USER MOD reduce.3.24.130724 H: found=0, std=0, add=1374, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1367 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 81 HIS : no HE2:sc= -0.992 K(o=-1.5,f=-3.3) USER MOD Set 1.2: B 91 GLN : amide:sc= -0.526 K(o=-1.5,f=-4.6) USER MOD Set 2.1: A 91 GLN : amide:sc= -0.371 K(o=-1.7,f=-4.1) USER MOD Set 2.2: B 81 HIS : no HE2:sc= -1.29 K(o=-1.7,f=-3.5) USER MOD Set 3.1: A 102 CYS SG : rot -43:sc= 0.324 USER MOD Set 3.2: B 57 CYS SG : rot -36:sc= 0.161 USER MOD Set 3.3: B 61 CYS SG : rot 179:sc= 1.24 USER MOD Set 4.1: B 39 GLN :FLIP amide:sc= -0.657 F(o=-3.8,f=-1.4) USER MOD Set 4.2: B 43 HIS :FLIP no HD1:sc= -0.704 F(o=-2,f=-1.4) USER MOD Set 5.1: A 57 CYS SG : rot 180:sc= 0.489 USER MOD Set 5.2: A 61 CYS SG : rot 100:sc= 0.641 USER MOD Set 6.1: A 39 GLN : amide:sc= -0.879 K(o=-1.2,f=-4.9!) USER MOD Set 6.2: A 43 HIS : no HE2:sc= -0.367 K(o=-1.2,f=-4.5!) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 CYS SG : rot 92:sc= 0.117 USER MOD Single : A 35 CYS SG : rot 54:sc= 0.664 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.373 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -0.318 K(o=-0.32,f=-1.7) USER MOD Single : A 52 SER OG : rot 82:sc= 1.24 USER MOD Single : A 53 ASN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 54 HIS : no HD1:sc= -0.33 K(o=-0.33,f=-1.2) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 31:sc= 0.581 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= 0.218 X(o=0.22,f=0) USER MOD Single : A 75 TYR OH : rot 180:sc= 0.0034 USER MOD Single : A 80 SER OG : rot -70:sc= 0.705 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.528 K(o=-0.53,f=-1.4) USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 24 CYS SG : rot 180:sc= 0 USER MOD Single : B 35 CYS SG : rot 49:sc= 0.557 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 47 THR OG1 : rot 180:sc= 0.461 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 50 ASN : amide:sc= -0.345 K(o=-0.34,f=-3.8!) USER MOD Single : B 52 SER OG : rot 72:sc= 1.24 USER MOD Single : B 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 54 HIS : no HD1:sc= -1.63 K(o=-1.6,f=-2.2!) USER MOD Single : B 56 SER OG : rot 74:sc= 0.443 USER MOD Single : B 67 THR OG1 : rot 31:sc= 0.817 USER MOD Single : B 68 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 GLN : amide:sc= 0.68 K(o=0.68,f=-5.2!) USER MOD Single : B 75 TYR OH : rot 180:sc=-0.00584 USER MOD Single : B 80 SER OG : rot -66:sc= 1.15 USER MOD ----------------------------------------------------------------- ATOM 11 N LEU A 11 4.369 -1.451 -9.159 1.00 0.00 N ATOM 12 CA LEU A 11 3.399 -1.568 -8.058 1.00 0.00 C ATOM 13 C LEU A 11 3.964 -2.242 -6.803 1.00 0.00 C ATOM 14 O LEU A 11 3.925 -1.631 -5.733 1.00 0.00 O ATOM 15 CB LEU A 11 2.130 -2.302 -8.554 1.00 0.00 C ATOM 16 CG LEU A 11 1.065 -1.388 -9.195 1.00 0.00 C ATOM 17 CD1 LEU A 11 -0.043 -2.234 -9.839 1.00 0.00 C ATOM 18 CD2 LEU A 11 0.401 -0.465 -8.156 1.00 0.00 C ATOM 0 HA LEU A 11 3.146 -0.552 -7.754 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.425 -3.058 -9.281 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.679 -2.828 -7.713 1.00 0.00 H new ATOM 0 HG LEU A 11 1.579 -0.783 -9.941 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -0.788 -1.577 -10.288 1.00 0.00 H new ATOM 0 HD12 LEU A 11 0.388 -2.873 -10.610 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -0.517 -2.853 -9.078 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -0.342 0.162 -8.649 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -0.084 -1.070 -7.390 1.00 0.00 H new ATOM 0 HD23 LEU A 11 1.159 0.167 -7.693 1.00 0.00 H new ATOM 30 N ALA A 12 4.524 -3.450 -6.929 1.00 0.00 N ATOM 31 CA ALA A 12 5.055 -4.209 -5.791 1.00 0.00 C ATOM 32 C ALA A 12 6.239 -3.503 -5.104 1.00 0.00 C ATOM 33 O ALA A 12 6.269 -3.414 -3.872 1.00 0.00 O ATOM 34 CB ALA A 12 5.418 -5.615 -6.268 1.00 0.00 C ATOM 0 H ALA A 12 4.622 -3.930 -7.824 1.00 0.00 H new ATOM 0 HA ALA A 12 4.284 -4.276 -5.023 1.00 0.00 H new ATOM 0 HB1 ALA A 12 5.815 -6.192 -5.432 1.00 0.00 H new ATOM 0 HB2 ALA A 12 4.528 -6.108 -6.659 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.171 -5.550 -7.053 1.00 0.00 H new ATOM 40 N ARG A 13 7.158 -2.920 -5.890 1.00 0.00 N ATOM 41 CA ARG A 13 8.262 -2.079 -5.404 1.00 0.00 C ATOM 42 C ARG A 13 7.728 -0.942 -4.522 1.00 0.00 C ATOM 43 O ARG A 13 8.174 -0.771 -3.387 1.00 0.00 O ATOM 44 CB ARG A 13 9.039 -1.535 -6.618 1.00 0.00 C ATOM 45 CG ARG A 13 10.349 -0.803 -6.294 1.00 0.00 C ATOM 46 CD ARG A 13 11.088 -0.456 -7.604 1.00 0.00 C ATOM 47 NE ARG A 13 11.428 0.976 -7.718 1.00 0.00 N ATOM 48 CZ ARG A 13 12.445 1.598 -7.137 1.00 0.00 C ATOM 49 NH1 ARG A 13 13.307 0.969 -6.367 1.00 0.00 N ATOM 50 NH2 ARG A 13 12.582 2.894 -7.325 1.00 0.00 N ATOM 0 H ARG A 13 7.153 -3.023 -6.905 1.00 0.00 H new ATOM 0 HA ARG A 13 8.937 -2.672 -4.786 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.264 -2.367 -7.285 1.00 0.00 H new ATOM 0 HB3 ARG A 13 8.389 -0.853 -7.167 1.00 0.00 H new ATOM 0 HG2 ARG A 13 10.139 0.107 -5.731 1.00 0.00 H new ATOM 0 HG3 ARG A 13 10.980 -1.429 -5.664 1.00 0.00 H new ATOM 0 HD2 ARG A 13 12.003 -1.046 -7.665 1.00 0.00 H new ATOM 0 HD3 ARG A 13 10.466 -0.744 -8.452 1.00 0.00 H new ATOM 0 HE ARG A 13 10.818 1.546 -8.304 1.00 0.00 H new ATOM 0 HH11 ARG A 13 13.206 -0.032 -6.200 1.00 0.00 H new ATOM 0 HH12 ARG A 13 14.077 1.482 -5.938 1.00 0.00 H new ATOM 0 HH21 ARG A 13 11.914 3.398 -7.907 1.00 0.00 H new ATOM 0 HH22 ARG A 13 13.357 3.394 -6.888 1.00 0.00 H new ATOM 64 N LEU A 14 6.734 -0.201 -5.026 1.00 0.00 N ATOM 65 CA LEU A 14 6.120 0.946 -4.349 1.00 0.00 C ATOM 66 C LEU A 14 5.344 0.552 -3.089 1.00 0.00 C ATOM 67 O LEU A 14 5.563 1.166 -2.049 1.00 0.00 O ATOM 68 CB LEU A 14 5.270 1.704 -5.385 1.00 0.00 C ATOM 69 CG LEU A 14 4.601 3.029 -4.966 1.00 0.00 C ATOM 70 CD1 LEU A 14 3.308 2.850 -4.156 1.00 0.00 C ATOM 71 CD2 LEU A 14 5.570 3.992 -4.263 1.00 0.00 C ATOM 0 H LEU A 14 6.324 -0.388 -5.941 1.00 0.00 H new ATOM 0 HA LEU A 14 6.897 1.610 -3.971 1.00 0.00 H new ATOM 0 HB2 LEU A 14 5.906 1.912 -6.246 1.00 0.00 H new ATOM 0 HB3 LEU A 14 4.484 1.030 -5.725 1.00 0.00 H new ATOM 0 HG LEU A 14 4.307 3.490 -5.909 1.00 0.00 H new ATOM 0 HD11 LEU A 14 2.900 3.828 -3.901 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.580 2.297 -4.750 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.525 2.297 -3.242 1.00 0.00 H new ATOM 0 HD21 LEU A 14 5.042 4.906 -3.992 1.00 0.00 H new ATOM 0 HD22 LEU A 14 5.963 3.520 -3.363 1.00 0.00 H new ATOM 0 HD23 LEU A 14 6.394 4.234 -4.935 1.00 0.00 H new ATOM 83 N GLY A 15 4.488 -0.477 -3.117 1.00 0.00 N ATOM 84 CA GLY A 15 3.690 -0.839 -1.933 1.00 0.00 C ATOM 85 C GLY A 15 4.576 -1.353 -0.804 1.00 0.00 C ATOM 86 O GLY A 15 4.389 -0.938 0.333 1.00 0.00 O ATOM 0 H GLY A 15 4.329 -1.068 -3.933 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.129 0.030 -1.591 1.00 0.00 H new ATOM 0 HA3 GLY A 15 2.961 -1.603 -2.203 1.00 0.00 H new ATOM 90 N ARG A 16 5.590 -2.170 -1.123 1.00 0.00 N ATOM 91 CA ARG A 16 6.628 -2.639 -0.188 1.00 0.00 C ATOM 92 C ARG A 16 7.416 -1.458 0.385 1.00 0.00 C ATOM 93 O ARG A 16 7.651 -1.385 1.586 1.00 0.00 O ATOM 94 CB ARG A 16 7.526 -3.646 -0.938 1.00 0.00 C ATOM 95 CG ARG A 16 8.546 -4.432 -0.092 1.00 0.00 C ATOM 96 CD ARG A 16 9.815 -3.646 0.281 1.00 0.00 C ATOM 97 NE ARG A 16 10.929 -4.539 0.660 1.00 0.00 N ATOM 98 CZ ARG A 16 11.764 -5.177 -0.164 1.00 0.00 C ATOM 99 NH1 ARG A 16 11.649 -5.105 -1.478 1.00 0.00 N ATOM 100 NH2 ARG A 16 12.742 -5.911 0.326 1.00 0.00 N ATOM 0 H ARG A 16 5.716 -2.535 -2.067 1.00 0.00 H new ATOM 0 HA ARG A 16 6.178 -3.141 0.668 1.00 0.00 H new ATOM 0 HB2 ARG A 16 6.881 -4.363 -1.446 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.071 -3.105 -1.711 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.058 -4.764 0.825 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.838 -5.328 -0.640 1.00 0.00 H new ATOM 0 HD2 ARG A 16 10.118 -3.026 -0.563 1.00 0.00 H new ATOM 0 HD3 ARG A 16 9.594 -2.972 1.108 1.00 0.00 H new ATOM 0 HE ARG A 16 11.076 -4.684 1.659 1.00 0.00 H new ATOM 0 HH11 ARG A 16 10.903 -4.548 -1.895 1.00 0.00 H new ATOM 0 HH12 ARG A 16 12.306 -5.606 -2.076 1.00 0.00 H new ATOM 0 HH21 ARG A 16 12.862 -5.992 1.336 1.00 0.00 H new ATOM 0 HH22 ARG A 16 13.379 -6.398 -0.304 1.00 0.00 H new ATOM 114 N ALA A 17 7.736 -0.458 -0.435 1.00 0.00 N ATOM 115 CA ALA A 17 8.398 0.768 0.013 1.00 0.00 C ATOM 116 C ALA A 17 7.556 1.646 0.966 1.00 0.00 C ATOM 117 O ALA A 17 8.079 2.630 1.490 1.00 0.00 O ATOM 118 CB ALA A 17 8.908 1.525 -1.215 1.00 0.00 C ATOM 0 H ALA A 17 7.542 -0.475 -1.436 1.00 0.00 H new ATOM 0 HA ALA A 17 9.243 0.481 0.639 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.404 2.442 -0.897 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.615 0.900 -1.760 1.00 0.00 H new ATOM 0 HB3 ALA A 17 8.068 1.773 -1.864 1.00 0.00 H new ATOM 124 N LEU A 18 6.301 1.270 1.251 1.00 0.00 N ATOM 125 CA LEU A 18 5.482 1.832 2.333 1.00 0.00 C ATOM 126 C LEU A 18 5.157 0.782 3.409 1.00 0.00 C ATOM 127 O LEU A 18 5.189 1.103 4.597 1.00 0.00 O ATOM 128 CB LEU A 18 4.199 2.428 1.743 1.00 0.00 C ATOM 129 CG LEU A 18 4.445 3.835 1.131 1.00 0.00 C ATOM 130 CD1 LEU A 18 4.873 3.790 -0.342 1.00 0.00 C ATOM 131 CD2 LEU A 18 3.213 4.738 1.260 1.00 0.00 C ATOM 0 H LEU A 18 5.815 0.547 0.720 1.00 0.00 H new ATOM 0 HA LEU A 18 6.053 2.620 2.824 1.00 0.00 H new ATOM 0 HB2 LEU A 18 3.808 1.761 0.975 1.00 0.00 H new ATOM 0 HB3 LEU A 18 3.439 2.498 2.521 1.00 0.00 H new ATOM 0 HG LEU A 18 5.268 4.252 1.712 1.00 0.00 H new ATOM 0 HD11 LEU A 18 5.028 4.805 -0.707 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.801 3.226 -0.434 1.00 0.00 H new ATOM 0 HD13 LEU A 18 4.094 3.307 -0.933 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.428 5.712 0.820 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.371 4.282 0.739 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.963 4.863 2.313 1.00 0.00 H new ATOM 143 N ALA A 19 4.952 -0.468 3.002 1.00 0.00 N ATOM 144 CA ALA A 19 4.569 -1.626 3.805 1.00 0.00 C ATOM 145 C ALA A 19 5.797 -2.409 4.308 1.00 0.00 C ATOM 146 O ALA A 19 6.379 -3.226 3.602 1.00 0.00 O ATOM 147 CB ALA A 19 3.656 -2.475 2.916 1.00 0.00 C ATOM 0 H ALA A 19 5.059 -0.718 2.019 1.00 0.00 H new ATOM 0 HA ALA A 19 4.047 -1.322 4.712 1.00 0.00 H new ATOM 0 HB1 ALA A 19 3.335 -3.361 3.465 1.00 0.00 H new ATOM 0 HB2 ALA A 19 2.782 -1.890 2.628 1.00 0.00 H new ATOM 0 HB3 ALA A 19 4.200 -2.779 2.022 1.00 0.00 H new ATOM 153 N ASP A 20 6.158 -2.144 5.559 1.00 0.00 N ATOM 154 CA ASP A 20 7.401 -2.559 6.242 1.00 0.00 C ATOM 155 C ASP A 20 7.198 -2.439 7.776 1.00 0.00 C ATOM 156 O ASP A 20 6.191 -1.858 8.192 1.00 0.00 O ATOM 157 CB ASP A 20 8.522 -1.607 5.769 1.00 0.00 C ATOM 158 CG ASP A 20 9.745 -2.189 5.013 1.00 0.00 C ATOM 159 OD1 ASP A 20 9.660 -2.492 3.800 1.00 0.00 O ATOM 160 OD2 ASP A 20 10.844 -2.121 5.609 1.00 0.00 O ATOM 0 H ASP A 20 5.556 -1.597 6.174 1.00 0.00 H new ATOM 0 HA ASP A 20 7.662 -3.591 6.009 1.00 0.00 H new ATOM 0 HB2 ASP A 20 8.064 -0.858 5.123 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.899 -1.083 6.647 1.00 0.00 H new ATOM 165 N PRO A 21 8.142 -2.914 8.619 1.00 0.00 N ATOM 166 CA PRO A 21 8.142 -2.723 10.073 1.00 0.00 C ATOM 167 C PRO A 21 8.538 -1.271 10.428 1.00 0.00 C ATOM 168 O PRO A 21 7.901 -0.316 9.982 1.00 0.00 O ATOM 169 CB PRO A 21 9.143 -3.784 10.574 1.00 0.00 C ATOM 170 CG PRO A 21 10.206 -3.707 9.474 1.00 0.00 C ATOM 171 CD PRO A 21 9.305 -3.713 8.245 1.00 0.00 C ATOM 0 HA PRO A 21 7.167 -2.853 10.544 1.00 0.00 H new ATOM 0 HB2 PRO A 21 9.546 -3.542 11.557 1.00 0.00 H new ATOM 0 HB3 PRO A 21 8.694 -4.775 10.648 1.00 0.00 H new ATOM 0 HG2 PRO A 21 10.814 -2.805 9.542 1.00 0.00 H new ATOM 0 HG3 PRO A 21 10.891 -4.555 9.494 1.00 0.00 H new ATOM 0 HD2 PRO A 21 9.815 -3.286 7.381 1.00 0.00 H new ATOM 0 HD3 PRO A 21 9.015 -4.728 7.974 1.00 0.00 H new ATOM 179 N THR A 22 9.631 -1.083 11.179 1.00 0.00 N ATOM 180 CA THR A 22 10.218 0.206 11.569 1.00 0.00 C ATOM 181 C THR A 22 10.422 1.154 10.393 1.00 0.00 C ATOM 182 O THR A 22 10.312 2.360 10.584 1.00 0.00 O ATOM 183 CB THR A 22 11.533 -0.043 12.316 1.00 0.00 C ATOM 184 OG1 THR A 22 11.185 -0.746 13.486 1.00 0.00 O ATOM 185 CG2 THR A 22 12.268 1.237 12.726 1.00 0.00 C ATOM 0 H THR A 22 10.160 -1.871 11.552 1.00 0.00 H new ATOM 0 HA THR A 22 9.508 0.707 12.228 1.00 0.00 H new ATOM 0 HB THR A 22 12.210 -0.583 11.654 1.00 0.00 H new ATOM 0 HG1 THR A 22 11.993 -0.936 14.006 1.00 0.00 H new ATOM 0 HG21 THR A 22 13.188 0.977 13.249 1.00 0.00 H new ATOM 0 HG22 THR A 22 12.509 1.819 11.836 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.631 1.827 13.385 1.00 0.00 H new ATOM 193 N ARG A 23 10.643 0.665 9.168 1.00 0.00 N ATOM 194 CA ARG A 23 10.737 1.531 7.984 1.00 0.00 C ATOM 195 C ARG A 23 9.396 2.185 7.593 1.00 0.00 C ATOM 196 O ARG A 23 9.396 3.244 6.961 1.00 0.00 O ATOM 197 CB ARG A 23 11.332 0.751 6.811 1.00 0.00 C ATOM 198 CG ARG A 23 12.119 1.653 5.844 1.00 0.00 C ATOM 199 CD ARG A 23 11.591 1.489 4.409 1.00 0.00 C ATOM 200 NE ARG A 23 10.232 2.053 4.322 1.00 0.00 N ATOM 201 CZ ARG A 23 9.124 1.389 4.009 1.00 0.00 C ATOM 202 NH1 ARG A 23 9.140 0.275 3.301 1.00 0.00 N ATOM 203 NH2 ARG A 23 7.983 1.854 4.473 1.00 0.00 N ATOM 0 H ARG A 23 10.761 -0.328 8.969 1.00 0.00 H new ATOM 0 HA ARG A 23 11.401 2.355 8.246 1.00 0.00 H new ATOM 0 HB2 ARG A 23 11.991 -0.028 7.194 1.00 0.00 H new ATOM 0 HB3 ARG A 23 10.530 0.252 6.267 1.00 0.00 H new ATOM 0 HG2 ARG A 23 12.030 2.694 6.154 1.00 0.00 H new ATOM 0 HG3 ARG A 23 13.178 1.399 5.880 1.00 0.00 H new ATOM 0 HD2 ARG A 23 12.253 1.995 3.706 1.00 0.00 H new ATOM 0 HD3 ARG A 23 11.578 0.435 4.132 1.00 0.00 H new ATOM 0 HE ARG A 23 10.132 3.048 4.521 1.00 0.00 H new ATOM 0 HH11 ARG A 23 10.026 -0.107 2.972 1.00 0.00 H new ATOM 0 HH12 ARG A 23 8.266 -0.203 3.083 1.00 0.00 H new ATOM 0 HH21 ARG A 23 7.972 2.695 5.050 1.00 0.00 H new ATOM 0 HH22 ARG A 23 7.110 1.373 4.255 1.00 0.00 H new ATOM 217 N CYS A 24 8.253 1.593 7.951 1.00 0.00 N ATOM 218 CA CYS A 24 6.944 2.251 7.880 1.00 0.00 C ATOM 219 C CYS A 24 6.829 3.273 9.019 1.00 0.00 C ATOM 220 O CYS A 24 6.512 4.434 8.763 1.00 0.00 O ATOM 221 CB CYS A 24 5.828 1.202 7.945 1.00 0.00 C ATOM 222 SG CYS A 24 4.253 2.016 7.560 1.00 0.00 S ATOM 0 H CYS A 24 8.209 0.636 8.301 1.00 0.00 H new ATOM 0 HA CYS A 24 6.842 2.782 6.933 1.00 0.00 H new ATOM 0 HB2 CYS A 24 6.022 0.397 7.236 1.00 0.00 H new ATOM 0 HB3 CYS A 24 5.789 0.751 8.936 1.00 0.00 H new ATOM 0 HG CYS A 24 4.019 1.926 6.284 1.00 0.00 H new ATOM 228 N ARG A 25 7.225 2.909 10.249 1.00 0.00 N ATOM 229 CA ARG A 25 7.283 3.870 11.360 1.00 0.00 C ATOM 230 C ARG A 25 8.151 5.097 11.039 1.00 0.00 C ATOM 231 O ARG A 25 7.674 6.210 11.205 1.00 0.00 O ATOM 232 CB ARG A 25 7.677 3.199 12.689 1.00 0.00 C ATOM 233 CG ARG A 25 6.644 3.531 13.785 1.00 0.00 C ATOM 234 CD ARG A 25 5.363 2.722 13.542 1.00 0.00 C ATOM 235 NE ARG A 25 4.124 3.511 13.528 1.00 0.00 N ATOM 236 CZ ARG A 25 2.939 2.986 13.217 1.00 0.00 C ATOM 237 NH1 ARG A 25 2.740 1.683 13.159 1.00 0.00 N ATOM 238 NH2 ARG A 25 1.929 3.788 12.947 1.00 0.00 N ATOM 0 H ARG A 25 7.508 1.961 10.498 1.00 0.00 H new ATOM 0 HA ARG A 25 6.269 4.248 11.492 1.00 0.00 H new ATOM 0 HB2 ARG A 25 7.739 2.119 12.554 1.00 0.00 H new ATOM 0 HB3 ARG A 25 8.666 3.540 12.997 1.00 0.00 H new ATOM 0 HG2 ARG A 25 7.053 3.298 14.768 1.00 0.00 H new ATOM 0 HG3 ARG A 25 6.420 4.598 13.778 1.00 0.00 H new ATOM 0 HD2 ARG A 25 5.455 2.201 12.589 1.00 0.00 H new ATOM 0 HD3 ARG A 25 5.281 1.958 14.316 1.00 0.00 H new ATOM 0 HE ARG A 25 4.173 4.502 13.766 1.00 0.00 H new ATOM 0 HH11 ARG A 25 3.507 1.041 13.356 1.00 0.00 H new ATOM 0 HH12 ARG A 25 1.819 1.318 12.917 1.00 0.00 H new ATOM 0 HH21 ARG A 25 2.059 4.799 12.977 1.00 0.00 H new ATOM 0 HH22 ARG A 25 1.018 3.398 12.708 1.00 0.00 H new ATOM 252 N ILE A 26 9.342 4.938 10.452 1.00 0.00 N ATOM 253 CA ILE A 26 10.150 6.045 9.897 1.00 0.00 C ATOM 254 C ILE A 26 9.306 6.921 8.980 1.00 0.00 C ATOM 255 O ILE A 26 9.252 8.122 9.204 1.00 0.00 O ATOM 256 CB ILE A 26 11.388 5.503 9.143 1.00 0.00 C ATOM 257 CG1 ILE A 26 12.408 4.924 10.134 1.00 0.00 C ATOM 258 CG2 ILE A 26 12.052 6.549 8.234 1.00 0.00 C ATOM 259 CD1 ILE A 26 13.305 5.942 10.839 1.00 0.00 C ATOM 0 H ILE A 26 9.784 4.025 10.344 1.00 0.00 H new ATOM 0 HA ILE A 26 10.500 6.656 10.729 1.00 0.00 H new ATOM 0 HB ILE A 26 11.029 4.710 8.487 1.00 0.00 H new ATOM 0 HG12 ILE A 26 11.868 4.358 10.893 1.00 0.00 H new ATOM 0 HG13 ILE A 26 13.043 4.217 9.600 1.00 0.00 H new ATOM 0 HG21 ILE A 26 12.913 6.104 7.735 1.00 0.00 H new ATOM 0 HG22 ILE A 26 11.335 6.889 7.486 1.00 0.00 H new ATOM 0 HG23 ILE A 26 12.379 7.398 8.835 1.00 0.00 H new ATOM 0 HD11 ILE A 26 13.985 5.422 11.514 1.00 0.00 H new ATOM 0 HD12 ILE A 26 13.882 6.494 10.097 1.00 0.00 H new ATOM 0 HD13 ILE A 26 12.688 6.637 11.409 1.00 0.00 H new ATOM 271 N LEU A 27 8.600 6.325 8.010 1.00 0.00 N ATOM 272 CA LEU A 27 7.710 7.087 7.121 1.00 0.00 C ATOM 273 C LEU A 27 6.598 7.828 7.881 1.00 0.00 C ATOM 274 O LEU A 27 6.426 9.010 7.611 1.00 0.00 O ATOM 275 CB LEU A 27 7.143 6.242 5.953 1.00 0.00 C ATOM 276 CG LEU A 27 8.129 5.840 4.831 1.00 0.00 C ATOM 277 CD1 LEU A 27 7.390 5.187 3.654 1.00 0.00 C ATOM 278 CD2 LEU A 27 8.876 7.032 4.233 1.00 0.00 C ATOM 0 H LEU A 27 8.627 5.323 7.821 1.00 0.00 H new ATOM 0 HA LEU A 27 8.345 7.849 6.669 1.00 0.00 H new ATOM 0 HB2 LEU A 27 6.716 5.330 6.371 1.00 0.00 H new ATOM 0 HB3 LEU A 27 6.323 6.799 5.499 1.00 0.00 H new ATOM 0 HG LEU A 27 8.829 5.157 5.312 1.00 0.00 H new ATOM 0 HD11 LEU A 27 8.107 4.915 2.880 1.00 0.00 H new ATOM 0 HD12 LEU A 27 6.873 4.292 4.000 1.00 0.00 H new ATOM 0 HD13 LEU A 27 6.664 5.890 3.245 1.00 0.00 H new ATOM 0 HD21 LEU A 27 9.552 6.683 3.452 1.00 0.00 H new ATOM 0 HD22 LEU A 27 8.159 7.734 3.806 1.00 0.00 H new ATOM 0 HD23 LEU A 27 9.451 7.530 5.014 1.00 0.00 H new ATOM 290 N VAL A 28 5.895 7.224 8.846 1.00 0.00 N ATOM 291 CA VAL A 28 4.835 7.948 9.600 1.00 0.00 C ATOM 292 C VAL A 28 5.418 9.073 10.469 1.00 0.00 C ATOM 293 O VAL A 28 4.747 10.064 10.735 1.00 0.00 O ATOM 294 CB VAL A 28 3.871 7.067 10.447 1.00 0.00 C ATOM 295 CG1 VAL A 28 3.498 5.738 9.774 1.00 0.00 C ATOM 296 CG2 VAL A 28 4.335 6.740 11.878 1.00 0.00 C ATOM 0 H VAL A 28 6.028 6.253 9.129 1.00 0.00 H new ATOM 0 HA VAL A 28 4.215 8.368 8.808 1.00 0.00 H new ATOM 0 HB VAL A 28 3.003 7.723 10.515 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.824 5.178 10.423 1.00 0.00 H new ATOM 0 HG12 VAL A 28 3.004 5.938 8.823 1.00 0.00 H new