USER MOD reduce.3.24.130724 H: found=0, std=0, add=834, rem=0, adj=38 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 104 SER OG : rot -104:sc= -1.77! USER MOD Set 1.2: A 108 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 63 HIS : no HD1:sc= -6.73! C(o=-9.8!,f=-9.8!) USER MOD Set 2.2: A 79 TYR OH : rot 146:sc= -3.04! USER MOD Set 3.1: A 55 THR OG1 : rot 179:sc= -6.2! USER MOD Set 3.2: A 57 GLN : amide:sc= -0.462 K(o=-6.7,f=-8.2!) USER MOD Set 4.1: A 5 SER OG : rot 180:sc= -0.087 USER MOD Set 4.2: A 14 HIS : no HD1:sc= -12.9! C(o=-13!,f=-18!) USER MOD Single : A 1 VAL N :NH3+ 154:sc= -0.214 (180deg=-1.65!) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= -0.742 K(o=-0.74,f=0) USER MOD Single : A 8 SER OG : rot 180:sc= 0.00325 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=-0.091) USER MOD Single : A 15 ASN : amide:sc= -0.356 K(o=-0.36,f=-1.5!) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 141:sc= 0.123 USER MOD Single : A 22 THR OG1 : rot 18:sc= -1.86! USER MOD Single : A 25 SER OG : rot -179:sc= 0.446 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.174 USER MOD Single : A 29 TYR OH : rot -100:sc= -2.01! USER MOD Single : A 30 SER OG : rot -140:sc= -3.32! USER MOD Single : A 32 ASN : amide:sc= -0.486 X(o=-0.49,f=-0.12) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -80:sc= -1.01 USER MOD Single : A 40 ASN : amide:sc= -0.827! C(o=-0.83!,f=-9.4!) USER MOD Single : A 41 SER OG : rot 180:sc= -0.232 USER MOD Single : A 46 SER OG : rot 36:sc= 0.262 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.161 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -3.76! C(o=-3.8!,f=-9.6!) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot -30:sc= 1.09 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ -155:sc= -0.445 (180deg=-2.02!) USER MOD Single : A 78 SER OG : rot 180:sc= -0.309 USER MOD Single : A 80 SER OG : rot 180:sc=-0.00931 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -1.02 K(o=-1,f=-3.3!) USER MOD Single : A 84 ASN : amide:sc= -2.56! C(o=-2.6!,f=-1.8!) 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 -61:sc= 0.415! USER MOD Single : A 98 SER OG : rot 27:sc= -0.66! USER MOD Single : A 99 SER OG : rot -40:sc= -0.189 USER MOD Single : A 100 SER OG : rot 1:sc= 0.863! USER MOD Single : A 101 SER OG : rot 112:sc= 0.336 USER MOD Single : A 102 THR OG1 : rot 170:sc= -1.7 USER MOD Single : A 107 ASN : amide:sc= -3.12! K(o=-3.1!,f=-2.5) 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 -31.383 -43.449 14.869 1.00 0.00 N ATOM 2 CA VAL A 1 -30.366 -42.380 14.657 1.00 0.00 C ATOM 3 C VAL A 1 -29.685 -42.559 13.298 1.00 0.00 C ATOM 4 O VAL A 1 -29.619 -43.649 12.764 1.00 0.00 O ATOM 5 CB VAL A 1 -29.360 -42.558 15.794 1.00 0.00 C ATOM 6 CG1 VAL A 1 -28.831 -43.993 15.793 1.00 0.00 C ATOM 7 CG2 VAL A 1 -28.195 -41.587 15.599 1.00 0.00 C ATOM 0 H1 VAL A 1 -31.517 -43.604 15.889 1.00 0.00 H new ATOM 0 H2 VAL A 1 -32.286 -43.159 14.441 1.00 0.00 H new ATOM 0 H3 VAL A 1 -31.057 -44.331 14.425 1.00 0.00 H new ATOM 0 HA VAL A 1 -30.807 -41.383 14.659 1.00 0.00 H new ATOM 0 HB VAL A 1 -29.851 -42.354 16.746 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -28.114 -44.117 16.605 1.00 0.00 H new ATOM 0 HG12 VAL A 1 -29.660 -44.687 15.932 1.00 0.00 H new ATOM 0 HG13 VAL A 1 -28.341 -44.200 14.841 1.00 0.00 H new ATOM 0 HG21 VAL A 1 -27.477 -41.713 16.409 1.00 0.00 H new ATOM 0 HG22 VAL A 1 -27.707 -41.791 14.646 1.00 0.00 H new ATOM 0 HG23 VAL A 1 -28.570 -40.564 15.602 1.00 0.00 H new ATOM 19 N LYS A 2 -29.183 -41.497 12.731 1.00 0.00 N ATOM 20 CA LYS A 2 -28.513 -41.608 11.404 1.00 0.00 C ATOM 21 C LYS A 2 -27.052 -41.159 11.504 1.00 0.00 C ATOM 22 O LYS A 2 -26.600 -40.697 12.532 1.00 0.00 O ATOM 23 CB LYS A 2 -29.306 -40.679 10.484 1.00 0.00 C ATOM 24 CG LYS A 2 -30.704 -41.260 10.259 1.00 0.00 C ATOM 25 CD LYS A 2 -31.725 -40.124 10.167 1.00 0.00 C ATOM 26 CE LYS A 2 -32.117 -39.906 8.704 1.00 0.00 C ATOM 27 NZ LYS A 2 -33.576 -40.202 8.644 1.00 0.00 N ATOM 0 H LYS A 2 -29.207 -40.558 13.128 1.00 0.00 H new ATOM 0 HA LYS A 2 -28.498 -42.633 11.032 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -29.380 -39.686 10.927 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -28.790 -40.565 9.531 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -30.720 -41.851 9.343 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -30.965 -41.932 11.077 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -32.608 -40.366 10.759 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -31.304 -39.208 10.582 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -31.909 -38.884 8.388 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -31.554 -40.565 8.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -33.916 -40.074 7.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -33.744 -41.184 8.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -34.088 -39.555 9.278 1.00 0.00 H new ATOM 41 N CYS A 3 -26.310 -41.302 10.440 1.00 0.00 N ATOM 42 CA CYS A 3 -24.874 -40.897 10.462 1.00 0.00 C ATOM 43 C CYS A 3 -24.637 -39.709 9.530 1.00 0.00 C ATOM 44 O CYS A 3 -24.329 -39.875 8.370 1.00 0.00 O ATOM 45 CB CYS A 3 -24.118 -42.123 9.959 1.00 0.00 C ATOM 46 SG CYS A 3 -23.428 -43.024 11.366 1.00 0.00 S ATOM 0 H CYS A 3 -26.637 -41.683 9.552 1.00 0.00 H new ATOM 0 HA CYS A 3 -24.549 -40.587 11.455 1.00 0.00 H new ATOM 0 HB2 CYS A 3 -24.788 -42.770 9.393 1.00 0.00 H new ATOM 0 HB3 CYS A 3 -23.320 -41.819 9.281 1.00 0.00 H new ATOM 51 N GLN A 4 -24.765 -38.513 10.025 1.00 0.00 N ATOM 52 CA GLN A 4 -24.534 -37.329 9.153 1.00 0.00 C ATOM 53 C GLN A 4 -23.048 -37.221 8.807 1.00 0.00 C ATOM 54 O GLN A 4 -22.226 -37.943 9.335 1.00 0.00 O ATOM 55 CB GLN A 4 -24.983 -36.129 9.984 1.00 0.00 C ATOM 56 CG GLN A 4 -26.441 -36.319 10.408 1.00 0.00 C ATOM 57 CD GLN A 4 -26.791 -35.309 11.503 1.00 0.00 C ATOM 58 OE1 GLN A 4 -27.696 -35.530 12.283 1.00 0.00 O ATOM 59 NE2 GLN A 4 -26.106 -34.203 11.594 1.00 0.00 N ATOM 0 H GLN A 4 -25.018 -38.303 10.990 1.00 0.00 H new ATOM 0 HA GLN A 4 -25.078 -37.393 8.211 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -24.348 -36.024 10.864 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -24.878 -35.212 9.404 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -27.100 -36.185 9.551 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -26.595 -37.335 10.773 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -25.346 -34.018 10.939 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -26.330 -33.523 12.320 1.00 0.00 H new ATOM 68 N SER A 5 -22.697 -36.329 7.922 1.00 0.00 N ATOM 69 CA SER A 5 -21.263 -36.179 7.542 1.00 0.00 C ATOM 70 C SER A 5 -20.376 -36.256 8.789 1.00 0.00 C ATOM 71 O SER A 5 -20.733 -35.763 9.839 1.00 0.00 O ATOM 72 CB SER A 5 -21.170 -34.797 6.897 1.00 0.00 C ATOM 73 OG SER A 5 -20.710 -33.857 7.860 1.00 0.00 O ATOM 0 H SER A 5 -23.341 -35.697 7.445 1.00 0.00 H new ATOM 0 HA SER A 5 -20.927 -36.966 6.867 1.00 0.00 H new ATOM 0 HB2 SER A 5 -20.489 -34.826 6.046 1.00 0.00 H new ATOM 0 HB3 SER A 5 -22.145 -34.495 6.515 1.00 0.00 H new ATOM 0 HG SER A 5 -20.648 -32.970 7.448 1.00 0.00 H new ATOM 79 N PRO A 6 -19.246 -36.889 8.626 1.00 0.00 N ATOM 80 CA PRO A 6 -18.288 -37.053 9.751 1.00 0.00 C ATOM 81 C PRO A 6 -17.607 -35.722 10.092 1.00 0.00 C ATOM 82 O PRO A 6 -17.491 -34.853 9.256 1.00 0.00 O ATOM 83 CB PRO A 6 -17.271 -38.049 9.201 1.00 0.00 C ATOM 84 CG PRO A 6 -17.336 -37.892 7.720 1.00 0.00 C ATOM 85 CD PRO A 6 -18.756 -37.508 7.389 1.00 0.00 C ATOM 0 HA PRO A 6 -18.767 -37.388 10.671 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -16.270 -37.838 9.576 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -17.515 -39.068 9.501 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -16.639 -37.126 7.381 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -17.059 -38.820 7.220 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -18.798 -36.814 6.550 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -19.352 -38.378 7.113 1.00 0.00 H new ATOM 93 N PRO A 7 -17.169 -35.616 11.317 1.00 0.00 N ATOM 94 CA PRO A 7 -16.480 -34.384 11.773 1.00 0.00 C ATOM 95 C PRO A 7 -15.060 -34.335 11.200 1.00 0.00 C ATOM 96 O PRO A 7 -14.592 -35.281 10.598 1.00 0.00 O ATOM 97 CB PRO A 7 -16.449 -34.532 13.292 1.00 0.00 C ATOM 98 CG PRO A 7 -16.530 -36.005 13.543 1.00 0.00 C ATOM 99 CD PRO A 7 -17.276 -36.618 12.383 1.00 0.00 C ATOM 0 HA PRO A 7 -16.974 -33.467 11.452 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -15.535 -34.111 13.710 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -17.284 -34.007 13.756 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -15.532 -36.436 13.629 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -17.046 -36.207 14.482 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -16.834 -37.568 12.083 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -18.317 -36.817 12.639 1.00 0.00 H new ATOM 107 N SER A 8 -14.369 -33.243 11.382 1.00 0.00 N ATOM 108 CA SER A 8 -12.979 -33.143 10.847 1.00 0.00 C ATOM 109 C SER A 8 -12.042 -34.043 11.653 1.00 0.00 C ATOM 110 O SER A 8 -12.433 -34.635 12.639 1.00 0.00 O ATOM 111 CB SER A 8 -12.588 -31.677 11.022 1.00 0.00 C ATOM 112 OG SER A 8 -12.734 -31.312 12.388 1.00 0.00 O ATOM 0 H SER A 8 -14.705 -32.417 11.877 1.00 0.00 H new ATOM 0 HA SER A 8 -12.914 -33.460 9.806 1.00 0.00 H new ATOM 0 HB2 SER A 8 -11.558 -31.522 10.700 1.00 0.00 H new ATOM 0 HB3 SER A 8 -13.216 -31.044 10.395 1.00 0.00 H new ATOM 0 HG SER A 8 -12.482 -30.372 12.504 1.00 0.00 H new ATOM 118 N ILE A 9 -10.807 -34.148 11.248 1.00 0.00 N ATOM 119 CA ILE A 9 -9.853 -35.010 12.006 1.00 0.00 C ATOM 120 C ILE A 9 -8.469 -34.402 12.049 1.00 0.00 C ATOM 121 O ILE A 9 -8.251 -33.265 11.683 1.00 0.00 O ATOM 122 CB ILE A 9 -9.792 -36.357 11.288 1.00 0.00 C ATOM 123 CG1 ILE A 9 -9.969 -36.189 9.772 1.00 0.00 C ATOM 124 CG2 ILE A 9 -10.880 -37.251 11.849 1.00 0.00 C ATOM 125 CD1 ILE A 9 -8.784 -36.844 9.055 1.00 0.00 C ATOM 0 H ILE A 9 -10.417 -33.678 10.431 1.00 0.00 H new ATOM 0 HA ILE A 9 -10.196 -35.116 13.035 1.00 0.00 H new ATOM 0 HB ILE A 9 -8.813 -36.807 11.453 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -10.904 -36.647 9.449 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -10.027 -35.131 9.515 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -10.851 -38.218 11.347 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -10.720 -37.392 12.918 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -11.853 -36.787 11.686 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -8.902 -36.729 7.978 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -7.857 -36.365 9.372 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -8.748 -37.904 9.305 1.00 0.00 H new ATOM 137 N SER A 10 -7.537 -35.172 12.515 1.00 0.00 N ATOM 138 CA SER A 10 -6.146 -34.685 12.621 1.00 0.00 C ATOM 139 C SER A 10 -5.744 -33.918 11.358 1.00 0.00 C ATOM 140 O SER A 10 -5.247 -34.486 10.408 1.00 0.00 O ATOM 141 CB SER A 10 -5.295 -35.944 12.782 1.00 0.00 C ATOM 142 OG SER A 10 -5.114 -36.214 14.166 1.00 0.00 O ATOM 0 H SER A 10 -7.683 -36.131 12.831 1.00 0.00 H new ATOM 0 HA SER A 10 -6.017 -33.996 13.456 1.00 0.00 H new ATOM 0 HB2 SER A 10 -5.780 -36.790 12.295 1.00 0.00 H new ATOM 0 HB3 SER A 10 -4.329 -35.808 12.297 1.00 0.00 H new ATOM 0 HG SER A 10 -4.570 -37.022 14.273 1.00 0.00 H new ATOM 148 N ASN A 11 -5.950 -32.631 11.341 1.00 0.00 N ATOM 149 CA ASN A 11 -5.575 -31.832 10.140 1.00 0.00 C ATOM 150 C ASN A 11 -6.002 -32.554 8.858 1.00 0.00 C ATOM 151 O ASN A 11 -5.209 -32.767 7.962 1.00 0.00 O ATOM 152 CB ASN A 11 -4.052 -31.720 10.208 1.00 0.00 C ATOM 153 CG ASN A 11 -3.640 -30.256 10.061 1.00 0.00 C ATOM 154 OD1 ASN A 11 -4.099 -29.569 9.171 1.00 0.00 O ATOM 155 ND2 ASN A 11 -2.784 -29.747 10.904 1.00 0.00 N ATOM 0 H ASN A 11 -6.362 -32.097 12.106 1.00 0.00 H new ATOM 0 HA ASN A 11 -6.062 -30.857 10.126 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -3.690 -32.117 11.156 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -3.597 -32.318 9.418 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -2.500 -28.771 10.816 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -2.399 -30.325 11.651 1.00 0.00 H new ATOM 162 N GLY A 12 -7.248 -32.931 8.760 1.00 0.00 N ATOM 163 CA GLY A 12 -7.719 -33.635 7.532 1.00 0.00 C ATOM 164 C GLY A 12 -9.222 -33.406 7.356 1.00 0.00 C ATOM 165 O GLY A 12 -9.956 -33.287 8.315 1.00 0.00 O ATOM 0 H GLY A 12 -7.959 -32.782 9.476 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -7.180 -33.266 6.659 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -7.510 -34.702 7.609 1.00 0.00 H new ATOM 169 N ARG A 13 -9.685 -33.341 6.136 1.00 0.00 N ATOM 170 CA ARG A 13 -11.142 -33.118 5.902 1.00 0.00 C ATOM 171 C ARG A 13 -11.871 -34.446 5.752 1.00 0.00 C ATOM 172 O ARG A 13 -11.345 -35.504 6.040 1.00 0.00 O ATOM 173 CB ARG A 13 -11.233 -32.320 4.602 1.00 0.00 C ATOM 174 CG ARG A 13 -11.788 -30.924 4.899 1.00 0.00 C ATOM 175 CD ARG A 13 -11.565 -30.015 3.688 1.00 0.00 C ATOM 176 NE ARG A 13 -12.688 -30.330 2.761 1.00 0.00 N ATOM 177 CZ ARG A 13 -13.342 -29.365 2.175 1.00 0.00 C ATOM 178 NH1 ARG A 13 -14.018 -28.506 2.888 1.00 0.00 N ATOM 179 NH2 ARG A 13 -13.322 -29.261 0.875 1.00 0.00 N ATOM 0 H ARG A 13 -9.119 -33.432 5.293 1.00 0.00 H new ATOM 0 HA ARG A 13 -11.604 -32.591 6.737 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -10.248 -32.241 4.141 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -11.878 -32.836 3.890 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -12.852 -30.986 5.129 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -11.296 -30.505 5.777 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -11.573 -28.964 3.976 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -10.600 -30.210 3.220 1.00 0.00 H new ATOM 0 HE ARG A 13 -12.946 -31.301 2.584 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -14.035 -28.589 3.904 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -14.529 -27.752 2.429 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -12.795 -29.934 0.318 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -13.833 -28.507 0.416 1.00 0.00 H new ATOM 193 N HIS A 14 -13.086 -34.384 5.309 1.00 0.00 N ATOM 194 CA HIS A 14 -13.892 -35.627 5.136 1.00 0.00 C ATOM 195 C HIS A 14 -15.001 -35.409 4.102 1.00 0.00 C ATOM 196 O HIS A 14 -14.936 -34.510 3.287 1.00 0.00 O ATOM 197 CB HIS A 14 -14.486 -35.890 6.520 1.00 0.00 C ATOM 198 CG HIS A 14 -15.638 -34.953 6.769 1.00 0.00 C ATOM 199 ND1 HIS A 14 -16.934 -35.279 6.415 1.00 0.00 N ATOM 200 CD2 HIS A 14 -15.711 -33.716 7.361 1.00 0.00 C ATOM 201 CE1 HIS A 14 -17.729 -34.270 6.797 1.00 0.00 C ATOM 202 NE2 HIS A 14 -17.036 -33.285 7.377 1.00 0.00 N ATOM 0 H HIS A 14 -13.566 -33.521 5.055 1.00 0.00 H new ATOM 0 HA HIS A 14 -13.296 -36.465 4.775 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -14.825 -36.924 6.590 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -13.722 -35.753 7.285 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -14.871 -33.163 7.754 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -18.799 -34.255 6.654 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -17.399 -32.408 7.750 1.00 0.00 H new ATOM 210 N ASN A 15 -16.021 -36.225 4.139 1.00 0.00 N ATOM 211 CA ASN A 15 -17.152 -36.078 3.171 1.00 0.00 C ATOM 212 C ASN A 15 -16.726 -36.533 1.773 1.00 0.00 C ATOM 213 O ASN A 15 -15.617 -36.292 1.340 1.00 0.00 O ATOM 214 CB ASN A 15 -17.495 -34.586 3.170 1.00 0.00 C ATOM 215 CG ASN A 15 -18.976 -34.401 2.834 1.00 0.00 C ATOM 216 OD1 ASN A 15 -19.703 -35.363 2.689 1.00 0.00 O ATOM 217 ND2 ASN A 15 -19.458 -33.195 2.703 1.00 0.00 N ATOM 0 H ASN A 15 -16.121 -36.993 4.802 1.00 0.00 H new ATOM 0 HA ASN A 15 -18.009 -36.690 3.453 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -17.276 -34.151 4.145 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -16.878 -34.061 2.441 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -20.444 -33.061 2.479 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -18.849 -32.386 2.825 1.00 0.00 H new ATOM 224 N GLY A 16 -17.604 -37.188 1.064 1.00 0.00 N ATOM 225 CA GLY A 16 -17.257 -37.659 -0.306 1.00 0.00 C ATOM 226 C GLY A 16 -18.268 -37.101 -1.309 1.00 0.00 C ATOM 227 O GLY A 16 -17.912 -36.418 -2.249 1.00 0.00 O ATOM 0 H GLY A 16 -18.548 -37.417 1.375 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -16.250 -37.334 -0.569 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -17.259 -38.748 -0.339 1.00 0.00 H new ATOM 231 N TYR A 17 -19.526 -37.387 -1.118 1.00 0.00 N ATOM 232 CA TYR A 17 -20.560 -36.873 -2.061 1.00 0.00 C ATOM 233 C TYR A 17 -21.950 -36.983 -1.429 1.00 0.00 C ATOM 234 O TYR A 17 -22.942 -37.142 -2.112 1.00 0.00 O ATOM 235 CB TYR A 17 -20.455 -37.780 -3.289 1.00 0.00 C ATOM 236 CG TYR A 17 -20.346 -36.936 -4.536 1.00 0.00 C ATOM 237 CD1 TYR A 17 -21.439 -36.173 -4.963 1.00 0.00 C ATOM 238 CD2 TYR A 17 -19.152 -36.919 -5.267 1.00 0.00 C ATOM 239 CE1 TYR A 17 -21.338 -35.392 -6.120 1.00 0.00 C ATOM 240 CE2 TYR A 17 -19.051 -36.138 -6.424 1.00 0.00 C ATOM 241 CZ TYR A 17 -20.144 -35.374 -6.850 1.00 0.00 C ATOM 242 OH TYR A 17 -20.045 -34.603 -7.990 1.00 0.00 O ATOM 0 H TYR A 17 -19.883 -37.955 -0.350 1.00 0.00 H new ATOM 0 HA TYR A 17 -20.408 -35.824 -2.314 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -19.584 -38.429 -3.200 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -21.330 -38.427 -3.351 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -22.360 -36.187 -4.400 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -18.309 -37.509 -4.938 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -22.181 -34.803 -6.449 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -18.130 -36.125 -6.988 1.00 0.00 H new ATOM 0 HH TYR A 17 -19.150 -34.703 -8.376 1.00 0.00 H new ATOM 252 N GLU A 18 -22.030 -36.905 -0.128 1.00 0.00 N ATOM 253 CA GLU A 18 -23.359 -37.011 0.543 1.00 0.00 C ATOM 254 C GLU A 18 -23.311 -36.364 1.930 1.00 0.00 C ATOM 255 O GLU A 18 -22.301 -35.832 2.344 1.00 0.00 O ATOM 256 CB GLU A 18 -23.630 -38.513 0.666 1.00 0.00 C ATOM 257 CG GLU A 18 -22.346 -39.241 1.077 1.00 0.00 C ATOM 258 CD GLU A 18 -21.754 -39.947 -0.144 1.00 0.00 C ATOM 259 OE1 GLU A 18 -22.522 -40.507 -0.909 1.00 0.00 O ATOM 260 OE2 GLU A 18 -20.544 -39.916 -0.294 1.00 0.00 O ATOM 0 H GLU A 18 -21.236 -36.773 0.498 1.00 0.00 H new ATOM 0 HA GLU A 18 -24.140 -36.500 -0.020 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -24.412 -38.691 1.404 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -23.993 -38.905 -0.284 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -21.627 -38.531 1.486 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -22.560 -39.966 1.862 1.00 0.00 H new ATOM 267 N ASP A 19 -24.398 -36.413 2.650 1.00 0.00 N ATOM 268 CA ASP A 19 -24.422 -35.807 4.013 1.00 0.00 C ATOM 269 C ASP A 19 -24.843 -36.857 5.045 1.00 0.00 C ATOM 270 O ASP A 19 -24.260 -36.970 6.105 1.00 0.00 O ATOM 271 CB ASP A 19 -25.459 -34.685 3.932 1.00 0.00 C ATOM 272 CG ASP A 19 -24.792 -33.410 3.412 1.00 0.00 C ATOM 273 OD1 ASP A 19 -23.651 -33.493 2.985 1.00 0.00 O ATOM 274 OD2 ASP A 19 -25.432 -32.372 3.448 1.00 0.00 O ATOM 0 H ASP A 19 -25.272 -36.847 2.354 1.00 0.00 H new ATOM 0 HA ASP A 19 -23.445 -35.433 4.318 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -26.275 -34.977 3.271 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -25.894 -34.506 4.915 1.00 0.00 H new ATOM 279 N PHE A 20 -25.850 -37.629 4.740 1.00 0.00 N ATOM 280 CA PHE A 20 -26.306 -38.675 5.699 1.00 0.00 C ATOM 281 C PHE A 20 -25.651 -40.018 5.358 1.00 0.00 C ATOM 282 O PHE A 20 -25.504 -40.373 4.205 1.00 0.00 O ATOM 283 CB PHE A 20 -27.822 -38.750 5.509 1.00 0.00 C ATOM 284 CG PHE A 20 -28.476 -37.573 6.195 1.00 0.00 C ATOM 285 CD1 PHE A 20 -28.369 -36.292 5.641 1.00 0.00 C ATOM 286 CD2 PHE A 20 -29.189 -37.763 7.384 1.00 0.00 C ATOM 287 CE1 PHE A 20 -28.974 -35.201 6.277 1.00 0.00 C ATOM 288 CE2 PHE A 20 -29.795 -36.673 8.020 1.00 0.00 C ATOM 289 CZ PHE A 20 -29.687 -35.392 7.466 1.00 0.00 C ATOM 0 H PHE A 20 -26.377 -37.581 3.868 1.00 0.00 H new ATOM 0 HA PHE A 20 -26.038 -38.442 6.730 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -28.066 -38.747 4.447 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -28.205 -39.683 5.921 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -27.820 -36.145 4.723 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -29.272 -38.751 7.811 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -28.890 -34.212 5.850 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -30.345 -36.820 8.937 1.00 0.00 H new ATOM 0 HZ PHE A 20 -30.154 -34.551 7.956 1.00 0.00 H new ATOM 299 N TYR A 21 -25.249 -40.761 6.351 1.00 0.00 N ATOM 300 CA TYR A 21 -24.596 -42.076 6.090 1.00 0.00 C ATOM 301 C TYR A 21 -25.272 -43.184 6.901 1.00 0.00 C ATOM 302 O TYR A 21 -24.955 -44.346 6.773 1.00 0.00 O ATOM 303 CB TYR A 21 -23.154 -41.891 6.537 1.00 0.00 C ATOM 304 CG TYR A 21 -22.279 -41.782 5.312 1.00 0.00 C ATOM 305 CD1 TYR A 21 -22.426 -42.705 4.273 1.00 0.00 C ATOM 306 CD2 TYR A 21 -21.329 -40.760 5.212 1.00 0.00 C ATOM 307 CE1 TYR A 21 -21.622 -42.612 3.133 1.00 0.00 C ATOM 308 CE2 TYR A 21 -20.524 -40.665 4.071 1.00 0.00 C ATOM 309 CZ TYR A 21 -20.669 -41.592 3.032 1.00 0.00 C ATOM 310 OH TYR A 21 -19.875 -41.498 1.907 1.00 0.00 O ATOM 0 H TYR A 21 -25.345 -40.514 7.336 1.00 0.00 H new ATOM 0 HA TYR A 21 -24.668 -42.369 5.043 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -23.060 -40.994 7.150 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -22.838 -42.733 7.153 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -23.162 -43.492 4.351 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -21.217 -40.045 6.014 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -21.736 -43.326 2.331 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -19.791 -39.876 3.992 1.00 0.00 H new ATOM 0 HH TYR A 21 -19.757 -40.555 1.668 1.00 0.00 H new ATOM 320 N THR A 22 -26.205 -42.828 7.732 1.00 0.00 N ATOM 321 CA THR A 22 -26.918 -43.845 8.557 1.00 0.00 C ATOM 322 C THR A 22 -25.946 -44.845 9.200 1.00 0.00 C ATOM 323 O THR A 22 -25.390 -44.591 10.251 1.00 0.00 O ATOM 324 CB THR A 22 -27.871 -44.555 7.590 1.00 0.00 C ATOM 325 OG1 THR A 22 -27.152 -44.997 6.448 1.00 0.00 O ATOM 326 CG2 THR A 22 -28.975 -43.588 7.158 1.00 0.00 C ATOM 0 H THR A 22 -26.510 -41.866 7.879 1.00 0.00 H new ATOM 0 HA THR A 22 -27.448 -43.376 9.386 1.00 0.00 H new ATOM 0 HB THR A 22 -28.317 -45.415 8.089 1.00 0.00 H new ATOM 0 HG1 THR A 22 -26.193 -45.009 6.649 1.00 0.00 H new ATOM 0 HG21 THR A 22 -29.653 -44.093 6.470 1.00 0.00 H new ATOM 0 HG22 THR A 22 -29.530 -43.254 8.035 1.00 0.00 H new ATOM 0 HG23 THR A 22 -28.530 -42.726 6.661 1.00 0.00 H new ATOM 334 N ASP A 23 -25.758 -45.991 8.601 1.00 0.00 N ATOM 335 CA ASP A 23 -24.846 -47.008 9.209 1.00 0.00 C ATOM 336 C ASP A 23 -24.255 -47.917 8.127 1.00 0.00 C ATOM 337 O ASP A 23 -24.793 -48.049 7.046 1.00 0.00 O ATOM 338 CB ASP A 23 -25.753 -47.804 10.156 1.00 0.00 C ATOM 339 CG ASP A 23 -25.204 -49.224 10.354 1.00 0.00 C ATOM 340 OD1 ASP A 23 -25.321 -50.015 9.432 1.00 0.00 O ATOM 341 OD2 ASP A 23 -24.677 -49.493 11.419 1.00 0.00 O ATOM 0 H ASP A 23 -26.194 -46.268 7.721 1.00 0.00 H new ATOM 0 HA ASP A 23 -23.998 -46.558 9.725 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -25.821 -47.296 11.118 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -26.763 -47.851 9.749 1.00 0.00 H new ATOM 346 N GLY A 24 -23.150 -48.548 8.419 1.00 0.00 N ATOM 347 CA GLY A 24 -22.520 -49.454 7.419 1.00 0.00 C ATOM 348 C GLY A 24 -21.937 -48.618 6.284 1.00 0.00 C ATOM 349 O GLY A 24 -21.793 -49.078 5.169 1.00 0.00 O ATOM 0 H GLY A 24 -22.656 -48.474 9.309 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -21.736 -50.047 7.890 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -23.258 -50.155 7.029 1.00 0.00 H new ATOM 353 N SER A 25 -21.603 -47.390 6.560 1.00 0.00 N ATOM 354 CA SER A 25 -21.033 -46.519 5.495 1.00 0.00 C ATOM 355 C SER A 25 -19.588 -46.164 5.823 1.00 0.00 C ATOM 356 O SER A 25 -19.101 -46.440 6.901 1.00 0.00 O ATOM 357 CB SER A 25 -21.902 -45.271 5.498 1.00 0.00 C ATOM 358 OG SER A 25 -23.124 -45.558 6.159 1.00 0.00 O ATOM 0 H SER A 25 -21.700 -46.951 7.476 1.00 0.00 H new ATOM 0 HA SER A 25 -21.027 -47.009 4.521 1.00 0.00 H new ATOM 0 HB2 SER A 25 -21.385 -44.454 6.001 1.00 0.00 H new ATOM 0 HB3 SER A 25 -22.095 -44.945 4.476 1.00 0.00 H new ATOM 0 HG SER A 25 -23.697 -44.763 6.147 1.00 0.00 H new ATOM 364 N VAL A 26 -18.897 -45.554 4.905 1.00 0.00 N ATOM 365 CA VAL A 26 -17.484 -45.189 5.178 1.00 0.00 C ATOM 366 C VAL A 26 -17.148 -43.846 4.545 1.00 0.00 C ATOM 367 O VAL A 26 -17.756 -43.428 3.580 1.00 0.00 O ATOM 368 CB VAL A 26 -16.655 -46.312 4.551 1.00 0.00 C ATOM 369 CG1 VAL A 26 -15.187 -45.893 4.472 1.00 0.00 C ATOM 370 CG2 VAL A 26 -16.772 -47.572 5.407 1.00 0.00 C ATOM 0 H VAL A 26 -19.247 -45.294 3.983 1.00 0.00 H new ATOM 0 HA VAL A 26 -17.284 -45.086 6.245 1.00 0.00 H new ATOM 0 HB VAL A 26 -17.029 -46.512 3.547 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -14.603 -46.697 4.025 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -15.097 -44.995 3.860 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -14.813 -45.687 5.475 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -16.181 -48.372 4.960 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -16.402 -47.365 6.411 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -17.816 -47.879 5.461 1.00 0.00 H new ATOM 380 N VAL A 27 -16.189 -43.160 5.095 1.00 0.00 N ATOM 381 CA VAL A 27 -15.824 -41.833 4.534 1.00 0.00 C ATOM 382 C VAL A 27 -14.324 -41.691 4.366 1.00 0.00 C ATOM 383 O VAL A 27 -13.566 -41.805 5.308 1.00 0.00 O ATOM 384 CB VAL A 27 -16.340 -40.828 5.553 1.00 0.00 C ATOM 385 CG1 VAL A 27 -15.676 -39.464 5.348 1.00 0.00 C ATOM 386 CG2 VAL A 27 -17.830 -40.682 5.356 1.00 0.00 C ATOM 0 H VAL A 27 -15.645 -43.458 5.904 1.00 0.00 H new ATOM 0 HA VAL A 27 -16.252 -41.686 3.543 1.00 0.00 H new ATOM 0 HB VAL A 27 -16.110 -41.180 6.559 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -16.058 -38.759 6.086 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.597 -39.563 5.465 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -15.900 -39.097 4.346 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -18.224 -39.965 6.077 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -18.030 -40.327 4.345 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -18.313 -41.648 5.504 1.00 0.00 H new ATOM 396 N THR A 28 -13.889 -41.402 3.179 1.00 0.00 N ATOM 397 CA THR A 28 -12.441 -41.209 2.979 1.00 0.00 C ATOM 398 C THR A 28 -12.077 -39.838 3.531 1.00 0.00 C ATOM 399 O THR A 28 -12.356 -38.818 2.932 1.00 0.00 O ATOM 400 CB THR A 28 -12.207 -41.284 1.469 1.00 0.00 C ATOM 401 OG1 THR A 28 -13.428 -41.598 0.813 1.00 0.00 O ATOM 402 CG2 THR A 28 -11.172 -42.368 1.172 1.00 0.00 C ATOM 0 H THR A 28 -14.470 -41.292 2.348 1.00 0.00 H new ATOM 0 HA THR A 28 -11.830 -41.956 3.485 1.00 0.00 H new ATOM 0 HB THR A 28 -11.842 -40.323 1.108 1.00 0.00 H new ATOM 0 HG1 THR A 28 -13.277 -41.644 -0.154 1.00 0.00 H new ATOM 0 HG21 THR A 28 -11.003 -42.424 0.097 1.00 0.00 H new ATOM 0 HG22 THR A 28 -10.236 -42.125 1.675 1.00 0.00 H new ATOM 0 HG23 THR A 28 -11.538 -43.329 1.533 1.00 0.00 H new ATOM 410 N TYR A 29 -11.486 -39.804 4.687 1.00 0.00 N ATOM 411 CA TYR A 29 -11.141 -38.496 5.302 1.00 0.00 C ATOM 412 C TYR A 29 -10.041 -37.802 4.495 1.00 0.00 C ATOM 413 O TYR A 29 -8.999 -38.369 4.236 1.00 0.00 O ATOM 414 CB TYR A 29 -10.614 -38.847 6.695 1.00 0.00 C ATOM 415 CG TYR A 29 -11.731 -38.833 7.716 1.00 0.00 C ATOM 416 CD1 TYR A 29 -13.070 -38.725 7.317 1.00 0.00 C ATOM 417 CD2 TYR A 29 -11.416 -38.939 9.076 1.00 0.00 C ATOM 418 CE1 TYR A 29 -14.089 -38.721 8.278 1.00 0.00 C ATOM 419 CE2 TYR A 29 -12.433 -38.935 10.035 1.00 0.00 C ATOM 420 CZ TYR A 29 -13.770 -38.826 9.638 1.00 0.00 C ATOM 421 OH TYR A 29 -14.771 -38.825 10.587 1.00 0.00 O ATOM 0 H TYR A 29 -11.226 -40.625 5.234 1.00 0.00 H new ATOM 0 HA TYR A 29 -11.996 -37.821 5.334 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -10.148 -39.832 6.674 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -9.842 -38.135 6.986 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -13.316 -38.645 6.269 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -10.385 -39.024 9.385 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -15.121 -38.637 7.970 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -12.186 -39.016 11.083 1.00 0.00 H new ATOM 0 HH TYR A 29 -14.843 -37.933 10.986 1.00 0.00 H new ATOM 431 N SER A 30 -10.259 -36.577 4.105 1.00 0.00 N ATOM 432 CA SER A 30 -9.216 -35.851 3.327 1.00 0.00 C ATOM 433 C SER A 30 -8.043 -35.501 4.245 1.00 0.00 C ATOM 434 O SER A 30 -8.184 -35.444 5.451 1.00 0.00 O ATOM 435 CB SER A 30 -9.899 -34.580 2.821 1.00 0.00 C ATOM 436 OG SER A 30 -11.299 -34.667 3.059 1.00 0.00 O ATOM 0 H SER A 30 -11.111 -36.048 4.290 1.00 0.00 H new ATOM 0 HA SER A 30 -8.821 -36.447 2.504 1.00 0.00 H new ATOM 0 HB2 SER A 30 -9.487 -33.707 3.327 1.00 0.00 H new ATOM 0 HB3 SER A 30 -9.708 -34.451 1.756 1.00 0.00 H new ATOM 0 HG SER A 30 -11.785 -34.298 2.292 1.00 0.00 H new ATOM 442 N CYS A 31 -6.886 -35.268 3.690 1.00 0.00 N ATOM 443 CA CYS A 31 -5.711 -34.927 4.543 1.00 0.00 C ATOM 444 C CYS A 31 -4.965 -33.722 3.964 1.00 0.00 C ATOM 445 O CYS A 31 -5.049 -33.433 2.787 1.00 0.00 O ATOM 446 CB CYS A 31 -4.824 -36.170 4.506 1.00 0.00 C ATOM 447 SG CYS A 31 -4.637 -36.825 6.180 1.00 0.00 S ATOM 0 H CYS A 31 -6.703 -35.298 2.687 1.00 0.00 H new ATOM 0 HA CYS A 31 -6.003 -34.661 5.559 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -5.265 -36.925 3.855 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -3.848 -35.921 4.090 1.00 0.00 H new ATOM 452 N ASN A 32 -4.231 -33.020 4.783 1.00 0.00 N ATOM 453 CA ASN A 32 -3.475 -31.837 4.278 1.00 0.00 C ATOM 454 C ASN A 32 -2.274 -32.297 3.445 1.00 0.00 C ATOM 455 O ASN A 32 -1.491 -33.124 3.868 1.00 0.00 O ATOM 456 CB ASN A 32 -3.010 -31.098 5.533 1.00 0.00 C ATOM 457 CG ASN A 32 -3.583 -29.678 5.532 1.00 0.00 C ATOM 458 OD1 ASN A 32 -2.918 -28.742 5.927 1.00 0.00 O ATOM 459 ND2 ASN A 32 -4.800 -29.478 5.103 1.00 0.00 N ATOM 0 H ASN A 32 -4.122 -33.213 5.779 1.00 0.00 H new ATOM 0 HA ASN A 32 -4.082 -31.200 3.635 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -3.337 -31.633 6.425 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -1.921 -31.062 5.564 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -5.191 -28.536 5.100 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -5.359 -30.264 4.771 1.00 0.00 H new ATOM 466 N SER A 33 -2.126 -31.769 2.261 1.00 0.00 N ATOM 467 CA SER A 33 -0.980 -32.174 1.396 1.00 0.00 C ATOM 468 C SER A 33 0.326 -32.177 2.198 1.00 0.00 C ATOM 469 O SER A 33 0.719 -31.175 2.763 1.00 0.00 O ATOM 470 CB SER A 33 -0.927 -31.114 0.295 1.00 0.00 C ATOM 471 OG SER A 33 -0.385 -31.689 -0.886 1.00 0.00 O ATOM 0 H SER A 33 -2.750 -31.073 1.854 1.00 0.00 H new ATOM 0 HA SER A 33 -1.104 -33.180 0.996 1.00 0.00 H new ATOM 0 HB2 SER A 33 -1.927 -30.727 0.099 1.00 0.00 H new ATOM 0 HB3 SER A 33 -0.316 -30.270 0.616 1.00 0.00 H new ATOM 0 HG SER A 33 -0.352 -31.012 -1.594 1.00 0.00 H new ATOM 477 N GLY A 34 1.008 -33.291 2.245 1.00 0.00 N ATOM 478 CA GLY A 34 2.293 -33.347 3.002 1.00 0.00 C ATOM 479 C GLY A 34 2.232 -34.448 4.061 1.00 0.00 C ATOM 480 O GLY A 34 3.188 -35.166 4.281 1.00 0.00 O ATOM 0 H GLY A 34 0.732 -34.163 1.793 1.00 0.00 H new ATOM 0 HA2 GLY A 34 3.120 -33.536 2.317 1.00 0.00 H new ATOM 0 HA3 GLY A 34 2.486 -32.385 3.477 1.00 0.00 H new ATOM 484 N TYR A 35 1.121 -34.580 4.727 1.00 0.00 N ATOM 485 CA TYR A 35 1.000 -35.628 5.782 1.00 0.00 C ATOM 486 C TYR A 35 0.459 -36.935 5.191 1.00 0.00 C ATOM 487 O TYR A 35 -0.218 -36.941 4.183 1.00 0.00 O ATOM 488 CB TYR A 35 0.007 -35.054 6.791 1.00 0.00 C ATOM 489 CG TYR A 35 0.730 -34.138 7.749 1.00 0.00 C ATOM 490 CD1 TYR A 35 1.916 -34.559 8.362 1.00 0.00 C ATOM 491 CD2 TYR A 35 0.211 -32.868 8.025 1.00 0.00 C ATOM 492 CE1 TYR A 35 2.583 -33.709 9.252 1.00 0.00 C ATOM 493 CE2 TYR A 35 0.877 -32.019 8.915 1.00 0.00 C ATOM 494 CZ TYR A 35 2.063 -32.439 9.529 1.00 0.00 C ATOM 495 OH TYR A 35 2.719 -31.601 10.407 1.00 0.00 O ATOM 0 H TYR A 35 0.288 -34.007 4.588 1.00 0.00 H new ATOM 0 HA TYR A 35 1.964 -35.864 6.234 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -0.779 -34.506 6.271 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -0.477 -35.862 7.340 1.00 0.00 H new ATOM 0 HD1 TYR A 35 2.316 -35.539 8.148 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -0.704 -32.544 7.551 1.00 0.00 H new ATOM 0 HE1 TYR A 35 3.498 -34.033 9.725 1.00 0.00 H new ATOM 0 HE2 TYR A 35 0.476 -31.039 9.129 1.00 0.00 H new ATOM 0 HH TYR A 35 2.225 -30.758 10.486 1.00 0.00 H new ATOM 505 N SER A 36 0.749 -38.040 5.822 1.00 0.00 N ATOM 506 CA SER A 36 0.252 -39.351 5.317 1.00 0.00 C ATOM 507 C SER A 36 -1.091 -39.689 5.960 1.00 0.00 C ATOM 508 O SER A 36 -1.308 -39.445 7.132 1.00 0.00 O ATOM 509 CB SER A 36 1.310 -40.367 5.742 1.00 0.00 C ATOM 510 OG SER A 36 1.533 -41.282 4.678 1.00 0.00 O ATOM 0 H SER A 36 1.312 -38.091 6.671 1.00 0.00 H new ATOM 0 HA SER A 36 0.099 -39.344 4.238 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.238 -39.857 6.000 1.00 0.00 H new ATOM 0 HB3 SER A 36 0.981 -40.901 6.634 1.00 0.00 H new ATOM 0 HG SER A 36 0.824 -41.958 4.674 1.00 0.00 H new ATOM 516 N LEU A 37 -1.992 -40.260 5.209 1.00 0.00 N ATOM 517 CA LEU A 37 -3.311 -40.626 5.792 1.00 0.00 C ATOM 518 C LEU A 37 -3.267 -42.069 6.288 1.00 0.00 C ATOM 519 O LEU A 37 -3.442 -43.002 5.530 1.00 0.00 O ATOM 520 CB LEU A 37 -4.326 -40.479 4.657 1.00 0.00 C ATOM 521 CG LEU A 37 -5.720 -40.829 5.184 1.00 0.00 C ATOM 522 CD1 LEU A 37 -6.610 -39.587 5.150 1.00 0.00 C ATOM 523 CD2 LEU A 37 -6.342 -41.920 4.311 1.00 0.00 C ATOM 0 H LEU A 37 -1.872 -40.488 4.222 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.575 -39.994 6.640 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -4.315 -39.459 4.272 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.061 -41.136 3.828 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.634 -41.188 6.210 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.602 -39.840 5.526 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -6.172 -38.809 5.775 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -6.692 -39.226 4.125 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.334 -42.167 4.689 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.423 -41.562 3.285 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -5.712 -42.809 4.337 1.00 0.00 H new ATOM 535 N ILE A 38 -3.038 -42.258 7.555 1.00 0.00 N ATOM 536 CA ILE A 38 -2.987 -43.647 8.098 1.00 0.00 C ATOM 537 C ILE A 38 -4.405 -44.097 8.446 1.00 0.00 C ATOM 538 O ILE A 38 -5.212 -43.318 8.908 1.00 0.00 O ATOM 539 CB ILE A 38 -2.115 -43.610 9.369 1.00 0.00 C ATOM 540 CG1 ILE A 38 -1.183 -42.389 9.380 1.00 0.00 C ATOM 541 CG2 ILE A 38 -1.259 -44.871 9.424 1.00 0.00 C ATOM 542 CD1 ILE A 38 -0.415 -42.317 8.060 1.00 0.00 C ATOM 0 H ILE A 38 -2.884 -41.516 8.238 1.00 0.00 H new ATOM 0 HA ILE A 38 -2.568 -44.344 7.372 1.00 0.00 H new ATOM 0 HB ILE A 38 -2.780 -43.548 10.231 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -1.763 -41.478 9.525 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -0.485 -42.459 10.215 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -0.640 -44.851 10.321 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -1.905 -45.749 9.448 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -0.620 -44.916 8.542 1.00 0.00 H new ATOM 0 HD11 ILE A 38 0.245 -41.450 8.070 1.00 0.00 H new ATOM 0 HD12 ILE A 38 0.178 -43.223 7.934 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -1.120 -42.226 7.233 1.00 0.00 H new ATOM 554 N GLY A 39 -4.721 -45.341 8.222 1.00 0.00 N ATOM 555 CA GLY A 39 -6.094 -45.825 8.536 1.00 0.00 C ATOM 556 C GLY A 39 -6.595 -46.708 7.393 1.00 0.00 C ATOM 557 O GLY A 39 -5.818 -47.303 6.673 1.00 0.00 O ATOM 0 H GLY A 39 -4.090 -46.043 7.836 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -6.088 -46.388 9.469 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -6.766 -44.979 8.678 1.00 0.00 H new ATOM 561 N ASN A 40 -7.884 -46.800 7.217 1.00 0.00 N ATOM 562 CA ASN A 40 -8.421 -47.648 6.114 1.00 0.00 C ATOM 563 C ASN A 40 -9.045 -46.783 5.032 1.00 0.00 C ATOM 564 O ASN A 40 -10.167 -46.997 4.619 1.00 0.00 O ATOM 565 CB ASN A 40 -9.480 -48.530 6.759 1.00 0.00 C ATOM 566 CG ASN A 40 -10.500 -47.659 7.497 1.00 0.00 C ATOM 567 OD1 ASN A 40 -10.193 -46.559 7.910 1.00 0.00 O ATOM 568 ND2 ASN A 40 -11.711 -48.110 7.682 1.00 0.00 N ATOM 0 H ASN A 40 -8.587 -46.327 7.786 1.00 0.00 H new ATOM 0 HA ASN A 40 -7.635 -48.236 5.639 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -9.981 -49.128 5.998 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -9.012 -49.227 7.454 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -12.399 -47.539 8.173 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -11.970 -49.034 7.335 1.00 0.00 H new ATOM 575 N SER A 41 -8.304 -45.822 4.574 1.00 0.00 N ATOM 576 CA SER A 41 -8.791 -44.902 3.504 1.00 0.00 C ATOM 577 C SER A 41 -10.316 -44.755 3.527 1.00 0.00 C ATOM 578 O SER A 41 -10.954 -44.692 2.496 1.00 0.00 O ATOM 579 CB SER A 41 -8.337 -45.541 2.193 1.00 0.00 C ATOM 580 OG SER A 41 -8.883 -46.850 2.097 1.00 0.00 O ATOM 0 H SER A 41 -7.358 -45.626 4.901 1.00 0.00 H new ATOM 0 HA SER A 41 -8.393 -43.896 3.640 1.00 0.00 H new ATOM 0 HB2 SER A 41 -8.663 -44.935 1.347 1.00 0.00 H new ATOM 0 HB3 SER A 41 -7.249 -45.584 2.153 1.00 0.00 H new ATOM 0 HG SER A 41 -8.596 -47.264 1.256 1.00 0.00 H new ATOM 586 N GLY A 42 -10.910 -44.703 4.688 1.00 0.00 N ATOM 587 CA GLY A 42 -12.393 -44.563 4.747 1.00 0.00 C ATOM 588 C GLY A 42 -12.886 -44.794 6.173 1.00 0.00 C ATOM 589 O GLY A 42 -12.613 -45.813 6.777 1.00 0.00 O ATOM 0 H GLY A 42 -10.438 -44.751 5.591 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -12.686 -43.569 4.409 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -12.861 -45.280 4.072 1.00 0.00 H new ATOM 593 N VAL A 43 -13.627 -43.865 6.711 1.00 0.00 N ATOM 594 CA VAL A 43 -14.155 -44.046 8.093 1.00 0.00 C ATOM 595 C VAL A 43 -15.247 -45.107 8.047 1.00 0.00 C ATOM 596 O VAL A 43 -15.528 -45.651 7.003 1.00 0.00 O ATOM 597 CB VAL A 43 -14.752 -42.696 8.513 1.00 0.00 C ATOM 598 CG1 VAL A 43 -14.761 -42.599 10.040 1.00 0.00 C ATOM 599 CG2 VAL A 43 -13.914 -41.544 7.961 1.00 0.00 C ATOM 0 H VAL A 43 -13.889 -42.991 6.255 1.00 0.00 H new ATOM 0 HA VAL A 43 -13.383 -44.359 8.796 1.00 0.00 H new ATOM 0 HB VAL A 43 -15.766 -42.628 8.118 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -15.185 -41.641 10.341 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -15.364 -43.408 10.452 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -13.741 -42.679 10.416 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -14.353 -40.595 8.269 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -12.897 -41.616 8.347 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -13.893 -41.598 6.873 1.00 0.00 H new ATOM 609 N LEU A 44 -15.876 -45.398 9.149 1.00 0.00 N ATOM 610 CA LEU A 44 -16.961 -46.417 9.120 1.00 0.00 C ATOM 611 C LEU A 44 -18.068 -46.035 10.093 1.00 0.00 C ATOM 612 O LEU A 44 -17.975 -46.283 11.279 1.00 0.00 O ATOM 613 CB LEU A 44 -16.316 -47.735 9.552 1.00 0.00 C ATOM 614 CG LEU A 44 -17.413 -48.781 9.798 1.00 0.00 C ATOM 615 CD1 LEU A 44 -17.611 -49.631 8.542 1.00 0.00 C ATOM 616 CD2 LEU A 44 -17.010 -49.684 10.966 1.00 0.00 C ATOM 0 H LEU A 44 -15.689 -44.980 10.060 1.00 0.00 H new ATOM 0 HA LEU A 44 -17.407 -46.495 8.129 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -15.629 -48.086 8.782 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -15.730 -47.586 10.459 1.00 0.00 H new ATOM 0 HG LEU A 44 -18.346 -48.270 10.038 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -18.390 -50.371 8.723 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -17.905 -48.990 7.711 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -16.679 -50.139 8.296 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -17.790 -50.425 11.139 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -16.074 -50.190 10.729 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -16.878 -49.080 11.864 1.00 0.00 H new ATOM 628 N CYS A 45 -19.126 -45.459 9.607 1.00 0.00 N ATOM 629 CA CYS A 45 -20.237 -45.100 10.524 1.00 0.00 C ATOM 630 C CYS A 45 -21.178 -46.290 10.671 1.00 0.00 C ATOM 631 O CYS A 45 -21.879 -46.662 9.747 1.00 0.00 O ATOM 632 CB CYS A 45 -20.956 -43.923 9.879 1.00 0.00 C ATOM 633 SG CYS A 45 -21.438 -42.756 11.176 1.00 0.00 S ATOM 0 H CYS A 45 -19.270 -45.223 8.625 1.00 0.00 H new ATOM 0 HA CYS A 45 -19.878 -44.837 11.519 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -20.305 -43.434 9.154 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -21.836 -44.269 9.336 1.00 0.00 H new ATOM 638 N SER A 46 -21.189 -46.895 11.823 1.00 0.00 N ATOM 639 CA SER A 46 -22.080 -48.068 12.036 1.00 0.00 C ATOM 640 C SER A 46 -22.912 -47.871 13.307 1.00 0.00 C ATOM 641 O SER A 46 -22.381 -47.677 14.383 1.00 0.00 O ATOM 642 CB SER A 46 -21.136 -49.259 12.193 1.00 0.00 C ATOM 643 OG SER A 46 -20.106 -48.925 13.113 1.00 0.00 O ATOM 0 H SER A 46 -20.620 -46.629 12.627 1.00 0.00 H new ATOM 0 HA SER A 46 -22.781 -48.211 11.214 1.00 0.00 H new ATOM 0 HB2 SER A 46 -21.687 -50.130 12.547 1.00 0.00 H new ATOM 0 HB3 SER A 46 -20.705 -49.525 11.228 1.00 0.00 H new ATOM 0 HG SER A 46 -20.473 -48.360 13.824 1.00 0.00 H new ATOM 649 N GLY A 47 -24.210 -47.922 13.195 1.00 0.00 N ATOM 650 CA GLY A 47 -25.071 -47.740 14.399 1.00 0.00 C ATOM 651 C GLY A 47 -25.123 -46.259 14.776 1.00 0.00 C ATOM 652 O GLY A 47 -25.166 -45.906 15.937 1.00 0.00 O ATOM 0 H GLY A 47 -24.713 -48.082 12.322 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -26.077 -48.110 14.198 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -24.677 -48.323 15.231 1.00 0.00 H new ATOM 656 N GLY A 48 -25.121 -45.388 13.804 1.00 0.00 N ATOM 657 CA GLY A 48 -25.172 -43.930 14.109 1.00 0.00 C ATOM 658 C GLY A 48 -23.898 -43.515 14.841 1.00 0.00 C ATOM 659 O GLY A 48 -23.930 -42.740 15.776 1.00 0.00 O ATOM 0 H GLY A 48 -25.086 -45.623 12.812 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -25.276 -43.359 13.187 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -26.045 -43.707 14.722 1.00 0.00 H new ATOM 663 N GLU A 49 -22.775 -44.027 14.422 1.00 0.00 N ATOM 664 CA GLU A 49 -21.492 -43.665 15.090 1.00 0.00 C ATOM 665 C GLU A 49 -20.314 -43.915 14.147 1.00 0.00 C ATOM 666 O GLU A 49 -20.170 -44.982 13.585 1.00 0.00 O ATOM 667 CB GLU A 49 -21.402 -44.585 16.307 1.00 0.00 C ATOM 668 CG GLU A 49 -21.891 -43.836 17.548 1.00 0.00 C ATOM 669 CD GLU A 49 -22.948 -44.674 18.267 1.00 0.00 C ATOM 670 OE1 GLU A 49 -22.824 -45.887 18.255 1.00 0.00 O ATOM 671 OE2 GLU A 49 -23.865 -44.087 18.818 1.00 0.00 O ATOM 0 H GLU A 49 -22.689 -44.682 13.645 1.00 0.00 H new ATOM 0 HA GLU A 49 -21.459 -42.612 15.370 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -22.006 -45.478 16.147 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -20.374 -44.917 16.451 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -21.054 -43.635 18.217 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -22.310 -42.871 17.262 1.00 0.00 H new ATOM 678 N TRP A 50 -19.465 -42.940 13.976 1.00 0.00 N ATOM 679 CA TRP A 50 -18.291 -43.124 13.077 1.00 0.00 C ATOM 680 C TRP A 50 -17.168 -43.842 13.831 1.00 0.00 C ATOM 681 O TRP A 50 -16.909 -43.563 14.985 1.00 0.00 O ATOM 682 CB TRP A 50 -17.864 -41.706 12.695 1.00 0.00 C ATOM 683 CG TRP A 50 -18.797 -41.167 11.658 1.00 0.00 C ATOM 684 CD1 TRP A 50 -19.762 -40.244 11.882 1.00 0.00 C ATOM 685 CD2 TRP A 50 -18.870 -41.499 10.242 1.00 0.00 C ATOM 686 NE1 TRP A 50 -20.419 -39.988 10.692 1.00 0.00 N ATOM 687 CE2 TRP A 50 -19.906 -40.736 9.653 1.00 0.00 C ATOM 688 CE3 TRP A 50 -18.145 -42.379 9.419 1.00 0.00 C ATOM 689 CZ2 TRP A 50 -20.212 -40.843 8.297 1.00 0.00 C ATOM 690 CZ3 TRP A 50 -18.449 -42.488 8.054 1.00 0.00 C ATOM 691 CH2 TRP A 50 -19.479 -41.722 7.495 1.00 0.00 C ATOM 0 H TRP A 50 -19.533 -42.024 14.420 1.00 0.00 H new ATOM 0 HA TRP A 50 -18.524 -43.727 12.200 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -17.871 -41.063 13.575 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -16.843 -41.713 12.313 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -19.983 -39.783 12.834 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -21.189 -39.326 10.595 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -17.349 -42.975 9.841 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -21.009 -40.252 7.870 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -17.885 -43.167 7.431 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -19.707 -41.810 6.443 1.00 0.00 H new ATOM 702 N SER A 51 -16.505 -44.770 13.195 1.00 0.00 N ATOM 703 CA SER A 51 -15.409 -45.502 13.894 1.00 0.00 C ATOM 704 C SER A 51 -14.257 -45.813 12.934 1.00 0.00 C ATOM 705 O SER A 51 -14.427 -45.859 11.731 1.00 0.00 O ATOM 706 CB SER A 51 -16.053 -46.797 14.386 1.00 0.00 C ATOM 707 OG SER A 51 -15.446 -47.188 15.610 1.00 0.00 O ATOM 0 H SER A 51 -16.673 -45.052 12.229 1.00 0.00 H new ATOM 0 HA SER A 51 -14.984 -44.913 14.707 1.00 0.00 H new ATOM 0 HB2 SER A 51 -17.124 -46.653 14.528 1.00 0.00 H new ATOM 0 HB3 SER A 51 -15.933 -47.583 13.640 1.00 0.00 H new ATOM 0 HG SER A 51 -15.858 -48.018 15.929 1.00 0.00 H new ATOM 713 N ASP A 52 -13.087 -46.034 13.469 1.00 0.00 N ATOM 714 CA ASP A 52 -11.904 -46.354 12.617 1.00 0.00 C ATOM 715 C ASP A 52 -11.563 -45.185 11.691 1.00 0.00 C ATOM 716 O ASP A 52 -11.653 -45.293 10.485 1.00 0.00 O ATOM 717 CB ASP A 52 -12.311 -47.587 11.807 1.00 0.00 C ATOM 718 CG ASP A 52 -11.262 -48.687 11.984 1.00 0.00 C ATOM 719 OD1 ASP A 52 -10.596 -48.685 13.006 1.00 0.00 O ATOM 720 OD2 ASP A 52 -11.143 -49.513 11.094 1.00 0.00 O ATOM 0 H ASP A 52 -12.898 -46.006 14.471 1.00 0.00 H new ATOM 0 HA ASP A 52 -11.013 -46.538 13.218 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -13.287 -47.945 12.136 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -12.406 -47.327 10.753 1.00 0.00 H new ATOM 725 N PRO A 53 -11.165 -44.108 12.302 1.00 0.00 N ATOM 726 CA PRO A 53 -10.778 -42.892 11.563 1.00 0.00 C ATOM 727 C PRO A 53 -9.276 -42.922 11.255 1.00 0.00 C ATOM 728 O PRO A 53 -8.488 -43.343 12.078 1.00 0.00 O ATOM 729 CB PRO A 53 -11.097 -41.779 12.555 1.00 0.00 C ATOM 730 CG PRO A 53 -11.032 -42.417 13.919 1.00 0.00 C ATOM 731 CD PRO A 53 -11.048 -43.921 13.743 1.00 0.00 C ATOM 0 HA PRO A 53 -11.289 -42.777 10.607 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.380 -40.962 12.470 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -12.084 -41.358 12.367 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -10.127 -42.106 14.441 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -11.877 -42.097 14.528 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -10.138 -44.378 14.132 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -11.885 -44.376 14.273 1.00 0.00 H new ATOM 739 N PRO A 54 -8.926 -42.471 10.080 1.00 0.00 N ATOM 740 CA PRO A 54 -7.503 -42.448 9.678 1.00 0.00 C ATOM 741 C PRO A 54 -6.791 -41.254 10.319 1.00 0.00 C ATOM 742 O PRO A 54 -7.399 -40.446 10.994 1.00 0.00 O ATOM 743 CB PRO A 54 -7.560 -42.318 8.160 1.00 0.00 C ATOM 744 CG PRO A 54 -8.880 -41.676 7.861 1.00 0.00 C ATOM 745 CD PRO A 54 -9.805 -41.948 9.028 1.00 0.00 C ATOM 0 HA PRO A 54 -6.948 -43.331 9.995 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -6.735 -41.711 7.787 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -7.480 -43.293 7.680 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -8.758 -40.603 7.713 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -9.300 -42.079 6.939 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -10.314 -41.040 9.351 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -10.578 -42.669 8.762 1.00 0.00 H new ATOM 753 N THR A 55 -5.506 -41.146 10.131 1.00 0.00 N ATOM 754 CA THR A 55 -4.759 -40.014 10.754 1.00 0.00 C ATOM 755 C THR A 55 -3.994 -39.210 9.710 1.00 0.00 C ATOM 756 O THR A 55 -3.676 -39.692 8.644 1.00 0.00 O ATOM 757 CB THR A 55 -3.762 -40.679 11.702 1.00 0.00 C ATOM 758 OG1 THR A 55 -3.155 -41.774 11.042 1.00 0.00 O ATOM 759 CG2 THR A 55 -4.487 -41.178 12.946 1.00 0.00 C ATOM 0 H THR A 55 -4.941 -41.788 9.576 1.00 0.00 H new ATOM 0 HA THR A 55 -5.438 -39.323 11.254 1.00 0.00 H new ATOM 0 HB THR A 55 -3.002 -39.955 11.996 1.00 0.00 H new ATOM 0 HG1 THR A 55 -2.501 -42.194 11.639 1.00 0.00 H new ATOM 0 HG21 THR A 55 -3.772 -41.651 13.619 1.00 0.00 H new ATOM 0 HG22 THR A 55 -4.960 -40.337 13.453 1.00 0.00 H new ATOM 0 HG23 THR A 55 -5.248 -41.903 12.657 1.00 0.00 H new ATOM 767 N CYS A 56 -3.666 -37.994 10.036 1.00 0.00 N ATOM 768 CA CYS A 56 -2.884 -37.151 9.096 1.00 0.00 C ATOM 769 C CYS A 56 -1.541 -36.840 9.733 1.00 0.00 C ATOM 770 O CYS A 56 -1.317 -35.775 10.273 1.00 0.00 O ATOM 771 CB CYS A 56 -3.712 -35.884 8.896 1.00 0.00 C ATOM 772 SG CYS A 56 -3.625 -35.379 7.162 1.00 0.00 S ATOM 0 H CYS A 56 -3.908 -37.545 10.919 1.00 0.00 H new ATOM 0 HA CYS A 56 -2.692 -37.636 8.139 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -4.748 -36.064 9.182 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -3.338 -35.086 9.538 1.00 0.00 H new ATOM 777 N GLN A 57 -0.655 -37.786 9.688 1.00 0.00 N ATOM 778 CA GLN A 57 0.682 -37.592 10.303 1.00 0.00 C ATOM 779 C GLN A 57 1.763 -37.664 9.228 1.00 0.00 C ATOM 780 O GLN A 57 1.499 -37.485 8.059 1.00 0.00 O ATOM 781 CB GLN A 57 0.861 -38.748 11.306 1.00 0.00 C ATOM 782 CG GLN A 57 -0.276 -39.775 11.194 1.00 0.00 C ATOM 783 CD GLN A 57 -0.123 -40.834 12.288 1.00 0.00 C ATOM 784 OE1 GLN A 57 -0.962 -40.951 13.158 1.00 0.00 O ATOM 785 NE2 GLN A 57 0.922 -41.616 12.279 1.00 0.00 N ATOM 0 H GLN A 57 -0.800 -38.695 9.248 1.00 0.00 H new ATOM 0 HA GLN A 57 0.762 -36.621 10.792 1.00 0.00 H new ATOM 0 HB2 GLN A 57 1.816 -39.241 11.127 1.00 0.00 H new ATOM 0 HB3 GLN A 57 0.893 -38.349 12.320 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -1.240 -39.276 11.289 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -0.257 -40.247 10.212 1.00 0.00 H new ATOM 0 HE21 GLN A 57 1.626 -41.517 11.548 1.00 0.00 H new ATOM 0 HE22 GLN A 57 1.034 -42.326 13.003 1.00 0.00 H new ATOM 794 N ILE A 58 2.974 -37.942 9.613 1.00 0.00 N ATOM 795 CA ILE A 58 4.068 -38.050 8.607 1.00 0.00 C ATOM 796 C ILE A 58 4.584 -39.487 8.616 1.00 0.00 C ATOM 797 O ILE A 58 4.645 -40.121 9.651 1.00 0.00 O ATOM 798 CB ILE A 58 5.176 -37.070 9.033 1.00 0.00 C ATOM 799 CG1 ILE A 58 4.657 -36.057 10.065 1.00 0.00 C ATOM 800 CG2 ILE A 58 5.662 -36.307 7.801 1.00 0.00 C ATOM 801 CD1 ILE A 58 4.877 -36.606 11.475 1.00 0.00 C ATOM 0 H ILE A 58 3.256 -38.100 10.580 1.00 0.00 H new ATOM 0 HA ILE A 58 3.728 -37.806 7.601 1.00 0.00 H new ATOM 0 HB ILE A 58 5.987 -37.642 9.484 1.00 0.00 H new ATOM 0 HG12 ILE A 58 5.176 -35.105 9.949 1.00 0.00 H new ATOM 0 HG13 ILE A 58 3.597 -35.864 9.900 1.00 0.00 H new ATOM 0 HG21 ILE A 58 6.448 -35.609 8.092 1.00 0.00 H new ATOM 0 HG22 ILE A 58 6.055 -37.012 7.068 1.00 0.00 H new ATOM 0 HG23 ILE A 58 4.830 -35.755 7.363 1.00 0.00 H new ATOM 0 HD11 ILE A 58 4.509 -35.887 12.207 1.00 0.00 H new ATOM 0 HD12 ILE A 58 4.338 -37.547 11.587 1.00 0.00 H new ATOM 0 HD13 ILE A 58 5.941 -36.776 11.637 1.00 0.00 H new ATOM 813 N VAL A 59 4.931 -40.025 7.483 1.00 0.00 N ATOM 814 CA VAL A 59 5.408 -41.435 7.468 1.00 0.00 C ATOM 815 C VAL A 59 6.735 -41.564 6.761 1.00 0.00 C ATOM 816 O VAL A 59 6.963 -42.484 6.006 1.00 0.00 O ATOM 817 CB VAL A 59 4.341 -42.198 6.705 1.00 0.00 C ATOM 818 CG1 VAL A 59 2.974 -41.918 7.329 1.00 0.00 C ATOM 819 CG2 VAL A 59 4.347 -41.734 5.253 1.00 0.00 C ATOM 0 H VAL A 59 4.906 -39.558 6.577 1.00 0.00 H new ATOM 0 HA VAL A 59 5.560 -41.813 8.479 1.00 0.00 H new ATOM 0 HB VAL A 59 4.543 -43.268 6.750 1.00 0.00 H new ATOM 0 HG11 VAL A 59 2.206 -42.465 6.783 1.00 0.00 H new ATOM 0 HG12 VAL A 59 2.977 -42.239 8.371 1.00 0.00 H new ATOM 0 HG13 VAL A 59 2.763 -40.850 7.279 1.00 0.00 H new ATOM 0 HG21 VAL A 59 3.584 -42.276 4.695 1.00 0.00 H new ATOM 0 HG22 VAL A 59 4.137 -40.665 5.212 1.00 0.00 H new ATOM 0 HG23 VAL A 59 5.325 -41.929 4.813 1.00 0.00 H new ATOM 829 N LYS A 60 7.620 -40.674 7.018 1.00 0.00 N ATOM 830 CA LYS A 60 8.947 -40.769 6.366 1.00 0.00 C ATOM 831 C LYS A 60 9.796 -41.782 7.134 1.00 0.00 C ATOM 832 O LYS A 60 10.408 -41.467 8.135 1.00 0.00 O ATOM 833 CB LYS A 60 9.544 -39.366 6.458 1.00 0.00 C ATOM 834 CG LYS A 60 9.002 -38.503 5.318 1.00 0.00 C ATOM 835 CD LYS A 60 9.982 -37.362 5.036 1.00 0.00 C ATOM 836 CE LYS A 60 9.214 -36.138 4.532 1.00 0.00 C ATOM 837 NZ LYS A 60 10.236 -35.060 4.417 1.00 0.00 N ATOM 0 H LYS A 60 7.494 -39.882 7.648 1.00 0.00 H new ATOM 0 HA LYS A 60 8.895 -41.100 5.329 1.00 0.00 H new ATOM 0 HB2 LYS A 60 9.295 -38.916 7.419 1.00 0.00 H new ATOM 0 HB3 LYS A 60 10.631 -39.418 6.403 1.00 0.00 H new ATOM 0 HG2 LYS A 60 8.864 -39.109 4.422 1.00 0.00 H new ATOM 0 HG3 LYS A 60 8.025 -38.101 5.584 1.00 0.00 H new ATOM 0 HD2 LYS A 60 10.533 -37.110 5.942 1.00 0.00 H new ATOM 0 HD3 LYS A 60 10.716 -37.675 4.293 1.00 0.00 H new ATOM 0 HE2 LYS A 60 8.741 -36.338 3.570 1.00 0.00 H new ATOM 0 HE3 LYS A 60 8.421 -35.857 5.