166 1.00 0.00 O ATOM 1203 ND2 ASN A 84 12.571 43.041 -13.982 1.00 0.00 N ATOM 0 H ASN A 84 10.979 38.598 -13.948 1.00 0.00 H new ATOM 0 HA ASN A 84 10.176 40.561 -15.963 1.00 0.00 H new ATOM 0 HB2 ASN A 84 10.431 40.871 -13.428 1.00 0.00 H new ATOM 0 HB3 ASN A 84 12.147 40.555 -13.587 1.00 0.00 H new ATOM 0 HD21 ASN A 84 12.739 44.021 -14.209 1.00 0.00 H new ATOM 0 HD22 ASN A 84 13.227 42.537 -13.385 1.00 0.00 H new ATOM 1210 N VAL A 85 12.087 40.862 -17.450 1.00 0.00 N ATOM 1211 CA VAL A 85 13.246 40.998 -18.373 1.00 0.00 C ATOM 1212 C VAL A 85 13.591 42.478 -18.550 1.00 0.00 C ATOM 1213 O VAL A 85 12.804 43.254 -19.055 1.00 0.00 O ATOM 1214 CB VAL A 85 12.819 40.391 -19.703 1.00 0.00 C ATOM 1215 CG1 VAL A 85 12.909 38.866 -19.617 1.00 0.00 C ATOM 1216 CG2 VAL A 85 11.386 40.802 -20.035 1.00 0.00 C ATOM 0 H VAL A 85 11.217 41.279 -17.780 1.00 0.00 H new ATOM 0 HA VAL A 85 14.129 40.492 -17.983 1.00 0.00 H new ATOM 0 HB VAL A 85 13.481 40.754 -20.489 1.00 0.00 H new ATOM 0 HG11 VAL A 85 12.604 38.429 -20.568 1.00 0.00 H new ATOM 0 HG12 VAL A 85 13.936 38.574 -19.396 1.00 0.00 H new ATOM 0 HG13 VAL A 85 12.252 38.507 -18.825 1.00 0.00 H new ATOM 0 HG21 VAL A 85 11.093 40.362 -20.988 1.00 0.00 H new ATOM 0 HG22 VAL A 85 10.716 40.450 -19.251 1.00 0.00 H new ATOM 0 HG23 VAL A 85 11.326 41.888 -20.103 1.00 0.00 H new ATOM 1226 N ASP A 86 14.764 42.871 -18.144 1.00 0.00 N ATOM 1227 CA ASP A 86 15.169 44.301 -18.294 1.00 0.00 C ATOM 1228 C ASP A 86 15.692 44.522 -19.710 1.00 0.00 C ATOM 1229 O ASP A 86 16.621 43.873 -20.144 1.00 0.00 O ATOM 1230 CB ASP A 86 16.275 44.519 -17.262 1.00 0.00 C ATOM 1231 CG ASP A 86 16.016 45.823 -16.505 1.00 0.00 C ATOM 1232 OD1 ASP A 86 14.973 45.925 -15.880 1.00 0.00 O ATOM 1233 OD2 ASP A 86 16.866 46.697 -16.561 1.00 0.00 O ATOM 0 H ASP A 86 15.463 42.266 -17.714 1.00 0.00 H new ATOM 0 HA ASP A 86 14.344 44.996 -18.136 1.00 0.00 H new ATOM 0 HB2 ASP A 86 16.307 43.682 -16.565 1.00 0.00 H new ATOM 0 HB3 ASP A 86 17.246 44.560 -17.756 1.00 0.00 H new ATOM 1238 N PHE A 87 15.085 45.405 -20.448 1.00 0.00 N ATOM 1239 CA PHE A 87 15.531 45.618 -21.850 1.00 0.00 C ATOM 1240 C PHE A 87 16.738 46.549 -21.943 1.00 0.00 C ATOM 1241 O PHE A 87 16.836 47.549 -21.258 1.00 0.00 O ATOM 1242 CB PHE A 87 14.313 46.190 -22.562 1.00 0.00 C ATOM 1243 CG PHE A 87 13.356 45.051 -22.770 1.00 0.00 C ATOM 1244 CD1 PHE A 87 13.611 44.110 -23.771 1.00 0.00 C ATOM 1245 CD2 PHE A 87 12.243 44.906 -21.936 1.00 0.00 C ATOM 1246 CE1 PHE A 87 12.749 43.027 -23.946 1.00 0.00 C ATOM 1247 CE2 PHE A 87 11.384 43.816 -22.106 1.00 0.00 C ATOM 1248 CZ PHE A 87 11.638 42.878 -23.112 1.00 0.00 C ATOM 0 H PHE A 87 14.304 45.986 -20.144 1.00 0.00 H new ATOM 0 HA PHE A 87 15.873 44.689 -22.307 1.00 0.00 H new ATOM 0 HB2 PHE A 87 13.852 46.978 -21.967 1.00 0.00 H new ATOM 0 HB3 PHE A 87 14.597 46.635 -23.516 1.00 0.00 H new ATOM 0 HD1 PHE A 87 14.475 44.221 -24.409 1.00 0.00 H new ATOM 0 HD2 PHE A 87 12.047 45.634 -21.163 1.00 0.00 H new ATOM 0 HE1 PHE A 87 12.940 42.304 -24.726 1.00 0.00 H new ATOM 0 HE2 PHE A 87 10.525 43.698 -21.461 1.00 0.00 H new ATOM 0 HZ PHE A 87 10.974 42.037 -23.244 1.00 0.00 H new ATOM 1258 N LYS A 88 17.661 46.201 -22.799 1.00 0.00 N ATOM 1259 CA LYS A 88 18.890 47.020 -22.978 1.00 0.00 C ATOM 1260 C LYS A 88 18.904 47.648 -24.374 1.00 0.00 C ATOM 1261 O LYS A 88 19.498 47.118 -25.292 1.00 0.00 O ATOM 1262 CB LYS A 88 20.032 46.017 -22.842 1.00 0.00 C ATOM 1263 CG LYS A 88 20.955 46.438 -21.695 1.00 0.00 C ATOM 1264 CD LYS A 88 22.332 46.805 -22.254 1.00 0.00 C ATOM 1265 CE LYS A 88 23.084 47.677 -21.243 1.00 0.00 C ATOM 1266 NZ LYS A 88 24.496 47.194 -21.279 1.00 0.00 N ATOM 0 H LYS A 88 17.612 45.371 -23.390 1.00 0.00 H new ATOM 0 HA LYS A 88 18.960 47.836 -22.259 1.00 0.00 H new ATOM 0 HB2 LYS A 88 19.633 45.020 -22.653 1.00 0.00 H new ATOM 0 HB3 LYS A 88 20.595 45.964 -23.774 1.00 0.00 H new ATOM 0 HG2 LYS A 88 20.528 47.289 -21.164 1.00 0.00 H new ATOM 0 HG3 LYS A 88 21.049 45.627 -20.973 1.00 0.00 H new ATOM 0 HD2 LYS A 88 22.903 45.900 -22.464 1.00 0.00 H new ATOM 0 HD3 LYS A 88 22.222 47.339 -23.198 1.00 0.00 H new ATOM 0 HE2 LYS A 88 23.022 48.732 -21.511 1.00 0.00 H new ATOM 0 HE3 LYS A 88 22.659 47.576 -20.