USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1145 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 104 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 106 HIS : no HD1:sc= -0.476 X(o=-0.48,f=-0.035) USER MOD Single : A 4 SER OG : rot 180:sc= -0.111 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0.0242 USER MOD Single : A 13 GLN : amide:sc= 0.0789 K(o=0.079,f=-0.93) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 31 MET CE :methyl -179:sc= 0 (180deg=-0.00261) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 CYS SG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 GLN : amide:sc= 0.906 K(o=0.91,f=-2.3!) USER MOD Single : A 56 ASN : amide:sc= -0.115 K(o=-0.12,f=-1.2!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 161:sc= 1.69 (180deg=1.41) USER MOD Single : A 67 THR OG1 : rot -66:sc= 0.153 USER MOD Single : A 68 MET CE :methyl 173:sc= -0.0146 (180deg=-0.125) USER MOD Single : A 72 CYS SG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -117:sc= -0.46 (180deg=-1.08) USER MOD Single : A 78 SER OG : rot -32:sc= 0.665 USER MOD Single : A 79 CYS SG : rot -84:sc= 0.425 USER MOD Single : A 80 GLN : amide:sc= 0.941 K(o=0.94,f=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0.0398 USER MOD Single : A 88 MET CE :methyl 174:sc= -1.41 (180deg=-1.65) USER MOD Single : A 90 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.054) USER MOD Single : A 91 HIS : no HD1:sc=-0.00164 X(o=-0.0016,f=-0.38) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.0115 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ -116:sc= 1.04 (180deg=-0.827) USER MOD Single : A 126 THR OG1 : rot 180:sc= -0.168 USER MOD Single : A 131 HIS : no HE2:sc= 0.424 K(o=0.42,f=-2.7!) USER MOD Single : A 132 HIS : no HD1:sc= -0.0333 X(o=-0.033,f=-0.11) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 39.622 39.781 -37.601 1.00 0.00 N ATOM 2 CA PRO A 1 38.465 39.075 -37.022 1.00 0.00 C ATOM 3 C PRO A 1 38.800 37.608 -36.733 1.00 0.00 C ATOM 4 O PRO A 1 39.693 37.044 -37.362 1.00 0.00 O ATOM 5 CB PRO A 1 37.348 39.185 -38.070 1.00 0.00 C ATOM 6 CG PRO A 1 38.115 39.220 -39.399 1.00 0.00 C ATOM 7 CD PRO A 1 39.397 39.980 -39.042 1.00 0.00 C ATOM 0 H2 PRO A 1 40.474 39.242 -37.450 1.00 0.00 H new ATOM 0 H3 PRO A 1 39.752 40.681 -37.138 1.00 0.00 H new ATOM 0 HA PRO A 1 38.168 39.512 -36.069 1.00 0.00 H new ATOM 0 HB2 PRO A 1 36.665 38.337 -38.021 1.00 0.00 H new ATOM 0 HB3 PRO A 1 36.749 40.084 -37.927 1.00 0.00 H new ATOM 0 HG2 PRO A 1 38.331 38.217 -39.766 1.00 0.00 H new ATOM 0 HG3 PRO A 1 37.548 39.730 -40.178 1.00 0.00 H new ATOM 0 HD2 PRO A 1 40.242 39.606 -39.620 1.00 0.00 H new ATOM 0 HD3 PRO A 1 39.296 41.040 -39.275 1.00 0.00 H new ATOM 15 N ALA A 2 38.098 36.998 -35.776 1.00 0.00 N ATOM 16 CA ALA A 2 38.257 35.608 -35.372 1.00 0.00 C ATOM 17 C ALA A 2 36.864 35.072 -35.035 1.00 0.00 C ATOM 18 O ALA A 2 35.945 35.861 -34.808 1.00 0.00 O ATOM 19 CB ALA A 2 39.196 35.515 -34.164 1.00 0.00 C ATOM 0 H ALA A 2 37.376 37.482 -35.243 1.00 0.00 H new ATOM 0 HA ALA A 2 38.702 35.014 -36.171 1.00 0.00 H new ATOM 0 HB1 ALA A 2 39.308 34.471 -33.870 1.00 0.00 H new ATOM 0 HB2 ALA A 2 40.171 35.924 -34.429 1.00 0.00 H new ATOM 0 HB3 ALA A 2 38.777 36.083 -33.333 1.00 0.00 H new ATOM 25 N ALA A 3 36.710 33.751 -35.043 1.00 0.00 N ATOM 26 CA ALA A 3 35.489 33.016 -34.750 1.00 0.00 C ATOM 27 C ALA A 3 35.897 31.568 -34.455 1.00 0.00 C ATOM 28 O ALA A 3 37.087 31.250 -34.464 1.00 0.00 O ATOM 29 CB ALA A 3 34.533 33.083 -35.952 1.00 0.00 C ATOM 0 H ALA A 3 37.486 33.128 -35.269 1.00 0.00 H new ATOM 0 HA ALA A 3 34.966 33.444 -33.895 1.00 0.00 H new ATOM 0 HB1 ALA A 3 33.622 32.530 -35.723 1.00 0.00 H new ATOM 0 HB2 ALA A 3 34.283 34.123 -36.161 1.00 0.00 H new ATOM 0 HB3 ALA A 3 35.015 32.643 -36.825 1.00 0.00 H new ATOM 35 N SER A 4 34.925 30.702 -34.181 1.00 0.00 N ATOM 36 CA SER A 4 35.117 29.289 -33.894 1.00 0.00 C ATOM 37 C SER A 4 33.905 28.561 -34.494 1.00 0.00 C ATOM 38 O SER A 4 32.829 29.168 -34.554 1.00 0.00 O ATOM 39 CB SER A 4 35.206 29.104 -32.371 1.00 0.00 C ATOM 40 OG SER A 4 35.925 27.939 -32.029 1.00 0.00 O ATOM 0 H SER A 4 33.944 30.980 -34.152 1.00 0.00 H new ATOM 0 HA SER A 4 36.035 28.888 -34.323 1.00 0.00 H new ATOM 0 HB2 SER A 4 35.689 29.974 -31.926 1.00 0.00 H new ATOM 0 HB3 SER A 4 34.201 29.048 -31.952 1.00 0.00 H new ATOM 0 HG SER A 4 35.964 27.853 -31.054 1.00 0.00 H new ATOM 46 N PRO A 5 34.043 27.312 -34.972 1.00 0.00 N ATOM 47 CA PRO A 5 32.927 26.569 -35.540 1.00 0.00 C ATOM 48 C PRO A 5 31.969 26.107 -34.430 1.00 0.00 C ATOM 49 O PRO A 5 32.202 26.329 -33.240 1.00 0.00 O ATOM 50 CB PRO A 5 33.576 25.392 -36.278 1.00 0.00 C ATOM 51 CG PRO A 5 34.818 25.106 -35.436 1.00 0.00 C ATOM 52 CD PRO A 5 35.250 26.497 -34.973 1.00 0.00 C ATOM 0 HA PRO A 5 32.319 27.168 -36.217 1.00 0.00 H new ATOM 0 HB2 PRO A 5 32.912 24.529 -36.325 1.00 0.00 H new ATOM 0 HB3 PRO A 5 33.835 25.652 -37.305 1.00 0.00 H new ATOM 0 HG2 PRO A 5 34.592 24.453 -34.593 1.00 0.00 H new ATOM 0 HG3 PRO A 5 35.597 24.615 -36.020 1.00 0.00 H new ATOM 0 HD2 PRO A 5 35.695 26.457 -33.979 1.00 0.00 H new ATOM 0 HD3 PRO A 5 36.002 26.915 -35.642 1.00 0.00 H new ATOM 60 N SER A 6 30.867 25.473 -34.822 1.00 0.00 N ATOM 61 CA SER A 6 29.859 24.951 -33.916 1.00 0.00 C ATOM 62 C SER A 6 29.303 23.659 -34.520 1.00 0.00 C ATOM 63 O SER A 6 29.644 23.304 -35.651 1.00 0.00 O ATOM 64 CB SER A 6 28.781 26.018 -33.683 1.00 0.00 C ATOM 65 OG SER A 6 28.209 25.859 -32.401 1.00 0.00 O ATOM 0 H SER A 6 30.649 25.306 -35.804 1.00 0.00 H new ATOM 0 HA SER A 6 30.278 24.713 -32.938 1.00 0.00 H new ATOM 0 HB2 SER A 6 29.217 27.013 -33.774 1.00 0.00 H new ATOM 0 HB3 SER A 6 28.008 25.938 -34.447 1.00 0.00 H new ATOM 0 HG SER A 6 27.524 26.545 -32.261 1.00 0.00 H new ATOM 71 N ALA A 7 28.492 22.928 -33.756 1.00 0.00 N ATOM 72 CA ALA A 7 27.881 21.674 -34.170 1.00 0.00 C ATOM 73 C ALA A 7 26.561 21.476 -33.432 1.00 0.00 C ATOM 74 O ALA A 7 26.167 22.297 -32.603 1.00 0.00 O ATOM 75 CB ALA A 7 28.830 20.508 -33.876 1.00 0.00 C ATOM 0 H ALA A 7 28.238 23.203 -32.807 1.00 0.00 H new ATOM 0 HA ALA A 7 27.687 21.707 -35.242 1.00 0.00 H new ATOM 0 HB1 ALA A 7 28.365 19.573 -34.189 1.00 0.00 H new ATOM 0 HB2 ALA A 7 29.762 20.651 -34.423 1.00 0.00 H new ATOM 0 HB3 ALA A 7 29.039 20.470 -32.807 1.00 0.00 H new ATOM 81 N LEU A 8 25.870 20.379 -33.742 1.00 0.00 N ATOM 82 CA LEU A 8 24.588 20.009 -33.157 1.00 0.00 C ATOM 83 C LEU A 8 24.678 18.571 -32.650 1.00 0.00 C ATOM 84 O LEU A 8 25.670 17.883 -32.883 1.00 0.00 O ATOM 85 CB LEU A 8 23.454 20.180 -34.188 1.00 0.00 C ATOM 86 CG LEU A 8 23.406 21.591 -34.820 1.00 0.00 C ATOM 87 CD1 LEU A 8 23.989 21.594 -36.240 1.00 0.00 C ATOM 88 CD2 LEU A 8 21.970 22.125 -34.868 1.00 0.00 C ATOM 0 H LEU A 8 26.201 19.703 -34.431 1.00 0.00 H new ATOM 0 HA LEU A 8 24.357 20.665 -32.318 1.00 0.00 H new ATOM 0 HB2 LEU A 8 23.577 19.440 -34.979 1.00 0.00 H new ATOM 0 HB3 LEU A 8 22.499 19.974 -33.704 1.00 0.00 H new ATOM 0 HG LEU A 8 24.013 22.239 -34.188 1.00 0.00 H new ATOM 0 HD11 LEU A 8 23.938 22.602 -36.652 1.00 0.00 H new ATOM 0 HD12 LEU A 8 25.028 21.267 -36.207 1.00 0.00 H new ATOM 0 HD13 LEU A 8 23.415 20.915 -36.871 1.00 0.00 H new ATOM 0 HD21 LEU A 8 21.966 23.118 -35.317 1.00 0.00 H new ATOM 0 HD22 LEU A 8 21.352 21.454 -35.465 1.00 0.00 H new ATOM 0 HD23 LEU A 8 21.569 22.183 -33.856 1.00 0.00 H new ATOM 100 N LYS A 9 23.658 18.112 -31.921 1.00 0.00 N ATOM 101 CA LYS A 9 23.589 16.761 -31.374 1.00 0.00 C ATOM 102 C LYS A 9 22.147 16.289 -31.479 1.00 0.00 C ATOM 103 O LYS A 9 21.239 17.080 -31.225 1.00 0.00 O ATOM 104 CB LYS A 9 24.149 16.697 -29.932 1.00 0.00 C ATOM 105 CG LYS A 9 23.235 17.154 -28.771 1.00 0.00 C ATOM 106 CD LYS A 9 22.901 18.657 -28.745 1.00 0.00 C ATOM 107 CE LYS A 9 21.779 19.019 -27.754 1.00 0.00 C ATOM 108 NZ LYS A 9 22.129 18.829 -26.328 1.00 0.00 N ATOM 0 H LYS A 9 22.844 18.682 -31.692 1.00 0.00 H new ATOM 0 HA LYS A 9 24.223 16.085 -31.948 1.00 0.00 H new ATOM 0 HB2 LYS A 9 24.446 15.667 -29.736 1.00 0.00 H new ATOM 0 HB3 LYS A 9 25.055 17.302 -29.900 1.00 0.00 H new ATOM 0 HG2 LYS A 9 22.302 16.593 -28.823 1.00 0.00 H new ATOM 0 HG3 LYS A 9 23.714 16.889 -27.828 1.00 0.00 H new ATOM 0 HD2 LYS A 9 23.800 19.216 -28.485 1.00 0.00 H new ATOM 0 HD3 LYS A 9 22.607 18.973 -29.746 1.00 0.00 H new ATOM 0 HE2 LYS A 9 21.497 20.060 -27.909 1.00 0.00 H new ATOM 0 HE3 LYS A 9 20.902 18.414 -27.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 21.319 19.096 -25.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 22.369 17.831 -26.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 22.946 19.426 -26.088 1.00 0.00 H new ATOM 122 N GLY A 10 21.946 15.012 -31.785 1.00 0.00 N ATOM 123 CA GLY A 10 20.630 14.411 -31.928 1.00 0.00 C ATOM 124 C GLY A 10 20.781 13.116 -32.707 1.00 0.00 C ATOM 125 O GLY A 10 20.347 13.031 -33.850 1.00 0.00 O ATOM 0 H GLY A 10 22.710 14.355 -31.943 1.00 0.00 H new ATOM 0 HA2 GLY A 10 20.193 14.217 -30.949 1.00 0.00 H new ATOM 0 HA3 GLY A 10 19.956 15.091 -32.449 1.00 0.00 H new ATOM 129 N VAL A 11 21.472 12.140 -32.122 1.00 0.00 N ATOM 130 CA VAL A 11 21.721 10.836 -32.720 1.00 0.00 C ATOM 131 C VAL A 11 21.677 9.802 -31.591 1.00 0.00 C ATOM 132 O VAL A 11 21.794 10.159 -30.415 1.00 0.00 O ATOM 133 CB VAL A 11 23.047 10.889 -33.520 1.00 0.00 C ATOM 134 CG1 VAL A 11 24.285 11.105 -32.633 1.00 0.00 C ATOM 135 CG2 VAL A 11 23.260 9.655 -34.410 1.00 0.00 C ATOM 0 H VAL A 11 21.884 12.240 -31.194 1.00 0.00 H new ATOM 0 HA VAL A 11 20.965 10.542 -33.448 1.00 0.00 H new ATOM 0 HB VAL A 11 22.937 11.762 -34.163 1.00 0.00 H new ATOM 0 HG11 VAL A 11 25.179 11.132 -33.256 1.00 0.00 H new ATOM 0 HG12 VAL A 11 24.188 12.049 -32.096 1.00 0.00 H new ATOM 0 HG13 VAL A 11 24.367 10.287 -31.917 1.00 0.00 H new ATOM 0 HG21 VAL A 11 24.205 9.751 -34.945 1.00 0.00 H new ATOM 0 HG22 VAL A 11 23.283 8.759 -33.790 1.00 0.00 H new ATOM 0 HG23 VAL A 11 22.443 9.579 -35.128 1.00 0.00 H new ATOM 145 N SER A 12 21.562 8.527 -31.949 1.00 0.00 N ATOM 146 CA SER A 12 21.480 7.342 -31.104 1.00 0.00 C ATOM 147 C SER A 12 22.715 7.058 -30.228 1.00 0.00 C ATOM 148 O SER A 12 22.914 5.906 -29.855 1.00 0.00 O ATOM 149 CB SER A 12 21.186 6.147 -32.031 1.00 0.00 C ATOM 150 OG SER A 12 20.212 6.493 -33.005 1.00 0.00 O ATOM 0 H SER A 12 21.520 8.274 -32.936 1.00 0.00 H new ATOM 0 HA SER A 12 20.688 7.517 -30.376 1.00 0.00 H new ATOM 0 HB2 SER A 12 22.104 5.829 -32.525 1.00 0.00 H new ATOM 0 HB3 SER A 12 20.833 5.301 -31.441 1.00 0.00 H new ATOM 0 HG SER A 12 20.041 5.722 -33.585 1.00 0.00 H new ATOM 156 N GLN A 13 23.550 8.046 -29.889 1.00 0.00 N ATOM 157 CA GLN A 13 24.751 7.862 -29.071 1.00 0.00 C ATOM 158 C GLN A 13 24.417 7.089 -27.794 1.00 0.00 C ATOM 159 O GLN A 13 24.982 6.029 -27.560 1.00 0.00 O ATOM 160 CB GLN A 13 25.420 9.219 -28.766 1.00 0.00 C ATOM 161 CG GLN A 13 26.825 9.090 -28.135 1.00 0.00 C ATOM 162 CD GLN A 13 27.871 8.481 -29.079 1.00 0.00 C ATOM 163 OE1 GLN A 13 27.690 8.486 -30.290 1.00 0.00 O ATOM 164 NE2 GLN A 13 28.977 7.953 -28.575 1.00 0.00 N ATOM 0 H GLN A 13 23.407 9.013 -30.181 1.00 0.00 H new ATOM 0 HA GLN A 13 25.470 7.268 -29.635 1.00 0.00 H new ATOM 0 HB2 GLN A 13 25.497 9.792 -29.690 1.00 0.00 H new ATOM 0 HB3 GLN A 13 24.779 9.787 -28.092 1.00 0.00 H new ATOM 0 HG2 GLN A 13 27.164 10.077 -27.819 1.00 0.00 H new ATOM 0 HG3 GLN A 13 26.756 8.475 -27.238 1.00 0.00 H new ATOM 0 HE21 GLN A 13 29.127 7.949 -27.566 1.00 0.00 H new ATOM 0 HE22 GLN A 13 29.679 7.550 -29.196 1.00 0.00 H new ATOM 173 N ALA A 14 23.457 7.568 -26.994 1.00 0.00 N ATOM 174 CA ALA A 14 23.065 6.909 -25.748 1.00 0.00 C ATOM 175 C ALA A 14 22.472 5.505 -25.957 1.00 0.00 C ATOM 176 O ALA A 14 22.348 4.757 -24.988 1.00 0.00 O ATOM 177 CB ALA A 14 22.075 7.799 -24.988 1.00 0.00 C ATOM 0 H ALA A 14 22.933 8.420 -27.193 1.00 0.00 H new ATOM 0 HA ALA A 14 23.974 6.768 -25.163 1.00 0.00 H new ATOM 0 HB1 ALA A 14 21.783 7.308 -24.060 1.00 0.00 H new ATOM 0 HB2 ALA A 14 22.546 8.755 -24.760 1.00 0.00 H new ATOM 0 HB3 ALA A 14 21.191 7.968 -25.603 1.00 0.00 H new ATOM 183 N LEU A 15 22.063 5.150 -27.180 1.00 0.00 N ATOM 184 CA LEU A 15 21.494 3.847 -27.520 1.00 0.00 C ATOM 185 C LEU A 15 22.577 2.889 -28.022 1.00 0.00 C ATOM 186 O LEU A 15 22.433 1.680 -27.868 1.00 0.00 O ATOM 187 CB LEU A 15 20.362 3.989 -28.557 1.00 0.00 C ATOM 188 CG LEU A 15 18.947 4.137 -27.965 1.00 0.00 C ATOM 189 CD1 LEU A 15 18.496 2.870 -27.225 1.00 0.00 C ATOM 190 CD2 LEU A 15 18.823 5.354 -27.040 1.00 0.00 C ATOM 0 H LEU A 15 22.121 5.780 -27.980 1.00 0.00 H new ATOM 0 HA LEU A 15 21.065 3.424 -26.612 1.00 0.00 H new ATOM 0 HB2 LEU A 15 20.570 4.857 -29.182 1.00 0.00 H new ATOM 0 HB3 LEU A 15 20.376 3.116 -29.209 1.00 0.00 H new ATOM 0 HG LEU A 15 18.286 4.293 -28.818 1.00 0.00 H new ATOM 0 HD11 LEU A 15 17.493 3.020 -26.824 1.00 0.00 H new ATOM 0 HD12 LEU A 15 18.488 2.028 -27.917 1.00 0.00 H new ATOM 0 HD13 LEU A 15 19.186 2.661 -26.407 1.00 0.00 H new ATOM 0 HD21 LEU A 15 17.807 5.412 -26.650 1.00 0.00 H new ATOM 0 HD22 LEU A 15 19.525 5.255 -26.212 1.00 0.00 H new ATOM 0 HD23 LEU A 15 19.049 6.261 -27.600 1.00 0.00 H new ATOM 202 N LEU A 16 23.663 3.404 -28.599 1.00 0.00 N ATOM 203 CA LEU A 16 24.772 2.604 -29.108 1.00 0.00 C ATOM 204 C LEU A 16 25.850 2.431 -28.037 1.00 0.00 C ATOM 205 O LEU A 16 26.452 1.366 -27.929 1.00 0.00 O ATOM 206 CB LEU A 16 25.367 3.279 -30.356 1.00 0.00 C ATOM 207 CG LEU A 16 24.415 3.299 -31.571 1.00 0.00 C ATOM 208 CD1 LEU A 16 24.976 4.221 -32.659 1.00 0.00 C ATOM 209 CD2 LEU A 16 24.191 1.900 -32.160 1.00 0.00 C ATOM 0 H LEU A 16 23.797 4.407 -28.727 1.00 0.00 H new ATOM 0 HA LEU A 16 24.397 1.616 -29.377 1.00 0.00 H new ATOM 0 HB2 LEU A 16 25.643 4.304 -30.106 1.00 0.00 H new ATOM 0 HB3 LEU A 16 26.285 2.761 -30.634 1.00 0.00 H new ATOM 0 HG LEU A 16 23.453 3.670 -31.218 1.00 0.00 H new ATOM 0 HD11 LEU A 16 24.299 4.230 -33.513 1.00 0.00 H new ATOM 0 HD12 LEU A 16 25.075 5.232 -32.264 1.00 0.00 H new ATOM 0 HD13 LEU A 16 25.954 3.858 -32.975 1.00 0.00 H new ATOM 0 HD21 LEU A 16 23.514 1.968 -33.012 1.00 0.00 H new ATOM 0 HD22 LEU A 16 25.145 1.486 -32.486 1.00 0.00 H new ATOM 0 HD23 LEU A 16 23.754 1.251 -31.401 1.00 0.00 H new ATOM 221 N GLU A 17 26.078 3.451 -27.210 1.00 0.00 N ATOM 222 CA GLU A 17 27.094 3.443 -26.154 1.00 0.00 C ATOM 223 C GLU A 17 26.790 2.372 -25.125 1.00 0.00 C ATOM 224 O GLU A 17 27.670 1.671 -24.632 1.00 0.00 O ATOM 225 CB GLU A 17 27.153 4.814 -25.465 1.00 0.00 C ATOM 226 CG GLU A 17 27.964 5.825 -26.280 1.00 0.00 C ATOM 227 CD GLU A 17 29.475 5.641 -26.117 1.00 0.00 C ATOM 228 OE1 GLU A 17 29.948 4.508 -25.872 1.00 0.00 O ATOM 229 OE2 GLU A 17 30.197 6.656 -26.176 1.00 0.00 O ATOM 0 H GLU A 17 25.552 4.324 -27.255 1.00 0.00 H new ATOM 0 HA GLU A 17 28.059 3.227 -26.613 1.00 0.00 H new ATOM 0 HB2 GLU A 17 26.141 5.192 -25.320 1.00 0.00 H new ATOM 0 HB3 GLU A 17 27.597 4.705 -24.476 1.00 0.00 H new ATOM 0 HG2 GLU A 17 27.702 5.729 -27.334 1.00 0.00 H new ATOM 0 HG3 GLU A 17 27.690 6.835 -25.974 1.00 0.00 H new ATOM 236 N ARG A 18 25.509 2.206 -24.812 1.00 0.00 N ATOM 237 CA ARG A 18 25.067 1.209 -23.857 1.00 0.00 C ATOM 238 C ARG A 18 25.471 -0.204 -24.277 1.00 0.00 C ATOM 239 O ARG A 18 25.408 -1.074 -23.423 1.00 0.00 O ATOM 240 CB ARG A 18 23.561 1.341 -23.598 1.00 0.00 C ATOM 241 CG ARG A 18 22.782 1.421 -24.914 1.00 0.00 C ATOM 242 CD ARG A 18 21.276 1.422 -24.722 1.00 0.00 C ATOM 243 NE ARG A 18 20.831 2.593 -23.944 1.00 0.00 N ATOM 244 CZ ARG A 18 19.877 2.609 -23.007 1.00 0.00 C ATOM 245 NH1 ARG A 18 19.190 1.507 -22.729 1.00 0.00 N ATOM 246 NH2 ARG A 18 19.600 3.727 -22.353 1.00 0.00 N ATOM 0 H ARG A 18 24.753 2.760 -25.215 1.00 0.00 H new ATOM 0 HA ARG A 18 25.577 1.395 -22.912 1.00 0.00 H new ATOM 0 HB2 ARG A 18 23.212 0.488 -23.016 1.00 0.00 H new ATOM 0 HB3 ARG A 18 23.368 2.233 -23.002 1.00 0.00 H new ATOM 0 HG2 ARG A 18 23.074 2.326 -25.446 1.00 0.00 H new ATOM 0 HG3 ARG A 18 23.060 0.577 -25.545 1.00 0.00 H new ATOM 0 HD2 ARG A 18 20.784 1.422 -25.695 1.00 0.00 H new ATOM 0 HD3 ARG A 18 20.973 0.508 -24.211 1.00 0.00 H new ATOM 0 HE ARG A 18 21.297 3.479 -24.140 1.00 0.00 H new ATOM 0 HH11 ARG A 18 19.389 0.642 -23.231 1.00 0.00 H new ATOM 0 HH12 ARG A 18 18.464 1.526 -22.013 1.00 0.00 H new ATOM 0 HH21 ARG A 18 20.115 4.582 -22.563 1.00 0.00 H new ATOM 0 HH22 ARG A 18 18.871 3.733 -21.639 1.00 0.00 H new ATOM 260 N ILE A 19 25.845 -0.480 -25.536 1.00 0.00 N ATOM 261 CA ILE A 19 26.268 -1.804 -25.988 1.00 0.00 C ATOM 262 C ILE A 19 27.520 -2.193 -25.190 1.00 0.00 C ATOM 263 O ILE A 19 27.512 -3.223 -24.521 1.00 0.00 O ATOM 264 CB ILE A 19 26.470 -1.847 -27.524 1.00 0.00 C ATOM 265 CG1 ILE A 19 25.128 -1.558 -28.245 1.00 0.00 C ATOM 266 CG2 ILE A 19 27.014 -3.220 -27.967 1.00 0.00 C ATOM 267 CD1 ILE A 19 25.260 -1.355 -29.759 1.00 0.00 C ATOM 0 H ILE A 19 25.860 0.223 -26.275 1.00 0.00 H new ATOM 0 HA ILE A 19 25.491 -2.544 -25.796 1.00 0.00 H new ATOM 