ATOM 0 HG13 VAL A 28 4.401 5.153 9.598 1.00 0.00 H new ATOM 0 HG21 VAL A 28 3.585 6.122 12.371 1.00 0.00 H new ATOM 0 HG22 VAL A 28 5.281 6.200 11.839 1.00 0.00 H new ATOM 0 HG23 VAL A 28 4.468 7.666 12.438 1.00 0.00 H new ATOM 306 N ALA A 29 6.671 8.921 10.905 1.00 0.00 N ATOM 307 CA ALA A 29 7.396 9.886 11.719 1.00 0.00 C ATOM 308 C ALA A 29 7.982 11.049 10.893 1.00 0.00 C ATOM 309 O ALA A 29 8.237 12.119 11.441 1.00 0.00 O ATOM 310 CB ALA A 29 8.456 9.085 12.487 1.00 0.00 C ATOM 0 H ALA A 29 7.224 8.091 10.690 1.00 0.00 H new ATOM 0 HA ALA A 29 6.725 10.390 12.415 1.00 0.00 H new ATOM 0 HB1 ALA A 29 9.035 9.759 13.118 1.00 0.00 H new ATOM 0 HB2 ALA A 29 7.966 8.336 13.109 1.00 0.00 H new ATOM 0 HB3 ALA A 29 9.121 8.590 11.780 1.00 0.00 H new ATOM 316 N LEU A 30 8.149 10.891 9.574 1.00 0.00 N ATOM 317 CA LEU A 30 8.500 12.011 8.691 1.00 0.00 C ATOM 318 C LEU A 30 7.407 13.062 8.685 1.00 0.00 C ATOM 319 O LEU A 30 7.701 14.247 8.825 1.00 0.00 O ATOM 320 CB LEU A 30 8.661 11.526 7.239 1.00 0.00 C ATOM 321 CG LEU A 30 9.926 10.707 6.992 1.00 0.00 C ATOM 322 CD1 LEU A 30 9.829 10.105 5.593 1.00 0.00 C ATOM 323 CD2 LEU A 30 11.144 11.620 7.095 1.00 0.00 C ATOM 0 H LEU A 30 8.047 9.997 9.094 1.00 0.00 H new ATOM 0 HA LEU A 30 9.433 12.430 9.068 1.00 0.00 H new ATOM 0 HB2 LEU A 30 7.793 10.924 6.970 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.666 12.392 6.577 1.00 0.00 H new ATOM 0 HG LEU A 30 10.027 9.912 7.731 1.00 0.00 H new ATOM 0 HD11 LEU A 30 10.721 9.513 5.389 1.00 0.00 H new ATOM 0 HD12 LEU A 30 8.948 9.466 5.532 1.00 0.00 H new ATOM 0 HD13 LEU A 30 9.748 10.905 4.857 1.00 0.00 H new ATOM 0 HD21 LEU A 30 12.050 11.040 6.919 1.00 0.00 H new ATOM 0 HD22 LEU A 30 11.070 12.411 6.349 1.00 0.00 H new ATOM 0 HD23 LEU A 30 11.184 12.062 8.090 1.00 0.00 H new ATOM 335 N LEU A 31 6.189 12.562 8.482 1.00 0.00 N ATOM 336 CA LEU A 31 4.939 13.259 8.207 1.00 0.00 C ATOM 337 C LEU A 31 4.711 14.457 9.148 1.00 0.00 C ATOM 338 O LEU A 31 4.561 15.577 8.670 1.00 0.00 O ATOM 339 CB LEU A 31 3.858 12.174 8.369 1.00 0.00 C ATOM 340 CG LEU A 31 2.687 12.184 7.387 1.00 0.00 C ATOM 341 CD1 LEU A 31 1.757 11.085 7.896 1.00 0.00 C ATOM 342 CD2 LEU A 31 1.957 13.527 7.275 1.00 0.00 C ATOM 0 H LEU A 31 6.041 11.553 8.510 1.00 0.00 H new ATOM 0 HA LEU A 31 4.930 13.704 7.212 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.346 11.202 8.299 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.451 12.254 9.377 1.00 0.00 H new ATOM 0 HG LEU A 31 3.046 12.015 6.372 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.883 11.019 7.248 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.284 10.131 7.892 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.439 11.319 8.912 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.142 13.439 6.556 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.554 13.804 8.249 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.655 14.294 6.940 1.00 0.00 H new ATOM 354 N ASP A 32 4.783 14.209 10.458 1.00 0.00 N ATOM 355 CA ASP A 32 4.652 15.178 11.563 1.00 0.00 C ATOM 356 C ASP A 32 6.031 15.483 12.212 1.00 0.00 C ATOM 357 O ASP A 32 6.143 15.868 13.378 1.00 0.00 O ATOM 358 CB ASP A 32 3.618 14.640 12.577 1.00 0.00 C ATOM 359 CG ASP A 32 2.161 14.745 12.089 1.00 0.00 C ATOM 360 OD1 ASP A 32 1.537 15.798 12.364 1.00 0.00 O ATOM 361 OD2 ASP A 32 1.667 13.761 11.486 1.00 0.00 O ATOM 0 H ASP A 32 4.945 13.263 10.804 1.00 0.00 H new ATOM 0 HA ASP A 32 4.290 16.132 11.180 1.00 0.00 H new ATOM 0 HB2 ASP A 32 3.845 13.596 12.795 1.00 0.00 H new ATOM 0 HB3 ASP A 32 3.719 15.190 13.513 1.00 0.00 H new ATOM 366 N GLY A 33 7.115 15.257 11.458 1.00 0.00 N ATOM 367 CA GLY A 33 8.511 15.444 11.862 1.00 0.00 C ATOM 368 C GLY A 33 9.233 16.476 11.011 1.00 0.00 C ATOM 369 O GLY A 33 9.399 17.614 11.434 1.00 0.00 O ATOM 0 H GLY A 33 7.035 14.921 10.498 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.545 15.752 12.907 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.036 14.491 11.794 1.00 0.00 H new ATOM 373 N VAL A 34 9.759 16.042 9.861 1.00 0.00 N ATOM 374 CA VAL A 34 10.648 16.796 8.936 1.00 0.00 C ATOM 375 C VAL A 34 11.579 17.850 9.578 1.00 0.00 C ATOM 376 O VAL A 34 11.792 18.919 9.011 1.00 0.00 O ATOM 377 CB VAL A 34 9.870 17.368 7.725 1.00 0.00 C ATOM 378 CG1 VAL A 34 9.343 16.260 6.812 1.00 0.00 C ATOM 379 CG2 VAL A 34 8.705 18.289 8.116 1.00 0.00 C ATOM 0 H VAL A 34 9.571 15.099 9.520 1.00 0.00 H new ATOM 0 HA VAL A 34 11.343 16.036 8.580 1.00 0.00 H new ATOM 0 HB VAL A 34 10.603 17.971 7.189 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.804 16.704 5.975 1.00 0.00 H new ATOM 0 HG12 VAL A 34 10.179 15.672 6.434 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.670 15.614 7.375 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.209 18.650 7.215 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.992 17.735 8.726 1.00 0.00 H new ATOM 0 HG23 VAL A 34 9.087 19.137 8.685 1.00 0.00 H new ATOM 389 N CYS A 35 12.156 17.559 10.753 1.00 0.00 N ATOM 390 CA CYS A 35 13.014 18.503 11.484 1.00 0.00 C ATOM 391 C CYS A 35 14.487 18.389 11.090 1.00 0.00 C ATOM 392 O CYS A 35 14.988 19.220 10.346 1.00 0.00 O ATOM 393 CB CYS A 35 12.799 18.330 12.999 1.00 0.00 C ATOM 394 SG CYS A 35 11.262 19.140 13.514 1.00 0.00 S ATOM 0 H CYS A 35 12.041 16.661 11.224 1.00 0.00 H new ATOM 0 HA CYS A 35 12.721 19.515 11.205 1.00 0.00 H new ATOM 0 HB2 CYS A 35 12.760 17.270 13.249 1.00 0.00 H new ATOM 0 HB3 CYS A 35 13.642 18.755 13.544 1.00 0.00 H new ATOM 0 HG CYS A 35 10.278 18.708 12.783 1.00 0.00 H new ATOM 400 N TYR A 36 15.179 17.358 11.583 1.00 0.00 N ATOM 401 CA TYR A 36 16.626 17.193 11.387 1.00 0.00 C ATOM 402 C TYR A 36 16.990 15.727 11.057 1.00 0.00 C ATOM 403 O TYR A 36 16.167 14.844 11.316 1.00 0.00 O ATOM 404 CB TYR A 36 17.402 17.755 12.608 1.00 0.00 C ATOM 405 CG TYR A 36 16.688 18.778 13.480 1.00 0.00 C ATOM 406 CD1 TYR A 36 16.403 20.062 12.980 1.00 0.00 C ATOM 407 CD2 TYR A 36 16.282 18.435 14.788 1.00 0.00 C ATOM 408 CE1 TYR A 36 15.660 20.977 13.748 1.00 0.00 C ATOM 409 CE2 TYR A 36 15.570 19.360 15.575 1.00 0.00 C ATOM 410 CZ TYR A 36 15.243 20.630 15.051 1.00 0.00 C ATOM 411 OH TYR A 36 14.512 21.503 15.792 1.00 0.00 O ATOM 0 H TYR A 36 14.752 16.611 12.131 1.00 0.00 H new ATOM 0 HA TYR A 36 16.932 17.776 10.518 1.00 0.00 H new ATOM 0 HB2 TYR A 36 17.689 16.915 13.240 1.00 0.00 H new ATOM 0 HB3 TYR A 36 18.323 18.208 12.242 1.00 0.00 H new ATOM 0 HD1 TYR A 36 16.757 20.347 12.000 1.00 0.00 H new ATOM 0 HD2 TYR A 36 16.519 17.459 15.186 1.00 0.00 H new ATOM 0 HE1 TYR A 36 15.409 21.945 13.341 1.00 0.00 H new ATOM 0 HE2 TYR A 36 15.274 19.098 16.580 1.00 0.00 H new ATOM 0 HH TYR A 36 14.309 21.103 16.663 1.00 0.00 H new ATOM 421 N PRO A 37 18.199 15.416 10.535 1.00 0.00 N ATOM 422 CA PRO A 37 18.499 14.098 9.970 1.00 0.00 C ATOM 423 C PRO A 37 18.499 12.956 10.993 1.00 0.00 C ATOM 424 O PRO A 37 18.317 11.810 10.602 1.00 0.00 O ATOM 425 CB PRO A 37 19.859 14.246 9.279 1.00 0.00 C ATOM 426 CG PRO A 37 20.545 15.343 10.083 1.00 0.00 C ATOM 427 CD PRO A 37 19.380 16.267 10.433 1.00 0.00 C ATOM 0 HA PRO A 37 17.711 13.808 9.275 1.00 0.00 H new ATOM 0 HB2 PRO A 37 20.426 13.315 9.304 1.00 0.00 H new ATOM 0 HB3 PRO A 37 19.749 14.525 8.231 1.00 0.00 H new ATOM 0 HG2 PRO A 37 21.033 14.949 10.974 1.00 0.00 H new ATOM 0 HG3 PRO A 37 21.310 15.856 9.501 1.00 0.00 H new ATOM 0 HD2 PRO A 37 19.566 16.788 11.372 1.00 0.00 H new ATOM 0 HD3 PRO A 37 19.245 17.030 9.666 1.00 0.00 H new ATOM 435 N GLY A 38 18.647 13.255 12.289 1.00 0.00 N ATOM 436 CA GLY A 38 18.494 12.289 13.385 1.00 0.00 C ATOM 437 C GLY A 38 17.199 12.428 14.197 1.00 0.00 C ATOM 438 O GLY A 38 17.081 11.768 15.224 1.00 0.00 O ATOM 0 H GLY A 38 18.881 14.194 12.612 1.00 0.00 H new ATOM 0 HA2 GLY A 38 18.539 11.282 12.970 1.00 0.00 H new ATOM 0 HA3 GLY A 38 19.342 12.393 14.062 1.00 0.00 H new ATOM 442 N GLN A 39 16.236 13.263 13.790 1.00 0.00 N ATOM 443 CA GLN A 39 15.069 13.595 14.628 1.00 0.00 C ATOM 444 C GLN A 39 14.100 12.427 14.833 1.00 0.00 C ATOM 445 O GLN A 39 13.458 12.370 15.877 1.00 0.00 O ATOM 446 CB GLN A 39 14.343 14.819 14.053 1.00 0.00 C ATOM 447 CG GLN A 39 13.467 14.502 12.822 1.00 0.00 C ATOM 448 CD GLN A 39 12.034 14.067 13.120 1.00 0.00 C ATOM 449 OE1 GLN A 39 11.505 13.181 12.481 1.00 0.00 O ATOM 450 NE2 GLN A 39 11.332 14.689 14.040 1.00 0.00 N ATOM 0 H GLN A 39 16.239 13.725 12.881 1.00 0.00 H new ATOM 0 HA GLN A 39 15.455 13.829 15.620 1.00 0.00 H new ATOM 0 HB2 GLN A 39 13.716 15.257 14.830 1.00 0.00 H new ATOM 0 HB3 GLN A 39 15.082 15.572 13.778 1.00 0.00 H new ATOM 0 HG2 GLN A 39 13.433 15.387 12.186 1.00 0.00 H new ATOM 0 HG3 GLN A 39 13.953 13.714 12.247 1.00 0.00 H new ATOM 0 HE21 GLN A 39 11.758 15.436 14.588 1.00 0.00 H new ATOM 0 HE22 GLN A 39 10.361 14.424 14.206 1.00 0.00 H new ATOM 459 N LEU A 40 14.008 11.496 13.876 1.00 0.00 N ATOM 460 CA LEU A 40 13.071 10.365 13.936 1.00 0.00 C ATOM 461 C LEU A 40 13.351 9.459 15.142 1.00 0.00 C ATOM 462 O LEU A 40 12.477 8.713 15.562 1.00 0.00 O ATOM 463 CB LEU A 40 13.128 9.548 12.632 1.00 0.00 C ATOM 464 CG LEU A 40 12.859 10.373 11.355 1.00 0.00 C ATOM 465 CD1 LEU A 40 13.766 9.908 10.221 1.00 0.00 C ATOM 466 CD2 LEU A 40 11.392 10.267 10.937 1.00 0.00 C ATOM 0 H LEU A 40 14.584 11.505 13.034 1.00 0.00 H new ATOM 0 HA LEU A 40 12.069 10.776 14.055 1.00 0.00 H new ATOM 0 HB2 LEU A 40 14.111 9.083 12.550 1.00 0.00 H new ATOM 0 HB3 LEU A 40 12.398 8.741 12.690 1.00 0.00 H new ATOM 0 HG LEU A 40 13.078 11.418 11.574 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.564 10.499 9.328 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.808 10.036 10.513 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.575 8.856 10.010 1.00 0.00 H new ATOM 0 HD21 LEU A 40 11.227 10.857 10.035 1.00 0.00 H new ATOM 0 HD22 LEU A 40 11.145 9.224 10.739 1.00 0.00 H new ATOM 0 HD23 LEU A 40 10.757 10.645 11.738 1.00 0.00 H new ATOM 478 N ALA A 41 14.551 9.558 15.721 1.00 0.00 N ATOM 479 CA ALA A 41 14.933 8.852 16.942 1.00 0.00 C ATOM 480 C ALA A 41 14.044 9.232 18.136 1.00 0.00 C ATOM 481 O ALA A 41 13.766 8.388 18.983 1.00 0.00 O ATOM 482 CB ALA A 41 16.409 9.164 17.218 1.00 0.00 C ATOM 0 H ALA A 41 15.297 10.143 15.345 1.00 0.00 H new ATOM 0 HA ALA A 41 14.793 7.780 16.803 1.00 0.00 H new ATOM 0 HB1 ALA A 41 16.726 8.650 18.126 1.00 0.00 H new ATOM 0 HB2 ALA A 41 17.016 8.825 16.378 1.00 0.00 H new ATOM 0 HB3 ALA A 41 16.536 10.239 17.346 1.00 0.00 H new ATOM 488 N ALA A 42 13.573 10.484 18.188 1.00 0.00 N ATOM 489 CA ALA A 42 12.662 10.954 19.230 1.00 0.00 C ATOM 490 C ALA A 42 11.230 10.456 18.991 1.00 0.00 C ATOM 491 O ALA A 42 10.578 10.015 19.929 1.00 0.00 O ATOM 492 CB ALA A 42 12.738 12.485 19.285 1.00 0.00 C ATOM 0 H ALA A 42 13.816 11.200 17.504 1.00 0.00 H new ATOM 0 HA ALA A 42 12.963 10.546 20.195 1.00 0.00 H new ATOM 0 HB1 ALA A 42 12.064 12.855 20.058 1.00 0.00 H new ATOM 0 HB2 ALA A 42 13.758 12.791 19.516 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.445 12.899 18.320 1.00 0.00 H new ATOM 498 N HIS A 43 10.765 10.477 17.736 1.00 0.00 N ATOM 499 CA HIS A 43 9.445 9.938 17.384 1.00 0.00 C ATOM 500 C HIS A 43 9.319 8.423 17.626 1.00 0.00 C ATOM 501 O HIS A 43 8.260 7.943 18.032 1.00 0.00 O ATOM 502 CB HIS A 43 9.185 10.207 15.901 1.00 0.00 C ATOM 503 CG HIS A 43 8.779 11.608 15.553 1.00 0.00 C ATOM 504 ND1 HIS A 43 7.812 12.362 16.214 1.00 0.00 N ATOM 505 CD2 HIS A 43 9.041 12.177 14.348 1.00 0.00 C ATOM 506 CE1 HIS A 43 7.488 13.357 15.373 1.00 0.00 C ATOM 507 NE2 HIS A 43 8.200 13.262 14.237 1.00 0.00 N ATOM 0 H HIS A 43 11.284 10.862 16.946 1.00 0.00 H new ATOM 0 HA HIS A 43 8.718 10.434 18.027 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.088 9.961 15.343 1.00 0.00 H new ATOM 0 HB3 HIS A 43 8.405 9.527 15.559 1.00 0.00 H new ATOM 0 HD1 HIS A 43 7.429 12.193 17.144 1.00 0.00 H new ATOM 0 HD2 HIS A 43 9.766 11.844 13.620 1.00 0.00 H new ATOM 0 HE1 HIS A 43 6.758 14.126 15.580 1.00 0.00 H new ATOM 515 N LEU A 44 10.373 7.660 17.308 1.00 0.00 N ATOM 516 CA LEU A 44 10.352 6.197 17.378 1.00 0.00 C ATOM 517 C LEU A 44 10.849 5.650 18.722 1.00 0.00 C ATOM 518 O LEU A 44 10.522 4.514 19.055 1.00 0.00 O ATOM 519 CB LEU A 44 11.156 5.613 16.194 1.00 0.00 C ATOM 520 CG LEU A 44 10.704 6.063 14.787 1.00 0.00 C ATOM 521 CD1 LEU A 44 11.378 5.251 13.692 1.00 0.00 C ATOM 522 CD2 LEU A 44 9.186 5.988 14.588 1.00 0.00 C ATOM 0 H LEU A 44 11.265 8.043 16.995 1.00 0.00 H new ATOM 0 HA LEU A 44 9.313 5.877 17.302 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.204 5.884 16.322 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.100 4.526 16.242 1.00 0.00 H new ATOM 0 HG LEU A 44 11.008 7.107 14.714 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.034 5.598 12.718 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.459 5.375 13.760 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.125 4.198 13.812 1.00 0.00 H new ATOM 0 HD21 LEU A 44 8.934 6.317 13.580 1.00 0.00 H new ATOM 0 HD22 LEU A 44 8.851 4.960 14.728 1.00 0.00 H new ATOM 0 HD23 LEU A 44 8.692 6.633 15.314 1.00 0.00 H new ATOM 534 N GLY A 45 11.650 6.416 19.474 1.00 0.00 N ATOM 535 CA GLY A 45 12.374 5.932 20.659 1.00 0.00 C ATOM 536 C GLY A 45 13.584 5.061 20.297 1.00 0.00 C ATOM 537 O GLY A 45 14.173 4.424 21.169 1.00 0.00 O ATOM 0 H GLY A 45 11.816 7.402 19.275 1.00 0.00 H new ATOM 0 HA2 GLY A 45 12.709 6.785 21.249 1.00 0.00 H new ATOM 0 HA3 GLY A 45 11.693 5.358 21.287 1.00 0.00 H new ATOM 541 N LEU A 46 13.939 4.995 19.007 1.00 0.00 N ATOM 542 CA LEU A 46 14.938 4.081 18.450 1.00 0.00 C ATOM 543 C LEU A 46 16.250 4.817 18.157 1.00 0.00 C ATOM 544 O LEU A 46 16.258 6.017 17.896 1.00 0.00 O ATOM 545 CB LEU A 46 14.366 3.388 17.195 1.00 0.00 C ATOM 546 CG LEU A 46 13.078 2.569 17.449 1.00 0.00 C ATOM 547 CD1 LEU A 46 12.517 2.001 16.140 1.00 0.00 C ATOM 548 CD2 LEU A 46 13.302 1.417 18.440 1.00 0.00 C ATOM 0 H LEU A 46 13.522 5.600 18.299 1.00 0.00 H new ATOM 0 HA LEU A 46 15.170 3.309 19.184 1.00 0.00 H new ATOM 0 HB2 LEU A 46 14.157 4.146 16.440 1.00 0.00 H new ATOM 0 HB3 LEU A 46 15.127 2.726 16.781 1.00 0.00 H new ATOM 0 HG LEU A 46 12.360 3.262 17.886 1.00 0.00 H new ATOM 0 HD11 LEU A 46 11.612 1.430 16.349 1.00 0.00 H new ATOM 0 HD12 LEU A 46 12.281 2.819 15.460 1.00 0.00 H new ATOM 0 HD13 LEU A 46 13.259 1.349 15.679 1.00 0.00 H new ATOM 0 HD21 LEU A 46 12.368 0.874 18.584 1.00 0.00 H new ATOM 0 HD22 LEU A 46 14.059 0.739 18.045 1.00 0.00 H new ATOM 0 HD23 LEU A 46 13.638 1.819 19.396 1.00 0.00 H new ATOM 560 N THR A 47 17.378 4.096 18.205 1.00 0.00 N ATOM 561 CA THR A 47 18.726 4.687 18.131 1.00 0.00 C ATOM 562 C THR A 47 18.965 5.365 16.784 1.00 0.00 C ATOM 563 O THR A 47 18.400 4.951 15.770 1.00 0.00 O ATOM 564 CB THR A 47 19.836 3.672 18.458 1.00 0.00 C ATOM 565 OG1 THR A 47 20.041 2.780 17.387 1.00 0.00 O ATOM 566 CG2 THR A 47 19.533 2.826 19.694 1.00 0.00 C ATOM 0 H THR A 47 17.384 3.080 18.297 1.00 0.00 H new ATOM 0 HA THR A 47 18.772 5.455 18.903 1.00 0.00 H new ATOM 0 HB THR A 47 20.723 4.277 18.646 1.00 0.00 H new ATOM 0 HG1 THR A 47 20.752 2.147 17.620 1.00 0.00 H new ATOM 0 HG21 THR A 47 20.354 2.131 19.870 1.00 0.00 H new ATOM 0 HG22 THR A 47 19.417 3.477 20.561 1.00 0.00 H new ATOM 0 HG23 THR A 47 18.612 2.266 19.535 1.00 0.00 H new ATOM 574 N ARG A 48 19.870 6.355 16.742 1.00 0.00 N ATOM 575 CA ARG A 48 20.241 7.021 15.480 1.00 0.00 C ATOM 576 C ARG A 48 20.758 6.024 14.431 1.00 0.00 C ATOM 577 O ARG A 48 20.537 6.215 13.239 1.00 0.00 O ATOM 578 CB ARG A 48 21.226 8.188 15.717 1.00 0.00 C ATOM 579 CG ARG A 48 22.639 7.773 16.174 1.00 0.00 C ATOM 580 CD ARG A 48 23.551 8.968 16.510 1.00 0.00 C ATOM 581 NE ARG A 48 24.016 9.711 15.317 1.00 0.00 N ATOM 582 CZ ARG A 48 24.897 10.715 15.324 1.00 0.00 C ATOM 583 NH1 ARG A 48 25.415 11.192 16.440 1.00 0.00 N ATOM 584 NH2 ARG A 48 25.289 11.274 14.197 1.00 0.00 N ATOM 0 H ARG A 48 20.358 6.712 17.563 1.00 0.00 H new ATOM 0 HA ARG A 48 19.331 7.456 15.068 1.00 0.00 H new ATOM 0 HB2 ARG A 48 21.314 8.761 14.794 1.00 0.00 H new ATOM 0 HB3 ARG A 48 20.800 8.855 16.467 1.00 0.00 H new ATOM 0 HG2 ARG A 48 22.555 7.132 17.052 1.00 0.00 H new ATOM 0 HG3 ARG A 48 23.106 7.179 15.389 1.00 0.00 H new ATOM 0 HD2 ARG A 48 23.013 9.652 17.167 1.00 0.00 H new ATOM 0 HD3 ARG A 48 24.418 8.609 17.065 1.00 0.00 H new ATOM 0 HE ARG A 48 23.631 9.433 14.414 1.00 0.00 H new ATOM 0 HH11 ARG A 48 25.145 10.793 17.339 1.00 0.00 H new ATOM 0 HH12 ARG A 48 26.085 11.960 16.404 1.00 0.00 H new ATOM 0 HH21 ARG A 48 24.919 10.941 13.307 1.00 0.00 H new ATOM 0 HH22 ARG A 48 25.962 12.040 14.215 1.00 0.00 H new ATOM 598 N SER A 49 21.404 4.939 14.856 1.00 0.00 N ATOM 599 CA SER A 49 21.816 3.837 13.980 1.00 0.00 C ATOM 600 C SER A 49 20.607 3.044 13.469 1.00 0.00 C ATOM 601 O SER A 49 20.463 2.880 12.266 1.00 0.00 O ATOM 602 CB SER A 49 22.788 2.907 14.722 1.00 0.00 C ATOM 603 OG SER A 49 23.752 3.652 15.452 1.00 0.00 O ATOM 0 H SER A 49 21.661 4.796 15.833 1.00 0.00 H new ATOM 0 HA SER A 49 22.321 4.267 13.115 1.00 0.00 H new ATOM 0 HB2 SER A 49 22.231 2.262 15.402 1.00 0.00 H new ATOM 0 HB3 SER A 49 23.292 2.257 14.007 1.00 0.00 H new ATOM 0 HG SER A 49 24.357 3.037 15.916 1.00 0.00 H new ATOM 609 N ASN A 50 19.684 2.622 14.347 1.00 0.00 N ATOM 610 CA ASN A 50 18.471 1.899 13.943 1.00 0.00 C ATOM 611 C ASN A 50 17.533 2.741 13.045 1.00 0.00 C ATOM 612 O ASN A 50 16.962 2.223 12.087 1.00 0.00 O ATOM 613 CB ASN A 50 17.749 1.400 15.200 1.00 0.00 C ATOM 614 CG ASN A 50 16.532 0.557 14.840 1.00 0.00 C ATOM 615 OD1 ASN A 50 15.431 1.068 14.740 1.00 0.00 O ATOM 616 ND2 ASN A 50 16.696 -0.738 14.636 1.00 0.00 N ATOM 0 H ASN A 50 19.758 2.772 15.353 1.00 0.00 H new ATOM 0 HA ASN A 50 18.771 1.050 13.328 1.00 0.00 H new ATOM 0 HB2 ASN A 50 18.436 0.810 15.807 1.00 0.00 H new ATOM 0 HB3 ASN A 50 17.438 2.251 15.806 1.00 0.00 H new ATOM 0 HD21 ASN A 50 15.896 -1.321 14.392 1.00 0.00 H new ATOM 0 HD22 ASN A 50 17.623 -1.155 14.723 1.00 0.00 H new ATOM 623 N VAL A 51 17.417 4.044 13.307 1.00 0.00 N ATOM 624 CA VAL A 51 16.741 5.001 12.421 1.00 0.00 C ATOM 625 C VAL A 51 17.460 5.117 11.070 1.00 0.00 C ATOM 626 O VAL A 51 16.820 4.952 10.035 1.00 0.00 O ATOM 627 CB VAL A 51 16.604 6.372 13.130 1.00 0.00 C ATOM 628 CG1 VAL A 51 16.424 7.586 12.203 1.00 0.00 C ATOM 629 CG2 VAL A 51 15.468 6.337 14.165 1.00 0.00 C ATOM 0 H VAL A 51 17.794 4.473 14.152 1.00 0.00 H new ATOM 0 HA VAL A 51 15.738 4.632 12.206 1.00 0.00 H new ATOM 0 HB VAL A 51 17.568 6.521 13.616 1.00 0.00 H new ATOM 0 HG11 VAL A 51 16.338 8.492 12.803 