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 25.069 47.747 -20.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 24.526 46.189 -21.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 24.878 47.309 -22.240 1.00 0.00 H new ATOM 1280 N CYS A 89 18.253 48.766 -24.537 1.00 0.00 N ATOM 1281 CA CYS A 89 18.220 49.432 -25.872 1.00 0.00 C ATOM 1282 C CYS A 89 19.575 49.307 -26.573 1.00 0.00 C ATOM 1283 O CYS A 89 20.603 49.617 -26.006 1.00 0.00 O ATOM 1284 CB CYS A 89 17.918 50.898 -25.567 1.00 0.00 C ATOM 1285 SG CYS A 89 16.668 51.508 -26.721 1.00 0.00 S ATOM 0 H CYS A 89 17.740 49.250 -23.800 1.00 0.00 H new ATOM 0 HA CYS A 89 17.481 48.982 -26.535 1.00 0.00 H new ATOM 0 HB2 CYS A 89 17.563 51.002 -24.542 1.00 0.00 H new ATOM 0 HB3 CYS A 89 18.827 51.493 -25.651 1.00 0.00 H new ATOM 1290 N LYS A 90 19.579 48.854 -27.801 1.00 0.00 N ATOM 1291 CA LYS A 90 20.868 48.709 -28.546 1.00 0.00 C ATOM 1292 C LYS A 90 21.816 49.866 -28.207 1.00 0.00 C ATOM 1293 O LYS A 90 22.672 49.751 -27.352 1.00 0.00 O ATOM 1294 CB LYS A 90 20.473 48.762 -30.021 1.00 0.00 C ATOM 1295 CG LYS A 90 20.476 47.348 -30.604 1.00 0.00 C ATOM 1296 CD LYS A 90 21.299 47.333 -31.893 1.00 0.00 C ATOM 1297 CE LYS A 90 22.596 46.554 -31.662 1.00 0.00 C ATOM 1298 NZ LYS A 90 23.685 47.497 -32.039 1.00 0.00 N ATOM 0 H LYS A 90 18.746 48.578 -28.321 1.00 0.00 H new ATOM 0 HA LYS A 90 21.390 47.787 -28.290 1.00 0.00 H new ATOM 0 HB2 LYS A 90 19.484 49.208 -30.127 1.00 0.00 H new ATOM 0 HB3 LYS A 90 21.169 49.395 -30.572 1.00 0.00 H new ATOM 0 HG2 LYS A 90 20.896 46.646 -29.883 1.00 0.00 H new ATOM 0 HG3 LYS A 90 19.455 47.024 -30.807 1.00 0.00 H new ATOM 0 HD2 LYS A 90 20.725 46.874 -32.698 1.00 0.00 H new ATOM 0 HD3 LYS A 90 21.525 48.353 -32.204 1.00 0.00 H new ATOM 0 HE2 LYS A 90 22.688 46.240 -30.622 1.00 0.00 H new ATOM 0 HE3 LYS A 90 22.628 45.651 -32.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 24.607 47.034 -31.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 23.576 47.773 -33.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 23.634 48.344 -31.438 1.00 0.00 H new ATOM 1312 N TYR A 91 21.663 50.980 -28.868 1.00 0.00 N ATOM 1313 CA TYR A 91 22.545 52.151 -28.584 1.00 0.00 C ATOM 1314 C TYR A 91 21.957 53.413 -29.222 1.00 0.00 C ATOM 1315 O TYR A 91 21.391 53.369 -30.296 1.00 0.00 O ATOM 1316 CB TYR A 91 23.895 51.805 -29.216 1.00 0.00 C ATOM 1317 CG TYR A 91 25.004 52.366 -28.359 1.00 0.00 C ATOM 1318 CD1 TYR A 91 25.290 51.786 -27.118 1.00 0.00 C ATOM 1319 CD2 TYR A 91 25.744 53.468 -28.805 1.00 0.00 C ATOM 1320 CE1 TYR A 91 26.315 52.309 -26.321 1.00 0.00 C ATOM 1321 CE2 TYR A 91 26.770 53.990 -28.009 1.00 0.00 C ATOM 1322 CZ TYR A 91 27.056 53.411 -26.767 1.00 0.00 C ATOM 1323 OH TYR A 91 28.066 53.926 -25.979 1.00 0.00 O ATOM 0 H TYR A 91 20.964 51.132 -29.595 1.00 0.00 H new ATOM 0 HA TYR A 91 22.642 52.346 -27.516 1.00 0.00 H new ATOM 0 HB2 TYR A 91 24.001 50.724 -29.307 1.00 0.00 H new ATOM 0 HB3 TYR A 91 23.954 52.217 -30.224 1.00 0.00 H new ATOM 0 HD1 TYR A 91 24.720 50.935 -26.775 1.00 0.00 H new ATOM 0 HD2 TYR A 91 25.523 53.915 -29.763 1.00 0.00 H new ATOM 0 HE1 TYR A 91 26.535 51.863 -25.362 1.00 0.00 H new ATOM 0 HE2 TYR A 91 27.341 54.840 -28.353 1.00 0.00 H new ATOM 0 HH TYR A 91 28.481 54.687 -26.435 1.00 0.00 H new ATOM 1333 N GLY A 92 22.079 54.538 -28.570 1.00 0.00 N ATOM 1334 CA GLY A 92 21.516 55.793 -29.144 1.00 0.00 C ATOM 