0 HB ILE A 19 27.198 -1.082 -27.794 1.00 0.00 H new ATOM 0 HG12 ILE A 19 24.443 -2.385 -28.059 1.00 0.00 H new ATOM 0 HG13 ILE A 19 24.678 -0.667 -27.808 1.00 0.00 H new ATOM 0 HG21 ILE A 19 27.148 -3.227 -29.049 1.00 0.00 H new ATOM 0 HG22 ILE A 19 27.972 -3.405 -27.482 1.00 0.00 H new ATOM 0 HG23 ILE A 19 26.307 -4.000 -27.684 1.00 0.00 H new ATOM 0 HD11 ILE A 19 24.277 -1.158 -30.187 1.00 0.00 H new ATOM 0 HD12 ILE A 19 25.918 -0.509 -29.957 1.00 0.00 H new ATOM 0 HD13 ILE A 19 25.679 -2.254 -30.211 1.00 0.00 H new ATOM 279 N ARG A 20 28.597 -1.395 -25.226 1.00 0.00 N ATOM 280 CA ARG A 20 29.807 -1.732 -24.465 1.00 0.00 C ATOM 281 C ARG A 20 29.520 -1.724 -22.963 1.00 0.00 C ATOM 282 O ARG A 20 29.973 -2.606 -22.242 1.00 0.00 O ATOM 283 CB ARG A 20 30.993 -0.820 -24.831 1.00 0.00 C ATOM 284 CG ARG A 20 30.704 0.691 -24.770 1.00 0.00 C ATOM 285 CD ARG A 20 31.805 1.493 -24.082 1.00 0.00 C ATOM 286 NE ARG A 20 31.658 2.936 -24.360 1.00 0.00 N ATOM 287 CZ ARG A 20 32.457 3.943 -23.989 1.00 0.00 C ATOM 288 NH1 ARG A 20 33.479 3.727 -23.160 1.00 0.00 N ATOM 289 NH2 ARG A 20 32.224 5.164 -24.455 1.00 0.00 N ATOM 0 H ARG A 20 28.655 -0.529 -25.762 1.00 0.00 H new ATOM 0 HA ARG A 20 30.103 -2.744 -24.742 1.00 0.00 H new ATOM 0 HB2 ARG A 20 31.822 -1.042 -24.159 1.00 0.00 H new ATOM 0 HB3 ARG A 20 31.324 -1.069 -25.839 1.00 0.00 H new ATOM 0 HG2 ARG A 20 30.570 1.069 -25.784 1.00 0.00 H new ATOM 0 HG3 ARG A 20 29.764 0.852 -24.242 1.00 0.00 H new ATOM 0 HD2 ARG A 20 31.768 1.320 -23.006 1.00 0.00 H new ATOM 0 HD3 ARG A 20 32.780 1.150 -24.427 1.00 0.00 H new ATOM 0 HE ARG A 20 30.839 3.200 -24.907 1.00 0.00 H new ATOM 0 HH11 ARG A 20 33.657 2.788 -22.803 1.00 0.00 H new ATOM 0 HH12 ARG A 20 34.083 4.501 -22.883 1.00 0.00 H new ATOM 0 HH21 ARG A 20 31.442 5.327 -25.089 1.00 0.00 H new ATOM 0 HH22 ARG A 20 32.827 5.939 -24.179 1.00 0.00 H new ATOM 303 N ALA A 21 28.730 -0.760 -22.485 1.00 0.00 N ATOM 304 CA ALA A 21 28.386 -0.644 -21.074 1.00 0.00 C ATOM 305 C ALA A 21 27.478 -1.774 -20.571 1.00 0.00 C ATOM 306 O ALA A 21 27.163 -1.801 -19.385 1.00 0.00 O ATOM 307 CB ALA A 21 27.722 0.705 -20.808 1.00 0.00 C ATOM 0 H ALA A 21 28.312 -0.038 -23.071 1.00 0.00 H new ATOM 0 HA ALA A 21 29.322 -0.724 -20.522 1.00 0.00 H new ATOM 0 HB1 ALA A 21 27.468 0.783 -19.751 1.00 0.00 H new ATOM 0 HB2 ALA A 21 28.409 1.508 -21.077 1.00 0.00 H new ATOM 0 HB3 ALA A 21 26.815 0.788 -21.406 1.00 0.00 H new ATOM 313 N LYS A 22 27.000 -2.672 -21.438 1.00 0.00 N ATOM 314 CA LYS A 22 26.106 -3.760 -21.015 1.00 0.00 C ATOM 315 C LYS A 22 26.726 -4.623 -19.934 1.00 0.00 C ATOM 316 O LYS A 22 26.004 -5.128 -19.077 1.00 0.00 O ATOM 317 CB LYS A 22 25.661 -4.639 -22.174 1.00 0.00 C ATOM 318 CG LYS A 22 24.615 -3.889 -23.007 1.00 0.00 C ATOM 319 CD LYS A 22 23.541 -4.819 -23.514 1.00 0.00 C ATOM 320 CE LYS A 22 22.481 -5.127 -22.455 1.00 0.00 C ATOM 321 NZ LYS A 22 21.716 -6.325 -22.830 1.00 0.00 N ATOM 0 H LYS A 22 27.215 -2.669 -22.435 1.00 0.00 H new ATOM 0 HA LYS A 22 25.225 -3.265 -20.606 1.00 0.00 H new ATOM 0 HB2 LYS A 22 26.517 -4.902 -22.795 1.00 0.00 H new ATOM 0 HB3 LYS A 22 25.242 -5.572 -21.798 1.00 0.00 H new ATOM 0 HG2 LYS A 22 24.162 -3.104 -22.402 1.00 0.00 H new ATOM 0 HG3 LYS A 22 25.102 -3.400 -23.851 1.00 0.00 H new ATOM 0 HD2 LYS A 22 23.060 -4.373 -24.385 1.00 0.00 H new ATOM 0 HD3 LYS A 22 23.999 -5.751 -23.846 1.00 0.00 H new ATOM 0 HE2 LYS A 22 22.958 -5.281 -21.487 1.00 0.00 H new ATOM 0 HE3 LYS A 22 21.808 -4.277 -22.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 21.000 -6.522 -22.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 21.246 -6.165 -23.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 22.360 -7.137 -22.910 1.00 0.00 H new ATOM 335 N GLU A 23 28.036 -4.829 -19.986 1.00 0.00 N ATOM 336 CA GLU A 23 28.706 -5.654 -18.995 1.00 0.00 C ATOM 337 C GLU A 23 28.970 -4.848 -17.714 1.00 0.00 C ATOM 338 O GLU A 23 28.861 -5.394 -16.614 1.00 0.00 O ATOM 339 CB GLU A 23 29.940 -6.300 -19.652 1.00 0.00 C ATOM 340 CG GLU A 23 31.178 -5.394 -19.741 1.00 0.00 C ATOM 341 CD GLU A 23 31.887 -5.248 -18.386 1.00 0.00 C ATOM 342 OE1 GLU A 23 31.890 -6.217 -17.585 1.00 0.00 O ATOM 343 OE2 GLU A 23 32.334 -4.127 -18.063 1.00 0.00 O ATOM 0 H GLU A 23 28.650 -4.438 -20.700 1.00 0.00 H new ATOM 0 HA GLU A 23 28.078 -6.479 -18.658 1.00 0.00 H new ATOM 0 HB2 GLU A 23 30.204 -7.196 -19.091 1.00 0.00 H new ATOM 0 HB3 GLU A 23 29.671 -6.622 -20.658 1.00 0.00 H new ATOM 0 HG2 GLU A 23 31.875 -5.804 -20.472 1.00 0.00 H new ATOM 0 HG3 GLU A 23 30.881 -4.409 -20.102 1.00 0.00 H new ATOM 350 N VAL A 24 29.207 -3.536 -17.841 1.00 0.00 N ATOM 351 CA VAL A 24 29.496 -2.627 -16.733 1.00 0.00 C ATOM 352 C VAL A 24 28.460 -2.716 -15.626 1.00 0.00 C ATOM 353 O VAL A 24 28.799 -2.698 -14.443 1.00 0.00 O ATOM 354 CB VAL A 24 29.736 -1.185 -17.242 1.00 0.00 C ATOM 355 CG1 VAL A 24 30.079 -0.205 -16.109 1.00 0.00 C ATOM 356 CG2 VAL A 24 30.884 -1.135 -18.266 1.00 0.00 C ATOM 0 H VAL A 24 29.202 -3.067 -18.747 1.00 0.00 H new ATOM 0 HA VAL A 24 30.429 -2.951 -16.272 1.00 0.00 H new ATOM 0 HB VAL A 24 28.796 -0.883 -17.705 1.00 0.00 H new ATOM 0 HG11 VAL A 24 30.237 0.790 -16.524 1.00 0.00 H new ATOM 0 HG12 VAL A 24 29.257 -0.174 -15.394 1.00 0.00 H new ATOM 0 HG13 VAL A 24 30.987 -0.536 -15.604 1.00 0.00 H new ATOM 0 HG21 VAL A 24 31.026 -0.108 -18.603 1.00 0.00 H new ATOM 0 HG22 VAL A 24 31.802 -1.495 -17.801 1.00 0.00 H new ATOM 0 HG23 VAL A 24 30.638 -1.766 -19.120 1.00 0.00 H new ATOM 366 N GLN A 25 27.214 -2.920 -16.023 1.00 0.00 N ATOM 367 CA GLN A 25 26.034 -3.025 -15.191 1.00 0.00 C ATOM 368 C GLN A 25 26.136 -4.096 -14.103 1.00 0.00 C ATOM 369 O GLN A 25 25.404 -4.011 -13.119 1.00 0.00 O ATOM 370 CB GLN A 25 24.835 -3.222 -16.120 1.00 0.00 C ATOM 371 CG GLN A 25 24.705 -2.026 -17.083 1.00 0.00 C ATOM 372 CD GLN A 25 24.003 -0.849 -16.406 1.00 0.00 C ATOM 373 OE1 GLN A 25 24.645 0.101 -15.969 1.00 0.00 O ATOM 374 NE2 GLN A 25 22.686 -0.880 -16.290 1.00 0.00 N ATOM 0 H GLN A 25 26.988 -3.024 -17.012 1.00 0.00 H new ATOM 0 HA GLN A 25 25.915 -2.105 -14.618 1.00 0.00 H new ATOM 0 HB2 GLN A 25 24.954 -4.144 -16.688 1.00 0.00 H new ATOM 0 HB3 GLN A 25 23.923 -3.325 -15.532 1.00 0.00 H new ATOM 0 HG2 GLN A 25 25.694 -1.718 -17.421 1.00 0.00 H new ATOM 0 HG3 GLN A 25 24.145 -2.327 -17.968 1.00 0.00 H new ATOM 0 HE21 GLN A 25 22.160 -1.674 -16.656 1.00 0.00 H new ATOM 0 HE22 GLN A 25 22.196 -0.110 -15.834 1.00 0.00 H new ATOM 383 N LYS A 26 27.051 -5.069 -14.210 1.00 0.00 N ATOM 384 CA LYS A 26 27.227 -6.100 -13.183 1.00 0.00 C ATOM 385 C LYS A 26 27.561 -5.441 -11.836 1.00 0.00 C ATOM 386 O LYS A 26 27.246 -5.993 -10.782 1.00 0.00 O ATOM 387 CB LYS A 26 28.322 -7.063 -13.644 1.00 0.00 C ATOM 388 CG LYS A 26 28.459 -8.313 -12.761 1.00 0.00 C ATOM 389 CD LYS A 26 29.482 -9.278 -13.374 1.00 0.00 C ATOM 390 CE LYS A 26 30.927 -8.795 -13.197 1.00 0.00 C ATOM 391 NZ LYS A 26 31.560 -9.352 -11.985 1.00 0.00 N ATOM 0 H LYS A 26 27.684 -5.162 -15.004 1.00 0.00 H new ATOM 0 HA LYS A 26 26.308 -6.668 -13.041 1.00 0.00 H new ATOM 0 HB2 LYS A 26 28.113 -7.374 -14.668 1.00 0.00 H new ATOM 0 HB3 LYS A 26 29.275 -6.534 -13.660 1.00 0.00 H new ATOM 0 HG2 LYS A 26 28.773 -8.027 -11.757 1.00 0.00 H new ATOM 0 HG3 LYS A 26 27.493 -8.808 -12.664 1.00 0.00 H new ATOM 0 HD2 LYS A 26 29.372 -10.260 -12.913 1.00 0.00 H new ATOM 0 HD3 LYS A 26 29.271 -9.399 -14.436 1.00 0.00 H new ATOM 0 HE2 LYS A 26 31.512 -9.078 -14.072 1.00 0.00 H new ATOM 0 HE3 LYS A 26 30.940 -7.706 -13.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 32.535 -8.997 -11.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 31.019 -9.061 -11.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 31.573 -10.390 -12.046 1.00 0.00 H new ATOM 405 N GLN A 27 28.147 -4.239 -11.866 1.00 0.00 N ATOM 406 CA GLN A 27 28.498 -3.477 -10.676 1.00 0.00 C ATOM 407 C GLN A 27 27.262 -3.186 -9.815 1.00 0.00 C ATOM 408 O GLN A 27 27.409 -3.031 -8.610 1.00 0.00 O ATOM 409 CB GLN A 27 29.254 -2.186 -11.033 1.00 0.00 C ATOM 410 CG GLN A 27 28.385 -1.061 -11.624 1.00 0.00 C ATOM 411 CD GLN A 27 29.170 0.222 -11.884 1.00 0.00 C ATOM 412 OE1 GLN A 27 30.331 0.357 -11.507 1.00 0.00 O ATOM 413 NE2 GLN A 27 28.553 1.228 -12.474 1.00 0.00 N ATOM 0 H GLN A 27 28.392 -3.766 -12.736 1.00 0.00 H new ATOM 0 HA GLN A 27 29.174 -4.092 -10.082 1.00 0.00 H new ATOM 0 HB2 GLN A 27 29.745 -1.811 -10.135 1.00 0.00 H new ATOM 0 HB3 GLN A 27 30.040 -2.430 -11.748 1.00 0.00 H new ATOM 0 HG2 GLN A 27 27.941 -1.405 -12.558 1.00 0.00 H new ATOM 0 HG3 GLN A 27 27.564 -0.846 -10.940 1.00 0.00 H new ATOM 0 HE21 GLN A 27 27.589 1.121 -12.789 1.00 0.00 H new ATOM 0 HE22 GLN A 27 29.040 2.113 -12.615 1.00 0.00 H new ATOM 422 N LEU A 28 26.045 -3.157 -10.383 1.00 0.00 N ATOM 423 CA LEU A 28 24.800 -2.909 -9.641 1.00 0.00 C ATOM 424 C LEU A 28 24.510 -4.042 -8.641 1.00 0.00 C ATOM 425 O LEU A 28 23.533 -3.981 -7.891 1.00 0.00 O ATOM 426 CB LEU A 28 23.607 -2.776 -10.597 1.00 0.00 C ATOM 427 CG LEU A 28 23.376 -1.385 -11.203 1.00 0.00 C ATOM 428 CD1 LEU A 28 24.466 -0.900 -12.162 1.00 0.00 C ATOM 429 CD2 LEU A 28 22.064 -1.450 -11.984 1.00 0.00 C ATOM 0 H LEU A 28 25.898 -3.307 -11.381 1.00 0.00 H new ATOM 0 HA LEU A 28 24.936 -1.975 -9.096 1.00 0.00 H new ATOM 0 HB2 LEU A 28 23.740 -3.487 -11.412 1.00 0.00 H new ATOM 0 HB3 LEU A 28 22.704 -3.071 -10.062 1.00 0.00 H new ATOM 0 HG LEU A 28 23.371 -0.679 -10.373 1.00 0.00 H new ATOM 0 HD11 LEU A 28 24.208 0.091 -12.534 1.00 0.00 H new ATOM 0 HD12 LEU A 28 25.419 -0.853 -11.636 1.00 0.00 H new ATOM 0 HD13 LEU A 28 24.548 -1.592 -13.000 1.00 0.00 H new ATOM 0 HD21 LEU A 28 21.860 -0.478 -12.434 1.00 0.00 H new ATOM 0 HD22 LEU A 28 22.144 -2.203 -12.768 1.00 0.00 H new ATOM 0 HD23 LEU A 28 21.251 -1.715 -11.308 1.00 0.00 H new ATOM 441 N ALA A 29 25.330 -5.093 -8.660 1.00 0.00 N ATOM 442 CA ALA A 29 25.289 -6.265 -7.813 1.00 0.00 C ATOM 443 C ALA A 29 26.629 -6.427 -7.078 1.00 0.00 C ATOM 444 O ALA A 29 26.961 -7.541 -6.657 1.00 0.00 O ATOM 445 CB ALA A 29 24.936 -7.489 -8.668 1.00 0.00 C ATOM 0 H ALA A 29 26.100 -5.141 -9.327 1.00 0.00 H new ATOM 0 HA ALA A 29 24.519 -6.158 -7.049 1.00 0.00 H new ATOM 0 HB1 ALA A 29 24.903 -8.377 -8.036 1.00 0.00 H new ATOM 0 HB2 ALA A 29 23.962 -7.339 -9.134 1.00 0.00 H new ATOM 0 HB3 ALA A 29 25.692 -7.622 -9.442 1.00 0.00 H new ATOM 451 N ARG A 30 27.422 -5.356 -6.950 1.00 0.00 N ATOM 452 CA ARG A 30 28.728 -5.355 -6.294 1.00 0.00 C ATOM 453 C ARG A 30 28.884 -4.150 -5.372 1.00 0.00 C ATOM 454 O ARG A 30 29.084 -3.036 -5.846 1.00 0.00 O ATOM 455 CB ARG A 30 29.863 -5.398 -7.342 1.00 0.00 C ATOM 456 CG ARG A 30 31.171 -5.941 -6.740 1.00 0.00 C ATOM 457 CD ARG A 30 31.067 -7.467 -6.679 1.00 0.00 C ATOM 458 NE ARG A 30 32.146 -8.122 -5.934 1.00 0.00 N ATOM 459 CZ ARG A 30 32.264 -9.453 -5.861 1.00 0.00 C ATOM 460 NH1 ARG A 30 31.385 -10.241 -6.480 1.00 0.00 N ATOM 461 NH2 ARG A 30 33.252 -10.011 -5.176 1.00 0.00 N ATOM 0 H ARG A 30 27.161 -4.439 -7.313 1.00 0.00 H new ATOM 0 HA ARG A 30 28.795 -6.252 -5.678 1.00 0.00 H new ATOM 0 HB2 ARG A 30 29.560 -6.025 -8.181 1.00 0.00 H new ATOM 0 HB3 ARG A 30 30.032 -4.396 -7.737 1.00 0.00 H new ATOM 0 HG2 ARG A 30 32.024 -5.641 -7.349 1.00 0.00 H new ATOM 0 HG3 ARG A 30 31.331 -5.530 -5.743 1.00 0.00 H new ATOM 0 HD2 ARG A 30 30.114 -7.735 -6.224 1.00 0.00 H new ATOM 0 HD3 ARG A 30 31.056 -7.858 -7.696 1.00 0.00 H new ATOM 0 HE ARG A 30 32.833 -7.541 -5.453 1.00 0.00 H new ATOM 0 HH11 ARG A 30 30.618 -9.830 -7.012 1.00 0.00 H new ATOM 0 HH12 ARG A 30 31.479 -11.255 -6.421 1.00 0.00 H new ATOM 0 HH21 ARG A 30 33.935 -9.424 -4.696 1.00 0.00 H new ATOM 0 HH22 ARG A 30 33.330 -11.027 -5.129 1.00 0.00 H new ATOM 475 N MET A 31 28.770 -4.353 -4.059 1.00 0.00 N ATOM 476 CA MET A 31 28.898 -3.331 -3.009 1.00 0.00 C ATOM 477 C MET A 31 27.923 -2.156 -3.061 1.00 0.00 C ATOM 478 O MET A 31 28.066 -1.161 -2.352 1.00 0.00 O ATOM 479 CB MET A 31 30.326 -2.808 -2.939 1.00 0.00 C ATOM 480 CG MET A 31 31.367 -3.903 -2.694 1.00 0.00 C ATOM 481 SD MET A 31 32.941 -3.285 -2.045 1.00 0.00 S ATOM 482 CE MET A 31 33.496 -2.265 -3.437 1.00 0.00 C ATOM 0 H MET A 31 28.576 -5.278 -3.676 1.00 0.00 H new ATOM 0 HA MET A 31 28.623 -3.871 -2.103 1.00 0.00 H new ATOM 0 HB2 MET A 31 30.563 -2.295 -3.871 1.00 0.00 H new ATOM 0 HB3 MET A 31 30.395 -2.068 -2.142 1.00 0.00 H new ATOM 0 HG2 MET A 31 30.957 -4.631 -1.994 1.00 0.00 H new ATOM 0 HG3 MET A 31 31.553 -4.430 -3.630 1.00 0.00 H new ATOM 0 HE1 MET A 31 34.465 -1.826 -3.202 1.00 0.00 H new ATOM 0 HE2 MET A 31 33.585 -2.885 -4.329 1.00 0.00 H new ATOM 0 HE3 MET A 31 32.772 -1.471 -3.618 1.00 0.00 H new ATOM 492 N THR A 32 26.919 -2.283 -3.895 1.00 0.00 N ATOM 493 CA THR A 32 25.849 -1.334 -4.143 1.00 0.00 C ATOM 494 C THR A 32 24.583 -2.103 -4.550 1.00 0.00 C ATOM 495 O THR A 32 24.618 -3.327 -4.730 1.00 0.00 O ATOM 496 CB THR A 32 26.357 -0.281 -5.150 1.00 0.00 C ATOM 497 OG1 THR A 32 25.483 0.813 -5.290 1.00 0.00 O ATOM 498 CG2 THR A 32 26.563 -0.831 -6.557 1.00 0.00 C ATOM 0 H THR A 32 26.817 -3.121 -4.467 1.00 0.00 H new ATOM 0 HA THR A 32 25.561 -0.772 -3.254 1.00 0.00 H new ATOM 0 HB THR A 32 27.309 0.029 -4.718 1.00 0.00 H new ATOM 0 HG1 THR A 32 25.855 1.448 -5.937 1.00 0.00 H new ATOM 0 HG21 THR A 32 26.921 -0.035 -7.210 1.00 0.00 H new ATOM 0 HG22 THR A 32 27.298 -1.635 -6.529 1.00 0.00 H new ATOM 0 HG23 THR A 32 25.618 -1.216 -6.939 1.00 0.00 H new ATOM 506 N ARG A 33 23.466 -1.383 -4.685 1.00 0.00 N ATOM 507 CA ARG A 33 22.138 -1.888 -5.039 1.00 0.00 C ATOM 508 C ARG A 33 21.467 -0.960 -6.051 1.00 0.00 C ATOM 509 O ARG A 33 22.004 0.102 -6.380 1.00 0.00 O ATOM 510 CB ARG A 33 21.297 -2.010 -3.746 1.00 0.00 C ATOM 511 CG ARG A 33 21.386 -0.733 -2.889 1.00 0.00 C ATOM 512 CD ARG A 33 20.299 -0.590 -1.817 1.00 0.00 C ATOM 513 NE ARG A 33 20.414 0.711 -1.135 1.00 0.00 N ATOM 514 CZ ARG A 33 19.730 1.096 -0.051 1.00 0.00 C ATOM 515 NH1 ARG A 33 18.740 0.367 0.441 1.00 0.00 N ATOM 516 NH2 ARG A 33 20.050 2.237 0.539 1.00 0.00 N ATOM 0 H ARG A 33 23.465 -0.373 -4.542 1.00 0.00 H new ATOM 0 HA ARG A 33 22.223 -2.869 -5.506 1.00 0.00 H new ATOM 0 HB2 ARG A 33 20.256 -2.203 -4.005 1.00 0.00 H new ATOM 0 HB3 ARG A 33 21.644 -2.864 -3.165 1.00 0.00 H new ATOM 0 HG2 ARG A 33 22.360 -0.709 -2.401 1.00 0.00 H new ATOM 0 HG3 ARG A 33 21.339 0.133 -3.549 1.00 0.00 H new ATOM 0 HD2 ARG A 33 19.314 -0.681 -2.275 1.00 0.00 H new ATOM 0 HD3 ARG A 33 20.388 -1.397 -1.090 1.00 0.00 H new ATOM 0 HE ARG A 33 21.077 1.381 -1.526 1.00 0.00 H new ATOM 0 HH11 ARG A 33 18.482 -0.512 -0.008 1.00 0.00 H new ATOM 0 HH12 ARG A 33 18.235 0.684 1.269 1.00 0.00 H new ATOM 0 HH21 ARG A 33 20.808 2.809 0.167 1.00 0.00 H new ATOM 0 HH22 ARG A 33 19.538 2.545 1.366 1.00 0.00 H new ATOM 530 N CYS A 34 20.305 -1.367 -6.570 1.00 0.00 N ATOM 531 CA CYS A 34 19.508 -0.633 -7.544 1.00 0.00 C ATOM 532 C CYS A 34 18.091 -1.225 -7.598 1.00 0.00 C ATOM 533 O CYS A 34 17.151 -0.515 -7.237 1.00 0.00 O ATOM 534 CB CYS A 34 20.209 -0.576 -8.912 1.00 0.00 C ATOM 535 SG CYS A 34 19.296 0.515 -10.034 1.00 0.00 S ATOM 0 H CYS A 34 19.880 -2.256 -6.308 1.00 0.00 H new ATOM 0 HA CYS A 34 19.410 0.407 -7.232 1.00 0.00 H new ATOM 0 HB2 CYS A 34 21.230 -0.214 -8.791 1.00 0.00 H new ATOM 0 HB3 CYS A 34 20.274 -1.577 -9.338 1.00 0.00 H new ATOM 0 HG CYS A 34 19.899 0.556 -11.185 1.00 0.00 H new ATOM 541 N PRO A 35 17.892 -2.520 -7.929 1.00 0.00 N ATOM 542 CA PRO A 35 16.559 -3.109 -7.999 1.00 0.00 C ATOM 543 C PRO A 35 15.825 -3.118 -6.658 1.00 0.00 C ATOM 544 O PRO A 35 14.600 -3.228 -6.661 1.00 0.00 O ATOM 545 CB PRO A 35 16.725 -4.521 -8.556 1.00 0.00 C ATOM 546 CG PRO A 35 18.178 -4.858 -8.257 1.00 0.00 C ATOM 547 CD PRO A 35 18.868 -3.501 -8.370 1.00 0.00 C ATOM 0 HA PRO A 35 15.931 -2.499 -8.648 1.00 0.00 H new ATOM 0 HB2 PRO A 35 16.044 -5.224 -8.076 1.00 0.00 H new ATOM 0 HB3 PRO A 35 16.518 -4.557 -9.625 1.00 0.00 H new ATOM 0 HG2 PRO A 35 18.297 -5.291 -7.264 1.00 0.00 H new ATOM 0 HG3 PRO A 35 18.581 -5.578 -8.969 1.00 0.00 H new ATOM 0 HD2 PRO A 35 19.764 -3.466 -7.751 1.00 0.00 H new ATOM 0 HD3 PRO A 35 19.181 -3.306 -9.396 1.00 0.00 H new ATOM 555 N GLU A 36 16.540 -2.947 -5.537 1.00 0.00 N ATOM 556 CA GLU A 36 15.979 -2.903 -4.182 1.00 0.00 C ATOM 557 C GLU A 36 14.965 -1.746 -4.063 1.00 0.00 C ATOM 558 O GLU A 36 14.159 -1.682 -3.134 1.00 0.00 O ATOM 559 CB GLU A 36 17.137 -2.847 -3.175 1.00 0.00 C ATOM 560 CG GLU A 36 16.734 -3.075 -1.702 1.00 0.00 C ATOM 561 CD GLU A 36 16.456 -1.801 -0.891 1.00 0.00 C ATOM 562 OE1 GLU A 36 16.903 -0.703 -1.296 1.00 0.00 O ATOM 563 OE2 GLU A 36 15.862 -1.899 0.205 1.00 0.00 O ATOM 0 H GLU A 36 17.553 -2.832 -5.550 1.00 0.00 H new ATOM 0 HA GLU A 36 15.408 -3.803 -3.955 1.00 0.00 H new ATOM 0 HB2 GLU A 36 17.877 -3.597 -3.454 1.00 0.00 H new ATOM 0 HB3 GLU A 36 17.623 -1.875 -3.257 1.00 0.00 H new ATOM 0 HG2 GLU A 36 15.842 -3.701 -1.680 1.00 0.00 H new ATOM 0 HG3 GLU A 36 17.529 -3.634 -1.208 1.00 