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 9.784 -34.188 4.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 10.664 -34.887 5.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 10.975 -35.352 3.746 1.00 0.00 H new ATOM 851 N CYS A 61 9.812 -43.004 6.687 1.00 0.00 N ATOM 852 CA CYS A 61 10.590 -44.052 7.404 1.00 0.00 C ATOM 853 C CYS A 61 12.092 -43.813 7.268 1.00 0.00 C ATOM 854 O CYS A 61 12.537 -43.077 6.410 1.00 0.00 O ATOM 855 CB CYS A 61 10.185 -45.360 6.731 1.00 0.00 C ATOM 856 SG CYS A 61 8.380 -45.450 6.667 1.00 0.00 S ATOM 0 H CYS A 61 9.319 -43.325 5.854 1.00 0.00 H new ATOM 0 HA CYS A 61 10.383 -44.055 8.474 1.00 0.00 H new ATOM 0 HB2 CYS A 61 10.601 -45.411 5.725 1.00 0.00 H new ATOM 0 HB3 CYS A 61 10.586 -46.209 7.285 1.00 0.00 H new ATOM 861 N PRO A 62 12.818 -44.450 8.142 1.00 0.00 N ATOM 862 CA PRO A 62 14.296 -44.322 8.159 1.00 0.00 C ATOM 863 C PRO A 62 14.909 -45.077 6.978 1.00 0.00 C ATOM 864 O PRO A 62 15.052 -44.553 5.891 1.00 0.00 O ATOM 865 CB PRO A 62 14.688 -44.983 9.481 1.00 0.00 C ATOM 866 CG PRO A 62 13.578 -45.937 9.784 1.00 0.00 C ATOM 867 CD PRO A 62 12.327 -45.349 9.194 1.00 0.00 C ATOM 0 HA PRO A 62 14.641 -43.291 8.076 1.00 0.00 H new ATOM 0 HB2 PRO A 62 15.642 -45.503 9.394 1.00 0.00 H new ATOM 0 HB3 PRO A 62 14.799 -44.243 10.274 1.00 0.00 H new ATOM 0 HG2 PRO A 62 13.784 -46.918 9.355 1.00 0.00 H new ATOM 0 HG3 PRO A 62 13.470 -46.075 10.860 1.00 0.00 H new ATOM 0 HD2 PRO A 62 11.676 -46.123 8.786 1.00 0.00 H new ATOM 0 HD3 PRO A 62 11.749 -44.808 9.943 1.00 0.00 H new ATOM 875 N HIS A 63 15.260 -46.309 7.193 1.00 0.00 N ATOM 876 CA HIS A 63 15.855 -47.134 6.119 1.00 0.00 C ATOM 877 C HIS A 63 15.593 -48.591 6.463 1.00 0.00 C ATOM 878 O HIS A 63 15.716 -48.983 7.607 1.00 0.00 O ATOM 879 CB HIS A 63 17.347 -46.835 6.164 1.00 0.00 C ATOM 880 CG HIS A 63 17.782 -46.228 4.862 1.00 0.00 C ATOM 881 ND1 HIS A 63 18.965 -45.518 4.736 1.00 0.00 N ATOM 882 CD2 HIS A 63 17.208 -46.225 3.618 1.00 0.00 C ATOM 883 CE1 HIS A 63 19.063 -45.120 3.455 1.00 0.00 C ATOM 884 NE2 HIS A 63 18.017 -45.524 2.729 1.00 0.00 N ATOM 0 H HIS A 63 15.156 -46.787 8.088 1.00 0.00 H new ATOM 0 HA HIS A 63 15.447 -46.928 5.130 1.00 0.00 H new ATOM 0 HB2 HIS A 63 17.566 -46.153 6.985 1.00 0.00 H new ATOM 0 HB3 HIS A 63 17.906 -47.752 6.353 1.00 0.00 H new ATOM 0 HD2 HIS A 63 16.269 -46.696 3.365 1.00 0.00 H new ATOM 0 HE1 HIS A 63 19.887 -44.544 3.061 1.00 0.00 H new ATOM 0 HE2 HIS A 63 17.848 -45.355 1.737 1.00 0.00 H new ATOM 892 N PRO A 64 15.225 -49.351 5.483 1.00 0.00 N ATOM 893 CA PRO A 64 14.934 -50.768 5.734 1.00 0.00 C ATOM 894 C PRO A 64 16.244 -51.530 5.857 1.00 0.00 C ATOM 895 O PRO A 64 16.553 -52.405 5.074 1.00 0.00 O ATOM 896 CB PRO A 64 14.148 -51.194 4.509 1.00 0.00 C ATOM 897 CG PRO A 64 14.570 -50.252 3.419 1.00 0.00 C ATOM 898 CD PRO A 64 15.059 -48.982 4.075 1.00 0.00 C ATOM 0 HA PRO A 64 14.379 -50.955 6.653 1.00 0.00 H new ATOM 0 HB2 PRO A 64 14.367 -52.228 4.242 1.00 0.00 H new ATOM 0 HB3 PRO A 64 13.075 -51.131 4.689 1.00 0.00 H new ATOM 0 HG2 PRO A 64 15.358 -50.697 2.812 1.00 0.00 H new ATOM 0 HG3 PRO A 64 13.735 -50.041 2.751 1.00 0.00 H new ATOM 0 HD2 PRO A 64 15.998 -48.643 3.638 1.00 0.00 H new ATOM 0 HD3 PRO A 64 14.341 -48.170 3.957 1.00 0.00 H new ATOM 906 N THR A 65 17.021 -51.186 6.840 1.00 0.00 N ATOM 907 CA THR A 65 18.325 -51.868 7.036 1.00 0.00 C ATOM 908 C THR A 65 18.108 -53.247 7.634 1.00 0.00 C ATOM 909 O THR A 65 17.035 -53.566 8.106 1.00 0.00 O ATOM 910 CB THR A 65 19.087 -50.984 8.014 1.00 0.00 C ATOM 911 OG1 THR A 65 18.169 -50.333 8.881 1.00 0.00 O ATOM 912 CG2 THR A 65 19.877 -49.947 7.230 1.00 0.00 C ATOM 0 H THR A 65 16.808 -50.457 7.521 1.00 0.00 H new ATOM 0 HA THR A 65 18.865 -52.005 6.099 1.00 0.00 H new ATOM 0 HB THR A 65 19.769 -51.592 8.609 1.00 0.00 H new ATOM 0 HG1 THR A 65 18.660 -49.765 9.511 1.00 0.00 H new ATOM 0 HG21 THR A 65 20.426 -49.309 7.922 1.00 0.00 H new ATOM 0 HG22 THR A 65 20.579 -50.451 6.565 1.00 0.00 H new ATOM 0 HG23 THR A 65 19.192 -49.338 6.640 1.00 0.00 H new ATOM 920 N ILE A 66 19.109 -54.072 7.627 1.00 0.00 N ATOM 921 CA ILE A 66 18.924 -55.421 8.208 1.00 0.00 C ATOM 922 C ILE A 66 20.275 -56.107 8.425 1.00 0.00 C ATOM 923 O ILE A 66 21.291 -55.689 7.906 1.00 0.00 O ATOM 924 CB ILE A 66 18.038 -56.187 7.203 1.00 0.00 C ATOM 925 CG1 ILE A 66 18.390 -57.675 7.191 1.00 0.00 C ATOM 926 CG2 ILE A 66 18.209 -55.629 5.791 1.00 0.00 C ATOM 927 CD1 ILE A 66 17.386 -58.407 6.305 1.00 0.00 C ATOM 0 H ILE A 66 20.036 -53.875 7.249 1.00 0.00 H new ATOM 0 HA ILE A 66 18.452 -55.385 9.190 1.00 0.00 H new ATOM 0 HB ILE A 66 17.003 -56.061 7.520 1.00 0.00 H new ATOM 0 HG12 ILE A 66 19.403 -57.821 6.815 1.00 0.00 H new ATOM 0 HG13 ILE A 66 18.365 -58.078 8.204 1.00 0.00 H new ATOM 0 HG21 ILE A 66 17.575 -56.185 5.101 1.00 0.00 H new ATOM 0 HG22 ILE A 66 17.924 -54.577 5.779 1.00 0.00 H new ATOM 0 HG23 ILE A 66 19.251 -55.726 5.485 1.00 0.00 H new ATOM 0 HD11 ILE A 66 17.625 -59.470 6.287 1.00 0.00 H new ATOM 0 HD12 ILE A 66 16.381 -58.267 6.702 1.00 0.00 H new ATOM 0 HD13 ILE A 66 17.435 -58.007 5.292 1.00 0.00 H new ATOM 939 N SER A 67 20.288 -57.156 9.201 1.00 0.00 N ATOM 940 CA SER A 67 21.565 -57.874 9.471 1.00 0.00 C ATOM 941 C SER A 67 22.030 -58.627 8.223 1.00 0.00 C ATOM 942 O SER A 67 21.616 -59.740 7.966 1.00 0.00 O ATOM 943 CB SER A 67 21.238 -58.851 10.598 1.00 0.00 C ATOM 944 OG SER A 67 22.187 -58.695 11.645 1.00 0.00 O ATOM 0 H SER A 67 19.466 -57.548 9.661 1.00 0.00 H new ATOM 0 HA SER A 67 22.370 -57.192 9.743 1.00 0.00 H new ATOM 0 HB2 SER A 67 20.231 -58.667 10.974 1.00 0.00 H new ATOM 0 HB3 SER A 67 21.257 -59.875 10.224 1.00 0.00 H new ATOM 0 HG SER A 67 21.979 -59.320 12.371 1.00 0.00 H new ATOM 950 N ASN A 68 22.895 -58.030 7.450 1.00 0.00 N ATOM 951 CA ASN A 68 23.399 -58.709 6.222 1.00 0.00 C ATOM 952 C ASN A 68 22.243 -59.340 5.443 1.00 0.00 C ATOM 953 O ASN A 68 22.281 -60.502 5.091 1.00 0.00 O ATOM 954 CB ASN A 68 24.348 -59.791 6.732 1.00 0.00 C ATOM 955 CG ASN A 68 25.794 -59.346 6.509 1.00 0.00 C ATOM 956 OD1 ASN A 68 26.067 -58.542 5.639 1.00 0.00 O ATOM 957 ND2 ASN A 68 26.739 -59.836 7.263 1.00 0.00 N ATOM 0 H ASN A 68 23.276 -57.098 7.616 1.00 0.00 H new ATOM 0 HA ASN A 68 23.893 -58.013 5.544 1.00 0.00 H new ATOM 0 HB2 ASN A 68 24.172 -59.974 7.792 1.00 0.00 H new ATOM 0 HB3 ASN A 68 24.160 -60.730 6.211 1.00 0.00 H new ATOM 0 HD21 ASN A 68 27.706 -59.544 7.122 1.00 0.00 H new ATOM 0 HD22 ASN A 68 26.511 -60.511 7.993 1.00 0.00 H new ATOM 964 N GLY A 69 21.218 -58.585 5.165 1.00 0.00 N ATOM 965 CA GLY A 69 20.066 -59.146 4.404 1.00 0.00 C ATOM 966 C GLY A 69 19.235 -57.998 3.833 1.00 0.00 C ATOM 967 O GLY A 69 18.023 -58.041 3.823 1.00 0.00 O ATOM 0 H GLY A 69 21.127 -57.605 5.431 1.00 0.00 H new ATOM 0 HA2 GLY A 69 20.424 -59.787 3.599 1.00 0.00 H new ATOM 0 HA3 GLY A 69 19.451 -59.767 5.056 1.00 0.00 H new ATOM 971 N TYR A 70 19.896 -56.968 3.378 1.00 0.00 N ATOM 972 CA TYR A 70 19.195 -55.779 2.808 1.00 0.00 C ATOM 973 C TYR A 70 18.146 -56.149 1.775 1.00 0.00 C ATOM 974 O TYR A 70 17.519 -57.184 1.816 1.00 0.00 O ATOM 975 CB TYR A 70 20.290 -54.920 2.173 1.00 0.00 C ATOM 976 CG TYR A 70 21.018 -55.708 1.106 1.00 0.00 C ATOM 977 CD1 TYR A 70 22.104 -56.523 1.448 1.00 0.00 C ATOM 978 CD2 TYR A 70 20.606 -55.618 -0.231 1.00 0.00 C ATOM 979 CE1 TYR A 70 22.776 -57.248 0.455 1.00 0.00 C ATOM 980 CE2 TYR A 70 21.278 -56.343 -1.222 1.00 0.00 C ATOM 981 CZ TYR A 70 22.362 -57.158 -0.879 1.00 0.00 C ATOM 982 OH TYR A 70 23.024 -57.872 -1.857 1.00 0.00 O ATOM 0 H TYR A 70 20.914 -56.899 3.377 1.00 0.00 H new ATOM 0 HA TYR A 70 18.652 -55.253 3.593 1.00 0.00 H new ATOM 0 HB2 TYR A 70 19.851 -54.022 1.737 1.00 0.00 H new ATOM 0 HB3 TYR A 70 20.994 -54.592 2.937 1.00 0.00 H new ATOM 0 HD1 TYR A 70 22.424 -56.593 2.477 1.00 0.00 H new ATOM 0 HD2 TYR A 70 19.769 -54.989 -0.497 1.00 0.00 H new ATOM 0 HE1 TYR A 70 23.614 -57.876 0.719 1.00 0.00 H new ATOM 0 HE2 TYR A 70 20.960 -56.273 -2.252 1.00 0.00 H new ATOM 0 HH TYR A 70 22.609 -57.697 -2.727 1.00 0.00 H new ATOM 992 N LEU A 71 17.920 -55.247 0.890 1.00 0.00 N ATOM 993 CA LEU A 71 16.873 -55.420 -0.137 1.00 0.00 C ATOM 994 C LEU A 71 17.357 -54.870 -1.474 1.00 0.00 C ATOM 995 O LEU A 71 17.683 -53.707 -1.602 1.00 0.00 O ATOM 996 CB LEU A 71 15.688 -54.601 0.409 1.00 0.00 C ATOM 997 CG LEU A 71 16.193 -53.347 1.154 1.00 0.00 C ATOM 998 CD1 LEU A 71 16.347 -52.186 0.183 1.00 0.00 C ATOM 999 CD2 LEU A 71 15.207 -52.975 2.245 1.00 0.00 C ATOM 0 H LEU A 71 18.431 -54.366 0.829 1.00 0.00 H new ATOM 0 HA LEU A 71 16.608 -56.462 -0.315 1.00 0.00 H new ATOM 0 HB2 LEU A 71 15.035 -54.305 -0.412 1.00 0.00 H new ATOM 0 HB3 LEU A 71 15.093 -55.217 1.084 1.00 0.00 H new ATOM 0 HG LEU A 71 17.164 -53.564 1.599 1.00 0.00 H new ATOM 0 HD11 LEU A 71 16.704 -51.307 0.720 1.00 0.00 H new ATOM 0 HD12 LEU A 71 17.065 -52.453 -0.593 1.00 0.00 H new ATOM 0 HD13 LEU A 71 15.383 -51.965 -0.275 1.00 0.00 H new ATOM 0 HD21 LEU A 71 15.564 -52.089 2.771 1.00 0.00 H new ATOM 0 HD22 LEU A 71 14.234 -52.766 1.800 1.00 0.00 H new ATOM 0 HD23 LEU A 71 15.114 -53.802 2.949 1.00 0.00 H new ATOM 1011 N SER A 72 17.406 -55.704 -2.468 1.00 0.00 N ATOM 1012 CA SER A 72 17.869 -55.248 -3.801 1.00 0.00 C ATOM 1013 C SER A 72 16.658 -55.004 -4.704 1.00 0.00 C ATOM 1014 O SER A 72 16.767 -54.954 -5.913 1.00 0.00 O ATOM 1015 CB SER A 72 18.712 -56.406 -4.328 1.00 0.00 C ATOM 1016 OG SER A 72 18.960 -56.216 -5.715 1.00 0.00 O ATOM 0 H SER A 72 17.144 -56.688 -2.414 1.00 0.00 H new ATOM 0 HA SER A 72 18.435 -54.317 -3.763 1.00 0.00 H new ATOM 0 HB2 SER A 72 19.654 -56.462 -3.783 1.00 0.00 H new ATOM 0 HB3 SER A 72 18.194 -57.351 -4.166 1.00 0.00 H new ATOM 0 HG SER A 72 18.212 -55.727 -6.117 1.00 0.00 H new ATOM 1022 N SER A 73 15.501 -54.869 -4.116 1.00 0.00 N ATOM 1023 CA SER A 73 14.267 -54.647 -4.923 1.00 0.00 C ATOM 1024 C SER A 73 14.168 -53.194 -5.398 1.00 0.00 C ATOM 1025 O SER A 73 14.452 -52.885 -6.538 1.00 0.00 O ATOM 1026 CB SER A 73 13.118 -54.981 -3.974 1.00 0.00 C ATOM 1027 OG SER A 73 11.881 -54.797 -4.649 1.00 0.00 O ATOM 0 H SER A 73 15.356 -54.903 -3.107 1.00 0.00 H new ATOM 0 HA SER A 73 14.256 -55.261 -5.824 1.00 0.00 H new ATOM 0 HB2 SER A 73 13.206 -56.010 -3.627 1.00 0.00 H new ATOM 0 HB3 SER A 73 13.162 -54.342 -3.092 1.00 0.00 H new ATOM 0 HG SER A 73 11.142 -55.012 -4.042 1.00 0.00 H new ATOM 1033 N GLY A 74 13.747 -52.304 -4.543 1.00 0.00 N ATOM 1034 CA GLY A 74 13.611 -50.879 -4.965 1.00 0.00 C ATOM 1035 C GLY A 74 14.448 -49.970 -4.068 1.00 0.00 C ATOM 1036 O GLY A 74 15.394 -49.349 -4.508 1.00 0.00 O ATOM 0 H GLY A 74 13.492 -52.499 -3.575 1.00 0.00 H new ATOM 0 HA2 GLY A 74 13.930 -50.769 -6.002 1.00 0.00 H new ATOM 0 HA3 GLY A 74 12.564 -50.579 -4.920 1.00 0.00 H new ATOM 1040 N PHE A 75 14.091 -49.874 -2.821 1.00 0.00 N ATOM 1041 CA PHE A 75 14.847 -48.991 -1.886 1.00 0.00 C ATOM 1042 C PHE A 75 14.833 -47.547 -2.393 1.00 0.00 C ATOM 1043 O PHE A 75 14.476 -47.275 -3.522 1.00 0.00 O ATOM 1044 CB PHE A 75 16.277 -49.532 -1.869 1.00 0.00 C ATOM 1045 CG PHE A 75 17.174 -48.546 -1.157 1.00 0.00 C ATOM 1046 CD1 PHE A 75 17.310 -48.598 0.236 1.00 0.00 C ATOM 1047 CD2 PHE A 75 17.862 -47.572 -1.891 1.00 0.00 C ATOM 1048 CE1 PHE A 75 18.135 -47.677 0.894 1.00 0.00 C ATOM 1049 CE2 PHE A 75 18.688 -46.653 -1.233 1.00 0.00 C ATOM 1050 CZ PHE A 75 18.824 -46.705 0.159 1.00 0.00 C ATOM 0 H PHE A 75 13.304 -50.371 -2.404 1.00 0.00 H new ATOM 0 HA PHE A 75 14.406 -48.989 -0.889 1.00 0.00 H new ATOM 0 HB2 PHE A 75 16.307 -50.498 -1.365 1.00 0.00 H new ATOM 0 HB3 PHE A 75 16.630 -49.693 -2.888 1.00 0.00 H new ATOM 0 HD1 PHE A 75 16.779 -49.348 0.803 1.00 0.00 H new ATOM 0 HD2 PHE A 75 17.755 -47.530 -2.965 1.00 0.00 H new ATOM 0 HE1 PHE A 75 18.240 -47.717 1.968 1.00 0.00 H new ATOM 0 HE2 PHE A 75 19.221 -45.904 -1.800 1.00 0.00 H new ATOM 0 HZ PHE A 75 19.461 -45.995 0.666 1.00 0.00 H new ATOM 1060 N LYS A 76 15.223 -46.621 -1.562 1.00 0.00 N ATOM 1061 CA LYS A 76 15.240 -45.191 -1.984 1.00 0.00 C ATOM 1062 C LYS A 76 15.779 -44.322 -0.845 1.00 0.00 C ATOM 1063 O LYS A 76 15.552 -44.596 0.315 1.00 0.00 O ATOM 1064 CB LYS A 76 13.779 -44.845 -2.284 1.00 0.00 C ATOM 1065 CG LYS A 76 13.720 -43.736 -3.338 1.00 0.00 C ATOM 1066 CD LYS A 76 12.365 -43.030 -3.263 1.00 0.00 C ATOM 1067 CE LYS A 76 12.311 -41.918 -4.313 1.00 0.00 C ATOM 1068 NZ LYS A 76 13.605 -41.195 -4.170 1.00 0.00 N ATOM 0 H LYS A 76 15.532 -46.793 -0.605 1.00 0.00 H new ATOM 0 HA LYS A 76 15.879 -45.019 -2.850 1.00 0.00 H new ATOM 0 HB2 LYS A 76 13.251 -45.729 -2.642 1.00 0.00 H new ATOM 0 HB3 LYS A 76 13.277 -44.521 -1.372 1.00 0.00 H new ATOM 0 HG2 LYS A 76 14.525 -43.020 -3.172 1.00 0.00 H new ATOM 0 HG3 LYS A 76 13.868 -44.157 -4.332 1.00 0.00 H new ATOM 0 HD2 LYS A 76 11.560 -43.745 -3.433 1.00 0.00 H new ATOM 0 HD3 LYS A 76 12.215 -42.612 -2.267 1.00 0.00 H new ATOM 0 HE2 LYS A 76 12.196 -42.327 -5.317 1.00 0.00 H new ATOM 0 HE3 LYS A 76 11.465 -41.252 -4.