1335 C GLY A 92 20.025 55.591 -29.416 1.00 0.00 C ATOM 1336 O GLY A 92 19.522 55.923 -30.471 1.00 0.00 O ATOM 0 H GLY A 92 22.543 54.642 -27.667 1.00 0.00 H new ATOM 0 HA2 GLY A 92 21.664 56.623 -28.452 1.00 0.00 H new ATOM 0 HA3 GLY A 92 22.035 56.051 -30.067 1.00 0.00 H new ATOM 1340 N TYR A 93 19.318 55.039 -28.469 1.00 0.00 N ATOM 1341 CA TYR A 93 17.861 54.799 -28.662 1.00 0.00 C ATOM 1342 C TYR A 93 17.142 54.833 -27.311 1.00 0.00 C ATOM 1343 O TYR A 93 17.740 54.622 -26.274 1.00 0.00 O ATOM 1344 CB TYR A 93 17.778 53.404 -29.274 1.00 0.00 C ATOM 1345 CG TYR A 93 18.209 53.453 -30.720 1.00 0.00 C ATOM 1346 CD1 TYR A 93 17.683 54.425 -31.577 1.00 0.00 C ATOM 1347 CD2 TYR A 93 19.137 52.523 -31.204 1.00 0.00 C ATOM 1348 CE1 TYR A 93 18.084 54.468 -32.918 1.00 0.00 C ATOM 1349 CE2 TYR A 93 19.539 52.566 -32.544 1.00 0.00 C ATOM 1350 CZ TYR A 93 19.012 53.538 -33.401 1.00 0.00 C ATOM 1351 OH TYR A 93 19.408 53.580 -34.722 1.00 0.00 O ATOM 0 H TYR A 93 19.689 54.743 -27.566 1.00 0.00 H new ATOM 0 HA TYR A 93 17.392 55.554 -29.293 1.00 0.00 H new ATOM 0 HB2 TYR A 93 18.414 52.715 -28.719 1.00 0.00 H new ATOM 0 HB3 TYR A 93 16.758 53.025 -29.202 1.00 0.00 H new ATOM 0 HD1 TYR A 93 16.967 55.143 -31.204 1.00 0.00 H new ATOM 0 HD2 TYR A 93 19.543 51.772 -30.543 1.00 0.00 H new ATOM 0 HE1 TYR A 93 17.677 55.219 -33.580 1.00 0.00 H new ATOM 0 HE2 TYR A 93 20.256 51.849 -32.916 1.00 0.00 H new ATOM 0 HH TYR A 93 20.057 52.866 -34.892 1.00 0.00 H new ATOM 1361 N LYS A 94 15.864 55.094 -27.312 1.00 0.00 N ATOM 1362 CA LYS A 94 15.114 55.137 -26.025 1.00 0.00 C ATOM 1363 C LYS A 94 14.006 54.079 -26.026 1.00 0.00 C ATOM 1364 O LYS A 94 13.047 54.171 -26.765 1.00 0.00 O ATOM 1365 CB LYS A 94 14.520 56.544 -25.958 1.00 0.00 C ATOM 1366 CG LYS A 94 15.066 57.270 -24.726 1.00 0.00 C ATOM 1367 CD LYS A 94 14.571 58.718 -24.724 1.00 0.00 C ATOM 1368 CE LYS A 94 13.186 58.786 -24.075 1.00 0.00 C ATOM 1369 NZ LYS A 94 13.418 59.371 -22.724 1.00 0.00 N ATOM 0 H LYS A 94 15.307 55.279 -28.146 1.00 0.00 H new ATOM 0 HA LYS A 94 15.751 54.927 -25.166 1.00 0.00 H new ATOM 0 HB2 LYS A 94 14.771 57.100 -26.862 1.00 0.00 H new ATOM 0 HB3 LYS A 94 13.432 56.489 -25.909 1.00 0.00 H new ATOM 0 HG2 LYS A 94 14.741 56.762 -23.818 1.00 0.00 H new ATOM 0 HG3 LYS A 94 16.156 57.247 -24.731 1.00 0.00 H new ATOM 0 HD2 LYS A 94 15.271 59.351 -24.179 1.00 0.00 H new ATOM 0 HD3 LYS A 94 14.525 59.099 -25.744 1.00 0.00 H new ATOM 0 HE2 LYS A 94 12.506 59.405 -24.661 1.00 0.00 H new ATOM 0 HE3 LYS A 94 12.735 57.796 -24.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 12.512 59.448 -22.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 14.063 58.758 -22.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 13.841 60.316 -22.823 1.00 0.00 H new ATOM 1383 N LEU A 95 14.133 53.073 -25.205 1.00 0.00 N ATOM 1384 CA LEU A 95 13.087 52.009 -25.163 1.00 0.00 C ATOM 1385 C LEU A 95 11.694 52.633 -25.075 1.00 0.00 C ATOM 1386 O LEU A 95 11.218 52.959 -24.006 1.00 0.00 O ATOM 1387 CB LEU A 95 13.378 51.206 -23.892 1.00 0.00 C ATOM 1388 CG LEU A 95 14.619 50.337 -24.095 1.00 0.00 C ATOM 1389 CD1 LEU A 95 15.256 50.037 -22.737 1.00 0.00 C ATOM 1390 CD2 LEU A 95 14.221 49.022 -24.770 1.00 0.00 C ATOM 0 H LEU A 95 14.914 52.941 -24.562 1.00 0.00 H new ATOM 0 HA LEU A 95 13.108 51.388 -26.058 1.00 0.00 H new ATOM 0 HB2 LEU A 95 13.532 51.883 -23.052 1.00 0.00 H new ATOM 0 HB3 LEU A 95 12.522 50.579 -23.644 1.00 0.00 H new ATOM 0 HG LEU A 95 15.333 50.867 -24.726 1.00 0.00 H new ATOM 0 HD11 LEU A 95 16.141 49.417 -22.879 1.00 0.00 H new ATOM 0 HD12 LEU A 95 15.541 50.972 -22.254 1.00 0.00 H new ATOM 0 HD13 LEU A 95 14.540 49.508 -22.108 1.00 0.00 H new ATOM 0 HD21 LEU A 95 15.107 48.404 -24.914 1.00 0.00 H new ATOM 0 HD22 LEU A 95 13.507 48.491 -24.140 1.00 0.00 H new ATOM 0 HD23 