0.00 H new ATOM 570 N GLN A 37 14.966 -0.826 -5.034 1.00 0.00 N ATOM 571 CA GLN A 37 14.029 0.284 -5.109 1.00 0.00 C ATOM 572 C GLN A 37 12.586 -0.259 -5.261 1.00 0.00 C ATOM 573 O GLN A 37 11.629 0.466 -4.972 1.00 0.00 O ATOM 574 CB GLN A 37 14.465 1.172 -6.286 1.00 0.00 C ATOM 575 CG GLN A 37 13.548 2.374 -6.553 1.00 0.00 C ATOM 576 CD GLN A 37 14.264 3.496 -7.309 1.00 0.00 C ATOM 577 OE1 GLN A 37 14.181 4.661 -6.923 1.00 0.00 O ATOM 578 NE2 GLN A 37 14.984 3.192 -8.378 1.00 0.00 N ATOM 0 H GLN A 37 15.636 -0.839 -5.803 1.00 0.00 H new ATOM 0 HA GLN A 37 14.033 0.884 -4.199 1.00 0.00 H new ATOM 0 HB2 GLN A 37 15.474 1.537 -6.095 1.00 0.00 H new ATOM 0 HB3 GLN A 37 14.513 0.561 -7.187 1.00 0.00 H new ATOM 0 HG2 GLN A 37 12.682 2.047 -7.128 1.00 0.00 H new ATOM 0 HG3 GLN A 37 13.173 2.760 -5.605 1.00 0.00 H new ATOM 0 HE21 GLN A 37 15.048 2.223 -8.691 1.00 0.00 H new ATOM 0 HE22 GLN A 37 15.475 3.926 -8.888 1.00 0.00 H new ATOM 587 N GLU A 38 12.413 -1.534 -5.648 1.00 0.00 N ATOM 588 CA GLU A 38 11.122 -2.189 -5.837 1.00 0.00 C ATOM 589 C GLU A 38 10.219 -2.078 -4.614 1.00 0.00 C ATOM 590 O GLU A 38 9.009 -2.041 -4.783 1.00 0.00 O ATOM 591 CB GLU A 38 11.274 -3.664 -6.251 1.00 0.00 C ATOM 592 CG GLU A 38 11.721 -4.602 -5.117 1.00 0.00 C ATOM 593 CD GLU A 38 11.656 -6.063 -5.550 1.00 0.00 C ATOM 594 OE1 GLU A 38 10.588 -6.694 -5.364 1.00 0.00 O ATOM 595 OE2 GLU A 38 12.676 -6.575 -6.068 1.00 0.00 O ATOM 0 H GLU A 38 13.200 -2.153 -5.843 1.00 0.00 H new ATOM 0 HA GLU A 38 10.641 -1.651 -6.654 1.00 0.00 H new ATOM 0 HB2 GLU A 38 10.321 -4.018 -6.644 1.00 0.00 H new ATOM 0 HB3 GLU A 38 11.997 -3.727 -7.064 1.00 0.00 H new ATOM 0 HG2 GLU A 38 12.739 -4.354 -4.817 1.00 0.00 H new ATOM 0 HG3 GLU A 38 11.086 -4.450 -4.244 1.00 0.00 H new ATOM 602 N LEU A 39 10.752 -1.991 -3.387 1.00 0.00 N ATOM 603 CA LEU A 39 9.922 -1.874 -2.186 1.00 0.00 C ATOM 604 C LEU A 39 9.050 -0.622 -2.282 1.00 0.00 C ATOM 605 O LEU A 39 7.885 -0.611 -1.869 1.00 0.00 O ATOM 606 CB LEU A 39 10.799 -1.759 -0.921 1.00 0.00 C ATOM 607 CG LEU A 39 11.288 -3.073 -0.289 1.00 0.00 C ATOM 608 CD1 LEU A 39 10.121 -3.921 0.230 1.00 0.00 C ATOM 609 CD2 LEU A 39 12.164 -3.890 -1.239 1.00 0.00 C ATOM 0 H LEU A 39 11.755 -2.000 -3.203 1.00 0.00 H new ATOM 0 HA LEU A 39 9.302 -2.768 -2.116 1.00 0.00 H new ATOM 0 HB2 LEU A 39 11.673 -1.156 -1.168 1.00 0.00 H new ATOM 0 HB3 LEU A 39 10.236 -1.209 -0.167 1.00 0.00 H new ATOM 0 HG LEU A 39 11.908 -2.787 0.561 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.507 -4.841 0.669 1.00 0.00 H new ATOM 0 HD12 LEU A 39 9.572 -3.360 0.986 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.453 -4.166 -0.596 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.482 -4.807 -0.743 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.595 -4.140 -2.134 1.00 0.00 H new ATOM 0 HD23 LEU A 39 13.041 -3.306 -1.518 1.00 0.00 H new ATOM 621 N ARG A 40 9.656 0.460 -2.769 1.00 0.00 N ATOM 622 CA ARG A 40 9.034 1.762 -2.939 1.00 0.00 C ATOM 623 C ARG A 40 8.037 1.682 -4.083 1.00 0.00 C ATOM 624 O ARG A 40 6.901 2.127 -3.928 1.00 0.00 O ATOM 625 CB ARG A 40 10.121 2.834 -3.162 1.00 0.00 C ATOM 626 CG ARG A 40 11.318 2.720 -2.188 1.00 0.00 C ATOM 627 CD ARG A 40 10.904 2.635 -0.710 1.00 0.00 C ATOM 628 NE ARG A 40 10.212 3.862 -0.294 1.00 0.00 N ATOM 629 CZ ARG A 40 10.795 4.976 0.156 1.00 0.00 C ATOM 630 NH1 ARG A 40 12.097 5.012 0.441 1.00 0.00 N ATOM 631 NH2 ARG A 40 10.049 6.060 0.296 1.00 0.00 N ATOM 0 H ARG A 40 10.632 0.448 -3.066 1.00 0.00 H new ATOM 0 HA ARG A 40 8.487 2.054 -2.043 1.00 0.00 H new ATOM 0 HB2 ARG A 40 10.489 2.758 -4.185 1.00 0.00 H new ATOM 0 HB3 ARG A 40 9.672 3.821 -3.057 1.00 0.00 H new ATOM 0 HG2 ARG A 40 11.901 1.836 -2.445 1.00 0.00 H new ATOM 0 HG3 ARG A 40 11.970 3.583 -2.325 1.00 0.00 H new ATOM 0 HD2 ARG A 40 10.252 1.775 -0.559 1.00 0.00 H new ATOM 0 HD3 ARG A 40 11.786 2.480 -0.088 1.00 0.00 H new ATOM 0 HE ARG A 40 9.194 3.863 -0.354 1.00 0.00 H new ATOM 0 HH11 ARG A 40 12.670 4.177 0.317 1.00 0.00 H new ATOM 0 HH12 ARG A 40 12.520 5.874 0.783 1.00 0.00 H new ATOM 0 HH21 ARG A 40 9.057 6.030 0.062 1.00 0.00 H new ATOM 0 HH22 ARG A 40 10.466 6.926 0.638 1.00 0.00 H new ATOM 645 N LEU A 41 8.451 1.084 -5.203 1.00 0.00 N ATOM 646 CA LEU A 41 7.582 0.926 -6.366 1.00 0.00 C ATOM 647 C LEU A 41 6.337 0.154 -5.935 1.00 0.00 C ATOM 648 O LEU A 41 5.220 0.624 -6.097 1.00 0.00 O ATOM 649 CB LEU A 41 8.304 0.212 -7.523 1.00 0.00 C ATOM 650 CG LEU A 41 9.624 0.870 -7.969 1.00 0.00 C ATOM 651 CD1 LEU A 41 10.184 0.131 -9.183 1.00 0.00 C ATOM 652 CD2 LEU A 41 9.454 2.357 -8.291 1.00 0.00 C ATOM 0 H LEU A 41 9.388 0.700 -5.326 1.00 0.00 H new ATOM 0 HA LEU A 41 7.298 1.910 -6.740 1.00 0.00 H new ATOM 0 HB2 LEU A 41 8.510 -0.816 -7.224 1.00 0.00 H new ATOM 0 HB3 LEU A 41 7.631 0.166 -8.379 1.00 0.00 H new ATOM 0 HG LEU A 41 10.324 0.800 -7.136 1.00 0.00 H new ATOM 0 HD11 LEU A 41 11.117 0.599 -9.495 1.00 0.00 H new ATOM 0 HD12 LEU A 41 10.370 -0.910 -8.921 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.464 0.176 -10.000 1.00 0.00 H new ATOM 0 HD21 LEU A 41 10.412 2.774 -8.600 1.00 0.00 H new ATOM 0 HD22 LEU A 41 8.730 2.474 -9.097 1.00 0.00 H new ATOM 0 HD23 LEU A 41 9.098 2.883 -7.405 1.00 0.00 H new ATOM 664 N GLN A 42 6.524 -0.984 -5.277 1.00 0.00 N ATOM 665 CA GLN A 42 5.454 -1.831 -4.802 1.00 0.00 C ATOM 666 C GLN A 42 4.500 -1.091 -3.869 1.00 0.00 C ATOM 667 O GLN A 42 3.299 -1.331 -3.975 1.00 0.00 O ATOM 668 CB GLN A 42 6.042 -3.105 -4.185 1.00 0.00 C ATOM 669 CG GLN A 42 6.418 -4.104 -5.294 1.00 0.00 C ATOM 670 CD GLN A 42 5.158 -4.762 -5.851 1.00 0.00 C ATOM 671 OE1 GLN A 42 4.577 -5.635 -5.205 1.00 0.00 O ATOM 672 NE2 GLN A 42 4.662 -4.342 -7.000 1.00 0.00 N ATOM 0 H GLN A 42 7.452 -1.346 -5.057 1.00 0.00 H new ATOM 0 HA GLN A 42 4.837 -2.128 -5.650 1.00 0.00 H new ATOM 0 HB2 GLN A 42 6.923 -2.858 -3.593 1.00 0.00 H new ATOM 0 HB3 GLN A 42 5.318 -3.558 -3.507 1.00 0.00 H new ATOM 0 HG2 GLN A 42 6.953 -3.590 -6.092 1.00 0.00 H new ATOM 0 HG3 GLN A 42 7.091 -4.864 -4.897 1.00 0.00 H new ATOM 0 HE21 GLN A 42 5.147 -3.619 -7.531 1.00 0.00 H new ATOM 0 HE22 GLN A 42 3.794 -4.741 -7.357 1.00 0.00 H new ATOM 681 N ARG A 43 4.969 -0.193 -2.987 1.00 0.00 N ATOM 682 CA ARG A 43 4.026 0.520 -2.115 1.00 0.00 C ATOM 683 C ARG A 43 3.102 1.419 -2.949 1.00 0.00 C ATOM 684 O ARG A 43 1.888 1.413 -2.714 1.00 0.00 O ATOM 685 CB ARG A 43 4.727 1.242 -0.943 1.00 0.00 C ATOM 686 CG ARG A 43 5.008 2.745 -1.139 1.00 0.00 C ATOM 687 CD ARG A 43 5.804 3.373 0.008 1.00 0.00 C ATOM 688 NE ARG A 43 5.073 3.320 1.280 1.00 0.00 N ATOM 689 CZ ARG A 43 5.430 2.716 2.414 1.00 0.00 C ATOM 690 NH1 ARG A 43 6.590 2.081 2.527 1.00 0.00 N ATOM 691 NH2 ARG A 43 4.598 2.737 3.443 1.00 0.00 N ATOM 0 H ARG A 43 5.952 0.049 -2.862 1.00 0.00 H new ATOM 0 HA ARG A 43 3.387 -0.215 -1.626 1.00 0.00 H new ATOM 0 HB2 ARG A 43 4.113 1.122 -0.050 1.00 0.00 H new ATOM 0 HB3 ARG A 43 5.674 0.739 -0.748 1.00 0.00 H new ATOM 0 HG2 ARG A 43 5.556 2.885 -2.071 1.00 0.00 H new ATOM 0 HG3 ARG A 43 4.060 3.273 -1.244 1.00 0.00 H new ATOM 0 HD2 ARG A 43 6.756 2.853 0.115 1.00 0.00 H new ATOM 0 HD3 ARG A 43 6.033 4.411 -0.235 1.00 0.00 H new ATOM 0 HE ARG A 43 4.177 3.808 1.299 1.00 0.00 H new ATOM 0 HH11 ARG A 43 7.232 2.047 1.735 1.00 0.00 H new ATOM 0 HH12 ARG A 43 6.839 1.627 3.406 1.00 0.00 H new ATOM 0 HH21 ARG A 43 3.698 3.211 3.362 1.00 0.00 H new ATOM 0 HH22 ARG A 43 4.856 2.280 4.317 1.00 0.00 H new ATOM 705 N LEU A 44 3.649 2.176 -3.915 1.00 0.00 N ATOM 706 CA LEU A 44 2.827 3.057 -4.754 1.00 0.00 C ATOM 707 C LEU A 44 1.984 2.251 -5.745 1.00 0.00 C ATOM 708 O LEU A 44 0.881 2.673 -6.096 1.00 0.00 O ATOM 709 CB LEU A 44 3.644 4.196 -5.410 1.00 0.00 C ATOM 710 CG LEU A 44 4.770 3.832 -6.404 1.00 0.00 C ATOM 711 CD1 LEU A 44 4.289 3.502 -7.825 1.00 0.00 C ATOM 712 CD2 LEU A 44 5.773 4.985 -6.530 1.00 0.00 C ATOM 0 H LEU A 44 4.646 2.195 -4.131 1.00 0.00 H new ATOM 0 HA LEU A 44 2.123 3.569 -4.098 1.00 0.00 H new ATOM 0 HB2 LEU A 44 2.942 4.847 -5.931 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.090 4.785 -4.609 1.00 0.00 H new ATOM 0 HG LEU A 44 5.220 2.934 -5.981 1.00 0.00 H new ATOM 0 HD11 LEU A 44 5.147 3.259 -8.452 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.611 2.649 -7.791 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.767 4.364 -8.242 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.558 4.709 -7.234 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.259 5.876 -6.890 1.00 0.00 H new ATOM 0 HD23 LEU A 44 6.216 5.190 -5.555 1.00 0.00 H new ATOM 724 N GLU A 45 2.456 1.077 -6.164 1.00 0.00 N ATOM 725 CA GLU A 45 1.760 0.198 -7.096 1.00 0.00 C ATOM 726 C GLU A 45 0.617 -0.551 -6.408 1.00 0.00 C ATOM 727 O GLU A 45 -0.285 -1.059 -7.077 1.00 0.00 O ATOM 728 CB GLU A 45 2.713 -0.881 -7.633 1.00 0.00 C ATOM 729 CG GLU A 45 3.682 -0.450 -8.736 1.00 0.00 C ATOM 730 CD GLU A 45 4.480 -1.671 -9.195 1.00 0.00 C ATOM 731 OE1 GLU A 45 5.452 -2.075 -8.512 1.00 0.00 O ATOM 732 OE2 GLU A 45 4.084 -2.272 -10.222 1.00 0.00 O ATOM 0 H GLU A 45 3.354 0.704 -5.856 1.00 0.00 H new ATOM 0 HA GLU A 45 1.381 0.835 -7.895 1.00 0.00 H new ATOM 0 HB2 GLU A 45 3.297 -1.266 -6.797 1.00 0.00 H new ATOM 0 HB3 GLU A 45 2.113 -1.709 -8.011 1.00 0.00 H new ATOM 0 HG2 GLU A 45 3.133 -0.021 -9.574 1.00 0.00 H new ATOM 0 HG3 GLU A 45 4.355 0.324 -8.366 1.00 0.00 H new ATOM 739 N ARG A 46 0.635 -0.623 -5.074 1.00 0.00 N ATOM 740 CA ARG A 46 -0.372 -1.328 -4.298 1.00 0.00 C ATOM 741 C ARG A 46 -1.751 -0.660 -4.342 1.00 0.00 C ATOM 742 O ARG A 46 -2.713 -1.290 -3.908 1.00 0.00 O ATOM 743 CB ARG A 46 0.131 -1.594 -2.861 1.00 0.00 C ATOM 744 CG ARG A 46 0.040 -3.072 -2.458 1.00 0.00 C ATOM 745 CD ARG A 46 1.095 -4.031 -3.026 1.00 0.00 C ATOM 746 NE ARG A 46 0.747 -5.402 -2.607 1.00 0.00 N ATOM 747 CZ ARG A 46 1.334 -6.562 -2.921 1.00 0.00 C ATOM 748 NH1 ARG A 46 2.419 -6.639 -3.682 1.00 0.00 N ATOM 749 NH2 ARG A 46 0.796 -7.679 -2.449 1.00 0.00 N ATOM 0 H ARG A 46 1.359 -0.187 -4.503 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.525 -2.297 -4.773 1.00 0.00 H new ATOM 0 HB2 ARG A 46 1.166 -1.263 -2.777 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -0.452 -0.996 -2.161 1.00 0.00 H new ATOM 0 HG2 ARG A 46 0.087 -3.127 -1.370 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -0.942 -3.441 -2.753 1.00 0.00 H new ATOM 0 HD2 ARG A 46 1.125 -3.962 -4.113 1.00 0.00 H new ATOM 0 HD3 ARG A 46 2.087 -3.763 -2.662 1.00 0.00 H new ATOM 0 HE ARG A 46 -0.059 -5.476 -1.987 1.00 0.00 H new ATOM 0 HH11 ARG A 46 2.842 -5.789 -4.055 1.00 0.00 H new ATOM 0 HH12 ARG A 46 2.830 -7.548 -3.893 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -0.040 -7.636 -1.866 1.00 0.00 H new ATOM 0 HH22 ARG A 46 1.218 -8.581 -2.669 1.00 0.00 H new ATOM 763 N LEU A 47 -1.888 0.569 -4.857 1.00 0.00 N ATOM 764 CA LEU A 47 -3.179 1.263 -4.948 1.00 0.00 C ATOM 765 C LEU A 47 -4.142 0.449 -5.833 1.00 0.00 C ATOM 766 O LEU A 47 -5.134 -0.079 -5.320 1.00 0.00 O ATOM 767 CB LEU A 47 -3.018 2.730 -5.408 1.00 0.00 C ATOM 768 CG LEU A 47 -2.333 3.675 -4.400 1.00 0.00 C ATOM 769 CD1 LEU A 47 -2.073 5.029 -5.071 1.00 0.00 C ATOM 770 CD2 LEU A 47 -3.159 3.894 -3.131 1.00 0.00 C ATOM 0 H LEU A 47 -1.105 1.111 -5.223 1.00 0.00 H new ATOM 0 HA LEU A 47 -3.619 1.327 -3.953 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.445 2.740 -6.335 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.005 3.129 -5.640 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.399 3.201 -4.100 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.589 5.700 -4.361 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -1.426 4.888 -5.937 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.020 5.463 -5.393 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.625 4.568 -2.461 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -4.122 4.332 -3.395 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -3.320 2.938 -2.632 1.00 0.00 H new ATOM 782 N PRO A 48 -3.890 0.278 -7.149 1.00 0.00 N ATOM 783 CA PRO A 48 -4.790 -0.506 -7.987 1.00 0.00 C ATOM 784 C PRO A 48 -4.806 -1.969 -7.542 1.00 0.00 C ATOM 785 O PRO A 48 -5.843 -2.611 -7.670 1.00 0.00 O ATOM 786 CB PRO A 48 -4.281 -0.359 -9.422 1.00 0.00 C ATOM 787 CG PRO A 48 -2.798 -0.080 -9.220 1.00 0.00 C ATOM 788 CD PRO A 48 -2.797 0.790 -7.964 1.00 0.00 C ATOM 0 HA PRO A 48 -5.818 -0.153 -7.908 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -4.448 -1.264 -10.006 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -4.779 0.456 -9.948 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -2.227 -0.998 -9.079 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -2.362 0.438 -10.074 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -1.846 0.720 -7.437 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -2.948 1.841 -8.212 1.00 0.00 H new ATOM 796 N GLU A 49 -3.697 -2.482 -6.995 1.00 0.00 N ATOM 797 CA GLU A 49 -3.580 -3.853 -6.525 1.00 0.00 C ATOM 798 C GLU A 49 -4.656 -4.146 -5.478 1.00 0.00 C ATOM 799 O GLU A 49 -5.436 -5.079 -5.652 1.00 0.00 O ATOM 800 CB GLU A 49 -2.170 -4.080 -5.951 1.00 0.00 C ATOM 801 CG GLU A 49 -1.789 -5.550 -5.741 1.00 0.00 C ATOM 802 CD GLU A 49 -1.547 -6.286 -7.059 1.00 0.00 C ATOM 803 OE1 GLU A 49 -0.621 -5.897 -7.809 1.00 0.00 O ATOM 804 OE2 GLU A 49 -2.266 -7.279 -7.328 1.00 0.00 O ATOM 0 H GLU A 49 -2.843 -1.938 -6.868 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.730 -4.539 -7.359 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -1.442 -3.623 -6.622 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -2.094 -3.560 -4.996 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -0.890 -5.605 -5.128 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -2.583 -6.052 -5.188 1.00 0.00 H new ATOM 811 N LEU A 50 -4.721 -3.356 -4.398 1.00 0.00 N ATOM 812 CA LEU A 50 -5.706 -3.567 -3.342 1.00 0.00 C ATOM 813 C LEU A 50 -7.119 -3.373 -3.854 1.00 0.00 C ATOM 814 O LEU A 50 -7.991 -4.156 -3.487 1.00 0.00 O ATOM 815 CB LEU A 50 -5.468 -2.662 -2.122 1.00 0.00 C ATOM 816 CG LEU A 50 -4.611 -3.272 -1.000 1.00 0.00 C ATOM 817 CD1 LEU A 50 -5.043 -4.689 -0.599 1.00 0.00 C ATOM 818 CD2 LEU A 50 -3.129 -3.332 -1.351 1.00 0.00 C ATOM 0 H LEU A 50 -4.099 -2.564 -4.237 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.583 -4.601 -3.020 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.990 -1.743 -2.461 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.436 -2.383 -1.705 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.771 -2.593 -0.162 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.395 -5.056 0.197 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -6.074 -4.669 -0.246 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.968 -5.350 -1.462 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.576 -3.772 -0.521 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.991 -3.943 -2.243 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -2.759 -2.324 -1.540 1.00 0.00 H new ATOM 830 N ALA A 51 -7.365 -2.361 -4.688 1.00 0.00 N ATOM 831 CA ALA A 51 -8.690 -2.120 -5.239 1.00 0.00 C ATOM 832 C ALA A 51 -9.168 -3.361 -6.009 1.00 0.00 C ATOM 833 O ALA A 51 -10.246 -3.899 -5.743 1.00 0.00 O ATOM 834 CB ALA A 51 -8.607 -0.901 -6.150 1.00 0.00 C ATOM 0 H ALA A 51 -6.656 -1.695 -4.995 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.411 -1.929 -4.445 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -9.589 -0.698 -6.577 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -8.277 -0.037 -5.573 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -7.895 -1.094 -6.953 1.00 0.00 H new ATOM 840 N ARG A 52 -8.350 -3.821 -6.961 1.00 0.00 N ATOM 841 CA ARG A 52 -8.634 -4.993 -7.788 1.00 0.00 C ATOM 842 C ARG A 52 -8.840 -6.218 -6.894 1.00 0.00 C ATOM 843 O ARG A 52 -9.852 -6.907 -7.050 1.00 0.00 O ATOM 844 CB ARG A 52 -7.491 -5.223 -8.795 1.00 0.00 C ATOM 845 CG ARG A 52 -7.410 -4.190 -9.936 1.00 0.00 C ATOM 846 CD ARG A 52 -6.093 -4.344 -10.721 1.00 0.00 C ATOM 847 NE ARG A 52 -5.994 -3.377 -11.832 1.00 0.00 N ATOM 848 CZ ARG A 52 -4.977 -3.253 -12.700 1.00 0.00 C ATOM 849 NH1 ARG A 52 -4.003 -4.151 -12.788 1.00 0.00 N ATOM 850 NH2 ARG A 52 -4.894 -2.213 -13.514 1.00 0.00 N ATOM 0 H ARG A 52 -7.457 -3.380 -7.181 1.00 0.00 H new ATOM 0 HA ARG A 52 -9.550 -4.824 -8.355 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -6.545 -5.220 -8.254 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.605 -6.215 -9.231 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -8.257 -4.318 -10.610 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -7.479 -3.182 -9.526 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -5.250 -4.206 -10.044 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -6.023 -5.358 -11.116 1.00 0.00 H new ATOM 0 HE ARG A 52 -6.779 -2.737 -11.953 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -4.010 -4.972 -12.183 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -3.248 -4.020 -13.461 