1.00 0.00 H new ATOM 0 HG12 VAL A 51 17.286 7.669 11.541 1.00 0.00 H new ATOM 0 HG13 VAL A 51 15.520 7.458 11.608 1.00 0.00 H new ATOM 0 HG21 VAL A 51 15.389 7.309 14.651 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.528 6.103 13.666 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.681 5.573 14.913 1.00 0.00 H new ATOM 639 N SER A 52 18.781 5.340 11.049 1.00 0.00 N ATOM 640 CA SER A 52 19.529 5.499 9.782 1.00 0.00 C ATOM 641 C SER A 52 19.511 4.239 8.907 1.00 0.00 C ATOM 642 O SER A 52 19.381 4.344 7.683 1.00 0.00 O ATOM 643 CB SER A 52 20.991 5.881 10.024 1.00 0.00 C ATOM 644 OG SER A 52 21.104 7.073 10.783 1.00 0.00 O ATOM 0 H SER A 52 19.357 5.415 11.888 1.00 0.00 H new ATOM 0 HA SER A 52 19.011 6.302 9.257 1.00 0.00 H new ATOM 0 HB2 SER A 52 21.498 5.069 10.545 1.00 0.00 H new ATOM 0 HB3 SER A 52 21.496 6.010 9.067 1.00 0.00 H new ATOM 0 HG SER A 52 21.007 6.865 11.736 1.00 0.00 H new ATOM 650 N ASN A 53 19.544 3.060 9.537 1.00 0.00 N ATOM 651 CA ASN A 53 19.343 1.752 8.913 1.00 0.00 C ATOM 652 C ASN A 53 18.090 1.722 8.036 1.00 0.00 C ATOM 653 O ASN A 53 18.106 1.152 6.947 1.00 0.00 O ATOM 654 CB ASN A 53 19.286 0.675 10.008 1.00 0.00 C ATOM 655 CG ASN A 53 20.658 0.258 10.535 1.00 0.00 C ATOM 656 OD1 ASN A 53 21.698 0.786 10.171 1.00 0.00 O ATOM 657 ND2 ASN A 53 20.711 -0.732 11.408 1.00 0.00 N ATOM 0 H ASN A 53 19.719 2.991 10.539 1.00 0.00 H new ATOM 0 HA ASN A 53 20.185 1.549 8.251 1.00 0.00 H new ATOM 0 HB2 ASN A 53 18.686 1.046 10.839 1.00 0.00 H new ATOM 0 HB3 ASN A 53 18.776 -0.204 9.614 1.00 0.00 H new ATOM 0 HD21 ASN A 53 21.612 -1.046 11.769 1.00 0.00 H new ATOM 0 HD22 ASN A 53 19.851 -1.182 11.721 1.00 0.00 H new ATOM 664 N HIS A 54 17.020 2.400 8.452 1.00 0.00 N ATOM 665 CA HIS A 54 15.793 2.518 7.670 1.00 0.00 C ATOM 666 C HIS A 54 15.617 3.850 6.904 1.00 0.00 C ATOM 667 O HIS A 54 14.601 4.009 6.223 1.00 0.00 O ATOM 668 CB HIS A 54 14.625 2.089 8.563 1.00 0.00 C ATOM 669 CG HIS A 54 14.533 0.582 8.703 1.00 0.00 C ATOM 670 ND1 HIS A 54 14.456 -0.342 7.679 1.00 0.00 N ATOM 671 CD2 HIS A 54 14.500 -0.137 9.866 1.00 0.00 C ATOM 672 CE1 HIS A 54 14.316 -1.563 8.216 1.00 0.00 C ATOM 673 NE2 HIS A 54 14.330 -1.485 9.552 1.00 0.00 N ATOM 0 H HIS A 54 16.982 2.886 9.348 1.00 0.00 H new ATOM 0 HA HIS A 54 15.842 1.836 6.821 1.00 0.00 H new ATOM 0 HB2 HIS A 54 14.741 2.537 9.550 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.693 2.471 8.147 1.00 0.00 H new ATOM 0 HD2 HIS A 54 14.591 0.271 10.862 1.00 0.00 H new ATOM 0 HE1 HIS A 54 14.208 -2.477 7.652 1.00 0.00 H new ATOM 0 HE2 HIS A 54 14.235 -2.258 10.210 1.00 0.00 H new ATOM 681 N LEU A 55 16.590 4.775 6.941 1.00 0.00 N ATOM 682 CA LEU A 55 16.652 5.923 6.019 1.00 0.00 C ATOM 683 C LEU A 55 17.486 5.609 4.780 1.00 0.00 C ATOM 684 O LEU A 55 17.194 6.164 3.728 1.00 0.00 O ATOM 685 CB LEU A 55 17.266 7.173 6.672 1.00 0.00 C ATOM 686 CG LEU A 55 16.395 7.802 7.772 1.00 0.00 C ATOM 687 CD1 LEU A 55 17.225 8.854 8.515 1.00 0.00 C ATOM 688 CD2 LEU A 55 15.153 8.440 7.136 1.00 0.00 C ATOM 0 H LEU A 55 17.358 4.749 7.612 1.00 0.00 H new ATOM 0 HA LEU A 55 15.615 6.120 5.746 1.00 0.00 H new ATOM 0 HB2 LEU A 55 18.234 6.908 7.098 1.00 0.00 H new ATOM 0 HB3 LEU A 55 17.451 7.919 5.899 1.00 0.00 H new ATOM 0 HG LEU A 55 16.067 7.041 8.480 1.00 0.00 H new ATOM 0 HD11 LEU A 55 16.619 9.309 9.299 1.00 0.00 H new ATOM 0 HD12 LEU A 55 18.099 8.379 8.961 1.00 0.00 H new ATOM 0 HD13 LEU A 55 17.549 9.624 7.814 1.00 0.00 H new ATOM 0 HD21 LEU A 55 14.534 8.886 7.914 1.00 0.00 H new ATOM 0 HD22 LEU A 55 15.461 9.211 6.430 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.580 7.676 6.611 1.00 0.00 H new ATOM 700 N SER A 56 18.514 4.764 4.886 1.00 0.00 N ATOM 701 CA SER A 56 19.494 4.540 3.811 1.00 0.00 C ATOM 702 C SER A 56 18.870 4.341 2.416 1.00 0.00 C ATOM 703 O SER A 56 19.076 5.171 1.528 1.00 0.00 O ATOM 704 CB SER A 56 20.410 3.372 4.196 1.00 0.00 C ATOM 705 OG SER A 56 21.558 3.378 3.366 1.00 0.00 O ATOM 0 H SER A 56 18.694 4.211 5.724 1.00 0.00 H new ATOM 0 HA SER A 56 20.080 5.454 3.717 1.00 0.00 H new ATOM 0 HB2 SER A 56 20.704 3.456 5.242 1.00 0.00 H new ATOM 0 HB3 SER A 56 19.877 2.427 4.090 1.00 0.00 H new ATOM 0 HG SER A 56 22.144 2.633 3.613 1.00 0.00 H new ATOM 711 N CYS A 57 18.017 3.321 2.260 1.00 0.00 N ATOM 712 CA CYS A 57 17.335 3.033 0.997 1.00 0.00 C ATOM 713 C CYS A 57 16.154 3.995 0.711 1.00 0.00 C ATOM 714 O CYS A 57 15.726 4.165 -0.430 1.00 0.00 O ATOM 715 CB CYS A 57 16.888 1.569 1.067 1.00 0.00 C ATOM 716 SG CYS A 57 16.428 0.884 -0.556 1.00 0.00 S ATOM 0 H CYS A 57 17.781 2.671 3.010 1.00 0.00 H new ATOM 0 HA CYS A 57 18.015 3.193 0.160 1.00 0.00 H new ATOM 0 HB2 CYS A 57 17.693 0.970 1.493 1.00 0.00 H new ATOM 0 HB3 CYS A 57 16.037 1.487 1.744 1.00 0.00 H new ATOM 0 HG CYS A 57 16.064 -0.356 -0.416 1.00 0.00 H new ATOM 721 N LEU A 58 15.619 4.643 1.751 1.00 0.00 N ATOM 722 CA LEU A 58 14.539 5.633 1.651 1.00 0.00 C ATOM 723 C LEU A 58 14.972 6.833 0.795 1.00 0.00 C ATOM 724 O LEU A 58 14.177 7.380 0.025 1.00 0.00 O ATOM 725 CB LEU A 58 14.174 6.065 3.090 1.00 0.00 C ATOM 726 CG LEU A 58 12.670 6.149 3.384 1.00 0.00 C ATOM 727 CD1 LEU A 58 12.026 4.760 3.397 1.00 0.00 C ATOM 728 CD2 LEU A 58 12.515 6.779 4.771 1.00 0.00 C ATOM 0 H LEU A 58 15.932 4.491 2.710 1.00 0.00 H new ATOM 0 HA LEU A 58 13.667 5.202 1.158 1.00 0.00 H new ATOM 0 HB2 LEU A 58 14.626 5.362 3.789 1.00 0.00 H new ATOM 0 HB3 LEU A 58 14.621 7.040 3.284 1.00 0.00 H new ATOM 0 HG LEU A 58 12.179 6.739 2.610 1.00 0.00 H new ATOM 0 HD11 LEU A 58 10.961 4.855 3.608 1.00 0.00 H new ATOM 0 HD12 LEU A 58 12.163 4.287 2.425 1.00 0.00 H new ATOM 0 HD13 LEU A 58 12.496 4.148 4.168 1.00 0.00 H new ATOM 0 HD21 LEU A 58 11.456 6.857 5.019 1.00 0.00 H new ATOM 0 HD22 LEU A 58 13.016 6.156 5.512 1.00 0.00 H new ATOM 0 HD23 LEU A 58 12.962 7.773 4.771 1.00 0.00 H new ATOM 740 N ARG A 59 16.254 7.202 0.923 1.00 0.00 N ATOM 741 CA ARG A 59 16.901 8.281 0.170 1.00 0.00 C ATOM 742 C ARG A 59 17.309 7.844 -1.248 1.00 0.00 C ATOM 743 O ARG A 59 17.524 8.693 -2.105 1.00 0.00 O ATOM 744 CB ARG A 59 18.116 8.795 0.945 1.00 0.00 C ATOM 745 CG ARG A 59 17.724 9.306 2.347 1.00 0.00 C ATOM 746 CD ARG A 59 18.871 9.996 3.058 1.00 0.00 C ATOM 747 NE ARG A 59 20.071 9.142 3.108 1.00 0.00 N ATOM 748 CZ ARG A 59 21.316 9.585 3.196 1.00 0.00 C ATOM 749 NH1 ARG A 59 21.577 10.818 3.579 1.00 0.00 N ATOM 750 NH2 ARG A 59 22.312 8.789 2.876 1.00 0.00 N ATOM 0 H ARG A 59 16.888 6.741 1.575 1.00 0.00 H new ATOM 0 HA ARG A 59 16.174 9.085 0.054 1.00 0.00 H new ATOM 0 HB2 ARG A 59 18.851 7.996 1.041 1.00 0.00 H new ATOM 0 HB3 ARG A 59 18.592 9.600 0.384 1.00 0.00 H new ATOM 0 HG2 ARG A 59 16.888 9.999 2.256 1.00 0.00 H new ATOM 0 HG3 ARG A 59 17.378 8.468 2.952 1.00 0.00 H new ATOM 0 HD2 ARG A 59 19.109 10.929 2.546 1.00 0.00 H new ATOM 0 HD3 ARG A 59 18.567 10.257 4.072 1.00 0.00 H new ATOM 0 HE ARG A 59 19.932 8.132 3.072 1.00 0.00 H new ATOM 0 HH11 ARG A 59 20.813 11.451 3.814 1.00 0.00 H new ATOM 0 HH12 ARG A 59 22.543 11.139 3.640 1.00 0.00 H new ATOM 0 HH21 ARG A 59 22.123 7.837 2.562 1.00 0.00 H new ATOM 0 HH22 ARG A 59 23.273 9.123 2.941 1.00 0.00 H new ATOM 764 N GLY A 60 17.433 6.531 -1.490 1.00 0.00 N ATOM 765 CA GLY A 60 17.859 5.945 -2.773 1.00 0.00 C ATOM 766 C GLY A 60 16.704 5.584 -3.714 1.00 0.00 C ATOM 767 O GLY A 60 16.783 5.855 -4.907 1.00 0.00 O ATOM 0 H GLY A 60 17.235 5.826 -0.780 1.00 0.00 H new ATOM 0 HA2 GLY A 60 18.519 6.649 -3.280 1.00 0.00 H new ATOM 0 HA3 GLY A 60 18.444 5.047 -2.573 1.00 0.00 H new ATOM 771 N CYS A 61 15.617 5.015 -3.182 1.00 0.00 N ATOM 772 CA CYS A 61 14.362 4.795 -3.896 1.00 0.00 C ATOM 773 C CYS A 61 13.551 6.110 -4.084 1.00 0.00 C ATOM 774 O CYS A 61 12.495 6.106 -4.721 1.00 0.00 O ATOM 775 CB CYS A 61 13.627 3.673 -3.148 1.00 0.00 C ATOM 776 SG CYS A 61 14.281 1.984 -3.381 1.00 0.00 S ATOM 0 H CYS A 61 15.589 4.687 -2.217 1.00 0.00 H new ATOM 0 HA CYS A 61 14.531 4.476 -4.925 1.00 0.00 H new ATOM 0 HB2 CYS A 61 13.645 3.903 -2.083 1.00 0.00 H new ATOM 0 HB3 CYS A 61 12.582 3.682 -3.459 1.00 0.00 H new ATOM 0 HG CYS A 61 15.023 1.662 -2.363 1.00 0.00 H new ATOM 781 N GLY A 62 14.045 7.225 -3.527 1.00 0.00 N ATOM 782 CA GLY A 62 13.571 8.591 -3.767 1.00 0.00 C ATOM 783 C GLY A 62 12.500 9.114 -2.811 1.00 0.00 C ATOM 784 O GLY A 62 12.138 10.276 -2.928 1.00 0.00 O ATOM 0 H GLY A 62 14.822 7.195 -2.867 1.00 0.00 H new ATOM 0 HA2 GLY A 62 14.428 9.263 -3.722 1.00 0.00 H new ATOM 0 HA3 GLY A 62 13.178 8.643 -4.782 1.00 0.00 H new ATOM 788 N LEU A 63 11.980 8.316 -1.866 1.00 0.00 N ATOM 789 CA LEU A 63 10.853 8.715 -1.013 1.00 0.00 C ATOM 790 C LEU A 63 11.140 9.894 -0.082 1.00 0.00 C ATOM 791 O LEU A 63 10.207 10.618 0.261 1.00 0.00 O ATOM 792 CB LEU A 63 10.420 7.520 -0.184 1.00 0.00 C ATOM 793 CG LEU A 63 9.959 6.329 -1.038 1.00 0.00 C ATOM 794 CD1 LEU A 63 9.516 5.295 -0.032 1.00 0.00 C ATOM 795 CD2 LEU A 63 8.811 6.623 -2.019 1.00 0.00 C ATOM 0 H LEU A 63 12.329 7.377 -1.673 1.00 0.00 H new ATOM 0 HA LEU A 63 10.066 9.054 -1.687 1.00 0.00 H new ATOM 0 HB2 LEU A 63 11.249 7.206 0.450 1.00 0.00 H new ATOM 0 HB3 LEU A 63 9.608 7.820 0.479 1.00 0.00 H new ATOM 0 HG LEU A 63 10.778 6.018 -1.686 1.00 0.00 H new ATOM 0 HD11 LEU A 63 9.168 4.404 -0.555 1.00 0.00 H new ATOM 0 HD12 LEU A 63 10.354 5.033 0.614 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.705 5.700 0.573 1.00 0.00 H new ATOM 0 HD21 LEU A 63 8.563 5.717 -2.571 1.00 0.00 H new ATOM 0 HD22 LEU A 63 7.936 6.960 -1.464 1.00 0.00 H new ATOM 0 HD23 LEU A 63 9.120 7.401 -2.718 1.00 0.00 H new ATOM 807 N VAL A 64 12.395 10.064 0.327 1.00 0.00 N ATOM 808 CA VAL A 64 12.859 11.187 1.146 1.00 0.00 C ATOM 809 C VAL A 64 13.966 11.938 0.436 1.00 0.00 C ATOM 810 O VAL A 64 14.936 11.352 -0.040 1.00 0.00 O ATOM 811 CB VAL A 64 13.368 10.768 2.539 1.00 0.00 C ATOM 812 CG1 VAL A 64 12.216 10.731 3.533 1.00 0.00 C ATOM 813 CG2 VAL A 64 14.072 9.426 2.555 1.00 0.00 C ATOM 0 H VAL A 64 13.140 9.408 0.093 1.00 0.00 H new ATOM 0 HA VAL A 64 11.986 11.823 1.291 1.00 0.00 H new ATOM 0 HB VAL A 64 14.103 11.521 2.823 1.00 0.00 H new ATOM 0 HG11 VAL A 64 12.590 10.434 4.513 1.00 0.00 H new ATOM 0 HG12 VAL A 64 11.763 11.720 3.602 1.00 0.00 H new ATOM 0 HG13 VAL A 64 11.468 10.013 3.197 1.00 0.00 H new ATOM 0 HG21 VAL A 64 14.401 9.200 3.569 1.00 0.00 H new ATOM 0 HG22 VAL A 64 13.385 8.651 2.215 1.00 0.00 H new ATOM 0 HG23 VAL A 64 14.937 9.461 1.892 1.00 0.00 H new ATOM 823 N VAL A 65 13.807 13.254 0.429 1.00 0.00 N ATOM 824 CA VAL A 65 14.702 14.218 -0.198 1.00 0.00 C ATOM 825 C VAL A 65 15.206 15.167 0.886 1.00 0.00 C ATOM 826 O VAL A 65 14.442 15.648 1.725 1.00 0.00 O ATOM 827 CB VAL A 65 13.968 14.977 -1.330 1.00 0.00 C ATOM 828 CG1 VAL A 65 14.913 15.931 -2.068 1.00 0.00 C ATOM 829 CG2 VAL A 65 13.371 14.009 -2.369 1.00 0.00 C ATOM 0 H VAL A 65 13.011 13.701 0.883 1.00 0.00 H new ATOM 0 HA VAL A 65 15.552 13.713 -0.657 1.00 0.00 H new ATOM 0 HB VAL A 65 13.169 15.540 -0.848 1.00 0.00 H new ATOM 0 HG11 VAL A 65 14.366 16.448 -2.856 1.00 0.00 H new ATOM 0 HG12 VAL A 65 15.314 16.662 -1.366 1.00 0.00 H new ATOM 0 HG13 VAL A 65 15.733 15.363 -2.508 1.00 0.00 H new ATOM 0 HG21 VAL A 65 12.864 14.579 -3.148 1.00 0.00 H new ATOM 0 HG22 VAL A 65 14.170 13.416 -2.815 1.00 0.00 H new ATOM 0 HG23 VAL A 65 12.657 13.346 -1.881 1.00 0.00 H new ATOM 839 N ALA A 66 16.516 15.411 0.899 1.00 0.00 N ATOM 840 CA ALA A 66 17.118 16.411 1.776 1.00 0.00 C ATOM 841 C ALA A 66 16.773 17.847 1.342 1.00 0.00 C ATOM 842 O ALA A 66 16.661 18.181 0.164 1.00 0.00 O ATOM 843 CB ALA A 66 18.630 16.172 1.852 1.00 0.00 C ATOM 0 H ALA A 66 17.186 14.923 0.304 1.00 0.00 H new ATOM 0 HA ALA A 66 16.698 16.301 2.776 1.00 0.00 H new ATOM 0 HB1 ALA A 66 19.084 16.917 2.506 1.00 0.00 H new ATOM 0 HB2 ALA A 66 18.821 15.175 2.250 1.00 0.00 H new ATOM 0 HB3 ALA A 66 19.062 16.254 0.855 1.00 0.00 H new ATOM 849 N THR A 67 16.603 18.714 2.336 1.00 0.00 N ATOM 850 CA THR A 67 16.234 20.131 2.206 1.00 0.00 C ATOM 851 C THR A 67 16.714 20.818 3.475 1.00 0.00 C ATOM 852 O THR A 67 16.903 20.144 4.473 1.00 0.00 O ATOM 853 CB THR A 67 14.721 20.223 1.970 1.00 0.00 C ATOM 854 OG1 THR A 67 14.499 20.074 0.589 1.00 0.00 O ATOM 855 CG2 THR A 67 14.068 21.542 2.377 1.00 0.00 C ATOM 0 H THR A 67 16.724 18.437 3.310 1.00 0.00 H new ATOM 0 HA THR A 67 16.698 20.631 1.356 1.00 0.00 H new ATOM 0 HB THR A 67 14.276 19.448 2.594 1.00 0.00 H new ATOM 0 HG1 THR A 67 15.192 19.496 0.207 1.00 0.00 H new ATOM 0 HG21 THR A 67 12.999 21.499 2.167 1.00 0.00 H new ATOM 0 HG22 THR A 67 14.222 21.711 3.443 1.00 0.00 H new ATOM 0 HG23 THR A 67 14.516 22.359 1.812 1.00 0.00 H new ATOM 863 N TYR A 68 16.930 22.129 3.478 1.00 0.00 N ATOM 864 CA TYR A 68 17.314 22.859 4.694 1.00 0.00 C ATOM 865 C TYR A 68 16.100 23.414 5.453 1.00 0.00 C ATOM 866 O TYR A 68 15.208 24.000 4.836 1.00 0.00 O ATOM 867 CB TYR A 68 18.276 24.004 4.333 1.00 0.00 C ATOM 868 CG TYR A 68 19.748 23.702 4.512 1.00 0.00 C ATOM 869 CD1 TYR A 68 20.450 22.987 3.523 1.00 0.00 C ATOM 870 CD2 TYR A 68 20.431 24.184 5.648 1.00 0.00 C ATOM 871 CE1 TYR A 68 21.830 22.744 3.669 1.00 0.00 C ATOM 872 CE2 TYR A 68 21.805 23.937 5.804 1.00 0.00 C ATOM 873 CZ TYR A 68 22.509 23.211 4.817 1.00 0.00 C ATOM 874 OH TYR A 68 23.833 22.956 4.988 1.00 0.00 O ATOM 0 H TYR A 68 16.846 22.717 2.649 1.00 0.00 H new ATOM 0 HA TYR A 68 17.811 22.150 5.356 1.00 0.00 H new ATOM 0 HB2 TYR A 68 18.105 24.284 3.294 1.00 0.00 H new ATOM 0 HB3 TYR A 68 18.025 24.872 4.943 1.00 0.00 H new ATOM 0 HD1 TYR A 68 19.929 22.624 2.650 1.00 0.00 H new ATOM 0 HD2 TYR A 68 19.896 24.745 6.400 1.00 0.00 H new ATOM 0 HE1 TYR A 68 22.368 22.202 2.905 1.00 0.00 H new ATOM 0 HE2 TYR A 68 22.323 24.302 6.678 1.00 0.00 H new ATOM 0 HH TYR A 68 24.136 23.352 5.831 1.00 0.00 H new ATOM 884 N GLU A 69 16.084 23.254 6.783 1.00 0.00 N ATOM 885 CA GLU A 69 15.185 24.005 7.673 1.00 0.00 C ATOM 886 C GLU A 69 15.735 25.429 7.935 1.00 0.00 C ATOM 887 O GLU A 69 14.991 26.306 8.360 1.00 0.00 O ATOM 888 CB GLU A 69 14.802 23.199 8.940 1.00 0.00 C ATOM 889 CG GLU A 69 15.873 22.599 9.871 1.00 0.00 C ATOM 890 CD GLU A 69 16.630 23.619 10.718 1.00 0.00 C ATOM 891 OE1 GLU A 69 17.423 24.374 10.133 1.00 0.00 O ATOM 892 OE2 GLU A 69 16.517 23.626 11.965 1.00 0.00 O ATOM 0 H GLU A 69 16.694 22.600 7.274 1.00 0.00 H new ATOM 0 HA GLU A 69 14.231 24.152 7.167 1.00 0.00 H new ATOM 0 HB2 GLU A 69 14.180 23.851 9.553 1.00 0.00 H new ATOM 0 HB3 GLU A 69 14.171 22.373 8.611 1.00 0.00 H new ATOM 0 HG2 GLU A 69 15.395 21.880 10.536 1.00 0.00 H new ATOM 0 HG3 GLU A 69 16.591 22.046 9.266 1.00 0.00 H new ATOM 899 N GLY A 70 17.000 25.689 7.557 1.00 0.00 N ATOM 900 CA GLY A 70 17.655 27.005 7.516 1.00 0.00 C ATOM 901 C GLY A 70 18.975 27.036 8.288 1.00 0.00 C ATOM 902 O GLY A 70 19.976 27.533 7.780 1.00 0.00 O ATOM 0 H GLY A 70 17.626 24.942 7.255 1.00 0.00 H new ATOM 0 HA2 GLY A 70 17.840 27.281 6.478 1.00 0.00 H new ATOM 0 HA3 GLY A 70 16.980 27.754 7.930 1.00 0.00 H new ATOM 906 N ARG A 71 18.973 26.454 9.485 1.00 0.00 N ATOM 907 CA ARG A 71 20.094 26.258 10.418 1.00 0.00 C ATOM 908 C ARG A 71 20.774 24.891 10.205 1.00 0.00 C ATOM 909 O ARG A 71 21.900 24.650 10.640 1.00 0.00 O ATOM 910 CB ARG A 71 19.520 26.250 11.852 1.00 0.00 C ATOM 911 CG ARG A 71 18.559 27.403 12.219 1.00 0.00 C ATOM 912 CD ARG A 71 17.418 26.911 13.121 1.00 0.00 C ATOM 913 NE ARG A 71 17.906 26.560 14.469 1.00 0.00 N ATOM 914 CZ ARG A 71 18.019 25.345 14.997 1.00 0.00 C ATOM 915 NH1 ARG A 71 17.669 24.245 14.365 1.00 0.00 N ATOM 916 NH2 ARG A 71 18.512 25.221 16.212 1.00 0.00 N ATOM 0 H ARG A 71 18.109 26.070 9.867 1.00 0.00 H new ATOM 0 HA ARG A 71 20.820 27.054 10.254 1.00 0.00 H new ATOM 0 HB2 ARG A 71 18.994 25.307 12.003 1.00 0.00 H new ATOM 0 HB3 ARG A 71 20.354 26.266 12.553 1.00 0.00 H new ATOM 0 HG2 ARG A 71 19.112 28.193 12.727 1.00 0.00 H new ATOM 0 HG3 ARG A 71 18.145 27.838 11.309 1.00 0.00 H new ATOM 0 HD2 ARG A 71 16.655 27.686 13.200 1.00 0.00 H new ATOM 0 HD3 ARG A 71 16.943 26.041 12.667 1.00 0.00 H new ATOM 0 HE ARG A 71 18.189 27.339 15.064 1.00 0.00 H new ATOM 0 HH11 ARG A 71 17.289 24.299 13.420 1.00 0.00 H new ATOM 0 HH12 ARG A 71 17.778 23.339 14.820 1.00 0.00 H new ATOM 0 HH21 ARG A 71 18.800 26.050 16.733 1.00 0.00 H new ATOM 0 HH22 ARG A 71 18.606 24.296 16.632 1.00 0.00 H new ATOM 930 N GLN A 72 20.049 23.949 9.609 1.00 0.00 N ATOM 931 CA GLN A 72 20.368 22.538 9.477 1.00 0.00 C ATOM 932 C GLN A 72 19.606 21.961 8.274 1.00 0.00 C ATOM 933 O GLN A 72 18.683 22.581 7.742 1.00 0.00 O ATOM 934 CB GLN A 72 19.935 21.830 10.787 1.00 0.00 C ATOM 935 CG GLN A 72 20.706 20.548 11.142 1.00 0.00 C ATOM 936 CD GLN A 72 22.137 20.740 11.661 1.00 0.00 C ATOM 937 OE1 GLN A 72 22.754 19.785 12.097 1.00 0.00 O ATOM 938 NE2 GLN A 72 22.739 21.916 11.639 1.00 0.00 N ATOM 0 H GLN A 72 19.155 24.174 9.173 1.00 0.00 H new ATOM 0 HA GLN A 72 21.435 22.389 9.313 1.00 0.00 H new ATOM 0 HB2 GLN A 72 20.042 22.535 11.611 1.00 0.00 H new ATOM 0 HB3 GLN A 72 18.876 21.585 10.712 1.00 0.00 H new ATOM 0 HG2 GLN A 72 20.138 20.004 11.897 1.00 0.00 H new ATOM 0 HG3 GLN A 72 20.745 19.915 10.255 1.00 0.00 H new ATOM 0 HE21 GLN A 72 22.247 22.734 11.279 1.00 0.00 H new ATOM 0 HE22 GLN A 72 23.696 22.006 11.982 1.00 0.00 H new ATOM 947 N VAL A 73 19.962 20.745 7.867 1.00 0.00 N ATOM 948 CA VAL A 73 19.183 19.953 6.909 1.00 0.00 C ATOM 949 C VAL A 73 18.076 19.173 7.621 1.00 0.00 C ATOM 950 O VAL A 73 18.177 18.878 8.811 1.00 0.00 O ATOM 951 CB VAL A 73 20.050 19.004 6.054 1.00 0.00 C ATOM 952 CG1 VAL A 73 21.085 19.776 5.229 1.00 0.00 C ATOM 953 CG2 VAL A 73 20.751 17.911 6.885 1.00 0.00 C ATOM 0 H VAL A 73 20.806 20.275 8.194 1.00 0.00 H new ATOM 0 HA VAL A 73 18.732 20.667 6.220 1.00 0.00 H new ATOM 0 HB VAL A 73 19.356 18.504 5.378 1.00 0.00 H new ATOM 0 HG11 VAL A 73 21.677 19.075 4.640 1.00 0.00 H new ATOM 0 HG12 VAL A 73 20.574 20.470 4.562 1.00 0.00 H new ATOM 0 HG13 VAL A 73 21.741 20.333 5.898 1.00 0.00 H new ATOM 0 HG21 VAL A 73 21.344 17.277 6.226 1.00 0.00 H new ATOM 0 HG22 VAL A 73 21.403 18.377 7.624 1.00 0.00 H new ATOM 0 HG23 VAL A 73 20.002 17.304 7.394 1.00 0.00 H new ATOM 963 N ARG A 74 17.053 18.797 6.857 1.00 0.00 N ATOM 964 CA ARG A 74 15.939 17.919 7.198 1.00 0.00 C ATOM 965 C ARG A 74 15.800 16.847 6.115 1.00 0.00 C ATOM 966 O ARG A 74 16.266 17.016 4.985 1.00 0.00 O ATOM 967 CB ARG A 74 14.634 18.719 7.312 1.00 0.00 C ATOM 968 CG ARG A 74 14.036 19.277 6.012 1.00 0.00 C ATOM 969 CD ARG A 74 12.750 20.027 6.362 1.00 0.00 C ATOM 970 NE ARG A 74 12.278 