LEU A 95 13.765 49.233 -25.737 1.00 0.00 H new ATOM 1402 N SER A 96 11.031 52.790 -26.185 1.00 0.00 N ATOM 1403 CA SER A 96 9.663 53.377 -26.150 1.00 0.00 C ATOM 1404 C SER A 96 8.675 52.336 -25.621 1.00 0.00 C ATOM 1405 O SER A 96 8.163 51.522 -26.363 1.00 0.00 O ATOM 1406 CB SER A 96 9.344 53.731 -27.601 1.00 0.00 C ATOM 1407 OG SER A 96 7.989 53.400 -27.875 1.00 0.00 O ATOM 0 H SER A 96 11.375 52.539 -27.112 1.00 0.00 H new ATOM 0 HA SER A 96 9.597 54.250 -25.500 1.00 0.00 H new ATOM 0 HB2 SER A 96 9.514 54.794 -27.775 1.00 0.00 H new ATOM 0 HB3 SER A 96 10.007 53.188 -28.275 1.00 0.00 H new ATOM 0 HG SER A 96 7.886 52.426 -27.884 1.00 0.00 H new ATOM 1413 N GLY A 97 8.410 52.349 -24.343 1.00 0.00 N ATOM 1414 CA GLY A 97 7.460 51.354 -23.772 1.00 0.00 C ATOM 1415 C GLY A 97 7.857 51.031 -22.330 1.00 0.00 C ATOM 1416 O GLY A 97 7.407 51.666 -21.397 1.00 0.00 O ATOM 0 H GLY A 97 8.810 53.004 -23.671 1.00 0.00 H new ATOM 0 HA2 GLY A 97 6.444 51.749 -23.800 1.00 0.00 H new ATOM 0 HA3 GLY A 97 7.465 50.445 -24.373 1.00 0.00 H new ATOM 1420 N SER A 98 8.694 50.048 -22.138 1.00 0.00 N ATOM 1421 CA SER A 98 9.112 49.688 -20.752 1.00 0.00 C ATOM 1422 C SER A 98 10.485 49.008 -20.762 1.00 0.00 C ATOM 1423 O SER A 98 10.664 47.955 -21.342 1.00 0.00 O ATOM 1424 CB SER A 98 8.037 48.721 -20.262 1.00 0.00 C ATOM 1425 OG SER A 98 7.790 48.952 -18.881 1.00 0.00 O ATOM 0 H SER A 98 9.106 49.480 -22.878 1.00 0.00 H new ATOM 0 HA SER A 98 9.204 50.563 -20.109 1.00 0.00 H new ATOM 0 HB2 SER A 98 7.120 48.858 -20.835 1.00 0.00 H new ATOM 0 HB3 SER A 98 8.359 47.692 -20.418 1.00 0.00 H new ATOM 0 HG SER A 98 8.157 48.211 -18.355 1.00 0.00 H new ATOM 1431 N SER A 99 11.454 49.603 -20.121 1.00 0.00 N ATOM 1432 CA SER A 99 12.817 48.996 -20.091 1.00 0.00 C ATOM 1433 C SER A 99 12.836 47.767 -19.177 1.00 0.00 C ATOM 1434 O SER A 99 13.811 47.046 -19.110 1.00 0.00 O ATOM 1435 CB SER A 99 13.721 50.090 -19.529 1.00 0.00 C ATOM 1436 OG SER A 99 13.703 50.029 -18.109 1.00 0.00 O ATOM 0 H SER A 99 11.361 50.484 -19.616 1.00 0.00 H new ATOM 0 HA SER A 99 13.139 48.661 -21.077 1.00 0.00 H new ATOM 0 HB2 SER A 99 14.739 49.962 -19.897 1.00 0.00 H new ATOM 0 HB3 SER A 99 13.381 51.069 -19.867 1.00 0.00 H new ATOM 0 HG SER A 99 14.284 50.729 -17.744 1.00 0.00 H new ATOM 1442 N SER A 100 11.766 47.522 -18.472 1.00 0.00 N ATOM 1443 CA SER A 100 11.725 46.339 -17.565 1.00 0.00 C ATOM 1444 C SER A 100 10.336 45.701 -17.606 1.00 0.00 C ATOM 1445 O SER A 100 9.400 46.186 -17.000 1.00 0.00 O ATOM 1446 CB SER A 100 12.022 46.895 -16.174 1.00 0.00 C ATOM 1447 OG SER A 100 10.880 47.595 -15.695 1.00 0.00 O ATOM 0 H SER A 100 10.918 48.089 -18.484 1.00 0.00 H new ATOM 0 HA SER A 100 12.440 45.568 -17.852 1.00 0.00 H new ATOM 0 HB2 SER A 100 12.278 46.084 -15.492 1.00 0.00 H new ATOM 0 HB3 SER A 100 12.883 47.563 -16.213 1.00 0.00 H new ATOM 0 HG SER A 100 10.200 47.633 -16.400 1.00 0.00 H new ATOM 1453 N SER A 101 10.194 44.622 -18.322 1.00 0.00 N ATOM 1454 CA SER A 101 8.862 43.960 -18.409 1.00 0.00 C ATOM 1455 C SER A 101 8.874 42.622 -17.693 1.00 0.00 C ATOM 1456 O SER A 101 9.910 42.057 -17.410 1.00 0.00 O ATOM 1457 CB SER A 101 8.610 43.762 -19.903 1.00 0.00 C ATOM 1458 OG SER A 101 8.864 44.981 -20.589 1.00 0.00 O ATOM 0 H SER A 101 10.940 44.170 -18.850 1.00 0.00 H new ATOM 0 HA SER A 101 8.084 44.559 -17.936 1.00 0.00 H new ATOM 0 HB2 SER A 101 9.254 42.973 -20.290 1.00 0.00 H new ATOM 0 HB3 SER A 101 7.581 43.445 -20.071 1.00 0.00 H new ATOM 0 HG SER A 101 9.798 45.002 -20.884 1.00 0.00 H new ATOM 1464 N THR A 102 7.716 42.118 -17.394 1.00 0.00 N ATOM 1465 CA THR A 102 7.632 40.820 -16.692 1.00 0.00 C ATOM 1466 C THR A 102 6.512 39.976 -17.282 1.00 0.00 C ATOM 1467 O THR A 102 5.412 40.448 -17.500 1.00 0.00 O ATOM 1468 CB THR A 102 7.317 41.180 -15.243 1.00 0.00 