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -5.610 -1.487 -13.489 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -4.114 -2.137 -14.166 1.00 0.00 H new ATOM 864 N VAL A 53 -7.923 -6.479 -5.956 1.00 0.00 N ATOM 865 CA VAL A 53 -8.015 -7.612 -5.042 1.00 0.00 C ATOM 866 C VAL A 53 -9.327 -7.537 -4.268 1.00 0.00 C ATOM 867 O VAL A 53 -10.067 -8.514 -4.277 1.00 0.00 O ATOM 868 CB VAL A 53 -6.780 -7.696 -4.119 1.00 0.00 C ATOM 869 CG1 VAL A 53 -7.016 -8.641 -2.930 1.00 0.00 C ATOM 870 CG2 VAL A 53 -5.566 -8.220 -4.904 1.00 0.00 C ATOM 0 H VAL A 53 -7.093 -5.904 -5.813 1.00 0.00 H new ATOM 0 HA VAL A 53 -8.018 -8.538 -5.617 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.597 -6.689 -3.745 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.123 -8.671 -2.306 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.859 -8.280 -2.340 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -7.234 -9.643 -3.299 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -4.701 -8.275 -4.243 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -5.787 -9.213 -5.296 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -5.348 -7.544 -5.731 1.00 0.00 H new ATOM 880 N LEU A 54 -9.649 -6.411 -3.627 1.00 0.00 N ATOM 881 CA LEU A 54 -10.875 -6.238 -2.853 1.00 0.00 C ATOM 882 C LEU A 54 -12.085 -6.655 -3.686 1.00 0.00 C ATOM 883 O LEU A 54 -12.882 -7.485 -3.234 1.00 0.00 O ATOM 884 CB LEU A 54 -10.953 -4.798 -2.319 1.00 0.00 C ATOM 885 CG LEU A 54 -12.261 -4.447 -1.584 1.00 0.00 C ATOM 886 CD1 LEU A 54 -12.637 -5.480 -0.520 1.00 0.00 C ATOM 887 CD2 LEU A 54 -12.103 -3.086 -0.901 1.00 0.00 C ATOM 0 H LEU A 54 -9.054 -5.582 -3.633 1.00 0.00 H new ATOM 0 HA LEU A 54 -10.871 -6.891 -1.980 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -10.116 -4.632 -1.640 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -10.827 -4.109 -3.154 1.00 0.00 H new ATOM 0 HG LEU A 54 -13.055 -4.431 -2.331 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -13.566 -5.181 -0.035 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -12.770 -6.454 -0.990 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -11.843 -5.541 0.224 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -13.025 -2.832 -0.379 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -11.282 -3.131 -0.186 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -11.889 -2.325 -1.651 1.00 0.00 H new ATOM 899 N ARG A 55 -12.213 -6.141 -4.918 1.00 0.00 N ATOM 900 CA ARG A 55 -13.343 -6.534 -5.756 1.00 0.00 C ATOM 901 C ARG A 55 -13.329 -8.051 -5.970 1.00 0.00 C ATOM 902 O ARG A 55 -14.390 -8.672 -5.896 1.00 0.00 O ATOM 903 CB ARG A 55 -13.363 -5.781 -7.105 1.00 0.00 C ATOM 904 CG ARG A 55 -14.738 -5.940 -7.788 1.00 0.00 C ATOM 905 CD ARG A 55 -14.938 -5.098 -9.056 1.00 0.00 C ATOM 906 NE ARG A 55 -14.818 -5.859 -10.311 1.00 0.00 N ATOM 907 CZ ARG A 55 -15.597 -5.696 -11.392 1.00 0.00 C ATOM 908 NH1 ARG A 55 -16.493 -4.711 -11.467 1.00 0.00 N ATOM 909 NH2 ARG A 55 -15.474 -6.524 -12.422 1.00 0.00 N ATOM 0 H ARG A 55 -11.568 -5.474 -5.342 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.259 -6.256 -5.234 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.150 -4.724 -6.942 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.579 -6.167 -7.756 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -14.880 -6.990 -8.042 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -15.515 -5.677 -7.070 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -15.923 -4.634 -9.019 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.205 -4.291 -9.062 1.00 0.00 H new ATOM 0 HE ARG A 55 -14.085 -6.566 -10.363 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -16.599 -4.058 -10.691 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -17.072 -4.611 -12.301 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -14.790 -7.280 -12.390 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -16.064 -6.404 -13.246 1.00 0.00 H new ATOM 923 N ASN A 56 -12.157 -8.631 -6.237 1.00 0.00 N ATOM 924 CA ASN A 56 -11.961 -10.052 -6.488 1.00 0.00 C ATOM 925 C ASN A 56 -12.425 -10.925 -5.323 1.00 0.00 C ATOM 926 O ASN A 56 -13.284 -11.787 -5.542 1.00 0.00 O ATOM 927 CB ASN A 56 -10.508 -10.356 -6.918 1.00 0.00 C ATOM 928 CG ASN A 56 -10.244 -10.073 -8.396 1.00 0.00 C ATOM 929 OD1 ASN A 56 -11.126 -10.236 -9.244 1.00 0.00 O ATOM 930 ND2 ASN A 56 -9.047 -9.642 -8.760 1.00 0.00 N ATOM 0 H ASN A 56 -11.288 -8.099 -6.285 1.00 0.00 H new ATOM 0 HA ASN A 56 -12.603 -10.318 -7.328 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -9.825 -9.759 -6.313 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -10.286 -11.403 -6.710 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -8.853 -9.444 -9.742 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -8.318 -9.507 -8.059 1.00 0.00 H new ATOM 937 N VAL A 57 -11.916 -10.706 -4.108 1.00 0.00 N ATOM 938 CA VAL A 57 -12.278 -11.498 -2.928 1.00 0.00 C ATOM 939 C VAL A 57 -13.795 -11.466 -2.699 1.00 0.00 C ATOM 940 O VAL A 57 -14.422 -12.526 -2.603 1.00 0.00 O ATOM 941 CB VAL A 57 -11.501 -11.043 -1.671 1.00 0.00 C ATOM 942 CG1 VAL A 57 -11.493 -12.170 -0.623 1.00 0.00 C ATOM 943 CG2 VAL A 57 -10.034 -10.663 -1.923 1.00 0.00 C ATOM 0 H VAL A 57 -11.237 -9.970 -3.913 1.00 0.00 H new ATOM 0 HA VAL A 57 -11.989 -12.532 -3.118 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.026 -10.150 -1.332 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -10.944 -11.842 0.260 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -12.518 -12.414 -0.343 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -11.012 -13.053 -1.042 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.571 -10.357 -0.985 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.500 -11.523 -2.328 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.989 -9.839 -2.635 1.00 0.00 H new ATOM 953 N PHE A 58 -14.402 -10.271 -2.696 1.00 0.00 N ATOM 954 CA PHE A 58 -15.836 -10.101 -2.468 1.00 0.00 C ATOM 955 C PHE A 58 -16.664 -10.833 -3.515 1.00 0.00 C ATOM 956 O PHE A 58 -17.709 -11.409 -3.201 1.00 0.00 O ATOM 957 CB PHE A 58 -16.188 -8.612 -2.436 1.00 0.00 C ATOM 958 CG PHE A 58 -16.231 -8.001 -1.057 1.00 0.00 C ATOM 959 CD1 PHE A 58 -15.061 -7.945 -0.285 1.00 0.00 C ATOM 960 CD2 PHE A 58 -17.424 -7.435 -0.566 1.00 0.00 C ATOM 961 CE1 PHE A 58 -15.071 -7.289 0.953 1.00 0.00 C ATOM 962 CE2 PHE A 58 -17.431 -6.763 0.669 1.00 0.00 C ATOM 963 CZ PHE A 58 -16.251 -6.695 1.427 1.00 0.00 C ATOM 0 H PHE A 58 -13.906 -9.394 -2.853 1.00 0.00 H new ATOM 0 HA PHE A 58 -16.079 -10.542 -1.502 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -15.459 -8.068 -3.037 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.159 -8.473 -2.910 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -14.153 -8.407 -0.645 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -18.335 -7.517 -1.140 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -14.168 -7.240 1.544 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -18.338 -6.302 1.032 1.00 0.00 H new ATOM 0 HZ PHE A 58 -16.251 -6.184 2.378 1.00 0.00 H new ATOM 973 N VAL A 59 -16.244 -10.802 -4.780 1.00 0.00 N ATOM 974 CA VAL A 59 -16.978 -11.502 -5.834 1.00 0.00 C ATOM 975 C VAL A 59 -16.967 -13.006 -5.521 1.00 0.00 C ATOM 976 O VAL A 59 -18.024 -13.637 -5.577 1.00 0.00 O ATOM 977 CB VAL A 59 -16.414 -11.144 -7.223 1.00 0.00 C ATOM 978 CG1 VAL A 59 -16.891 -12.090 -8.328 1.00 0.00 C ATOM 979 CG2 VAL A 59 -16.859 -9.735 -7.627 1.00 0.00 C ATOM 0 H VAL A 59 -15.411 -10.307 -5.097 1.00 0.00 H new ATOM 0 HA VAL A 59 -18.020 -11.183 -5.862 1.00 0.00 H new ATOM 0 HB VAL A 59 -15.331 -11.222 -7.129 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -16.459 -11.784 -9.281 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -16.576 -13.108 -8.097 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -17.978 -12.053 -8.394 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -16.454 -9.493 -8.610 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -17.948 -9.693 -7.663 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -16.492 -9.014 -6.896 1.00 0.00 H new ATOM 989 N SER A 60 -15.807 -13.558 -5.154 1.00 0.00 N ATOM 990 CA SER A 60 -15.635 -14.973 -4.837 1.00 0.00 C ATOM 991 C SER A 60 -16.481 -15.370 -3.629 1.00 0.00 C ATOM 992 O SER A 60 -17.022 -16.473 -3.585 1.00 0.00 O ATOM 993 CB SER A 60 -14.144 -15.250 -4.579 1.00 0.00 C ATOM 994 OG SER A 60 -13.775 -16.557 -4.978 1.00 0.00 O ATOM 0 H SER A 60 -14.945 -13.020 -5.068 1.00 0.00 H new ATOM 0 HA SER A 60 -15.973 -15.575 -5.681 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.540 -14.521 -5.119 1.00 0.00 H new ATOM 0 HB3 SER A 60 -13.928 -15.119 -3.519 1.00 0.00 H new ATOM 0 HG SER A 60 -12.821 -16.696 -4.801 1.00 0.00 H new ATOM 1000 N GLU A 61 -16.666 -14.438 -2.694 1.00 0.00 N ATOM 1001 CA GLU A 61 -17.421 -14.625 -1.469 1.00 0.00 C ATOM 1002 C GLU A 61 -18.913 -14.851 -1.679 1.00 0.00 C ATOM 1003 O GLU A 61 -19.629 -15.068 -0.705 1.00 0.00 O ATOM 1004 CB GLU A 61 -17.219 -13.373 -0.599 1.00 0.00 C ATOM 1005 CG GLU A 61 -17.392 -13.596 0.909 1.00 0.00 C ATOM 1006 CD GLU A 61 -16.880 -14.938 1.413 1.00 0.00 C ATOM 1007 OE1 GLU A 61 -15.702 -15.266 1.148 1.00 0.00 O ATOM 1008 OE2 GLU A 61 -17.671 -15.682 2.038 1.00 0.00 O ATOM 0 H GLU A 61 -16.277 -13.499 -2.779 1.00 0.00 H new ATOM 0 HA GLU A 61 -17.047 -15.532 -0.994 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.218 -12.981 -0.780 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -17.925 -12.607 -0.921 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -16.873 -12.800 1.443 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.450 -13.509 1.157 1.00 0.00 H new ATOM 1015 N ARG A 62 -19.429 -14.729 -2.907 1.00 0.00 N ATOM 1016 CA ARG A 62 -20.848 -14.929 -3.210 1.00 0.00 C ATOM 1017 C ARG A 62 -21.785 -13.975 -2.456 1.00 0.00 C ATOM 1018 O ARG A 62 -23.001 -14.149 -2.522 1.00 0.00 O ATOM 1019 CB ARG A 62 -21.212 -16.404 -2.939 1.00 0.00 C ATOM 1020 CG ARG A 62 -22.353 -16.922 -3.823 1.00 0.00 C ATOM 1021 CD ARG A 62 -21.835 -17.708 -5.026 1.00 0.00 C ATOM 1022 NE ARG A 62 -21.018 -16.897 -5.944 1.00 0.00 N ATOM 1023 CZ ARG A 62 -19.858 -17.251 -6.510 1.00 0.00 C ATOM 1024 NH1 ARG A 62 -19.177 -18.318 -6.094 1.00 0.00 N ATOM 1025 NH2 ARG A 62 -19.401 -16.519 -7.515 1.00 0.00 N ATOM 0 H ARG A 62 -18.868 -14.487 -3.724 1.00 0.00 H new ATOM 0 HA ARG A 62 -20.996 -14.691 -4.263 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -20.329 -17.023 -3.098 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -21.495 -16.514 -1.892 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -23.010 -17.558 -3.230 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -22.952 -16.081 -4.171 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -21.242 -18.552 -4.672 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -22.682 -18.121 -5.573 1.00 0.00 H new ATOM 0 HE ARG A 62 -21.373 -15.969 -6.172 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -19.538 -18.886 -5.327 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -18.295 -18.567 -6.542 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -19.930 -15.709 -7.838 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -18.520 -16.765 -7.966 1.00 0.00 H new ATOM 1039 N LYS A 63 -21.275 -12.945 -1.767 1.00 0.00 N ATOM 1040 CA LYS A 63 -22.093 -11.997 -1.025 1.00 0.00 C ATOM 1041 C LYS A 63 -21.491 -10.605 -1.063 1.00 0.00 C ATOM 1042 O LYS A 63 -20.267 -10.494 -1.046 1.00 0.00 O ATOM 1043 CB LYS A 63 -22.438 -12.559 0.358 1.00 0.00 C ATOM 1044 CG LYS A 63 -21.213 -12.629 1.253 1.00 0.00 C ATOM 1045 CD LYS A 63 -21.363 -13.385 2.576 1.00 0.00 C ATOM 1046 CE LYS A 63 -21.670 -14.859 2.347 1.00 0.00 C ATOM 1047 NZ LYS A 63 -20.529 -15.652 1.825 1.00 0.00 N ATOM 0 H LYS A 63 -20.275 -12.752 -1.713 1.00 0.00 H new ATOM 0 HA LYS A 63 -23.060 -11.864 -1.510 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -23.197 -11.933 0.827 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -22.868 -13.555 0.250 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -20.406 -13.093 0.687 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -20.899 -11.610 1.479 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -20.445 -13.290 3.156 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -22.161 -12.934 3.165 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -22.001 -15.298 3.288 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -22.502 -14.939 1.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -20.701 -16.663 1.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -20.430 -15.487 0.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -19.655 -15.363 2.309 1.00 0.00 H new ATOM 1061 N PRO A 64 -22.305 -9.544 -1.198 1.00 0.00 N ATOM 1062 CA PRO A 64 -21.820 -8.176 -1.230 1.00 0.00 C ATOM 1063 C PRO A 64 -21.692 -7.592 0.183 1.00 0.00 C ATOM 1064 O PRO A 64 -21.273 -6.442 0.309 1.00 0.00 O ATOM 1065 CB PRO A 64 -22.904 -7.419 -1.999 1.00 0.00 C ATOM 1066 CG PRO A 64 -24.172 -8.065 -1.444 1.00 0.00 C ATOM 1067 CD PRO A 64 -23.764 -9.533 -1.264 1.00 0.00 C ATOM 0 HA PRO A 64 -20.831 -8.107 -1.684 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -22.871 -6.347 -1.807 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -22.813 -7.553 -3.077 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -24.475 -7.612 -0.500 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -25.011 -7.961 -2.131 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -24.198 -9.949 -0.355 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -24.121 -10.141 -2.095 1.00 0.00 H new ATOM 1075 N ALA A 65 -22.096 -8.331 1.230 1.00 0.00 N ATOM 1076 CA ALA A 65 -22.021 -7.840 2.605 1.00 0.00 C ATOM 1077 C ALA A 65 -21.414 -8.918 3.482 1.00 0.00 C ATOM 1078 O ALA A 65 -21.886 -10.059 3.426 1.00 0.00 O ATOM 1079 CB ALA A 65 -23.399 -7.408 3.119 1.00 0.00 C ATOM 0 H ALA A 65 -22.478 -9.273 1.143 1.00 0.00 H new ATOM 0 HA ALA A 65 -21.385 -6.955 2.636 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -23.309 -7.048 4.144 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -23.789 -6.610 2.487 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -24.080 -8.258 3.092 1.00 0.00 H new ATOM 1085 N LEU A 66 -20.380 -8.557 4.247 1.00 0.00 N ATOM 1086 CA LEU A 66 -19.625 -9.436 5.142 1.00 0.00 C ATOM 1087 C LEU A 66 -19.541 -8.825 6.533 1.00 0.00 C ATOM 1088 O LEU A 66 -19.685 -7.612 6.675 1.00 0.00 O ATOM 1089 CB LEU A 66 -18.173 -9.592 4.628 1.00 0.00 C ATOM 1090 CG LEU A 66 -17.985 -9.798 3.114 1.00 0.00 C ATOM 1091 CD1 LEU A 66 -16.503 -9.917 2.767 1.00 0.00 C ATOM 1092 CD2 LEU A 66 -18.705 -11.047 2.620 1.00 0.00 C ATOM 0 H LEU A 66 -20.031 -7.599 4.259 1.00 0.00 H new ATOM 0 HA LEU A 66 -20.135 -10.399 5.173 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.613 -8.704 4.921 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.720 -10.439 5.144 1.00 0.00 H new ATOM 0 HG LEU A 66 -18.414 -8.926 2.621 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -16.391 -10.062 1.692 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -15.985 -9.006 3.066 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -16.073 -10.768 3.295 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -18.548 -11.157 1.547 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -18.311 -11.922 3.136 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -19.772 -10.956 2.823 1.00 0.00 H new ATOM 1104 N THR A 67 -19.283 -9.641 7.550 1.00 0.00 N ATOM 1105 CA THR A 67 -19.141 -9.175 8.923 1.00 0.00 C ATOM 1106 C THR A 67 -17.791 -8.447 9.020 1.00 0.00 C ATOM 1107 O THR A 67 -16.858 -8.797 8.290 1.00 0.00 O ATOM 1108 CB THR A 67 -19.206 -10.373 9.885 1.00 0.00 C ATOM 1109 OG1 THR A 67 -20.031 -11.412 9.364 1.00 0.00 O ATOM 1110 CG2 THR A 67 -19.759 -9.939 11.240 1.00 0.00 C ATOM 0 H THR A 67 -19.166 -10.649 7.443 1.00 0.00 H new ATOM 0 HA THR A 67 -19.946 -8.494 9.199 1.00 0.00 H new ATOM 0 HB THR A 67 -18.190 -10.751 10.002 1.00 0.00 H new ATOM 0 HG1 THR A 67 -20.961 -11.104 9.327 1.00 0.00 H new ATOM 0 HG21 THR A 67 -19.799 -10.799 11.909 1.00 0.00 H new ATOM 0 HG22 THR A 67 -19.111 -9.174 11.669 1.00 0.00 H new ATOM 0 HG23 THR A 67 -20.762 -9.534 11.111 1.00 0.00 H new ATOM 1118 N MET A 68 -17.666 -7.463 9.916 1.00 0.00 N ATOM 1119 CA MET A 68 -16.444 -6.687 10.101 1.00 0.00 C ATOM 1120 C MET A 68 -15.253 -7.596 10.424 1.00 0.00 C ATOM 1121 O MET A 68 -14.196 -7.466 9.811 1.00 0.00 O ATOM 1122 CB MET A 68 -16.674 -5.610 11.174 1.00 0.00 C ATOM 1123 CG MET A 68 -15.492 -4.645 11.293 1.00 0.00 C ATOM 1124 SD MET A 68 -15.050 -3.740 9.779 1.00 0.00 S ATOM 1125 CE MET A 68 -16.417 -2.553 9.694 1.00 0.00 C ATOM 0 H MET A 68 -18.423 -7.182 10.540 1.00 0.00 H new ATOM 0 HA MET A 68 -16.194 -6.181 9.169 1.00 0.00 H new ATOM 0 HB2 MET A 68 -17.576 -5.048 10.933 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.846 -6.091 12.137 1.00 0.00 H new ATOM 0 HG2 MET A 68 -15.718 -3.919 12.074 1.00 0.00 H new ATOM 0 HG3 MET