USER MOD reduce.3.24.130724 H: found=0, std=0, add=1103, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1097 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 127 GLN : amide:sc= -3.9! C(o=-16!,f=-21!) USER MOD Set 1.2: A 129 HIS : no HE2:sc= -11.7! C(o=-16!,f=-17!) USER MOD Set 2.1: A 103 ASN : amide:sc= -0.393 X(o=-0.39,f=-0.61) USER MOD Set 2.2: A 110 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 92 THR OG1 : rot 120:sc= -0.784 USER MOD Set 3.2: A 95 MET CE :methyl -166:sc= -1.1 (180deg=-1.43) USER MOD Set 4.1: A 63 SER OG : rot 1:sc= 2.04 USER MOD Set 4.2: A 100 TYR OH : rot 81:sc= 1.05 USER MOD Set 4.3: A 111 GLN : amide:sc= 0 X(o=3.1,f=2.9) USER MOD Set 5.1: A 29 HIS : no HD1:sc= -3.32! C(o=-6.7!,f=-1.1!) USER MOD Set 5.2: A 102 TYR OH : rot 30:sc= -3.36! USER MOD Set 6.1: A 19 ASN : amide:sc= -0.342 K(o=-19,f=-21) USER MOD Set 6.2: A 55 HIS : no HD1:sc= -14.2! C(o=-19!,f=-24!) USER MOD Set 6.3: A 119 MET CE :methyl -139:sc= -4.46! (180deg=-0.913) USER MOD Set 7.1: A 18 SER OG : rot -140:sc= -1.65 USER MOD Set 7.2: A 54 ASN : amide:sc= -2.31 K(o=-4,f=1.5) USER MOD Single : A 1 GLY N :NH3+ -122:sc= 0.113 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 53:sc= 1.01 USER MOD Single : A 5 SER OG : rot 73:sc= 1.19 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0712) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 HIS : no HD1:sc= -2.59! C(o=-2.6!,f=-2.6!) USER MOD Single : A 25 ASN : amide:sc= 0.235 X(o=0.23,f=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 CYS SG : rot 64:sc= -0.113 USER MOD Single : A 31 CYS SG : rot 98:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -0.167 K(o=-0.17,f=-0.8) USER MOD Single : A 40 GLN : amide:sc= -0.507 K(o=-0.51,f=-2.3!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= 0.991 K(o=0.99,f=-0.84) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 94:sc= -1.34 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 CYS SG : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 TYR OH : rot -21:sc= -1.91 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0.0661 USER MOD Single : A 74 SER OG : rot -91:sc= 0.0386 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 14:sc= 0.117 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 MET CE :methyl 144:sc= -2.77 (180deg=-4.03!) USER MOD Single : A 118 SER OG : rot 46:sc= 1.14 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 24:sc= 0.831 USER MOD Single : A 132 GLN : amide:sc= -0.0174 X(o=-0.017,f=-0.045) USER MOD Single : A 133 SER OG : rot -97:sc= 1.13 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.291 33.760 -26.246 1.00 0.00 N ATOM 2 CA GLY A 1 17.933 32.621 -25.611 1.00 0.00 C ATOM 3 C GLY A 1 17.179 31.326 -25.917 1.00 0.00 C ATOM 4 O GLY A 1 16.283 31.309 -26.760 1.00 0.00 O ATOM 0 H1 GLY A 1 17.969 34.234 -26.876 1.00 0.00 H new ATOM 0 H2 GLY A 1 16.473 33.434 -26.800 1.00 0.00 H new ATOM 0 H3 GLY A 1 16.971 34.429 -25.517 1.00 0.00 H new ATOM 0 HA2 GLY A 1 18.962 32.538 -25.960 1.00 0.00 H new ATOM 0 HA3 GLY A 1 17.974 32.776 -24.533 1.00 0.00 H new ATOM 8 N SER A 2 17.569 30.271 -25.216 1.00 0.00 N ATOM 9 CA SER A 2 16.941 28.975 -25.402 1.00 0.00 C ATOM 10 C SER A 2 17.609 27.935 -24.500 1.00 0.00 C ATOM 11 O SER A 2 18.693 28.173 -23.970 1.00 0.00 O ATOM 12 CB SER A 2 17.013 28.533 -26.865 1.00 0.00 C ATOM 13 OG SER A 2 18.343 28.585 -27.374 1.00 0.00 O ATOM 0 H SER A 2 18.313 30.288 -24.518 1.00 0.00 H new ATOM 0 HA SER A 2 15.890 29.062 -25.128 1.00 0.00 H new ATOM 0 HB2 SER A 2 16.630 27.517 -26.956 1.00 0.00 H new ATOM 0 HB3 SER A 2 16.369 29.172 -27.469 1.00 0.00 H new ATOM 0 HG SER A 2 18.347 28.294 -28.310 1.00 0.00 H new ATOM 19 N SER A 3 16.934 26.804 -24.354 1.00 0.00 N ATOM 20 CA SER A 3 17.449 25.728 -23.525 1.00 0.00 C ATOM 21 C SER A 3 16.496 24.531 -23.569 1.00 0.00 C ATOM 22 O SER A 3 15.375 24.645 -24.062 1.00 0.00 O ATOM 23 CB SER A 3 17.651 26.192 -22.081 1.00 0.00 C ATOM 24 OG SER A 3 18.998 26.581 -21.829 1.00 0.00 O ATOM 0 H SER A 3 16.035 26.610 -24.796 1.00 0.00 H new ATOM 0 HA SER A 3 18.419 25.427 -23.920 1.00 0.00 H new ATOM 0 HB2 SER A 3 16.987 27.031 -21.873 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.372 25.388 -21.400 1.00 0.00 H new ATOM 0 HG SER A 3 19.278 27.241 -22.497 1.00 0.00 H new ATOM 30 N GLY A 4 16.978 23.412 -23.049 1.00 0.00 N ATOM 31 CA GLY A 4 16.183 22.196 -23.023 1.00 0.00 C ATOM 32 C GLY A 4 16.861 21.116 -22.178 1.00 0.00 C ATOM 33 O GLY A 4 17.969 21.315 -21.682 1.00 0.00 O ATOM 0 H GLY A 4 17.909 23.322 -22.642 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.194 22.412 -22.618 1.00 0.00 H new ATOM 0 HA3 GLY A 4 16.038 21.830 -24.039 1.00 0.00 H new ATOM 37 N SER A 5 16.168 19.995 -22.041 1.00 0.00 N ATOM 38 CA SER A 5 16.689 18.882 -21.265 1.00 0.00 C ATOM 39 C SER A 5 15.651 17.761 -21.196 1.00 0.00 C ATOM 40 O SER A 5 14.467 18.018 -20.983 1.00 0.00 O ATOM 41 CB SER A 5 17.082 19.330 -19.856 1.00 0.00 C ATOM 42 OG SER A 5 18.464 19.664 -19.768 1.00 0.00 O ATOM 0 H SER A 5 15.250 19.833 -22.454 1.00 0.00 H new ATOM 0 HA SER A 5 17.585 18.508 -21.761 1.00 0.00 H new ATOM 0 HB2 SER A 5 16.481 20.193 -19.569 1.00 0.00 H new ATOM 0 HB3 SER A 5 16.855 18.534 -19.146 1.00 0.00 H new ATOM 0 HG SER A 5 18.624 20.517 -20.223 1.00 0.00 H new ATOM 48 N SER A 6 16.133 16.540 -21.380 1.00 0.00 N ATOM 49 CA SER A 6 15.261 15.378 -21.342 1.00 0.00 C ATOM 50 C SER A 6 16.072 14.107 -21.602 1.00 0.00 C ATOM 51 O SER A 6 17.249 14.178 -21.951 1.00 0.00 O ATOM 52 CB SER A 6 14.129 15.504 -22.363 1.00 0.00 C ATOM 53 OG SER A 6 12.857 15.216 -21.788 1.00 0.00 O ATOM 0 H SER A 6 17.116 16.330 -21.556 1.00 0.00 H new ATOM 0 HA SER A 6 14.813 15.319 -20.350 1.00 0.00 H new ATOM 0 HB2 SER A 6 14.121 16.514 -22.773 1.00 0.00 H new ATOM 0 HB3 SER A 6 14.313 14.824 -23.195 1.00 0.00 H new ATOM 0 HG SER A 6 12.161 15.309 -22.471 1.00 0.00 H new ATOM 59 N GLY A 7 15.409 12.974 -21.424 1.00 0.00 N ATOM 60 CA GLY A 7 16.053 11.689 -21.636 1.00 0.00 C ATOM 61 C GLY A 7 16.907 11.706 -22.905 1.00 0.00 C ATOM 62 O GLY A 7 16.381 11.605 -24.013 1.00 0.00 O ATOM 0 H GLY A 7 14.432 12.919 -21.135 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.677 11.445 -20.777 1.00 0.00 H new ATOM 0 HA3 GLY A 7 15.297 10.908 -21.713 1.00 0.00 H new ATOM 66 N PRO A 8 18.244 11.838 -22.697 1.00 0.00 N ATOM 67 CA PRO A 8 19.176 11.870 -23.812 1.00 0.00 C ATOM 68 C PRO A 8 19.371 10.472 -24.403 1.00 0.00 C ATOM 69 O PRO A 8 20.191 9.696 -23.915 1.00 0.00 O ATOM 70 CB PRO A 8 20.455 12.456 -23.239 1.00 0.00 C ATOM 71 CG PRO A 8 20.347 12.298 -21.731 1.00 0.00 C ATOM 72 CD PRO A 8 18.903 11.960 -21.400 1.00 0.00 C ATOM 0 HA PRO A 8 18.815 12.474 -24.645 1.00 0.00 H new ATOM 0 HB2 PRO A 8 21.331 11.934 -23.625 1.00 0.00 H new ATOM 0 HB3 PRO A 8 20.562 13.505 -23.515 1.00 0.00 H new ATOM 0 HG2 PRO A 8 21.013 11.510 -21.381 1.00 0.00 H new ATOM 0 HG3 PRO A 8 20.649 13.217 -21.228 1.00 0.00 H new ATOM 0 HD2 PRO A 8 18.834 11.032 -20.832 1.00 0.00 H new ATOM 0 HD3 PRO A 8 18.443 12.740 -20.794 1.00 0.00 H new ATOM 80 N ARG A 9 18.603 10.193 -25.447 1.00 0.00 N ATOM 81 CA ARG A 9 18.681 8.903 -26.110 1.00 0.00 C ATOM 82 C ARG A 9 18.281 7.785 -25.145 1.00 0.00 C ATOM 83 O ARG A 9 18.914 7.601 -24.106 1.00 0.00 O ATOM 84 CB ARG A 9 20.095 8.636 -26.631 1.00 0.00 C ATOM 85 CG ARG A 9 20.374 9.445 -27.899 1.00 0.00 C ATOM 86 CD ARG A 9 21.536 8.842 -28.690 1.00 0.00 C ATOM 87 NE ARG A 9 22.673 9.788 -28.720 1.00 0.00 N ATOM 88 CZ ARG A 9 23.570 9.917 -27.733 1.00 0.00 C ATOM 89 NH1 ARG A 9 23.467 9.161 -26.631 1.00 0.00 N ATOM 90 NH2 ARG A 9 24.570 10.802 -27.847 1.00 0.00 N ATOM 0 H ARG A 9 17.924 10.839 -25.849 1.00 0.00 H new ATOM 0 HA ARG A 9 17.992 8.922 -26.955 1.00 0.00 H new ATOM 0 HB2 ARG A 9 20.824 8.894 -25.863 1.00 0.00 H new ATOM 0 HB3 ARG A 9 20.215 7.573 -26.840 1.00 0.00 H new ATOM 0 HG2 ARG A 9 19.480 9.471 -28.522 1.00 0.00 H new ATOM 0 HG3 ARG A 9 20.607 10.476 -27.633 1.00 0.00 H new ATOM 0 HD2 ARG A 9 21.847 7.901 -28.235 1.00 0.00 H new ATOM 0 HD3 ARG A 9 21.215 8.614 -29.706 1.00 0.00 H new ATOM 0 HE ARG A 9 22.781 10.379 -29.544 1.00 0.00 H new ATOM 0 HH11 ARG A 9 22.706 8.488 -26.544 1.00 0.00 H new ATOM 0 HH12 ARG A 9 24.150 9.259 -25.880 1.00 0.00 H new ATOM 0 HH21 ARG A 9 24.648 11.378 -28.685 1.00 0.00 H new ATOM 0 HH22 ARG A 9 25.253 10.900 -27.095 1.00 0.00 H new ATOM 104 N LEU A 10 17.233 7.068 -25.522 1.00 0.00 N ATOM 105 CA LEU A 10 16.741 5.973 -24.703 1.00 0.00 C ATOM 106 C LEU A 10 16.328 4.811 -25.608 1.00 0.00 C ATOM 107 O LEU A 10 15.591 5.003 -26.574 1.00 0.00 O ATOM 108 CB LEU A 10 15.624 6.458 -23.776 1.00 0.00 C ATOM 109 CG LEU A 10 16.054 7.378 -22.632 1.00 0.00 C ATOM 110 CD1 LEU A 10 14.845 7.843 -21.818 1.00 0.00 C ATOM 111 CD2 LEU A 10 17.111 6.705 -21.754 1.00 0.00 C ATOM 0 H LEU A 10 16.711 7.224 -26.384 1.00 0.00 H new ATOM 0 HA LEU A 10 17.529 5.603 -24.048 1.00 0.00 H new ATOM 0 HB2 LEU A 10 14.881 6.982 -24.378 1.00 0.00 H new ATOM 0 HB3 LEU A 10 15.130 5.586 -23.348 1.00 0.00 H new ATOM 0 HG LEU A 10 16.513 8.267 -23.064 1.00 0.00 H new ATOM 0 HD11 LEU A 10 15.179 8.496 -21.011 1.00 0.00 H new ATOM 0 HD12 LEU A 10 14.158 8.388 -22.465 1.00 0.00 H new ATOM 0 HD13 LEU A 10 14.335 6.977 -21.396 1.00 0.00 H new ATOM 0 HD21 LEU A 10 17.399 7.381 -20.949 1.00 0.00 H new ATOM 0 HD22 LEU A 10 16.701 5.788 -21.330 1.00 0.00 H new ATOM 0 HD23 LEU A 10 17.987 6.466 -22.357 1.00 0.00 H new ATOM 123 N TYR A 11 16.821 3.630 -25.263 1.00 0.00 N ATOM 124 CA TYR A 11 16.512 2.437 -26.032 1.00 0.00 C ATOM 125 C TYR A 11 16.708 1.175 -25.188 1.00 0.00 C ATOM 126 O TYR A 11 17.839 0.768 -24.928 1.00 0.00 O ATOM 127 CB TYR A 11 17.505 2.417 -27.196 1.00 0.00 C ATOM 128 CG TYR A 11 16.870 2.093 -28.550 1.00 0.00 C ATOM 129 CD1 TYR A 11 15.775 2.810 -28.987 1.00 0.00 C ATOM 130 CD2 TYR A 11 17.392 1.084 -29.333 1.00 0.00 C ATOM 131 CE1 TYR A 11 15.177 2.505 -30.261 1.00 0.00 C ATOM 132 CE2 TYR A 11 16.795 0.779 -30.607 1.00 0.00 C ATOM 133 CZ TYR A 11 15.716 1.505 -31.008 1.00 0.00 C ATOM 134 OH TYR A 11 15.152 1.217 -32.212 1.00 0.00 O ATOM 0 H TYR A 11 17.432 3.474 -24.461 1.00 0.00 H new ATOM 0 HA TYR A 11 15.475 2.454 -26.367 1.00 0.00 H new ATOM 0 HB2 TYR A 11 17.995 3.389 -27.259 1.00 0.00 H new ATOM 0 HB3 TYR A 11 18.282 1.682 -26.985 1.00 0.00 H new ATOM 0 HD1 TYR A 11 15.367 3.600 -28.374 1.00 0.00 H new ATOM 0 HD2 TYR A 11 18.249 0.523 -28.990 1.00 0.00 H new ATOM 0 HE1 TYR A 11 14.320 3.058 -30.615 1.00 0.00 H new ATOM 0 HE2 TYR A 11 17.194 -0.008 -31.230 1.00 0.00 H new ATOM 0 HH TYR A 11 15.642 0.481 -32.635 1.00 0.00 H new ATOM 144 N LYS A 12 15.589 0.592 -24.785 1.00 0.00 N ATOM 145 CA LYS A 12 15.623 -0.615 -23.976 1.00 0.00 C ATOM 146 C LYS A 12 14.195 -1.122 -23.764 1.00 0.00 C ATOM 147 O LYS A 12 13.306 -0.352 -23.406 1.00 0.00 O ATOM 148 CB LYS A 12 16.387 -0.366 -22.674 1.00 0.00 C ATOM 149 CG LYS A 12 15.628 0.608 -21.771 1.00 0.00 C ATOM 150 CD LYS A 12 16.495 1.820 -21.422 1.00 0.00 C ATOM 151 CE LYS A 12 15.762 2.760 -20.462 1.00 0.00 C ATOM 152 NZ LYS A 12 15.700 2.171 -19.106 1.00 0.00 N ATOM 0 H LYS A 12 14.653 0.933 -25.003 1.00 0.00 H new ATOM 0 HA LYS A 12 16.169 -1.405 -24.493 1.00 0.00 H new ATOM 0 HB2 LYS A 12 16.538 -1.310 -22.151 1.00 0.00 H new ATOM 0 HB3 LYS A 12 17.375 0.036 -22.899 1.00 0.00 H new ATOM 0 HG2 LYS A 12 14.718 0.939 -22.271 1.00 0.00 H new ATOM 0 HG3 LYS A 12 15.322 0.099 -20.857 1.00 0.00 H new ATOM 0 HD2 LYS A 12 17.428 1.486 -20.968 1.00 0.00 H new ATOM 0 HD3 LYS A 12 16.758 2.358 -22.333 1.00 0.00 H new ATOM 0 HE2 LYS A 12 16.274 3.722 -20.424 1.00 0.00 H new ATOM 0 HE3 LYS A 12 14.753 2.950 -20.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 15.339 2.880 -18.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 15.066 1.347 -19.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 16.652 1.872 -18.814 1.00 0.00 H new ATOM 166 N GLU A 13 14.021 -2.415 -23.994 1.00 0.00 N ATOM 167 CA GLU A 13 12.716 -3.034 -23.832 1.00 0.00 C ATOM 168 C GLU A 13 12.004 -2.460 -22.606 1.00 0.00 C ATOM 169 O GLU A 13 12.652 -2.015 -21.659 1.00 0.00 O ATOM 170 CB GLU A 13 12.840 -4.556 -23.732 1.00 0.00 C ATOM 171 CG GLU A 13 12.545 -5.220 -25.078 1.00 0.00 C ATOM 172 CD GLU A 13 11.892 -6.590 -24.882 1.00 0.00 C ATOM 173 OE1 GLU A 13 10.877 -6.636 -24.154 1.00 0.00 O ATOM 174 OE2 GLU A 13 12.422 -7.560 -25.466 1.00 0.00 O ATOM 0 H GLU A 13 14.761 -3.051 -24.291 1.00 0.00 H new ATOM 0 HA GLU A 13 12.117 -2.808 -24.714 1.00 0.00 H new ATOM 0 HB2 GLU A 13 13.845 -4.822 -23.404 1.00 0.00 H new ATOM 0 HB3 GLU A 13 12.149 -4.932 -22.978 1.00 0.00 H new ATOM 0 HG2 GLU A 13 11.887 -4.581 -25.667 1.00 0.00 H new ATOM 0 HG3 GLU A 13 13.470 -5.332 -25.643 1.00 0.00 H new ATOM 181 N PRO A 14 10.646 -2.489 -22.664 1.00 0.00 N ATOM 182 CA PRO A 14 9.839 -1.977 -21.569 1.00 0.00 C ATOM 183 C PRO A 14 9.844 -2.945 -20.384 1.00 0.00 C ATOM 184 O PRO A 14 10.413 -4.033 -20.469 1.00 0.00 O ATOM 185 CB PRO A 14 8.455 -1.772 -22.163 1.00 0.00 C ATOM 186 CG PRO A 14 8.418 -2.608 -23.432 1.00 0.00 C ATOM 187 CD PRO A 14 9.845 -3.009 -23.768 1.00 0.00 C ATOM 0 HA PRO A 14 10.226 -1.043 -21.163 1.00 0.00 H new ATOM 0 HB2 PRO A 14 7.680 -2.087 -21.465 1.00 0.00 H new ATOM 0 HB3 PRO A 14 8.277 -0.720 -22.383 1.00 0.00 H new ATOM 0 HG2 PRO A 14 7.797 -3.492 -23.289 1.00 0.00 H new ATOM 0 HG3 PRO A 14 7.978 -2.039 -24.251 1.00 0.00 H new ATOM 0 HD2 PRO A 14 9.943 -4.091 -23.853 1.00 0.00 H new ATOM 0 HD3 PRO A 14 10.162 -2.585 -24.721 1.00 0.00 H new ATOM 195 N SER A 15 9.203 -2.515 -19.307 1.00 0.00 N ATOM 196 CA SER A 15 9.126 -3.331 -18.107 1.00 0.00 C ATOM 197 C SER A 15 8.317 -2.604 -17.031 1.00 0.00 C ATOM 198 O SER A 15 8.883 -1.917 -16.182 1.00 0.00 O ATOM 199 CB SER A 15 10.523 -3.670 -17.582 1.00 0.00 C ATOM 200 OG SER A 15 10.708 -5.075 -17.429 1.00 0.00 O ATOM 0 H SER A 15 8.732 -1.613 -19.240 1.00 0.00 H new ATOM 0 HA SER A 15 8.625 -4.265 -18.360 1.00 0.00 H new ATOM 0 HB2 SER A 15 11.274 -3.278 -18.268 1.00 0.00 H new ATOM 0 HB3 SER A 15 10.680 -3.177 -16.623 1.00 0.00 H new ATOM 0 HG SER A 15 11.612 -5.251 -17.094 1.00 0.00 H new ATOM 206 N ALA A 16 7.006 -2.779 -17.103 1.00 0.00 N ATOM 207 CA ALA A 16 6.113 -2.148 -16.146 1.00 0.00 C ATOM 208 C ALA A 16 6.295 -0.630 -16.209 1.00 0.00 C ATOM 209 O ALA A 16 7.273 -0.142 -16.772 1.00 0.00 O ATOM 210 CB ALA A 16 6.382 -2.710 -14.749 1.00 0.00 C ATOM 0 H ALA A 16 6.540 -3.349 -17.809 1.00 0.00 H new ATOM 0 HA ALA A 16 5.073 -2.366 -16.390 1.00 0.00 H new ATOM 0 HB1 ALA A 16 5.712 -2.237 -14.031 1.00 0.00 H new ATOM 0 HB2 ALA A 16 6.210 -3.786 -14.751 1.00 0.00 H new ATOM 0 HB3 ALA A 16 7.416 -2.508 -14.468 1.00 0.00 H new ATOM 216 N LYS A 17 5.338 0.073 -15.622 1.00 0.00 N ATOM 217 CA LYS A 17 5.381 1.526 -15.604 1.00 0.00 C ATOM 218 C LYS A 17 4.219 2.055 -14.761 1.00 0.00 C ATOM 219 O LYS A 17 3.058 1.922 -15.144 1.00 0.00 O ATOM 220 CB LYS A 17 5.407 2.078 -17.031 1.00 0.00 C ATOM 221 CG LYS A 17 5.636 3.591 -17.028 1.00 0.00 C ATOM 222 CD LYS A 17 7.130 3.920 -17.056 1.00 0.00 C ATOM 223 CE LYS A 17 7.419 5.078 -18.014 1.00 0.00 C ATOM 224 NZ LYS A 17 8.706 5.724 -17.673 1.00 0.00 N ATOM 0 H LYS A 17 4.528 -0.336 -15.155 1.00 0.00 H new ATOM 0 HA LYS A 17 6.301 1.875 -15.135 1.00 0.00 H new ATOM 0 HB2 LYS A 17 6.197 1.588 -17.600 1.00 0.00 H new ATOM 0 HB3 LYS A 17 4.465 1.850 -17.531 1.00 0.00 H new ATOM 0 HG2 LYS A 17 5.145 4.038 -17.892 1.00 0.00 H new ATOM 0 HG3 LYS A 17 5.180 4.030 -16.140 1.00 0.00 H new ATOM 0 HD2 LYS A 17 7.467 4.180 -16.053 1.00 0.00 H new ATOM 0 HD3 LYS A 17 7.694 3.040 -17.364 1.00 0.00 H new ATOM 0 HE2 LYS A 17 7.451 4.710 -19.040 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.613 5.810 -17.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 8.887 6.507 -18.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 8.663 6.092 -16.