20.930 5.292 1.00 0.00 N ATOM 971 CZ ARG A 74 11.027 21.077 4.862 1.00 0.00 C ATOM 972 NH1 ARG A 74 10.033 20.341 5.328 1.00 0.00 N ATOM 973 NH2 ARG A 74 10.760 21.989 3.948 1.00 0.00 N ATOM 0 H ARG A 74 16.977 19.130 5.896 1.00 0.00 H new ATOM 0 HA ARG A 74 16.136 17.450 8.162 1.00 0.00 H new ATOM 0 HB2 ARG A 74 13.886 18.080 7.781 1.00 0.00 H new ATOM 0 HB3 ARG A 74 14.808 19.555 7.989 1.00 0.00 H new ATOM 0 HG2 ARG A 74 14.745 19.945 5.523 1.00 0.00 H new ATOM 0 HG3 ARG A 74 13.826 18.468 5.312 1.00 0.00 H new ATOM 0 HD2 ARG A 74 11.967 19.302 6.585 1.00 0.00 H new ATOM 0 HD3 ARG A 74 12.915 20.608 7.269 1.00 0.00 H new ATOM 0 HE ARG A 74 12.987 21.502 4.834 1.00 0.00 H new ATOM 0 HH11 ARG A 74 10.213 19.633 6.040 1.00 0.00 H new ATOM 0 HH12 ARG A 74 9.086 20.481 4.976 1.00 0.00 H new ATOM 0 HH21 ARG A 74 11.509 22.574 3.577 1.00 0.00 H new ATOM 0 HH22 ARG A 74 9.805 22.110 3.612 1.00 0.00 H new ATOM 987 N TYR A 75 15.089 15.771 6.440 1.00 0.00 N ATOM 988 CA TYR A 75 14.645 14.771 5.466 1.00 0.00 C ATOM 989 C TYR A 75 13.136 14.936 5.292 1.00 0.00 C ATOM 990 O TYR A 75 12.382 14.713 6.236 1.00 0.00 O ATOM 991 CB TYR A 75 15.003 13.355 5.945 1.00 0.00 C ATOM 992 CG TYR A 75 16.488 13.032 5.949 1.00 0.00 C ATOM 993 CD1 TYR A 75 17.301 13.349 4.839 1.00 0.00 C ATOM 994 CD2 TYR A 75 17.062 12.397 7.068 1.00 0.00 C ATOM 995 CE1 TYR A 75 18.681 13.071 4.864 1.00 0.00 C ATOM 996 CE2 TYR A 75 18.442 12.115 7.099 1.00 0.00 C ATOM 997 CZ TYR A 75 19.257 12.464 6.001 1.00 0.00 C ATOM 998 OH TYR A 75 20.597 12.233 6.041 1.00 0.00 O ATOM 0 H TYR A 75 14.800 15.564 7.396 1.00 0.00 H new ATOM 0 HA TYR A 75 15.146 14.916 4.509 1.00 0.00 H new ATOM 0 HB2 TYR A 75 14.615 13.221 6.955 1.00 0.00 H new ATOM 0 HB3 TYR A 75 14.492 12.633 5.309 1.00 0.00 H new ATOM 0 HD1 TYR A 75 16.862 13.808 3.965 1.00 0.00 H new ATOM 0 HD2 TYR A 75 16.440 12.125 7.908 1.00 0.00 H new ATOM 0 HE1 TYR A 75 19.298 13.322 4.014 1.00 0.00 H new ATOM 0 HE2 TYR A 75 18.876 11.632 7.962 1.00 0.00 H new ATOM 0 HH TYR A 75 20.831 11.811 6.894 1.00 0.00 H new ATOM 1008 N ALA A 76 12.711 15.406 4.121 1.00 0.00 N ATOM 1009 CA ALA A 76 11.308 15.625 3.794 1.00 0.00 C ATOM 1010 C ALA A 76 10.837 14.605 2.758 1.00 0.00 C ATOM 1011 O ALA A 76 11.621 14.220 1.888 1.00 0.00 O ATOM 1012 CB ALA A 76 11.147 17.067 3.295 1.00 0.00 C ATOM 0 H ALA A 76 13.346 15.649 3.360 1.00 0.00 H new ATOM 0 HA ALA A 76 10.684 15.487 4.677 1.00 0.00 H new ATOM 0 HB1 ALA A 76 10.102 17.251 3.045 1.00 0.00 H new ATOM 0 HB2 ALA A 76 11.460 17.759 4.076 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.764 17.216 2.409 1.00 0.00 H new ATOM 1018 N LEU A 77 9.570 14.182 2.841 1.00 0.00 N ATOM 1019 CA LEU A 77 8.940 13.394 1.786 1.00 0.00 C ATOM 1020 C LEU A 77 9.021 14.138 0.450 1.00 0.00 C ATOM 1021 O LEU A 77 8.979 15.368 0.412 1.00 0.00 O ATOM 1022 CB LEU A 77 7.503 13.036 2.196 1.00 0.00 C ATOM 1023 CG LEU A 77 7.462 11.898 3.222 1.00 0.00 C ATOM 1024 CD1 LEU A 77 6.038 11.835 3.752 1.00 0.00 C ATOM 1025 CD2 LEU A 77 7.858 10.539 2.634 1.00 0.00 C ATOM 0 H LEU A 77 8.961 14.376 3.636 1.00 0.00 H new ATOM 0 HA LEU A 77 9.474 12.454 1.647 1.00 0.00 H new ATOM 0 HB2 LEU A 77 7.015 13.917 2.613 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.936 12.746 1.311 1.00 0.00 H new ATOM 0 HG LEU A 77 8.188 12.105 4.008 1.00 0.00 H new ATOM 0 HD11 LEU A 77 5.959 11.036 4.489 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.781 12.786 4.219 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.352 11.638 2.928 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.808 9.777 3.412 1.00 0.00 H new ATOM 0 HD22 LEU A 77 7.173 10.278 1.827 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.874 10.593 2.244 1.00 0.00 H new ATOM 1037 N ALA A 78 9.176 13.361 -0.619 1.00 0.00 N ATOM 1038 CA ALA A 78 9.531 13.862 -1.950 1.00 0.00 C ATOM 1039 C ALA A 78 8.432 14.704 -2.622 1.00 0.00 C ATOM 1040 O ALA A 78 8.746 15.680 -3.303 1.00 0.00 O ATOM 1041 CB ALA A 78 9.952 12.656 -2.791 1.00 0.00 C ATOM 0 H ALA A 78 9.057 12.348 -0.587 1.00 0.00 H new ATOM 0 HA ALA A 78 10.356 14.568 -1.855 1.00 0.00 H new ATOM 0 HB1 ALA A 78 10.225 12.988 -3.793 1.00 0.00 H new ATOM 0 HB2 ALA A 78 10.808 12.168 -2.325 1.00 0.00 H new ATOM 0 HB3 ALA A 78 9.124 11.951 -2.856 1.00 0.00 H new ATOM 1047 N ASP A 79 7.166 14.367 -2.347 1.00 0.00 N ATOM 1048 CA ASP A 79 5.963 15.141 -2.674 1.00 0.00 C ATOM 1049 C ASP A 79 4.799 14.784 -1.724 1.00 0.00 C ATOM 1050 O ASP A 79 4.748 13.712 -1.110 1.00 0.00 O ATOM 1051 CB ASP A 79 5.549 14.969 -4.158 1.00 0.00 C ATOM 1052 CG ASP A 79 4.189 15.629 -4.474 1.00 0.00 C ATOM 1053 OD1 ASP A 79 3.992 16.824 -4.153 1.00 0.00 O ATOM 1054 OD2 ASP A 79 3.243 14.882 -4.808 1.00 0.00 O ATOM 0 H ASP A 79 6.941 13.498 -1.863 1.00 0.00 H new ATOM 0 HA ASP A 79 6.206 16.194 -2.530 1.00 0.00 H new ATOM 0 HB2 ASP A 79 6.317 15.403 -4.798 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.498 13.907 -4.397 1.00 0.00 H new ATOM 1059 N SER A 80 3.835 15.704 -1.663 1.00 0.00 N ATOM 1060 CA SER A 80 2.513 15.597 -1.053 1.00 0.00 C ATOM 1061 C SER A 80 1.772 14.292 -1.382 1.00 0.00 C ATOM 1062 O SER A 80 1.032 13.790 -0.537 1.00 0.00 O ATOM 1063 CB SER A 80 1.676 16.797 -1.523 1.00 0.00 C ATOM 1064 OG SER A 80 1.385 16.746 -2.914 1.00 0.00 O ATOM 0 H SER A 80 3.975 16.625 -2.077 1.00 0.00 H new ATOM 0 HA SER A 80 2.653 15.592 0.028 1.00 0.00 H new ATOM 0 HB2 SER A 80 0.743 16.828 -0.961 1.00 0.00 H new ATOM 0 HB3 SER A 80 2.212 17.719 -1.301 1.00 0.00 H new ATOM 0 HG SER A 80 2.204 16.913 -3.426 1.00 0.00 H new ATOM 1070 N HIS A 81 2.002 13.694 -2.560 1.00 0.00 N ATOM 1071 CA HIS A 81 1.497 12.376 -2.945 1.00 0.00 C ATOM 1072 C HIS A 81 1.867 11.288 -1.940 1.00 0.00 C ATOM 1073 O HIS A 81 1.004 10.482 -1.587 1.00 0.00 O ATOM 1074 CB HIS A 81 2.037 12.020 -4.347 1.00 0.00 C ATOM 1075 CG HIS A 81 1.161 12.468 -5.490 1.00 0.00 C ATOM 1076 ND1 HIS A 81 -0.057 13.109 -5.387 1.00 0.00 N ATOM 1077 CD2 HIS A 81 1.259 11.987 -6.763 1.00 0.00 C ATOM 1078 CE1 HIS A 81 -0.723 12.924 -6.539 1.00 0.00 C ATOM 1079 NE2 HIS A 81 0.089 12.311 -7.420 1.00 0.00 N ATOM 0 H HIS A 81 2.563 14.131 -3.291 1.00 0.00 H new ATOM 0 HA HIS A 81 0.408 12.425 -2.961 1.00 0.00 H new ATOM 0 HB2 HIS A 81 3.024 12.467 -4.466 1.00 0.00 H new ATOM 0 HB3 HIS A 81 2.167 10.940 -4.408 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -0.393 13.632 -4.578 1.00 0.00 H new ATOM 0 HD2 HIS A 81 2.098 11.451 -7.180 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -1.745 13.219 -6.728 1.00 0.00 H new ATOM 1088 N LEU A 82 3.124 11.237 -1.487 1.00 0.00 N ATOM 1089 CA LEU A 82 3.548 10.215 -0.523 1.00 0.00 C ATOM 1090 C LEU A 82 2.992 10.548 0.853 1.00 0.00 C ATOM 1091 O LEU A 82 2.390 9.680 1.464 1.00 0.00 O ATOM 1092 CB LEU A 82 5.073 10.052 -0.445 1.00 0.00 C ATOM 1093 CG LEU A 82 5.831 10.102 -1.792 1.00 0.00 C ATOM 1094 CD1 LEU A 82 7.336 10.150 -1.506 1.00 0.00 C ATOM 1095 CD2 LEU A 82 5.491 8.880 -2.658 1.00 0.00 C ATOM 0 H LEU A 82 3.860 11.885 -1.769 1.00 0.00 H new ATOM 0 HA LEU A 82 3.150 9.263 -0.874 1.00 0.00 H new ATOM 0 HB2 LEU A 82 5.469 10.835 0.201 1.00 0.00 H new ATOM 0 HB3 LEU A 82 5.292 9.099 0.037 1.00 0.00 H new ATOM 0 HG LEU A 82 5.529 10.992 -2.344 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.884 10.186 -2.447 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.566 11.038 -0.918 1.00 0.00 H new ATOM 0 HD13 LEU A 82 7.629 9.260 -0.949 1.00 0.00 H new ATOM 0 HD21 LEU A 82 6.036 8.938 -3.600 1.00 0.00 H new ATOM 0 HD22 LEU A 82 5.775 7.970 -2.130 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.420 8.864 -2.859 1.00 0.00 H new ATOM 1107 N ALA A 83 3.085 11.810 1.291 1.00 0.00 N ATOM 1108 CA ALA A 83 2.503 12.290 2.548 1.00 0.00 C ATOM 1109 C ALA A 83 0.991 12.000 2.646 1.00 0.00 C ATOM 1110 O ALA A 83 0.496 11.720 3.732 1.00 0.00 O ATOM 1111 CB ALA A 83 2.810 13.789 2.668 1.00 0.00 C ATOM 0 H ALA A 83 3.576 12.538 0.772 1.00 0.00 H new ATOM 0 HA ALA A 83 2.950 11.752 3.384 1.00 0.00 H new ATOM 0 HB1 ALA A 83 2.388 14.174 3.596 1.00 0.00 H new ATOM 0 HB2 ALA A 83 3.889 13.940 2.670 1.00 0.00 H new ATOM 0 HB3 ALA A 83 2.371 14.319 1.823 1.00 0.00 H new ATOM 1117 N ARG A 84 0.282 11.993 1.509 1.00 0.00 N ATOM 1118 CA ARG A 84 -1.134 11.633 1.399 1.00 0.00 C ATOM 1119 C ARG A 84 -1.394 10.136 1.566 1.00 0.00 C ATOM 1120 O ARG A 84 -2.008 9.767 2.560 1.00 0.00 O ATOM 1121 CB ARG A 84 -1.698 12.105 0.046 1.00 0.00 C ATOM 1122 CG ARG A 84 -2.443 13.437 0.135 1.00 0.00 C ATOM 1123 CD ARG A 84 -3.463 13.509 -1.010 1.00 0.00 C ATOM 1124 NE ARG A 84 -4.356 14.669 -0.868 1.00 0.00 N ATOM 1125 CZ ARG A 84 -5.363 14.753 -0.005 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -5.685 13.771 0.812 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -6.075 15.860 0.054 1.00 0.00 N ATOM 0 H ARG A 84 0.695 12.247 0.611 1.00 0.00 H new ATOM 0 HA ARG A 84 -1.643 12.138 2.220 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -0.880 12.201 -0.668 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -2.374 11.344 -0.344 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -2.948 13.524 1.097 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -1.741 14.268 0.068 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -2.937 13.568 -1.963 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -4.055 12.594 -1.029 1.00 0.00 H new ATOM 0 HE ARG A 84 -4.190 15.469 -1.478 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -5.153 12.901 0.799 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -6.467 13.881 1.458 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -5.851 16.643 -0.560 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -6.850 15.934 0.713 1.00 0.00 H new ATOM 1141 N ALA A 85 -0.900 9.258 0.681 1.00 0.00 N ATOM 1142 CA ALA A 85 -1.211 7.820 0.805 1.00 0.00 C ATOM 1143 C ALA A 85 -0.568 7.178 2.060 1.00 0.00 C ATOM 1144 O ALA A 85 -0.929 6.072 2.467 1.00 0.00 O ATOM 1145 CB ALA A 85 -0.925 7.110 -0.523 1.00 0.00 C ATOM 0 H ALA A 85 -0.301 9.504 -0.107 1.00 0.00 H new ATOM 0 HA ALA A 85 -2.278 7.693 0.989 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -1.156 6.049 -0.426 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.542 7.545 -1.309 1.00 0.00 H new ATOM 0 HB3 ALA A 85 0.127 7.230 -0.780 1.00 0.00 H new ATOM 1151 N LEU A 86 0.355 7.910 2.693 1.00 0.00 N ATOM 1152 CA LEU A 86 0.871 7.673 4.036 1.00 0.00 C ATOM 1153 C LEU A 86 -0.170 8.120 5.095 1.00 0.00 C ATOM 1154 O LEU A 86 -0.525 7.335 5.972 1.00 0.00 O ATOM 1155 CB LEU A 86 2.175 8.495 4.152 1.00 0.00 C ATOM 1156 CG LEU A 86 2.832 8.499 5.534 1.00 0.00 C ATOM 1157 CD1 LEU A 86 3.265 7.123 6.023 1.00 0.00 C ATOM 1158 CD2 LEU A 86 4.051 9.417 5.480 1.00 0.00 C ATOM 0 H LEU A 86 0.782 8.726 2.255 1.00 0.00 H new ATOM 0 HA LEU A 86 1.067 6.615 4.212 1.00 0.00 H new ATOM 0 HB2 LEU A 86 2.893 8.108 3.429 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.961 9.525 3.868 1.00 0.00 H new ATOM 0 HG LEU A 86 2.082 8.849 6.243 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.721 7.214 7.009 1.00 0.00 H new ATOM 0 HD12 LEU A 86 2.396 6.468 6.084 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.989 6.700 5.326 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.536 9.435 6.456 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.753 9.046 4.733 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.735 10.425 5.213 1.00 0.00 H new ATOM 1170 N GLY A 87 -0.640 9.372 4.996 1.00 0.00 N ATOM 1171 CA GLY A 87 -1.431 10.126 5.979 1.00 0.00 C ATOM 1172 C GLY A 87 -2.947 9.918 5.991 1.00 0.00 C ATOM 1173 O GLY A 87 -3.516 9.827 7.077 1.00 0.00 O ATOM 0 H GLY A 87 -0.462 9.928 4.159 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -1.052 9.881 6.971 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -1.241 11.187 5.818 1.00 0.00 H new ATOM 1177 N GLU A 88 -3.602 9.828 4.825 1.00 0.00 N ATOM 1178 CA GLU A 88 -5.014 9.413 4.740 1.00 0.00 C ATOM 1179 C GLU A 88 -5.202 7.966 5.234 1.00 0.00 C ATOM 1180 O GLU A 88 -6.284 7.614 5.704 1.00 0.00 O ATOM 1181 CB GLU A 88 -5.650 9.720 3.362 1.00 0.00 C ATOM 1182 CG GLU A 88 -5.074 9.060 2.083 1.00 0.00 C ATOM 1183 CD GLU A 88 -4.514 10.026 1.009 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -4.629 11.271 1.140 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -3.939 9.525 0.015 1.00 0.00 O ATOM 0 H GLU A 88 -3.176 10.038 3.922 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.587 10.033 5.430 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -6.704 9.447 3.422 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.608 10.800 3.218 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.278 8.377 2.379 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -5.858 8.456 1.626 1.00 0.00 H new ATOM 1192 N LEU A 89 -4.104 7.191 5.202 1.00 0.00 N ATOM 1193 CA LEU A 89 -3.856 5.898 5.837 1.00 0.00 C ATOM 1194 C LEU A 89 -4.672 4.741 5.248 1.00 0.00 C ATOM 1195 O LEU A 89 -5.902 4.762 5.205 1.00 0.00 O ATOM 1196 CB LEU A 89 -4.043 6.041 7.363 1.00 0.00 C ATOM 1197 CG LEU A 89 -3.654 4.803 8.193 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -2.186 4.390 7.996 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -3.906 5.080 9.682 1.00 0.00 C ATOM 0 H LEU A 89 -3.286 7.493 4.673 1.00 0.00 H new ATOM 0 HA LEU A 89 -2.824 5.619 5.624 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -3.451 6.889 7.707 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -5.088 6.279 7.564 1.00 0.00 H new ATOM 0 HG LEU A 89 -4.275 3.978 7.844 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.970 3.513 8.605 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -2.012 4.154 6.946 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -1.534 5.210 8.297 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -3.630 4.203 10.267 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -3.305 5.932 10.000 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.962 5.302 9.837 1.00 0.00 H new ATOM 1211 N VAL A 90 -3.985 3.650 4.887 1.00 0.00 N ATOM 1212 CA VAL A 90 -4.658 2.424 4.426 1.00 0.00 C ATOM 1213 C VAL A 90 -5.699 1.989 5.450 1.00 0.00 C ATOM 1214 O VAL A 90 -5.499 2.046 6.664 1.00 0.00 O ATOM 1215 CB VAL A 90 -3.751 1.225 4.077 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -2.556 1.641 3.207 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -3.310 0.422 5.304 1.00 0.00 C ATOM 0 H VAL A 90 -2.967 3.589 4.904 1.00 0.00 H new ATOM 0 HA VAL A 90 -5.110 2.711 3.477 1.00 0.00 H new ATOM 0 HB VAL A 90 -4.368 0.550 3.483 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.945 0.766 2.986 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -2.918 2.076 2.275 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -1.956 2.377 3.742 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -2.675 -0.406 4.988 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -2.752 1.069 5.981 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -4.188 0.030 5.817 1.00 0.00 H new ATOM 1227 N GLN A 91 -6.829 1.520 4.950 1.00 0.00 N ATOM 1228 CA GLN A 91 -8.032 1.417 5.741 1.00 0.00 C ATOM 1229 C GLN A 91 -8.026 0.265 6.747 1.00 0.00 C ATOM 1230 O GLN A 91 -8.932 0.214 7.562 1.00 0.00 O ATOM 1231 CB GLN A 91 -9.170 1.296 4.739 1.00 0.00 C ATOM 1232 CG GLN A 91 -9.640 2.661 4.211 1.00 0.00 C ATOM 1233 CD GLN A 91 -10.547 3.413 5.190 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -11.741 3.169 5.276 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -10.022 4.309 6.001 1.00 0.00 N ATOM 0 H GLN A 91 -6.933 1.202 3.986 1.00 0.00 H new ATOM 0 HA GLN A 91 -8.135 2.297 6.376 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -8.847 0.678 3.901 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -10.010 0.783 5.208 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -8.768 3.276 3.989 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -10.174 2.515 3.272 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -9.027 4.527 5.945 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -10.610 4.785 6.685 1.00 0.00 H new ATOM 1244 N VAL A 92 -7.006 -0.597 6.763 1.00 0.00 N ATOM 1245 CA VAL A 92 -6.829 -1.780 7.653 1.00 0.00 C ATOM 1246 C VAL A 92 -6.729 -1.473 9.166 1.00 0.00 C ATOM 1247 O VAL A 92 -6.160 -2.227 9.944 1.00 0.00 O ATOM 1248 CB VAL A 92 -5.650 -2.662 7.162 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -4.282 -2.133 7.631 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -5.842 -4.154 7.484 1.00 0.00 C ATOM 0 H VAL A 92 -6.223 -0.493 6.118 1.00 0.00 H new ATOM 0 HA VAL A 92 -7.761 -2.339 7.568 1.00 0.00 H new ATOM 0 HB VAL A 92 -5.655 -2.586 6.075 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.493 -2.787 7.260 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -4.130 -1.125 7.245 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -4.254 -2.112 8.720 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -4.985 -4.719 7.116 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -5.927 -4.285 8.563 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -6.750 -4.516 7.002 1.00 0.00 H new ATOM 1260 N VAL A 93 -7.278 -0.333 9.586 1.00 0.00 N ATOM 1261 CA VAL A 93 -7.533 0.057 10.977 1.00 0.00 C ATOM 1262 C VAL A 93 -6.233 0.443 11.725 1.00 0.00 C ATOM 1263 O VAL A 93 -6.264 0.675 12.929 1.00 0.00 O ATOM 1264 CB VAL A 93 -8.410 -1.015 11.708 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -9.211 -0.379 12.858 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -9.482 -1.656 10.774 1.00 0.00 C ATOM 0 H VAL A 93 -7.575 0.387 8.927 1.00 0.00 H new ATOM 0 HA VAL A 93 -8.125 0.972 10.975 1.00 0.00 H new ATOM 0 HB VAL A 93 -7.701 -1.766 12.056 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -9.812 -1.144 13.350 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -8.524 0.062 13.580 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -9.866 0.396 12.460 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -10.060 -2.391 11.334 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -10.149 -0.880 10.399 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -8.988 -2.146 9.935 1.00 0.00 H new ATOM 1276 N LEU A 94 -5.109 0.544 10.984 1.00 0.00 N ATOM 1277 CA LEU A 94 -3.716 0.700 11.440 1.00 0.00 C ATOM 1278 C LEU A 94 -3.158 -0.693 11.805 1.00 0.00 C ATOM 1279 O LEU A 94 -3.338 -1.170 12.920 1.00 0.00 O ATOM 1280 CB LEU A 94 -3.591 1.754 12.571 1.00 0.00 C ATOM 1281 CG LEU A 94 -2.213 2.427 12.714 1.00 0.00 C ATOM 1282 CD1 LEU A 94 -2.264 3.457 13.851 1.00 0.00 C ATOM 1283 CD2 LEU A 94 -1.074 1.435 12.981 1.00 0.00 C ATOM 0 H LEU A 94 -5.160 0.516 9.966 1.00 0.00 H new ATOM 0 