A 68 -14.620 -5.209 11.624 1.00 0.00 H new ATOM 0 HE1 MET A 68 -16.231 -1.841 8.890 1.00 0.00 H new ATOM 0 HE2 MET A 68 -17.349 -3.084 9.499 1.00 0.00 H new ATOM 0 HE3 MET A 68 -16.495 -2.019 10.641 1.00 0.00 H new ATOM 1135 N GLU A 69 -15.439 -8.552 11.332 1.00 0.00 N ATOM 1136 CA GLU A 69 -14.410 -9.492 11.752 1.00 0.00 C ATOM 1137 C GLU A 69 -13.923 -10.329 10.563 1.00 0.00 C ATOM 1138 O GLU A 69 -12.716 -10.516 10.387 1.00 0.00 O ATOM 1139 CB GLU A 69 -14.979 -10.349 12.900 1.00 0.00 C ATOM 1140 CG GLU A 69 -14.049 -11.490 13.319 1.00 0.00 C ATOM 1141 CD GLU A 69 -14.450 -12.121 14.652 1.00 0.00 C ATOM 1142 OE1 GLU A 69 -15.265 -13.078 14.663 1.00 0.00 O ATOM 1143 OE2 GLU A 69 -13.955 -11.685 15.716 1.00 0.00 O ATOM 0 H GLU A 69 -16.331 -8.695 11.805 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.531 -8.964 12.122 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -15.170 -9.710 13.762 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.939 -10.765 12.593 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -14.050 -12.257 12.544 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.029 -11.113 13.393 1.00 0.00 H new ATOM 1150 N VAL A 70 -14.856 -10.818 9.742 1.00 0.00 N ATOM 1151 CA VAL A 70 -14.553 -11.641 8.580 1.00 0.00 C ATOM 1152 C VAL A 70 -13.752 -10.842 7.550 1.00 0.00 C ATOM 1153 O VAL A 70 -12.672 -11.277 7.153 1.00 0.00 O ATOM 1154 CB VAL A 70 -15.854 -12.244 8.003 1.00 0.00 C ATOM 1155 CG1 VAL A 70 -15.602 -13.082 6.739 1.00 0.00 C ATOM 1156 CG2 VAL A 70 -16.550 -13.139 9.043 1.00 0.00 C ATOM 0 H VAL A 70 -15.853 -10.649 9.872 1.00 0.00 H new ATOM 0 HA VAL A 70 -13.921 -12.478 8.878 1.00 0.00 H new ATOM 0 HB VAL A 70 -16.490 -11.398 7.742 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -16.548 -13.483 6.374 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -15.153 -12.454 5.970 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -14.927 -13.904 6.976 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -17.463 -13.552 8.615 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -15.883 -13.952 9.328 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -16.798 -12.547 9.924 1.00 0.00 H new ATOM 1166 N VAL A 71 -14.250 -9.684 7.099 1.00 0.00 N ATOM 1167 CA VAL A 71 -13.541 -8.883 6.099 1.00 0.00 C ATOM 1168 C VAL A 71 -12.152 -8.434 6.579 1.00 0.00 C ATOM 1169 O VAL A 71 -11.235 -8.311 5.768 1.00 0.00 O ATOM 1170 CB VAL A 71 -14.427 -7.710 5.624 1.00 0.00 C ATOM 1171 CG1 VAL A 71 -14.697 -6.638 6.683 1.00 0.00 C ATOM 1172 CG2 VAL A 71 -13.840 -7.026 4.389 1.00 0.00 C ATOM 0 H VAL A 71 -15.136 -9.284 7.410 1.00 0.00 H new ATOM 0 HA VAL A 71 -13.348 -9.517 5.234 1.00 0.00 H new ATOM 0 HB VAL A 71 -15.380 -8.184 5.390 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -15.327 -5.857 6.257 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -15.205 -7.089 7.536 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.752 -6.204 7.011 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -14.490 -6.206 4.084 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -12.850 -6.636 4.625 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -13.761 -7.748 3.576 1.00 0.00 H new ATOM 1182 N CYS A 72 -11.991 -8.215 7.881 1.00 0.00 N ATOM 1183 CA CYS A 72 -10.750 -7.764 8.481 1.00 0.00 C ATOM 1184 C CYS A 72 -9.667 -8.815 8.297 1.00 0.00 C ATOM 1185 O CYS A 72 -8.635 -8.548 7.671 1.00 0.00 O ATOM 1186 CB CYS A 72 -10.978 -7.442 9.962 1.00 0.00 C ATOM 1187 SG CYS A 72 -9.517 -6.618 10.647 1.00 0.00 S ATOM 0 H CYS A 72 -12.740 -8.351 8.559 1.00 0.00 H new ATOM 0 HA CYS A 72 -10.414 -6.853 7.985 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -11.853 -6.801 10.073 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -11.182 -8.359 10.515 1.00 0.00 H new ATOM 0 HG CYS A 72 -9.720 -6.347 11.902 1.00 0.00 H new ATOM 1193 N ALA A 73 -9.903 -10.009 8.844 1.00 0.00 N ATOM 1194 CA ALA A 73 -8.955 -11.102 8.754 1.00 0.00 C ATOM 1195 C ALA A 73 -8.703 -11.492 7.291 1.00 0.00 C ATOM 1196 O ALA A 73 -7.565 -11.774 6.900 1.00 0.00 O ATOM 1197 CB ALA A 73 -9.462 -12.260 9.595 1.00 0.00 C ATOM 0 H ALA A 73 -10.754 -10.237 9.358 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.988 -10.793 9.150 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -8.757 -13.089 9.535 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -9.560 -11.941 10.633 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.434 -12.583 9.222 1.00 0.00 H new ATOM 1203 N ARG A 74 -9.747 -11.447 6.460 1.00 0.00 N ATOM 1204 CA ARG A 74 -9.668 -11.770 5.041 1.00 0.00 C ATOM 1205 C ARG A 74 -8.703 -10.852 4.300 1.00 0.00 C ATOM 1206 O ARG A 74 -8.039 -11.315 3.372 1.00 0.00 O ATOM 1207 CB ARG A 74 -11.074 -11.625 4.434 1.00 0.00 C ATOM 1208 CG ARG A 74 -11.906 -12.912 4.514 1.00 0.00 C ATOM 1209 CD ARG A 74 -11.496 -13.921 3.429 1.00 0.00 C ATOM 1210 NE ARG A 74 -12.262 -15.177 3.548 1.00 0.00 N ATOM 1211 CZ ARG A 74 -12.243 -16.191 2.671 1.00 0.00 C ATOM 1212 NH1 ARG A 74 -11.555 -16.087 1.538 1.00 0.00 N ATOM 1213 NH2 ARG A 74 -12.906 -17.305 2.951 1.00 0.00 N ATOM 0 H ARG A 74 -10.684 -11.180 6.763 1.00 0.00 H new ATOM 0 HA ARG A 74 -9.296 -12.789 4.938 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -11.604 -10.825 4.951 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -10.982 -11.324 3.390 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -11.783 -13.365 5.498 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.963 -12.670 4.405 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -11.659 -13.485 2.443 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -10.430 -14.133 3.511 1.00 0.00 H new ATOM 0 HE ARG A 74 -12.858 -15.283 4.369 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -11.038 -15.232 1.332 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -11.544 -16.862 0.875 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -13.424 -17.384 3.826 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -12.898 -18.083 2.291 1.00 0.00 H new ATOM 1227 N MET A 75 -8.649 -9.574 4.666 1.00 0.00 N ATOM 1228 CA MET A 75 -7.790 -8.588 4.032 1.00 0.00 C ATOM 1229 C MET A 75 -6.379 -8.610 4.605 1.00 0.00 C ATOM 1230 O MET A 75 -5.414 -8.639 3.834 1.00 0.00 O ATOM 1231 CB MET A 75 -8.418 -7.195 4.193 1.00 0.00 C ATOM 1232 CG MET A 75 -9.366 -6.811 3.050 1.00 0.00 C ATOM 1233 SD MET A 75 -10.695 -7.944 2.562 1.00 0.00 S ATOM 1234 CE MET A 75 -9.932 -8.730 1.119 1.00 0.00 C ATOM 0 H MET A 75 -9.213 -9.192 5.425 1.00 0.00 H new ATOM 0 HA MET A 75 -7.705 -8.835 2.974 1.00 0.00 H new ATOM 0 HB2 MET A 75 -8.965 -7.159 5.135 1.00 0.00 H new ATOM 0 HB3 MET A 75 -7.622 -6.453 4.259 1.00 0.00 H new ATOM 0 HG2 MET A 75 -9.830 -5.862 3.318 1.00 0.00 H new ATOM 0 HG3 MET A 75 -8.754 -6.629 2.167 1.00 0.00 H new ATOM 0 HE1 MET A 75 -10.516 -8.499 0.228 1.00 0.00 H new ATOM 0 HE2 MET A 75 -8.916 -8.355 0.995 1.00 0.00 H new ATOM 0 HE3 MET A 75 -9.904 -9.810 1.265 1.00 0.00 H new ATOM 1244 N VAL A 76 -6.248 -8.605 5.935 1.00 0.00 N ATOM 1245 CA VAL A 76 -4.976 -8.597 6.643 1.00 0.00 C ATOM 1246 C VAL A 76 -4.092 -9.789 6.258 1.00 0.00 C ATOM 1247 O VAL A 76 -2.872 -9.643 6.234 1.00 0.00 O ATOM 1248 CB VAL A 76 -5.236 -8.411 8.156 1.00 0.00 C ATOM 1249 CG1 VAL A 76 -5.478 -9.718 8.912 1.00 0.00 C ATOM 1250 CG2 VAL A 76 -4.083 -7.675 8.830 1.00 0.00 C ATOM 0 H VAL A 76 -7.052 -8.606 6.563 1.00 0.00 H new ATOM 0 HA VAL A 76 -4.376 -7.742 6.332 1.00 0.00 H new ATOM 0 HB VAL A 76 -6.152 -7.822 8.206 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.652 -9.502 9.966 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.350 -10.223 8.496 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -4.604 -10.362 8.813 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -4.296 -7.560 9.893 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -3.163 -8.247 8.704 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -3.964 -6.691 8.375 1.00 0.00 H new ATOM 1260 N ASP A 77 -4.657 -10.945 5.886 1.00 0.00 N ATOM 1261 CA ASP A 77 -3.862 -12.117 5.479 1.00 0.00 C ATOM 1262 C ASP A 77 -3.035 -11.850 4.213 1.00 0.00 C ATOM 1263 O ASP A 77 -2.122 -12.607 3.880 1.00 0.00 O ATOM 1264 CB ASP A 77 -4.781 -13.310 5.250 1.00 0.00 C ATOM 1265 CG ASP A 77 -4.052 -14.564 4.755 1.00 0.00 C ATOM 1266 OD1 ASP A 77 -3.124 -15.077 5.425 1.00 0.00 O ATOM 1267 OD2 ASP A 77 -4.450 -15.070 3.680 1.00 0.00 O ATOM 0 H ASP A 77 -5.665 -11.096 5.858 1.00 0.00 H new ATOM 0 HA ASP A 77 -3.163 -12.332 6.287 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -5.296 -13.544 6.181 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.545 -13.034 4.523 1.00 0.00 H new ATOM 1272 N SER A 78 -3.322 -10.773 3.473 1.00 0.00 N ATOM 1273 CA SER A 78 -2.569 -10.445 2.275 1.00 0.00 C ATOM 1274 C SER A 78 -1.196 -9.883 2.658 1.00 0.00 C ATOM 1275 O SER A 78 -0.432 -9.560 1.749 1.00 0.00 O ATOM 1276 CB SER A 78 -3.356 -9.464 1.391 1.00 0.00 C ATOM 1277 OG SER A 78 -2.675 -9.233 0.163 1.00 0.00 O ATOM 0 H SER A 78 -4.073 -10.118 3.690 1.00 0.00 H new ATOM 0 HA SER A 78 -2.413 -11.353 1.693 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.350 -9.864 1.191 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.493 -8.520 1.919 1.00 0.00 H new ATOM 0 HG SER A 78 -1.708 -9.285 0.311 1.00 0.00 H new ATOM 1283 N CYS A 79 -0.872 -9.729 3.950 1.00 0.00 N ATOM 1284 CA CYS A 79 0.411 -9.184 4.371 1.00 0.00 C ATOM 1285 C CYS A 79 1.590 -10.136 4.191 1.00 0.00 C ATOM 1286 O CYS A 79 2.725 -9.709 4.381 1.00 0.00 O ATOM 1287 CB CYS A 79 0.334 -8.615 5.787 1.00 0.00 C ATOM 1288 SG CYS A 79 0.120 -9.915 7.033 1.00 0.00 S ATOM 0 H CYS A 79 -1.491 -9.979 4.721 1.00 0.00 H new ATOM 0 HA CYS A 79 0.620 -8.361 3.688 1.00 0.00 H new ATOM 0 HB2 CYS A 79 1.243 -8.054 6.002 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -0.497 -7.912 5.850 1.00 0.00 H new ATOM 0 HG CYS A 79 -1.141 -10.213 7.137 1.00 0.00 H new ATOM 1294 N GLN A 80 1.335 -11.379 3.773 1.00 0.00 N ATOM 1295 CA GLN A 80 2.304 -12.448 3.524 1.00 0.00 C ATOM 1296 C GLN A 80 3.274 -12.172 2.355 1.00 0.00 C ATOM 1297 O GLN A 80 3.568 -13.060 1.551 1.00 0.00 O ATOM 1298 CB GLN A 80 1.512 -13.750 3.317 1.00 0.00 C ATOM 1299 CG GLN A 80 0.588 -13.738 2.082 1.00 0.00 C ATOM 1300 CD GLN A 80 -0.218 -15.025 1.990 1.00 0.00 C ATOM 1301 OE1 GLN A 80 0.244 -16.036 1.466 1.00 0.00 O ATOM 1302 NE2 GLN A 80 -1.445 -15.014 2.480 1.00 0.00 N ATOM 0 H GLN A 80 0.380 -11.685 3.587 1.00 0.00 H new ATOM 0 HA GLN A 80 2.962 -12.523 4.390 1.00 0.00 H new ATOM 0 HB2 GLN A 80 2.214 -14.578 3.223 1.00 0.00 H new ATOM 0 HB3 GLN A 80 0.910 -13.941 4.205 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -0.088 -12.885 2.138 1.00 0.00 H new ATOM 0 HG3 GLN A 80 1.185 -13.613 1.178 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -1.814 -14.167 2.912 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -2.023 -15.853 2.426 1.00 0.00 H new ATOM 1311 N THR A 81 3.774 -10.951 2.216 1.00 0.00 N ATOM 1312 CA THR A 81 4.665 -10.525 1.165 1.00 0.00 C ATOM 1313 C THR A 81 5.816 -9.718 1.787 1.00 0.00 C ATOM 1314 O THR A 81 6.772 -10.332 2.277 1.00 0.00 O ATOM 1315 CB THR A 81 3.811 -9.869 0.053 1.00 0.00 C ATOM 1316 OG1 THR A 81 4.626 -9.229 -0.900 1.00 0.00 O ATOM 1317 CG2 THR A 81 2.748 -8.889 0.560 1.00 0.00 C ATOM 0 H THR A 81 3.553 -10.200 2.870 1.00 0.00 H new ATOM 0 HA THR A 81 5.186 -11.333 0.652 1.00 0.00 H new ATOM 0 HB THR A 81 3.272 -10.697 -0.407 1.00 0.00 H new ATOM 0 HG1 THR A 81 4.063 -8.824 -1.593 1.00 0.00 H new ATOM 0 HG21 THR A 81 2.198 -8.478 -0.287 1.00 0.00 H new ATOM 0 HG22 THR A 81 2.057 -9.412 1.222 1.00 0.00 H new ATOM 0 HG23 THR A 81 3.231 -8.079 1.106 1.00 0.00 H new ATOM 1325 N ALA A 82 5.748 -8.384 1.843 1.00 0.00 N ATOM 1326 CA ALA A 82 6.814 -7.551 2.399 1.00 0.00 C ATOM 1327 C ALA A 82 6.317 -6.235 3.001 1.00 0.00 C ATOM 1328 O ALA A 82 7.082 -5.284 3.180 1.00 0.00 O ATOM 1329 CB ALA A 82 7.874 -7.327 1.317 1.00 0.00 C ATOM 0 H ALA A 82 4.948 -7.851 1.502 1.00 0.00 H new ATOM 0 HA ALA A 82 7.254 -8.083 3.243 1.00 0.00 H new ATOM 0 HB1 ALA A 82 8.676 -6.707 1.717 1.00 0.00 H new ATOM 0 HB2 ALA A 82 8.281 -8.288 1.002 1.00 0.00 H new ATOM 0 HB3 ALA A 82 7.421 -6.827 0.461 1.00 0.00 H new ATOM 1335 N LEU A 83 5.026 -6.154 3.287 1.00 0.00 N ATOM 1336 CA LEU A 83 4.342 -5.011 3.882 1.00 0.00 C ATOM 1337 C LEU A 83 3.783 -5.482 5.222 1.00 0.00 C ATOM 1338 O LEU A 83 3.676 -6.686 5.469 1.00 0.00 O ATOM 1339 CB LEU A 83 3.299 -4.400 2.919 1.00 0.00 C ATOM 1340 CG LEU A 83 2.372 -5.389 2.194 1.00 0.00 C ATOM 1341 CD1 LEU A 83 1.264 -5.920 3.101 1.00 0.00 C ATOM 1342 CD2 LEU A 83 1.694 -4.750 0.981 1.00 0.00 C ATOM 0 H LEU A 83 4.389 -6.928 3.100 1.00 0.00 H new ATOM 0 HA LEU A 83 5.024 -4.181 4.064 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.680 -3.704 3.484 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.830 -3.816 2.167 1.00 0.00 H new ATOM 0 HG LEU A 83 3.021 -6.207 1.882 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.637 -6.614 2.541 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.707 -6.437 3.952 1.00 0.00 H new ATOM 0 HD13 LEU A 83 0.656 -5.089 3.457 1.00 0.00 H new ATOM 0 HD21 LEU A 83 1.048 -5.483 0.497 1.00 0.00 H new ATOM 0 HD22 LEU A 83 1.097 -3.898 1.305 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.453 -4.414 0.275 1.00 0.00 H new ATOM 1354 N SER A 84 3.465 -4.551 6.109 1.00 0.00 N ATOM 1355 CA SER A 84 2.937 -4.864 7.426 1.00 0.00 C ATOM 1356 C SER A 84 1.398 -4.829 7.396 1.00 0.00 C ATOM 1357 O SER A 84 0.807 -4.169 6.534 1.00 0.00 O ATOM 1358 CB SER A 84 3.567 -3.886 8.436 1.00 0.00 C ATOM 1359 OG SER A 84 3.663 -2.574 7.913 1.00 0.00 O ATOM 0 H SER A 84 3.567 -3.551 5.933 1.00 0.00 H new ATOM 0 HA SER A 84 3.200 -5.874 7.739 1.00 0.00 H new ATOM 0 HB2 SER A 84 2.969 -3.870 9.347 1.00 0.00 H new ATOM 0 HB3 SER A 84 4.560 -4.240 8.713 1.00 0.00 H new ATOM 0 HG SER A 84 4.066 -1.983 8.583 1.00 0.00 H new ATOM 1365 N PRO A 85 0.713 -5.476 8.356 1.00 0.00 N ATOM 1366 CA PRO A 85 -0.748 -5.500 8.424 1.00 0.00 C ATOM 1367 C PRO A 85 -1.369 -4.115 8.684 1.00 0.00 C ATOM 1368 O PRO A 85 -2.594 -3.975 8.626 1.00 0.00 O ATOM 1369 CB PRO A 85 -1.080 -6.525 9.513 1.00 0.00 C ATOM 1370 CG PRO A 85 0.147 -6.551 10.409 1.00 0.00 C ATOM 1371 CD PRO A 85 1.277 -6.296 9.417 1.00 0.00 C ATOM 0 HA PRO A 85 -1.184 -5.784 7.466 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -1.971 -6.235 10.070 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -1.278 -7.508 9.084 1.00 0.00 H new ATOM 0 HG2 PRO A 85 0.103 -5.784 11.182 1.00 0.00 H new ATOM 0 HG3 PRO A 85 0.260 -7.509 10.917 1.00 0.00 H new ATOM 0 HD2 PRO A 85 2.111 -5.787 9.900 1.00 0.00 H new ATOM 0 HD3 PRO A 85 1.664 -7.234 9.019 1.00 0.00 H new ATOM 1379 N GLY A 86 -0.558 -3.097 8.999 1.00 0.00 N ATOM 1380 CA GLY A 86 -1.020 -1.739 9.232 1.00 0.00 C ATOM 1381 C GLY A 86 -1.288 -1.056 7.894 1.00 0.00 C ATOM 1382 O GLY A 86 -2.290 -0.356 7.767 1.00 0.00 O ATOM 0 H GLY A 86 0.451 -3.204 9.099 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -1.928 -1.751 9.835 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.272 -1.180 9.794 1.00 0.00 H new ATOM 1386 N GLU A 87 -0.450 -1.312 6.877 1.00 0.00 N ATOM 1387 CA GLU A 87 -0.589 -0.729 5.544 1.00 0.00 C ATOM 1388 C GLU A 87 -1.951 -1.120 4.978 1.00 0.00 C ATOM 1389 O GLU A 87 -2.691 -0.279 4.477 1.00 0.00 O ATOM 1390 CB GLU A 87 0.537 -1.205 4.598 1.00 0.00 C ATOM 1391 CG GLU A 87 1.974 -1.151 5.147 1.00 0.00 C ATOM 1392 CD GLU A 87 2.512 0.255 5.418 1.00 0.00 C ATOM 1393 OE1 GLU A 87 1.773 1.120 5.938 1.00 0.00 O ATOM 1394 OE2 GLU A 87 3.714 0.511 5.166 1.00 0.00 O ATOM 0 H GLU A 87 0.351 -1.938 6.964 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.511 0.355 5.624 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.323 -2.233 4.306 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.497 -0.601 3.691 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.014 -1.724 6.074 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.637 -1.646 4.437 1.00 0.00 H new ATOM 1401 N MET A 88 -2.293 -2.407 5.119 1.00 0.00 N ATOM 1402 CA MET A 88 -3.545 -2.992 4.665 1.00 0.00 C ATOM 1403 C MET A 88 -4.739 -2.187 5.166 1.00 0.00 C ATOM 1404 O MET A 88 -5.653 -1.865 4.408 1.00 0.00 O ATOM 1405 CB MET A 88 -3.655 -4.437 5.179 1.00 0.00 C ATOM 1406 CG MET A 88 -4.345 -5.305 4.130 1.00 0.00 C ATOM 1407 SD MET A 88 -3.276 -5.721 2.727 1.00 0.00 S ATOM 1408 CE MET A 88 -2.133 -6.813 3.597 1.00 0.00 C ATOM 0 H MET A 88 -1.679 -3.086 5.569 1.00 0.00 H new ATOM 0 HA MET A 88 -3.552 -2.981 3.575 1.00 0.00 H new ATOM 0 HB2 MET A 88 -2.663 -4.832 5.397 1.00 0.00 H new ATOM 0 HB3 MET A 88 -4.219 -4.460 6.112 1.00 0.00 H new ATOM 0 HG2 MET A 88 -4.690 -6.226 4.600 1.00 0.00 H new ATOM 0 HG3 MET A 88 -5.229 -4.784 3.762 1.00 0.00 H new ATOM 0 HE1 MET A 88 -1.448 -7.267 2.881 1.00 0.00 H new ATOM 0 HE2 MET A 88 -1.565 -6.237 4.328 1.00 0.00 H new ATOM 0 HE3 MET A 88 -2.695 -7.595 4.108 1.00 0.00 H new ATOM 1418 N GLU A 89 -4.728 -1.899 6.467 1.00 0.00 N ATOM 1419 CA GLU A 89 -5.776 -1.153 7.124 1.00 0.00 C ATOM 1420 C GLU A 89 -5.921 0.203 6.447 1.00 0.00 C ATOM 1421 O GLU A 89 -7.002 0.511 5.953 1.00 0.00 O ATOM 1422 CB GLU A 89 -5.472 -1.081 8.624 1.00 0.00 C ATOM 1423 CG GLU A 89 -6.726 -0.718 9.423 1.00 0.00 C ATOM 1424 CD GLU A 89 -6.555 -0.982 10.918 1.00 0.00 C ATOM 1425 OE1 GLU A 89 -6.053 -2.072 11.300 1.00 0.00 O ATOM 1426 OE2 GLU A 89 -7.023 -0.157 11.730 1.00 0.00 O ATOM 0 H GLU A 89 -3.976 -2.186 7.094 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.744 -1.645 7.031 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -5.084 -2.040 8.966 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -4.694 -0.339 8.805 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.962 0.335 9.266 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.572 -1.294 9.049 1.00 0.00 H new ATOM 1433 N LYS A 90 -4.831 0.973 6.357 1.00 0.00 N ATOM 1434 CA LYS A 90 -4.820 2.298 5.731 1.00 0.00 C ATOM 1435 C LYS A 90 -5.302 2.257 4.283 1.00 0.00 C ATOM 1436 O LYS A 90 -5.839 3.246 3.789 1.00 0.00 O ATOM 1437 CB LYS A 90 -3.430 2.941 5.859 1.00 0.00 C ATOM 1438 CG LYS A 90 -3.072 3.064 7.348 1.00 0.00 C ATOM 1439 CD LYS A 90 -1.920 4.026 7.633 1.00 0.00 C ATOM 1440 CE LYS A 90 -1.530 3.949 9.115 1.00 0.00 C ATOM 1441 NZ LYS A 90 -2.619 4.344 10.034 1.00 0.00 N ATOM 0 H LYS A 90 -3.921 0.689 6.721 1.00 0.00 H new ATOM 0 HA LYS A 90 -5.532 2.926 6.267 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.686 2.336 5.341 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -3.425 3.924 5.388 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.953 3.396 7.897 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.811 2.077 7.731 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.062 3.775 7.009 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -2.213 5.044 7.378 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -1.220 2.930 9.348 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -0.667 4.592 9.