C ATOM 1469 OG1 THR A 102 8.082 42.314 -14.858 1.00 0.00 O ATOM 1470 CG2 THR A 102 7.669 39.997 -14.352 1.00 0.00 C ATOM 0 H THR A 102 6.819 42.554 -17.608 1.00 0.00 H new ATOM 0 HA THR A 102 8.550 40.240 -16.782 1.00 0.00 H new ATOM 0 HB THR A 102 6.257 41.414 -15.142 1.00 0.00 H new ATOM 0 HG1 THR A 102 9.022 42.170 -15.095 1.00 0.00 H new ATOM 0 HG21 THR A 102 7.447 40.245 -13.314 1.00 0.00 H new ATOM 0 HG22 THR A 102 7.082 39.129 -14.651 1.00 0.00 H new ATOM 0 HG23 THR A 102 8.730 39.769 -14.452 1.00 0.00 H new ATOM 1478 N CYS A 103 6.772 38.726 -17.534 1.00 0.00 N ATOM 1479 CA CYS A 103 5.704 37.866 -18.093 1.00 0.00 C ATOM 1480 C CYS A 103 4.558 37.794 -17.093 1.00 0.00 C ATOM 1481 O CYS A 103 4.581 37.011 -16.169 1.00 0.00 O ATOM 1482 CB CYS A 103 6.331 36.491 -18.282 1.00 0.00 C ATOM 1483 SG CYS A 103 5.147 35.435 -19.141 1.00 0.00 S ATOM 0 H CYS A 103 7.670 38.268 -17.378 1.00 0.00 H new ATOM 0 HA CYS A 103 5.310 38.248 -19.035 1.00 0.00 H new ATOM 0 HB2 CYS A 103 7.254 36.571 -18.857 1.00 0.00 H new ATOM 0 HB3 CYS A 103 6.594 36.058 -17.317 1.00 0.00 H new ATOM 1488 N SER A 104 3.570 38.620 -17.258 1.00 0.00 N ATOM 1489 CA SER A 104 2.427 38.618 -16.301 1.00 0.00 C ATOM 1490 C SER A 104 1.713 37.276 -16.298 1.00 0.00 C ATOM 1491 O SER A 104 2.044 36.385 -17.054 1.00 0.00 O ATOM 1492 CB SER A 104 1.496 39.723 -16.796 1.00 0.00 C ATOM 1493 OG SER A 104 1.399 40.735 -15.803 1.00 0.00 O ATOM 0 H SER A 104 3.501 39.300 -18.015 1.00 0.00 H new ATOM 0 HA SER A 104 2.759 38.786 -15.276 1.00 0.00 H new ATOM 0 HB2 SER A 104 1.876 40.145 -17.726 1.00 0.00 H new ATOM 0 HB3 SER A 104 0.509 39.313 -17.012 1.00 0.00 H new ATOM 0 HG SER A 104 0.804 41.447 -16.118 1.00 0.00 H new ATOM 1499 N PRO A 105 0.753 37.182 -15.420 1.00 0.00 N ATOM 1500 CA PRO A 105 -0.023 35.943 -15.279 1.00 0.00 C ATOM 1501 C PRO A 105 -1.120 35.853 -16.342 1.00 0.00 C ATOM 1502 O PRO A 105 -2.069 35.107 -16.207 1.00 0.00 O ATOM 1503 CB PRO A 105 -0.621 36.049 -13.886 1.00 0.00 C ATOM 1504 CG PRO A 105 -0.679 37.514 -13.584 1.00 0.00 C ATOM 1505 CD PRO A 105 0.312 38.217 -14.483 1.00 0.00 C ATOM 0 HA PRO A 105 0.586 35.049 -15.411 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -1.614 35.602 -13.851 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -0.008 35.522 -13.155 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -1.685 37.898 -13.752 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.439 37.697 -12.537 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -0.150 39.055 -15.005 1.00 0.00 H new ATOM 0 HD3 PRO A 105 1.149 38.620 -13.913 1.00 0.00 H new ATOM 1513 N GLY A 106 -0.996 36.594 -17.403 1.00 0.00 N ATOM 1514 CA GLY A 106 -2.023 36.528 -18.469 1.00 0.00 C ATOM 1515 C GLY A 106 -1.391 35.930 -19.727 1.00 0.00 C ATOM 1516 O GLY A 106 -1.989 35.905 -20.784 1.00 0.00 O ATOM 0 H GLY A 106 -0.228 37.242 -17.577 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -2.866 35.918 -18.144 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -2.413 37.524 -18.680 1.00 0.00 H new ATOM 1520 N ASN A 107 -0.179 35.446 -19.608 1.00 0.00 N ATOM 1521 CA ASN A 107 0.528 34.834 -20.770 1.00 0.00 C ATOM 1522 C ASN A 107 1.040 35.917 -21.715 1.00 0.00 C ATOM 1523 O ASN A 107 0.657 35.973 -22.867 1.00 0.00 O ATOM 1524 CB ASN A 107 -0.507 33.955 -21.477 1.00 0.00 C ATOM 1525 CG ASN A 107 0.184 32.720 -22.059 1.00 0.00 C ATOM 1526 OD1 ASN A 107 0.050 31.632 -21.536 1.00 0.00 O ATOM 1527 ND2 ASN A 107 0.923 32.844 -23.127 1.00 0.00 N ATOM 0 H ASN A 107 0.356 35.450 -18.740 1.00 0.00 H new ATOM 0 HA ASN A 107 1.393 34.254 -20.449 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -1.284 33.653 -20.775 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -0.997 34.519 -22.271 1.00 0.00 H new ATOM 0 HD21 ASN A 107 1.388 32.027 -23.523 1.00 0.00 H new ATOM 0 HD22 ASN