HA LEU A 94 -3.100 1.102 10.636 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -4.337 2.530 12.402 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.839 1.274 13.518 1.00 0.00 H new ATOM 0 HG LEU A 94 -1.998 2.906 11.759 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.289 3.934 13.954 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.016 4.213 13.624 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -2.523 2.956 14.784 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -0.133 1.977 13.071 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.271 0.895 13.907 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -1.007 0.727 12.155 1.00 0.00 H new ATOM 1295 N ALA A 95 -2.494 -1.344 10.843 1.00 0.00 N ATOM 1296 CA ALA A 95 -1.893 -2.669 11.026 1.00 0.00 C ATOM 1297 C ALA A 95 -0.636 -2.633 11.929 1.00 0.00 C ATOM 1298 O ALA A 95 0.019 -1.595 12.041 1.00 0.00 O ATOM 1299 CB ALA A 95 -1.587 -3.282 9.648 1.00 0.00 C ATOM 0 H ALA A 95 -2.358 -0.962 9.907 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.611 -3.301 11.548 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -1.140 -4.267 9.779 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -2.511 -3.376 9.078 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.893 -2.637 9.109 1.00 0.00 H new ATOM 1305 N VAL A 96 -0.254 -3.785 12.486 1.00 0.00 N ATOM 1306 CA VAL A 96 0.990 -3.970 13.271 1.00 0.00 C ATOM 1307 C VAL A 96 2.250 -3.780 12.405 1.00 0.00 C ATOM 1308 O VAL A 96 2.278 -4.238 11.269 1.00 0.00 O ATOM 1309 CB VAL A 96 1.037 -5.382 13.909 1.00 0.00 C ATOM 1310 CG1 VAL A 96 2.306 -5.621 14.754 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -0.151 -5.657 14.835 1.00 0.00 C ATOM 0 H VAL A 96 -0.806 -4.639 12.408 1.00 0.00 H new ATOM 0 HA VAL A 96 0.980 -3.209 14.052 1.00 0.00 H new ATOM 0 HB VAL A 96 1.018 -6.051 13.049 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.280 -6.627 15.174 1.00 0.00 H new ATOM 0 HG12 VAL A 96 3.189 -5.514 14.123 1.00 0.00 H new ATOM 0 HG13 VAL A 96 2.347 -4.891 15.563 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -0.063 -6.660 15.252 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -0.158 -4.927 15.645 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -1.079 -5.580 14.269 1.00 0.00 H new ATOM 1321 N ASP A 97 3.330 -3.219 12.965 1.00 0.00 N ATOM 1322 CA ASP A 97 4.692 -3.136 12.395 1.00 0.00 C ATOM 1323 C ASP A 97 5.415 -4.504 12.232 1.00 0.00 C ATOM 1324 O ASP A 97 6.558 -4.674 12.664 1.00 0.00 O ATOM 1325 CB ASP A 97 5.525 -2.173 13.264 1.00 0.00 C ATOM 1326 CG ASP A 97 4.954 -0.758 13.316 1.00 0.00 C ATOM 1327 OD1 ASP A 97 5.267 0.038 12.406 1.00 0.00 O ATOM 1328 OD2 ASP A 97 4.216 -0.428 14.272 1.00 0.00 O ATOM 0 H ASP A 97 3.278 -2.782 13.885 1.00 0.00 H new ATOM 0 HA ASP A 97 4.591 -2.761 11.376 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.586 -2.570 14.277 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.543 -2.132 12.876 1.00 0.00 H new ATOM 1333 N THR A 98 4.753 -5.498 11.627 1.00 0.00 N ATOM 1334 CA THR A 98 5.271 -6.853 11.379 1.00 0.00 C ATOM 1335 C THR A 98 5.248 -7.222 9.903 1.00 0.00 C ATOM 1336 O THR A 98 4.568 -6.613 9.075 1.00 0.00 O ATOM 1337 CB THR A 98 4.502 -7.937 12.166 1.00 0.00 C ATOM 1338 OG1 THR A 98 3.132 -7.647 12.226 1.00 0.00 O ATOM 1339 CG2 THR A 98 5.032 -8.058 13.594 1.00 0.00 C ATOM 0 H THR A 98 3.801 -5.377 11.281 1.00 0.00 H new ATOM 0 HA THR A 98 6.303 -6.825 11.728 1.00 0.00 H new ATOM 0 HB THR A 98 4.652 -8.877 11.636 1.00 0.00 H new ATOM 0 HG1 THR A 98 2.670 -8.351 12.728 1.00 0.00 H new ATOM 0 HG21 THR A 98 4.473 -8.828 14.126 1.00 0.00 H new ATOM 0 HG22 THR A 98 6.088 -8.328 13.569 1.00 0.00 H new ATOM 0 HG23 THR A 98 4.914 -7.104 14.108 1.00 0.00 H new ATOM 1347 N ASP A 99 5.984 -8.295 9.626 1.00 0.00 N ATOM 1348 CA ASP A 99 5.900 -9.094 8.411 1.00 0.00 C ATOM 1349 C ASP A 99 5.495 -10.507 8.850 1.00 0.00 C ATOM 1350 O ASP A 99 5.991 -11.012 9.856 1.00 0.00 O ATOM 1351 CB ASP A 99 7.226 -9.129 7.632 1.00 0.00 C ATOM 1352 CG ASP A 99 7.094 -10.007 6.375 1.00 0.00 C ATOM 1353 OD1 ASP A 99 5.976 -10.024 5.806 1.00 0.00 O ATOM 1354 OD2 ASP A 99 8.085 -10.678 6.012 1.00 0.00 O ATOM 0 H ASP A 99 6.688 -8.646 10.275 1.00 0.00 H new ATOM 0 HA ASP A 99 5.172 -8.655 7.729 1.00 0.00 H new ATOM 0 HB2 ASP A 99 7.513 -8.117 7.347 1.00 0.00 H new ATOM 0 HB3 ASP A 99 8.019 -9.517 8.271 1.00 0.00 H new ATOM 1359 N GLN A 100 4.593 -11.128 8.099 1.00 0.00 N ATOM 1360 CA GLN A 100 4.018 -12.453 8.311 1.00 0.00 C ATOM 1361 C GLN A 100 3.540 -12.976 6.939 1.00 0.00 C ATOM 1362 O GLN A 100 3.172 -12.169 6.082 1.00 0.00 O ATOM 1363 CB GLN A 100 2.869 -12.377 9.345 1.00 0.00 C ATOM 1364 CG GLN A 100 3.286 -12.102 10.805 1.00 0.00 C ATOM 1365 CD GLN A 100 4.388 -13.037 11.322 1.00 0.00 C ATOM 1366 OE1 GLN A 100 4.506 -14.188 10.924 1.00 0.00 O ATOM 1367 NE2 GLN A 100 5.254 -12.566 12.186 1.00 0.00 N ATOM 0 H GLN A 100 4.215 -10.685 7.262 1.00 0.00 H new ATOM 0 HA GLN A 100 4.754 -13.145 8.720 1.00 0.00 H new ATOM 0 HB2 GLN A 100 2.178 -11.594 9.033 1.00 0.00 H new ATOM 0 HB3 GLN A 100 2.319 -13.318 9.317 1.00 0.00 H new ATOM 0 HG2 GLN A 100 3.630 -11.071 10.887 1.00 0.00 H new ATOM 0 HG3 GLN A 100 2.410 -12.198 11.447 1.00 0.00 H new ATOM 0 HE21 GLN A 100 5.166 -11.608 12.525 1.00 0.00 H new ATOM 0 HE22 GLN A 100 6.015 -13.157 12.519 1.00 0.00 H new ATOM 1376 N PRO A 101 3.521 -14.297 6.684 1.00 0.00 N ATOM 1377 CA PRO A 101 3.343 -14.835 5.333 1.00 0.00 C ATOM 1378 C PRO A 101 1.974 -14.585 4.683 1.00 0.00 C ATOM 1379 O PRO A 101 0.925 -14.532 5.322 1.00 0.00 O ATOM 1380 CB PRO A 101 3.677 -16.327 5.428 1.00 0.00 C ATOM 1381 CG PRO A 101 3.383 -16.646 6.888 1.00 0.00 C ATOM 1382 CD PRO A 101 3.811 -15.375 7.616 1.00 0.00 C ATOM 0 HA PRO A 101 4.009 -14.299 4.656 1.00 0.00 H new ATOM 0 HB2 PRO A 101 3.063 -16.923 4.752 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.718 -16.526 5.172 1.00 0.00 H new ATOM 0 HG2 PRO A 101 2.327 -16.865 7.047 1.00 0.00 H new ATOM 0 HG3 PRO A 101 3.944 -17.515 7.231 1.00 0.00 H new ATOM 0 HD2 PRO A 101 3.262 -15.250 8.549 1.00 0.00 H new ATOM 0 HD3 PRO A 101 4.870 -15.403 7.871 1.00 0.00 H new ATOM 1390 N CYS A 102 2.021 -14.476 3.354 1.00 0.00 N ATOM 1391 CA CYS A 102 0.900 -14.340 2.443 1.00 0.00 C ATOM 1392 C CYS A 102 0.779 -15.647 1.613 1.00 0.00 C ATOM 1393 O CYS A 102 1.609 -15.905 0.742 1.00 0.00 O ATOM 1394 CB CYS A 102 1.207 -13.065 1.640 1.00 0.00 C ATOM 1395 SG CYS A 102 -0.139 -12.468 0.579 1.00 0.00 S ATOM 0 H CYS A 102 2.912 -14.482 2.857 1.00 0.00 H new ATOM 0 HA CYS A 102 -0.077 -14.224 2.912 1.00 0.00 H new ATOM 0 HB2 CYS A 102 1.475 -12.272 2.338 1.00 0.00 H new ATOM 0 HB3 CYS A 102 2.082 -13.250 1.017 1.00 0.00 H new ATOM 0 HG CYS A 102 -0.684 -13.474 -0.038 1.00 0.00 H new ATOM 1476 N LEU B 11 1.758 -5.020 8.642 1.00 0.00 N ATOM 1477 CA LEU B 11 1.879 -3.950 7.639 1.00 0.00 C ATOM 1478 C LEU B 11 2.482 -4.405 6.306 1.00 0.00 C ATOM 1479 O LEU B 11 1.899 -4.104 5.261 1.00 0.00 O ATOM 1480 CB LEU B 11 2.683 -2.771 8.236 1.00 0.00 C ATOM 1481 CG LEU B 11 1.800 -1.747 8.976 1.00 0.00 C ATOM 1482 CD1 LEU B 11 2.645 -0.810 9.847 1.00 0.00 C ATOM 1483 CD2 LEU B 11 0.991 -0.890 7.987 1.00 0.00 C ATOM 0 HA LEU B 11 0.865 -3.630 7.398 1.00 0.00 H new ATOM 0 HB2 LEU B 11 3.431 -3.162 8.926 1.00 0.00 H new ATOM 0 HB3 LEU B 11 3.222 -2.265 7.435 1.00 0.00 H new ATOM 0 HG LEU B 11 1.120 -2.320 9.607 1.00 0.00 H new ATOM 0 HD11 LEU B 11 1.993 -0.100 10.356 1.00 0.00 H new ATOM 0 HD12 LEU B 11 3.192 -1.395 10.587 1.00 0.00 H new ATOM 0 HD13 LEU B 11 3.352 -0.268 9.219 1.00 0.00 H new ATOM 0 HD21 LEU B 11 0.378 -0.178 8.539 1.00 0.00 H new ATOM 0 HD22 LEU B 11 1.673 -0.350 7.331 1.00 0.00 H new ATOM 0 HD23 LEU B 11 0.347 -1.535 7.389 1.00 0.00 H new ATOM 1495 N ALA B 12 3.595 -5.147 6.332 1.00 0.00 N ATOM 1496 CA ALA B 12 4.252 -5.681 5.135 1.00 0.00 C ATOM 1497 C ALA B 12 3.359 -6.690 4.392 1.00 0.00 C ATOM 1498 O ALA B 12 3.141 -6.557 3.185 1.00 0.00 O ATOM 1499 CB ALA B 12 5.594 -6.288 5.559 1.00 0.00 C ATOM 0 H ALA B 12 4.071 -5.397 7.199 1.00 0.00 H new ATOM 0 HA ALA B 12 4.431 -4.877 4.421 1.00 0.00 H new ATOM 0 HB1 ALA B 12 6.103 -6.693 4.684 1.00 0.00 H new ATOM 0 HB2 ALA B 12 6.214 -5.516 6.015 1.00 0.00 H new ATOM 0 HB3 ALA B 12 5.420 -7.087 6.280 1.00 0.00 H new ATOM 1505 N ARG B 13 2.776 -7.657 5.116 1.00 0.00 N ATOM 1506 CA ARG B 13 1.843 -8.668 4.583 1.00 0.00 C ATOM 1507 C ARG B 13 0.711 -8.005 3.783 1.00 0.00 C ATOM 1508 O ARG B 13 0.459 -8.382 2.636 1.00 0.00 O ATOM 1509 CB ARG B 13 1.284 -9.497 5.758 1.00 0.00 C ATOM 1510 CG ARG B 13 0.300 -10.612 5.376 1.00 0.00 C ATOM 1511 CD ARG B 13 -0.205 -11.358 6.631 1.00 0.00 C ATOM 1512 NE ARG B 13 -1.667 -11.597 6.596 1.00 0.00 N ATOM 1513 CZ ARG B 13 -2.307 -12.395 5.751 1.00 0.00 C ATOM 1514 NH1 ARG B 13 -1.655 -13.201 4.946 1.00 0.00 N ATOM 1515 NH2 ARG B 13 -3.624 -12.400 5.684 1.00 0.00 N ATOM 0 H ARG B 13 2.943 -7.763 6.117 1.00 0.00 H new ATOM 0 HA ARG B 13 2.374 -9.328 3.897 1.00 0.00 H new ATOM 0 HB2 ARG B 13 2.121 -9.944 6.294 1.00 0.00 H new ATOM 0 HB3 ARG B 13 0.786 -8.820 6.452 1.00 0.00 H new ATOM 0 HG2 ARG B 13 -0.546 -10.186 4.836 1.00 0.00 H new ATOM 0 HG3 ARG B 13 0.787 -11.316 4.701 1.00 0.00 H new ATOM 0 HD2 ARG B 13 0.314 -12.312 6.717 1.00 0.00 H new ATOM 0 HD3 ARG B 13 0.045 -10.778 7.520 1.00 0.00 H new ATOM 0 HE ARG B 13 -2.234 -11.102 7.285 1.00 0.00 H new ATOM 0 HH11 ARG B 13 -0.635 -13.223 4.962 1.00 0.00 H new ATOM 0 HH12 ARG B 13 -2.168 -13.806 4.305 1.00 0.00 H new ATOM 0 HH21 ARG B 13 -4.168 -11.784 6.288 1.00 0.00 H new ATOM 0 HH22 ARG B 13 -4.099 -13.020 5.028 1.00 0.00 H new ATOM 1529 N LEU B 14 0.061 -6.992 4.368 1.00 0.00 N ATOM 1530 CA LEU B 14 -1.098 -6.308 3.789 1.00 0.00 C ATOM 1531 C LEU B 14 -0.736 -5.554 2.507 1.00 0.00 C ATOM 1532 O LEU B 14 -1.363 -5.791 1.475 1.00 0.00 O ATOM 1533 CB LEU B 14 -1.701 -5.408 4.885 1.00 0.00 C ATOM 1534 CG LEU B 14 -3.025 -4.674 4.585 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -2.859 -3.426 3.704 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -4.104 -5.600 4.006 1.00 0.00 C ATOM 0 H LEU B 14 0.333 -6.618 5.277 1.00 0.00 H new ATOM 0 HA LEU B 14 -1.851 -7.029 3.471 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -1.856 -6.023 5.772 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -0.956 -4.656 5.144 1.00 0.00 H new ATOM 0 HG LEU B 14 -3.365 -4.330 5.562 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -3.833 -2.966 3.538 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -2.201 -2.714 4.202 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -2.425 -3.712 2.746 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -5.011 -5.027 3.816 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -3.747 -6.035 3.072 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -4.320 -6.396 4.718 1.00 0.00 H new ATOM 1548 N GLY B 15 0.289 -4.693 2.528 1.00 0.00 N ATOM 1549 CA GLY B 15 0.650 -3.919 1.334 1.00 0.00 C ATOM 1550 C GLY B 15 1.207 -4.790 0.210 1.00 0.00 C ATOM 1551 O GLY B 15 0.969 -4.487 -0.951 1.00 0.00 O ATOM 0 H GLY B 15 0.875 -4.516 3.344 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -0.229 -3.386 0.973 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.390 -3.166 1.605 1.00 0.00 H new ATOM 1555 N ARG B 16 1.862 -5.908 0.535 1.00 0.00 N ATOM 1556 CA ARG B 16 2.344 -6.902 -0.435 1.00 0.00 C ATOM 1557 C ARG B 16 1.172 -7.670 -1.053 1.00 0.00 C ATOM 1558 O ARG B 16 1.178 -7.960 -2.247 1.00 0.00 O ATOM 1559 CB ARG B 16 3.339 -7.825 0.292 1.00 0.00 C ATOM 1560 CG ARG B 16 4.139 -8.806 -0.581 1.00 0.00 C ATOM 1561 CD ARG B 16 3.402 -10.102 -0.962 1.00 0.00 C ATOM 1562 NE ARG B 16 4.363 -11.145 -1.380 1.00 0.00 N ATOM 1563 CZ ARG B 16 5.040 -11.962 -0.575 1.00 0.00 C ATOM 1564 NH1 ARG B 16 4.768 -12.048 0.714 1.00 0.00 N ATOM 1565 NH2 ARG B 16 6.012 -12.705 -1.062 1.00 0.00 N ATOM 0 H ARG B 16 2.078 -6.155 1.501 1.00 0.00 H new ATOM 0 HA ARG B 16 2.854 -6.417 -1.267 1.00 0.00 H new ATOM 0 HB2 ARG B 16 4.047 -7.200 0.837 1.00 0.00 H new ATOM 0 HB3 ARG B 16 2.787 -8.402 1.034 1.00 0.00 H new ATOM 0 HG2 ARG B 16 4.434 -8.293 -1.496 1.00 0.00 H new ATOM 0 HG3 ARG B 16 5.056 -9.071 -0.054 1.00 0.00 H new ATOM 0 HD2 ARG B 16 2.818 -10.457 -0.113 1.00 0.00 H new ATOM 0 HD3 ARG B 16 2.699 -9.902 -1.771 1.00 0.00 H new ATOM 0 HE ARG B 16 4.523 -11.249 -2.382 1.00 0.00 H new ATOM 0 HH11 ARG B 16 4.023 -11.480 1.117 1.00 0.00 H new ATOM 0 HH12 ARG B 16 5.303 -12.683 1.307 1.00 0.00 H new ATOM 0 HH21 ARG B 16 6.245 -12.654 -2.054 1.00 0.00 H new ATOM 0 HH22 ARG B 16 6.532 -13.331 -0.447 1.00 0.00 H new ATOM 1579 N ALA B 17 0.142 -7.976 -0.265 1.00 0.00 N ATOM 1580 CA ALA B 17 -1.053 -8.646 -0.768 1.00 0.00 C ATOM 1581 C ALA B 17 -1.816 -7.802 -1.812 1.00 0.00 C ATOM 1582 O ALA B 17 -2.405 -8.393 -2.721 1.00 0.00 O ATOM 1583 CB ALA B 17 -1.932 -9.052 0.414 1.00 0.00 C ATOM 0 H ALA B 17 0.113 -7.768 0.733 1.00 0.00 H new ATOM 0 HA ALA B 17 -0.749 -9.544 -1.305 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -2.827 -9.553 0.046 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -1.378 -9.729 1.064 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -2.219 -8.163 0.976 1.00 0.00 H new ATOM 1589 N LEU B 18 -1.749 -6.461 -1.734 1.00 0.00 N ATOM 1590 CA LEU B 18 -2.357 -5.555 -2.726 1.00 0.00 C ATOM 1591 C LEU B 18 -1.395 -5.132 -3.851 1.00 0.00 C ATOM 1592 O LEU B 18 -1.838 -4.987 -4.989 1.00 0.00 O ATOM 1593 CB LEU B 18 -2.954 -4.316 -2.019 1.00 0.00 C ATOM 1594 CG LEU B 18 -4.355 -4.568 -1.411 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -4.273 -5.078 0.034 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -5.249 -3.312 -1.463 1.00 0.00 C ATOM 0 H LEU B 18 -1.269 -5.973 -0.978 1.00 0.00 H new ATOM 0 HA LEU B 18 -3.152 -6.119 -3.214 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -2.275 -3.997 -1.228 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -3.019 -3.496 -2.734 1.00 0.00 H new ATOM 0 HG LEU B 18 -4.810 -5.342 -2.029 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -5.279 -5.241 0.420 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -3.719 -6.016 0.058 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.763 -4.339 0.652 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -6.221 -3.539 -1.025 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.777 -2.506 -0.901 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -5.382 -3.002 -2.500 1.00 0.00 H new ATOM 1608 N ALA B 19 -0.105 -4.960 -3.562 1.00 0.00 N ATOM 1609 CA ALA B 19 0.911 -4.534 -4.518 1.00 0.00 C ATOM 1610 C ALA B 19 1.561 -5.753 -5.197 1.00 0.00 C ATOM 1611 O ALA B 19 2.513 -6.341 -4.691 1.00 0.00 O ATOM 1612 CB ALA B 19 1.894 -3.636 -3.762 1.00 0.00 C ATOM 0 H ALA B 19 0.271 -5.119 -2.627 1.00 0.00 H new ATOM 0 HA ALA B 19 0.485 -3.957 -5.339 1.00 0.00 H new ATOM 0 HB1 ALA B 19 2.673 -3.295 -4.444 1.00 0.00 H new ATOM 0 HB2 ALA B 19 1.363 -2.775 -3.357 1.00 0.00 H new ATOM 0 HB3 ALA B 19 2.347 -4.199 -2.946 1.00 0.00 H new ATOM 1618 N ASP B 20 0.989 -6.134 -6.338 1.00 0.00 N ATOM 1619 CA ASP B 20 1.241 -7.368 -7.097 1.00 0.00 C ATOM 1620 C ASP B 20 0.549 -7.216 -8.464 1.00 0.00 C ATOM 1621 O ASP B 20 -0.562 -6.671 -8.468 1.00 0.00 O ATOM 1622 CB ASP B 20 0.676 -8.524 -6.257 1.00 0.00 C ATOM 1623 CG ASP B 20 0.656 -9.915 -6.896 1.00 0.00 C ATOM 1624 OD1 ASP B 20 -0.169 -10.137 -7.810 1.00 0.00 O ATOM 1625 OD2 ASP B 20 1.385 -10.803 -6.395 1.00 0.00 O ATOM 0 H ASP B 20 0.287 -5.550 -6.793 1.00 0.00 H new ATOM 0 HA ASP B 20 2.296 -7.566 -7.284 1.00 0.00 H new ATOM 0 HB2 ASP B 20 1.255 -8.585 -5.335 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -0.345 -8.268 -5.975 1.00 0.00 H new ATOM 1630 N PRO B 21 1.144 -7.681 -9.588 1.00 0.00 N ATOM 1631 CA PRO B 21 0.723 -7.378 -10.965 1.00 0.00 C ATOM 1632 C PRO B 21 -0.792 -7.498 -11.176 1.00 0.00 C ATOM 1633 O PRO B 21 -1.538 -6.513 -11.157 1.00 0.00 O ATOM 1634 CB PRO B 21 1.518 -8.371 -11.845 1.00 0.00 C ATOM 1635 CG PRO B 21 1.763 -9.538 -10.885 1.00 0.00 C ATOM 1636 CD PRO B 21 2.162 -8.729 -9.650 1.00 0.00 C ATOM 0 HA PRO B 21 0.933 -6.340 -11.222 1.00 0.00 H new ATOM 0 HB2 PRO B 21 0.951 -8.680 -12.723 1.00 0.00 H new ATOM 0 HB3 PRO B 21 2.451 -7.938 -12.204 1.00 0.00 H new ATOM 0 HG2 PRO B 21 0.874 -10.148 -10.723 1.00 0.00 H new ATOM 0 HG3 PRO B 21 2.552 -10.209 -11.226 1.00 0.00 H new ATOM 0 HD2 PRO B 21 2.161 -9.343 -8.750 1.00 0.00 H new ATOM 0 HD3 PRO B 21 3.164 -8.311 -9.750 1.00 0.00 H new ATOM 1644 N THR B 22 -1.243 -8.732 -11.388 1.00 0.00 N ATOM 1645 CA THR B 22 -2.610 -9.064 -11.737 1.00 0.00 C ATOM 1646 C THR B 22 -3.479 -9.196 -10.493 1.00 0.00 C ATOM 1647 O THR B 22 -4.683 -8.987 -10.609 1.00 0.00 O ATOM 1648 CB THR B 22 -2.580 -10.331 -12.588 1.00 0.00 C ATOM 1649 OG1 THR B 22 -1.679 -10.126 -13.656 1.00 0.00 O ATOM 1650 CG2 THR B 22 -3.941 -10.716 -13.157 1.00 0.00 C ATOM 0 H THR B 22 -0.641 -9.552 -11.318 1.00 0.00 H new ATOM 0 HA THR B 22 -3.067 -8.264 -12.319 1.00 0.00 H new ATOM 0 HB THR B 22 -2.269 -11.150 -11.940 1.00 0.00 H new ATOM 0 HG1 THR B 22 -1.645 -10.931 -14.214 1.00 0.00 H new ATOM 0 HG21 THR B 22 -3.843 -11.625 -13.750 1.00 0.00 H new ATOM 0 HG22 THR B 22 -4.641 -10.890 -12.340 1.00 0.00 H new ATOM 0 HG23 THR B 22 -4.313 -9.909 -13.788 1.00 0.00 H new ATOM 1658 N ARG B 23 -2.930 -9.457 -9.296 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.747 -9.511 -8.073 1.00 0.00 C ATOM 1660 C ARG B 23 -4.298 -8.135 -7.681 1.00 0.00 C ATOM 1661 O ARG B 23 -5.469 -8.047 -7.308 1.00 0.00 O ATOM 1662 CB ARG B 23 -2.982 -10.162 -6.920 1.00 0.00 C ATOM 1663 CG ARG B 23 -3.936 -10.765 -5.890 1.00 0.00 C ATOM 1664 CD ARG B 23 -3.194 -11.699 -4.910 1.00 0.00 C ATOM 1665 NE ARG B 23 -2.222 -10.952 -4.088 1.00 0.00 N ATOM 1666 CZ ARG B 23 -0.904 -11.066 -4.161 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -0.283 -12.119 -4.643 1.00 0.00 N ATOM 1668 NH2 ARG B 23 -0.162 -10.060 -3.788 1.00 0.00 N ATOM 0 H ARG B 23 -1.936 -9.632 -9.149 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.609 -10.141 -8.294 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -2.326 -10.940 -7.310 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -2.345 -9.420 -6.438 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -4.424 -9.965 -5.333 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -4.721 -11.322 -6.402 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -3.915 -12.196 -4.262 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -2.677 -12.479 -5.469 1.00 0.00 H new ATOM 0 HE ARG B 23 -2.597 -10.292 -3.406 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -0.820 -12.914 -4.990 1.00 0.00 H new ATOM 0 HH12 ARG B 23 0.736 -12.142 -4.670 1.00 0.00 H new ATOM 0 HH21 ARG B 23 -0.598 -9.203 -3.447 1.00 0.00 H new ATOM 0 HH22 ARG B 23 0.854 -10.130 -3.837 1.00 0.00 H new ATOM 1682 N CYS B 24 -3.521 -7.057 -7.865 1.00 0.00 N ATOM 1683 CA CYS B 24 -4.054 -5.694 -7.770 1.00 0.00 C ATOM 1684 C CYS B 24 -5.203 -5.534 -8.778 1.00 0.00 C ATOM 1685 O CYS B 24 -6.304 -5.108 -8.427 1.00 0.00 O ATOM 1686 CB CYS B 24 -2.920 -4.697 -8.046 1.00 0.00 C ATOM 1687 SG CYS B 24 -3.524 -3.018 -7.714 1.00 0.00 S ATOM 0 H CYS B 24 -2.525 -7.105 -8.080 1.00 0.00 H new ATOM 0 HA CYS B 24 -4.447 -5.499 -6.772 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -2.059 -4.920 -7.415 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -2.587 -4.781 -9.081 1.00 0.00 H new ATOM 0 HG CYS B 24 -2.573 -2.162 -7.942 1.00 0.00 H new ATOM 1693 N ARG B 25 -4.980 -5.982 -10.021 1.00 0.00 N ATOM 1694 CA ARG B 25 -5.983 -5.921 -11.084 1.00 0.00 C ATOM 1695 C ARG B 25 -7.262 -6.728 -10.770 1.00 0.00 C ATOM 1696 O ARG B 25 -8.342 -6.193 -10.979 1.00 0.00 O ATOM 1697 CB ARG B 25 -5.351 -6.286 -12.441 1.00 0.00 C ATOM 1698 CG ARG B 25 -5.634 -5.216 -13.511 1.00 0.00 C ATOM 1699 CD ARG B 25 -4.829 -3.920 -13.297 1.00 0.00 C ATOM 1700 NE ARG B 25 -5.696 -2.725 -13.338 1.00 0.00 N ATOM 1701 CZ ARG B 25 -5.291 -1.456 -13.310 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -4.014 -1.127 -13.394 1.00 0.00 N ATOM 1703 NH2 ARG B 25 -6.185 -0.493 -13.183 1.00 0.00 N ATOM 0 H ARG B 25 -4.096 -6.397 -10.315 1.00 0.00 H new ATOM 0 HA ARG B 25 -6.328 -4.889 -11.148 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -4.274 -6.403 -12.320 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -5.741 -7.247 -12.776 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -5.400 -5.624 -14.495 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -6.698 -4.980 -13.508 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -4.316 -3.965 -12.336 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -4.060 -3.838 -14.065 1.00 0.00 H new ATOM 0 HE ARG B 25 -6.702 -2.887 -13.393 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -3.305 -1.855 -13.483 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -3.738 -0.145 -13.370 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -7.176 -0.724 -13.107 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -5.885 0.482 -13.160 1.00 0.00 H new ATOM 1717 N ILE B 26 -7.190 -7.932 -10.191 1.00 0.00 N ATOM 1718 CA ILE B 26 -8.361 -8.685 -9.686 1.00 0.00 C ATOM 1719 C ILE B 26 -9.126 -7.865 -8.649 1.00 0.00 C ATOM 1720 O ILE B 26 -10.343 -7.765 -8.742 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.940 -10.047 -9.088 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -7.372 -10.995 -10.163 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -9.084 -10.741 -8.328 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -8.388 -11.807 -10.973 1.00 0.00 C ATOM 0 H ILE B 26 -6.307 -8.424 -10.055 1.00 0.00 H new ATOM 0 HA ILE B 26 -9.019 -8.877 -10.534 1.00 0.00 H new ATOM 0 HB ILE B 26 -7.152 -9.822 -8.369 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -6.778 -10.403 -10.859 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -6.691 -11.692 -9.676 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -8.732 -11.693 -7.930 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -9.415 -10.104 -7.507 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.917 -10.919 -9.008 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -7.862 -12.433 -11.694 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -8.969 -12.438 -10.300 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -9.057 -11.128 -11.502 1.00 0.00 H new ATOM 1736 N LEU B 27 -8.428 -7.241 -7.696 1.00 0.00 N ATOM 1737 CA LEU B 27 -9.076 -6.358 -6.715 1.00 0.00 C ATOM 1738 C LEU B 27 -9.771 -5.172 -7.402 1.00 0.00 C ATOM 1739 O LEU B 27 -10.957 -4.975 -7.152 1.00 0.00 O ATOM 1740 CB LEU B 27 -8.091 -5.909 -5.610 1.00 0.00 C ATOM 1741 CG LEU B 27 -7.655 -7.017 -4.631 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -6.582 -6.508 -3.660 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -8.816 -7.536 -3.770 1.00 0.00 C ATOM 0 H LEU B 27 -7.418 -7.329 -7.581 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.856 -6.934 -6.216 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -7.201 -5.495 -6.085 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -8.553 -5.103 -5.040 1.00 0.00 H new ATOM 0 HG LEU B 27 -7.272 -7.820 -5.261 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -6.294 -7.311 -2.982 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -5.709 -6.178 -4.223 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -6.979 -5.672 -3.084 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -8.452 -8.314 -3.099 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -9.229 -6.715 -3.183 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -9.592 -7.947 -4.415 1.00 0.00 H new ATOM 1755 N VAL B 28 -9.095 -4.442 -8.304 1.00 0.00 N ATOM 1756 CA VAL B 28 -9.703 -3.251 -8.968 1.00 0.00 C ATOM 1757 C VAL B 28 -10.884 -3.636 -9.865 1.00 0.00 C ATOM 1758 O VAL B 28 -11.810 -2.858 -10.058 1.00 0.00 O ATOM 1759 CB VAL B 28 -8.757 -2.322 -9.788 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -7.364 -2.086 -9.187 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -8.541 -2.707 -11.267 1.00 0.00 C ATOM 0 H VAL B 28 -8.138 -4.643 -8.595 1.00 0.00 H new ATOM 0 HA VAL B 28 -10.018 -2.664 -8.105 1.00 0.00 H new ATOM 0 HB VAL B 28 -9.342 -1.404 -9.734 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -6.793 -1.426 -9.840 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.465 -1.625 -8.204 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -6.844 -3.039 -9.089 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -7.866 -1.990 -11.735 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -8.106 -3.705 -11.323 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -9.498 -2.698 -11.789 1.00 0.00 H new ATOM 1771 N ALA B 29 -10.826 -4.839 -10.440 1.00 0.00 N ATOM 1772 CA ALA B 29 -11.860 -5.389 -11.298 1.00 0.00 C ATOM 1773 C ALA B 29 -13.049 -5.921 -10.482 1.00 0.00 C ATOM 1774 O ALA B 29 -14.176 -5.881 -10.969 1.00 0.00 O ATOM 1775 CB ALA B 29 -11.172 -6.442 -12.171 1.00 0.00 C ATOM 0 H ALA B 29 -10.034 -5.469 -10.314 1.00 0.00 H new ATOM 0 HA ALA B 29 -12.310 -4.630 -11.938 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -11.904 -6.893 -12.841 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -10.385 -5.970 -12.758 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -10.737 -7.214 -11.536 1.00 0.00 H new ATOM 1781 N LEU B 30 -12.850 -6.337 -9.225 1.00 0.00 N ATOM 1782 CA LEU B 30 -13.973 -6.619 -8.345 1.00 0.00 C ATOM 1783 C LEU B 30 -14.774 -5.372 -7.996 1.00 0.00 C ATOM 1784 O LEU B 30 -15.999 -5.474 -7.953 1.00 0.00 O ATOM 1785 CB LEU B 30 -13.453 -7.256 -7.069 1.00 0.00 C ATOM 1786 CG LEU B 30 -14.221 -8.546 -6.782 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -14.002 -9.669 -7.803 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -13.643 -8.977 -5.461 1.00 0.00 C ATOM 0 H LEU B 30 -11.932 -6.482 -8.806 1.00 0.00 H new ATOM 0 HA LEU B 30 -14.644 -7.295 -8.875 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -12.389 -7.470 -7.166 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -13.564 -6.563 -6.235 1.00 0.00 H new ATOM 0 HG LEU B 30 -15.295 -8.364 -6.807 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -14.587 -10.542 -7.515 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -14.318 -9.330 -8.790 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -12.945 -9.934 -7.831 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -14.118 -9.905 -5.141 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -12.570 -9.137 -5.568 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -13.822 -8.202 -4.715 1.00 0.00 H new ATOM 1800 N LEU B 31 -14.077 -4.256 -7.745 1.00 0.00 N ATOM 1801 CA LEU B 31 -14.605 -2.946 -7.377 1.00 0.00 C ATOM 1802 C LEU B 31 -15.789 -2.520 -8.277 1.00 0.00 C ATOM 1803 O LEU B 31 -16.878 -2.263 -7.772 1.00 0.00 O ATOM 1804 CB LEU B 31 -13.406 -1.988 -7.515 1.00 0.00 C ATOM 1805 CG LEU B 31 -13.239 -0.901 -6.453 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -12.078 -0.046 -6.951 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -14.491 -0.055 -6.191 1.00 0.00 C ATOM 0 H LEU B 31 -13.058 -4.250 -7.799 1.00 0.00 H new ATOM 0 HA LEU B 31 -15.015 -2.945 -6.367 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -12.496 -2.589 -7.526 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -13.477 -1.499 -8.487 1.00 0.00 H new ATOM 0 HG LEU B 31 -13.051 -1.359 -5.482 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -11.891 0.762 -6.243 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -11.184 -0.663 -7.041 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -12.328 0.375 -7.925 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -14.274 0.688 -5.423 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -14.788 0.449 -7.110 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -15.302 -0.700 -5.853 1.00 0.00 H new ATOM 1819 N ASP B 32 -15.570 -2.550 -9.598 1.00 0.00 N ATOM 1820 CA ASP B 32 -16.523 -2.240 -10.683 1.00 0.00 C ATOM 1821 C ASP B 32 -17.062 -3.539 -11.352 1.00 0.00 C ATOM 1822 O ASP B 32 -17.422 -3.591 -12.531 1.00 0.00 O ATOM 1823 CB ASP B 32 -15.832 -1.290 -11.688 1.00 0.00 C ATOM 1824 CG ASP B 32 -15.656 0.153 -11.170 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -14.755 0.378 -10.327 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -16.404 1.031 -11.664 1.00 0.00 O ATOM 0 H ASP B 32 -14.656 -2.810 -9.968 1.00 0.00 H new ATOM 0 HA ASP B 32 -17.400 -1.735 -10.277 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -14.853 -1.696 -11.941 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -16.415 -1.266 -12.609 1.00 0.00 H new ATOM 1831 N GLY B 33 -17.054 -4.636 -10.590 1.00 0.00 N ATOM 1832 CA GLY B 33 -17.444 -5.994 -10.977 1.00 0.00 C ATOM 1833 C GLY B 33 -18.487 -6.564 -10.041 1.00 0.00 C ATOM 1834 O GLY B 33 -19.679 -6.473 -10.313 1.00 0.00 O ATOM 0 H GLY B 33 -16.753 -4.595 -9.616 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -17.834 -5.985 -11.995 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -16.565 -6.639 -10.979 1.00 0.00 H new ATOM 1838 N VAL B 34 -18.016 -7.256 -9.002 1.00 0.00 N ATOM 1839 CA VAL B 34 -18.798 -8.155 -8.120 1.00 0.00 C ATOM 1840 C VAL B 34 -19.838 -8.998 -8.853 1.00 0.00 C ATOM 1841 O VAL B 34 -20.874 -9.368 -8.305 1.00 0.00 O ATOM 1842 CB VAL B 34 -19.377 -7.477 -6.869 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -18.214 -7.073 -5.974 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -20.287 -6.279 -7.169 1.00 0.00 C ATOM 0 H VAL B 34 -17.034 -7.210 -8.731 1.00 0.00 H new ATOM 0 HA VAL B 34 -18.048 -8.855 -7.751 1.00 0.00 H new ATOM 0 HB VAL B 34 -20.027 -8.195 -6.368 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -18.597 -6.588 -5.076 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -17.646 -7.960 -5.693 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.565 -6.381 -6.511 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -20.654 -5.858 -6.233 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -19.723 -5.521 -7.712 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -21.132 -6.606 -7.775 1.00 0.00 H new ATOM 1854 N CYS B 35 -19.530 -9.316 -10.107 1.00 0.00 N ATOM 1855 CA CYS B 35 -20.268 -10.285 -10.871 1.00 0.00 C ATOM 1856 C CYS B 35 -19.744 -11.678 -10.486 1.00 0.00 C ATOM 1857 O CYS B 35 -19.153 -11.923 -9.431 1.00 0.00 O ATOM 1858 CB CYS B 35 -20.191 -9.906 -12.365 1.00 0.00 C ATOM 1859 SG CYS B 35 -21.006 -8.313 -12.661 1.00 0.00 S ATOM 0 H CYS B 35 -18.751 -8.897 -10.616 1.00 0.00 H new ATOM 0 HA CYS B 35 -21.335 -10.301 -10.651 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -19.149 -9.851 -12.679 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -20.665 -10.681 -12.967 1.00 0.00 H new ATOM 0 HG CYS B 35 -20.585 -7.442 -11.792 1.00 0.00 H new ATOM 1865 N TYR B 36 -19.832 -12.582 -11.432 1.00 0.00 N ATOM 1866 CA TYR B 36 -19.673 -14.012 -11.216 1.00 0.00 C ATOM 1867 C TYR B 36 -18.219 -14.443 -10.944 1.00 0.00 C ATOM 1868 O TYR B 36 -17.290 -13.728 -11.326 1.00 0.00 O ATOM 1869 CB TYR B 36 -20.350 -14.787 -12.378 1.00 0.00 C ATOM 1870 CG TYR B 36 -20.647 -13.987 -13.642 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -21.765 -13.131 -13.681 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -19.758 -14.026 -14.735 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -21.953 -12.250 -14.763 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -19.958 -13.170 -15.835 1.00 0.00 C ATOM 1875 CZ TYR B 36 -21.038 -12.257 -15.838 1.00 0.00 C ATOM 1876 OH TYR B 36 -21.166 -11.370 -16.862 1.00 0.00 O ATOM 0 H TYR B 36 -20.022 -12.342 -12.405 1.00 0.00 H new ATOM 0 HA TYR B 36 -20.185 -14.274 -10.290 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -19.710 -15.627 -12.647 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -21.287 -15.205 -12.010 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -22.483 -13.151 -12.875 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -18.924 -14.712 -14.729 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -22.794 -11.572 -14.771 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -19.285 -13.211 -16.679 1.00 0.00 H new ATOM 0 HH TYR B 36 -20.449 -11.517 -17.514 1.00 0.00 H new ATOM 1886 N PRO B 37 -17.982 -15.646 -10.380 1.00 0.00 N ATOM 1887 CA PRO B 37 -16.641 -16.124 -10.043 1.00 0.00 C ATOM 1888 C PRO B 37 -15.682 -16.262 -11.240 1.00 0.00 C ATOM 1889 O PRO B 37 -14.477 -16.329 -11.028 1.00 0.00 O ATOM 1890 CB PRO B 37 -16.851 -17.458 -9.315 1.00 0.00 C ATOM 1891 CG PRO B 37 -18.213 -17.934 -9.812 1.00 0.00 C ATOM 1892 CD PRO B 37 -18.972 -16.617 -9.936 1.00 0.00 C ATOM 0 HA PRO B 37 -16.138 -15.385 -9.420 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -16.065 -18.173 -9.556 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -16.843 -17.329 -8.233 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -18.141 -18.457 -10.766 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -18.690 -18.617 -9.109 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -19.790 -16.700 -10.651 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -19.411 -16.324 -8.982 1.00 0.00 H new ATOM 1900 N GLY B 38 -16.184 -16.262 -12.484 1.00 0.00 N ATOM 1901 CA GLY B 38 -15.360 -16.186 -13.703 1.00 0.00 C ATOM 1902 C GLY B 38 -15.341 -14.817 -14.400 1.00 0.00 C ATOM 1903 O GLY B 38 -14.711 -14.698 -15.448 1.00 0.00 O ATOM 0 H GLY B 38 -17.184 -16.315 -12.676 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -14.336 -16.459 -13.447 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -15.721 -16.931 -14.412 1.00 0.00 H new ATOM 1907 N GLN B 39 -16.033 -13.800 -13.869 1.00 0.00 N ATOM 1908 CA GLN B 39 -16.280 -12.513 -14.549 1.00 0.00 C ATOM 1909 C GLN B 39 -15.010 -11.716 -14.839 1.00 0.00 C ATOM 1910 O GLN B 39 -14.943 -11.010 -15.841 1.00 0.00 O ATOM 1911 CB GLN B 39 -17.259 -11.653 -13.732 1.00 0.00 C ATOM 1912 CG GLN B 39 -16.673 -10.978 -12.466 1.00 0.00 C ATOM 1913 CD GLN B 39 -16.160 -9.538 -12.604 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -16.582 -8.757 -13.572 1.00 0.00 O flip ATOM 1915 NE2 GLN B 39 -15.388 -9.062 -11.794 1.00 0.00 N flip ATOM 0 H GLN B 39 -16.446 -13.846 -12.938 1.00 0.00 H new ATOM 0 HA GLN B 39 -16.717 -12.765 -15.515 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -17.659 -10.875 -14.383 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -18.098 -12.280 -13.431 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -17.441 -10.989 -11.693 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -15.850 -11.595 -12.106 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -15.036 -9.635 -11.027 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -15.092 -8.090 -11.882 1.00 0.00 H new ATOM 1924 N LEU B 40 -13.998 -11.851 -13.975 1.00 0.00 N ATOM 1925 CA LEU B 40 -12.747 -11.100 -14.064 1.00 0.00 C ATOM 1926 C LEU B 40 -11.967 -11.449 -15.333 1.00 0.00 C ATOM 1927 O LEU B 40 -11.112 -10.677 -15.744 1.00 0.00 O ATOM 1928 CB LEU B 40 -11.891 -11.324 -12.804 1.00 0.00 C ATOM 1929 CG LEU B 40 -12.634 -10.967 -11.498 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -12.502 -12.073 -10.449 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -12.148 -9.610 -11.000 1.00 0.00 C ATOM 0 H LEU B 40 -14.028 -12.495 -13.184 1.00 0.00 H new ATOM 0 HA LEU B 40 -12.998 -10.041 -14.123 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -11.579 -12.368 -12.764 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -10.985 -10.723 -12.876 1.00 0.00 H new ATOM 0 HG LEU B 40 -13.703 -10.890 -11.699 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -13.038 -11.783 -9.545 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -12.924 -12.998 -10.841 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -11.449 -12.226 -10.212 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -12.669 -9.353 -10.078 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -11.076 -9.655 -10.810 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -12.351 -8.851 -11.756 1.00 0.00 H new ATOM 1943 N ALA B 41 -12.289 -12.566 -15.985 1.00 0.00 N ATOM 1944 CA ALA B 41 -11.700 -12.917 -17.275 1.00 0.00 C ATOM 1945 C ALA B 41 -12.069 -11.907 -18.378 1.00 0.00 C ATOM 1946 O ALA B 41 -11.283 -11.700 -19.299 1.00 0.00 O ATOM 1947 CB ALA B 41 -12.141 -14.341 -17.626 1.00 0.00 C ATOM 0 H ALA B 41 -12.961 -13.249 -15.636 1.00 0.00 H new ATOM 0 HA ALA B 41 -10.613 -12.877 -17.202 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -11.714 -14.628 -18.587 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -11.795 -15.029 -16.855 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -13.229 -14.381 -17.686 1.00 0.00 H new ATOM 1953 N ALA B 42 -13.230 -11.244 -18.266 1.00 0.00 N ATOM 1954 CA ALA B 42 -13.615 -10.144 -19.147 1.00 0.00 C ATOM 1955 C ALA B 42 -12.880 -8.850 -18.768 1.00 0.00 C ATOM 1956 O ALA B 42 -12.229 -8.251 -19.616 1.00 0.00 O ATOM 1957 CB ALA B 42 -15.142 -9.985 -19.100 1.00 0.00 C ATOM 0 H ALA B 42 -13.929 -11.462 -17.555 1.00 0.00 H new ATOM 0 HA ALA B 42 -13.322 -10.369 -20.172 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -15.443 -9.166 -19.754 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -15.614 -10.909 -19.434 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -15.454 -9.767 -18.079 1.00 0.00 H new ATOM 1963 N HIS B 43 -12.933 -8.446 -17.493 1.00 0.00 N ATOM 1964 CA HIS B 43 -12.272 -7.223 -17.019 1.00 0.00 C ATOM 1965 C HIS B 43 -10.746 -7.213 -17.255 1.00 0.00 C ATOM 1966 O HIS B 43 -10.161 -6.155 -17.494 1.00 0.00 O ATOM 1967 CB HIS B 43 -12.532 -7.073 -15.514 1.00 0.00 C ATOM 1968 CG HIS B 43 -13.852 -6.479 -15.108 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -14.383 -6.605 -13.858 1.00 0.00 N flip ATOM 1970 CD2 HIS B 43 -14.557 -5.494 -15.798 1.00 0.00 C flip ATOM 1971 CE1 HIS B 43 -15.396 -5.673 -13.761 1.00 0.00 C flip ATOM 1972 NE2 HIS B 43 -15.480 -5.033 -14.939 1.00 0.00 N flip ATOM 0 H HIS B 43 -13.433 -8.955 -16.764 1.00 0.00 H new ATOM 0 HA HIS B 43 -12.691 -6.396 -17.592 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -12.448 -8.058 -15.055 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -11.738 -6.456 -15.092 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -14.394 -5.169 -16.815 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -16.012 -5.491 -12.893 1.00 0.00 H new ATOM 0 HE2 HIS B 43 -16.153 -4.297 -15.152 1.00 0.00 H new ATOM 1980 N LEU B 44 -10.095 -8.375 -17.120 1.00 0.00 N ATOM 1981 CA LEU B 44 -8.640 -8.508 -17.220 1.00 0.00 C ATOM 1982 C LEU B 44 -8.163 -8.981 -18.596 1.00 0.00 C ATOM 1983 O LEU B 44 -6.967 -8.894 -18.863 1.00 0.00 O ATOM 1984 CB LEU B 44 -8.134 -9.441 -16.095 1.00 0.00 C ATOM 1985 CG LEU B 44 -8.521 -9.002 -14.665 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -7.768 -9.771 -13.593 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -8.314 -7.501 -14.409 1.00 0.00 C ATOM 0 H LEU B 44 -10.571 -9.258 -16.936 1.00 0.00 H new ATOM 0 HA LEU B 44 -8.211 -7.514 -17.095 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -8.525 -10.443 -16.270 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -7.048 -9.507 -16.158 1.00 0.00 H new ATOM 0 HG LEU B 44 -9.586 -9.227 -14.601 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -8.079 -9.422 -12.608 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.987 -10.835 -13.687 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.697 -9.609 -13.714 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -8.606 -7.263 -13.386 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -7.264 -7.248 -14.555 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -8.926 -6.926 -15.104 1.00 0.00 H new ATOM 1999 N GLY B 45 -9.046 -9.527 -19.443 1.00 0.00 N ATOM 2000 CA GLY B 45 -8.669 -10.198 -20.697 1.00 0.00 C ATOM 2001 C GLY B 45 -7.877 -11.493 -20.479 1.00 0.00 C ATOM 2002 O GLY B 45 -7.370 -12.075 -21.439 1.00 0.00 O ATOM 0 H GLY B 45 -10.052 -9.516 -19.276 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -9.571 -10.424 -21.265 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -8.074 -9.514 -21.302 1.00 0.00 H new ATOM 2006 N LEU B 46 -7.728 -11.929 -19.221 1.00 0.00 N ATOM 2007 CA LEU B 46 -6.884 -13.055 -18.822 1.00 0.00 C ATOM 2008 C LEU B 46 -7.723 -14.308 -18.557 1.00 0.00 C ATOM 2009 O LEU B 46 -8.917 -14.242 -18.281 1.00 0.00 O ATOM 2010 CB LEU B 46 -6.021 -12.646 -17.612 1.00 0.00 C ATOM 2011 CG LEU B 46 -4.916 -11.622 -17.965 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -4.282 -11.030 -16.700 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -3.807 -12.250 -18.826 1.00 0.00 C ATOM 0 H LEU B 46 -8.207 -11.493 -18.433 1.00 0.00 H new ATOM 0 HA LEU B 46 -6.210 -13.313 -19.639 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -6.666 -12.223 -16.841 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -5.558 -13.537 -17.187 1.00 0.00 H new ATOM 0 HG LEU B 46 -5.402 -10.831 -18.535 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -3.509 -10.314 -16.981 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -5.048 -10.525 -16.111 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -3.837 -11.830 -16.107 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -3.051 -11.498 -19.051 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -3.347 -13.075 -18.282 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -4.236 -12.623 -19.756 1.00 0.00 H new ATOM 2025 N THR B 47 -7.087 -15.478 -18.663 1.00 0.00 N ATOM 2026 CA THR B 47 -7.783 -16.772 -18.651 1.00 0.00 C ATOM 2027 C THR B 47 -8.440 -17.025 -17.298 1.00 0.00 C ATOM 2028 O THR B 47 -7.943 -16.574 -16.265 1.00 0.00 O ATOM 2029 CB THR B 47 -6.855 -17.928 -19.060 1.00 0.00 C ATOM 2030 OG1 THR B 47 -5.889 -18.168 -18.066 1.00 0.00 O ATOM 2031 CG2 THR B 47 -6.090 -17.648 -20.352 1.00 0.00 C ATOM 0 H THR B 47 -6.075 -15.557 -18.760 1.00 0.00 H new ATOM 0 HA THR B 47 -8.573 -16.727 -19.400 1.00 0.00 H new ATOM 0 HB THR B 47 -7.511 -18.787 -19.202 1.00 0.00 H new ATOM 0 HG1 THR B 47 -5.310 -18.908 -18.345 1.00 0.00 H new ATOM 0 HG21 THR B 47 -5.452 -18.500 -20.589 1.00 0.00 H new ATOM 0 HG22 THR B 47 -6.797 -17.487 -21.166 1.00 0.00 H new ATOM 0 HG23 THR B 47 -5.474 -16.758 -20.225 1.00 0.00 H new ATOM 2039 N ARG B 48 -9.497 -17.848 -17.286 1.00 0.00 N ATOM 2040 CA ARG B 48 -10.128 -18.333 -16.046 1.00 0.00 C ATOM 2041 C ARG B 48 -9.119 -19.029 -15.114 1.00 0.00 C ATOM 2042 O ARG B 48 -9.285 -19.007 -13.900 1.00 0.00 O ATOM 2043 CB ARG B 48 -11.339 -19.238 -16.355 1.00 0.00 C ATOM 2044 CG ARG B 48 -10.992 -20.545 -17.096 1.00 0.00 C ATOM 2045 CD ARG B 48 -12.230 -21.366 -17.496 1.00 0.00 C ATOM 2046 NE ARG B 48 -12.806 -22.144 -16.377 1.00 0.00 N ATOM 2047 CZ ARG B 48 -13.792 -23.040 -16.497 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -14.428 -23.231 -17.636 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -14.166 -23.779 -15.473 1.00 0.00 N ATOM 0 H ARG B 48 -9.941 -18.198 -18.135 1.00 0.00 H new ATOM 0 HA ARG B 48 -10.496 -17.459 -15.508 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -11.837 -19.488 -15.418 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -12.053 -18.674 -16.955 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -10.419 -20.305 -17.992 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -10.350 -21.155 -16.461 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -12.991 -20.693 -17.890 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -11.959 -22.048 -18.302 1.00 0.00 H new ATOM 0 HE ARG B 48 -12.423 -21.985 -15.445 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -14.173 -22.687 -18.460 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -15.175 -23.923 -17.693 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -13.702 -23.673 -14.571 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -14.920 -24.457 -15.582 1.00 0.00 H new ATOM 2063 N SER B 49 -8.056 -19.615 -15.662 1.00 0.00 N ATOM 2064 CA SER B 49 -6.932 -20.158 -14.895 1.00 0.00 C ATOM 2065 C SER B 49 -6.099 -19.032 -14.266 1.00 0.00 C ATOM 2066 O SER B 49 -5.945 -19.010 -13.054 1.00 0.00 O ATOM 2067 CB SER B 49 -6.055 -21.045 -15.795 1.00 0.00 C ATOM 2068 OG SER B 49 -6.852 -21.897 -16.605 1.00 0.00 O ATOM 0 H SER B 49 -7.948 -19.729 -16.670 1.00 0.00 H new ATOM 0 HA SER B 49 -7.332 -20.769 -14.086 1.00 0.00 H new ATOM 0 HB2 SER B 49 -5.428 -20.418 -16.429 1.00 0.00 H new ATOM 0 HB3 SER B 49 -5.386 -21.645 -15.178 1.00 0.00 H new ATOM 0 HG SER B 49 -6.271 -22.449 -17.169 1.00 0.00 H new ATOM 2074 N ASN B 50 -5.632 -18.054 -15.054 1.00 0.00 N ATOM 2075 CA ASN B 50 -4.866 -16.895 -14.569 1.00 0.00 C ATOM 2076 C ASN B 50 -5.651 -16.073 -13.511 1.00 0.00 C ATOM 2077 O ASN B 50 -5.124 -15.727 -12.448 1.00 0.00 O ATOM 2078 CB ASN B 50 -4.470 -16.063 -15.801 1.00 0.00 C ATOM 2079 CG ASN B 50 -3.683 -14.807 -15.448 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -4.226 -13.883 -14.871 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -2.416 -14.717 -15.813 1.00 0.00 N ATOM 0 H ASN B 50 -5.778 -18.045 -16.063 1.00 0.00 H new ATOM 0 HA ASN B 50 -3.969 -17.225 -14.045 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -3.874 -16.681 -16.473 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -5.371 -15.779 -16.345 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -1.886 -13.869 -15.612 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -1.968 -15.496 -16.296 1.00 0.00 H new ATOM 2088 N VAL B 51 -6.939 -15.839 -13.767 1.00 0.00 N ATOM 2089 CA VAL B 51 -7.893 -15.267 -12.811 1.00 0.00 C ATOM 2090 C VAL B 51 -8.048 -16.145 -11.559 1.00 0.00 C ATOM 2091 O VAL B 51 -7.982 -15.613 -10.456 1.00 0.00 O ATOM 2092 CB VAL B 51 -9.241 -15.001 -13.522 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -10.453 -14.875 -12.587 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -9.142 -13.751 -14.416 1.00 0.00 C ATOM 0 H VAL B 51 -7.361 -16.048 -14.672 1.00 0.00 H new ATOM 0 HA VAL B 51 -7.504 -14.314 -12.453 1.00 0.00 H new ATOM 0 HB VAL B 51 -9.422 -15.892 -14.124 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -11.350 -14.689 -13.177 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -10.575 -15.799 -12.023 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -10.295 -14.046 -11.897 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -10.099 -13.579 -14.908 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -8.888 -12.885 -13.804 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -8.369 -13.903 -15.169 1.00 0.00 H new ATOM 2104 N SER B 52 -8.170 -17.476 -11.672 1.00 0.00 N ATOM 2105 CA SER B 52 -8.231 -18.352 -10.483 1.00 0.00 C ATOM 2106 C SER B 52 -6.940 -18.329 -9.656 1.00 0.00 C ATOM 2107 O SER B 52 -7.008 -18.327 -8.427 1.00 0.00 O ATOM 2108 CB SER B 52 -8.505 -19.815 -10.838 1.00 0.00 C ATOM 2109 OG SER B 52 -9.753 -19.987 -11.489 1.00 0.00 O ATOM 0 H SER B 52 -8.228 -17.969 -12.563 1.00 0.00 H new ATOM 0 HA SER B 52 -9.057 -17.943 -9.900 1.00 0.00 H new ATOM 0 HB2 SER B 52 -7.708 -20.185 -11.482 1.00 0.00 H new ATOM 0 HB3 SER B 52 -8.486 -20.417 -9.929 1.00 0.00 H new ATOM 0 HG SER B 52 -9.697 -19.635 -12.402 1.00 0.00 H new ATOM 2115 N ASN B 53 -5.778 -18.276 -10.318 1.00 0.00 N ATOM 2116 CA ASN B 53 -4.457 -18.165 -9.700 1.00 0.00 C ATOM 2117 C ASN B 53 -4.381 -16.920 -8.809 1.00 0.00 C ATOM 2118 O ASN B 53 -4.155 -17.032 -7.603 1.00 0.00 O ATOM 2119 CB ASN B 53 -3.372 -18.136 -10.798 1.00 0.00 C ATOM 2120 CG ASN B 53 -2.834 -19.515 -11.175 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -3.571 -20.467 -11.386 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -1.522 -19.666 -11.262 1.00 0.00 N ATOM 0 H ASN B 53 -5.733 -18.311 -11.336 1.00 0.00 H new ATOM 0 HA ASN B 53 -4.284 -19.033 -9.065 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -3.784 -17.662 -11.689 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -2.543 -17.514 -10.460 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -1.128 -20.575 -11.505 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -0.905 -18.873 -11.086 1.00 0.00 H new ATOM 2129 N HIS B 54 -4.622 -15.731 -9.370 1.00 0.00 N ATOM 2130 CA HIS B 54 -4.555 -14.499 -8.586 1.00 0.00 C ATOM 2131 C HIS B 54 -5.770 -14.314 -7.637 1.00 0.00 C ATOM 2132 O HIS B 54 -5.631 -13.597 -6.647 1.00 0.00 O ATOM 2133 CB HIS B 54 -4.211 -13.308 -9.505 1.00 0.00 C ATOM 2134 CG HIS B 54 -2.727 -13.207 -9.844 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -1.724 -12.745 -9.014 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -2.116 -13.464 -11.046 1.00 0.00 C ATOM 2137 CE1 HIS B 54 -0.570 -12.711 -9.694 1.00 0.00 C ATOM 2138 NE2 HIS B 54 -0.764 -13.138 -10.946 1.00 0.00 N ATOM 0 H HIS B 54 -4.862 -15.598 -10.352 1.00 0.00 H new ATOM 0 HA HIS B 54 -3.730 -14.565 -7.877 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -4.781 -13.397 -10.430 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -4.529 -12.384 -9.022 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -2.604 -13.855 -11.927 1.00 0.00 H new ATOM 0 HE1 HIS B 54 0.378 -12.386 -9.290 1.00 0.00 H new ATOM 0 HE2 HIS B 54 -0.062 -13.211 -11.682 1.00 0.00 H new ATOM 2146 N LEU B 55 -6.913 -14.994 -7.833 1.00 0.00 N ATOM 2147 CA LEU B 55 -7.982 -15.056 -6.825 1.00 0.00 C ATOM 2148 C LEU B 55 -7.615 -15.916 -5.618 1.00 0.00 C ATOM 2149 O LEU B 55 -8.066 -15.605 -4.525 1.00 0.00 O ATOM 2150 CB LEU B 55 -9.275 -15.652 -7.405 1.00 0.00 C ATOM 2151 CG LEU B 55 -10.118 -14.690 -8.250 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -11.107 -15.525 -9.066 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -10.863 -13.715 -7.331 1.00 0.00 C ATOM 0 H LEU B 55 -7.120 -15.511 -8.687 1.00 0.00 H new ATOM 0 HA LEU B 55 -8.126 -14.021 -6.515 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -9.015 -16.515 -8.018 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -9.888 -16.019 -6.582 1.00 0.00 H new ATOM 0 HG LEU B 55 -9.486 -14.107 -8.920 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -11.722 -14.865 -9.678 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -10.558 -16.212 -9.711 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -11.747 -16.094 -8.391 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -11.462 -13.032 -7.934 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -11.515 -14.274 -6.660 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -10.142 -13.145 -6.745 1.00 0.00 H new ATOM 2165 N SER B 56 -6.915 -17.040 -5.772 1.00 0.00 N ATOM 2166 CA SER B 56 -6.705 -17.977 -4.653 1.00 0.00 C ATOM 2167 C SER B 56 -6.119 -17.342 -3.387 1.00 0.00 C ATOM 2168 O SER B 56 -6.757 -17.440 -2.342 1.00 0.00 O ATOM 2169 CB SER B 56 -5.895 -19.191 -5.107 1.00 0.00 C ATOM 2170 OG SER B 56 -6.755 -20.035 -5.855 1.00 0.00 O ATOM 0 H SER B 56 -6.484 -17.328 -6.651 1.00 0.00 H new ATOM 0 HA SER B 56 -7.700 -18.307 -4.356 1.00 0.00 H new ATOM 0 HB2 SER B 56 -5.046 -18.877 -5.714 1.00 0.00 H new ATOM 0 HB3 SER B 56 -5.492 -19.724 -4.246 1.00 0.00 H new ATOM 0 HG SER B 56 -6.915 -19.640 -6.737 1.00 0.00 H new ATOM 2176 N CYS B 57 -4.999 -16.616 -3.469 1.00 0.00 N ATOM 2177 CA CYS B 57 -4.389 -15.999 -2.284 1.00 0.00 C ATOM 2178 C CYS B 57 -5.243 -14.847 -1.696 1.00 0.00 C ATOM 2179 O CYS B 57 -5.154 -14.501 -0.522 1.00 0.00 O ATOM 2180 CB CYS B 57 -2.991 -15.520 -2.687 1.00 0.00 C ATOM 2181 SG CYS B 57 -1.822 -15.432 -1.297 1.00 0.00 S ATOM 0 H CYS B 57 -4.497 -16.441 -4.340 1.00 0.00 H new ATOM 0 HA CYS B 57 -4.327 -16.736 -1.483 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -2.590 -16.193 -3.446 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -3.072 -14.534 -3.146 1.00 0.00 H new ATOM 0 HG CYS B 57 -2.450 -15.047 -0.226 1.00 0.00 H new ATOM 2186 N LEU B 58 -6.078 -14.238 -2.543 1.00 0.00 N ATOM 2187 CA LEU B 58 -7.020 -13.161 -2.232 1.00 0.00 C ATOM 2188 C LEU B 58 -8.179 -13.681 -1.367 1.00 0.00 C ATOM 2189 O LEU B 58 -8.581 -13.028 -0.400 1.00 0.00 O ATOM 2190 CB LEU B 58 -7.515 -12.618 -3.595 1.00 0.00 C ATOM 2191 CG LEU B 58 -7.655 -11.095 -3.732 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -6.347 -10.382 -3.398 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -8.086 -10.820 -5.176 1.00 0.00 C ATOM 0 H LEU B 58 -6.116 -14.502 -3.528 1.00 0.00 H new ATOM 0 HA LEU B 58 -6.548 -12.368 -1.651 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -6.828 -12.965 -4.367 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -8.485 -13.067 -3.806 1.00 0.00 H new ATOM 0 HG LEU B 58 -8.394 -10.712 -3.028 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -6.482 -9.306 -3.505 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -6.059 -10.611 -2.372 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -5.565 -10.719 -4.078 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -8.199 -9.746 -5.324 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -7.329 -11.203 -5.861 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -9.037 -11.316 -5.373 1.00 0.00 H new ATOM 2205 N ARG B 59 -8.693 -14.863 -1.731 1.00 0.00 N ATOM 2206 CA ARG B 59 -9.743 -15.601 -1.020 1.00 0.00 C ATOM 2207 C ARG B 59 -9.187 -16.409 0.164 1.00 0.00 C ATOM 2208 O ARG B 59 -9.976 -16.927 0.949 1.00 0.00 O ATOM 2209 CB ARG B 59 -10.466 -16.548 -2.002 1.00 0.00 C ATOM 2210 CG ARG B 59 -11.079 -15.892 -3.264 1.00 0.00 C ATOM 2211 CD ARG B 59 -11.632 -16.927 -4.243 1.00 0.00 C ATOM 2212 NE ARG B 59 -10.572 -17.820 -4.751 1.00 0.00 N ATOM 2213 CZ ARG B 59 -10.745 -19.062 -5.190 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -11.953 -19.580 -5.257 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -9.728 -19.812 -5.558 1.00 0.00 N ATOM 0 H ARG B 59 -8.373 -15.352 -2.567 1.00 0.00 H new ATOM 0 HA ARG B 59 -10.443 -14.870 -0.617 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -9.758 -17.312 -2.323 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -11.263 -17.058 -1.461 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -11.878 -15.213 -2.966 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -10.320 -15.291 -3.764 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -12.402 -17.520 -3.749 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -12.110 -16.417 -5.080 1.00 0.00 H new ATOM 0 HE ARG B 59 -9.621 -17.450 -4.766 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -12.761 -19.028 -4.971 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -12.081 -20.534 -5.595 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -8.778 -19.443 -5.510 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -9.889 -20.762 -5.891 1.00 0.00 H new ATOM 2229 N GLY B 60 -7.858 -16.519 0.295 1.00 0.00 N ATOM 2230 CA GLY B 60 -7.184 -17.159 1.428 1.00 0.00 C ATOM 2231 C GLY B 60 -6.880 -16.153 2.532 1.00 0.00 C ATOM 2232 O GLY B 60 -7.292 -16.348 3.668 1.00 0.00 O ATOM 0 H GLY B 60 -7.208 -16.156 -0.402 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -7.812 -17.957 1.824 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -6.257 -17.621 1.089 1.00 0.00 H new ATOM 2236 N CYS B 61 -6.219 -15.043 2.188 1.00 0.00 N ATOM 2237 CA CYS B 61 -5.818 -13.975 3.099 1.00 0.00 C ATOM 2238 C CYS B 61 -6.963 -13.015 3.537 1.00 0.00 C ATOM 2239 O CYS B 61 -6.697 -12.064 4.275 1.00 0.00 O ATOM 2240 CB CYS B 61 -4.629 -13.277 2.421 1.00 0.00 C ATOM 2241 SG CYS B 61 -3.085 -14.252 2.357 1.00 0.00 S ATOM 0 H CYS B 61 -5.938 -14.860 1.225 1.00 0.00 H new ATOM 0 HA CYS B 61 -5.528 -14.392 4.063 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -4.916 -13.014 1.403 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -4.428 -12.344 2.947 1.00 0.00 H new ATOM 0 HG CYS B 61 -2.166 -13.569 1.742 1.00 0.00 H new ATOM 2246 N GLY B 62 -8.199 -13.238 3.067 1.00 0.00 N ATOM 2247 CA GLY B 62 -9.395 -12.489 3.484 1.00 0.00 C ATOM 2248 C GLY B 62 -9.551 -11.116 2.825 1.00 0.00 C ATOM 2249 O GLY B 62 -10.101 -10.198 3.421 1.00 0.00 O ATOM 0 H GLY B 62 -8.400 -13.958 2.373 