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.259 4.367 11.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -2.969 5.287 9.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -3.396 3.656 9.968 1.00 0.00 H new ATOM 1455 N HIS A 91 -5.129 1.136 3.580 1.00 0.00 N ATOM 1456 CA HIS A 91 -5.581 1.030 2.200 1.00 0.00 C ATOM 1457 C HIS A 91 -7.102 0.961 2.194 1.00 0.00 C ATOM 1458 O HIS A 91 -7.741 1.540 1.318 1.00 0.00 O ATOM 1459 CB HIS A 91 -5.006 -0.183 1.469 1.00 0.00 C ATOM 1460 CG HIS A 91 -3.500 -0.278 1.413 1.00 0.00 C ATOM 1461 ND1 HIS A 91 -2.765 -1.441 1.493 1.00 0.00 N ATOM 1462 CD2 HIS A 91 -2.626 0.747 1.176 1.00 0.00 C ATOM 1463 CE1 HIS A 91 -1.472 -1.122 1.315 1.00 0.00 C ATOM 1464 NE2 HIS A 91 -1.340 0.196 1.103 1.00 0.00 N ATOM 0 H HIS A 91 -4.681 0.295 3.945 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.222 1.910 1.665 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -5.388 -1.084 1.948 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -5.387 -0.179 0.448 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -2.881 1.791 1.065 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -0.654 -1.827 1.339 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -0.471 0.700 0.923 1.00 0.00 H new ATOM 1472 N LEU A 92 -7.694 0.230 3.141 1.00 0.00 N ATOM 1473 CA LEU A 92 -9.144 0.117 3.246 1.00 0.00 C ATOM 1474 C LEU A 92 -9.714 1.494 3.574 1.00 0.00 C ATOM 1475 O LEU A 92 -10.746 1.867 3.012 1.00 0.00 O ATOM 1476 CB LEU A 92 -9.542 -0.923 4.309 1.00 0.00 C ATOM 1477 CG LEU A 92 -9.063 -2.339 3.943 1.00 0.00 C ATOM 1478 CD1 LEU A 92 -9.074 -3.254 5.170 1.00 0.00 C ATOM 1479 CD2 LEU A 92 -9.946 -2.944 2.843 1.00 0.00 C ATOM 0 H LEU A 92 -7.183 -0.296 3.850 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.556 -0.229 2.298 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -9.120 -0.636 5.272 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.626 -0.926 4.424 1.00 0.00 H new ATOM 0 HG LEU A 92 -8.041 -2.257 3.574 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -8.731 -4.249 4.885 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -8.411 -2.847 5.933 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -10.087 -3.319 5.566 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -9.590 -3.945 2.600 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.976 -3.001 3.194 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -9.900 -2.316 1.953 1.00 0.00 H new ATOM 1491 N VAL A 93 -9.026 2.256 4.433 1.00 0.00 N ATOM 1492 CA VAL A 93 -9.451 3.592 4.820 1.00 0.00 C ATOM 1493 C VAL A 93 -9.444 4.500 3.590 1.00 0.00 C ATOM 1494 O VAL A 93 -10.466 5.123 3.295 1.00 0.00 O ATOM 1495 CB VAL A 93 -8.556 4.167 5.941 1.00 0.00 C ATOM 1496 CG1 VAL A 93 -9.173 5.464 6.461 1.00 0.00 C ATOM 1497 CG2 VAL A 93 -8.369 3.200 7.117 1.00 0.00 C ATOM 0 H VAL A 93 -8.158 1.956 4.876 1.00 0.00 H new ATOM 0 HA VAL A 93 -10.464 3.537 5.219 1.00 0.00 H new ATOM 0 HB VAL A 93 -7.572 4.342 5.505 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -8.545 5.874 7.252 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -9.246 6.184 5.646 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -10.168 5.261 6.856 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -7.731 3.662 7.870 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.340 2.969 7.556 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -7.903 2.281 6.762 1.00 0.00 H new ATOM 1507 N LEU A 94 -8.322 4.557 2.861 1.00 0.00 N ATOM 1508 CA LEU A 94 -8.178 5.398 1.677 1.00 0.00 C ATOM 1509 C LEU A 94 -9.214 5.038 0.615 1.00 0.00 C ATOM 1510 O LEU A 94 -9.784 5.920 -0.027 1.00 0.00 O ATOM 1511 CB LEU A 94 -6.717 5.375 1.161 1.00 0.00 C ATOM 1512 CG LEU A 94 -6.346 4.443 -0.014 1.00 0.00 C ATOM 1513 CD1 LEU A 94 -6.682 5.018 -1.400 1.00 0.00 C ATOM 1514 CD2 LEU A 94 -4.833 4.178 0.012 1.00 0.00 C ATOM 0 H LEU A 94 -7.486 4.016 3.082 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.385 6.433 1.949 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.457 6.392 0.867 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.076 5.112 2.003 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.938 3.538 0.125 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.391 4.304 -2.170 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.754 5.206 -1.466 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.140 5.952 -1.548 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.564 3.521 -0.815 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.297 5.122 -0.086 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.563 3.703 0.955 1.00 0.00 H new ATOM 1526 N LEU A 95 -9.477 3.745 0.423 1.00 0.00 N ATOM 1527 CA LEU A 95 -10.443 3.296 -0.565 1.00 0.00 C ATOM 1528 C LEU A 95 -11.825 3.803 -0.182 1.00 0.00 C ATOM 1529 O LEU A 95 -12.477 4.422 -1.018 1.00 0.00 O ATOM 1530 CB LEU A 95 -10.410 1.766 -0.694 1.00 0.00 C ATOM 1531 CG LEU A 95 -9.257 1.274 -1.588 1.00 0.00 C ATOM 1532 CD1 LEU A 95 -9.065 -0.240 -1.424 1.00 0.00 C ATOM 1533 CD2 LEU A 95 -9.478 1.590 -3.075 1.00 0.00 C ATOM 0 H LEU A 95 -9.029 2.991 0.944 1.00 0.00 H new ATOM 0 HA LEU A 95 -10.187 3.704 -1.543 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -10.311 1.323 0.297 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -11.358 1.419 -1.105 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.365 1.810 -1.262 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -8.247 -0.574 -2.062 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -8.830 -0.466 -0.384 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -9.982 -0.756 -1.710 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.633 1.219 -3.655 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -10.393 1.107 -3.418 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -9.565 2.668 -3.209 1.00 0.00 H new ATOM 1545 N ALA A 96 -12.270 3.554 1.050 1.00 0.00 N ATOM 1546 CA ALA A 96 -13.574 4.013 1.519 1.00 0.00 C ATOM 1547 C ALA A 96 -13.650 5.543 1.572 1.00 0.00 C ATOM 1548 O ALA A 96 -14.739 6.097 1.492 1.00 0.00 O ATOM 1549 CB ALA A 96 -13.865 3.425 2.902 1.00 0.00 C ATOM 0 H ALA A 96 -11.739 3.031 1.746 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.326 3.668 0.809 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -14.839 3.771 3.247 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.867 2.337 2.842 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -13.096 3.748 3.604 1.00 0.00 H new ATOM 1555 N GLU A 97 -12.526 6.250 1.689 1.00 0.00 N ATOM 1556 CA GLU A 97 -12.513 7.704 1.743 1.00 0.00 C ATOM 1557 C GLU A 97 -12.924 8.297 0.397 1.00 0.00 C ATOM 1558 O GLU A 97 -13.811 9.153 0.344 1.00 0.00 O ATOM 1559 CB GLU A 97 -11.126 8.183 2.171 1.00 0.00 C ATOM 1560 CG GLU A 97 -11.036 9.708 2.215 1.00 0.00 C ATOM 1561 CD GLU A 97 -9.894 10.114 3.130 1.00 0.00 C ATOM 1562 OE1 GLU A 97 -10.124 10.104 4.366 1.00 0.00 O ATOM 1563 OE2 GLU A 97 -8.795 10.395 2.605 1.00 0.00 O ATOM 0 H GLU A 97 -11.600 5.826 1.749 1.00 0.00 H new ATOM 0 HA GLU A 97 -13.239 8.047 2.480 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -10.890 7.777 3.155 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -10.379 7.795 1.478 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.873 10.104 1.213 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -11.974 10.129 2.576 1.00 0.00 H new ATOM 1570 N LEU A 98 -12.289 7.851 -0.689 1.00 0.00 N ATOM 1571 CA LEU A 98 -12.586 8.344 -2.030 1.00 0.00 C ATOM 1572 C LEU A 98 -13.793 7.644 -2.641 1.00 0.00 C ATOM 1573 O LEU A 98 -14.415 8.185 -3.558 1.00 0.00 O ATOM 1574 CB LEU A 98 -11.407 8.064 -2.976 1.00 0.00 C ATOM 1575 CG LEU A 98 -10.185 8.988 -2.901 1.00 0.00 C ATOM 1576 CD1 LEU A 98 -10.596 10.459 -2.975 1.00 0.00 C ATOM 1577 CD2 LEU A 98 -9.300 8.699 -1.689 1.00 0.00 C ATOM 0 H LEU A 98 -11.558 7.141 -0.661 1.00 0.00 H new ATOM 0 HA LEU A 98 -12.780 9.411 -1.924 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -11.066 7.045 -2.792 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -11.785 8.094 -3.998 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.573 8.773 -3.777 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.708 11.088 -2.919 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -11.114 10.645 -3.916 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -11.260 10.694 -2.143 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.451 9.383 -1.687 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -9.878 8.836 -0.775 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.939 7.672 -1.739 1.00 0.00 H new ATOM 1589 N LEU A 99 -14.100 6.436 -2.167 1.00 0.00 N ATOM 1590 CA LEU A 99 -15.191 5.603 -2.647 1.00 0.00 C ATOM 1591 C LEU A 99 -16.124 5.214 -1.484 1.00 0.00 C ATOM 1592 O LEU A 99 -16.335 4.020 -1.248 1.00 0.00 O ATOM 1593 CB LEU A 99 -14.598 4.370 -3.364 1.00 0.00 C ATOM 1594 CG LEU A 99 -13.339 4.576 -4.227 1.00 0.00 C ATOM 1595 CD1 LEU A 99 -12.806 3.205 -4.648 1.00 0.00 C ATOM 1596 CD2 LEU A 99 -13.608 5.457 -5.450 1.00 0.00 C ATOM 0 H LEU A 99 -13.573 5.999 -1.411 1.00 0.00 H new ATOM 0 HA LEU A 99 -15.801 6.154 -3.363 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -14.365 3.622 -2.606 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -15.375 3.948 -4.001 1.00 0.00 H new ATOM 0 HG LEU A 99 -12.592 5.102 -3.632 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -11.914 3.334 -5.260 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.556 2.624 -3.761 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -13.568 2.679 -5.223 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -12.689 5.571 -6.025 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -14.371 4.991 -6.074 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -13.956 6.437 -5.123 1.00 0.00 H new ATOM 1608 N PRO A 100 -16.725 6.183 -0.770 1.00 0.00 N ATOM 1609 CA PRO A 100 -17.618 5.927 0.361 1.00 0.00 C ATOM 1610 C PRO A 100 -18.958 5.319 -0.065 1.00 0.00 C ATOM 1611 O PRO A 100 -19.738 4.841 0.768 1.00 0.00 O ATOM 1612 CB PRO A 100 -17.798 7.289 1.023 1.00 0.00 C ATOM 1613 CG PRO A 100 -17.646 8.274 -0.125 1.00 0.00 C ATOM 1614 CD PRO A 100 -16.568 7.613 -0.963 1.00 0.00 C ATOM 0 HA PRO A 100 -17.196 5.187 1.041 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -18.775 7.377 1.498 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -17.050 7.459 1.798 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -18.575 8.400 -0.681 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -17.345 9.263 0.222 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -16.675 7.878 -2.015 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -15.576 7.941 -0.651 1.00 0.00 H new ATOM 1622 N ASP A 101 -19.240 5.374 -1.366 1.00 0.00 N ATOM 1623 CA ASP A 101 -20.439 4.822 -1.971 1.00 0.00 C ATOM 1624 C ASP A 101 -20.125 3.398 -2.434 1.00 0.00 C ATOM 1625 O ASP A 101 -21.038 2.606 -2.669 1.00 0.00 O ATOM 1626 CB ASP A 101 -20.922 5.715 -3.122 1.00 0.00 C ATOM 1627 CG ASP A 101 -22.195 6.461 -2.729 1.00 0.00 C ATOM 1628 OD1 ASP A 101 -22.246 7.064 -1.633 1.00 0.00 O ATOM 1629 OD2 ASP A 101 -23.163 6.449 -3.523 1.00 0.00 O ATOM 0 H ASP A 101 -18.619 5.818 -2.043 1.00 0.00 H new ATOM 0 HA ASP A 101 -21.254 4.786 -1.248 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -20.143 6.430 -3.386 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -21.110 5.107 -4.007 1.00 0.00 H new ATOM 1634 N TRP A 102 -18.840 3.050 -2.587 1.00 0.00 N ATOM 1635 CA TRP A 102 -18.399 1.733 -2.999 1.00 0.00 C ATOM 1636 C TRP A 102 -18.262 0.894 -1.738 1.00 0.00 C ATOM 1637 O TRP A 102 -19.002 -0.082 -1.618 1.00 0.00 O ATOM 1638 CB TRP A 102 -17.077 1.791 -3.769 1.00 0.00 C ATOM 1639 CG TRP A 102 -16.599 0.470 -4.281 1.00 0.00 C ATOM 1640 CD1 TRP A 102 -17.357 -0.402 -4.976 1.00 0.00 C ATOM 1641 CD2 TRP A 102 -15.294 -0.168 -4.129 1.00 0.00 C ATOM 1642 NE1 TRP A 102 -16.607 -1.505 -5.309 1.00 0.00 N ATOM 1643 CE2 TRP A 102 -15.309 -1.398 -4.851 1.00 0.00 C ATOM 1644 CE3 TRP A 102 -14.098 0.157 -3.453 1.00 0.00 C ATOM 1645 CZ2 TRP A 102 -14.175 -2.219 -4.964 1.00 0.00 C ATOM 1646 CZ3 TRP A 102 -12.965 -0.676 -3.534 1.00 0.00 C ATOM 1647 CH2 TRP A 102 -12.987 -1.849 -4.309 1.00 0.00 C ATOM 0 H TRP A 102 -18.070 3.699 -2.421 1.00 0.00 H new ATOM 0 HA TRP A 102 -19.125 1.291 -3.682 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -17.192 2.473 -4.612 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -16.311 2.213 -3.119 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -18.396 -0.256 -5.232 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -16.966 -2.305 -5.831 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -14.051 1.060 -2.863 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -14.215 -3.126 -5.549 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -12.068 -0.410 -2.994 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -12.101 -2.459 -4.400 1.00 0.00 H new ATOM 1658 N LEU A 103 -17.328 1.229 -0.845 1.00 0.00 N ATOM 1659 CA LEU A 103 -17.097 0.529 0.415 1.00 0.00 C ATOM 1660 C LEU A 103 -17.821 1.320 1.488 1.00 0.00 C ATOM 1661 O LEU A 103 -17.616 2.524 1.653 1.00 0.00 O ATOM 1662 CB LEU A 103 -15.603 0.438 0.764 1.00 0.00 C ATOM 1663 CG LEU A 103 -15.246 -0.262 2.092 1.00 0.00 C ATOM 1664 CD1 LEU A 103 -15.877 -1.650 2.246 1.00 0.00 C ATOM 1665 CD2 LEU A 103 -13.722 -0.451 2.180 1.00 0.00 C ATOM 0 H LEU A 103 -16.695 2.017 -0.985 1.00 0.00 H new ATOM 0 HA LEU A 103 -17.463 -0.495 0.338 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -15.095 -0.087 -0.045 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -15.197 1.449 0.792 1.00 0.00 H new ATOM 0 HG LEU A 103 -15.636 0.383 2.880 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -15.581 -2.080 3.203 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -16.963 -1.562 2.207 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -15.536 -2.296 1.437 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -13.470 -0.945 3.118 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -13.382 -1.063 1.345 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -13.232 0.522 2.140 1.00 0.00 H new ATOM 1677 N SER A 104 -18.682 0.622 2.201 1.00 0.00 N ATOM 1678 CA SER A 104 -19.474 1.182 3.280 1.00 0.00 C ATOM 1679 C SER A 104 -19.590 0.179 4.424 1.00 0.00 C ATOM 1680 O SER A 104 -19.278 -1.003 4.257 1.00 0.00 O ATOM 1681 CB SER A 104 -20.817 1.675 2.719 1.00 0.00 C ATOM 1682 OG SER A 104 -21.564 0.676 2.040 1.00 0.00 O ATOM 0 H SER A 104 -18.855 -0.371 2.044 1.00 0.00 H new ATOM 0 HA SER A 104 -18.986 2.055 3.714 1.00 0.00 H new ATOM 0 HB2 SER A 104 -21.418 2.069 3.539 1.00 0.00 H new ATOM 0 HB3 SER A 104 -20.631 2.502 2.034 1.00 0.00 H new ATOM 0 HG SER A 104 -22.404 1.061 1.713 1.00 0.00 H new ATOM 1688 N LEU A 105 -20.011 0.636 5.603 1.00 0.00 N ATOM 1689 CA LEU A 105 -20.186 -0.192 6.791 1.00 0.00 C ATOM 1690 C LEU A 105 -21.592 0.005 7.324 1.00 0.00 C ATOM 1691 O LEU A 105 -22.190 1.068 7.144 1.00 0.00 O ATOM 1692 CB LEU A 105 -19.088 