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 9.474 5.027 -17.745 1.00 0.00 H new ATOM 238 N SER A 18 4.573 2.646 -13.629 1.00 0.00 N ATOM 239 CA SER A 18 3.574 3.196 -12.728 1.00 0.00 C ATOM 240 C SER A 18 2.647 2.084 -12.232 1.00 0.00 C ATOM 241 O SER A 18 2.400 1.113 -12.945 1.00 0.00 O ATOM 242 CB SER A 18 2.762 4.297 -13.413 1.00 0.00 C ATOM 243 OG SER A 18 1.623 4.676 -12.646 1.00 0.00 O ATOM 0 H SER A 18 5.537 2.756 -13.315 1.00 0.00 H new ATOM 0 HA SER A 18 4.089 3.638 -11.875 1.00 0.00 H new ATOM 0 HB2 SER A 18 3.397 5.168 -13.574 1.00 0.00 H new ATOM 0 HB3 SER A 18 2.439 3.952 -14.395 1.00 0.00 H new ATOM 0 HG SER A 18 0.861 4.826 -13.244 1.00 0.00 H new ATOM 249 N ASN A 19 2.160 2.264 -11.013 1.00 0.00 N ATOM 250 CA ASN A 19 1.266 1.288 -10.413 1.00 0.00 C ATOM 251 C ASN A 19 0.257 2.010 -9.518 1.00 0.00 C ATOM 252 O ASN A 19 -0.210 1.451 -8.527 1.00 0.00 O ATOM 253 CB ASN A 19 2.039 0.293 -9.546 1.00 0.00 C ATOM 254 CG ASN A 19 2.862 1.018 -8.479 1.00 0.00 C ATOM 255 OD1 ASN A 19 3.805 1.736 -8.768 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.453 0.791 -7.234 1.00 0.00 N ATOM 0 H ASN A 19 2.367 3.071 -10.425 1.00 0.00 H new ATOM 0 HA ASN A 19 0.764 0.751 -11.218 1.00 0.00 H new ATOM 0 HB2 ASN A 19 1.342 -0.395 -9.067 1.00 0.00 H new ATOM 0 HB3 ASN A 19 2.698 -0.306 -10.174 1.00 0.00 H new ATOM 0 HD21 ASN A 19 2.937 1.230 -6.450 1.00 0.00 H new ATOM 0 HD22 ASN A 19 1.656 0.178 -7.063 1.00 0.00 H new ATOM 263 N LYS A 20 -0.050 3.241 -9.900 1.00 0.00 N ATOM 264 CA LYS A 20 -0.995 4.045 -9.144 1.00 0.00 C ATOM 265 C LYS A 20 -2.371 3.376 -9.180 1.00 0.00 C ATOM 266 O LYS A 20 -3.005 3.198 -8.141 1.00 0.00 O ATOM 267 CB LYS A 20 -1.000 5.488 -9.655 1.00 0.00 C ATOM 268 CG LYS A 20 -2.134 6.292 -9.015 1.00 0.00 C ATOM 269 CD LYS A 20 -2.527 7.480 -9.895 1.00 0.00 C ATOM 270 CE LYS A 20 -2.358 8.801 -9.141 1.00 0.00 C ATOM 271 NZ LYS A 20 -2.643 9.947 -10.033 1.00 0.00 N ATOM 0 H LYS A 20 0.339 3.701 -10.723 1.00 0.00 H new ATOM 0 HA LYS A 20 -0.695 4.102 -8.098 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -0.043 5.960 -9.431 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -1.112 5.493 -10.739 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -2.999 5.647 -8.860 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -1.823 6.649 -8.033 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -1.912 7.490 -10.795 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -3.562 7.371 -10.218 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -3.029 8.825 -8.283 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -1.342 8.878 -8.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -2.524 10.835 -9.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -1.986 9.932 -10.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -3.620 9.880 -10.382 1.00 0.00 H new ATOM 285 N PHE A 21 -2.791 3.023 -10.385 1.00 0.00 N ATOM 286 CA PHE A 21 -4.079 2.377 -10.570 1.00 0.00 C ATOM 287 C PHE A 21 -4.134 1.042 -9.825 1.00 0.00 C ATOM 288 O PHE A 21 -5.210 0.587 -9.438 1.00 0.00 O ATOM 289 CB PHE A 21 -4.239 2.118 -12.069 1.00 0.00 C ATOM 290 CG PHE A 21 -4.743 3.327 -12.860 1.00 0.00 C ATOM 291 CD1 PHE A 21 -4.140 4.537 -12.710 1.00 0.00 C ATOM 292 CD2 PHE A 21 -5.794 3.192 -13.712 1.00 0.00 C ATOM 293 CE1 PHE A 21 -4.608 5.659 -13.443 1.00 0.00 C ATOM 294 CE2 PHE A 21 -6.262 4.314 -14.446 1.00 0.00 C ATOM 295 CZ PHE A 21 -5.659 5.524 -14.296 1.00 0.00 C ATOM 0 H PHE A 21 -2.262 3.172 -11.244 1.00 0.00 H new ATOM 0 HA PHE A 21 -4.874 3.013 -10.180 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -3.278 1.805 -12.478 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -4.932 1.289 -12.212 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -3.305 4.644 -12.033 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -6.273 2.231 -13.831 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -4.130 6.620 -13.323 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -7.096 4.207 -15.123 1.00 0.00 H new ATOM 0 HZ PHE A 21 -6.015 6.377 -14.854 1.00 0.00 H new ATOM 305 N ILE A 22 -2.962 0.451 -9.646 1.00 0.00 N ATOM 306 CA ILE A 22 -2.863 -0.822 -8.954 1.00 0.00 C ATOM 307 C ILE A 22 -3.107 -0.606 -7.459 1.00 0.00 C ATOM 308 O ILE A 22 -3.556 -1.515 -6.762 1.00 0.00 O ATOM 309 CB ILE A 22 -1.528 -1.501 -9.267 1.00 0.00 C ATOM 310 CG1 ILE A 22 -1.347 -1.684 -10.776 1.00 0.00 C ATOM 311 CG2 ILE A 22 -1.393 -2.823 -8.509 1.00 0.00 C ATOM 312 CD1 ILE A 22 0.119 -1.946 -11.124 1.00 0.00 C ATOM 0 H ILE A 22 -2.072 0.831 -9.969 1.00 0.00 H new ATOM 0 HA ILE A 22 -3.633 -1.507 -9.308 1.00 0.00 H new ATOM 0 HB ILE A 22 -0.725 -0.850 -8.922 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -1.961 -2.516 -11.121 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -1.695 -0.793 -11.298 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -0.435 -3.284 -8.750 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -1.446 -2.635 -7.437 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -2.202 -3.493 -8.800 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.220 -2.072 -12.202 1.00 0.00 H new ATOM 0 HD12 ILE A 22 0.727 -1.101 -10.799 1.00 0.00 H new ATOM 0 HD13 ILE A 22 0.457 -2.851 -10.619 1.00 0.00 H new ATOM 324 N ILE A 23 -2.800 0.602 -7.010 1.00 0.00 N ATOM 325 CA ILE A 23 -2.980 0.949 -5.611 1.00 0.00 C ATOM 326 C ILE A 23 -4.433 1.367 -5.377 1.00 0.00 C ATOM 327 O ILE A 23 -5.066 0.916 -4.423 1.00 0.00 O ATOM 328 CB ILE A 23 -1.960 2.007 -5.186 1.00 0.00 C ATOM 329 CG1 ILE A 23 -0.533 1.468 -5.293 1.00 0.00 C ATOM 330 CG2 ILE A 23 -2.270 2.535 -3.784 1.00 0.00 C ATOM 331 CD1 ILE A 23 -0.395 0.132 -4.560 1.00 0.00 C ATOM 0 H ILE A 23 -2.427 1.353 -7.591 1.00 0.00 H new ATOM 0 HA ILE A 23 -2.790 0.083 -4.976 1.00 0.00 H new ATOM 0 HB ILE A 23 -2.037 2.850 -5.872 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -0.266 1.340 -6.342 1.00 0.00 H new ATOM 0 HG13 ILE A 23 0.165 2.192 -4.872 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -1.530 3.286 -3.506 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.263 2.984 -3.776 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.238 1.712 -3.070 1.00 0.00 H new ATOM 0 HD11 ILE A 23 0.629 -0.229 -4.652 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -0.639 0.268 -3.506 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -1.077 -0.596 -4.999 1.00 0.00 H new ATOM 343 N HIS A 24 -4.920 2.222 -6.263 1.00 0.00 N ATOM 344 CA HIS A 24 -6.287 2.705 -6.165 1.00 0.00 C ATOM 345 C HIS A 24 -7.232 1.526 -5.925 1.00 0.00 C ATOM 346 O HIS A 24 -8.315 1.698 -5.367 1.00 0.00 O ATOM 347 CB HIS A 24 -6.664 3.525 -7.400 1.00 0.00 C ATOM 348 CG HIS A 24 -6.923 4.985 -7.113 1.00 0.00 C ATOM 349 ND1 HIS A 24 -8.197 5.520 -7.036 1.00 0.00 N ATOM 350 CD2 HIS A 24 -6.058 6.015 -6.885 1.00 0.00 C ATOM 351 CE1 HIS A 24 -8.092 6.814 -6.773 1.00 0.00 C ATOM 352 NE2 HIS A 24 -6.766 7.120 -6.681 1.00 0.00 N ATOM 0 H HIS A 24 -4.392 2.593 -7.053 1.00 0.00 H new ATOM 0 HA HIS A 24 -6.378 3.378 -5.313 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -5.862 3.446 -8.134 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -7.555 3.091 -7.853 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -4.980 5.944 -6.873 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -8.913 7.506 -6.653 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -6.382 8.045 -6.487 1.00 0.00 H new ATOM 360 N ASN A 25 -6.788 0.356 -6.358 1.00 0.00 N ATOM 361 CA ASN A 25 -7.580 -0.851 -6.197 1.00 0.00 C ATOM 362 C ASN A 25 -7.215 -1.524 -4.872 1.00 0.00 C ATOM 363 O ASN A 25 -8.086 -2.030 -4.167 1.00 0.00 O ATOM 364 CB ASN A 25 -7.303 -1.847 -7.325 1.00 0.00 C ATOM 365 CG ASN A 25 -8.319 -1.689 -8.458 1.00 0.00 C ATOM 366 OD1 ASN A 25 -9.464 -2.098 -8.361 1.00 0.00 O ATOM 367 ND2 ASN A 25 -7.837 -1.075 -9.535 1.00 0.00 N ATOM 0 H ASN A 25 -5.889 0.218 -6.820 1.00 0.00 H new ATOM 0 HA ASN A 25 -8.632 -0.568 -6.216 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -6.295 -1.693 -7.711 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -7.343 -2.864 -6.935 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -8.437 -0.922 -10.346 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -6.868 -0.757 -9.550 1.00 0.00 H new ATOM 374 N ALA A 26 -5.924 -1.508 -4.574 1.00 0.00 N ATOM 375 CA ALA A 26 -5.432 -2.110 -3.346 1.00 0.00 C ATOM 376 C ALA A 26 -6.165 -1.495 -2.153 1.00 0.00 C ATOM 377 O ALA A 26 -6.406 -2.170 -1.153 1.00 0.00 O ATOM 378 CB ALA A 26 -3.916 -1.924 -3.258 1.00 0.00 C ATOM 0 H ALA A 26 -5.204 -1.088 -5.161 1.00 0.00 H new ATOM 0 HA ALA A 26 -5.630 -3.182 -3.338 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -3.547 -2.375 -2.337 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.440 -2.404 -4.113 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -3.679 -0.860 -3.261 1.00 0.00 H new ATOM 384 N LEU A 27 -6.499 -0.221 -2.296 1.00 0.00 N ATOM 385 CA LEU A 27 -7.200 0.493 -1.242 1.00 0.00 C ATOM 386 C LEU A 27 -8.650 0.009 -1.182 1.00 0.00 C ATOM 387 O LEU A 27 -9.150 -0.333 -0.111 1.00 0.00 O ATOM 388 CB LEU A 27 -7.064 2.004 -1.436 1.00 0.00 C ATOM 389 CG LEU A 27 -5.645 2.525 -1.673 1.00 0.00 C ATOM 390 CD1 LEU A 27 -5.606 4.053 -1.619 1.00 0.00 C ATOM 391 CD2 LEU A 27 -4.658 1.892 -0.690 1.00 0.00 C ATOM 0 H LEU A 27 -6.297 0.336 -3.126 1.00 0.00 H new ATOM 0 HA LEU A 27 -6.751 0.278 -0.272 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -7.684 2.299 -2.283 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -7.470 2.501 -0.555 1.00 0.00 H new ATOM 0 HG LEU A 27 -5.336 2.230 -2.676 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -4.586 4.397 -1.791 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -6.261 4.461 -2.389 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -5.943 4.391 -0.639 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -3.657 2.279 -0.880 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -4.954 2.136 0.330 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -4.659 0.810 -0.819 1.00 0.00 H new ATOM 403 N SER A 28 -9.285 -0.005 -2.345 1.00 0.00 N ATOM 404 CA SER A 28 -10.668 -0.441 -2.437 1.00 0.00 C ATOM 405 C SER A 28 -10.742 -1.967 -2.353 1.00 0.00 C ATOM 406 O SER A 28 -11.828 -2.543 -2.399 1.00 0.00 O ATOM 407 CB SER A 28 -11.315 0.050 -3.734 1.00 0.00 C ATOM 408 OG SER A 28 -11.722 1.413 -3.644 1.00 0.00 O ATOM 0 H SER A 28 -8.867 0.279 -3.231 1.00 0.00 H new ATOM 0 HA SER A 28 -11.219 -0.010 -1.601 1.00 0.00 H new ATOM 0 HB2 SER A 28 -10.610 -0.064 -4.557 1.00 0.00 H new ATOM 0 HB3 SER A 28 -12.179 -0.572 -3.966 1.00 0.00 H new ATOM 0 HG SER A 28 -12.129 1.690 -4.492 1.00 0.00 H new ATOM 414 N HIS A 29 -9.573 -2.579 -2.230 1.00 0.00 N ATOM 415 CA HIS A 29 -9.491 -4.026 -2.139 1.00 0.00 C ATOM 416 C HIS A 29 -9.695 -4.461 -0.686 1.00 0.00 C ATOM 417 O HIS A 29 -10.468 -5.378 -0.411 1.00 0.00 O ATOM 418 CB HIS A 29 -8.176 -4.535 -2.731 1.00 0.00 C ATOM 419 CG HIS A 29 -8.332 -5.249 -4.052 1.00 0.00 C ATOM 420 ND1 HIS A 29 -7.719 -6.459 -4.328 1.00 0.00 N ATOM 421 CD2 HIS A 29 -9.039 -4.912 -5.169 1.00 0.00 C ATOM 422 CE1 HIS A 29 -8.048 -6.823 -5.559 1.00 0.00 C ATOM 423 NE2 HIS A 29 -8.865 -5.863 -6.079 1.00 0.00 N ATOM 0 H HIS A 29 -8.674 -2.098 -2.191 1.00 0.00 H new ATOM 0 HA HIS A 29 -10.287 -4.476 -2.732 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -7.499 -3.691 -2.864 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -7.706 -5.212 -2.017 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -9.639 -4.022 -5.292 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -7.726 -7.723 -6.062 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -9.275 -5.874 -7.013 1.00 0.00 H new ATOM 431 N CYS A 30 -8.988 -3.782 0.206 1.00 0.00 N ATOM 432 CA CYS A 30 -9.081 -4.087 1.624 1.00 0.00 C ATOM 433 C CYS A 30 -8.158 -3.131 2.382 1.00 0.00 C ATOM 434 O CYS A 30 -8.502 -2.657 3.463 1.00 0.00 O ATOM 435 CB CYS A 30 -8.747 -5.552 1.911 1.00 0.00 C ATOM 436 SG CYS A 30 -10.244 -6.435 2.482 1.00 0.00 S ATOM 0 H CYS A 30 -8.348 -3.022 -0.026 1.00 0.00 H new ATOM 0 HA CYS A 30 -10.107 -3.945 1.963 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -8.355 -6.027 1.012 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -7.967 -5.614 2.670 1.00 0.00 H new ATOM 0 HG CYS A 30 -11.132 -6.442 1.533 1.00 0.00 H new ATOM 442 N CYS A 31 -7.002 -2.878 1.785 1.00 0.00 N ATOM 443 CA CYS A 31 -6.026 -1.988 2.391 1.00 0.00 C ATOM 444 C CYS A 31 -6.774 -0.808 3.013 1.00 0.00 C ATOM 445 O CYS A 31 -6.442 -0.367 4.113 1.00 0.00 O ATOM 446 CB CYS A 31 -4.975 -1.528 1.379 1.00 0.00 C ATOM 447 SG CYS A 31 -3.927 -2.942 0.879 1.00 0.00 S ATOM 0 H CYS A 31 -6.720 -3.274 0.888 1.00 0.00 H new ATOM 0 HA CYS A 31 -5.478 -2.520 3.168 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -5.464 -1.100 0.504 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -4.357 -0.743 1.815 1.00 0.00 H new ATOM 0 HG CYS A 31 -4.361 -3.427 -0.246 1.00 0.00 H new ATOM 453 N LEU A 32 -7.771 -0.329 2.283 1.00 0.00 N ATOM 454 CA LEU A 32 -8.569 0.792 2.750 1.00 0.00 C ATOM 455 C LEU A 32 -9.984 0.678 2.180 1.00 0.00 C ATOM 456 O LEU A 32 -10.544 1.660 1.695 1.00 0.00 O ATOM 457 CB LEU A 32 -7.878 2.117 2.419 1.00 0.00 C ATOM 458 CG LEU A 32 -6.740 2.531 3.353 1.00 0.00 C ATOM 459 CD1 LEU A 32 -5.952 3.707 2.770 1.00 0.00 C ATOM 460 CD2 LEU A 32 -7.266 2.834 4.758 1.00 0.00 C ATOM 0 H LEU A 32 -8.044 -0.697 1.372 1.00 0.00 H new ATOM 0 HA LEU A 32 -8.659 0.768 3.836 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -7.485 2.055 1.404 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.629 2.907 2.422 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.049 1.693 3.442 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -5.149 3.981 3.454 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -5.527 3.419 1.808 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -6.618 4.559 2.632 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.436 3.126 5.402 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -7.990 3.647 4.708 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.747 1.945 5.166 1.00 0.00 H new ATOM 472 N ALA A 33 -10.523 -0.530 2.258 1.00 0.00 N ATOM 473 CA ALA A 33 -11.862 -0.786 1.756 1.00 0.00 C ATOM 474 C ALA A 33 -12.808 -1.021 2.935 1.00 0.00 C ATOM 475 O ALA A 33 -12.528 -1.843 3.806 1.00 0.00 O ATOM 476 CB ALA A 33 -11.828 -1.972 0.790 1.00 0.00 C ATOM 0 H ALA A 33 -10.056 -1.342 2.661 1.00 0.00 H new ATOM 0 HA ALA A 33 -12.234 0.075 1.201 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -12.833 -2.164 0.414 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -11.166 -1.743 -0.045 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -11.461 -2.856 1.312 1.00 0.00 H new ATOM 482 N GLY A 34 -13.910 -0.285 2.925 1.00 0.00 N ATOM 483 CA GLY A 34 -14.898 -0.402 3.983 1.00 0.00 C ATOM 484 C GLY A 34 -15.559 0.948 4.269 1.00 0.00 C ATOM 485 O GLY A 34 -15.326 1.921 3.554 1.00 0.00 O ATOM 0 H GLY A 34 -14.140 0.395 2.200 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -15.658 -1.129 3.697 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -14.423 -0.777 4.889 1.00 0.00 H new ATOM 489 N LYS A 35 -16.371 0.963 5.316 1.00 0.00 N ATOM 490 CA LYS A 35 -17.067 2.178 5.706 1.00 0.00 C ATOM 491 C LYS A 35 -16.179 2.988 6.652 1.00 0.00 C ATOM 492 O LYS A 35 -16.009 4.193 6.471 1.00 0.00 O ATOM 493 CB LYS A 35 -18.442 1.844 6.288 1.00 0.00 C ATOM 494 CG LYS A 35 -19.278 3.111 6.480 1.00 0.00 C ATOM 495 CD LYS A 35 -20.646 2.972 5.810 1.00 0.00 C ATOM 496 CE LYS A 35 -21.399 4.304 5.819 1.00 0.00 C ATOM 497 NZ LYS A 35 -22.675 4.183 5.078 1.00 0.00 N ATOM 0 H LYS A 35 -16.563 0.153 5.906 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.259 2.804 4.834 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -18.965 1.156 5.624 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -18.322 1.335 7.244 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -19.409 3.307 7.544 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -18.749 3.967 6.061 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -20.519 2.629 4.783 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -21.234 2.214 6.329 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -21.596 4.610 6.846 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -20.782 5.081 5.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -23.173 5.096 5.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -22.480 3.912 4.