A 107 1.035 33.758 -23.566 1.00 0.00 H new ATOM 1534 N THR A 108 1.905 36.779 -21.249 1.00 0.00 N ATOM 1535 CA THR A 108 2.424 37.845 -22.148 1.00 0.00 C ATOM 1536 C THR A 108 3.477 38.707 -21.458 1.00 0.00 C ATOM 1537 O THR A 108 3.733 38.580 -20.279 1.00 0.00 O ATOM 1538 CB THR A 108 1.204 38.684 -22.501 1.00 0.00 C ATOM 1539 OG1 THR A 108 0.160 38.426 -21.571 1.00 0.00 O ATOM 1540 CG2 THR A 108 0.752 38.310 -23.902 1.00 0.00 C ATOM 0 H THR A 108 2.270 36.790 -20.296 1.00 0.00 H new ATOM 0 HA THR A 108 2.913 37.420 -23.025 1.00 0.00 H new ATOM 0 HB THR A 108 1.454 39.744 -22.462 1.00 0.00 H new ATOM 0 HG1 THR A 108 -0.623 38.969 -21.800 1.00 0.00 H new ATOM 0 HG21 THR A 108 -0.122 38.902 -24.172 1.00 0.00 H new ATOM 0 HG22 THR A 108 1.557 38.508 -24.609 1.00 0.00 H new ATOM 0 HG23 THR A 108 0.496 37.251 -23.931 1.00 0.00 H new ATOM 1548 N TRP A 109 4.090 39.585 -22.204 1.00 0.00 N ATOM 1549 CA TRP A 109 5.140 40.469 -21.629 1.00 0.00 C ATOM 1550 C TRP A 109 4.547 41.819 -21.223 1.00 0.00 C ATOM 1551 O TRP A 109 4.471 42.743 -22.009 1.00 0.00 O ATOM 1552 CB TRP A 109 6.164 40.612 -22.753 1.00 0.00 C ATOM 1553 CG TRP A 109 7.068 39.430 -22.681 1.00 0.00 C ATOM 1554 CD1 TRP A 109 7.266 38.515 -23.663 1.00 0.00 C ATOM 1555 CD2 TRP A 109 7.888 39.011 -21.557 1.00 0.00 C ATOM 1556 NE1 TRP A 109 8.146 37.557 -23.201 1.00 0.00 N ATOM 1557 CE2 TRP A 109 8.565 37.824 -21.911 1.00 0.00 C ATOM 1558 CE3 TRP A 109 8.106 39.546 -20.276 1.00 0.00 C ATOM 1559 CZ2 TRP A 109 9.428 37.188 -21.024 1.00 0.00 C ATOM 1560 CZ3 TRP A 109 8.977 38.910 -19.379 1.00 0.00 C ATOM 1561 CH2 TRP A 109 9.640 37.734 -19.752 1.00 0.00 C ATOM 0 H TRP A 109 3.905 39.728 -23.197 1.00 0.00 H new ATOM 0 HA TRP A 109 5.588 40.064 -20.721 1.00 0.00 H new ATOM 0 HB2 TRP A 109 5.667 40.657 -23.722 1.00 0.00 H new ATOM 0 HB3 TRP A 109 6.730 41.537 -22.642 1.00 0.00 H new ATOM 0 HD1 TRP A 109 6.811 38.533 -24.642 1.00 0.00 H new ATOM 0 HE1 TRP A 109 8.450 36.750 -23.745 1.00 0.00 H new ATOM 0 HE3 TRP A 109 7.600 40.453 -19.980 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 9.932 36.278 -21.315 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 9.137 39.329 -18.397 1.00 0.00 H new ATOM 0 HH2 TRP A 109 10.313 37.249 -19.060 1.00 0.00 H new ATOM 1572 N LYS A 110 4.131 41.934 -19.989 1.00 0.00 N ATOM 1573 CA LYS A 110 3.546 43.217 -19.508 1.00 0.00 C ATOM 1574 C LYS A 110 4.515 43.889 -18.524 1.00 0.00 C ATOM 1575 O LYS A 110 5.056 43.229 -17.659 1.00 0.00 O ATOM 1576 CB LYS A 110 2.255 42.817 -18.791 1.00 0.00 C ATOM 1577 CG LYS A 110 1.317 42.111 -19.775 1.00 0.00 C ATOM 1578 CD LYS A 110 0.182 43.057 -20.174 1.00 0.00 C ATOM 1579 CE LYS A 110 -0.988 42.244 -20.731 1.00 0.00 C ATOM 1580 NZ LYS A 110 -0.679 42.067 -22.176 1.00 0.00 N ATOM 0 H LYS A 110 4.172 41.190 -19.292 1.00 0.00 H new ATOM 0 HA LYS A 110 3.361 43.923 -20.318 1.00 0.00 H new ATOM 0 HB2 LYS A 110 2.482 42.158 -17.953 1.00 0.00 H new ATOM 0 HB3 LYS A 110 1.768 43.700 -18.379 1.00 0.00 H new ATOM 0 HG2 LYS A 110 1.871 41.798 -20.660 1.00 0.00 H new ATOM 0 HG3 LYS A 110 0.908 41.209 -19.320 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -0.143 43.637 -19.310 1.00 0.00 H new ATOM 0 HD3 LYS A 110 0.533 43.768 -20.922 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -1.077 41.282 -20.225 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -1.934 42.766 -20.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -1.437 41.518 -22.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -0.607 42.999 -22.