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 13.497 -40.219 -4.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 13.887 -41.182 -3.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 14.336 -41.679 -4.729 1.00 0.00 H new ATOM 1082 N ARG A 77 16.495 -43.279 -1.165 1.00 0.00 N ATOM 1083 CA ARG A 77 17.049 -42.399 -0.094 1.00 0.00 C ATOM 1084 C ARG A 77 16.005 -42.176 1.000 1.00 0.00 C ATOM 1085 O ARG A 77 16.327 -42.029 2.163 1.00 0.00 O ATOM 1086 CB ARG A 77 17.379 -41.083 -0.795 1.00 0.00 C ATOM 1087 CG ARG A 77 18.880 -40.823 -0.698 1.00 0.00 C ATOM 1088 CD ARG A 77 19.177 -39.372 -1.079 1.00 0.00 C ATOM 1089 NE ARG A 77 19.657 -39.437 -2.486 1.00 0.00 N ATOM 1090 CZ ARG A 77 19.985 -38.342 -3.114 1.00 0.00 C ATOM 1091 NH1 ARG A 77 20.411 -37.308 -2.442 1.00 0.00 N ATOM 1092 NH2 ARG A 77 19.889 -38.281 -4.414 1.00 0.00 N ATOM 0 H ARG A 77 16.721 -42.998 -2.119 1.00 0.00 H new ATOM 0 HA ARG A 77 17.924 -42.836 0.387 1.00 0.00 H new ATOM 0 HB2 ARG A 77 17.073 -41.128 -1.840 1.00 0.00 H new ATOM 0 HB3 ARG A 77 16.826 -40.264 -0.335 1.00 0.00 H new ATOM 0 HG2 ARG A 77 19.229 -41.022 0.315 1.00 0.00 H new ATOM 0 HG3 ARG A 77 19.420 -41.501 -1.359 1.00 0.00 H new ATOM 0 HD2 ARG A 77 18.286 -38.751 -0.994 1.00 0.00 H new ATOM 0 HD3 ARG A 77 19.932 -38.938 -0.424 1.00 0.00 H new ATOM 0 HE ARG A 77 19.729 -40.338 -2.959 1.00 0.00 H new ATOM 0 HH11 ARG A 77 20.487 -37.356 -1.426 1.00 0.00 H new ATOM 0 HH12 ARG A 77 20.668 -36.451 -2.933 1.00 0.00 H new ATOM 0 HH21 ARG A 77 19.557 -39.090 -4.939 1.00 0.00 H new ATOM 0 HH22 ARG A 77 20.146 -37.424 -4.905 1.00 0.00 H new ATOM 1106 N SER A 78 14.757 -42.151 0.632 1.00 0.00 N ATOM 1107 CA SER A 78 13.683 -41.941 1.645 1.00 0.00 C ATOM 1108 C SER A 78 12.416 -42.705 1.243 1.00 0.00 C ATOM 1109 O SER A 78 12.288 -43.171 0.129 1.00 0.00 O ATOM 1110 CB SER A 78 13.426 -40.434 1.642 1.00 0.00 C ATOM 1111 OG SER A 78 14.670 -39.745 1.651 1.00 0.00 O ATOM 0 H SER A 78 14.431 -42.267 -0.328 1.00 0.00 H new ATOM 0 HA SER A 78 13.970 -42.304 2.632 1.00 0.00 H new ATOM 0 HB2 SER A 78 12.848 -40.154 0.761 1.00 0.00 H new ATOM 0 HB3 SER A 78 12.835 -40.153 2.514 1.00 0.00 H new ATOM 0 HG SER A 78 14.509 -38.778 1.648 1.00 0.00 H new ATOM 1117 N TYR A 79 11.479 -42.837 2.145 1.00 0.00 N ATOM 1118 CA TYR A 79 10.220 -43.571 1.818 1.00 0.00 C ATOM 1119 C TYR A 79 9.017 -42.858 2.449 1.00 0.00 C ATOM 1120 O TYR A 79 9.142 -41.777 2.989 1.00 0.00 O ATOM 1121 CB TYR A 79 10.399 -44.961 2.434 1.00 0.00 C ATOM 1122 CG TYR A 79 11.793 -45.478 2.150 1.00 0.00 C ATOM 1123 CD1 TYR A 79 12.858 -45.124 2.990 1.00 0.00 C ATOM 1124 CD2 TYR A 79 12.019 -46.316 1.050 1.00 0.00 C ATOM 1125 CE1 TYR A 79 14.146 -45.608 2.728 1.00 0.00 C ATOM 1126 CE2 TYR A 79 13.307 -46.798 0.789 1.00 0.00 C ATOM 1127 CZ TYR A 79 14.370 -46.444 1.628 1.00 0.00 C ATOM 1128 OH TYR A 79 15.640 -46.919 1.370 1.00 0.00 O ATOM 0 H TYR A 79 11.531 -42.468 3.095 1.00 0.00 H new ATOM 0 HA TYR A 79 10.037 -43.621 0.745 1.00 0.00 H new ATOM 0 HB2 TYR A 79 10.232 -44.915 3.510 1.00 0.00 H new ATOM 0 HB3 TYR A 79 9.657 -45.647 2.025 1.00 0.00 H new ATOM 0 HD1 TYR A 79 12.685 -44.479 3.839 1.00 0.00 H new ATOM 0 HD2 TYR A 79 11.199 -46.590 0.403 1.00 0.00 H new ATOM 0 HE1 TYR A 79 14.967 -45.336 3.375 1.00 0.00 H new ATOM 0 HE2 TYR A 79 13.481 -47.443 -0.060 1.00 0.00 H new ATOM 0 HH TYR A 79 15.581 -47.821 0.991 1.00 0.00 H new ATOM 1138 N SER A 80 7.850 -43.453 2.394 1.00 0.00 N ATOM 1139 CA SER A 80 6.656 -42.792 3.003 1.00 0.00 C ATOM 1140 C SER A 80 5.447 -43.754 3.046 1.00 0.00 C ATOM 1141 O SER A 80 4.864 -44.063 2.026 1.00 0.00 O ATOM 1142 CB SER A 80 6.355 -41.609 2.084 1.00 0.00 C ATOM 1143 OG SER A 80 5.025 -41.164 2.315 1.00 0.00 O ATOM 0 H SER A 80 7.674 -44.358 1.958 1.00 0.00 H new ATOM 0 HA SER A 80 6.845 -42.487 4.032 1.00 0.00 H new ATOM 0 HB2 SER A 80 7.060 -40.799 2.271 1.00 0.00 H new ATOM 0 HB3 SER A 80 6.477 -41.903 1.041 1.00 0.00 H new ATOM 0 HG SER A 80 4.828 -40.404 1.729 1.00 0.00 H new ATOM 1149 N TYR A 81 5.059 -44.208 4.221 1.00 0.00 N ATOM 1150 CA TYR A 81 3.880 -45.133 4.350 1.00 0.00 C ATOM 1151 C TYR A 81 3.746 -46.056 3.127 1.00 0.00 C ATOM 1152 O TYR A 81 2.659 -46.436 2.738 1.00 0.00 O ATOM 1153 CB TYR A 81 2.670 -44.207 4.479 1.00 0.00 C ATOM 1154 CG TYR A 81 1.390 -45.004 4.391 1.00 0.00 C ATOM 1155 CD1 TYR A 81 1.234 -46.167 5.155 1.00 0.00 C ATOM 1156 CD2 TYR A 81 0.357 -44.577 3.547 1.00 0.00 C ATOM 1157 CE1 TYR A 81 0.045 -46.902 5.075 1.00 0.00 C ATOM 1158 CE2 TYR A 81 -0.832 -45.313 3.468 1.00 0.00 C ATOM 1159 CZ TYR A 81 -0.988 -46.476 4.232 1.00 0.00 C ATOM 1160 OH TYR A 81 -2.160 -47.200 4.154 1.00 0.00 O ATOM 0 H TYR A 81 5.514 -43.974 5.104 1.00 0.00 H new ATOM 0 HA TYR A 81 3.982 -45.800 5.206 1.00 0.00 H new ATOM 0 HB2 TYR A 81 2.710 -43.674 5.429 1.00 0.00 H new ATOM 0 HB3 TYR A 81 2.693 -43.455 3.691 1.00 0.00 H new ATOM 0 HD1 TYR A 81 2.030 -46.497 5.806 1.00 0.00 H new ATOM 0 HD2 TYR A 81 0.477 -43.680 2.957 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -0.075 -47.799 5.665 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -1.629 -44.983 2.818 1.00 0.00 H new ATOM 0 HH TYR A 81 -2.772 -46.765 3.524 1.00 0.00 H new ATOM 1170 N ASN A 82 4.839 -46.435 2.522 1.00 0.00 N ATOM 1171 CA ASN A 82 4.753 -47.342 1.341 1.00 0.00 C ATOM 1172 C ASN A 82 6.152 -47.717 0.850 1.00 0.00 C ATOM 1173 O ASN A 82 7.015 -48.069 1.629 1.00 0.00 O ATOM 1174 CB ASN A 82 3.996 -46.549 0.282 1.00 0.00 C ATOM 1175 CG ASN A 82 3.379 -47.509 -0.738 1.00 0.00 C ATOM 1176 OD1 ASN A 82 3.118 -48.655 -0.431 1.00 0.00 O ATOM 1177 ND2 ASN A 82 3.135 -47.085 -1.949 1.00 0.00 N ATOM 0 H ASN A 82 5.783 -46.158 2.792 1.00 0.00 H new ATOM 0 HA ASN A 82 4.248 -48.279 1.579 1.00 0.00 H new ATOM 0 HB2 ASN A 82 3.215 -45.950 0.751 1.00 0.00 H new ATOM 0 HB3 ASN A 82 4.672 -45.856 -0.219 1.00 0.00 H new ATOM 0 HD21 ASN A 82 2.725 -47.716 -2.637 1.00 0.00 H new ATOM 0 HD22 ASN A 82 3.354 -46.123 -2.206 1.00 0.00 H new ATOM 1184 N ASP A 83 6.381 -47.673 -0.432 1.00 0.00 N ATOM 1185 CA ASP A 83 7.718 -48.058 -0.949 1.00 0.00 C ATOM 1186 C ASP A 83 8.105 -49.414 -0.366 1.00 0.00 C ATOM 1187 O ASP A 83 8.988 -49.520 0.461 1.00 0.00 O ATOM 1188 CB ASP A 83 8.671 -46.961 -0.470 1.00 0.00 C ATOM 1189 CG ASP A 83 9.234 -46.208 -1.677 1.00 0.00 C ATOM 1190 OD1 ASP A 83 8.453 -45.589 -2.382 1.00 0.00 O ATOM 1191 OD2 ASP A 83 10.437 -46.261 -1.875 1.00 0.00 O ATOM 0 H ASP A 83 5.703 -47.388 -1.139 1.00 0.00 H new ATOM 0 HA ASP A 83 7.743 -48.149 -2.035 1.00 0.00 H new ATOM 0 HB2 ASP A 83 8.145 -46.270 0.189 1.00 0.00 H new ATOM 0 HB3 ASP A 83 9.484 -47.399 0.110 1.00 0.00 H new ATOM 1196 N ASN A 84 7.435 -50.452 -0.784 1.00 0.00 N ATOM 1197 CA ASN A 84 7.748 -51.802 -0.244 1.00 0.00 C ATOM 1198 C ASN A 84 9.115 -52.267 -0.751 1.00 0.00 C ATOM 1199 O ASN A 84 9.410 -52.183 -1.926 1.00 0.00 O ATOM 1200 CB ASN A 84 6.632 -52.712 -0.760 1.00 0.00 C ATOM 1201 CG ASN A 84 6.437 -52.498 -2.262 1.00 0.00 C ATOM 1202 OD1 ASN A 84 7.386 -52.513 -3.020 1.00 0.00 O ATOM 1203 ND2 ASN A 84 5.234 -52.298 -2.727 1.00 0.00 N ATOM 0 H ASN A 84 6.686 -50.423 -1.475 1.00 0.00 H new ATOM 0 HA ASN A 84 7.797 -51.811 0.845 1.00 0.00 H new ATOM 0 HB2 ASN A 84 6.880 -53.755 -0.562 1.00 0.00 H new ATOM 0 HB3 ASN A 84 5.703 -52.499 -0.230 1.00 0.00 H new ATOM 0 HD21 ASN A 84 5.091 -52.154 -3.727 1.00 0.00 H new ATOM 0 HD22 ASN A 84 4.437 -52.285 -2.091 1.00 0.00 H new ATOM 1210 N VAL A 85 9.957 -52.751 0.122 1.00 0.00 N ATOM 1211 CA VAL A 85 11.300 -53.208 -0.334 1.00 0.00 C ATOM 1212 C VAL A 85 11.502 -54.696 -0.041 1.00 0.00 C ATOM 1213 O VAL A 85 11.441 -55.128 1.093 1.00 0.00 O ATOM 1214 CB VAL A 85 12.312 -52.379 0.456 1.00 0.00 C ATOM 1215 CG1 VAL A 85 12.259 -50.928 -0.017 1.00 0.00 C ATOM 1216 CG2 VAL A 85 11.986 -52.442 1.950 1.00 0.00 C ATOM 0 H VAL A 85 9.775 -52.849 1.121 1.00 0.00 H new ATOM 0 HA VAL A 85 11.414 -53.077 -1.410 1.00 0.00 H new ATOM 0 HB VAL A 85 13.312 -52.782 0.292 1.00 0.00 H new ATOM 0 HG11 VAL A 85 12.980 -50.335 0.546 1.00 0.00 H new ATOM 0 HG12 VAL A 85 12.501 -50.882 -1.079 1.00 0.00 H new ATOM 0 HG13 VAL A 85 11.257 -50.529 0.144 1.00 0.00 H new ATOM 0 HG21 VAL A 85 12.712 -51.849 2.506 1.00 0.00 H new ATOM 0 HG22 VAL A 85 10.985 -52.045 2.121 1.00 0.00 H new ATOM 0 HG23 VAL A 85 12.028 -53.477 2.288 1.00 0.00 H new ATOM 1226 N ASP A 86 11.773 -55.478 -1.050 1.00 0.00 N ATOM 1227 CA ASP A 86 12.013 -56.931 -0.818 1.00 0.00 C ATOM 1228 C ASP A 86 13.445 -57.103 -0.316 1.00 0.00 C ATOM 1229 O ASP A 86 14.351 -56.441 -0.779 1.00 0.00 O ATOM 1230 CB ASP A 86 11.826 -57.598 -2.182 1.00 0.00 C ATOM 1231 CG ASP A 86 10.689 -58.618 -2.098 1.00 0.00 C ATOM 1232 OD1 ASP A 86 9.600 -58.231 -1.706 1.00 0.00 O ATOM 1233 OD2 ASP A 86 10.926 -59.769 -2.427 1.00 0.00 O ATOM 0 H ASP A 86 11.839 -55.175 -2.022 1.00 0.00 H new ATOM 0 HA ASP A 86 11.341 -57.369 -0.080 1.00 0.00 H new ATOM 0 HB2 ASP A 86 11.600 -56.847 -2.938 1.00 0.00 H new ATOM 0 HB3 ASP A 86 12.749 -58.090 -2.488 1.00 0.00 H new ATOM 1238 N PHE A 87 13.661 -57.951 0.647 1.00 0.00 N ATOM 1239 CA PHE A 87 15.041 -58.102 1.180 1.00 0.00 C ATOM 1240 C PHE A 87 15.803 -59.233 0.496 1.00 0.00 C ATOM 1241 O PHE A 87 15.247 -60.240 0.102 1.00 0.00 O ATOM 1242 CB PHE A 87 14.858 -58.371 2.669 1.00 0.00 C ATOM 1243 CG PHE A 87 14.458 -57.075 3.320 1.00 0.00 C ATOM 1244 CD1 PHE A 87 13.110 -56.715 3.385 1.00 0.00 C ATOM 1245 CD2 PHE A 87 15.439 -56.219 3.828 1.00 0.00 C ATOM 1246 CE1 PHE A 87 12.741 -55.497 3.964 1.00 0.00 C ATOM 1247 CE2 PHE A 87 15.072 -54.998 4.401 1.00 0.00 C ATOM 1248 CZ PHE A 87 13.722 -54.637 4.470 1.00 0.00 C ATOM 0 H PHE A 87 12.952 -58.540 1.084 1.00 0.00 H new ATOM 0 HA PHE A 87 15.640 -57.211 0.994 1.00 0.00 H new ATOM 0 HB2 PHE A 87 14.094 -59.132 2.830 1.00 0.00 H new ATOM 0 HB3 PHE A 87 15.782 -58.750 3.106 1.00 0.00 H new ATOM 0 HD1 PHE A 87 12.354 -57.376 2.989 1.00 0.00 H new ATOM 0 HD2 PHE A 87 16.480 -56.501 3.778 1.00 0.00 H new ATOM 0 HE1 PHE A 87 11.699 -55.220 4.021 1.00 0.00 H new ATOM 0 HE2 PHE A 87 15.830 -54.334 4.790 1.00 0.00 H new ATOM 0 HZ PHE A 87 13.437 -53.695 4.914 1.00 0.00 H new ATOM 1258 N LYS A 88 17.085 -59.051 0.355 1.00 0.00 N ATOM 1259 CA LYS A 88 17.939 -60.074 -0.299 1.00 0.00 C ATOM 1260 C LYS A 88 18.992 -60.573 0.690 1.00 0.00 C ATOM 1261 O LYS A 88 20.073 -60.025 0.783 1.00 0.00 O ATOM 1262 CB LYS A 88 18.609 -59.324 -1.446 1.00 0.00 C ATOM 1263 CG LYS A 88 18.353 -60.062 -2.762 1.00 0.00 C ATOM 1264 CD LYS A 88 19.596 -60.866 -3.145 1.00 0.00 C ATOM 1265 CE LYS A 88 19.626 -61.072 -4.661 1.00 0.00 C ATOM 1266 NZ LYS A 88 20.443 -59.942 -5.184 1.00 0.00 N ATOM 0 H LYS A 88 17.584 -58.220 0.672 1.00 0.00 H new ATOM 0 HA LYS A 88 17.377 -60.943 -0.641 1.00 0.00 H new ATOM 0 HB2 LYS A 88 18.220 -58.308 -1.506 1.00 0.00 H new ATOM 0 HB3 LYS A 88 19.681 -59.244 -1.265 1.00 0.00 H new ATOM 0 HG2 LYS A 88 17.495 -60.726 -2.658 1.00 0.00 H new ATOM 0 HG3 LYS A 88 18.111 -59.349 -3.550 1.00 0.00 H new ATOM 0 HD2 LYS A 88 20.495 -60.342 -2.821 1.00 0.00 H new ATOM 0 HD3 LYS A 88 19.589 -61.830 -2.637 1.00 0.00 H new ATOM 0 HE2 LYS A 88 20.069 -62.033 -4.921 1.00 0.00 H new ATOM 0 HE3 LYS A 88 18.620 -61.061 -5.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 20.511 -60.013 -6.