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -23.269 3.456 5.526 1.00 0.00 H new ATOM 511 N VAL A 36 -15.635 2.294 7.642 1.00 0.00 N ATOM 512 CA VAL A 36 -14.769 2.934 8.617 1.00 0.00 C ATOM 513 C VAL A 36 -13.697 3.746 7.886 1.00 0.00 C ATOM 514 O VAL A 36 -13.439 4.896 8.235 1.00 0.00 O ATOM 515 CB VAL A 36 -14.182 1.885 9.564 1.00 0.00 C ATOM 516 CG1 VAL A 36 -12.662 1.800 9.414 1.00 0.00 C ATOM 517 CG2 VAL A 36 -14.575 2.175 11.014 1.00 0.00 C ATOM 0 H VAL A 36 -15.778 1.295 7.789 1.00 0.00 H new ATOM 0 HA VAL A 36 -15.338 3.629 9.235 1.00 0.00 H new ATOM 0 HB VAL A 36 -14.600 0.916 9.291 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -12.270 1.047 10.098 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -12.412 1.524 8.389 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -12.219 2.768 9.647 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -14.145 1.415 11.666 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -14.199 3.156 11.303 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -15.661 2.161 11.106 1.00 0.00 H new ATOM 527 N ASN A 37 -13.102 3.114 6.885 1.00 0.00 N ATOM 528 CA ASN A 37 -12.064 3.762 6.102 1.00 0.00 C ATOM 529 C ASN A 37 -12.698 4.442 4.886 1.00 0.00 C ATOM 530 O ASN A 37 -12.091 4.503 3.818 1.00 0.00 O ATOM 531 CB ASN A 37 -11.040 2.745 5.594 1.00 0.00 C ATOM 532 CG ASN A 37 -10.050 2.367 6.698 1.00 0.00 C ATOM 533 OD1 ASN A 37 -9.620 3.189 7.490 1.00 0.00 O ATOM 534 ND2 ASN A 37 -9.714 1.081 6.705 1.00 0.00 N ATOM 0 H ASN A 37 -13.319 2.160 6.598 1.00 0.00 H new ATOM 0 HA ASN A 37 -11.563 4.488 6.742 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -11.554 1.852 5.240 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -10.500 3.161 4.743 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -9.059 0.729 7.403 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -10.112 0.446 6.013 1.00 0.00 H new ATOM 541 N GLU A 38 -13.911 4.935 5.090 1.00 0.00 N ATOM 542 CA GLU A 38 -14.634 5.608 4.023 1.00 0.00 C ATOM 543 C GLU A 38 -14.137 7.047 3.871 1.00 0.00 C ATOM 544 O GLU A 38 -13.963 7.533 2.755 1.00 0.00 O ATOM 545 CB GLU A 38 -16.142 5.572 4.276 1.00 0.00 C ATOM 546 CG GLU A 38 -16.899 6.331 3.185 1.00 0.00 C ATOM 547 CD GLU A 38 -18.152 7.002 3.752 1.00 0.00 C ATOM 548 OE1 GLU A 38 -19.124 6.261 4.012 1.00 0.00 O ATOM 549 OE2 GLU A 38 -18.108 8.241 3.911 1.00 0.00 O ATOM 0 H GLU A 38 -14.411 4.882 5.977 1.00 0.00 H new ATOM 0 HA GLU A 38 -14.443 5.078 3.090 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -16.484 4.538 4.309 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -16.362 6.011 5.249 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -16.247 7.084 2.742 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -17.180 5.644 2.387 1.00 0.00 H new ATOM 556 N PRO A 39 -13.918 7.706 5.041 1.00 0.00 N ATOM 557 CA PRO A 39 -13.446 9.080 5.048 1.00 0.00 C ATOM 558 C PRO A 39 -11.960 9.151 4.690 1.00 0.00 C ATOM 559 O PRO A 39 -11.536 10.042 3.957 1.00 0.00 O ATOM 560 CB PRO A 39 -13.744 9.591 6.449 1.00 0.00 C ATOM 561 CG PRO A 39 -13.944 8.354 7.310 1.00 0.00 C ATOM 562 CD PRO A 39 -14.114 7.163 6.382 1.00 0.00 C ATOM 0 HA PRO A 39 -13.940 9.698 4.299 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -12.922 10.200 6.826 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -14.635 10.219 6.454 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -13.089 8.205 7.969 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -14.821 8.470 7.947 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -13.387 6.382 6.603 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -15.103 6.717 6.488 1.00 0.00 H new ATOM 570 N GLN A 40 -11.209 8.199 5.225 1.00 0.00 N ATOM 571 CA GLN A 40 -9.780 8.142 4.971 1.00 0.00 C ATOM 572 C GLN A 40 -9.514 7.726 3.523 1.00 0.00 C ATOM 573 O GLN A 40 -8.837 8.439 2.783 1.00 0.00 O ATOM 574 CB GLN A 40 -9.086 7.192 5.950 1.00 0.00 C ATOM 575 CG GLN A 40 -7.766 6.676 5.372 1.00 0.00 C ATOM 576 CD GLN A 40 -6.696 6.572 6.460 1.00 0.00 C ATOM 577 OE1 GLN A 40 -6.778 7.188 7.510 1.00 0.00 O ATOM 578 NE2 GLN A 40 -5.689 5.759 6.152 1.00 0.00 N ATOM 0 H GLN A 40 -11.564 7.461 5.833 1.00 0.00 H new ATOM 0 HA GLN A 40 -9.364 9.138 5.125 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -8.898 7.708 6.891 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -9.743 6.351 6.173 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -7.922 5.699 4.915 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -7.424 7.346 4.583 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -5.682 5.273 5.255 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -4.924 5.621 6.813 1.00 0.00 H new ATOM 587 N LYS A 41 -10.061 6.575 3.161 1.00 0.00 N ATOM 588 CA LYS A 41 -9.891 6.056 1.815 1.00 0.00 C ATOM 589 C LYS A 41 -9.936 7.215 0.817 1.00 0.00 C ATOM 590 O LYS A 41 -9.061 7.337 -0.039 1.00 0.00 O ATOM 591 CB LYS A 41 -10.919 4.959 1.529 1.00 0.00 C ATOM 592 CG LYS A 41 -10.883 4.543 0.058 1.00 0.00 C ATOM 593 CD LYS A 41 -12.069 3.640 -0.286 1.00 0.00 C ATOM 594 CE LYS A 41 -13.383 4.248 0.210 1.00 0.00 C ATOM 595 NZ LYS A 41 -14.530 3.679 -0.533 1.00 0.00 N ATOM 0 H LYS A 41 -10.623 5.987 3.777 1.00 0.00 H new ATOM 0 HA LYS A 41 -8.915 5.581 1.711 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -10.717 4.094 2.160 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -11.917 5.315 1.785 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.901 5.430 -0.575 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -9.950 4.020 -0.153 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -12.117 3.492 -1.365 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -11.926 2.658 0.165 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -13.501 4.054 1.276 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -13.361 5.330 0.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -15.414 4.102 -0.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -14.424 3.885 -1.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -14.559 2.649 -0.391 1.00 0.00 H new ATOM 609 N ASN A 42 -10.965 8.037 0.960 1.00 0.00 N ATOM 610 CA ASN A 42 -11.136 9.183 0.082 1.00 0.00 C ATOM 611 C ASN A 42 -9.898 10.078 0.172 1.00 0.00 C ATOM 612 O ASN A 42 -9.349 10.488 -0.849 1.00 0.00 O ATOM 613 CB ASN A 42 -12.352 10.015 0.492 1.00 0.00 C ATOM 614 CG ASN A 42 -13.622 9.501 -0.188 1.00 0.00 C ATOM 615 OD1 ASN A 42 -13.911 9.805 -1.334 1.00 0.00 O ATOM 616 ND2 ASN A 42 -14.364 8.707 0.579 1.00 0.00 N ATOM 0 H ASN A 42 -11.689 7.933 1.671 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.279 8.812 -0.933 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -12.474 9.978 1.574 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -12.189 11.059 0.225 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -15.232 8.313 0.216 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -14.065 8.492 1.530 1.00 0.00 H new ATOM 623 N ARG A 43 -9.495 10.354 1.404 1.00 0.00 N ATOM 624 CA ARG A 43 -8.333 11.193 1.641 1.00 0.00 C ATOM 625 C ARG A 43 -7.119 10.643 0.888 1.00 0.00 C ATOM 626 O ARG A 43 -6.297 11.408 0.386 1.00 0.00 O ATOM 627 CB ARG A 43 -8.006 11.272 3.133 1.00 0.00 C ATOM 628 CG ARG A 43 -9.042 12.117 3.877 1.00 0.00 C ATOM 629 CD ARG A 43 -8.418 13.409 4.408 1.00 0.00 C ATOM 630 NE ARG A 43 -9.435 14.202 5.132 1.00 0.00 N ATOM 631 CZ ARG A 43 -9.736 14.036 6.428 1.00 0.00 C ATOM 632 NH1 ARG A 43 -9.100 13.103 7.149 1.00 0.00 N ATOM 633 NH2 ARG A 43 -10.674 14.802 7.001 1.00 0.00 N ATOM 0 H ARG A 43 -9.953 10.011 2.249 1.00 0.00 H new ATOM 0 HA ARG A 43 -8.567 12.194 1.279 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -7.978 10.268 3.557 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -7.014 11.703 3.269 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -9.869 12.357 3.208 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -9.458 11.543 4.705 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -7.587 13.174 5.073 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -8.011 13.992 3.582 1.00 0.00 H new ATOM 0 HE ARG A 43 -9.939 14.921 4.613 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -8.387 12.519 6.712 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -9.329 12.977 8.135 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -11.159 15.511 6.451 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -10.903 14.676 7.987 1.00 0.00 H new ATOM 647 N ILE A 44 -7.046 9.321 0.834 1.00 0.00 N ATOM 648 CA ILE A 44 -5.946 8.660 0.152 1.00 0.00 C ATOM 649 C ILE A 44 -6.152 8.768 -1.360 1.00 0.00 C ATOM 650 O ILE A 44 -5.229 9.125 -2.092 1.00 0.00 O ATOM 651 CB ILE A 44 -5.794 7.222 0.650 1.00 0.00 C ATOM 652 CG1 ILE A 44 -6.074 7.129 2.152 1.00 0.00 C ATOM 653 CG2 ILE A 44 -4.418 6.659 0.288 1.00 0.00 C ATOM 654 CD1 ILE A 44 -5.314 8.212 2.919 1.00 0.00 C ATOM 0 H ILE A 44 -7.730 8.690 1.251 1.00 0.00 H new ATOM 0 HA ILE A 44 -5.002 9.154 0.382 1.00 0.00 H new ATOM 0 HB ILE A 44 -6.538 6.605 0.145 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -7.144 7.233 2.333 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -5.782 6.145 2.520 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -4.336 5.635 0.654 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.294 6.669 -0.795 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -3.642 7.271 0.747 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -5.530 8.124 3.984 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -4.243 8.091 2.755 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -5.626 9.195 2.566 1.00 0.00 H new ATOM 666 N LEU A 45 -7.367 8.453 -1.784 1.00 0.00 N ATOM 667 CA LEU A 45 -7.705 8.511 -3.196 1.00 0.00 C ATOM 668 C LEU A 45 -7.348 9.894 -3.746 1.00 0.00 C ATOM 669 O LEU A 45 -6.788 10.007 -4.835 1.00 0.00 O ATOM 670 CB LEU A 45 -9.169 8.122 -3.413 1.00 0.00 C ATOM 671 CG LEU A 45 -9.552 6.698 -3.007 1.00 0.00 C ATOM 672 CD1 LEU A 45 -11.061 6.577 -2.788 1.00 0.00 C ATOM 673 CD2 LEU A 45 -9.037 5.679 -4.026 1.00 0.00 C ATOM 0 H LEU A 45 -8.129 8.157 -1.175 1.00 0.00 H new ATOM 0 HA LEU A 45 -7.119 7.783 -3.758 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -9.796 8.818 -2.856 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -9.407 8.254 -4.469 1.00 0.00 H new ATOM 0 HG LEU A 45 -9.070 6.473 -2.056 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -11.306 5.555 -2.500 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -11.370 7.261 -1.997 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -11.584 6.830 -3.710 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -9.323 4.675 -3.713 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -9.470 5.891 -5.004 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -7.951 5.744 -4.088 1.00 0.00 H new ATOM 685 N GLU A 46 -7.687 10.910 -2.967 1.00 0.00 N ATOM 686 CA GLU A 46 -7.410 12.281 -3.362 1.00 0.00 C ATOM 687 C GLU A 46 -5.900 12.530 -3.389 1.00 0.00 C ATOM 688 O GLU A 46 -5.336 12.828 -4.440 1.00 0.00 O ATOM 689 CB GLU A 46 -8.113 13.272 -2.433 1.00 0.00 C ATOM 690 CG GLU A 46 -9.574 12.876 -2.213 1.00 0.00 C ATOM 691 CD GLU A 46 -10.521 13.909 -2.827 1.00 0.00 C ATOM 692 OE1 GLU A 46 -10.467 14.063 -4.066 1.00 0.00 O ATOM 693 OE2 GLU A 46 -11.278 14.522 -2.043 1.00 0.00 O ATOM 0 H GLU A 46 -8.151 10.812 -2.064 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.802 12.436 -4.367 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.594 13.309 -1.475 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.064 14.274 -2.860 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.760 11.898 -2.657 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -9.773 12.785 -1.145 1.00 0.00 H new ATOM 700 N GLU A 47 -5.290 12.399 -2.220 1.00 0.00 N ATOM 701 CA GLU A 47 -3.858 12.606 -2.097 1.00 0.00 C ATOM 702 C GLU A 47 -3.128 12.000 -3.297 1.00 0.00 C ATOM 703 O GLU A 47 -2.240 12.629 -3.871 1.00 0.00 O ATOM 704 CB GLU A 47 -3.331 12.024 -0.784 1.00 0.00 C ATOM 705 CG GLU A 47 -3.832 12.832 0.415 1.00 0.00 C ATOM 706 CD GLU A 47 -2.898 14.007 0.712 1.00 0.00 C ATOM 707 OE1 GLU A 47 -1.674 13.816 0.546 1.00 0.00 O ATOM 708 OE2 GLU A 47 -3.430 15.070 1.099 1.00 0.00 O ATOM 0 H GLU A 47 -5.762 12.152 -1.350 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.666 13.679 -2.084 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -3.652 10.987 -0.687 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.241 12.021 -0.795 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -4.837 13.203 0.214 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.900 12.186 1.291 1.00 0.00 H new ATOM 715 N ILE A 48 -3.530 10.786 -3.642 1.00 0.00 N ATOM 716 CA ILE A 48 -2.925 10.088 -4.764 1.00 0.00 C ATOM 717 C ILE A 48 -3.190 10.873 -6.050 1.00 0.00 C ATOM 718 O ILE A 48 -2.276 11.103 -6.841 1.00 0.00 O ATOM 719 CB ILE A 48 -3.411 8.638 -4.818 1.00 0.00 C ATOM 720 CG1 ILE A 48 -3.092 7.904 -3.513 1.00 0.00 C ATOM 721 CG2 ILE A 48 -2.839 7.913 -6.037 1.00 0.00 C ATOM 722 CD1 ILE A 48 -4.037 6.719 -3.305 1.00 0.00 C ATOM 0 H ILE A 48 -4.267 10.268 -3.165 1.00 0.00 H new ATOM 0 HA ILE A 48 -1.843 10.033 -4.640 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.495 8.645 -4.927 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -2.061 7.552 -3.532 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -3.178 8.594 -2.673 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.200 6.885 -6.051 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -3.158 8.422 -6.946 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -1.750 7.915 -5.984 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -3.789 6.215 -2.371 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -5.066 7.077 -3.262 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -3.931 6.019 -4.134 1.00 0.00 H new ATOM 734 N GLU A 49 -4.445 11.262 -6.220 1.00 0.00 N ATOM 735 CA GLU A 49 -4.842 12.017 -7.396 1.00 0.00 C ATOM 736 C GLU A 49 -4.153 13.383 -7.409 1.00 0.00 C ATOM 737 O GLU A 49 -3.852 13.921 -8.473 1.00 0.00 O ATOM 738 CB GLU A 49 -6.363 12.170 -7.463 1.00 0.00 C ATOM 739 CG GLU A 49 -7.039 10.821 -7.720 1.00 0.00 C ATOM 740 CD GLU A 49 -8.005 10.909 -8.903 1.00 0.00 C ATOM 741 OE1 GLU A 49 -7.553 11.374 -9.972 1.00 0.00 O ATOM 742 OE2 GLU A 49 -9.174 10.510 -8.712 1.00 0.00 O ATOM 0 H GLU A 49 -5.200 11.068 -5.563 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.526 11.464 -8.281 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -6.731 12.593 -6.528 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -6.627 12.870 -8.256 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -6.282 10.063 -7.920 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -7.579 10.505 -6.828 1.00 0.00 H new ATOM 749 N LYS A 50 -3.924 13.905 -6.213 1.00 0.00 N ATOM 750 CA LYS A 50 -3.275 15.198 -6.072 1.00 0.00 C ATOM 751 C LYS A 50 -1.767 15.031 -6.269 1.00 0.00 C ATOM 752 O LYS A 50 -1.111 15.905 -6.835 1.00 0.00 O ATOM 753 CB LYS A 50 -3.654 15.845 -4.739 1.00 0.00 C ATOM 754 CG LYS A 50 -2.467 15.846 -3.773 1.00 0.00 C ATOM 755 CD LYS A 50 -2.873 16.400 -2.406 1.00 0.00 C ATOM 756 CE LYS A 50 -3.712 17.670 -2.556 1.00 0.00 C ATOM 757 NZ LYS A 50 -3.481 18.582 -1.414 1.00 0.00 N ATOM 0 H LYS A 50 -4.176 13.456 -5.332 1.00 0.00 H new ATOM 0 HA LYS A 50 -3.623 15.885 -6.843 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -3.990 16.868 -4.910 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -4.490 15.305 -4.293 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -2.085 14.831 -3.659 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -1.657 16.447 -4.187 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -3.441 15.647 -1.859 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -1.981 16.616 -1.818 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -3.457 18.173 -3.488 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -4.769 17.410 -2.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -4.058 19.439 -1.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -3.747 18.105 -0.