0.067 7.834 1.00 0.00 C ATOM 1693 CG LEU A 105 -19.252 1.409 8.575 1.00 0.00 C ATOM 1694 CD1 LEU A 105 -19.926 1.232 9.944 1.00 0.00 C ATOM 1695 CD2 LEU A 105 -17.894 2.075 8.757 1.00 0.00 C ATOM 0 H LEU A 105 -20.245 1.616 5.760 1.00 0.00 H new ATOM 0 HA LEU A 105 -20.074 -1.244 6.529 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -19.090 -0.744 8.562 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -18.117 0.049 7.340 1.00 0.00 H new ATOM 0 HG LEU A 105 -19.896 2.041 7.964 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -20.021 2.203 10.431 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -20.915 0.795 9.809 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -19.320 0.572 10.565 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -18.021 3.022 9.281 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -17.244 1.422 9.339 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -17.445 2.258 7.781 1.00 0.00 H new ATOM 1707 N HIS A 106 -22.114 -1.012 7.996 1.00 0.00 N ATOM 1708 CA HIS A 106 -23.446 -1.020 8.560 1.00 0.00 C ATOM 1709 C HIS A 106 -23.391 -1.578 9.970 1.00 0.00 C ATOM 1710 O HIS A 106 -23.170 -2.776 10.172 1.00 0.00 O ATOM 1711 CB HIS A 106 -24.382 -1.814 7.647 1.00 0.00 C ATOM 1712 CG HIS A 106 -24.598 -1.111 6.330 1.00 0.00 C ATOM 1713 ND1 HIS A 106 -25.509 -0.109 6.093 1.00 0.00 N ATOM 1714 CD2 HIS A 106 -23.826 -1.236 5.207 1.00 0.00 C ATOM 1715 CE1 HIS A 106 -25.302 0.350 4.853 1.00 0.00 C ATOM 1716 NE2 HIS A 106 -24.289 -0.308 4.266 1.00 0.00 N ATOM 0 H HIS A 106 -21.602 -1.878 8.166 1.00 0.00 H new ATOM 0 HA HIS A 106 -23.843 -0.007 8.626 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -23.963 -2.804 7.468 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -25.341 -1.959 8.145 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -23.007 -1.926 5.071 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -25.872 1.141 4.388 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -23.929 -0.161 3.323 1.00 0.00 H new ATOM 1724 N ARG A 107 -23.504 -0.694 10.961 1.00 0.00 N ATOM 1725 CA ARG A 107 -23.504 -1.098 12.360 1.00 0.00 C ATOM 1726 C ARG A 107 -24.890 -1.679 12.621 1.00 0.00 C ATOM 1727 O ARG A 107 -25.893 -1.049 12.282 1.00 0.00 O ATOM 1728 CB ARG A 107 -23.188 0.098 13.276 1.00 0.00 C ATOM 1729 CG ARG A 107 -22.023 -0.215 14.227 1.00 0.00 C ATOM 1730 CD ARG A 107 -22.304 -1.315 15.259 1.00 0.00 C ATOM 1731 NE ARG A 107 -23.336 -0.903 16.214 1.00 0.00 N ATOM 1732 CZ ARG A 107 -23.643 -1.504 17.365 1.00 0.00 C ATOM 1733 NH1 ARG A 107 -23.139 -2.693 17.683 1.00 0.00 N ATOM 1734 NH2 ARG A 107 -24.464 -0.872 18.197 1.00 0.00 N ATOM 0 H ARG A 107 -23.597 0.311 10.816 1.00 0.00 H new ATOM 0 HA ARG A 107 -22.732 -1.837 12.574 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -22.939 0.968 12.668 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -24.073 0.357 13.856 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -21.158 -0.508 13.633 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -21.751 0.698 14.757 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -22.622 -2.223 14.747 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -21.386 -1.556 15.795 1.00 0.00 H new ATOM 0 HE ARG A 107 -23.875 -0.071 15.974 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -22.503 -3.165 17.041 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -23.389 -3.132 18.569 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -24.838 0.043 17.947 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -24.720 -1.302 19.086 1.00 0.00 H new ATOM 1748 N ILE A 108 -24.960 -2.876 13.192 1.00 0.00 N ATOM 1749 CA ILE A 108 -26.197 -3.582 13.503 1.00 0.00 C ATOM 1750 C ILE A 108 -26.206 -3.802 15.014 1.00 0.00 C ATOM 1751 O ILE A 108 -25.162 -3.933 15.647 1.00 0.00 O ATOM 1752 CB ILE A 108 -26.283 -4.926 12.723 1.00 0.00 C ATOM 1753 CG1 ILE A 108 -25.887 -4.840 11.231 1.00 0.00 C ATOM 1754 CG2 ILE A 108 -27.674 -5.580 12.842 1.00 0.00 C ATOM 1755 CD1 ILE A 108 -26.767 -3.943 10.350 1.00 0.00 C ATOM 0 H ILE A 108 -24.127 -3.400 13.461 1.00 0.00 H new ATOM 0 HA ILE A 108 -27.069 -3.003 13.199 1.00 0.00 H new ATOM 0 HB ILE A 108 -25.536 -5.552 13.212 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -24.860 -4.481 11.169 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -25.898 -5.847 10.814 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -27.686 -6.515 12.282 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -27.892 -5.783 13.891 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -28.429 -4.905 12.438 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -26.394 -3.961 9.326 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -27.794 -4.309 10.369 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -26.739 -2.921 10.729 1.00 0.00 H new ATOM 1767 N ARG A 109 -27.399 -3.945 15.598 1.00 0.00 N ATOM 1768 CA ARG A 109 -27.608 -4.162 17.034 1.00 0.00 C ATOM 1769 C ARG A 109 -26.889 -5.380 17.637 1.00 0.00 C ATOM 1770 O ARG A 109 -27.017 -5.587 18.838 1.00 0.00 O ATOM 1771 CB ARG A 109 -29.118 -4.270 17.322 1.00 0.00 C ATOM 1772 CG ARG A 109 -29.766 -5.538 16.723 1.00 0.00 C ATOM 1773 CD ARG A 109 -31.126 -5.817 17.369 1.00 0.00 C ATOM 1774 NE ARG A 109 -31.705 -7.086 16.888 1.00 0.00 N ATOM 1775 CZ ARG A 109 -32.777 -7.710 17.399 1.00 0.00 C ATOM 1776 NH1 ARG A 109 -33.455 -7.170 18.413 1.00 0.00 N ATOM 1777 NH2 ARG A 109 -33.168 -8.876 16.891 1.00 0.00 N ATOM 0 H ARG A 109 -28.271 -3.912 15.071 1.00 0.00 H new ATOM 0 HA ARG A 109 -27.159 -3.295 17.519 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -29.276 -4.265 18.400 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -29.621 -3.390 16.922 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -29.889 -5.414 15.647 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -29.106 -6.393 16.872 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -31.014 -5.855 18.453 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -31.810 -4.997 17.148 1.00 0.00 H new ATOM 0 HE ARG A 109 -31.247 -7.531 16.092 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -33.159 -6.276 18.806 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -34.269 -7.651 18.796 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -32.653 -9.293 16.115 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -33.983 -9.353 17.277 1.00 0.00 H new ATOM 1791 N THR A 110 -26.225 -6.207 16.834 1.00 0.00 N ATOM 1792 CA THR A 110 -25.527 -7.399 17.282 1.00 0.00 C ATOM 1793 C THR A 110 -24.060 -7.438 16.856 1.00 0.00 C ATOM 1794 O THR A 110 -23.318 -8.224 17.439 1.00 0.00 O ATOM 1795 CB THR A 110 -26.330 -8.604 16.762 1.00 0.00 C ATOM 1796 OG1 THR A 110 -26.149 -9.743 17.568 1.00 0.00 O ATOM 1797 CG2 THR A 110 -26.081 -8.964 15.290 1.00 0.00 C ATOM 0 H THR A 110 -26.158 -6.059 15.827 1.00 0.00 H new ATOM 0 HA THR A 110 -25.477 -7.413 18.371 1.00 0.00 H new ATOM 0 HB THR A 110 -27.366 -8.272 16.823 1.00 0.00 H new ATOM 0 HG1 THR A 110 -26.676 -10.486 17.207 1.00 0.00 H new ATOM 0 HG21 THR A 110 -26.692 -9.825 15.018 1.00 0.00 H new ATOM 0 HG22 THR A 110 -26.347 -8.116 14.658 1.00 0.00 H new ATOM 0 HG23 THR A 110 -25.028 -9.207 15.148 1.00 0.00 H new ATOM 1805 N ASP A 111 -23.656 -6.669 15.837 1.00 0.00 N ATOM 1806 CA ASP A 111 -22.279 -6.615 15.320 1.00 0.00 C ATOM 1807 C ASP A 111 -22.203 -5.582 14.190 1.00 0.00 C ATOM 1808 O ASP A 111 -23.204 -4.948 13.861 1.00 0.00 O ATOM 1809 CB ASP A 111 -21.765 -7.983 14.806 1.00 0.00 C ATOM 1810 CG ASP A 111 -20.279 -8.144 15.138 1.00 0.00 C ATOM 1811 OD1 ASP A 111 -19.447 -7.364 14.620 1.00 0.00 O ATOM 1812 OD2 ASP A 111 -19.928 -9.020 15.957 1.00 0.00 O ATOM 0 H ASP A 111 -24.293 -6.050 15.335 1.00 0.00 H new ATOM 0 HA ASP A 111 -21.636 -6.330 16.153 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -22.337 -8.790 15.263 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -21.915 -8.055 13.729 1.00 0.00 H new ATOM 1817 N THR A 112 -21.033 -5.368 13.603 1.00 0.00 N ATOM 1818 CA THR A 112 -20.798 -4.442 12.512 1.00 0.00 C ATOM 1819 C THR A 112 -20.513 -5.274 11.264 1.00 0.00 C ATOM 1820 O THR A 112 -19.880 -6.328 11.332 1.00 0.00 O ATOM 1821 CB THR A 112 -19.639 -3.508 12.881 1.00 0.00 C ATOM 1822 OG1 THR A 112 -19.916 -2.864 14.112 1.00 0.00 O ATOM 1823 CG2 THR A 112 -19.446 -2.403 11.837 1.00 0.00 C ATOM 0 H THR A 112 -20.186 -5.859 13.890 1.00 0.00 H new ATOM 0 HA THR A 112 -21.662 -3.806 12.318 1.00 0.00 H new ATOM 0 HB THR A 112 -18.742 -4.124 12.939 1.00 0.00 H new ATOM 0 HG1 THR A 112 -19.172 -2.270 14.345 1.00 0.00 H new ATOM 0 HG21 THR A 112 -18.616 -1.762 12.134 1.00 0.00 H new ATOM 0 HG22 THR A 112 -19.229 -2.852 10.868 1.00 0.00 H new ATOM 0 HG23 THR A 112 -20.356 -1.807 11.765 1.00 0.00 H new ATOM 1831 N TYR A 113 -20.981 -4.796 10.116 1.00 0.00 N ATOM 1832 CA TYR A 113 -20.820 -5.435 8.823 1.00 0.00 C ATOM 1833 C TYR A 113 -20.323 -4.385 7.836 1.00 0.00 C ATOM 1834 O TYR A 113 -20.341 -3.187 8.124 1.00 0.00 O ATOM 1835 CB TYR A 113 -22.166 -6.041 8.378 1.00 0.00 C ATOM 1836 CG TYR A 113 -22.672 -7.197 9.229 1.00 0.00 C ATOM 1837 CD1 TYR A 113 -23.202 -6.961 10.512 1.00 0.00 C ATOM 1838 CD2 TYR A 113 -22.604 -8.516 8.743 1.00 0.00 C ATOM 1839 CE1 TYR A 113 -23.624 -8.027 11.323 1.00 0.00 C ATOM 1840 CE2 TYR A 113 -23.021 -9.592 9.548 1.00 0.00 C ATOM 1841 CZ TYR A 113 -23.522 -9.354 10.849 1.00 0.00 C ATOM 1842 OH TYR A 113 -23.891 -10.391 11.651 1.00 0.00 O ATOM 0 H TYR A 113 -21.501 -3.920 10.063 1.00 0.00 H new ATOM 0 HA TYR A 113 -20.094 -6.247 8.873 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -22.919 -5.253 8.380 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -22.068 -6.385 7.348 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -23.285 -5.948 10.877 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -22.230 -8.703 7.747 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -24.026 -7.833 12.307 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -22.958 -10.602 9.171 1.00 0.00 H new ATOM 0 HH TYR A 113 -23.760 -11.237 11.173 1.00 0.00 H new ATOM 1852 N VAL A 114 -19.872 -4.828 6.672 1.00 0.00 N ATOM 1853 CA VAL A 114 -19.376 -4.011 5.582 1.00 0.00 C ATOM 1854 C VAL A 114 -20.227 -4.374 4.369 1.00 0.00 C ATOM 1855 O VAL A 114 -20.809 -5.465 4.305 1.00 0.00 O ATOM 1856 CB VAL A 114 -17.846 -4.210 5.428 1.00 0.00 C ATOM 1857 CG1 VAL A 114 -17.369 -4.473 4.000 1.00 0.00 C ATOM 1858 CG2 VAL A 114 -17.075 -2.996 5.965 1.00 0.00 C ATOM 0 H VAL A 114 -19.842 -5.824 6.454 1.00 0.00 H new ATOM 0 HA VAL A 114 -19.476 -2.938 5.746 1.00 0.00 H new ATOM 0 HB VAL A 114 -17.639 -5.107 6.011 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -16.286 -4.599 3.995 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -17.841 -5.379 3.620 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -17.639 -3.629 3.365 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -16.005 -3.162 5.845 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -17.368 -2.104 5.411 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -17.304 -2.858 7.022 1.00 0.00 H new ATOM 1868 N LYS A 115 -20.340 -3.452 3.424 1.00 0.00 N ATOM 1869 CA LYS A 115 -21.069 -3.564 2.179 1.00 0.00 C ATOM 1870 C LYS A 115 -20.129 -3.075 1.101 1.00 0.00 C ATOM 1871 O LYS A 115 -19.352 -2.144 1.327 1.00 0.00 O ATOM 1872 CB LYS A 115 -22.312 -2.662 2.183 1.00 0.00 C ATOM 1873 CG LYS A 115 -23.620 -3.434 2.401 1.00 0.00 C ATOM 1874 CD LYS A 115 -24.637 -3.121 1.302 1.00 0.00 C ATOM 1875 CE LYS A 115 -24.291 -3.834 -0.015 1.00 0.00 C ATOM 1876 NZ LYS A 115 -25.052 -3.256 -1.139 1.00 0.00 N ATOM 0 H LYS A 115 -19.890 -2.542 3.519 1.00 0.00 H new ATOM 0 HA LYS A 115 -21.398 -4.591 2.023 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -22.206 -1.912 2.967 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -22.367 -2.127 1.235 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -23.415 -4.504 2.416 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -24.040 -3.176 3.373 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -25.631 -3.425 1.630 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -24.672 -2.045 1.134 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -23.222 -3.747 -0.211 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -24.514 -4.897 0.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -24.803 -3.752 -2.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -26.071 -3.361 -0.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -24.819 -2.247 -1.233 1.00 0.00 H new ATOM 1890 N LEU A 116 -20.209 -3.699 -0.066 1.00 0.00 N ATOM 1891 CA LEU A 116 -19.389 -3.316 -1.187 1.00 0.00 C ATOM 1892 C LEU A 116 -20.170 -3.562 -2.459 1.00 0.00 C ATOM 1893 O LEU A 116 -20.638 -4.685 -2.679 1.00 0.00 O ATOM 1894 CB LEU A 116 -18.067 -4.077 -1.180 1.00 0.00 C ATOM 1895 CG LEU A 116 -17.106 -3.466 -2.214 1.00 0.00 C ATOM 1896 CD1 LEU A 116 -15.812 -3.029 -1.531 1.00 0.00 C ATOM 1897 CD2 LEU A 116 -16.858 -4.451 -3.361 1.00 0.00 C ATOM 0 H LEU A 116 -20.841 -4.477 -0.253 1.00 0.00 H new ATOM 0 HA LEU A 116 -19.139 -2.257 -1.121 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -17.620 -4.037 -0.187 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.241 -5.128 -1.409 1.00 0.00 H new ATOM 0 HG LEU A 116 -17.560 -2.577 -2.651 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -15.138 -2.598 -2.271 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -16.037 -2.284 -0.767 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -15.336 -3.893 -1.066 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -16.176 -4.003 -4.084 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.418 -5.367 -2.966 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.803 -4.685 -3.851 1.00 0.00 H new ATOM 1909 N ASP A 117 -20.339 -2.525 -3.277 1.00 0.00 N ATOM 1910 CA ASP A 117 -21.055 -2.654 -4.534 1.00 0.00 C ATOM 1911 C ASP A 117 -20.120 -3.370 -5.496 1.00 0.00 C ATOM 1912 O ASP A 117 -19.223 -2.787 -6.106 1.00 0.00 O ATOM 1913 CB ASP A 117 -21.577 -1.317 -5.079 1.00 0.00 C ATOM 1914 CG ASP A 117 -23.078 -1.223 -4.864 1.00 0.00 C ATOM 1915 OD1 ASP A 117 -23.819 -1.891 -5.624 1.00 0.00 O ATOM 1916 OD2 ASP A 117 -23.505 -0.575 -3.886 1.00 0.00 O ATOM 0 H ASP A 117 -19.987 -1.587 -3.087 1.00 0.00 H new ATOM 0 HA ASP A 117 -21.966 -3.234 -4.389 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -21.076 -0.489 -4.577 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -21.347 -1.232 -6.141 1.00 0.00 H new ATOM 1921 N LYS A 118 -20.313 -4.678 -5.620 1.00 0.00 N ATOM 1922 CA LYS A 118 -19.500 -5.526 -6.482 1.00 0.00 C ATOM 1923 C LYS A 118 -19.698 -5.202 -7.962 1.00 0.00 C ATOM 1924 O LYS A 118 -18.904 -5.662 -8.784 1.00 0.00 O ATOM 1925 CB LYS A 118 -19.800 -7.006 -6.184 1.00 0.00 C ATOM 1926 CG LYS A 118 -19.791 -7.294 -4.669 1.00 0.00 C ATOM 1927 CD LYS A 118 -19.457 -8.742 -4.319 1.00 0.00 C ATOM 1928 CE LYS A 118 -20.548 -9.727 -4.720 1.00 0.00 C ATOM 1929 NZ LYS A 118 -20.272 -11.061 -4.157 1.00 0.00 N ATOM 0 H LYS A 118 -21.045 -5.184 -5.121 1.00 0.00 H new ATOM 0 HA LYS A 118 -18.451 -5.327 -6.264 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.772 -7.271 -6.599 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -19.060 -7.635 -6.679 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -19.066 -6.637 -4.188 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -20.769 -7.046 -4.256 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -18.526 -9.022 -4.812 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -19.285 -8.818 -3.245 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -21.516 -9.370 -4.367 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -20.608 -9.790 -5.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -20.109 -11.737 -4.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -19.426 -11.015 -3.