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 0.224 41.561 -22.279 1.00 0.00 H new ATOM 1594 N PRO A 111 4.712 45.178 -18.675 1.00 0.00 N ATOM 1595 CA PRO A 111 4.036 45.964 -19.745 1.00 0.00 C ATOM 1596 C PRO A 111 4.576 45.596 -21.131 1.00 0.00 C ATOM 1597 O PRO A 111 5.593 44.945 -21.264 1.00 0.00 O ATOM 1598 CB PRO A 111 4.380 47.410 -19.398 1.00 0.00 C ATOM 1599 CG PRO A 111 5.640 47.321 -18.603 1.00 0.00 C ATOM 1600 CD PRO A 111 5.587 46.020 -17.853 1.00 0.00 C ATOM 0 HA PRO A 111 2.963 45.777 -19.788 1.00 0.00 H new ATOM 0 HB2 PRO A 111 4.521 48.010 -20.297 1.00 0.00 H new ATOM 0 HB3 PRO A 111 3.582 47.880 -18.823 1.00 0.00 H new ATOM 0 HG2 PRO A 111 6.512 47.356 -19.255 1.00 0.00 H new ATOM 0 HG3 PRO A 111 5.723 48.162 -17.914 1.00 0.00 H new ATOM 0 HD2 PRO A 111 6.578 45.580 -17.744 1.00 0.00 H new ATOM 0 HD3 PRO A 111 5.185 46.153 -16.848 1.00 0.00 H new ATOM 1608 N GLU A 112 3.887 46.006 -22.161 1.00 0.00 N ATOM 1609 CA GLU A 112 4.330 45.684 -23.548 1.00 0.00 C ATOM 1610 C GLU A 112 5.839 45.888 -23.703 1.00 0.00 C ATOM 1611 O GLU A 112 6.406 46.838 -23.199 1.00 0.00 O ATOM 1612 CB GLU A 112 3.569 46.664 -24.441 1.00 0.00 C ATOM 1613 CG GLU A 112 3.975 48.094 -24.085 1.00 0.00 C ATOM 1614 CD GLU A 112 3.064 49.082 -24.816 1.00 0.00 C ATOM 1615 OE1 GLU A 112 2.831 48.881 -25.996 1.00 0.00 O ATOM 1616 OE2 GLU A 112 2.615 50.023 -24.183 1.00 0.00 O ATOM 0 H GLU A 112 3.029 46.555 -22.101 1.00 0.00 H new ATOM 0 HA GLU A 112 4.129 44.644 -23.805 1.00 0.00 H new ATOM 0 HB2 GLU A 112 3.787 46.462 -25.490 1.00 0.00 H new ATOM 0 HB3 GLU A 112 2.495 46.535 -24.308 1.00 0.00 H new ATOM 0 HG2 GLU A 112 3.903 48.246 -23.008 1.00 0.00 H new ATOM 0 HG3 GLU A 112 5.015 48.268 -24.363 1.00 0.00 H new ATOM 1623 N LEU A 113 6.488 45.005 -24.411 1.00 0.00 N ATOM 1624 CA LEU A 113 7.958 45.139 -24.620 1.00 0.00 C ATOM 1625 C LEU A 113 8.303 46.562 -25.048 1.00 0.00 C ATOM 1626 O LEU A 113 7.541 47.214 -25.733 1.00 0.00 O ATOM 1627 CB LEU A 113 8.282 44.149 -25.745 1.00 0.00 C ATOM 1628 CG LEU A 113 8.878 42.837 -25.194 1.00 0.00 C ATOM 1629 CD1 LEU A 113 8.515 42.631 -23.718 1.00 0.00 C ATOM 1630 CD2 LEU A 113 8.325 41.666 -26.008 1.00 0.00 C ATOM 0 H LEU A 113 6.061 44.192 -24.856 1.00 0.00 H new ATOM 0 HA LEU A 113 8.527 44.934 -23.713 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.375 43.929 -26.309 1.00 0.00 H new ATOM 0 HB3 LEU A 113 8.987 44.605 -26.440 1.00 0.00 H new ATOM 0 HG LEU A 113 9.964 42.892 -25.274 1.00 0.00 H new ATOM 0 HD11 LEU A 113 8.951 41.697 -23.363 1.00 0.00 H new ATOM 0 HD12 LEU A 113 8.904 43.461 -23.128 1.00 0.00 H new ATOM 0 HD13 LEU A 113 7.431 42.588 -23.612 1.00 0.00 H new ATOM 0 HD21 LEU A 113 8.739 40.732 -25.629 1.00 0.00 H new ATOM 0 HD22 LEU A 113 7.239 41.644 -25.921 1.00 0.00 H new ATOM 0 HD23 LEU A 113 8.603 41.787 -27.055 1.00 0.00 H new ATOM 1642 N PRO A 114 9.453 46.989 -24.621 1.00 0.00 N ATOM 1643 CA PRO A 114 9.936 48.350 -24.950 1.00 0.00 C ATOM 1644 C PRO A 114 10.352 48.436 -26.420 1.00 0.00 C ATOM 1645 O PRO A 114 10.614 47.438 -27.062 1.00 0.00 O ATOM 1646 CB PRO A 114 11.145 48.526 -24.037 1.00 0.00 C ATOM 1647 CG PRO A 114 11.615 47.141 -23.734 1.00 0.00 C ATOM 1648 CD PRO A 114 10.409 46.243 -23.796 1.00 0.00 C ATOM 0 HA PRO A 114 9.177 49.119 -24.806 1.00 0.00 H new ATOM 0 HB2 PRO A 114 11.926 49.108 -24.526 1.00 0.00 H new ATOM 0 HB3 PRO A 114 10.875 49.058 -23.125 1.00 0.00 H new ATOM 0 HG2 PRO A 114 12.369 46.824 -24.454 1.00 0.00 H new ATOM 0 HG3 PRO A 114 12.077 47.098 -22.748 1.00 0.00 H new ATOM 0 HD2 PRO A 114 10.652 45.278 -24.241 1.00 0.00 H new ATOM 0 HD3 PRO A 114 10.008 46.044 -22.802 1.00 0.00 H new ATOM 1656 N LYS A 115 10.422 49.624 -26.955 1.00 0.00 N ATOM 1657 CA LYS A 115 10.832 49.776 -28.380 1.00 0.00 C ATOM 1658 C LYS A 115 12.059 50.680 -28.476 1.00 0.00 C ATOM 1659 O LYS A 115 11.972 51.876 -28.305 1.00 0.00 O ATOM 1660 CB LYS A 115 9.634 50.421 -29.081 1.00 0.00 C ATOM 1661 CG LYS A 115 9.834 50.351 -30.597 1.00 0.00 C ATOM 1662 CD LYS A 115 8.505 50.012 -31.275 1.00 0.00 C ATOM 1663 CE LYS A 115 8.169 48.538 -31.037 1.00 0.00 C ATOM 1664 NZ LYS