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -2.475 18.844 -1.377 1.00 0.00 H new ATOM 771 N SER A 51 -1.261 13.904 -5.791 1.00 0.00 N ATOM 772 CA SER A 51 0.158 13.613 -5.907 1.00 0.00 C ATOM 773 C SER A 51 0.546 13.483 -7.381 1.00 0.00 C ATOM 774 O SER A 51 -0.163 12.848 -8.160 1.00 0.00 O ATOM 775 CB SER A 51 0.521 12.334 -5.148 1.00 0.00 C ATOM 776 OG SER A 51 1.931 12.164 -5.033 1.00 0.00 O ATOM 0 H SER A 51 -1.808 13.182 -5.323 1.00 0.00 H new ATOM 0 HA SER A 51 0.715 14.438 -5.463 1.00 0.00 H new ATOM 0 HB2 SER A 51 0.077 12.364 -4.153 1.00 0.00 H new ATOM 0 HB3 SER A 51 0.093 11.473 -5.662 1.00 0.00 H new ATOM 0 HG SER A 51 2.237 12.540 -4.182 1.00 0.00 H new ATOM 782 N LYS A 52 1.672 14.096 -7.719 1.00 0.00 N ATOM 783 CA LYS A 52 2.163 14.057 -9.086 1.00 0.00 C ATOM 784 C LYS A 52 3.201 12.941 -9.219 1.00 0.00 C ATOM 785 O LYS A 52 4.147 13.057 -9.996 1.00 0.00 O ATOM 786 CB LYS A 52 2.682 15.433 -9.508 1.00 0.00 C ATOM 787 CG LYS A 52 1.673 16.148 -10.408 1.00 0.00 C ATOM 788 CD LYS A 52 1.688 15.563 -11.821 1.00 0.00 C ATOM 789 CE LYS A 52 0.266 15.293 -12.319 1.00 0.00 C ATOM 790 NZ LYS A 52 0.107 15.765 -13.713 1.00 0.00 N ATOM 0 H LYS A 52 2.257 14.622 -7.070 1.00 0.00 H new ATOM 0 HA LYS A 52 1.352 13.822 -9.776 1.00 0.00 H new ATOM 0 HB2 LYS A 52 2.878 16.038 -8.623 1.00 0.00 H new ATOM 0 HB3 LYS A 52 3.630 15.322 -10.035 1.00 0.00 H new ATOM 0 HG2 LYS A 52 0.673 16.057 -9.983 1.00 0.00 H new ATOM 0 HG3 LYS A 52 1.906 17.212 -10.449 1.00 0.00 H new ATOM 0 HD2 LYS A 52 2.189 16.254 -12.499 1.00 0.00 H new ATOM 0 HD3 LYS A 52 2.262 14.636 -11.829 1.00 0.00 H new ATOM 0 HE2 LYS A 52 0.051 14.226 -12.263 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -0.454 15.797 -11.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -0.863 15.574 -14.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 0.292 16.788 -13.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.781 15.265 -14.328 1.00 0.00 H new ATOM 804 N ALA A 53 2.988 11.884 -8.449 1.00 0.00 N ATOM 805 CA ALA A 53 3.894 10.748 -8.470 1.00 0.00 C ATOM 806 C ALA A 53 3.128 9.499 -8.914 1.00 0.00 C ATOM 807 O ALA A 53 2.027 9.238 -8.430 1.00 0.00 O ATOM 808 CB ALA A 53 4.535 10.579 -7.092 1.00 0.00 C ATOM 0 H ALA A 53 2.201 11.790 -7.807 1.00 0.00 H new ATOM 0 HA ALA A 53 4.700 10.913 -9.185 1.00 0.00 H new ATOM 0 HB1 ALA A 53 5.214 9.727 -7.109 1.00 0.00 H new ATOM 0 HB2 ALA A 53 5.091 11.481 -6.836 1.00 0.00 H new ATOM 0 HB3 ALA A 53 3.757 10.409 -6.347 1.00 0.00 H new ATOM 814 N ASN A 54 3.740 8.762 -9.828 1.00 0.00 N ATOM 815 CA ASN A 54 3.130 7.547 -10.342 1.00 0.00 C ATOM 816 C ASN A 54 3.622 6.350 -9.526 1.00 0.00 C ATOM 817 O ASN A 54 3.656 5.226 -10.025 1.00 0.00 O ATOM 818 CB ASN A 54 3.514 7.313 -11.804 1.00 0.00 C ATOM 819 CG ASN A 54 2.362 7.682 -12.740 1.00 0.00 C ATOM 820 OD1 ASN A 54 2.528 8.380 -13.727 1.00 0.00 O ATOM 821 ND2 ASN A 54 1.187 7.176 -12.377 1.00 0.00 N ATOM 0 H ASN A 54 4.653 8.982 -10.227 1.00 0.00 H new ATOM 0 HA ASN A 54 2.048 7.655 -10.267 1.00 0.00 H new ATOM 0 HB2 ASN A 54 4.393 7.907 -12.052 1.00 0.00 H new ATOM 0 HB3 ASN A 54 3.785 6.267 -11.950 1.00 0.00 H new ATOM 0 HD21 ASN A 54 0.356 7.365 -12.937 1.00 0.00 H new ATOM 0 HD22 ASN A 54 1.117 6.599 -11.539 1.00 0.00 H new ATOM 828 N HIS A 55 3.991 6.632 -8.285 1.00 0.00 N ATOM 829 CA HIS A 55 4.480 5.592 -7.396 1.00 0.00 C ATOM 830 C HIS A 55 3.843 5.757 -6.014 1.00 0.00 C ATOM 831 O HIS A 55 3.909 6.833 -5.421 1.00 0.00 O ATOM 832 CB HIS A 55 6.009 5.593 -7.347 1.00 0.00 C ATOM 833 CG HIS A 55 6.617 4.231 -7.111 1.00 0.00 C ATOM 834 ND1 HIS A 55 7.931 3.932 -7.423 1.00 0.00 N ATOM 835 CD2 HIS A 55 6.076 3.092 -6.589 1.00 0.00 C ATOM 836 CE1 HIS A 55 8.161 2.667 -7.101 1.00 0.00 C ATOM 837 NE2 HIS A 55 7.010 2.149 -6.584 1.00 0.00 N ATOM 0 H HIS A 55 3.961 7.565 -7.874 1.00 0.00 H new ATOM 0 HA HIS A 55 4.187 4.614 -7.779 1.00 0.00 H new ATOM 0 HB2 HIS A 55 6.392 5.993 -8.286 1.00 0.00 H new ATOM 0 HB3 HIS A 55 6.336 6.268 -6.556 1.00 0.00 H new ATOM 0 HD2 HIS A 55 5.061 2.977 -6.239 1.00 0.00 H new ATOM 0 HE1 HIS A 55 9.095 2.139 -7.226 1.00 0.00 H new ATOM 0 HE2 HIS A 55 6.887 1.194 -6.249 1.00 0.00 H new ATOM 845 N PHE A 56 3.241 4.676 -5.542 1.00 0.00 N ATOM 846 CA PHE A 56 2.592 4.687 -4.242 1.00 0.00 C ATOM 847 C PHE A 56 2.743 3.335 -3.542 1.00 0.00 C ATOM 848 O PHE A 56 2.267 2.317 -4.041 1.00 0.00 O ATOM 849 CB PHE A 56 1.106 4.959 -4.486 1.00 0.00 C ATOM 850 CG PHE A 56 0.823 6.291 -5.181 1.00 0.00 C ATOM 851 CD1 PHE A 56 0.800 7.444 -4.459 1.00 0.00 C ATOM 852 CD2 PHE A 56 0.595 6.324 -6.522 1.00 0.00 C ATOM 853 CE1 PHE A 56 0.537 8.681 -5.105 1.00 0.00 C ATOM 854 CE2 PHE A 56 0.332 7.561 -7.167 1.00 0.00 C ATOM 855 CZ PHE A 56 0.308 8.713 -6.445 1.00 0.00 C ATOM 0 H PHE A 56 3.189 3.786 -6.037 1.00 0.00 H new ATOM 0 HA PHE A 56 3.046 5.447 -3.606 1.00 0.00 H new ATOM 0 HB2 PHE A 56 0.694 4.151 -5.090 1.00 0.00 H new ATOM 0 HB3 PHE A 56 0.582 4.941 -3.530 1.00 0.00 H new ATOM 0 HD1 PHE A 56 0.982 7.418 -3.395 1.00 0.00 H new ATOM 0 HD2 PHE A 56 0.614 5.409 -7.096 1.00 0.00 H new ATOM 0 HE1 PHE A 56 0.519 9.596 -4.532 1.00 0.00 H new ATOM 0 HE2 PHE A 56 0.151 7.587 -8.231 1.00 0.00 H new ATOM 0 HZ PHE A 56 0.107 9.654 -6.936 1.00 0.00 H new ATOM 865 N LEU A 57 3.409 3.369 -2.397 1.00 0.00 N ATOM 866 CA LEU A 57 3.629 2.159 -1.623 1.00 0.00 C ATOM 867 C LEU A 57 2.748 2.191 -0.372 1.00 0.00 C ATOM 868 O LEU A 57 2.412 3.264 0.127 1.00 0.00 O ATOM 869 CB LEU A 57 5.118 1.978 -1.322 1.00 0.00 C ATOM 870 CG LEU A 57 6.007 1.630 -2.518 1.00 0.00 C ATOM 871 CD1 LEU A 57 6.458 2.895 -3.252 1.00 0.00 C ATOM 872 CD2 LEU A 57 7.191 0.764 -2.087 1.00 0.00 C ATOM 0 H LEU A 57 3.803 4.215 -1.987 1.00 0.00 H new ATOM 0 HA LEU A 57 3.335 1.281 -2.198 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.492 2.898 -0.872 1.00 0.00 H new ATOM 0 HB3 LEU A 57 5.224 1.192 -0.575 1.00 0.00 H new ATOM 0 HG LEU A 57 5.418 1.042 -3.222 1.00 0.00 H new ATOM 0 HD11 LEU A 57 7.088 2.620 -4.098 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.584 3.438 -3.612 1.00 0.00 H new ATOM 0 HD13 LEU A 57 7.023 3.530 -2.570 1.00 0.00 H new ATOM 0 HD21 LEU A 57 7.807 0.531 -2.956 1.00 0.00 H new ATOM 0 HD22 LEU A 57 7.789 1.304 -1.353 1.00 0.00 H new ATOM 0 HD23 LEU A 57 6.823 -0.162 -1.645 1.00 0.00 H new ATOM 884 N ILE A 58 2.399 1.003 0.098 1.00 0.00 N ATOM 885 CA ILE A 58 1.564 0.881 1.281 1.00 0.00 C ATOM 886 C ILE A 58 2.436 0.496 2.478 1.00 0.00 C ATOM 887 O ILE A 58 3.227 -0.443 2.398 1.00 0.00 O ATOM 888 CB ILE A 58 0.409 -0.088 1.024 1.00 0.00 C ATOM 889 CG1 ILE A 58 -0.682 0.570 0.177 1.00 0.00 C ATOM 890 CG2 ILE A 58 -0.143 -0.644 2.339 1.00 0.00 C ATOM 891 CD1 ILE A 58 -1.130 -0.355 -0.955 1.00 0.00 C ATOM 0 H ILE A 58 2.679 0.115 -0.319 1.00 0.00 H new ATOM 0 HA ILE A 58 1.099 1.838 1.520 1.00 0.00 H new ATOM 0 HB ILE A 58 0.793 -0.933 0.453 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.536 0.819 0.807 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -0.309 1.506 -0.239 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -0.963 -1.330 2.128 1.00 0.00 H new ATOM 0 HG22 ILE A 58 0.647 -1.175 2.870 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.507 0.177 2.957 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -1.906 0.137 -1.541 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -0.279 -0.583 -1.597 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -1.525 -1.280 -0.534 1.00 0.00 H new ATOM 903 N LEU A 59 2.262 1.241 3.560 1.00 0.00 N ATOM 904 CA LEU A 59 3.023 0.989 4.772 1.00 0.00 C ATOM 905 C LEU A 59 2.234 0.041 5.677 1.00 0.00 C ATOM 906 O LEU A 59 1.131 0.368 6.113 1.00 0.00 O ATOM 907 CB LEU A 59 3.406 2.307 5.447 1.00 0.00 C ATOM 908 CG LEU A 59 4.277 2.191 6.700 1.00 0.00 C ATOM 909 CD1 LEU A 59 5.692 1.733 6.344 1.00 0.00 C ATOM 910 CD2 LEU A 59 4.279 3.501 7.490 1.00 0.00 C ATOM 0 H LEU A 59 1.605 2.019 3.623 1.00 0.00 H new ATOM 0 HA LEU A 59 3.964 0.493 4.535 1.00 0.00 H new ATOM 0 HB2 LEU A 59 3.931 2.926 4.719 1.00 0.00 H new ATOM 0 HB3 LEU A 59 2.491 2.836 5.713 1.00 0.00 H new ATOM 0 HG LEU A 59 3.845 1.427 7.346 1.00 0.00 H new ATOM 0 HD11 LEU A 59 6.290 1.659 7.252 1.00 0.00 H new ATOM 0 HD12 LEU A 59 5.648 0.758 5.858 1.00 0.00 H new ATOM 0 HD13 LEU A 59 6.149 2.455 5.667 1.00 0.00 H new ATOM 0 HD21 LEU A 59 4.905 3.391 8.375 1.00 0.00 H new ATOM 0 HD22 LEU A 59 4.672 4.302 6.865 1.00 0.00 H new ATOM 0 HD23 LEU A 59 3.261 3.744 7.794 1.00 0.00 H new ATOM 922 N PHE A 60 2.829 -1.114 5.932 1.00 0.00 N ATOM 923 CA PHE A 60 2.196 -2.112 6.778 1.00 0.00 C ATOM 924 C PHE A 60 2.794 -2.098 8.186 1.00 0.00 C ATOM 925 O PHE A 60 3.613 -1.238 8.507 1.00 0.00 O ATOM 926 CB PHE A 60 2.462 -3.476 6.137 1.00 0.00 C ATOM 927 CG PHE A 60 1.684 -3.718 4.843 1.00 0.00 C ATOM 928 CD1 PHE A 60 0.331 -3.856 4.878 1.00 0.00 C ATOM 929 CD2 PHE A 60 2.344 -3.796 3.656 1.00 0.00 C ATOM 930 CE1 PHE A 60 -0.392 -4.081 3.677 1.00 0.00 C ATOM 931 CE2 PHE A 60 1.621 -4.021 2.455 1.00 0.00 C ATOM 932 CZ PHE A 60 0.269 -4.159 2.491 1.00 0.00 C ATOM 0 H PHE A 60 3.743 -1.382 5.568 1.00 0.00 H new ATOM 0 HA PHE A 60 1.130 -1.904 6.864 1.00 0.00 H new ATOM 0 HB2 PHE A 60 3.528 -3.567 5.930 1.00 0.00 H new ATOM 0 HB3 PHE A 60 2.208 -4.258 6.853 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -0.193 -3.794 5.820 1.00 0.00 H new ATOM 0 HD2 PHE A 60 3.418 -3.687 3.627 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -1.466 -4.190 3.705 1.00 0.00 H new ATOM 0 HE2 PHE A 60 2.145 -4.083 1.513 1.00 0.00 H new ATOM 0 HZ PHE A 60 -0.280 -4.331 1.577 1.00 0.00 H new ATOM 942 N ARG A 61 2.361 -3.059 8.988 1.00 0.00 N ATOM 943 CA ARG A 61 2.843 -3.168 10.354 1.00 0.00 C ATOM 944 C ARG A 61 4.102 -4.036 10.405 1.00 0.00 C ATOM 945 O ARG A 61 4.877 -3.957 11.357 1.00 0.00 O ATOM 946 CB ARG A 61 1.777 -3.774 11.268 1.00 0.00 C ATOM 947 CG ARG A 61 0.935 -2.681 11.929 1.00 0.00 C ATOM 948 CD ARG A 61 1.337 -2.490 13.393 1.00 0.00 C ATOM 949 NE ARG A 61 0.252 -2.964 14.282 1.00 0.00 N ATOM 950 CZ ARG A 61 -0.816 -2.229 14.622 1.00 0.00 C ATOM 951 NH1 ARG A 61 -0.948 -0.981 14.150 1.00 0.00 N ATOM 952 NH2 ARG A 61 -1.751 -2.741 15.433 1.00 0.00 N ATOM 0 H ARG A 61 1.681 -3.770 8.718 1.00 0.00 H new ATOM 0 HA ARG A 61 3.076 -2.162 10.704 1.00 0.00 H new ATOM 0 HB2 ARG A 61 1.132 -4.436 10.691 1.00 0.00 H new ATOM 0 HB3 ARG A 61 2.255 -4.384 12.035 1.00 0.00 H new ATOM 0 HG2 ARG A 61 1.061 -1.743 11.388 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -0.121 -2.944 11.869 1.00 0.00 H new ATOM 0 HD2 ARG A 61 2.255 -3.039 13.601 1.00 0.00 H new ATOM 0 HD3 ARG A 61 1.544 -1.438 13.588 1.00 0.00 H new ATOM 0 HE ARG A 61 0.322 -3.909 14.659 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -0.236 -0.591 13.532 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -1.761 -0.421 14.408 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -1.650 -3.690 15.792 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -2.564 -2.181 15.692 1.00 0.00 H new ATOM 966 N ASP A 62 4.267 -4.845 9.369 1.00 0.00 N ATOM 967 CA ASP A 62 5.419 -5.727 9.283 1.00 0.00 C ATOM 968 C ASP A 62 5.549 -6.251 7.852 1.00 0.00 C ATOM 969 O ASP A 62 6.597 -6.102 7.226 1.00 0.00 O ATOM 970 CB ASP A 62 5.261 -6.930 10.215 1.00 0.00 C ATOM 971 CG ASP A 62 6.561 -7.437 10.842 1.00 0.00 C ATOM 972 OD1 ASP A 62 7.242 -6.609 11.484 1.00 0.00 O ATOM 973 OD2 ASP A 62 6.845 -8.642 10.665 1.00 0.00 O ATOM 0 H ASP A 62 3.622 -4.908 8.581 1.00 0.00 H new ATOM 0 HA ASP A 62 6.302 -5.158 9.574 1.00 0.00 H new ATOM 0 HB2 ASP A 62 4.570 -6.663 11.014 1.00 0.00 H new ATOM 0 HB3 ASP A 62 4.802 -7.746 9.656 1.00 0.00 H new ATOM 978 N SER A 63 4.470 -6.854 7.376 1.00 0.00 N ATOM 979 CA SER A 63 4.451 -7.402 6.030 1.00 0.00 C ATOM 980 C SER A 63 3.015 -7.733 5.620 1.00 0.00 C ATOM 981 O SER A 63 2.392 -8.626 6.194 1.00 0.00 O ATOM 982 CB SER A 63 5.333 -8.648 5.929 1.00 0.00 C ATOM 983 OG SER A 63 6.717 -8.334 6.057 1.00 0.00 O ATOM 0 H SER A 63 3.602 -6.975 7.898 1.00 0.00 H new ATOM 0 HA SER A 63 4.852 -6.651 5.350 1.00 0.00 H new ATOM 0 HB2 SER A 63 5.049 -9.357 6.706 1.00 0.00 H new ATOM 0 HB3 SER A 63 5.160 -9.138 4.971 1.00 0.00 H new ATOM 0 HG SER A 63 6.822 -7.370 6.200 1.00 0.00 H new ATOM 989 N SER A 64 2.530 -6.997 4.632 1.00 0.00 N ATOM 990 CA SER A 64 1.179 -7.202 4.139 1.00 0.00 C ATOM 991 C SER A 64 0.235 -7.498 5.306 1.00 0.00 C ATOM 992 O SER A 64 -0.462 -8.512 5.304 1.00 0.00 O ATOM 993 CB SER A 64 1.132 -8.340 3.117 1.00 0.00 C ATOM 994 OG SER A 64 1.234 -7.860 1.779 1.00 0.00 O ATOM 0 H SER A 64 3.049 -6.257 4.159 1.00 0.00 H new ATOM 0 HA SER A 64 0.855 -6.288 3.641 1.00 0.00 H new ATOM 0 HB2 SER A 64 1.945 -9.039 3.315 1.00 0.00 H new ATOM 0 HB3 SER A 64 0.200 -8.894 3.234 1.00 0.00 H new ATOM 0 HG SER A 64 1.201 -8.616 1.157 1.00 0.00 H new ATOM 1000 N CYS A 65 0.243 -6.595 6.276 1.00 0.00 N ATOM 1001 CA CYS A 65 -0.603 -6.747 7.447 1.00 0.00 C ATOM 1002 C CYS A 65 -1.826 -5.844 7.276 1.00 0.00 C ATOM 1003 O CYS A 65 -2.876 -6.294 6.818 1.00 0.00 O ATOM 1004 CB CYS A 65 0.157 -6.439 8.738 1.00 0.00 C ATOM 1005 SG CYS A 65 0.720 -7.995 9.519 1.00 0.00 S ATOM 0 H CYS A 65 0.822 -5.755 6.275 1.00 0.00 H new ATOM 0 HA CYS A 65 -0.927 -7.784 7.532 1.00 0.00 H new ATOM 0 HB2 CYS A 65 1.013 -5.800 8.522 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -0.486 -5.889 9.426 1.00 0.00 H new ATOM 0 HG CYS A 65 1.366 -7.722 10.613 1.00 0.00 H new ATOM 1011 N GLN A 66 -1.651 -4.586 7.652 1.00 0.00 N ATOM 1012 CA GLN A 66 -2.727 -3.615 7.546 1.00 0.00 C ATOM 1013 C GLN A 66 -2.169 -2.243 7.166 1.00 0.00 C ATOM 1014 O GLN A 66 -1.166 -1.800 7.725 1.00 0.00 O ATOM 1015 CB GLN A 66 -3.528 -3.541 8.847 1.00 0.00 C ATOM 1016 CG GLN A 66 -4.426 -4.769 9.009 1.00 0.00 C ATOM 1017 CD GLN A 66 -5.865 -4.358 9.326 1.00 0.00 C ATOM 1018 OE1 GLN A 66 -6.623 -3.940 8.466 1.00 0.00 O ATOM 1019 NE2 GLN A 66 -6.199 -4.500 10.606 1.00 0.00 N ATOM 0 H GLN A 66 -0.779 -4.216 8.031 1.00 0.00 H new ATOM 0 HA GLN A 66 -3.406 -3.939 6.758 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -2.846 -3.470 9.694 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -4.137 -2.637 8.852 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -4.406 -5.361 8.094 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -4.041 -5.403 9.808 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -5.516 -4.856 11.275 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -7.138 -4.253 10.918 1.00 0.00 H new ATOM 1028 N PHE A 67 -2.842 -1.607 6.219 1.00 0.00 N ATOM 1029 CA PHE A 67 -2.425 -0.293 5.758 1.00 0.00 C ATOM 1030 C PHE A 67 -2.225 0.663 6.936 1.00 0.00 C ATOM 1031 O PHE A 67 -3.127 0.846 7.752 1.00 0.00 O ATOM 1032 CB PHE A 67 -3.546 0.244 4.866 1.00 0.00 C ATOM 1033 CG PHE A 67 -3.318 1.675 4.374 1.00 0.00 C ATOM 1034 CD1 PHE A 67 -3.589 2.727 5.193 1.00 0.00 C ATOM 1035 CD2 PHE A 67 -2.846 1.895 3.118 1.00 0.00 C ATOM 1036 CE1 PHE A 67 -3.377 4.055 4.736 1.00 0.00 C ATOM 1037 CE2 PHE A 67 -2.634 3.223 2.661 1.00 0.00 C ATOM 1038 CZ PHE A 67 -2.905 4.275 3.480 1.00 0.00 C ATOM 0 H PHE A 67 -3.673 -1.977 5.758 1.00 0.00 H new ATOM 0 HA PHE A 67 -1.479 -0.369 5.222 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -3.656 -0.413 4.003 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -4.485 0.206 5.418 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -3.965 2.552 6.190 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -2.632 1.060 2.468 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -3.591 4.890 5.386 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -2.258 3.398 1.664 1.00 0.00 H new ATOM 0 HZ PHE A 67 -2.745 5.285 3.132 1.00 0.00 H new ATOM 1048 N ARG A 68 -1.037 1.248 6.987 1.00 0.00 N ATOM 1049 CA ARG A 68 -0.707 2.180 8.051 1.00 0.00 C ATOM 1050 C ARG A 68 -0.650 3.609 7.506 1.00 0.00 C ATOM 1051 O ARG A 68 -1.037 4.554 8.191 1.00 0.00 O ATOM 1052 CB ARG A 68 0.638 1.832 8.691 1.00 0.00 C ATOM 1053 CG ARG A 68 0.505 0.628 9.626 1.00 0.00 C ATOM 1054 CD ARG A 68 -0.262 1.002 10.895 1.00 0.00 C ATOM 1055 NE ARG A 68 0.681 1.452 11.943 1.00 0.00 N ATOM 1056 CZ ARG A 68 1.037 2.730 12.133 1.00 0.00 C ATOM 1057 NH1 ARG A 68 0.532 3.691 11.348 1.00 0.00 N ATOM 1058 NH2 ARG A 68 1.900 3.047 13.108 1.00 0.00 N ATOM 0 H ARG A 68 -0.291 1.094 6.308 1.00 0.00 H new ATOM 0 HA ARG A 68 -1.487 2.107 8.809 1.00 0.00 H new ATOM 0 HB2 ARG A 68 1.369 1.614 7.913 1.00 0.00 H new ATOM 0 HB3 ARG A 68 1.012 2.690 9.249 