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -21.086 -11.373 -3.589 1.00 0.00 H new ATOM 1943 N ALA A 119 -20.742 -4.445 -8.311 1.00 0.00 N ATOM 1944 CA ALA A 119 -21.042 -4.084 -9.688 1.00 0.00 C ATOM 1945 C ALA A 119 -20.277 -2.859 -10.202 1.00 0.00 C ATOM 1946 O ALA A 119 -20.241 -2.681 -11.420 1.00 0.00 O ATOM 1947 CB ALA A 119 -22.555 -3.887 -9.838 1.00 0.00 C ATOM 0 H ALA A 119 -21.405 -4.065 -7.635 1.00 0.00 H new ATOM 0 HA ALA A 119 -20.700 -4.910 -10.312 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -22.786 -3.616 -10.868 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -23.070 -4.813 -9.582 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -22.886 -3.091 -9.171 1.00 0.00 H new ATOM 1953 N VAL A 120 -19.646 -2.036 -9.355 1.00 0.00 N ATOM 1954 CA VAL A 120 -18.925 -0.860 -9.851 1.00 0.00 C ATOM 1955 C VAL A 120 -17.713 -1.314 -10.663 1.00 0.00 C ATOM 1956 O VAL A 120 -16.971 -2.204 -10.227 1.00 0.00 O ATOM 1957 CB VAL A 120 -18.509 0.096 -8.713 1.00 0.00 C ATOM 1958 CG1 VAL A 120 -18.172 1.479 -9.275 1.00 0.00 C ATOM 1959 CG2 VAL A 120 -19.593 0.289 -7.655 1.00 0.00 C ATOM 0 H VAL A 120 -19.620 -2.159 -8.343 1.00 0.00 H new ATOM 0 HA VAL A 120 -19.599 -0.293 -10.493 1.00 0.00 H new ATOM 0 HB VAL A 120 -17.644 -0.372 -8.244 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -17.881 2.142 -8.460 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -17.349 1.393 -9.985 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -19.046 1.889 -9.781 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -19.233 0.972 -6.886 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -20.486 0.705 -8.121 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -19.834 -0.673 -7.202 1.00 0.00 H new ATOM 1969 N ASP A 121 -17.500 -0.730 -11.844 1.00 0.00 N ATOM 1970 CA ASP A 121 -16.374 -1.082 -12.701 1.00 0.00 C ATOM 1971 C ASP A 121 -15.083 -0.551 -12.099 1.00 0.00 C ATOM 1972 O ASP A 121 -14.888 0.660 -11.967 1.00 0.00 O ATOM 1973 CB ASP A 121 -16.564 -0.604 -14.145 1.00 0.00 C ATOM 1974 CG ASP A 121 -17.209 -1.733 -14.934 1.00 0.00 C ATOM 1975 OD1 ASP A 121 -16.468 -2.617 -15.416 1.00 0.00 O ATOM 1976 OD2 ASP A 121 -18.454 -1.862 -14.925 1.00 0.00 O ATOM 0 H ASP A 121 -18.103 -0.003 -12.229 1.00 0.00 H new ATOM 0 HA ASP A 121 -16.317 -2.169 -12.751 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -17.192 0.287 -14.172 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -15.605 -0.331 -14.585 1.00 0.00 H new ATOM 1981 N LEU A 122 -14.186 -1.470 -11.738 1.00 0.00 N ATOM 1982 CA LEU A 122 -12.898 -1.151 -11.136 1.00 0.00 C ATOM 1983 C LEU A 122 -12.045 -0.283 -12.059 1.00 0.00 C ATOM 1984 O LEU A 122 -11.220 0.485 -11.579 1.00 0.00 O ATOM 1985 CB LEU A 122 -12.163 -2.437 -10.745 1.00 0.00 C ATOM 1986 CG LEU A 122 -11.304 -2.330 -9.470 1.00 0.00 C ATOM 1987 CD1 LEU A 122 -10.119 -1.384 -9.552 1.00 0.00 C ATOM 1988 CD2 LEU A 122 -12.126 -2.023 -8.215 1.00 0.00 C ATOM 0 H LEU A 122 -14.340 -2.471 -11.859 1.00 0.00 H new ATOM 0 HA LEU A 122 -13.081 -0.570 -10.232 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -12.898 -3.230 -10.605 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -11.522 -2.738 -11.573 1.00 0.00 H new ATOM 0 HG LEU A 122 -10.886 -3.333 -9.388 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -9.585 -1.386 -8.602 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -9.447 -1.710 -10.346 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -10.473 -0.376 -9.767 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -11.463 -1.960 -7.352 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -12.645 -1.073 -8.343 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -12.856 -2.817 -8.055 1.00 0.00 H new ATOM 2000 N ALA A 123 -12.238 -0.374 -13.376 1.00 0.00 N ATOM 2001 CA ALA A 123 -11.487 0.445 -14.321 1.00 0.00 C ATOM 2002 C ALA A 123 -11.778 1.923 -14.005 1.00 0.00 C ATOM 2003 O ALA A 123 -10.855 2.717 -13.832 1.00 0.00 O ATOM 2004 CB ALA A 123 -11.861 0.058 -15.755 1.00 0.00 C ATOM 0 H ALA A 123 -12.909 -1.008 -13.810 1.00 0.00 H new ATOM 0 HA ALA A 123 -10.414 0.280 -14.227 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -11.297 0.673 -16.457 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -11.624 -0.993 -15.922 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -12.928 0.218 -15.909 1.00 0.00 H new ATOM 2010 N GLY A 124 -13.062 2.284 -13.877 1.00 0.00 N ATOM 2011 CA GLY A 124 -13.483 3.644 -13.561 1.00 0.00 C ATOM 2012 C GLY A 124 -13.023 4.034 -12.160 1.00 0.00 C ATOM 2013 O GLY A 124 -12.581 5.164 -11.943 1.00 0.00 O ATOM 0 H GLY A 124 -13.838 1.632 -13.992 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -13.069 4.338 -14.292 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -14.568 3.720 -13.628 1.00 0.00 H new ATOM 2017 N LEU A 125 -13.093 3.099 -11.200 1.00 0.00 N ATOM 2018 CA LEU A 125 -12.661 3.361 -9.832 1.00 0.00 C ATOM 2019 C LEU A 125 -11.168 3.694 -9.851 1.00 0.00 C ATOM 2020 O LEU A 125 -10.768 4.712 -9.285 1.00 0.00 O ATOM 2021 CB LEU A 125 -13.006 2.201 -8.887 1.00 0.00 C ATOM 2022 CG LEU A 125 -14.514 2.019 -8.634 1.00 0.00 C ATOM 2023 CD1 LEU A 125 -14.764 0.781 -7.769 1.00 0.00 C ATOM 2024 CD2 LEU A 125 -15.106 3.243 -7.925 1.00 0.00 C ATOM 0 H LEU A 125 -13.447 2.155 -11.354 1.00 0.00 H new ATOM 0 HA LEU A 125 -13.204 4.217 -9.432 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -12.605 1.277 -9.303 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -12.506 2.364 -7.932 1.00 0.00 H new ATOM 0 HG LEU A 125 -14.997 1.898 -9.604 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -15.835 0.666 -7.599 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -14.381 -0.103 -8.279 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -14.255 0.897 -6.812 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -16.172 3.087 -7.759 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -14.607 3.385 -6.967 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -14.961 4.128 -8.545 1.00 0.00 H new ATOM 2036 N THR A 126 -10.337 2.893 -10.521 1.00 0.00 N ATOM 2037 CA THR A 126 -8.907 3.177 -10.617 1.00 0.00 C ATOM 2038 C THR A 126 -8.662 4.533 -11.288 1.00 0.00 C ATOM 2039 O THR A 126 -7.782 5.263 -10.829 1.00 0.00 O ATOM 2040 CB THR A 126 -8.171 2.049 -11.349 1.00 0.00 C ATOM 2041 OG1 THR A 126 -8.481 0.820 -10.733 1.00 0.00 O ATOM 2042 CG2 THR A 126 -6.656 2.231 -11.242 1.00 0.00 C ATOM 0 H THR A 126 -10.631 2.044 -11.004 1.00 0.00 H new ATOM 0 HA THR A 126 -8.504 3.231 -9.606 1.00 0.00 H new ATOM 0 HB THR A 126 -8.479 2.067 -12.394 1.00 0.00 H new ATOM 0 HG1 THR A 126 -8.015 0.094 -11.198 1.00 0.00 H new ATOM 0 HG21 THR A 126 -6.154 1.419 -11.769 1.00 0.00 H new ATOM 0 HG22 THR A 126 -6.372 3.184 -11.688 1.00 0.00 H new ATOM 0 HG23 THR A 126 -6.361 2.220 -10.193 1.00 0.00 H new ATOM 2050 N ALA A 127 -9.452 4.905 -12.306 1.00 0.00 N ATOM 2051 CA ALA A 127 -9.297 6.181 -12.994 1.00 0.00 C ATOM 2052 C ALA A 127 -9.362 7.324 -11.977 1.00 0.00 C ATOM 2053 O ALA A 127 -8.405 8.096 -11.849 1.00 0.00 O ATOM 2054 CB ALA A 127 -10.341 6.350 -14.107 1.00 0.00 C ATOM 0 H ALA A 127 -10.211 4.328 -12.669 1.00 0.00 H new ATOM 0 HA ALA A 127 -8.321 6.203 -13.478 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -10.196 7.312 -14.599 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -10.228 5.549 -14.837 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -11.342 6.310 -13.676 1.00 0.00 H new ATOM 2060 N ARG A 128 -10.475 7.421 -11.235 1.00 0.00 N ATOM 2061 CA ARG A 128 -10.648 8.470 -10.229 1.00 0.00 C ATOM 2062 C ARG A 128 -9.641 8.343 -9.085 1.00 0.00 C ATOM 2063 O ARG A 128 -9.344 9.355 -8.443 1.00 0.00 O ATOM 2064 CB ARG A 128 -12.101 8.543 -9.719 1.00 0.00 C ATOM 2065 CG ARG A 128 -12.628 7.279 -9.022 1.00 0.00 C ATOM 2066 CD ARG A 128 -13.908 7.536 -8.220 1.00 0.00 C ATOM 2067 NE ARG A 128 -15.060 7.926 -9.047 1.00 0.00 N ATOM 2068 CZ ARG A 128 -16.294 8.144 -8.573 1.00 0.00 C ATOM 2069 NH1 ARG A 128 -16.533 8.118 -7.263 1.00 0.00 N ATOM 2070 NH2 ARG A 128 -17.267 8.379 -9.442 1.00 0.00 N ATOM 0 H ARG A 128 -11.267 6.784 -11.316 1.00 0.00 H new ATOM 0 HA ARG A 128 -10.439 9.419 -10.723 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -12.181 9.379 -9.024 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -12.752 8.768 -10.564 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -12.821 6.510 -9.770 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -11.859 6.889 -8.356 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -14.162 6.635 -7.661 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -13.716 8.321 -7.489 1.00 0.00 H new ATOM 0 HE ARG A 128 -14.909 8.038 -10.050 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -15.773 7.931 -6.609 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -17.476 8.285 -6.913 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -17.066 8.390 -10.442 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -18.217 8.548 -9.111 1.00 0.00 H new ATOM 2084 N LEU A 129 -9.128 7.144 -8.787 1.00 0.00 N ATOM 2085 CA LEU A 129 -8.147 6.951 -7.721 1.00 0.00 C ATOM 2086 C LEU A 129 -6.859 7.632 -8.154 1.00 0.00 C ATOM 2087 O LEU A 129 -6.461 8.612 -7.536 1.00 0.00 O ATOM 2088 CB LEU A 129 -7.948 5.456 -7.383 1.00 0.00 C ATOM 2089 CG LEU A 129 -7.189 5.185 -6.060 1.00 0.00 C ATOM 2090 CD1 LEU A 129 -7.268 3.695 -5.690 1.00 0.00 C ATOM 2091 CD2 LEU A 129 -5.706 5.559 -6.103 1.00 0.00 C ATOM 0 H LEU A 129 -9.382 6.286 -9.277 1.00 0.00 H new ATOM 0 HA LEU A 129 -8.502 7.402 -6.794 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -8.926 4.977 -7.329 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -7.405 4.982 -8.201 1.00 0.00 H new ATOM 0 HG LEU A 129 -7.682 5.818 -5.322 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -6.730 3.522 -4.758 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -8.312 3.406 -5.565 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -6.819 3.099 -6.484 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -5.247 5.339 -5.139 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -5.208 4.982 -6.882 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -5.605 6.623 -6.318 1.00 0.00 H new ATOM 2103 N ALA A 130 -6.242 7.153 -9.239 1.00 0.00 N ATOM 2104 CA ALA A 130 -4.991 7.677 -9.769 1.00 0.00 C ATOM 2105 C ALA A 130 -5.095 9.146 -10.191 1.00 0.00 C ATOM 2106 O ALA A 130 -4.070 9.806 -10.379 1.00 0.00 O ATOM 2107 CB ALA A 130 -4.530 6.793 -10.924 1.00 0.00 C ATOM 0 H ALA A 130 -6.612 6.372 -9.781 1.00 0.00 H new ATOM 0 HA ALA A 130 -4.247 7.654 -8.973 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -3.593 7.179 -11.326 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -4.378 5.775 -10.565 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -5.288 6.792 -11.707 1.00 0.00 H new ATOM 2113 N HIS A 131 -6.307 9.677 -10.394 1.00 0.00 N ATOM 2114 CA HIS A 131 -6.451 11.081 -10.736 1.00 0.00 C ATOM 2115 C HIS A 131 -6.108 11.947 -9.499 1.00 0.00 C ATOM 2116 O HIS A 131 -5.708 13.097 -9.666 1.00 0.00 O ATOM 2117 CB HIS A 131 -7.874 11.338 -11.242 1.00 0.00 C ATOM 2118 CG HIS A 131 -8.059 12.626 -12.002 1.00 0.00 C ATOM 2119 ND1 HIS A 131 -7.330 13.789 -11.884 1.00 0.00 N ATOM 2120 CD2 HIS A 131 -9.016 12.835 -12.954 1.00 0.00 C ATOM 2121 CE1 HIS A 131 -7.834 14.678 -12.752 1.00 0.00 C ATOM 2122 NE2 HIS A 131 -8.861 14.139 -13.439 1.00 0.00 N ATOM 0 H HIS A 131 -7.183 9.159 -10.327 1.00 0.00 H new ATOM 0 HA HIS A 131 -5.761 11.353 -11.535 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -8.170 10.509 -11.885 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -8.552 11.337 -10.389 1.00 0.00 H new ATOM 0 HD1 HIS A 131 -6.547 13.946 -11.250 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -9.760 12.121 -13.275 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -7.468 15.686 -12.883 1.00 0.00 H new ATOM 2130 N HIS A 132 -6.240 11.400 -8.276 1.00 0.00 N ATOM 2131 CA HIS A 132 -5.968 12.044 -6.985 1.00 0.00 C ATOM 2132 C HIS A 132 -6.581 13.460 -6.915 1.00 0.00 C ATOM 2133 O HIS A 132 -5.908 14.423 -6.541 1.00 0.00 O ATOM 2134 CB HIS A 132 -4.456 12.042 -6.705 1.00 0.00 C ATOM 2135 CG HIS A 132 -3.683 10.766 -6.962 1.00 0.00 C ATOM 2136 ND1 HIS A 132 -2.607 10.674 -7.813 1.00 0.00 N ATOM 2137 CD2 HIS A 132 -3.820 9.549 -6.345 1.00 0.00 C ATOM 2138 CE1 HIS A 132 -2.126 9.425 -7.748 1.00 0.00 C ATOM 2139 NE2 HIS A 132 -2.816 8.704 -6.849 1.00 0.00 N ATOM 0 H HIS A 132 -6.559 10.438 -8.160 1.00 0.00 H new ATOM 0 HA HIS A 132 -6.453 11.468 -6.197 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -4.005 12.831 -7.306 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -4.310 12.315 -5.660 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -4.564 9.287 -5.607 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -1.300 9.051 -8.335 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -2.645 7.734 -6.584 1.00 0.00 H new ATOM 2147 N VAL A 133 -7.850 13.596 -7.312 1.00 0.00 N ATOM 2148 CA VAL A 133 -8.577 14.864 -7.317 1.00 0.00 C ATOM 2149 C VAL A 133 -8.866 15.318 -5.891 1.00 0.00 C ATOM 2150 O VAL A 133 -8.625 16.475 -5.534 1.00 0.00 O ATOM 2151 CB VAL A 133 -9.911 14.758 -8.098 1.00 0.00 C ATOM 2152 CG1 VAL A 133 -10.429 16.159 -8.456 1.00 0.00 C ATOM 2153 CG2 VAL A 133 -9.804 13.957 -9.398 1.00 0.00 C ATOM 0 H VAL A 133 -8.409 12.811 -7.645 1.00 0.00 H new ATOM 0 HA VAL A 133 -7.942 15.596 -7.816 1.00 0.00 H new ATOM 0 HB VAL A 133 -10.595 14.231 -7.432 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -11.367 16.071 -9.005 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -10.595 16.730 -7.542 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -9.693 16.672 -9.075 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -10.777 13.927 -9.888 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -9.079 14.432 -10.059 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -9.479 12.941 -9.174 1.00 0.00 H new ATOM 2163 N HIS A 134 -9.386 14.394 -5.082 1.00 0.00 N ATOM 2164 CA HIS A 134 -9.759 14.640 -3.696 1.00 0.00 C ATOM 2165 C HIS A 134 -8.803 13.988 -2.708 1.00 0.00 C ATOM 2166 O HIS A 134 -8.752 14.422 -1.556 1.00 0.00 O ATOM 2167 CB HIS A 134 -11.201 14.159 -3.472 1.00 0.00 C ATOM 2168 CG HIS A 134 -12.139 14.506 -4.603 1.00 0.00 C ATOM 2169 ND1 HIS A 134 -12.833 13.604 -5.377 1.00 0.00 N ATOM 2170 CD2 HIS A 134 -12.412 15.762 -5.074 1.00 0.00 C ATOM 2171 CE1 HIS A 134 -13.508 14.305 -6.298 1.00 0.00 C ATOM 2172 NE2 HIS A 134 -13.282 15.625 -6.163 1.00 0.00 N ATOM 0 H HIS A 134 -9.562 13.435 -5.382 1.00 0.00 H new ATOM 0 HA HIS A 134 -9.695 15.712 -3.511 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -11.197 13.078 -3.334 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -11.581 14.597 -2.549 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -12.027 16.690 -4.678 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -14.149 13.868 -7.050 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -13.667 16.375 -6.738 1.00 0.00 H new ATOM 2180 N ALA A 135 -8.056 12.982 -3.170 1.00 0.00 N ATOM 2181 CA ALA A 135 -7.112 12.225 -2.375 1.00 0.00 C ATOM 2182 C ALA A 135 -5.958 13.077 -1.850 1.00 0.00 C ATOM 2183 O ALA A 135 -5.735 14.208 -2.283 1.00 0.00 O ATOM 2184 CB ALA A 135 -6.582 11.050 -3.205 1.00 0.00 C ATOM 0 H ALA A 135 -8.100 12.669 -4.140 1.00 0.00 H new ATOM 0 HA ALA A 135 -7.641 11.855 -1.496 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -5.871 10.477 -2.611 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -7.412 10.407 -3.497 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -6.086 11.430 -4.098 1.00 0.00 H new ATOM 2190 N GLU A 136 -5.205 12.475 -0.939 1.00 0.00 N ATOM 2191 CA GLU A 136 -4.045 13.069 -0.278 1.00 0.00 C ATOM 2192 C GLU A 136 -2.919 12.049 -0.097 1.00 0.00 C ATOM 2193 O GLU A 136 -1.749 12.412 -0.200 1.00 0.00 O ATOM 2194 CB GLU A 136 -4.473 13.684 1.068 1.00 0.00 C ATOM 2195 CG GLU A 136 -4.785 12.645 2.153 1.00 0.00 C ATOM 2196 CD GLU A 136 -5.486 13.265 3.358 1.00 0.00 C ATOM 2197 OE1 GLU A 136 -6.698 13.562 3.252 1.00 0.00 O ATOM 2198 OE2 GLU A 136 -4.839 13.401 4.422 1.00 0.00 O ATOM 0 H GLU A 136 -5.391 11.522 -0.626 1.00 0.00 H new ATOM 0 HA GLU A 136 -3.650 13.862 -0.913 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -3.680 14.341 1.425 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -5.354 14.305 0.909 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -5.414 11.860 1.733 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -3.859 12.171 2.477 1.00 0.00 H new ATOM 2205 N GLY A 137 -3.262 10.772 0.099 1.00 0.00 N ATOM 2206 CA GLY A 137 -2.311 9.691 0.292 1.00 0.00 C ATOM 2207 C GLY A 137 -2.278 9.307 1.764 1.00 0.00 C ATOM 2208 O GLY A 137 -1.361 9.695 2.491 1.00 0.00 O ATOM 0 H GLY A 137 -4.233 10.462 0.127 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -2.594 8.830 -0.314 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.319 10.001 -0.037 1.00 0.00 H new ATOM 2212 N LEU A 138 -3.316 8.604 2.212 1.00 0.00 N ATOM 2213 CA LEU A 138 -3.453 8.122 3.587 1.00 0.00 C ATOM 2214 C LEU A 138 -2.367 7.107 3.880 1.00 0.00 C ATOM 2215 O LEU A 138 -1.939 7.032 5.056 1.00 0.00 O ATOM 2216 CB LEU A 138 -4.853 7.509 3.796 1.00 0.00 C ATOM 2217 CG LEU A 138 -5.814 8.443 4.551 1.00 0.00 C ATOM 2218 CD1 LEU A 138 -5.901 9.837 3.923 1.00 0.00 C ATOM 2219 CD2 LEU A 138 -7.206 7.816 4.562 1.00 0.00 C ATOM 0 H LEU A 138 -4.104 8.347 1.617 1.00 0.00 H new ATOM 0 HA LEU A 138 -3.343 8.957 4.278 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -5.283 7.262 2.826 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.755 6.575 4.348 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.425 8.565 5.562 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -6.593 10.452 4.498 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -4.914 10.300 3.927 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -6.257 9.752 2.896 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.896 8.470 5.095 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -7.552 7.681 3.537 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -7.165 6.848 5.061 1.00 0.00 H new TER 2231 LEU A 138