A 115 7.095 48.226 -32.020 1.00 0.00 N ATOM 0 H LYS A 115 10.213 50.495 -26.468 1.00 0.00 H new ATOM 0 HA LYS A 115 11.098 48.822 -28.835 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.715 49.907 -28.800 1.00 0.00 H new ATOM 0 HB3 LYS A 115 9.529 51.459 -28.764 1.00 0.00 H new ATOM 0 HG2 LYS A 115 10.211 51.304 -30.969 1.00 0.00 H new ATOM 0 HG3 LYS A 115 10.581 49.596 -30.841 1.00 0.00 H new ATOM 0 HD2 LYS A 115 7.711 50.645 -30.879 1.00 0.00 H new ATOM 0 HD3 LYS A 115 8.569 50.213 -32.344 1.00 0.00 H new ATOM 0 HE2 LYS A 115 9.042 47.904 -31.191 1.00 0.00 H new ATOM 0 HE3 LYS A 115 7.830 48.370 -30.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 6.810 47.231 -31.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 6.274 48.840 -31.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 7.449 48.389 -32.984 1.00 0.00 H new ATOM 1678 N CYS A 116 13.205 50.120 -28.753 1.00 0.00 N ATOM 1679 CA CYS A 116 14.426 50.964 -28.862 1.00 0.00 C ATOM 1680 C CYS A 116 14.253 51.949 -30.013 1.00 0.00 C ATOM 1681 O CYS A 116 14.480 51.632 -31.164 1.00 0.00 O ATOM 1682 CB CYS A 116 15.566 49.979 -29.131 1.00 0.00 C ATOM 1683 SG CYS A 116 17.132 50.627 -28.480 1.00 0.00 S ATOM 0 H CYS A 116 13.347 49.122 -28.907 1.00 0.00 H new ATOM 0 HA CYS A 116 14.623 51.554 -27.967 1.00 0.00 H new ATOM 0 HB2 CYS A 116 15.342 49.019 -28.667 1.00 0.00 H new ATOM 0 HB3 CYS A 116 15.656 49.802 -30.203 1.00 0.00 H new ATOM 1688 N VAL A 117 13.837 53.143 -29.703 1.00 0.00 N ATOM 1689 CA VAL A 117 13.626 54.163 -30.767 1.00 0.00 C ATOM 1690 C VAL A 117 14.616 55.295 -30.629 1.00 0.00 C ATOM 1691 O VAL A 117 15.423 55.327 -29.724 1.00 0.00 O ATOM 1692 CB VAL A 117 12.214 54.698 -30.554 1.00 0.00 C ATOM 1693 CG1 VAL A 117 11.232 53.725 -31.167 1.00 0.00 C ATOM 1694 CG2 VAL A 117 11.921 54.844 -29.059 1.00 0.00 C ATOM 0 H VAL A 117 13.633 53.459 -28.755 1.00 0.00 H new ATOM 0 HA VAL A 117 13.761 53.728 -31.757 1.00 0.00 H new ATOM 0 HB VAL A 117 12.121 55.677 -31.024 1.00 0.00 H new ATOM 0 HG11 VAL A 117 10.216 54.094 -31.023 1.00 0.00 H new ATOM 0 HG12 VAL A 117 11.435 53.627 -32.234 1.00 0.00 H new ATOM 0 HG13 VAL A 117 11.336 52.752 -30.687 1.00 0.00 H new ATOM 0 HG21 VAL A 117 10.910 55.227 -28.922 1.00 0.00 H new ATOM 0 HG22 VAL A 117 12.010 53.872 -28.574 1.00 0.00 H new ATOM 0 HG23 VAL A 117 12.635 55.538 -28.614 1.00 0.00 H new ATOM 1704 N ARG A 118 14.552 56.235 -31.517 1.00 0.00 N ATOM 1705 CA ARG A 118 15.487 57.374 -31.428 1.00 0.00 C ATOM 1706 C ARG A 118 14.720 58.696 -31.497 1.00 0.00 C ATOM 1707 O ARG A 118 14.962 59.543 -30.654 1.00 0.00 O ATOM 1708 CB ARG A 118 16.438 57.235 -32.623 1.00 0.00 C ATOM 1709 CG ARG A 118 15.686 56.657 -33.827 1.00 0.00 C ATOM 1710 CD ARG A 118 16.412 57.033 -35.119 1.00 0.00 C ATOM 1711 NE ARG A 118 16.584 55.746 -35.848 1.00 0.00 N ATOM 1712 CZ ARG A 118 17.536 55.620 -36.729 1.00 0.00 C ATOM 1713 NH1 ARG A 118 18.159 56.677 -37.172 1.00 0.00 N ATOM 1714 NH2 ARG A 118 17.865 54.436 -37.169 1.00 0.00 N ATOM 1715 OXT ARG A 118 13.905 58.838 -32.393 1.00 0.00 O ATOM 0 H ARG A 118 13.896 56.264 -32.297 1.00 0.00 H new ATOM 0 HA ARG A 118 16.035 57.372 -30.486 1.00 0.00 H new ATOM 0 HB2 ARG A 118 16.858 58.208 -32.879 1.00 0.00 H new ATOM 0 HB3 ARG A 118 17.273 56.586 -32.360 1.00 0.00 H new ATOM 0 HG2 ARG A 118 15.619 55.573 -33.739 1.00 0.00 H new ATOM 0 HG3 ARG A 118 14.665 57.039 -33.848 1.00 0.00 H new ATOM 0 HD2 ARG A 118 15.832 57.745 -35.706 1.00 0.00 H new ATOM 0 HD3 ARG A 118 17.374 57.501 -34.910 1.00 0.00 H new ATOM 0 HE ARG A 118 15.957 54.964 -35.658 1.00 0.00 H new ATOM 0 HH11 ARG A 118 17.901 57.602 -36.829 1.00 0.00 H new ATOM 0 HH12 ARG A 118 18.904 56.578 -37.862 1.00 0.00 H new ATOM 0 HH21 ARG A 118 17.377 53.610 -36.823 1.00 0.00 H new ATOM 0 HH22 ARG A 118 18.610 54.337 -37.859 1.00 0.00 H new