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -0.011 -0.182 9.110 1.00 0.00 H new ATOM 0 HG3 ARG A 68 1.495 0.258 9.891 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -0.980 1.793 10.676 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -0.832 0.144 11.251 1.00 0.00 H new ATOM 0 HE ARG A 68 1.085 0.746 12.559 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -0.124 3.450 10.605 1.00 0.00 H new ATOM 0 HH12 ARG A 68 0.804 4.663 11.493 1.00 0.00 H new ATOM 0 HH21 ARG A 68 2.286 2.316 13.705 1.00 0.00 H new ATOM 0 HH22 ARG A 68 2.171 4.020 13.253 1.00 0.00 H new ATOM 1072 N ALA A 69 -0.164 3.721 6.279 1.00 0.00 N ATOM 1073 CA ALA A 69 -0.051 5.018 5.634 1.00 0.00 C ATOM 1074 C ALA A 69 0.515 4.835 4.225 1.00 0.00 C ATOM 1075 O ALA A 69 1.304 3.923 3.982 1.00 0.00 O ATOM 1076 CB ALA A 69 0.813 5.943 6.494 1.00 0.00 C ATOM 0 H ALA A 69 0.156 2.934 5.714 1.00 0.00 H new ATOM 0 HA ALA A 69 -1.031 5.485 5.537 1.00 0.00 H new ATOM 0 HB1 ALA A 69 0.898 6.916 6.010 1.00 0.00 H new ATOM 0 HB2 ALA A 69 0.352 6.064 7.474 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.806 5.509 6.611 1.00 0.00 H new ATOM 1082 N LEU A 70 0.091 5.717 3.332 1.00 0.00 N ATOM 1083 CA LEU A 70 0.546 5.664 1.953 1.00 0.00 C ATOM 1084 C LEU A 70 1.769 6.569 1.789 1.00 0.00 C ATOM 1085 O LEU A 70 1.940 7.529 2.538 1.00 0.00 O ATOM 1086 CB LEU A 70 -0.601 6.001 0.997 1.00 0.00 C ATOM 1087 CG LEU A 70 -0.312 5.804 -0.493 1.00 0.00 C ATOM 1088 CD1 LEU A 70 -0.633 4.373 -0.929 1.00 0.00 C ATOM 1089 CD2 LEU A 70 -1.055 6.842 -1.337 1.00 0.00 C ATOM 0 H LEU A 70 -0.563 6.473 3.537 1.00 0.00 H new ATOM 0 HA LEU A 70 0.860 4.653 1.694 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -1.462 5.388 1.264 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.888 7.040 1.157 1.00 0.00 H new ATOM 0 HG LEU A 70 0.754 5.959 -0.658 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -0.419 4.260 -1.992 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -0.022 3.673 -0.359 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -1.687 4.165 -0.747 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -0.833 6.680 -2.392 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.128 6.744 -1.173 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -0.734 7.843 -1.048 1.00 0.00 H new ATOM 1101 N TYR A 71 2.587 6.230 0.804 1.00 0.00 N ATOM 1102 CA TYR A 71 3.790 7.000 0.532 1.00 0.00 C ATOM 1103 C TYR A 71 4.119 6.992 -0.962 1.00 0.00 C ATOM 1104 O TYR A 71 3.835 6.020 -1.660 1.00 0.00 O ATOM 1105 CB TYR A 71 4.918 6.302 1.294 1.00 0.00 C ATOM 1106 CG TYR A 71 4.937 6.606 2.793 1.00 0.00 C ATOM 1107 CD1 TYR A 71 4.045 5.975 3.636 1.00 0.00 C ATOM 1108 CD2 TYR A 71 5.845 7.511 3.303 1.00 0.00 C ATOM 1109 CE1 TYR A 71 4.062 6.261 5.048 1.00 0.00 C ATOM 1110 CE2 TYR A 71 5.863 7.797 4.714 1.00 0.00 C ATOM 1111 CZ TYR A 71 4.970 7.158 5.517 1.00 0.00 C ATOM 1112 OH TYR A 71 4.987 7.428 6.850 1.00 0.00 O ATOM 0 H TYR A 71 2.441 5.433 0.184 1.00 0.00 H new ATOM 0 HA TYR A 71 3.659 8.038 0.837 1.00 0.00 H new ATOM 0 HB2 TYR A 71 4.826 5.225 1.153 1.00 0.00 H new ATOM 0 HB3 TYR A 71 5.873 6.599 0.861 1.00 0.00 H new ATOM 0 HD1 TYR A 71 3.334 5.267 3.237 1.00 0.00 H new ATOM 0 HD2 TYR A 71 6.543 8.005 2.643 1.00 0.00 H new ATOM 0 HE1 TYR A 71 3.369 5.774 5.719 1.00 0.00 H new ATOM 0 HE2 TYR A 71 6.569 8.503 5.126 1.00 0.00 H new ATOM 0 HH TYR A 71 4.123 7.184 7.244 1.00 0.00 H new ATOM 1122 N THR A 72 4.714 8.088 -1.410 1.00 0.00 N ATOM 1123 CA THR A 72 5.085 8.221 -2.809 1.00 0.00 C ATOM 1124 C THR A 72 6.601 8.096 -2.972 1.00 0.00 C ATOM 1125 O THR A 72 7.362 8.617 -2.159 1.00 0.00 O ATOM 1126 CB THR A 72 4.526 9.549 -3.323 1.00 0.00 C ATOM 1127 OG1 THR A 72 4.738 10.455 -2.244 1.00 0.00 O ATOM 1128 CG2 THR A 72 3.005 9.518 -3.490 1.00 0.00 C ATOM 0 H THR A 72 4.949 8.893 -0.829 1.00 0.00 H new ATOM 0 HA THR A 72 4.657 7.418 -3.410 1.00 0.00 H new ATOM 0 HB THR A 72 4.991 9.794 -4.278 1.00 0.00 H new ATOM 0 HG1 THR A 72 4.406 11.343 -2.492 1.00 0.00 H new ATOM 0 HG21 THR A 72 2.659 10.484 -3.857 1.00 0.00 H new ATOM 0 HG22 THR A 72 2.733 8.741 -4.204 1.00 0.00 H new ATOM 0 HG23 THR A 72 2.538 9.307 -2.528 1.00 0.00 H new ATOM 1136 N LEU A 73 6.995 7.401 -4.030 1.00 0.00 N ATOM 1137 CA LEU A 73 8.406 7.201 -4.311 1.00 0.00 C ATOM 1138 C LEU A 73 8.886 8.279 -5.286 1.00 0.00 C ATOM 1139 O LEU A 73 8.213 8.571 -6.273 1.00 0.00 O ATOM 1140 CB LEU A 73 8.658 5.774 -4.799 1.00 0.00 C ATOM 1141 CG LEU A 73 10.080 5.469 -5.277 1.00 0.00 C ATOM 1142 CD1 LEU A 73 11.116 5.992 -4.281 1.00 0.00 C ATOM 1143 CD2 LEU A 73 10.256 3.975 -5.556 1.00 0.00 C ATOM 0 H LEU A 73 6.361 6.970 -4.703 1.00 0.00 H new ATOM 0 HA LEU A 73 8.995 7.310 -3.400 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.413 5.086 -3.990 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.968 5.564 -5.616 1.00 0.00 H new ATOM 0 HG LEU A 73 10.244 5.993 -6.218 1.00 0.00 H new ATOM 0 HD11 LEU A 73 12.118 5.763 -4.644 1.00 0.00 H new ATOM 0 HD12 LEU A 73 11.007 7.071 -4.175 1.00 0.00 H new ATOM 0 HD13 LEU A 73 10.963 5.515 -3.313 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.275 3.786 -5.894 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.065 3.410 -4.644 1.00 0.00 H new ATOM 0 HD23 LEU A 73 9.553 3.664 -6.329 1.00 0.00 H new ATOM 1155 N SER A 74 10.044 8.840 -4.974 1.00 0.00 N ATOM 1156 CA SER A 74 10.621 9.879 -5.810 1.00 0.00 C ATOM 1157 C SER A 74 11.359 9.249 -6.994 1.00 0.00 C ATOM 1158 O SER A 74 12.409 8.633 -6.819 1.00 0.00 O ATOM 1159 CB SER A 74 11.571 10.769 -5.006 1.00 0.00 C ATOM 1160 OG SER A 74 10.878 11.810 -4.323 1.00 0.00 O ATOM 0 H SER A 74 10.599 8.595 -4.154 1.00 0.00 H new ATOM 0 HA SER A 74 9.811 10.504 -6.186 1.00 0.00 H new ATOM 0 HB2 SER A 74 12.114 10.160 -4.283 1.00 0.00 H new ATOM 0 HB3 SER A 74 12.312 11.205 -5.675 1.00 0.00 H new ATOM 0 HG SER A 74 10.833 12.604 -4.896 1.00 0.00 H new ATOM 1166 N GLY A 75 10.779 9.424 -8.172 1.00 0.00 N ATOM 1167 CA GLY A 75 11.368 8.880 -9.384 1.00 0.00 C ATOM 1168 C GLY A 75 12.771 9.445 -9.613 1.00 0.00 C ATOM 1169 O GLY A 75 13.565 8.865 -10.353 1.00 0.00 O ATOM 0 H GLY A 75 9.907 9.935 -8.313 1.00 0.00 H new ATOM 0 HA2 GLY A 75 11.417 7.793 -9.313 1.00 0.00 H new ATOM 0 HA3 GLY A 75 10.733 9.115 -10.238 1.00 0.00 H new ATOM 1173 N GLU A 76 13.034 10.571 -8.965 1.00 0.00 N ATOM 1174 CA GLU A 76 14.328 11.221 -9.089 1.00 0.00 C ATOM 1175 C GLU A 76 15.374 10.485 -8.249 1.00 0.00 C ATOM 1176 O GLU A 76 16.556 10.480 -8.589 1.00 0.00 O ATOM 1177 CB GLU A 76 14.241 12.695 -8.690 1.00 0.00 C ATOM 1178 CG GLU A 76 13.971 12.842 -7.191 1.00 0.00 C ATOM 1179 CD GLU A 76 12.690 13.639 -6.940 1.00 0.00 C ATOM 1180 OE1 GLU A 76 11.609 13.016 -7.015 1.00 0.00 O ATOM 1181 OE2 GLU A 76 12.820 14.855 -6.679 1.00 0.00 O ATOM 0 H GLU A 76 12.373 11.049 -8.353 1.00 0.00 H new ATOM 0 HA GLU A 76 14.636 11.180 -10.134 1.00 0.00 H new ATOM 0 HB2 GLU A 76 15.172 13.201 -8.947 1.00 0.00 H new ATOM 0 HB3 GLU A 76 13.447 13.182 -9.256 1.00 0.00 H new ATOM 0 HG2 GLU A 76 13.885 11.856 -6.735 1.00 0.00 H new ATOM 0 HG3 GLU A 76 14.814 13.342 -6.713 1.00 0.00 H new ATOM 1188 N THR A 77 14.901 9.882 -7.168 1.00 0.00 N ATOM 1189 CA THR A 77 15.781 9.146 -6.277 1.00 0.00 C ATOM 1190 C THR A 77 15.179 7.780 -5.942 1.00 0.00 C ATOM 1191 O THR A 77 14.420 7.221 -6.733 1.00 0.00 O ATOM 1192 CB THR A 77 16.040 10.014 -5.044 1.00 0.00 C ATOM 1193 OG1 THR A 77 14.754 10.163 -4.448 1.00 0.00 O ATOM 1194 CG2 THR A 77 16.449 11.442 -5.409 1.00 0.00 C ATOM 0 H THR A 77 13.920 9.888 -6.889 1.00 0.00 H new ATOM 0 HA THR A 77 16.739 8.937 -6.752 1.00 0.00 H new ATOM 0 HB THR A 77 16.821 9.557 -4.436 1.00 0.00 H new ATOM 0 HG1 THR A 77 14.830 10.712 -3.640 1.00 0.00 H new ATOM 0 HG21 THR A 77 16.621 12.015 -4.498 1.00 0.00 H new ATOM 0 HG22 THR A 77 17.364 11.418 -6.001 1.00 0.00 H new ATOM 0 HG23 THR A 77 15.654 11.911 -5.989 1.00 0.00 H new ATOM 1202 N GLU A 78 15.540 7.280 -4.769 1.00 0.00 N ATOM 1203 CA GLU A 78 15.045 5.990 -4.321 1.00 0.00 C ATOM 1204 C GLU A 78 14.256 6.148 -3.019 1.00 0.00 C ATOM 1205 O GLU A 78 13.634 5.197 -2.547 1.00 0.00 O ATOM 1206 CB GLU A 78 16.192 4.992 -4.150 1.00 0.00 C ATOM 1207 CG GLU A 78 17.116 5.005 -5.369 1.00 0.00 C ATOM 1208 CD GLU A 78 18.279 4.027 -5.185 1.00 0.00 C ATOM 1209 OE1 GLU A 78 18.961 4.146 -4.144 1.00 0.00 O ATOM 1210 OE2 GLU A 78 18.460 3.184 -6.090 1.00 0.00 O ATOM 0 H GLU A 78 16.170 7.746 -4.115 1.00 0.00 H new ATOM 0 HA GLU A 78 14.374 5.595 -5.084 1.00 0.00 H new ATOM 0 HB2 GLU A 78 16.762 5.238 -3.254 1.00 0.00 H new ATOM 0 HB3 GLU A 78 15.788 3.990 -4.006 1.00 0.00 H new ATOM 0 HG2 GLU A 78 16.550 4.739 -6.262 1.00 0.00 H new ATOM 0 HG3 GLU A 78 17.504 6.012 -5.525 1.00 0.00 H new ATOM 1217 N GLU A 79 14.309 7.355 -2.475 1.00 0.00 N ATOM 1218 CA GLU A 79 13.607 7.649 -1.237 1.00 0.00 C ATOM 1219 C GLU A 79 12.115 7.850 -1.508 1.00 0.00 C ATOM 1220 O GLU A 79 11.714 8.102 -2.643 1.00 0.00 O ATOM 1221 CB GLU A 79 14.208 8.873 -0.544 1.00 0.00 C ATOM 1222 CG GLU A 79 15.569 8.541 0.072 1.00 0.00 C ATOM 1223 CD GLU A 79 16.626 8.330 -1.014 1.00 0.00 C ATOM 1224 OE1 GLU A 79 16.816 9.274 -1.811 1.00 0.00 O ATOM 1225 OE2 GLU A 79 17.220 7.231 -1.022 1.00 0.00 O ATOM 0 H GLU A 79 14.827 8.141 -2.869 1.00 0.00 H new ATOM 0 HA GLU A 79 13.723 6.798 -0.565 1.00 0.00 H new ATOM 0 HB2 GLU A 79 14.318 9.685 -1.263 1.00 0.00 H new ATOM 0 HB3 GLU A 79 13.529 9.225 0.233 1.00 0.00 H new ATOM 0 HG2 GLU A 79 15.879 9.349 0.734 1.00 0.00 H new ATOM 0 HG3 GLU A 79 15.486 7.642 0.683 1.00 0.00 H new ATOM 1232 N LEU A 80 11.332 7.731 -0.445 1.00 0.00 N ATOM 1233 CA LEU A 80 9.892 7.897 -0.554 1.00 0.00 C ATOM 1234 C LEU A 80 9.486 9.223 0.092 1.00 0.00 C ATOM 1235 O LEU A 80 10.341 10.037 0.437 1.00 0.00 O ATOM 1236 CB LEU A 80 9.168 6.681 0.028 1.00 0.00 C ATOM 1237 CG LEU A 80 9.372 5.360 -0.715 1.00 0.00 C ATOM 1238 CD1 LEU A 80 10.000 4.307 0.200 1.00 0.00 C ATOM 1239 CD2 LEU A 80 8.061 4.871 -1.335 1.00 0.00 C ATOM 0 H LEU A 80 11.667 7.522 0.495 1.00 0.00 H new ATOM 0 HA LEU A 80 9.591 7.947 -1.601 1.00 0.00 H new ATOM 0 HB2 LEU A 80 9.494 6.549 1.060 1.00 0.00 H new ATOM 0 HB3 LEU A 80 8.100 6.898 0.056 1.00 0.00 H new ATOM 0 HG LEU A 80 10.071 5.534 -1.533 1.00 0.00 H new ATOM 0 HD11 LEU A 80 10.134 3.378 -0.353 1.00 0.00 H new ATOM 0 HD12 LEU A 80 10.968 4.662 0.553 1.00 0.00 H new ATOM 0 HD13 LEU A 80 9.346 4.130 1.054 1.00 0.00 H new ATOM 0 HD21 LEU A 80 8.234 3.930 -1.857 1.00 0.00 H new ATOM 0 HD22 LEU A 80 7.321 4.719 -0.549 1.00 0.00 H new ATOM 0 HD23 LEU A 80 7.692 5.615 -2.041 1.00 0.00 H new ATOM 1251 N SER A 81 8.180 9.398 0.236 1.00 0.00 N ATOM 1252 CA SER A 81 7.650 10.611 0.835 1.00 0.00 C ATOM 1253 C SER A 81 6.300 10.322 1.494 1.00 0.00 C ATOM 1254 O SER A 81 5.449 9.656 0.908 1.00 0.00 O ATOM 1255 CB SER A 81 7.505 11.722 -0.207 1.00 0.00 C ATOM 1256 OG SER A 81 6.899 12.890 0.338 1.00 0.00 O ATOM 0 H SER A 81 7.474 8.720 -0.052 1.00 0.00 H new ATOM 0 HA SER A 81 8.353 10.952 1.595 1.00 0.00 H new ATOM 0 HB2 SER A 81 8.487 11.976 -0.605 1.00 0.00 H new ATOM 0 HB3 SER A 81 6.906 11.359 -1.042 1.00 0.00 H new ATOM 0 HG SER A 81 6.826 13.576 -0.358 1.00 0.00 H new ATOM 1262 N ARG A 82 6.147 10.838 2.705 1.00 0.00 N ATOM 1263 CA ARG A 82 4.915 10.644 3.451 1.00 0.00 C ATOM 1264 C ARG A 82 3.767 11.408 2.787 1.00 0.00 C ATOM 1265 O ARG A 82 3.640 12.619 2.961 1.00 0.00 O ATOM 1266 CB ARG A 82 5.065 11.119 4.897 1.00 0.00 C ATOM 1267 CG ARG A 82 3.800 10.826 5.705 1.00 0.00 C ATOM 1268 CD ARG A 82 3.773 11.644 6.998 1.00 0.00 C ATOM 1269 NE ARG A 82 2.448 12.284 7.164 1.00 0.00 N ATOM 1270 CZ ARG A 82 2.174 13.213 8.089 1.00 0.00 C ATOM 1271 NH1 ARG A 82 3.130 13.618 8.937 1.00 0.00 N ATOM 1272 NH2 ARG A 82 0.944 13.739 8.167 1.00 0.00 N ATOM 0 H ARG A 82 6.856 11.390 3.188 1.00 0.00 H new ATOM 0 HA ARG A 82 4.694 9.577 3.453 1.00 0.00 H new ATOM 0 HB2 ARG A 82 5.919 10.624 5.359 1.00 0.00 H new ATOM 0 HB3 ARG A 82 5.271 12.189 4.912 1.00 0.00 H new ATOM 0 HG2 ARG A 82 2.920 11.058 5.106 1.00 0.00 H new ATOM 0 HG3 ARG A 82 3.754 9.763 5.942 1.00 0.00 H new ATOM 0 HD2 ARG A 82 3.984 10.999 7.851 1.00 0.00 H new ATOM 0 HD3 ARG A 82 4.553 12.405 6.973 1.00 0.00 H new ATOM 0 HE ARG A 82 1.697 12.000 6.535 1.00 0.00 H new ATOM 0 HH11 ARG A 82 4.067 13.219 8.878 1.00 0.00 H new ATOM 0 HH12 ARG A 82 2.921 14.326 9.641 1.00 0.00 H new ATOM 0 HH21 ARG A 82 0.216 13.432 7.522 1.00 0.00 H new ATOM 0 HH22 ARG A 82 0.736 14.446 8.872 1.00 0.00 H new ATOM 1286 N LEU A 83 2.959 10.668 2.042 1.00 0.00 N ATOM 1287 CA LEU A 83 1.826 11.260 1.352 1.00 0.00 C ATOM 1288 C LEU A 83 0.740 11.610 2.371 1.00 0.00 C ATOM 1289 O LEU A 83 0.397 12.779 2.541 1.00 0.00 O ATOM 1290 CB LEU A 83 1.342 10.341 0.228 1.00 0.00 C ATOM 1291 CG LEU A 83 0.234 10.900 -0.666 1.00 0.00 C ATOM 1292 CD1 LEU A 83 0.634 12.255 -1.253 1.00 0.00 C ATOM 1293 CD2 LEU A 83 -0.153 9.896 -1.753 1.00 0.00 C ATOM 0 H LEU A 83 3.067 9.664 1.901 1.00 0.00 H new ATOM 0 HA LEU A 83 2.120 12.191 0.866 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.196 10.088 -0.401 1.00 0.00 H new ATOM 0 HB3 LEU A 83 0.988 9.411 0.673 1.00 0.00 H new ATOM 0 HG LEU A 83 -0.651 11.064 -0.051 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -0.171 12.630 -1.885 1.00 0.00 H new ATOM 0 HD12 LEU A 83 0.820 12.961 -0.444 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.539 12.140 -1.849 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.943 10.319 -2.374 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.717 9.676 -2.372 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -0.510 8.977 -1.289 1.00 0.00 H new ATOM 1305 N ALA A 84 0.229 10.576 3.022 1.00 0.00 N ATOM 1306 CA ALA A 84 -0.811 10.759 4.020 1.00 0.00 C ATOM 1307 C ALA A 84 -0.752 9.611 5.029 1.00 0.00 C ATOM 1308 O ALA A 84 -0.134 8.581 4.767 1.00 0.00 O ATOM 1309 CB ALA A 84 -2.172 10.857 3.327 1.00 0.00 C ATOM 0 H ALA A 84 0.516 9.608 2.878 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.657 11.688 4.569 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.952 10.994 4.076 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.172 11.706 2.643 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.363 9.941 2.768 1.00 0.00 H new ATOM 1315 N GLY A 85 -1.403 9.828 6.162 1.00 0.00 N ATOM 1316 CA GLY A 85 -1.432 8.824 7.212 1.00 0.00 C ATOM 1317 C GLY A 85 -0.675 9.305 8.452 1.00 0.00 C ATOM 1318 O GLY A 85 -1.112 10.234 9.129 1.00 0.00 O ATOM 0 H GLY A 85 -1.914 10.684 6.376 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -2.465 8.599 7.477 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -0.988 7.898 6.847 1.00 0.00 H new ATOM 1322 N TYR A 86 0.447 8.650 8.711 1.00 0.00 N ATOM 1323 CA TYR A 86 1.269 8.999 9.857 1.00 0.00 C ATOM 1324 C TYR A 86 2.513 8.111 9.931 1.00 0.00 C ATOM 1325 O TYR A 86 2.403 6.891 10.040 1.00 0.00 O ATOM 1326 CB TYR A 86 0.402 8.745 11.092 1.00 0.00 C ATOM 1327 CG TYR A 86 1.131 8.958 12.420 1.00 0.00 C ATOM 1328 CD1 TYR A 86 1.393 10.238 12.866 1.00 0.00 C ATOM 1329 CD2 TYR A 86 1.528 7.870 13.171 1.00 0.00 C ATOM 1330 CE1 TYR A 86 2.079 10.438 14.116 1.00 0.00 C ATOM 1331 CE2 TYR A 86 2.214 8.071 14.421 1.00 0.00 C ATOM 1332 CZ TYR A 86 2.456 9.345 14.832 1.00 0.00 C ATOM 1333 OH TYR A 86 3.105 9.534 16.012 1.00 0.00 O ATOM 0 H TYR A 86 0.806 7.880 8.147 1.00 0.00 H new ATOM 0 HA TYR A 86 1.604 10.034 9.787 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -0.465 9.404 11.056 1.00 0.00 H new ATOM 0 HB3 TYR A 86 0.027 7.722 11.055 1.00 0.00 H new ATOM 0 HD1 TYR A 86 1.083 11.089 12.277 1.00 0.00 H new ATOM 0 HD2 TYR A 86 1.324 6.869 12.821 1.00 0.00 H new ATOM 0 HE1 TYR A 86 2.289 11.434 14.477 1.00 0.00 H new ATOM 0 HE2 TYR A 86 2.529 7.229 15.019 1.00 0.00 H new ATOM 0 HH TYR A 86 3.312 8.665 16.414 1.00 0.00 H new ATOM 1343 N GLY A 87 3.667 8.758 9.869 1.00 0.00 N ATOM 1344 CA GLY A 87 4.930 8.041 9.927 1.00 0.00 C ATOM 1345 C GLY A 87 6.111 8.997 9.743 1.00 0.00 C ATOM 1346 O GLY A 87 6.014 10.180 10.066 1.00 0.00 O ATOM 0 H GLY A 87 3.754 9.770 9.779 1.00 0.00 H new ATOM 0 HA2 GLY A 87 5.018 7.529 10.885 1.00 0.00 H new ATOM 0 HA3 GLY A 87 4.953 7.275 9.152 1.00 0.00 H new ATOM 1350 N PRO A 88 7.229 8.433 9.210 1.00 0.00 N