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 19.993 -59.040 -4.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 21.397 -59.983 -4.771 1.00 0.00 H new ATOM 1280 N CYS A 89 18.687 -61.599 1.436 1.00 0.00 N ATOM 1281 CA CYS A 89 19.677 -62.118 2.421 1.00 0.00 C ATOM 1282 C CYS A 89 21.076 -62.142 1.803 1.00 0.00 C ATOM 1283 O CYS A 89 21.270 -62.620 0.703 1.00 0.00 O ATOM 1284 CB CYS A 89 19.209 -63.532 2.753 1.00 0.00 C ATOM 1285 SG CYS A 89 19.228 -63.752 4.547 1.00 0.00 S ATOM 0 H CYS A 89 17.798 -62.099 1.406 1.00 0.00 H new ATOM 0 HA CYS A 89 19.736 -61.493 3.312 1.00 0.00 H new ATOM 0 HB2 CYS A 89 18.204 -63.697 2.364 1.00 0.00 H new ATOM 0 HB3 CYS A 89 19.860 -64.265 2.277 1.00 0.00 H new ATOM 1290 N LYS A 90 22.048 -61.617 2.501 1.00 0.00 N ATOM 1291 CA LYS A 90 23.440 -61.595 1.957 1.00 0.00 C ATOM 1292 C LYS A 90 23.750 -62.900 1.213 1.00 0.00 C ATOM 1293 O LYS A 90 23.944 -62.913 0.014 1.00 0.00 O ATOM 1294 CB LYS A 90 24.342 -61.451 3.184 1.00 0.00 C ATOM 1295 CG LYS A 90 24.910 -60.030 3.239 1.00 0.00 C ATOM 1296 CD LYS A 90 26.411 -60.068 2.943 1.00 0.00 C ATOM 1297 CE LYS A 90 26.978 -58.644 2.986 1.00 0.00 C ATOM 1298 NZ LYS A 90 28.005 -58.595 1.906 1.00 0.00 N ATOM 0 H LYS A 90 21.939 -61.201 3.426 1.00 0.00 H new ATOM 0 HA LYS A 90 23.586 -60.785 1.242 1.00 0.00 H new ATOM 0 HB2 LYS A 90 23.776 -61.663 4.091 1.00 0.00 H new ATOM 0 HB3 LYS A 90 25.154 -62.177 3.138 1.00 0.00 H new ATOM 0 HG2 LYS A 90 24.401 -59.395 2.513 1.00 0.00 H new ATOM 0 HG3 LYS A 90 24.733 -59.594 4.222 1.00 0.00 H new ATOM 0 HD2 LYS A 90 26.921 -60.696 3.674 1.00 0.00 H new ATOM 0 HD3 LYS A 90 26.588 -60.512 1.963 1.00 0.00 H new ATOM 0 HE2 LYS A 90 26.195 -57.904 2.818 1.00 0.00 H new ATOM 0 HE3 LYS A 90 27.419 -58.426 3.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 28.435 -57.648 1.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 28.742 -59.304 2.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 27.556 -58.798 0.990 1.00 0.00 H new ATOM 1312 N TYR A 91 23.797 -63.993 1.920 1.00 0.00 N ATOM 1313 CA TYR A 91 24.093 -65.302 1.264 1.00 0.00 C ATOM 1314 C TYR A 91 24.172 -66.411 2.318 1.00 0.00 C ATOM 1315 O TYR A 91 24.673 -66.209 3.405 1.00 0.00 O ATOM 1316 CB TYR A 91 25.449 -65.110 0.583 1.00 0.00 C ATOM 1317 CG TYR A 91 25.345 -65.521 -0.866 1.00 0.00 C ATOM 1318 CD1 TYR A 91 24.932 -66.816 -1.200 1.00 0.00 C ATOM 1319 CD2 TYR A 91 25.663 -64.606 -1.877 1.00 0.00 C ATOM 1320 CE1 TYR A 91 24.837 -67.197 -2.544 1.00 0.00 C ATOM 1321 CE2 TYR A 91 25.568 -64.986 -3.221 1.00 0.00 C ATOM 1322 CZ TYR A 91 25.155 -66.282 -3.554 1.00 0.00 C ATOM 1323 OH TYR A 91 25.063 -66.658 -4.879 1.00 0.00 O ATOM 0 H TYR A 91 23.643 -64.039 2.927 1.00 0.00 H new ATOM 0 HA TYR A 91 23.320 -65.592 0.552 1.00 0.00 H new ATOM 0 HB2 TYR A 91 25.760 -64.068 0.655 1.00 0.00 H new ATOM 0 HB3 TYR A 91 26.209 -65.706 1.088 1.00 0.00 H new ATOM 0 HD1 TYR A 91 24.686 -67.522 -0.420 1.00 0.00 H new ATOM 0 HD2 TYR A 91 25.982 -63.607 -1.620 1.00 0.00 H new ATOM 0 HE1 TYR A 91 24.518 -68.196 -2.801 1.00 0.00 H new ATOM 0 HE2 TYR A 91 25.813 -64.280 -4.001 1.00 0.00 H new ATOM 0 HH TYR A 91 25.318 -65.904 -5.451 1.00 0.00 H new ATOM 1333 N GLY A 92 23.677 -67.579 2.011 1.00 0.00 N ATOM 1334 CA GLY A 92 23.723 -68.687 3.008 1.00 0.00 C ATOM 1335 C GLY A 92 23.097 -68.203 4.318 1.00 0.00 C ATOM 1336 O GLY A 92 23.636 -68.399 5.389 1.00 0.00 O ATOM 0 H GLY A 92 23.245 -67.814 1.117 1.00 0.00 H new ATOM 0 HA2 GLY A 92 23.183 -69.556 2.631 1.00 0.00 H new ATOM 0 HA3 GLY A 92 24.753 -69.000 3.176 1.00 0.00 H new ATOM 1340 N TYR A 93 21.963 -67.562 4.231 1.00 0.00 N ATOM 1341 CA TYR A 93 21.285 -67.043 5.455 1.00 0.00 C ATOM 1342 C TYR A 93 19.782 -66.900 5.190 1.00 0.00 C ATOM 1343 O TYR A 93 19.361 -66.695 4.068 1.00 0.00 O ATOM 1344 CB TYR A 93 21.918 -65.673 5.690 1.00 0.00 C ATOM 1345 CG TYR A 93 23.314 -65.833 6.248 1.00 0.00 C ATOM 1346 CD1 TYR A 93 23.555 -66.707 7.316 1.00 0.00 C ATOM 1347 CD2 TYR A 93 24.370 -65.100 5.692 1.00 0.00 C ATOM 1348 CE1 TYR A 93 24.854 -66.846 7.826 1.00 0.00 C ATOM 1349 CE2 TYR A 93 25.665 -65.240 6.202 1.00 0.00 C ATOM 1350 CZ TYR A 93 25.908 -66.112 7.268 1.00 0.00 C ATOM 1351 OH TYR A 93 27.186 -66.250 7.770 1.00 0.00 O ATOM 0 H TYR A 93 21.473 -67.374 3.357 1.00 0.00 H new ATOM 0 HA TYR A 93 21.400 -67.702 6.316 1.00 0.00 H new ATOM 0 HB2 TYR A 93 21.954 -65.115 4.754 1.00 0.00 H new ATOM 0 HB3 TYR A 93 21.306 -65.095 6.382 1.00 0.00 H new ATOM 0 HD1 TYR A 93 22.742 -67.273 7.746 1.00 0.00 H new ATOM 0 HD2 TYR A 93 24.184 -64.426 4.869 1.00 0.00 H new ATOM 0 HE1 TYR A 93 25.042 -67.519 8.649 1.00 0.00 H new ATOM 0 HE2 TYR A 93 26.478 -64.674 5.772 1.00 0.00 H new ATOM 0 HH TYR A 93 27.798 -65.671 7.269 1.00 0.00 H new ATOM 1361 N LYS A 94 18.971 -67.006 6.207 1.00 0.00 N ATOM 1362 CA LYS A 94 17.500 -66.875 6.004 1.00 0.00 C ATOM 1363 C LYS A 94 16.985 -65.602 6.679 1.00 0.00 C ATOM 1364 O LYS A 94 17.238 -65.359 7.842 1.00 0.00 O ATOM 1365 CB LYS A 94 16.896 -68.116 6.662 1.00 0.00 C ATOM 1366 CG LYS A 94 16.087 -68.898 5.626 1.00 0.00 C ATOM 1367 CD LYS A 94 16.456 -70.381 5.701 1.00 0.00 C ATOM 1368 CE LYS A 94 15.701 -71.037 6.858 1.00 0.00 C ATOM 1369 NZ LYS A 94 14.535 -71.710 6.222 1.00 0.00 N ATOM 0 H LYS A 94 19.263 -67.178 7.169 1.00 0.00 H new ATOM 0 HA LYS A 94 17.233 -66.804 4.950 1.00 0.00 H new ATOM 0 HB2 LYS A 94 17.686 -68.745 7.072 1.00 0.00 H new ATOM 0 HB3 LYS A 94 16.256 -67.824 7.495 1.00 0.00 H new ATOM 0 HG2 LYS A 94 15.020 -68.768 5.809 1.00 0.00 H new ATOM 0 HG3 LYS A 94 16.288 -68.513 4.626 1.00 0.00 H new ATOM 0 HD2 LYS A 94 16.207 -70.877 4.763 1.00 0.00 H new ATOM 0 HD3 LYS A 94 17.531 -70.492 5.845 1.00 0.00 H new ATOM 0 HE2 LYS A 94 16.331 -71.753 7.385 1.00 0.00 H new ATOM 0 HE3 LYS A 94 15.379 -70.296 7.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.967 -72.184 6.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.950 -71.003 5.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 14.873 -72.414 5.535 1.00 0.00 H new ATOM 1383 N LEU A 95 16.266 -64.786 5.958 1.00 0.00 N ATOM 1384 CA LEU A 95 15.739 -63.529 6.560 1.00 0.00 C ATOM 1385 C LEU A 95 14.747 -63.848 7.677 1.00 0.00 C ATOM 1386 O LEU A 95 13.581 -64.091 7.435 1.00 0.00 O ATOM 1387 CB LEU A 95 15.033 -62.801 5.416 1.00 0.00 C ATOM 1388 CG LEU A 95 16.074 -62.197 4.475 1.00 0.00 C ATOM 1389 CD1 LEU A 95 15.865 -62.744 3.061 1.00 0.00 C ATOM 1390 CD2 LEU A 95 15.925 -60.675 4.457 1.00 0.00 C ATOM 0 H LEU A 95 16.021 -64.935 4.979 1.00 0.00 H new ATOM 0 HA LEU A 95 16.532 -62.926 7.001 1.00 0.00 H new ATOM 0 HB2 LEU A 95 14.393 -63.494 4.870 1.00 0.00 H new ATOM 0 HB3 LEU A 95 14.388 -62.017 5.813 1.00 0.00 H new ATOM 0 HG LEU A 95 17.072 -62.461 4.824 1.00 0.00 H new ATOM 0 HD11 LEU A 95 16.608 -62.312 2.390 1.00 0.00 H new ATOM 0 HD12 LEU A 95 15.972 -63.829 3.071 1.00 0.00 H new ATOM 0 HD13 LEU A 95 14.866 -62.481 2.713 1.00 0.00 H new ATOM 0 HD21 LEU A 95 16.668 -60.245 3.786 1.00 0.00 H new ATOM 0 HD22 LEU A 95 14.926 -60.411 4.110 1.00 0.00 H new ATOM 0 HD23 LEU A 95 16.075 -60.283 5.463 1.00 0.00 H new ATOM 1402 N SER A 96 15.197 -63.839 8.899 1.00 0.00 N ATOM 1403 CA SER A 96 14.277 -64.130 10.030 1.00 0.00 C ATOM 1404 C SER A 96 13.438 -62.888 10.340 1.00 0.00 C ATOM 1405 O SER A 96 13.901 -61.959 10.972 1.00 0.00 O ATOM 1406 CB SER A 96 15.188 -64.472 11.207 1.00 0.00 C ATOM 1407 OG SER A 96 14.636 -63.934 12.401 1.00 0.00 O ATOM 0 H SER A 96 16.162 -63.643 9.163 1.00 0.00 H new ATOM 0 HA SER A 96 13.585 -64.943 9.810 1.00 0.00 H new ATOM 0 HB2 SER A 96 15.294 -65.553 11.297 1.00 0.00 H new ATOM 0 HB3 SER A 96 16.186 -64.066 11.039 1.00 0.00 H new ATOM 0 HG SER A 96 14.570 -62.960 12.321 1.00 0.00 H new ATOM 1413 N GLY A 97 12.212 -62.857 9.893 1.00 0.00 N ATOM 1414 CA GLY A 97 11.355 -61.669 10.162 1.00 0.00 C ATOM 1415 C GLY A 97 10.428 -61.414 8.972 1.00 0.00 C ATOM 1416 O GLY A 97 9.293 -61.847 8.952 1.00 0.00 O ATOM 0 H GLY A 97 11.768 -63.601 9.355 1.00 0.00 H new ATOM 0 HA2 GLY A 97 10.766 -61.832 11.064 1.00 0.00 H new ATOM 0 HA3 GLY A 97 11.979 -60.793 10.342 1.00 0.00 H new ATOM 1420 N SER A 98 10.900 -60.704 7.986 1.00 0.00 N ATOM 1421 CA SER A 98 10.043 -60.406 6.801 1.00 0.00 C ATOM 1422 C SER A 98 10.907 -60.053 5.584 1.00 0.00 C ATOM 1423 O SER A 98 11.553 -59.025 5.548 1.00 0.00 O ATOM 1424 CB SER A 98 9.214 -59.202 7.231 1.00 0.00 C ATOM 1425 OG SER A 98 8.032 -59.656 7.876 1.00 0.00 O ATOM 0 H SER A 98 11.843 -60.316 7.948 1.00 0.00 H new ATOM 0 HA SER A 98 9.428 -61.257 6.508 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.791 -58.570 7.906 1.00 0.00 H new ATOM 0 HB3 SER A 98 8.959 -58.593 6.364 1.00 0.00 H new ATOM 0 HG SER A 98 8.193 -60.539 8.270 1.00 0.00 H new ATOM 1431 N SER A 99 10.922 -60.897 4.589 1.00 0.00 N ATOM 1432 CA SER A 99 11.745 -60.611 3.376 1.00 0.00 C ATOM 1433 C SER A 99 11.126 -59.475 2.559 1.00 0.00 C ATOM 1434 O SER A 99 11.694 -59.019 1.587 1.00 0.00 O ATOM 1435 CB SER A 99 11.735 -61.914 2.578 1.00 0.00 C ATOM 1436 OG SER A 99 12.789 -61.888 1.625 1.00 0.00 O ATOM 0 H SER A 99 10.400 -61.773 4.562 1.00 0.00 H new ATOM 0 HA SER A 99 12.756 -60.294 3.632 1.00 0.00 H new ATOM 0 HB2 SER A 99 11.856 -62.765 3.248 1.00 0.00 H new ATOM 0 HB3 SER A 99 10.776 -62.038 2.074 1.00 0.00 H new ATOM 0 HG SER A 99 12.850 -60.994 1.229 1.00 0.00 H new ATOM 1442 N SER A 100 9.969 -59.012 2.942 1.00 0.00 N ATOM 1443 CA SER A 100 9.324 -57.904 2.180 1.00 0.00 C ATOM 1444 C SER A 100 8.701 -56.892 3.145 1.00 0.00 C ATOM 1445 O SER A 100 7.835 -57.221 3.932 1.00 0.00 O ATOM 1446 CB SER A 100 8.247 -58.579 1.334 1.00 0.00 C ATOM 1447 OG SER A 100 7.161 -58.958 2.170 1.00 0.00 O ATOM 0 H SER A 100 9.443 -59.351 3.747 1.00 0.00 H new ATOM 0 HA SER A 100 10.037 -57.355 1.565 1.00 0.00 H new ATOM 0 HB2 SER A 100 7.901 -57.899 0.555 1.00 0.00 H new ATOM 0 HB3 SER A 100 8.658 -59.455 0.833 1.00 0.00 H new ATOM 0 HG SER A 100 7.346 -58.682 3.092 1.00 0.00 H new ATOM 1453 N SER A 101 9.138 -55.664 3.091 1.00 0.00 N ATOM 1454 CA SER A 101 8.577 -54.629 4.007 1.00 0.00 C ATOM 1455 C SER A 101 8.248 -53.360 3.246 1.00 0.00 C ATOM 1456 O SER A 101 8.567 -53.213 2.084 1.00 0.00 O ATOM 1457 CB SER A 101 9.680 -54.353 5.024 1.00 0.00 C ATOM 1458 OG SER A 101 10.080 -55.575 5.632 1.00 0.00 O ATOM 0 H SER A 101 9.860 -55.332 2.452 1.00 0.00 H new ATOM 0 HA SER A 101 7.654 -54.968 4.477 1.00 0.00 H new ATOM 0 HB2 SER A 101 10.532 -53.882 4.534 1.00 0.00 H new ATOM 0 HB3 SER A 101 9.324 -53.656 5.783 1.00 0.00 H new ATOM 0 HG SER A 101 10.995 -55.793 5.358 1.00 0.00 H new ATOM 1464 N THR A 102 7.607 -52.442 3.903 1.00 0.00 N ATOM 1465 CA THR A 102 7.243 -51.176 3.236 1.00 0.00 C ATOM 1466 C THR A 102 7.264 -50.023 4.236 1.00 0.00 C ATOM 1467 O THR A 102 6.780 -50.136 5.348 1.00 0.00 O ATOM 1468 CB THR A 102 5.835 -51.408 2.702 1.00 0.00 C ATOM 1469 OG1 THR A 102 5.791 -52.646 2.004 1.00 0.00 O ATOM 1470 CG2 THR A 102 5.476 -50.272 1.756 1.00 0.00 C ATOM 0 H THR A 102 7.319 -52.517 4.879 1.00 0.00 H new ATOM 0 HA THR A 102 7.940 -50.909 2.442 1.00 0.00 H new ATOM 0 HB THR A 102 5.124 -51.439 3.527 1.00 0.00 H new ATOM 0 HG1 THR A 102 4.860 -52.874 1.801 1.00 0.00 H new ATOM 0 HG21 THR A 102 4.470 -50.427 1.367 1.00 0.00 H new ATOM 0 HG22 THR A 102 5.515 -49.325 2.294 1.00 0.00 H new ATOM 0 HG23 THR A 102 6.185 -50.249 0.929 1.00 0.00 H new ATOM 1478 N CYS A 103 7.821 -48.912 3.845 1.00 0.00 N ATOM 1479 CA CYS A 103 7.868 -47.746 4.764 1.00 0.00 C ATOM 1480 C CYS A 103 6.476 -47.514 5.351 1.00 0.00 C ATOM 1481 O CYS A 103 5.638 -46.897 4.741 1.00 0.00 O ATOM 1482 CB CYS A 103 8.288 -46.570 3.881 1.00 0.00 C ATOM 1483 SG CYS A 103 7.945 -45.020 4.746 1.00 0.00 S ATOM 0 H CYS A 103 8.245 -48.762 2.929 1.00 0.00 H new ATOM 0 HA CYS A 103 8.555 -47.886 5.599 1.00 0.00 H new ATOM 0 HB2 CYS A 103 9.349 -46.640 3.643 1.00 0.00 H new ATOM 0 HB3 CYS A 103 7.747 -46.599 2.935 1.00 0.00 H new ATOM 1488 N SER A 104 6.218 -48.021 6.518 1.00 0.00 N ATOM 1489 CA SER A 104 4.862 -47.841 7.123 1.00 0.00 C ATOM 1490 C SER A 104 4.563 -46.378 7.422 1.00 0.00 C ATOM 1491 O SER A 104 5.400 -45.514 7.249 1.00 0.00 O ATOM 1492 CB SER A 104 4.884 -48.673 8.408 1.00 0.00 C ATOM 1493 OG SER A 104 4.576 -47.840 9.518 1.00 0.00 O ATOM 0 H SER A 104 6.881 -48.552 7.083 1.00 0.00 H new ATOM 0 HA SER A 104 4.077 -48.163 6.439 1.00 0.00 H new ATOM 0 HB2 SER A 104 4.162 -49.487 8.339 1.00 0.00 H new ATOM 0 HB3 SER A 104 5.865 -49.128 8.542 1.00 0.00 H new ATOM 0 HG SER A 104 5.397 -47.641 10.015 1.00 0.00 H new ATOM 1499 N PRO A 105 3.344 -46.158 7.841 1.00 0.00 N ATOM 1500 CA PRO A 105 2.878 -44.798 8.146 1.00 0.00 C ATOM 1501 C PRO A 105 3.307 -44.358 9.545 1.00 0.00 C ATOM 1502 O PRO A 105 2.791 -43.403 10.092 1.00 0.00 O ATOM 1503 CB PRO A 105 1.368 -44.906 8.052 1.00 0.00 C ATOM 1504 CG PRO A 105 1.048 -46.345 8.320 1.00 0.00 C ATOM 1505 CD PRO A 105 2.297 -47.158 8.062 1.00 0.00 C ATOM 0 HA PRO A 105 3.296 -44.054 7.468 1.00 0.00 H new ATOM 0 HB2 PRO A 105 0.883 -44.255 8.779 1.00 0.00 H new ATOM 0 HB3 PRO A 105 1.014 -44.603 7.067 1.00 0.00 H new ATOM 0 HG2 PRO A 105 0.714 -46.476 9.349 1.00 0.00 H new ATOM 0 HG3 PRO A 105 0.235 -46.681 7.676 1.00 0.00 H new ATOM 0 HD2 PRO A 105 2.534 -47.801 8.909 1.00 0.00 H new ATOM 0 HD3 PRO A 105 2.177 -47.806 7.194 1.00 0.00 H new ATOM 1513 N GLY A 106 4.250 -45.033 10.127 1.00 0.00 N ATOM 1514 CA GLY A 106 4.709 -44.632 11.479 1.00 0.00 C ATOM 1515 C GLY A 106 6.191 -44.280 11.398 1.00 0.00 C ATOM 1516 O GLY A 106 6.921 -44.374 12.365 1.00 0.00 O ATOM 0 H GLY A 106 4.723 -45.844 9.727 1.00 0.00 H new ATOM 0 HA2 GLY A 106 4.135 -43.777 11.837 1.00 0.00 H new ATOM 0 HA3 GLY A 106 4.550 -45.443 12.190 1.00 0.00 H new ATOM 1520 N ASN A 107 6.636 -43.881 10.238 1.00 0.00 N ATOM 1521 CA ASN A 107 8.071 -43.522 10.064 1.00 0.00 C ATOM 1522 C ASN A 107 8.951 -44.736 10.358 1.00 0.00 C ATOM 1523 O ASN A 107 9.879 -44.666 11.139 1.00 0.00 O ATOM 1524 CB ASN A 107 8.334 -42.408 11.078 1.00 0.00 C ATOM 1525 CG ASN A 107 8.200 -41.049 10.390 1.00 0.00 C ATOM 1526 OD1 ASN A 107 9.183 -40.376 10.151 1.00 0.00 O ATOM 1527 ND2 ASN A 107 7.015 -40.612 10.058 1.00 0.00 N ATOM 0 H ASN A 107 6.063 -43.788 9.399 1.00 0.00 H new ATOM 0 HA ASN A 107 8.296 -43.201 9.047 1.00 0.00 H new ATOM 0 HB2 ASN A 107 7.627 -42.480 11.905 1.00 0.00 H new ATOM 0 HB3 ASN A 107 9.332 -42.516 11.502 1.00 0.00 H new ATOM 0 HD21 ASN A 107 6.916 -39.707 9.599 1.00 0.00 H new ATOM 0 HD22 ASN A 107 6.189 -41.176 10.258 1.00 0.00 H new ATOM 1534 N THR A 108 8.668 -45.851 9.741 1.00 0.00 N ATOM 1535 CA THR A 108 9.494 -47.064 9.996 1.00 0.00 C ATOM 1536 C THR A 108 9.302 -48.099 8.889 1.00 0.00 C ATOM 1537 O THR A 108 8.606 -47.872 7.920 1.00 0.00 O ATOM 1538 CB THR A 108 8.988 -47.612 11.326 1.00 0.00 C ATOM 1539 OG1 THR A 108 7.649 -47.187 11.533 1.00 0.00 O ATOM 1540 CG2 THR A 108 9.874 -47.088 12.452 1.00 0.00 C ATOM 0 H THR A 108 7.905 -45.974 9.075 1.00 0.00 H new ATOM 0 HA THR A 108 10.558 -46.830 10.021 1.00 0.00 H new ATOM 0 HB THR A 108 9.021 -48.701 11.313 1.00 0.00 H new ATOM 0 HG1 THR A 108 7.322 -47.540 12.387 1.00 0.00 H new ATOM 0 HG21 THR A 108 9.518 -47.476 13.406 1.00 0.00 H new ATOM 0 HG22 THR A 108 10.901 -47.414 12.289 1.00 0.00 H new ATOM 0 HG23 THR A 108 9.837 -45.999 12.467 1.00 0.00 H new ATOM 1548 N TRP A 109 9.922 -49.236 9.030 1.00 0.00 N ATOM 1549 CA TRP A 109 9.792 -50.294 7.994 1.00 0.00 C ATOM 1550 C TRP A 109 8.953 -51.459 8.519 1.00 0.00 C ATOM 1551 O TRP A 109 9.420 -52.284 9.280 1.00 0.00 O ATOM 1552 CB TRP A 109 11.225 -50.719 7.706 1.00 0.00 C ATOM 1553 CG TRP A 109 11.785 -49.788 6.685 1.00 0.00 C ATOM 1554 CD1 TRP A 109 12.751 -48.861 6.901 1.00 0.00 C ATOM 1555 CD2 TRP A 109 11.410 -49.673 5.287 1.00 0.00 C ATOM 1556 NE1 TRP A 109 12.988 -48.189 5.715 1.00 0.00 N ATOM 1557 CE2 TRP A 109 12.191 -48.660 4.691 1.00 0.00 C ATOM 1558 CE3 TRP A 109 10.480 -50.351 4.485 1.00 0.00 C ATOM 1559 CZ2 TRP A 109 12.054 -48.330 3.342 1.00 0.00 C ATOM 1560 CZ3 TRP A 109 10.340 -50.025 3.130 1.00 0.00 C ATOM 1561 CH2 TRP A 109 11.124 -49.019 2.556 1.00 0.00 C ATOM 0 H TRP A 109 10.516 -49.478 9.823 1.00 0.00 H new ATOM 0 HA TRP A 109 9.285 -49.946 7.094 1.00 0.00 H new ATOM 0 HB2 TRP A 109 11.822 -50.689 8.617 1.00 0.00 H new ATOM 0 HB3 TRP A 109 11.252 -51.746 7.341 1.00 0.00 H new ATOM 0 HD1 TRP A 109 13.251 -48.678 7.841 1.00 0.00 H new ATOM 0 HE1 TRP A 109 13.669 -47.437 5.610 1.00 0.00 H new ATOM 0 HE3 TRP A 109 9.868 -51.130 4.915 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 12.661 -47.549 2.908 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 9.621 -50.555 2.523 1.00 0.00 H new ATOM 0 HH2 TRP A 109 11.012 -48.775 1.510 1.00 0.00 H new ATOM 1572 N LYS A 110 7.710 -51.527 8.118 1.00 0.00 N ATOM 1573 CA LYS A 110 6.832 -52.634 8.595 1.00 0.00 C ATOM 1574 C LYS A 110 6.588 -53.643 7.463 1.00 0.00 C ATOM 1575 O LYS A 110 6.407 -53.253 6.327 1.00 0.00 O ATOM 1576 CB LYS A 110 5.520 -51.955 8.993 1.00 0.00 C ATOM 1577 CG LYS A 110 5.713 -51.191 10.306 1.00 0.00 C ATOM 1578 CD LYS A 110 4.572 -51.529 11.269 1.00 0.00 C ATOM 1579 CE LYS A 110 3.426 -50.532 11.076 1.00 0.00 C ATOM 1580 NZ LYS A 110 2.233 -51.371 10.773 1.00 0.00 N ATOM 0 H LYS A 110 7.267 -50.864 7.482 1.00 0.00 H new ATOM 0 HA LYS A 110 7.277 -53.185 9.424 1.00 0.00 H new ATOM 0 HB2 LYS A 110 5.200 -51.271 8.207 1.00 0.00 H new ATOM 0 HB3 LYS A 110 4.733 -52.701 9.107 1.00 0.00 H new ATOM 0 HG2 LYS A 110 6.671 -51.454 10.754 1.00 0.00 H new ATOM 0 HG3 LYS A 110 5.735 -50.118 10.114 1.00 0.00 H new ATOM 0 HD2 LYS A 110 4.219 -52.544 11.088 1.00 0.00 H new ATOM 0 HD3 LYS A 110 4.929 -51.494 12.298 1.00 0.00 H new ATOM 0 HE2 LYS A 110 3.269 -49.932 11.973 1.00 0.00 H new ATOM 0 HE3 LYS A 110 3.638 -49.839 10.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 1.405 -50.758 10.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 2.409 -51.926 9.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 2.051 -52.016 11.568 1.00 0.00 H new ATOM 1594 N PRO A 111 6.582 -54.911 7.802 1.00 0.00 N ATOM 1595 CA PRO A 111 6.807 -55.352 9.204 1.00 0.00 C ATOM 1596 C PRO A 111 8.283 -55.184 9.586 1.00 0.00 C ATOM 1597 O PRO A 111 9.114 -54.862 8.761 1.00 0.00 O ATOM 1598 CB PRO A 111 6.410 -56.825 9.187 1.00 0.00 C ATOM 1599 CG PRO A 111 6.586 -57.256 7.768 1.00 0.00 C ATOM 1600 CD PRO A 111 6.362 -56.046 6.901 1.00 0.00 C ATOM 0 HA PRO A 111 6.238 -54.774 9.932 1.00 0.00 H new ATOM 0 HB2 PRO A 111 7.038 -57.411 9.858 1.00 0.00 H new ATOM 0 HB3 PRO A 111 5.380 -56.960 9.516 1.00 0.00 H new ATOM 0 HG2 PRO A 111 7.585 -57.662 7.611 1.00 0.00 H new ATOM 0 HG3 PRO A 111 5.878 -58.046 7.516 1.00 0.00 H new ATOM 0 HD2 PRO A 111 7.054 -56.026 6.059 1.00 0.00 H new ATOM 0 HD3 PRO A 111 5.354 -56.035 6.486 1.00 0.00 H new ATOM 1608 N GLU A 112 8.607 -55.387 10.834 1.00 0.00 N ATOM 1609 CA GLU A 112 10.022 -55.226 11.282 1.00 0.00 C ATOM 1610 C GLU A 112 10.994 -55.792 10.242 1.00 0.00 C ATOM 1611 O GLU A 112 10.787 -56.855 9.692 1.00 0.00 O ATOM 1612 CB GLU A 112 10.117 -56.019 12.586 1.00 0.00 C ATOM 1613 CG GLU A 112 10.249 -55.052 13.765 1.00 0.00 C ATOM 1614 CD GLU A 112 9.842 -55.766 15.055 1.00 0.00 C ATOM 1615 OE1 GLU A 112 8.726 -56.256 15.111 1.00 0.00 O ATOM 1616 OE2 GLU A 112 10.654 -55.813 15.965 1.00 0.00 O ATOM 0 H GLU A 112 7.951 -55.658 11.566 1.00 0.00 H new ATOM 0 HA GLU A 112 10.287 -54.177 11.415 1.00 0.00 H new ATOM 0 HB2 GLU A 112 9.231 -56.642 12.710 1.00 0.00 H new ATOM 0 HB3 GLU A 112 10.976 -56.689 12.554 1.00 0.00 H new ATOM 0 HG2 GLU A 112 11.276 -54.694 13.843 1.00 0.00 H new ATOM 0 HG3 GLU A 112 9.618 -54.178 13.605 1.00 0.00 H new ATOM 1623 N LEU A 113 12.060 -55.085 9.979 1.00 0.00 N ATOM 1624 CA LEU A 113 13.063 -55.569 8.986 1.00 0.00 C ATOM 1625 C LEU A 113 13.411 -57.032 9.259 1.00 0.00 C ATOM 1626 O LEU A 113 13.427 -57.474 10.391 1.00 0.00 O ATOM 1627 CB LEU A 113 14.289 -54.673 9.207 1.00 0.00 C ATOM 1628 CG LEU A 113 14.345 -53.515 8.184 1.00 0.00 C ATOM 1629 CD1 LEU A 113 12.976 -53.260 7.536 1.00 0.00 C ATOM 1630 CD2 LEU A 113 14.797 -52.241 8.903 1.00 0.00 C ATOM 0 H LEU A 113 12.281 -54.188 10.412 1.00 0.00 H new ATOM 0 HA LEU A 113 12.695 -55.518 7.961 1.00 0.00 H new ATOM 0 HB2 LEU A 113 14.264 -54.265 10.217 1.00 0.00 H new ATOM 0 HB3 LEU A 113 15.196 -55.272 9.128 1.00 0.00 H new ATOM 0 HG LEU A 113 15.047 -53.791 7.397 1.00 0.00 H new ATOM 0 HD11 LEU A 113 13.058 -52.439 6.824 1.00 0.00 H new ATOM 0 HD12 LEU A 113 12.646 -54.160 7.016 1.00 0.00 H new ATOM 0 HD13 LEU A 113 12.251 -53.000 8.307 1.00 0.00 H new ATOM 0 HD21 LEU A 113 14.840 -51.417 8.191 1.00 0.00 H new ATOM 0 HD22 LEU A 113 14.088 -51.999 9.695 1.00 0.00 H new ATOM 0 HD23 LEU A 113 15.785 -52.399 9.336 1.00 0.00 H new ATOM 1642 N PRO A 114 13.676 -57.731 8.193 1.00 0.00 N ATOM 1643 CA PRO A 114 14.031 -59.167 8.284 1.00 0.00 C ATOM 1644 C PRO A 114 15.443 -59.350 8.845 1.00 0.00 C ATOM 1645 O PRO A 114 16.207 -58.411 8.950 1.00 0.00 O ATOM 1646 CB PRO A 114 13.946 -59.644 6.837 1.00 0.00 C ATOM 1647 CG PRO A 114 14.138 -58.422 5.998 1.00 0.00 C ATOM 1648 CD PRO A 114 13.672 -57.243 6.811 1.00 0.00 C ATOM 0 HA PRO A 114 13.378 -59.726 8.954 1.00 0.00 H new ATOM 0 HB2 PRO A 114 14.712 -60.389 6.625 1.00 0.00 H new ATOM 0 HB3 PRO A 114 12.982 -60.111 6.634 1.00 0.00 H new ATOM 0 HG2 PRO A 114 15.186 -58.307 5.720 1.00 0.00 H new ATOM 0 HG3 PRO A 114 13.569 -58.499 5.071 1.00 0.00 H new ATOM 0 HD2 PRO A 114 14.337 -56.388 6.689 1.00 0.00 H new ATOM 0 HD3 PRO A 114 12.677 -56.918 6.507 1.00 0.00 H new ATOM 1656 N LYS A 115 15.792 -60.555 9.209 1.00 0.00 N ATOM 1657 CA LYS A 115 17.153 -60.801 9.768 1.00 0.00 C ATOM 1658 C LYS A 115 17.854 -61.936 9.014 1.00 0.00 C ATOM 1659 O LYS A 115 17.494 -63.088 9.136 1.00 0.00 O ATOM 1660 CB LYS A 115 16.912 -61.197 11.224 1.00 0.00 C ATOM 1661 CG LYS A 115 18.213 -61.052 12.015 1.00 0.00 C ATOM 1662 CD LYS A 115 17.894 -60.632 13.451 1.00 0.00 C ATOM 1663 CE LYS A 115 17.119 -61.750 14.151 1.00 0.00 C ATOM 1664 NZ LYS A 115 15.986 -61.065 14.833 1.00 0.00 N ATOM 0 H LYS A 115 15.194 -61.379 9.144 1.00 0.00 H new ATOM 0 HA LYS A 115 17.796 -59.925 9.678 1.00 0.00 H new ATOM 0 HB2 LYS A 115 16.137 -60.567 11.660 1.00 0.00 H new ATOM 0 HB3 LYS A 115 16.554 -62.225 11.278 1.00 0.00 H new ATOM 0 HG2 LYS A 115 18.759 -61.996 12.014 1.00 0.00 H new ATOM 0 HG3 LYS A 115 18.857 -60.310 11.543 1.00 0.00 H new ATOM 0 HD2 LYS A 115 18.816 -60.420 13.992 1.00 0.00 H new ATOM 0 HD3 LYS A 115 17.307 -59.714 13.450 1.00 0.00 H new ATOM 0 HE2 LYS A 115 16.760 -62.489 13.435 1.00 0.00 H new ATOM 0 HE3 LYS A 115 17.749 -62.279 14.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 15.408 -61.768 15.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 16.358 -60.372 15.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 15.400 -60.576 14.126 1.00 0.00 H new ATOM 1678 N CYS A 116 18.862 -61.622 8.245 1.00 0.00 N ATOM 1679 CA CYS A 116 19.592 -62.690 7.501 1.00 0.00 C ATOM 1680 C CYS A 116 20.310 -63.595 8.499 1.00 0.00 C ATOM 1681 O CYS A 116 21.440 -63.359 8.877 1.00 0.00 O ATOM 1682 CB CYS A 116 20.584 -61.938 6.609 1.00 0.00 C ATOM 1683 SG CYS A 116 20.975 -62.914 5.130 1.00 0.00 S ATOM 0 H CYS A 116 19.211 -60.675 8.100 1.00 0.00 H new ATOM 0 HA CYS A 116 18.938 -63.329 6.908 1.00 0.00 H new ATOM 0 HB2 CYS A 116 20.162 -60.976 6.316 1.00 0.00 H new ATOM 0 HB3 CYS A 116 21.497 -61.729 7.166 1.00 0.00 H new ATOM 1688 N VAL A 117 19.643 -64.625 8.934 1.00 0.00 N ATOM 1689 CA VAL A 117 20.257 -65.560 9.923 1.00 0.00 C ATOM 1690 C VAL A 117 20.656 -66.859 9.262 1.00 0.00 C ATOM 1691 O VAL A 117 20.528 -67.033 8.069 1.00 0.00 O ATOM 1692 CB VAL A 117 19.178 -65.836 10.967 1.00 0.00 C ATOM 1693 CG1 VAL A 117 19.161 -64.694 11.957 1.00 0.00 C ATOM 1694 CG2 VAL A 117 17.802 -65.951 10.305 1.00 0.00 C ATOM 0 H VAL A 117 18.694 -64.863 8.647 1.00 0.00 H new ATOM 0 HA VAL A 117 21.155 -65.124 10.360 1.00 0.00 H new ATOM 0 HB VAL A 117 19.400 -66.777 11.471 1.00 0.00 H new ATOM 0 HG11 VAL A 117 18.394 -64.877 12.710 1.00 0.00 H new ATOM 0 HG12 VAL A 117 20.135 -64.618 12.441 1.00 0.00 H new ATOM 0 HG13 VAL A 117 18.942 -63.763 11.435 1.00 0.00 H new ATOM 0 HG21 VAL A 117 17.047 -66.148 11.066 1.00 0.00 H new ATOM 0 HG22 VAL A 117 17.566 -65.019 9.792 1.00 0.00 H new ATOM 0 HG23 VAL A 117 17.812 -66.769 9.584 1.00 0.00 H new ATOM 1704 N ARG A 118 21.133 -67.781 10.037 1.00 0.00 N ATOM 1705 CA ARG A 118 21.528 -69.074 9.448 1.00 0.00 C ATOM 1706 C ARG A 118 20.852 -70.232 10.187 1.00 0.00 C ATOM 1707 O ARG A 118 19.667 -70.124 10.457 1.00 0.00 O ATOM 1708 CB ARG A 118 23.050 -69.142 9.589 1.00 0.00 C ATOM 1709 CG ARG A 118 23.433 -69.467 11.037 1.00 0.00 C ATOM 1710 CD ARG A 118 24.266 -70.751 11.067 1.00 0.00 C ATOM 1711 NE ARG A 118 23.883 -71.430 12.335 1.00 0.00 N ATOM 1712 CZ ARG A 118 23.827 -72.733 12.386 1.00 0.00 C ATOM 1713 NH1 ARG A 118 23.160 -73.393 11.479 1.00 0.00 N ATOM 1714 NH2 ARG A 118 24.437 -73.376 13.343 1.00 0.00 N ATOM 1715 OXT ARG A 118 21.531 -71.204 10.472 1.00 0.00 O ATOM 0 H ARG A 118 21.265 -67.695 11.045 1.00 0.00 H new ATOM 0 HA ARG A 118 21.222 -69.155 8.405 1.00 0.00 H new ATOM 0 HB2 ARG A 118 23.451 -69.903 8.919 1.00 0.00 H new ATOM 0 HB3 ARG A 118 23.493 -68.191 9.293 1.00 0.00 H new ATOM 0 HG2 ARG A 118 24.000 -68.642 11.469 1.00 0.00 H new ATOM 0 HG3 ARG A 118 22.536 -69.588 11.644 1.00 0.00 H new ATOM 0 HD2 ARG A 118 24.053 -71.380 10.203 1.00 0.00 H new ATOM 0 HD3 ARG A 118 25.333 -70.530 11.045 1.00 0.00 H new ATOM 0 HE ARG A 118 23.664 -70.877 13.164 1.00 0.00 H new ATOM 0 HH11 ARG A 118 22.683 -72.891 10.731 1.00 0.00 H new ATOM 0 HH12 ARG A 118 23.116 -74.411 11.519 1.00 0.00 H new ATOM 0 HH21 ARG A 118 24.958 -72.861 14.052 1.00 0.00 H new ATOM 0 HH22 ARG A 118 24.393 -74.394 13.382 1.00 0.00 H new TER 1729 ARG A 118