ATOM 1351 CA PRO A 88 8.427 9.221 8.979 1.00 0.00 C ATOM 1352 C PRO A 88 8.260 10.127 7.757 1.00 0.00 C ATOM 1353 O PRO A 88 7.920 9.657 6.673 1.00 0.00 O ATOM 1354 CB PRO A 88 9.543 8.202 8.814 1.00 0.00 C ATOM 1355 CG PRO A 88 8.858 6.883 8.496 1.00 0.00 C ATOM 1356 CD PRO A 88 7.380 7.035 8.816 1.00 0.00 C ATOM 0 HA PRO A 88 8.647 9.903 9.801 1.00 0.00 H new ATOM 0 HB2 PRO A 88 10.222 8.493 8.013 1.00 0.00 H new ATOM 0 HB3 PRO A 88 10.138 8.124 9.724 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.996 6.625 7.446 1.00 0.00 H new ATOM 0 HG3 PRO A 88 9.294 6.075 9.083 1.00 0.00 H new ATOM 0 HD2 PRO A 88 6.761 6.798 7.951 1.00 0.00 H new ATOM 0 HD3 PRO A 88 7.077 6.362 9.618 1.00 0.00 H new ATOM 1364 N ARG A 89 8.506 11.411 7.974 1.00 0.00 N ATOM 1365 CA ARG A 89 8.387 12.387 6.904 1.00 0.00 C ATOM 1366 C ARG A 89 8.857 11.783 5.579 1.00 0.00 C ATOM 1367 O ARG A 89 8.262 12.033 4.533 1.00 0.00 O ATOM 1368 CB ARG A 89 9.213 13.639 7.207 1.00 0.00 C ATOM 1369 CG ARG A 89 8.968 14.724 6.156 1.00 0.00 C ATOM 1370 CD ARG A 89 10.096 15.758 6.162 1.00 0.00 C ATOM 1371 NE ARG A 89 9.964 16.659 4.996 1.00 0.00 N ATOM 1372 CZ ARG A 89 9.073 17.656 4.915 1.00 0.00 C ATOM 1373 NH1 ARG A 89 8.230 17.887 5.931 1.00 0.00 N ATOM 1374 NH2 ARG A 89 9.024 18.424 3.818 1.00 0.00 N ATOM 0 H ARG A 89 8.787 11.798 8.875 1.00 0.00 H new ATOM 0 HA ARG A 89 7.337 12.668 6.827 1.00 0.00 H new ATOM 0 HB2 ARG A 89 8.954 14.020 8.195 1.00 0.00 H new ATOM 0 HB3 ARG A 89 10.272 13.383 7.231 1.00 0.00 H new ATOM 0 HG2 ARG A 89 8.893 14.268 5.169 1.00 0.00 H new ATOM 0 HG3 ARG A 89 8.016 15.218 6.353 1.00 0.00 H new ATOM 0 HD2 ARG A 89 10.064 16.337 7.085 1.00 0.00 H new ATOM 0 HD3 ARG A 89 11.062 15.254 6.135 1.00 0.00 H new ATOM 0 HE ARG A 89 10.590 16.512 4.205 1.00 0.00 H new ATOM 0 HH11 ARG A 89 8.267 17.303 6.767 1.00 0.00 H new ATOM 0 HH12 ARG A 89 7.552 18.646 5.868 1.00 0.00 H new ATOM 0 HH21 ARG A 89 9.665 18.250 3.044 1.00 0.00 H new ATOM 0 HH22 ARG A 89 8.345 19.183 3.757 1.00 0.00 H new ATOM 1388 N THR A 90 9.921 10.998 5.668 1.00 0.00 N ATOM 1389 CA THR A 90 10.478 10.356 4.489 1.00 0.00 C ATOM 1390 C THR A 90 10.999 8.960 4.838 1.00 0.00 C ATOM 1391 O THR A 90 11.113 8.612 6.012 1.00 0.00 O ATOM 1392 CB THR A 90 11.553 11.279 3.912 1.00 0.00 C ATOM 1393 OG1 THR A 90 10.817 12.251 3.175 1.00 0.00 O ATOM 1394 CG2 THR A 90 12.414 10.584 2.855 1.00 0.00 C ATOM 0 H THR A 90 10.412 10.792 6.538 1.00 0.00 H new ATOM 0 HA THR A 90 9.716 10.203 3.725 1.00 0.00 H new ATOM 0 HB THR A 90 12.190 11.643 4.718 1.00 0.00 H new ATOM 0 HG1 THR A 90 9.870 12.200 3.421 1.00 0.00 H new ATOM 0 HG21 THR A 90 13.161 11.282 2.478 1.00 0.00 H new ATOM 0 HG22 THR A 90 12.914 9.724 3.301 1.00 0.00 H new ATOM 0 HG23 THR A 90 11.781 10.250 2.033 1.00 0.00 H new ATOM 1402 N VAL A 91 11.300 8.199 3.797 1.00 0.00 N ATOM 1403 CA VAL A 91 11.806 6.849 3.978 1.00 0.00 C ATOM 1404 C VAL A 91 12.963 6.608 3.007 1.00 0.00 C ATOM 1405 O VAL A 91 12.978 7.154 1.905 1.00 0.00 O ATOM 1406 CB VAL A 91 10.669 5.838 3.815 1.00 0.00 C ATOM 1407 CG1 VAL A 91 11.215 4.413 3.696 1.00 0.00 C ATOM 1408 CG2 VAL A 91 9.669 5.947 4.968 1.00 0.00 C ATOM 0 H VAL A 91 11.203 8.491 2.825 1.00 0.00 H new ATOM 0 HA VAL A 91 12.196 6.720 4.987 1.00 0.00 H new ATOM 0 HB VAL A 91 10.142 6.073 2.890 1.00 0.00 H new ATOM 0 HG11 VAL A 91 10.386 3.714 3.581 1.00 0.00 H new ATOM 0 HG12 VAL A 91 11.870 4.346 2.827 1.00 0.00 H new ATOM 0 HG13 VAL A 91 11.778 4.163 4.595 1.00 0.00 H new ATOM 0 HG21 VAL A 91 8.871 5.218 4.828 1.00 0.00 H new ATOM 0 HG22 VAL A 91 10.179 5.751 5.911 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.244 6.951 4.987 1.00 0.00 H new ATOM 1418 N THR A 92 13.906 5.789 3.452 1.00 0.00 N ATOM 1419 CA THR A 92 15.065 5.469 2.636 1.00 0.00 C ATOM 1420 C THR A 92 15.175 3.957 2.436 1.00 0.00 C ATOM 1421 O THR A 92 14.553 3.184 3.163 1.00 0.00 O ATOM 1422 CB THR A 92 16.297 6.086 3.303 1.00 0.00 C ATOM 1423 OG1 THR A 92 16.285 5.546 4.621 1.00 0.00 O ATOM 1424 CG2 THR A 92 16.154 7.594 3.516 1.00 0.00 C ATOM 0 H THR A 92 13.891 5.338 4.367 1.00 0.00 H new ATOM 0 HA THR A 92 14.974 5.891 1.635 1.00 0.00 H new ATOM 0 HB THR A 92 17.178 5.888 2.692 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.110 5.039 4.774 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.055 7.981 3.992 1.00 0.00 H new ATOM 0 HG22 THR A 92 16.012 8.086 2.554 1.00 0.00 H new ATOM 0 HG23 THR A 92 15.293 7.791 4.154 1.00 0.00 H new ATOM 1432 N PRO A 93 15.993 3.569 1.421 1.00 0.00 N ATOM 1433 CA PRO A 93 16.192 2.162 1.116 1.00 0.00 C ATOM 1434 C PRO A 93 17.107 1.502 2.150 1.00 0.00 C ATOM 1435 O PRO A 93 17.320 0.291 2.112 1.00 0.00 O ATOM 1436 CB PRO A 93 16.773 2.143 -0.289 1.00 0.00 C ATOM 1437 CG PRO A 93 17.309 3.543 -0.538 1.00 0.00 C ATOM 1438 CD PRO A 93 16.745 4.456 0.539 1.00 0.00 C ATOM 0 HA PRO A 93 15.267 1.587 1.158 1.00 0.00 H new ATOM 0 HB2 PRO A 93 17.566 1.400 -0.373 1.00 0.00 H new ATOM 0 HB3 PRO A 93 16.011 1.880 -1.023 1.00 0.00 H new ATOM 0 HG2 PRO A 93 18.399 3.546 -0.509 1.00 0.00 H new ATOM 0 HG3 PRO A 93 17.016 3.894 -1.528 1.00 0.00 H new ATOM 0 HD2 PRO A 93 17.540 4.970 1.079 1.00 0.00 H new ATOM 0 HD3 PRO A 93 16.103 5.225 0.110 1.00 0.00 H new ATOM 1446 N ALA A 94 17.622 2.327 3.050 1.00 0.00 N ATOM 1447 CA ALA A 94 18.508 1.838 4.092 1.00 0.00 C ATOM 1448 C ALA A 94 17.681 1.457 5.322 1.00 0.00 C ATOM 1449 O ALA A 94 18.156 0.731 6.194 1.00 0.00 O ATOM 1450 CB ALA A 94 19.563 2.901 4.406 1.00 0.00 C ATOM 0 H ALA A 94 17.442 3.331 3.079 1.00 0.00 H new ATOM 0 HA ALA A 94 19.035 0.944 3.759 1.00 0.00 H new ATOM 0 HB1 ALA A 94 20.228 2.534 5.188 1.00 0.00 H new ATOM 0 HB2 ALA A 94 20.142 3.115 3.508 1.00 0.00 H new ATOM 0 HB3 ALA A 94 19.071 3.812 4.746 1.00 0.00 H new ATOM 1456 N MET A 95 16.457 1.964 5.352 1.00 0.00 N ATOM 1457 CA MET A 95 15.559 1.685 6.460 1.00 0.00 C ATOM 1458 C MET A 95 14.503 0.652 6.064 1.00 0.00 C ATOM 1459 O MET A 95 13.932 -0.018 6.923 1.00 0.00 O ATOM 1460 CB MET A 95 14.870 2.980 6.896 1.00 0.00 C ATOM 1461 CG MET A 95 15.882 3.976 7.465 1.00 0.00 C ATOM 1462 SD MET A 95 15.072 5.089 8.601 1.00 0.00 S ATOM 1463 CE MET A 95 13.668 5.574 7.612 1.00 0.00 C ATOM 0 H MET A 95 16.066 2.566 4.627 1.00 0.00 H new ATOM 0 HA MET A 95 16.144 1.279 7.285 1.00 0.00 H new ATOM 0 HB2 MET A 95 14.355 3.426 6.045 1.00 0.00 H new ATOM 0 HB3 MET A 95 14.112 2.758 7.647 1.00 0.00 H new ATOM 0 HG2 MET A 95 16.683 3.441 7.976 1.00 0.00 H new ATOM 0 HG3 MET A 95 16.342 4.542 6.655 1.00 0.00 H new ATOM 0 HE1 MET A 95 13.192 6.446 8.059 1.00 0.00 H new ATOM 0 HE2 MET A 95 14.001 5.820 6.604 1.00 0.00 H new ATOM 0 HE3 MET A 95 12.953 4.753 7.568 1.00 0.00 H new ATOM 1473 N VAL A 96 14.274 0.556 4.762 1.00 0.00 N ATOM 1474 CA VAL A 96 13.296 -0.384 4.242 1.00 0.00 C ATOM 1475 C VAL A 96 13.736 -1.810 4.580 1.00 0.00 C ATOM 1476 O VAL A 96 14.861 -2.205 4.278 1.00 0.00 O ATOM 1477 CB VAL A 96 13.101 -0.159 2.741 1.00 0.00 C ATOM 1478 CG1 VAL A 96 14.362 -0.537 1.961 1.00 0.00 C ATOM 1479 CG2 VAL A 96 11.885 -0.930 2.224 1.00 0.00 C ATOM 0 H VAL A 96 14.749 1.114 4.052 1.00 0.00 H new ATOM 0 HA VAL A 96 12.325 -0.223 4.710 1.00 0.00 H new ATOM 0 HB VAL A 96 12.916 0.904 2.583 1.00 0.00 H new ATOM 0 HG11 VAL A 96 14.196 -0.368 0.897 1.00 0.00 H new ATOM 0 HG12 VAL A 96 15.197 0.076 2.300 1.00 0.00 H new ATOM 0 HG13 VAL A 96 14.592 -1.589 2.129 1.00 0.00 H new ATOM 0 HG21 VAL A 96 11.769 -0.753 1.155 1.00 0.00 H new ATOM 0 HG22 VAL A 96 12.028 -1.996 2.402 1.00 0.00 H new ATOM 0 HG23 VAL A 96 10.990 -0.592 2.747 1.00 0.00 H new ATOM 1489 N GLU A 97 12.825 -2.544 5.203 1.00 0.00 N ATOM 1490 CA GLU A 97 13.104 -3.917 5.585 1.00 0.00 C ATOM 1491 C GLU A 97 12.928 -4.849 4.385 1.00 0.00 C ATOM 1492 O GLU A 97 13.811 -5.650 4.081 1.00 0.00 O ATOM 1493 CB GLU A 97 12.216 -4.353 6.752 1.00 0.00 C ATOM 1494 CG GLU A 97 12.583 -5.761 7.225 1.00 0.00 C ATOM 1495 CD GLU A 97 11.515 -6.319 8.168 1.00 0.00 C ATOM 1496 OE1 GLU A 97 10.546 -6.909 7.642 1.00 0.00 O ATOM 1497 OE2 GLU A 97 11.690 -6.142 9.393 1.00 0.00 O ATOM 0 H GLU A 97 11.893 -2.213 5.452 1.00 0.00 H new ATOM 0 HA GLU A 97 14.140 -3.977 5.917 1.00 0.00 H new ATOM 0 HB2 GLU A 97 12.323 -3.649 7.577 1.00 0.00 H new ATOM 0 HB3 GLU A 97 11.170 -4.329 6.446 1.00 0.00 H new ATOM 0 HG2 GLU A 97 12.693 -6.420 6.364 1.00 0.00 H new ATOM 0 HG3 GLU A 97 13.546 -5.738 7.734 1.00 0.00 H new ATOM 1504 N GLY A 98 11.782 -4.713 3.734 1.00 0.00 N ATOM 1505 CA GLY A 98 11.479 -5.533 2.573 1.00 0.00 C ATOM 1506 C GLY A 98 10.522 -4.807 1.624 1.00 0.00 C ATOM 1507 O GLY A 98 9.898 -3.817 2.003 1.00 0.00 O ATOM 0 H GLY A 98 11.052 -4.047 3.988 1.00 0.00 H new ATOM 0 HA2 GLY A 98 12.401 -5.780 2.047 1.00 0.00 H new ATOM 0 HA3 GLY A 98 11.034 -6.475 2.894 1.00 0.00 H new ATOM 1511 N ILE A 99 10.437 -5.329 0.409 1.00 0.00 N ATOM 1512 CA ILE A 99 9.567 -4.743 -0.597 1.00 0.00 C ATOM 1513 C ILE A 99 8.650 -5.828 -1.166 1.00 0.00 C ATOM 1514 O ILE A 99 9.040 -6.991 -1.255 1.00 0.00 O ATOM 1515 CB ILE A 99 10.391 -4.015 -1.660 1.00 0.00 C ATOM 1516 CG1 ILE A 99 11.734 -4.712 -1.885 1.00 0.00 C ATOM 1517 CG2 ILE A 99 10.564 -2.537 -1.303 1.00 0.00 C ATOM 1518 CD1 ILE A 99 12.371 -4.264 -3.202 1.00 0.00 C ATOM 0 H ILE A 99 10.956 -6.151 0.099 1.00 0.00 H new ATOM 0 HA ILE A 99 8.925 -3.984 -0.150 1.00 0.00 H new ATOM 0 HB ILE A 99 9.845 -4.056 -2.603 1.00 0.00 H new ATOM 0 HG12 ILE A 99 12.407 -4.489 -1.057 1.00 0.00 H new ATOM 0 HG13 ILE A 99 11.590 -5.792 -1.896 1.00 0.00 H new ATOM 0 HG21 ILE A 99 11.154 -2.043 -2.075 1.00 0.00 H new ATOM 0 HG22 ILE A 99 9.585 -2.062 -1.234 1.00 0.00 H new ATOM 0 HG23 ILE A 99 11.077 -2.452 -0.345 1.00 0.00 H new ATOM 0 HD11 ILE A 99 13.324 -4.775 -3.337 1.00 0.00 H new ATOM 0 HD12 ILE A 99 11.707 -4.511 -4.030 1.00 0.00 H new ATOM 0 HD13 ILE A 99 12.536 -3.187 -3.178 1.00 0.00 H new ATOM 1530 N TYR A 100 7.449 -5.409 -1.536 1.00 0.00 N ATOM 1531 CA TYR A 100 6.473 -6.330 -2.093 1.00 0.00 C ATOM 1532 C TYR A 100 5.718 -5.689 -3.259 1.00 0.00 C ATOM 1533 O TYR A 100 5.878 -4.500 -3.529 1.00 0.00 O ATOM 1534 CB TYR A 100 5.485 -6.632 -0.965 1.00 0.00 C ATOM 1535 CG TYR A 100 6.149 -7.043 0.350 1.00 0.00 C ATOM 1536 CD1 TYR A 100 6.778 -6.096 1.132 1.00 0.00 C ATOM 1537 CD2 TYR A 100 6.119 -8.362 0.756 1.00 0.00 C ATOM 1538 CE1 TYR A 100 7.403 -6.483 2.370 1.00 0.00 C ATOM 1539 CE2 TYR A 100 6.744 -8.750 1.994 1.00 0.00 C ATOM 1540 CZ TYR A 100 7.355 -7.791 2.740 1.00 0.00 C ATOM 1541 OH TYR A 100 7.946 -8.157 3.909 1.00 0.00 O ATOM 0 H TYR A 100 7.129 -4.443 -1.461 1.00 0.00 H new ATOM 0 HA TYR A 100 6.964 -7.228 -2.469 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.869 -5.750 -0.789 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.815 -7.429 -1.287 1.00 0.00 H new ATOM 0 HD1 TYR A 100 6.802 -5.064 0.815 1.00 0.00 H new ATOM 0 HD2 TYR A 100 5.626 -9.104 0.145 1.00 0.00 H new ATOM 0 HE1 TYR A 100 7.899 -5.751 2.991 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.728 -9.779 2.322 1.00 0.00 H new ATOM 0 HH TYR A 100 7.348 -7.948 4.657 1.00 0.00 H new ATOM 1551 N LYS A 101 4.910 -6.506 -3.919 1.00 0.00 N ATOM 1552 CA LYS A 101 4.129 -6.033 -5.050 1.00 0.00 C ATOM 1553 C LYS A 101 2.678 -6.494 -4.891 1.00 0.00 C ATOM 1554 O LYS A 101 2.299 -7.009 -3.840 1.00 0.00 O ATOM 1555 CB LYS A 101 4.772 -6.473 -6.367 1.00 0.00 C ATOM 1556 CG LYS A 101 4.942 -7.993 -6.413 1.00 0.00 C ATOM 1557 CD LYS A 101 3.800 -8.648 -7.193 1.00 0.00 C ATOM 1558 CE LYS A 101 4.338 -9.670 -8.197 1.00 0.00 C ATOM 1559 NZ LYS A 101 4.892 -8.986 -9.387 1.00 0.00 N ATOM 0 H LYS A 101 4.779 -7.492 -3.693 1.00 0.00 H new ATOM 0 HA LYS A 101 4.118 -4.943 -5.075 1.00 0.00 H new ATOM 0 HB2 LYS A 101 4.155 -6.147 -7.204 1.00 0.00 H new ATOM 0 HB3 LYS A 101 5.743 -5.991 -6.481 1.00 0.00 H new ATOM 0 HG2 LYS A 101 5.895 -8.242 -6.879 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.969 -8.391 -5.398 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.116 -9.138 -6.500 1.00 0.00 H new ATOM 0 HD3 LYS A 101 3.228 -7.883 -7.718 1.00 0.00 H new ATOM 0 HE2 LYS A 101 5.111 -10.278 -7.727 1.00 0.00 H new ATOM 0 HE3 LYS A 101 3.539 -10.347 -8.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 5.253 -9.694 -10.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 4.145 -8.425 -9.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 5.668 -8.358 -9.096 1.00 0.00 H new ATOM 1573 N TYR A 102 1.907 -6.291 -5.948 1.00 0.00 N ATOM 1574 CA TYR A 102 0.507 -6.679 -5.939 1.00 0.00 C ATOM 1575 C TYR A 102 0.109 -7.329 -7.266 1.00 0.00 C ATOM 1576 O TYR A 102 0.081 -6.667 -8.302 1.00 0.00 O ATOM 1577 CB TYR A 102 -0.288 -5.384 -5.761 1.00 0.00 C ATOM 1578 CG TYR A 102 -1.794 -5.543 -5.977 1.00 0.00 C ATOM 1579 CD1 TYR A 102 -2.318 -5.496 -7.253 1.00 0.00 C ATOM 1580 CD2 TYR A 102 -2.630 -5.735 -4.895 1.00 0.00 C ATOM 1581 CE1 TYR A 102 -3.735 -5.647 -7.456 1.00 0.00 C ATOM 1582 CE2 TYR A 102 -4.048 -5.885 -5.098 1.00 0.00 C ATOM 1583 CZ TYR A 102 -4.530 -5.834 -6.368 1.00 0.00 C ATOM 1584 OH TYR A 102 -5.869 -5.976 -6.560 1.00 0.00 O ATOM 0 H TYR A 102 2.225 -5.863 -6.817 1.00 0.00 H new ATOM 0 HA TYR A 102 0.314 -7.401 -5.145 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -0.114 -4.998 -4.756 1.00 0.00 H new ATOM 0 HB3 TYR A 102 0.092 -4.638 -6.459 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -1.664 -5.346 -8.100 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -2.221 -5.773 -3.896 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -4.157 -5.613 -8.449 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -4.713 -6.035 -4.260 1.00 0.00 H new ATOM 0 HH TYR A 102 -6.032 -6.387 -7.435 1.00 0.00 H new ATOM 1594 N ASN A 103 -0.189 -8.618 -7.190 1.00 0.00 N ATOM 1595 CA ASN A 103 -0.584 -9.364 -8.372 1.00 0.00 C ATOM 1596 C ASN A 103 -1.940 -8.853 -8.864 1.00 0.00 C ATOM 1597 O ASN A 103 -2.978 -9.196 -8.301 1.00 0.00 O ATOM 1598 CB ASN A 103 -0.726 -10.855 -8.060 1.00 0.00 C ATOM 1599 CG ASN A 103 0.271 -11.684 -8.872 1.00 0.00 C ATOM 1600 OD1 ASN A 103 -0.014 -12.153 -9.962 1.00 0.00 O ATOM 1601 ND2 ASN A 103 1.453 -11.837 -8.283 1.00 0.00 N ATOM 0 H ASN A 103 -0.165 -9.164 -6.329 1.00 0.00 H new ATOM 0 HA ASN A 103 0.186 -9.226 -9.131 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -0.563 -11.024 -6.996 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -1.742 -11.181 -8.283 1.00 0.00 H new ATOM 0 HD21 ASN A 103 2.187 -12.374 -8.745 1.00 0.00 H new ATOM 0 HD22 ASN A 103 1.626 -11.418 -7.369 1.00 0.00 H new ATOM 1608 N SER A 104 -1.886 -8.040 -9.909 1.00 0.00 N ATOM 1609 CA SER A 104 -3.097 -7.478 -10.483 1.00 0.00 C ATOM 1610 C SER A 104 -3.804 -8.527 -11.343 1.00 0.00 C ATOM 1611 O SER A 104 -4.845 -8.249 -11.937 1.00 0.00 O ATOM 1612 CB SER A 104 -2.785 -6.233 -11.315 1.00 0.00 C ATOM 1613 OG SER A 104 -3.531 -5.099 -10.880 1.00 0.00 O ATOM 0 H SER A 104 -1.023 -7.757 -10.373 1.00 0.00 H new ATOM 0 HA SER A 104 -3.757 -7.181 -9.667 1.00 0.00 H new ATOM 0 HB2 SER A 104 -1.720 -6.012 -11.251 1.00 0.00 H new ATOM 0 HB3 SER A 104 -3.007 -6.433 -12.363 1.00 0.00 H new ATOM 0 HG SER A 104 -3.302 -4.324 -11.435 1.00 0.00 H new ATOM 1619 N ASP A 105 -3.211 -9.712 -11.382 1.00 0.00 N ATOM 1620 CA ASP A 105 -3.772 -10.804 -12.159 1.00 0.00 C ATOM 1621 C ASP A 105 -4.310 -11.876 -11.210 1.00 0.00 C ATOM 1622 O ASP A 105 -5.348 -12.480 -11.474 1.00 0.00 O ATOM 1623 CB ASP A 105 -2.708 -11.451 -13.048 1.00 0.00 C ATOM 1624 CG ASP A 105 -2.701 -10.973 -14.501 1.00 0.00 C ATOM 1625 OD1 ASP A 105 -3.792 -10.591 -14.978 1.00 0.00 O ATOM 1626 OD2 ASP A 105 -1.606 -10.999 -15.103 1.00 0.00 O ATOM 0 H ASP A 105 -2.348 -9.939 -10.888 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.567 -10.399 -12.785 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -1.727 -11.259 -12.613 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.855 -12.531 -13.037 1.00 0.00 H new ATOM 1631 N ARG A 106 -3.580 -12.080 -10.123 1.00 0.00 N ATOM 1632 CA ARG A 106 -3.971 -13.069 -9.133 1.00 0.00 C ATOM 1633 C ARG A 106 -4.487 -12.378 -7.869 1.00 0.00 C ATOM 1634 O ARG A 106 -4.769 -13.037 -6.869 1.00 0.00 O ATOM 1635 CB ARG A 106 -2.794 -13.975 -8.766 1.00 0.00 C ATOM 1636 CG ARG A 106 -2.731 -15.192 -9.691 1.00 0.00 C ATOM 1637 CD ARG A 106 -2.614 -16.488 -8.886 1.00 0.00 C ATOM 1638 NE ARG A 106 -3.121 -17.627 -9.684 1.00 0.00 N ATOM 1639 CZ ARG A 106 -4.415 -17.829 -9.968 1.00 0.00 C ATOM 1640 NH1 ARG A 106 -5.341 -16.970 -9.520 1.00 0.00 N ATOM 1641 NH2 ARG A 106 -4.782 -18.890 -10.699 1.00 0.00 N ATOM 0 H ARG A 106 -2.720 -11.577 -9.906 1.00 0.00 H new ATOM 0 HA ARG A 106 -4.763 -13.679 -9.567 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -1.863 -13.413 -8.834 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -2.892 -14.304 -7.732 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -3.625 -15.226 -10.314 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -1.878 -15.099 -10.363 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -1.574 -16.661 -8.609 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -3.180 -16.402 -7.959 1.00 0.00 H new ATOM 0 HE ARG A 106 -2.443 -18.300 -10.040 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -5.061 -16.163 -8.963 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -6.326 -17.123 -9.736 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -4.077 -19.544 -11.039 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -5.767 -19.044 -10.915 1.00 0.00 H new ATOM 1655 N LYS A 107 -4.596 -11.061 -7.955 1.00 0.00 N ATOM 1656 CA LYS A 107 -5.074 -10.274 -6.831 1.00 0.00 C ATOM 1657 C LYS A 107 -4.374 -10.741 -5.553 1.00 0.00 C ATOM 1658 O LYS A 107 -5.017 -10.925 -4.520 1.00 0.00 O ATOM 1659 CB LYS A 107 -6.601 -10.328 -6.750 1.00 0.00 C ATOM 1660 CG LYS A 107 -7.084 -11.745 -6.435 1.00 0.00 C ATOM 1661 CD LYS A 107 -8.535 -11.735 -5.951 1.00 0.00 C ATOM 1662 CE LYS A 107 -9.469 -12.337 -7.003 1.00 0.00 C ATOM 1663 NZ LYS A 107 -10.883 -12.116 -6.628 1.00 0.00 N ATOM 0 H LYS A 107 -4.361 -10.518 -8.786 1.00 0.00 H new ATOM 0 HA LYS A 107 -4.822 -9.222 -6.968 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -6.952 -9.641 -5.980 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -7.031 -9.995 -7.695 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -6.998 -12.368 -7.325 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -6.445 -12.189 -5.672 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -8.616 -12.300 -5.022 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -8.841 -10.712 -5.730 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -9.270 -11.886 -7.975 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -9.275 -13.405 -7.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -11.503 -12.531 -7.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -11.073 -12.567 -5.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -11.068 -11.095 -6.557 1.00 0.00 H new ATOM 1677 N ARG A 108 -3.066 -10.919 -5.665 1.00 0.00 N ATOM 1678 CA ARG A 108 -2.271 -11.361 -4.531 1.00 0.00 C ATOM 1679 C ARG A 108 -1.103 -10.401 -4.295 1.00 0.00 C ATOM 1680 O ARG A 108 -0.996 -9.373 -4.962 1.00 0.00 O ATOM 1681 CB ARG A 108 -1.725 -12.772 -4.758 1.00 0.00 C ATOM 1682 CG ARG A 108 -2.807 -13.825 -4.512 1.00 0.00 C ATOM 1683 CD ARG A 108 -2.238 -15.030 -3.758 1.00 0.00 C ATOM 1684 NE ARG A 108 -1.919 -16.117 -4.710 1.00 0.00 N ATOM 1685 CZ ARG A 108 -1.722 -17.394 -4.353 1.00 0.00 C ATOM 1686 NH1 ARG A 108 -1.811 -17.751 -3.065 1.00 0.00 N ATOM 1687 NH2 ARG A 108 -1.437 -18.313 -5.285 1.00 0.00 N ATOM 0 H ARG A 108 -2.537 -10.765 -6.523 1.00 0.00 H new ATOM 0 HA ARG A 108 -2.920 -11.371 -3.655 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -1.351 -12.861 -5.778 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -0.881 -12.951 -4.092 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -3.624 -13.386 -3.939 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -3.225 -14.152 -5.464 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -1.341 -14.738 -3.213 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -2.959 -15.381 -3.020 1.00 0.00 H new ATOM 0 HE ARG A 108 -1.844 -15.880 -5.699 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -2.029 -17.051 -2.356 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -1.661 -18.723 -2.794 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -1.370 -18.041 -6.266 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -1.287 -19.285 -5.014 1.00 0.00 H new ATOM 1701 N PHE A 109 -0.258 -10.771 -3.344 1.00 0.00 N ATOM 1702 CA PHE A 109 0.898 -9.955 -3.012 1.00 0.00 C ATOM 1703 C PHE A 109 2.176 -10.795 -3.001 1.00 0.00 C ATOM 1704 O PHE A 109 2.180 -11.921 -2.504 1.00 0.00 O ATOM 1705 CB PHE A 109 0.659 -9.393 -1.609 1.00 0.00 C ATOM 1706 CG PHE A 109 0.006 -8.009 -1.596 1.00 0.00 C ATOM 1707 CD1 PHE A 109 0.780 -6.891 -1.640 1.00 0.00 C ATOM 1708 CD2 PHE A 109 -1.348 -7.897 -1.541 1.00 0.00 C ATOM 1709 CE1 PHE A 109 0.173 -5.607 -1.628 1.00 0.00 C ATOM 1710 CE2 PHE A 109 -1.955 -6.613 -1.529 1.00 0.00 C ATOM 1711 CZ PHE A 109 -1.181 -5.495 -1.573 1.00 0.00 C ATOM 0 H PHE A 109 -0.351 -11.624 -2.793 1.00 0.00 H new ATOM 0 HA PHE A 109 1.021 -9.164 -3.752 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.028 -10.087 -1.054 1.00 0.00 H new ATOM 0 HB3 PHE A 109 1.612 -9.339 -1.083 1.00 0.00 H new ATOM 0 HD1 PHE A 109 1.855 -6.980 -1.684 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -1.962 -8.785 -1.506 1.00 0.00 H new ATOM 0 HE1 PHE A 109 0.787 -4.719 -1.663 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -3.030 -6.524 -1.485 1.00 0.00 H new ATOM 0 HZ PHE A 109 -1.642 -4.518 -1.564 1.00 0.00 H new ATOM 1721 N THR A 110 3.232 -10.216 -3.555 1.00 0.00 N ATOM 1722 CA THR A 110 4.514 -10.897 -3.615 1.00 0.00 C ATOM 1723 C THR A 110 5.608 -10.031 -2.988 1.00 0.00 C ATOM 1724 O THR A 110 5.474 -8.810 -2.918 1.00 0.00 O ATOM 1725 CB THR A 110 4.788 -11.260 -5.076 1.00 0.00 C ATOM 1726 OG1 THR A 110 3.679 -12.075 -5.445 1.00 0.00 O ATOM 1727 CG2 THR A 110 5.998 -12.184 -5.232 1.00 0.00 C ATOM 0 H THR A 110 3.225 -9.283 -3.966 1.00 0.00 H new ATOM 0 HA THR A 110 4.500 -11.819 -3.033 1.00 0.00 H new ATOM 0 HB THR A 110 4.950 -10.349 -5.652 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.775 -12.354 -6.380 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.149 -12.411 -6.287 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.886 -11.691 -4.836 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.822 -13.109 -4.683 1.00 0.00 H new ATOM 1735 N GLN A 111 6.666 -10.696 -2.549 1.00 0.00 N ATOM 1736 CA GLN A 111 7.783 -10.002 -1.931 1.00 0.00 C ATOM 1737 C GLN A 111 8.968 -9.938 -2.896 1.00 0.00 C ATOM 1738 O GLN A 111 9.658 -10.935 -3.103 1.00 0.00 O ATOM 1739 CB GLN A 111 8.183 -10.671 -0.614 1.00 0.00 C ATOM 1740 CG GLN A 111 9.457 -10.043 -0.045 1.00 0.00 C ATOM 1741 CD GLN A 111 9.718 -10.530 1.382 1.00 0.00 C ATOM 1742 OE1 GLN A 111 9.515 -11.685 1.718 1.00 0.00 O ATOM 1743 NE2 GLN A 111 10.179 -9.588 2.200 1.00 0.00 N ATOM 0 H GLN A 111 6.774 -11.709 -2.609 1.00 0.00 H new ATOM 0 HA GLN A 111 7.471 -8.983 -1.703 1.00 0.00 H new ATOM 0 HB2 GLN A 111 7.372 -10.575 0.108 1.00 0.00 H new ATOM 0 HB3 GLN A 111 8.340 -11.737 -0.777 1.00 0.00 H new ATOM 0 HG2 GLN A 111 10.306 -10.295 -0.680 1.00 0.00 H new ATOM 0 HG3 GLN A 111 9.366 -8.957 -0.051 1.00 0.00 H new ATOM 0 HE21 GLN A 111 10.327 -8.640 1.854 1.00 0.00 H new ATOM 0 HE22 GLN A 111 10.385 -9.814 3.173 1.00 0.00 H new ATOM 1752 N ILE A 112 9.168 -8.756 -3.460 1.00 0.00 N ATOM 1753 CA ILE A 112 10.258 -8.549 -4.398 1.00 0.00 C ATOM 1754 C ILE A 112 11.504 -9.280 -3.895 1.00 0.00 C ATOM 1755 O ILE A 112 11.780 -9.291 -2.696 1.00 0.00 O ATOM 1756 CB ILE A 112 10.478 -7.055 -4.643 1.00 0.00 C ATOM 1757 CG1 ILE A 112 9.156 -6.287 -4.571 1.00 0.00 C ATOM 1758 CG2 ILE A 112 11.207 -6.818 -5.967 1.00 0.00 C ATOM 1759 CD1 ILE A 112 8.054 -7.018 -5.340 1.00 0.00 C ATOM 0 H ILE A 112 8.593 -7.932 -3.285 1.00 0.00 H new ATOM 0 HA ILE A 112 10.009 -8.974 -5.370 1.00 0.00 H new ATOM 0 HB ILE A 112 11.118 -6.669 -3.850 1.00 0.00 H new ATOM 0 HG12 ILE A 112 8.858 -6.166 -3.530 1.00 0.00 H new ATOM 0 HG13 ILE A 112 9.290 -5.287 -4.983 1.00 0.00 H new ATOM 0 HG21 ILE A 112 11.351 -5.748 -6.117 1.00 0.00 H new ATOM 0 HG22 ILE A 112 12.177 -7.314 -5.942 1.00 0.00 H new ATOM 0 HG23 ILE A 112 10.613 -7.223 -6.787 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.126 -6.451 -5.273 1.00 0.00 H new ATOM 0 HD12 ILE A 112 8.344 -7.116 -6.386 1.00 0.00 H new ATOM 0 HD13 ILE A 112 7.906 -8.009 -4.910 1.00 0.00 H new ATOM 1771 N PRO A 113 12.243 -9.888 -4.861 1.00 0.00 N ATOM 1772 CA PRO A 113 13.454 -10.620 -4.527 1.00 0.00 C ATOM 1773 C PRO A 113 14.602 -9.661 -4.204 1.00 0.00 C ATOM 1774 O PRO A 113 15.683 -10.094 -3.807 1.00 0.00 O ATOM 1775 CB PRO A 113 13.733 -11.493 -5.740 1.00 0.00 C ATOM 1776 CG PRO A 113 12.941 -10.881 -6.884 1.00 0.00 C ATOM 1777 CD PRO A 113 11.947 -9.896 -6.290 1.00 0.00 C ATOM 0 HA PRO A 113 13.343 -11.230 -3.631 1.00 0.00 H new ATOM 0 HB2 PRO A 113 14.798 -11.514 -5.970 1.00 0.00 H new ATOM 0 HB3 PRO A 113 13.426 -12.523 -5.559 1.00 0.00 H new ATOM 0 HG2 PRO A 113 13.608 -10.376 -7.582 1.00 0.00 H new ATOM 0 HG3 PRO A 113 12.420 -11.657 -7.445 1.00 0.00 H new ATOM 0 HD2 PRO A 113 12.065 -8.903 -6.725 1.00 0.00 H new ATOM 0 HD3 PRO A 113 10.920 -10.207 -6.480 1.00 0.00 H new ATOM 1785 N ALA A 114 14.328 -8.378 -4.385 1.00 0.00 N ATOM 1786 CA ALA A 114 15.324 -7.355 -4.117 1.00 0.00 C ATOM 1787 C ALA A 114 14.895 -6.538 -2.897 1.00 0.00 C ATOM 1788 O ALA A 114 13.728 -6.560 -2.510 1.00 0.00 O ATOM 1789 CB ALA A 114 15.511 -6.486 -5.363 1.00 0.00 C ATOM 0 H ALA A 114 13.430 -8.023 -4.714 1.00 0.00 H new ATOM 0 HA ALA A 114 16.288 -7.809 -3.887 1.00 0.00 H new ATOM 0 HB1 ALA A 114 16.258 -5.718 -5.162 1.00 0.00 H new ATOM 0 HB2 ALA A 114 15.844 -7.108 -6.194 1.00 0.00 H new ATOM 0 HB3 ALA A 114 14.564 -6.012 -5.621 1.00 0.00 H new ATOM 1795 N LYS A 115 15.863 -5.837 -2.324 1.00 0.00 N ATOM 1796 CA LYS A 115 15.600 -5.015 -1.155 1.00 0.00 C ATOM 1797 C LYS A 115 15.678 -3.539 -1.547 1.00 0.00 C ATOM 1798 O LYS A 115 15.568 -2.659 -0.694 1.00 0.00 O ATOM 1799 CB LYS A 115 16.539 -5.398 -0.009 1.00 0.00 C ATOM 1800 CG LYS A 115 15.777 -6.115 1.108 1.00 0.00 C ATOM 1801 CD LYS A 115 15.550 -7.587 0.759 1.00 0.00 C ATOM 1802 CE LYS A 115 14.820 -8.312 1.892 1.00 0.00 C ATOM 1803 NZ LYS A 115 15.144 -9.756 1.876 1.00 0.00 N ATOM 0 H LYS A 115 16.830 -5.822 -2.648 1.00 0.00 H new ATOM 0 HA LYS A 115 14.591 -5.193 -0.783 1.00 0.00 H new ATOM 0 HB2 LYS A 115 17.333 -6.043 -0.385 1.00 0.00 H new ATOM 0 HB3 LYS A 115 17.017 -4.503 0.389 1.00 0.00 H new ATOM 0 HG2 LYS A 115 16.336 -6.041 2.041 1.00 0.00 H new ATOM 0 HG3 LYS A 115 14.818 -5.624 1.272 1.00 0.00 H new ATOM 0 HD2 LYS A 115 14.968 -7.661 -0.160 1.00 0.00 H new ATOM 0 HD3 LYS A 115 16.508 -8.072 0.570 1.00 0.00 H new ATOM 0 HE2 LYS A 115 15.105 -7.880 2.851 1.00 0.00 H new ATOM 0 HE3 LYS A 115 13.744 -8.173 1.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 14.641 -10.233 2.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 14.850 -10.168 0.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 16.169 -9.883 1.999 1.00 0.00 H new ATOM 1817 N THR A 116 15.868 -3.312 -2.838 1.00 0.00 N ATOM 1818 CA THR A 116 15.963 -1.956 -3.354 1.00 0.00 C ATOM 1819 C THR A 116 14.641 -1.539 -4.001 1.00 0.00 C ATOM 1820 O THR A 116 13.870 -2.386 -4.449 1.00 0.00 O ATOM 1821 CB THR A 116 17.154 -1.897 -4.313 1.00 0.00 C ATOM 1822 OG1 THR A 116 18.200 -2.559 -3.607 1.00 0.00 O ATOM 1823 CG2 THR A 116 17.678 -0.473 -4.508 1.00 0.00 C ATOM 0 H THR A 116 15.959 -4.044 -3.543 1.00 0.00 H new ATOM 0 HA THR A 116 16.138 -1.239 -2.552 1.00 0.00 H new ATOM 0 HB THR A 116 16.865 -2.312 -5.278 1.00 0.00 H new ATOM 0 HG1 THR A 116 19.011 -2.568 -4.157 1.00 0.00 H new ATOM 0 HG21 THR A 116 18.522 -0.487 -5.197 1.00 0.00 H new ATOM 0 HG22 THR A 116 16.886 0.153 -4.918 1.00 0.00 H new ATOM 0 HG23 THR A 116 18.000 -0.069 -3.548 1.00 0.00 H new ATOM 1831 N MET A 117 14.419 -0.233 -4.029 1.00 0.00 N ATOM 1832 CA MET A 117 13.204 0.308 -4.613 1.00 0.00 C ATOM 1833 C MET A 117 13.119 -0.021 -6.105 1.00 0.00 C ATOM 1834 O MET A 117 14.135 -0.299 -6.741 1.00 0.00 O ATOM 1835 CB MET A 117 13.176 1.826 -4.423 1.00 0.00 C ATOM 1836 CG MET A 117 12.203 2.221 -3.311 1.00 0.00 C ATOM 1837 SD MET A 117 12.730 1.516 -1.758 1.00 0.00 S ATOM 1838 CE MET A 117 11.228 0.684 -1.269 1.00 0.00 C ATOM 0 H MET A 117 15.061 0.467 -3.656 1.00 0.00 H new ATOM 0 HA MET A 117 12.350 -0.145 -4.110 1.00 0.00 H new ATOM 0 HB2 MET A 117 14.176 2.184 -4.180 1.00 0.00 H new ATOM 0 HB3 MET A 117 12.883 2.308 -5.356 1.00 0.00 H new ATOM 0 HG2 MET A 117 12.154 3.307 -3.229 1.00 0.00 H new ATOM 0 HG3 MET A 117 11.199 1.874 -3.555 1.00 0.00 H new ATOM 0 HE1 MET A 117 11.477 -0.249 -0.763 1.00 0.00 H new ATOM 0 HE2 MET A 117 10.662 1.324 -0.592 1.00 0.00 H new ATOM 0 HE3 MET A 117 10.627 0.469 -2.153 1.00 0.00 H new ATOM 1848 N SER A 118 11.899 0.022 -6.620 1.00 0.00 N ATOM 1849 CA SER A 118 11.669 -0.268 -8.025 1.00 0.00 C ATOM 1850 C SER A 118 10.186 -0.095 -8.359 1.00 0.00 C ATOM 1851 O SER A 118 9.338 -0.129 -7.470 1.00 0.00 O ATOM 1852 CB SER A 118 12.131 -1.683 -8.378 1.00 0.00 C ATOM 1853 OG SER A 118 13.514 -1.724 -8.718 1.00 0.00 O ATOM 0 H SER A 118 11.059 0.253 -6.089 1.00 0.00 H new ATOM 0 HA SER A 118 12.253 0.435 -8.619 1.00 0.00 H new ATOM 0 HB2 SER A 118 11.946 -2.346 -7.533 1.00 0.00 H new ATOM 0 HB3 SER A 118 11.541 -2.059 -9.214 1.00 0.00 H new ATOM 0 HG SER A 118 14.027 -1.207 -8.062 1.00 0.00 H new ATOM 1859 N MET A 119 9.920 0.088 -9.644 1.00 0.00 N ATOM 1860 CA MET A 119 8.554 0.266 -10.107 1.00 0.00 C ATOM 1861 C MET A 119 7.766 -1.042 -10.009 1.00 0.00 C ATOM 1862 O MET A 119 6.568 -1.071 -10.286 1.00 0.00 O ATOM 1863 CB MET A 119 8.565 0.748 -11.559 1.00 0.00 C ATOM 1864 CG MET A 119 7.299 1.543 -11.883 1.00 0.00 C ATOM 1865 SD MET A 119 7.650 3.293 -11.845 1.00 0.00 S ATOM 1866 CE MET A 119 7.439 3.613 -10.101 1.00 0.00 C ATOM 0 H MET A 119 10.627 0.117 -10.379 1.00 0.00 H new ATOM 0 HA MET A 119 8.070 1.008 -9.472 1.00 0.00 H new ATOM 0 HB2 MET A 119 9.443 1.370 -11.733 1.00 0.00 H new ATOM 0 HB3 MET A 119 8.643 -0.108 -12.229 1.00 0.00 H new ATOM 0 HG2 MET A 119 6.924 1.260 -12.867 1.00 0.00 H new ATOM 0 HG3 MET A 119 6.516 1.305 -11.163 1.00 0.00 H new ATOM 0 HE1 MET A 119 6.914 4.559 -9.965 1.00 0.00 H new ATOM 0 HE2 MET A 119 6.858 2.808 -9.651 1.00 0.00 H new ATOM 0 HE3 MET A 119 8.416 3.668 -9.620 1.00 0.00 H new ATOM 1876 N SER A 120 8.471 -2.091 -9.613 1.00 0.00 N ATOM 1877 CA SER A 120 7.853 -3.399 -9.475 1.00 0.00 C ATOM 1878 C SER A 120 7.444 -3.633 -8.019 1.00 0.00 C ATOM 1879 O SER A 120 7.173 -4.765 -7.621 1.00 0.00 O ATOM 1880 CB SER A 120 8.797 -4.507 -9.946 1.00 0.00 C ATOM 1881 OG SER A 120 8.755 -4.679 -11.360 1.00 0.00 O ATOM 0 H SER A 120 9.464 -2.062 -9.383 1.00 0.00 H new ATOM 0 HA SER A 120 6.964 -3.425 -10.105 1.00 0.00 H new ATOM 0 HB2 SER A 120 9.816 -4.270 -9.640 1.00 0.00 H new ATOM 0 HB3 SER A 120 8.528 -5.444 -9.459 1.00 0.00 H new ATOM 0 HG SER A 120 9.372 -5.394 -11.621 1.00 0.00 H new ATOM 1887 N VAL A 121 7.412 -2.545 -7.264 1.00 0.00 N ATOM 1888 CA VAL A 121 7.040 -2.617 -5.862 1.00 0.00 C ATOM 1889 C VAL A 121 5.741 -1.839 -5.641 1.00 0.00 C ATOM 1890 O VAL A 121 5.570 -0.746 -6.178 1.00 0.00 O ATOM 1891 CB VAL A 121 8.193 -2.117 -4.989 1.00 0.00 C ATOM 1892 CG1 VAL A 121 7.859 -2.264 -3.503 1.00 0.00 C ATOM 1893 CG2 VAL A 121 9.496 -2.841 -5.332 1.00 0.00 C ATOM 0 H VAL A 121 7.638 -1.608 -7.597 1.00 0.00 H new ATOM 0 HA VAL A 121 6.852 -3.650 -5.570 1.00 0.00 H new ATOM 0 HB VAL A 121 8.335 -1.057 -5.198 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.695 -1.902 -2.905 1.00 0.00 H new ATOM 0 HG12 VAL A 121 6.967 -1.682 -3.271 1.00 0.00 H new ATOM 0 HG13 VAL A 121 7.677 -3.314 -3.273 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.299 -2.466 -4.697 1.00 0.00 H new ATOM 0 HG22 VAL A 121 9.372 -3.911 -5.167 1.00 0.00 H new ATOM 0 HG23 VAL A 121 9.747 -2.662 -6.377 1.00 0.00 H new ATOM 1903 N ASP A 122 4.860 -2.434 -4.851 1.00 0.00 N ATOM 1904 CA ASP A 122 3.582 -1.810 -4.553 1.00 0.00 C ATOM 1905 C ASP A 122 3.346 -1.836 -3.041 1.00 0.00 C ATOM 1906 O ASP A 122 2.269 -1.474 -2.571 1.00 0.00 O ATOM 1907 CB ASP A 122 2.431 -2.564 -5.223 1.00 0.00 C ATOM 1908 CG ASP A 122 2.158 -2.168 -6.676 1.00 0.00 C ATOM 1909 OD1 ASP A 122 3.095 -2.315 -7.490 1.00 0.00 O ATOM 1910 OD2 ASP A 122 1.019 -1.726 -6.939 1.00 0.00 O ATOM 0 H ASP A 122 5.006 -3.341 -4.408 1.00 0.00 H new ATOM 0 HA ASP A 122 3.611 -0.787 -4.929 1.00 0.00 H new ATOM 0 HB2 ASP A 122 2.647 -3.632 -5.188 1.00 0.00 H new ATOM 0 HB3 ASP A 122 1.523 -2.403 -4.641 1.00 0.00 H new ATOM 1915 N ALA A 123 4.372 -2.267 -2.322 1.00 0.00 N ATOM 1916 CA ALA A 123 4.291 -2.344 -0.874 1.00 0.00 C ATOM 1917 C ALA A 123 5.703 -2.428 -0.291 1.00 0.00 C ATOM 1918 O ALA A 123 6.620 -2.923 -0.946 1.00 0.00 O ATOM 1919 CB ALA A 123 3.424 -3.540 -0.474 1.00 0.00 C ATOM 0 H ALA A 123 5.264 -2.567 -2.716 1.00 0.00 H new ATOM 0 HA ALA A 123 3.820 -1.449 -0.469 1.00 0.00 H new ATOM 0 HB1 ALA A 123 3.363 -3.598 0.613 1.00 0.00 H new ATOM 0 HB2 ALA A 123 2.423 -3.418 -0.888 1.00 0.00 H new ATOM 0 HB3 ALA A 123 3.868 -4.457 -0.862 1.00 0.00 H new ATOM 1925 N PHE A 124 5.834 -1.936 0.932 1.00 0.00 N ATOM 1926 CA PHE A 124 7.120 -1.949 1.610 1.00 0.00 C ATOM 1927 C PHE A 124 6.944 -1.788 3.121 1.00 0.00 C ATOM 1928 O PHE A 124 5.993 -1.153 3.575 1.00 0.00 O ATOM 1929 CB PHE A 124 7.921 -0.762 1.072 1.00 0.00 C ATOM 1930 CG PHE A 124 7.532 0.583 1.689 1.00 0.00 C ATOM 1931 CD1 PHE A 124 6.233 0.987 1.674 1.00 0.00 C ATOM 1932 CD2 PHE A 124 8.484 1.373 2.252 1.00 0.00 C ATOM 1933 CE1 PHE A 124 5.872 2.235 2.247 1.00 0.00 C ATOM 1934 CE2 PHE A 124 8.123 2.622 2.825 1.00 0.00 C ATOM 1935 CZ PHE A 124 6.824 3.026 2.810 1.00 0.00 C ATOM 0 H PHE A 124 5.071 -1.526 1.471 1.00 0.00 H new ATOM 0 HA PHE A 124 7.627 -2.897 1.429 1.00 0.00 H new ATOM 0 HB2 PHE A 124 8.981 -0.940 1.253 1.00 0.00 H new ATOM 0 HB3 PHE A 124 7.787 -0.707 -0.008 1.00 0.00 H new ATOM 0 HD1 PHE A 124 5.477 0.359 1.227 1.00 0.00 H new ATOM 0 HD2 PHE A 124 9.515 1.051 2.264 1.00 0.00 H new ATOM 0 HE1 PHE A 124 4.841 2.556 2.236 1.00 0.00 H new ATOM 0 HE2 PHE A 124 8.879 3.250 3.272 1.00 0.00 H new ATOM 0 HZ PHE A 124 6.549 3.975 3.245 1.00 0.00 H new ATOM 1945 N THR A 125 7.876 -2.373 3.859 1.00 0.00 N ATOM 1946 CA THR A 125 7.837 -2.302 5.309 1.00 0.00 C ATOM 1947 C THR A 125 9.185 -1.830 5.857 1.00 0.00 C ATOM 1948 O THR A 125 10.196 -2.511 5.698 1.00 0.00 O ATOM 1949 CB THR A 125 7.412 -3.674 5.838 1.00 0.00 C ATOM 1950 OG1 THR A 125 8.486 -4.535 5.469 1.00 0.00 O ATOM 1951 CG2 THR A 125 6.204 -4.242 5.091 1.00 0.00 C ATOM 0 H THR A 125 8.663 -2.899 3.479 1.00 0.00 H new ATOM 0 HA THR A 125 7.108 -1.566 5.649 1.00 0.00 H new ATOM 0 HB THR A 125 7.177 -3.597 6.900 1.00 0.00 H new ATOM 0 HG1 THR A 125 9.304 -4.007 5.354 1.00 0.00 H new ATOM 0 HG21 THR A 125 5.945 -5.216 5.506 1.00 0.00 H new ATOM 0 HG22 THR A 125 5.357 -3.564 5.200 1.00 0.00 H new ATOM 0 HG23 THR A 125 6.448 -4.351 4.034 1.00 0.00 H new ATOM 1959 N ILE A 126 9.155 -0.667 6.491 1.00 0.00 N ATOM 1960 CA ILE A 126 10.362 -0.095 7.063 1.00 0.00 C ATOM 1961 C ILE A 126 10.864 -0.999 8.191 1.00 0.00 C ATOM 1962 O ILE A 126 10.183 -1.946 8.582 1.00 0.00 O ATOM 1963 CB ILE A 126 10.117 1.351 7.498 1.00 0.00 C ATOM 1964 CG1 ILE A 126 9.193 1.409 8.716 1.00 0.00 C ATOM 1965 CG2 ILE A 126 9.584 2.190 6.334 1.00 0.00 C ATOM 1966 CD1 ILE A 126 9.061 2.841 9.237 1.00 0.00 C ATOM 0 H ILE A 126 8.314 -0.105 6.621 1.00 0.00 H new ATOM 0 HA ILE A 126 11.153 -0.048 6.314 1.00 0.00 H new ATOM 0 HB ILE A 126 11.071 1.784 7.798 1.00 0.00 H new ATOM 0 HG12 ILE A 126 8.209 1.023 8.449 1.00 0.00 H new ATOM 0 HG13 ILE A 126 9.584 0.766 9.504 1.00 0.00 H new ATOM 0 HG21 ILE A 126 9.418 3.214 6.669 1.00 0.00 H new ATOM 0 HG22 ILE A 126 10.310 2.188 5.521 1.00 0.00 H new ATOM 0 HG23 ILE A 126 8.643 1.767 5.981 1.00 0.00 H new ATOM 0 HD11 ILE A 126 8.399 2.854 10.103 1.00 0.00 H new ATOM 0 HD12 ILE A 126 10.043 3.215 9.526 1.00 0.00 H new ATOM 0 HD13 ILE A 126 8.647 3.476 8.454 1.00 0.00 H new ATOM 1978 N GLN A 127 12.051 -0.675 8.683 1.00 0.00 N ATOM 1979 CA GLN A 127 12.651 -1.445 9.758 1.00 0.00 C ATOM 1980 C GLN A 127 11.718 -1.484 10.970 1.00 0.00 C ATOM 1981 O GLN A 127 10.620 -0.930 10.930 1.00 0.00 O ATOM 1982 CB GLN A 127 14.021 -0.880 10.139 1.00 0.00 C ATOM 1983 CG GLN A 127 15.124 -1.477 9.263 1.00 0.00 C ATOM 1984 CD GLN A 127 16.388 -1.748 10.081 1.00 0.00 C ATOM 1985 OE1 GLN A 127 16.340 -2.184 11.220 1.00 0.00 O ATOM 1986 NE2 GLN A 127 17.519 -1.468 9.439 1.00 0.00 N ATOM 0 H GLN A 127 12.613 0.111 8.356 1.00 0.00 H new ATOM 0 HA GLN A 127 12.800 -2.466 9.407 1.00 0.00 H new ATOM 0 HB2 GLN A 127 14.014 0.205 10.031 1.00 0.00 H new ATOM 0 HB3 GLN A 127 14.228 -1.095 11.187 1.00 0.00 H new ATOM 0 HG2 GLN A 127 14.773 -2.405 8.812 1.00 0.00 H new ATOM 0 HG3 GLN A 127 15.355 -0.793 8.446 1.00 0.00 H new ATOM 0 HE21 GLN A 127 17.488 -1.105 8.486 1.00 0.00 H new ATOM 0 HE22 GLN A 127 18.417 -1.616 9.900 1.00 0.00 H new ATOM 1995 N GLY A 128 12.188 -2.143 12.018 1.00 0.00 N ATOM 1996 CA GLY A 128 11.409 -2.261 13.239 1.00 0.00 C ATOM 1997 C GLY A 128 11.882 -1.256 14.291 1.00 0.00 C ATOM 1998 O GLY A 128 11.075 -0.710 15.041 1.00 0.00 O ATOM 0 H GLY A 128 13.099 -2.601 12.047 1.00 0.00 H new ATOM 0 HA2 GLY A 128 10.355 -2.094 13.019 1.00 0.00 H new ATOM 0 HA3 GLY A 128 11.496 -3.273 13.633 1.00 0.00 H new ATOM 2002 N HIS A 129 13.190 -1.042 14.312 1.00 0.00 N ATOM 2003 CA HIS A 129 13.781 -0.112 15.260 1.00 0.00 C ATOM 2004 C HIS A 129 13.209 1.288 15.029 1.00 0.00 C ATOM 2005 O HIS A 129 13.253 2.135 15.920 1.00 0.00 O ATOM 2006 CB HIS A 129 15.308 -0.150 15.178 1.00 0.00 C ATOM 2007 CG HIS A 129 15.870 0.437 13.905 1.00 0.00 C ATOM 2008 ND1 HIS A 129 16.526 -0.324 12.954 1.00 0.00 N ATOM 2009 CD2 HIS A 129 15.865 1.719 13.437 1.00 0.00 C ATOM 2010 CE1 HIS A 129 16.896 0.474 11.963 1.00 0.00 C ATOM 2011 NE2 HIS A 129 16.487 1.739 12.265 1.00 0.00 N ATOM 0 H HIS A 129 13.857 -1.496 13.688 1.00 0.00 H new ATOM 0 HA HIS A 129 13.523 -0.409 16.276 1.00 0.00 H new ATOM 0 HB2 HIS A 129 15.721 0.392 16.029 1.00 0.00 H new ATOM 0 HB3 HIS A 129 15.641 -1.184 15.267 1.00 0.00 H new ATOM 0 HD1 HIS A 129 16.696 -1.328 13.007 1.00 0.00 H new ATOM 0 HD2 HIS A 129 15.429 2.572 13.936 1.00 0.00 H new ATOM 0 HE1 HIS A 129 17.428 0.175 11.072 1.00 0.00 H new ATOM 2019 N LEU A 130 12.686 1.488 13.828 1.00 0.00 N ATOM 2020 CA LEU A 130 12.107 2.772 13.469 1.00 0.00 C ATOM 2021 C LEU A 130 10.928 3.072 14.397 1.00 0.00 C ATOM 2022 O LEU A 130 10.830 4.167 14.948 1.00 0.00 O ATOM 2023 CB LEU A 130 11.742 2.798 11.983 1.00 0.00 C ATOM 2024 CG LEU A 130 12.801 3.377 11.043 1.00 0.00 C ATOM 2025 CD1 LEU A 130 14.211 3.017 11.516 1.00 0.00 C ATOM 2026 CD2 LEU A 130 12.552 2.937 9.599 1.00 0.00 C ATOM 0 H LEU A 130 12.651 0.783 13.092 1.00 0.00 H new ATOM 0 HA LEU A 130 12.835 3.571 13.609 1.00 0.00 H new ATOM 0 HB2 LEU A 130 11.521 1.779 11.666 1.00 0.00 H new ATOM 0 HB3 LEU A 130 10.825 3.375 11.864 1.00 0.00 H new ATOM 0 HG LEU A 130 12.721 4.464 11.067 1.00 0.00 H new ATOM 0 HD11 LEU A 130 14.944 3.441 10.830 1.00 0.00 H new ATOM 0 HD12 LEU A 130 14.374 3.420 12.515 1.00 0.00 H new ATOM 0 HD13 LEU A 130 14.321 1.933 11.540 1.00 0.00 H new ATOM 0 HD21 LEU A 130 13.319 3.362 8.952 1.00 0.00 H new ATOM 0 HD22 LEU A 130 12.589 1.849 9.539 1.00 0.00 H new ATOM 0 HD23 LEU A 130 11.571 3.285 9.277 1.00 0.00 H new ATOM 2038 N TRP A 131 10.061 2.080 14.540 1.00 0.00 N ATOM 2039 CA TRP A 131 8.893 2.224 15.391 1.00 0.00 C ATOM 2040 C TRP A 131 9.377 2.419 16.830 1.00 0.00 C ATOM 2041 O TRP A 131 9.163 3.476 17.422 1.00 0.00 O ATOM 2042 CB TRP A 131 7.950 1.029 15.235 1.00 0.00 C ATOM 2043 CG TRP A 131 7.417 0.839 13.814 1.00 0.00 C ATOM 2044 CD1 TRP A 131 7.707 -0.142 12.948 1.00 0.00 C ATOM 2045 CD2 TRP A 131 6.482 1.696 13.124 1.00 0.00 C ATOM 2046 NE1 TRP A 131 7.031 0.019 11.756 1.00 0.00 N ATOM 2047 CE2 TRP A 131 6.263 1.172 11.866 1.00 0.00 C ATOM 2048 CE3 TRP A 131 5.844 2.874 13.549 1.00 0.00 C ATOM 2049 CZ2 TRP A 131 5.404 1.761 10.930 1.00 0.00 C ATOM 2050 CZ3 TRP A 131 4.989 3.450 12.602 1.00 0.00 C ATOM 2051 CH2 TRP A 131 4.757 2.936 11.332 1.00 0.00 C ATOM 0 H TRP A 131 10.145 1.173 14.080 1.00 0.00 H new ATOM 0 HA TRP A 131 8.309 3.096 15.099 1.00 0.00 H new ATOM 0 HB2 TRP A 131 8.474 0.123 15.540 1.00 0.00 H new ATOM 0 HB3 TRP A 131 7.107 1.153 15.915 1.00 0.00 H new ATOM 0 HD1 TRP A 131 8.385 -0.956 13.157 1.00 0.00 H new ATOM 0 HE1 TRP A 131 7.085 -0.595 10.943 1.00 0.00 H new ATOM 0 HE3 TRP A 131 6.001 3.301 14.529 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 5.249 1.332 9.951 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 4.473 4.358 12.878 1.00 0.00 H new ATOM 0 HH2 TRP A 131 4.081 3.441 10.658 1.00 0.00 H new ATOM 2062 N GLN A 132 10.020 1.384 17.349 1.00 0.00 N ATOM 2063 CA GLN A 132 10.537 1.429 18.707 1.00 0.00 C ATOM 2064 C GLN A 132 12.051 1.214 18.706 1.00 0.00 C ATOM 2065 O GLN A 132 12.548 0.268 18.096 1.00 0.00 O ATOM 2066 CB GLN A 132 9.837 0.397 19.594 1.00 0.00 C ATOM 2067 CG GLN A 132 10.063 -1.022 19.067 1.00 0.00 C ATOM 2068 CD GLN A 132 8.741 -1.786 18.966 1.00 0.00 C ATOM 2069 OE1 GLN A 132 7.801 -1.367 18.312 1.00 0.00 O ATOM 2070 NE2 GLN A 132 8.723 -2.928 19.648 1.00 0.00 N ATOM 0 H GLN A 132 10.195 0.509 16.854 1.00 0.00 H new ATOM 0 HA GLN A 132 10.331 2.416 19.121 1.00 0.00 H new ATOM 0 HB2 GLN A 132 10.213 0.474 20.614 1.00 0.00 H new ATOM 0 HB3 GLN A 132 8.768 0.609 19.631 1.00 0.00 H new ATOM 0 HG2 GLN A 132 10.538 -0.978 18.087 1.00 0.00 H new ATOM 0 HG3 GLN A 132 10.746 -1.555 19.729 1.00 0.00 H new ATOM 0 HE21 GLN A 132 9.546 -3.220 20.175 1.00 0.00 H new ATOM 0 HE22 GLN A 132 7.886 -3.512 19.644 1.00 0.00 H new ATOM 2079 N SER A 133 12.744 2.108 19.396 1.00 0.00 N ATOM 2080 CA SER A 133 14.192 2.028 19.483 1.00 0.00 C ATOM 2081 C SER A 133 14.701 2.945 20.597 1.00 0.00 C ATOM 2082 O SER A 133 13.922 3.670 21.213 1.00 0.00 O ATOM 2083 CB SER A 133 14.845 2.400 18.150 1.00 0.00 C ATOM 2084 OG SER A 133 14.272 3.575 17.584 1.00 0.00 O ATOM 0 H SER A 133 12.329 2.892 19.900 1.00 0.00 H new ATOM 0 HA SER A 133 14.464 0.999 19.716 1.00 0.00 H new ATOM 0 HB2 SER A 133 15.914 2.554 18.300 1.00 0.00 H new ATOM 0 HB3 SER A 133 14.738 1.571 17.450 1.00 0.00 H new ATOM 0 HG SER A 133 13.600 3.323 16.916 1.00 0.00 H new ATOM 2090 N LYS A 134 16.006 2.882 20.822 1.00 0.00 N ATOM 2091 CA LYS A 134 16.628 3.698 21.851 1.00 0.00 C ATOM 2092 C LYS A 134 17.968 4.226 21.336 1.00 0.00 C ATOM 2093 O LYS A 134 18.964 3.503 21.333 1.00 0.00 O ATOM 2094 CB LYS A 134 16.737 2.915 23.161 1.00 0.00 C ATOM 2095 CG LYS A 134 17.569 3.683 24.190 1.00 0.00 C ATOM 2096 CD LYS A 134 17.065 3.418 25.611 1.00 0.00 C ATOM 2097 CE LYS A 134 17.980 4.072 26.648 1.00 0.00 C ATOM 2098 NZ LYS A 134 17.487 3.802 28.017 1.00 0.00 N ATOM 0 H LYS A 134 16.649 2.279 20.309 1.00 0.00 H new ATOM 0 HA LYS A 134 16.009 4.566 22.076 1.00 0.00 H new ATOM 0 HB2 LYS A 134 15.740 2.727 23.561 1.00 0.00 H new ATOM 0 HB3 LYS A 134 17.193 1.943 22.971 1.00 0.00 H new ATOM 0 HG2 LYS A 134 18.615 3.388 24.110 1.00 0.00 H new ATOM 0 HG3 LYS A 134 17.522 4.751 23.977 1.00 0.00 H new ATOM 0 HD2 LYS A 134 16.052 3.805 25.719 1.00 0.00 H new ATOM 0 HD3 LYS A 134 17.017 2.344 25.789 1.00 0.00 H new ATOM 0 HE2 LYS A 134 18.995 3.690 26.539 1.00 0.00 H new ATOM 0 HE3 LYS A 134 18.024 5.147 26.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 18.119 4.253 28.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 16.527 4.188 28.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 17.468 2.776 28.183 1.00 0.00 H new ATOM 2112 N LYS A 135 17.951 5.481 20.913 1.00 0.00 N ATOM 2113 CA LYS A 135 19.152 6.114 20.397 1.00 0.00 C ATOM 2114 C LYS A 135 19.508 5.496 19.044 1.00 0.00 C ATOM 2115 O LYS A 135 19.389 4.286 18.859 1.00 0.00 O ATOM 2116 CB LYS A 135 20.283 6.036 21.426 1.00 0.00 C ATOM 2117 CG LYS A 135 20.763 7.434 21.820 1.00 0.00 C ATOM 2118 CD LYS A 135 22.055 7.797 21.087 1.00 0.00 C ATOM 2119 CE LYS A 135 23.128 8.272 22.069 1.00 0.00 C ATOM 2120 NZ LYS A 135 24.425 7.621 21.775 1.00 0.00 N ATOM 0 H LYS A 135 17.123 6.077 20.917 1.00 0.00 H new ATOM 0 HA LYS A 135 18.980 7.177 20.227 1.00 0.00 H new ATOM 0 HB2 LYS A 135 19.937 5.503 22.312 1.00 0.00 H new ATOM 0 HB3 LYS A 135 21.115 5.464 21.015 1.00 0.00 H new ATOM 0 HG2 LYS A 135 19.990 8.167 21.587 1.00 0.00 H new ATOM 0 HG3 LYS A 135 20.928 7.476 22.897 1.00 0.00 H new ATOM 0 HD2 LYS A 135 22.420 6.931 20.535 1.00 0.00 H new ATOM 0 HD3 LYS A 135 21.855 8.580 20.355 1.00 0.00 H new ATOM 0 HE2 LYS A 135 23.235 9.355 22.004 1.00 0.00 H new ATOM 0 HE3 LYS A 135 22.822 8.042 23.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 25.142 7.955 22.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 24.323 6.590 21.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 24.723 7.861 20.808 1.00 0.00 H new ATOM 2134 N SER A 136 19.939 6.355 18.132 1.00 0.00 N ATOM 2135 CA SER A 136 20.313 5.908 16.801 1.00 0.00 C ATOM 2136 C SER A 136 21.344 6.865 16.198 1.00 0.00 C ATOM 2137 O SER A 136 21.320 8.063 16.475 1.00 0.00 O ATOM 2138 CB SER A 136 19.088 5.806 15.890 1.00 0.00 C ATOM 2139 OG SER A 136 19.131 4.642 15.067 1.00 0.00 O ATOM 0 H SER A 136 20.038 7.358 18.289 1.00 0.00 H new ATOM 0 HA SER A 136 20.754 4.915 16.885 1.00 0.00 H new ATOM 0 HB2 SER A 136 18.184 5.787 16.499 1.00 0.00 H new ATOM 0 HB3 SER A 136 19.029 6.694 15.260 1.00 0.00 H new ATOM 0 HG SER A 136 18.331 4.612 14.501 1.00 0.00 H new ATOM 2145 N GLY A 137 22.225 6.300 15.386 1.00 0.00 N ATOM 2146 CA GLY A 137 23.262 7.088 14.742 1.00 0.00 C ATOM 2147 C GLY A 137 24.415 6.198 14.274 1.00 0.00 C ATOM 2148 O GLY A 137 25.424 6.069 14.965 1.00 0.00 O ATOM 0 H GLY A 137 22.242 5.306 15.159 1.00 0.00 H new ATOM 0 HA2 GLY A 137 22.841 7.623 13.890 1.00 0.00 H new ATOM 0 HA3 GLY A 137 23.637 7.840 15.437 1.00 0.00 H new ATOM 2152 N PRO A 138 24.222 5.592 13.072 1.00 0.00 N ATOM 2153 CA PRO A 138 25.235 4.718 12.503 1.00 0.00 C ATOM 2154 C PRO A 138 26.407 5.528 11.946 1.00 0.00 C ATOM 2155 O PRO A 138 27.564 5.240 12.248 1.00 0.00 O ATOM 2156 CB PRO A 138 24.507 3.915 11.437 1.00 0.00 C ATOM 2157 CG PRO A 138 23.236 4.689 11.128 1.00 0.00 C ATOM 2158 CD PRO A 138 23.040 5.722 12.225 1.00 0.00 C ATOM 0 HA PRO A 138 25.685 4.056 13.243 1.00 0.00 H new ATOM 0 HB2 PRO A 138 25.122 3.802 10.544 1.00 0.00 H new ATOM 0 HB3 PRO A 138 24.276 2.911 11.794 1.00 0.00 H new ATOM 0 HG2 PRO A 138 23.312 5.175 10.155 1.00 0.00 H new ATOM 0 HG3 PRO A 138 22.381 4.015 11.081 1.00 0.00 H new ATOM 0 HD2 PRO A 138 22.957 6.727 11.812 1.00 0.00 H new ATOM 0 HD3 PRO A 138 22.126 5.533 12.788 1.00 0.00 H new ATOM 2166 N SER A 139 26.068 6.524 11.141 1.00 0.00 N ATOM 2167 CA SER A 139 27.078 7.377 10.539 1.00 0.00 C ATOM 2168 C SER A 139 26.442 8.684 10.060 1.00 0.00 C ATOM 2169 O SER A 139 25.236 8.742 9.827 1.00 0.00 O ATOM 2170 CB SER A 139 27.775 6.668 9.376 1.00 0.00 C ATOM 2171 OG SER A 139 26.843 6.143 8.435 1.00 0.00 O ATOM 0 H SER A 139 25.107 6.759 10.892 1.00 0.00 H new ATOM 0 HA SER A 139 27.830 7.603 11.295 1.00 0.00 H new ATOM 0 HB2 SER A 139 28.443 7.367 8.873 1.00 0.00 H new ATOM 0 HB3 SER A 139 28.394 5.859 9.763 1.00 0.00 H new ATOM 0 HG SER A 139 27.327 5.700 7.707 1.00 0.00 H new ATOM 2177 N SER A 140 27.282 9.700 9.927 1.00 0.00 N ATOM 2178 CA SER A 140 26.817 11.001 9.480 1.00 0.00 C ATOM 2179 C SER A 140 27.994 11.975 9.391 1.00 0.00 C ATOM 2180 O SER A 140 28.804 12.061 10.313 1.00 0.00 O ATOM 2181 CB SER A 140 25.741 11.553 10.417 1.00 0.00 C ATOM 2182 OG SER A 140 24.694 12.205 9.702 1.00 0.00 O ATOM 0 H SER A 140 28.282 9.648 10.121 1.00 0.00 H new ATOM 0 HA SER A 140 26.374 10.885 8.491 1.00 0.00 H new ATOM 0 HB2 SER A 140 25.323 10.739 11.009 1.00 0.00 H new ATOM 0 HB3 SER A 140 26.195 12.255 11.116 1.00 0.00 H new ATOM 0 HG SER A 140 24.026 12.542 10.335 1.00 0.00 H new ATOM 2188 N GLY A 141 28.050 12.685 8.274 1.00 0.00 N ATOM 2189 CA GLY A 141 29.114 13.650 8.053 1.00 0.00 C ATOM 2190 C GLY A 141 29.358 13.864 6.558 1.00 0.00 C ATOM 2191 O GLY A 141 29.375 12.908 5.785 1.00 0.00 O ATOM 0 H GLY A 141 27.376 12.611 7.512 1.00 0.00 H new ATOM 0 HA2 GLY A 141 28.853 14.599 8.522 1.00 0.00 H new ATOM 0 HA3 GLY A 141 30.031 13.301 8.529 1.00 0.00 H new TER 2195 GLY A 141