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -10.278 -13.087 3.260 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -9.366 -12.357 4.566 1.00 0.00 H new ATOM 2253 N LEU B 63 -9.049 -10.944 1.595 1.00 0.00 N ATOM 2254 CA LEU B 63 -9.276 -9.730 0.802 1.00 0.00 C ATOM 2255 C LEU B 63 -10.543 -9.805 -0.060 1.00 0.00 C ATOM 2256 O LEU B 63 -11.136 -8.770 -0.366 1.00 0.00 O ATOM 2257 CB LEU B 63 -8.029 -9.458 -0.018 1.00 0.00 C ATOM 2258 CG LEU B 63 -6.844 -9.132 0.911 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -5.613 -9.123 0.045 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -6.969 -7.787 1.654 1.00 0.00 C ATOM 0 H LEU B 63 -8.475 -11.642 1.123 1.00 0.00 H new ATOM 0 HA LEU B 63 -9.457 -8.893 1.477 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.791 -10.327 -0.632 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -8.207 -8.626 -0.699 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.807 -9.885 1.698 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -4.740 -8.896 0.656 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.487 -10.101 -0.418 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.720 -8.365 -0.731 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -6.093 -7.637 2.285 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -7.037 -6.976 0.929 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -7.866 -7.796 2.274 1.00 0.00 H new ATOM 2272 N VAL B 64 -10.981 -11.018 -0.396 1.00 0.00 N ATOM 2273 CA VAL B 64 -12.217 -11.297 -1.147 1.00 0.00 C ATOM 2274 C VAL B 64 -12.986 -12.465 -0.547 1.00 0.00 C ATOM 2275 O VAL B 64 -12.397 -13.370 0.041 1.00 0.00 O ATOM 2276 CB VAL B 64 -11.945 -11.595 -2.636 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -11.604 -10.299 -3.366 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -10.813 -12.573 -2.829 1.00 0.00 C ATOM 0 H VAL B 64 -10.472 -11.866 -0.147 1.00 0.00 H new ATOM 0 HA VAL B 64 -12.817 -10.390 -1.075 1.00 0.00 H new ATOM 0 HB VAL B 64 -12.851 -12.043 -3.044 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -11.412 -10.513 -4.417 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -12.440 -9.604 -3.284 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -10.716 -9.853 -2.919 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -10.662 -12.749 -3.894 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.900 -12.163 -2.396 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -11.058 -13.514 -2.337 1.00 0.00 H new ATOM 2288 N VAL B 65 -14.308 -12.419 -0.710 1.00 0.00 N ATOM 2289 CA VAL B 65 -15.275 -13.308 -0.048 1.00 0.00 C ATOM 2290 C VAL B 65 -16.408 -13.683 -1.017 1.00 0.00 C ATOM 2291 O VAL B 65 -16.861 -12.860 -1.815 1.00 0.00 O ATOM 2292 CB VAL B 65 -15.835 -12.636 1.235 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -16.828 -13.547 1.966 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -14.722 -12.273 2.238 1.00 0.00 C ATOM 0 H VAL B 65 -14.755 -11.740 -1.327 1.00 0.00 H new ATOM 0 HA VAL B 65 -14.766 -14.226 0.246 1.00 0.00 H new ATOM 0 HB VAL B 65 -16.333 -11.730 0.890 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -17.197 -13.041 2.858 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -17.665 -13.776 1.306 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -16.329 -14.472 2.254 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -15.164 -11.806 3.118 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -14.191 -13.177 2.535 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -14.023 -11.579 1.771 1.00 0.00 H new ATOM 2304 N ALA B 66 -16.858 -14.942 -0.971 1.00 0.00 N ATOM 2305 CA ALA B 66 -17.995 -15.434 -1.756 1.00 0.00 C ATOM 2306 C ALA B 66 -19.344 -15.007 -1.153 1.00 0.00 C ATOM 2307 O ALA B 66 -19.536 -14.971 0.063 1.00 0.00 O ATOM 2308 CB ALA B 66 -17.874 -16.958 -1.888 1.00 0.00 C ATOM 0 H ALA B 66 -16.436 -15.658 -0.379 1.00 0.00 H new ATOM 0 HA ALA B 66 -17.968 -14.985 -2.749 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -18.713 -17.341 -2.470 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -16.940 -17.207 -2.392 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -17.883 -17.411 -0.897 1.00 0.00 H new ATOM 2314 N THR B 67 -20.295 -14.665 -2.028 1.00 0.00 N ATOM 2315 CA THR B 67 -21.619 -14.094 -1.713 1.00 0.00 C ATOM 2316 C THR B 67 -22.500 -14.284 -2.947 1.00 0.00 C ATOM 2317 O THR B 67 -21.974 -14.634 -3.992 1.00 0.00 O ATOM 2318 CB THR B 67 -21.430 -12.629 -1.273 1.00 0.00 C ATOM 2319 OG1 THR B 67 -21.039 -12.641 0.079 1.00 0.00 O ATOM 2320 CG2 THR B 67 -22.665 -11.736 -1.338 1.00 0.00 C ATOM 0 H THR B 67 -20.159 -14.784 -3.032 1.00 0.00 H new ATOM 0 HA THR B 67 -22.120 -14.590 -0.882 1.00 0.00 H new ATOM 0 HB THR B 67 -20.705 -12.215 -1.974 1.00 0.00 H new ATOM 0 HG1 THR B 67 -20.523 -13.453 0.263 1.00 0.00 H new ATOM 0 HG21 THR B 67 -22.406 -10.731 -1.004 1.00 0.00 H new ATOM 0 HG22 THR B 67 -23.030 -11.694 -2.364 1.00 0.00 H new ATOM 0 HG23 THR B 67 -23.443 -12.143 -0.692 1.00 0.00 H new ATOM 2328 N TYR B 68 -23.818 -14.097 -2.882 1.00 0.00 N ATOM 2329 CA TYR B 68 -24.672 -14.119 -4.084 1.00 0.00 C ATOM 2330 C TYR B 68 -24.851 -12.728 -4.726 1.00 0.00 C ATOM 2331 O TYR B 68 -24.860 -11.706 -4.034 1.00 0.00 O ATOM 2332 CB TYR B 68 -26.047 -14.722 -3.744 1.00 0.00 C ATOM 2333 CG TYR B 68 -26.179 -16.221 -3.951 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -25.322 -17.117 -3.279 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -27.197 -16.726 -4.787 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -25.493 -18.508 -3.422 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -27.364 -18.114 -4.943 1.00 0.00 C ATOM 2338 CZ TYR B 68 -26.513 -19.011 -4.262 1.00 0.00 C ATOM 2339 OH TYR B 68 -26.671 -20.352 -4.427 1.00 0.00 O ATOM 0 H TYR B 68 -24.324 -13.928 -2.013 1.00 0.00 H new ATOM 0 HA TYR B 68 -24.162 -14.742 -4.819 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -26.274 -14.496 -2.702 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -26.802 -14.222 -4.351 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -24.530 -16.735 -2.651 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -27.851 -16.044 -5.310 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -24.845 -19.190 -2.890 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -28.145 -18.494 -5.585 1.00 0.00 H new ATOM 0 HH TYR B 68 -27.420 -20.521 -5.037 1.00 0.00 H new ATOM 2349 N GLU B 69 -25.019 -12.704 -6.051 1.00 0.00 N ATOM 2350 CA GLU B 69 -25.506 -11.557 -6.834 1.00 0.00 C ATOM 2351 C GLU B 69 -27.011 -11.734 -7.157 1.00 0.00 C ATOM 2352 O GLU B 69 -27.560 -11.053 -8.017 1.00 0.00 O ATOM 2353 CB GLU B 69 -24.662 -11.340 -8.113 1.00 0.00 C ATOM 2354 CG GLU B 69 -24.638 -12.534 -9.074 1.00 0.00 C ATOM 2355 CD GLU B 69 -24.173 -12.146 -10.477 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -22.947 -12.056 -10.681 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -25.044 -12.004 -11.369 1.00 0.00 O ATOM 0 H GLU B 69 -24.812 -13.515 -6.635 1.00 0.00 H new ATOM 0 HA GLU B 69 -25.392 -10.655 -6.232 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -25.049 -10.471 -8.645 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -23.638 -11.105 -7.821 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -23.977 -13.304 -8.676 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -25.636 -12.969 -9.133 1.00 0.00 H new ATOM 2364 N GLY B 70 -27.681 -12.709 -6.522 1.00 0.00 N ATOM 2365 CA GLY B 70 -29.081 -13.084 -6.749 1.00 0.00 C ATOM 2366 C GLY B 70 -29.217 -14.000 -7.961 1.00 0.00 C ATOM 2367 O GLY B 70 -29.692 -15.124 -7.844 1.00 0.00 O ATOM 0 H GLY B 70 -27.239 -13.282 -5.804 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -29.474 -13.586 -5.865 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -29.681 -12.186 -6.899 1.00 0.00 H new ATOM 2371 N ARG B 71 -28.726 -13.534 -9.111 1.00 0.00 N ATOM 2372 CA ARG B 71 -28.722 -14.247 -10.398 1.00 0.00 C ATOM 2373 C ARG B 71 -27.764 -15.452 -10.430 1.00 0.00 C ATOM 2374 O ARG B 71 -27.877 -16.311 -11.304 1.00 0.00 O ATOM 2375 CB ARG B 71 -28.241 -13.280 -11.494 1.00 0.00 C ATOM 2376 CG ARG B 71 -28.926 -11.903 -11.562 1.00 0.00 C ATOM 2377 CD ARG B 71 -28.124 -10.926 -12.437 1.00 0.00 C ATOM 2378 NE ARG B 71 -28.094 -11.336 -13.855 1.00 0.00 N ATOM 2379 CZ ARG B 71 -27.085 -11.913 -14.503 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -25.936 -12.219 -13.936 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -27.235 -12.200 -15.780 1.00 0.00 N ATOM 0 H ARG B 71 -28.301 -12.609 -9.178 1.00 0.00 H new ATOM 0 HA ARG B 71 -29.739 -14.608 -10.553 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -27.171 -13.120 -11.359 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -28.370 -13.770 -12.459 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -29.933 -12.014 -11.965 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -29.029 -11.495 -10.557 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -28.560 -9.930 -12.359 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -27.104 -10.858 -12.060 1.00 0.00 H new ATOM 0 HE ARG B 71 -28.939 -11.157 -14.397 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -25.784 -12.014 -12.948 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -25.198 -12.661 -14.485 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -28.112 -11.980 -16.253 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -26.474 -12.642 -16.296 1.00 0.00 H new ATOM 2395 N GLN B 72 -26.773 -15.467 -9.536 1.00 0.00 N ATOM 2396 CA GLN B 72 -25.600 -16.333 -9.503 1.00 0.00 C ATOM 2397 C GLN B 72 -24.820 -16.063 -8.201 1.00 0.00 C ATOM 2398 O GLN B 72 -25.154 -15.136 -7.460 1.00 0.00 O ATOM 2399 CB GLN B 72 -24.755 -16.027 -10.777 1.00 0.00 C ATOM 2400 CG GLN B 72 -23.582 -16.969 -11.077 1.00 0.00 C ATOM 2401 CD GLN B 72 -23.953 -18.410 -10.776 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -23.581 -18.951 -9.750 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -24.822 -19.023 -11.541 1.00 0.00 N ATOM 0 H GLN B 72 -26.774 -14.816 -8.751 1.00 0.00 H new ATOM 0 HA GLN B 72 -25.867 -17.390 -9.508 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -25.424 -16.035 -11.637 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -24.362 -15.014 -10.688 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -23.293 -16.875 -12.124 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -22.717 -16.680 -10.481 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -25.143 -18.582 -12.403 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -25.178 -19.941 -11.274 1.00 0.00 H new ATOM 2412 N VAL B 73 -23.784 -16.855 -7.919 1.00 0.00 N ATOM 2413 CA VAL B 73 -22.786 -16.552 -6.882 1.00 0.00 C ATOM 2414 C VAL B 73 -21.774 -15.521 -7.419 1.00 0.00 C ATOM 2415 O VAL B 73 -21.642 -15.363 -8.633 1.00 0.00 O ATOM 2416 CB VAL B 73 -22.071 -17.817 -6.355 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -23.058 -18.956 -6.054 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -20.957 -18.351 -7.273 1.00 0.00 C ATOM 0 H VAL B 73 -23.609 -17.734 -8.406 1.00 0.00 H new ATOM 0 HA VAL B 73 -23.314 -16.126 -6.029 1.00 0.00 H new ATOM 0 HB VAL B 73 -21.597 -17.482 -5.433 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -22.511 -19.824 -5.686 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -23.771 -18.629 -5.297 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -23.593 -19.224 -6.965 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -20.511 -19.239 -6.825 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -21.378 -18.608 -8.245 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -20.192 -17.585 -7.400 1.00 0.00 H new ATOM 2428 N ARG B 74 -21.021 -14.848 -6.541 1.00 0.00 N ATOM 2429 CA ARG B 74 -20.045 -13.812 -6.894 1.00 0.00 C ATOM 2430 C ARG B 74 -18.863 -13.803 -5.936 1.00 0.00 C ATOM 2431 O ARG B 74 -18.927 -14.342 -4.828 1.00 0.00 O ATOM 2432 CB ARG B 74 -20.689 -12.405 -6.892 1.00 0.00 C ATOM 2433 CG ARG B 74 -21.304 -11.954 -5.559 1.00 0.00 C ATOM 2434 CD ARG B 74 -21.584 -10.453 -5.551 1.00 0.00 C ATOM 2435 NE ARG B 74 -22.524 -10.068 -4.492 1.00 0.00 N ATOM 2436 CZ ARG B 74 -22.729 -8.849 -4.016 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -22.023 -7.810 -4.416 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -23.684 -8.681 -3.124 1.00 0.00 N ATOM 0 H ARG B 74 -21.076 -15.015 -5.536 1.00 0.00 H new ATOM 0 HA ARG B 74 -19.694 -14.052 -7.898 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -19.931 -11.679 -7.185 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -21.466 -12.381 -7.656 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -22.231 -12.499 -5.382 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -20.627 -12.203 -4.742 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -20.648 -9.912 -5.417 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -21.988 -10.156 -6.519 1.00 0.00 H new ATOM 0 HE ARG B 74 -23.078 -10.818 -4.079 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -21.290 -7.930 -5.115 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -22.210 -6.886 -4.026 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -24.242 -9.478 -2.818 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -23.865 -7.754 -2.739 1.00 0.00 H new ATOM 2452 N TYR B 75 -17.788 -13.128 -6.347 1.00 0.00 N ATOM 2453 CA TYR B 75 -16.684 -12.760 -5.447 1.00 0.00 C ATOM 2454 C TYR B 75 -16.764 -11.253 -5.155 1.00 0.00 C ATOM 2455 O TYR B 75 -16.732 -10.440 -6.071 1.00 0.00 O ATOM 2456 CB TYR B 75 -15.320 -13.120 -6.057 1.00 0.00 C ATOM 2457 CG TYR B 75 -15.029 -14.596 -6.259 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -15.293 -15.548 -5.251 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -14.449 -15.015 -7.470 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -14.994 -16.909 -5.463 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -14.170 -16.374 -7.696 1.00 0.00 C ATOM 2462 CZ TYR B 75 -14.438 -17.327 -6.693 1.00 0.00 C ATOM 2463 OH TYR B 75 -14.169 -18.641 -6.924 1.00 0.00 O ATOM 0 H TYR B 75 -17.655 -12.820 -7.310 1.00 0.00 H new ATOM 0 HA TYR B 75 -16.780 -13.323 -4.518 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -15.238 -12.622 -7.023 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -14.541 -12.705 -5.417 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -15.726 -15.232 -4.313 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -14.216 -14.286 -8.233 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -15.190 -17.632 -4.685 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -13.750 -16.688 -8.640 1.00 0.00 H new ATOM 0 HH TYR B 75 -13.791 -18.745 -7.822 1.00 0.00 H new ATOM 2473 N ALA B 76 -16.896 -10.872 -3.885 1.00 0.00 N ATOM 2474 CA ALA B 76 -16.935 -9.481 -3.424 1.00 0.00 C ATOM 2475 C ALA B 76 -15.711 -9.155 -2.563 1.00 0.00 C ATOM 2476 O ALA B 76 -15.167 -10.058 -1.932 1.00 0.00 O ATOM 2477 CB ALA B 76 -18.237 -9.265 -2.640 1.00 0.00 C ATOM 0 H ALA B 76 -16.982 -11.544 -3.122 1.00 0.00 H new ATOM 0 HA ALA B 76 -16.910 -8.808 -4.281 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -18.283 -8.234 -2.289 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -19.090 -9.466 -3.288 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -18.264 -9.941 -1.785 1.00 0.00 H new ATOM 2483 N LEU B 77 -15.287 -7.887 -2.511 1.00 0.00 N ATOM 2484 CA LEU B 77 -14.279 -7.420 -1.558 1.00 0.00 C ATOM 2485 C LEU B 77 -14.758 -7.672 -0.120 1.00 0.00 C ATOM 2486 O LEU B 77 -15.958 -7.653 0.145 1.00 0.00 O ATOM 2487 CB LEU B 77 -14.009 -5.938 -1.852 1.00 0.00 C ATOM 2488 CG LEU B 77 -13.233 -5.675 -3.142 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -13.214 -4.164 -3.291 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -11.806 -6.218 -3.126 1.00 0.00 C ATOM 0 H LEU B 77 -15.635 -7.156 -3.131 1.00 0.00 H new ATOM 0 HA LEU B 77 -13.343 -7.968 -1.664 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -14.962 -5.412 -1.904 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -13.454 -5.511 -1.017 1.00 0.00 H new ATOM 0 HG LEU B 77 -13.716 -6.189 -3.973 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -12.673 -3.895 -4.198 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -14.236 -3.792 -3.355 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -12.719 -3.719 -2.427 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -11.320 -5.992 -4.075 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -11.249 -5.752 -2.313 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -11.829 -7.298 -2.978 1.00 0.00 H new ATOM 2502 N ALA B 78 -13.817 -7.920 0.792 1.00 0.00 N ATOM 2503 CA ALA B 78 -14.131 -8.401 2.150 1.00 0.00 C ATOM 2504 C ALA B 78 -14.719 -7.351 3.119 1.00 0.00 C ATOM 2505 O ALA B 78 -15.167 -7.724 4.203 1.00 0.00 O ATOM 2506 CB ALA B 78 -12.881 -9.067 2.727 1.00 0.00 C ATOM 0 H ALA B 78 -12.820 -7.796 0.618 1.00 0.00 H new ATOM 0 HA ALA B 78 -14.946 -9.117 2.045 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -13.093 -9.430 3.733 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -12.589 -9.904 2.093 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -12.068 -8.342 2.767 1.00 0.00 H new ATOM 2512 N ASP B 79 -14.706 -6.075 2.713 1.00 0.00 N ATOM 2513 CA ASP B 79 -15.383 -4.911 3.304 1.00 0.00 C ATOM 2514 C ASP B 79 -15.137 -3.644 2.458 1.00 0.00 C ATOM 2515 O ASP B 79 -14.150 -3.510 1.728 1.00 0.00 O ATOM 2516 CB ASP B 79 -15.008 -4.656 4.789 1.00 0.00 C ATOM 2517 CG ASP B 79 -15.634 -3.366 5.365 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -16.849 -3.119 5.165 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -14.857 -2.489 5.802 1.00 0.00 O ATOM 0 H ASP B 79 -14.173 -5.805 1.887 1.00 0.00 H new ATOM 0 HA ASP B 79 -16.446 -5.150 3.296 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -15.330 -5.507 5.389 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -13.923 -4.596 4.877 1.00 0.00 H new ATOM 2524 N SER B 80 -16.044 -2.685 2.629 1.00 0.00 N ATOM 2525 CA SER B 80 -15.983 -1.285 2.202 1.00 0.00 C ATOM 2526 C SER B 80 -14.633 -0.600 2.486 1.00 0.00 C ATOM 2527 O SER B 80 -14.186 0.225 1.684 1.00 0.00 O ATOM 2528 CB SER B 80 -17.107 -0.531 2.935 1.00 0.00 C ATOM 2529 OG SER B 80 -16.924 -0.509 4.347 1.00 0.00 O ATOM 0 H SER B 80 -16.920 -2.884 3.113 1.00 0.00 H new ATOM 0 HA SER B 80 -16.102 -1.261 1.119 1.00 0.00 H new ATOM 0 HB2 SER B 80 -17.155 0.492 2.563 1.00 0.00 H new ATOM 0 HB3 SER B 80 -18.064 -0.999 2.704 1.00 0.00 H new ATOM 0 HG SER B 80 -17.004 -1.419 4.701 1.00 0.00 H new ATOM 2535 N HIS B 81 -13.932 -0.969 3.570 1.00 0.00 N ATOM 2536 CA HIS B 81 -12.564 -0.532 3.858 1.00 0.00 C ATOM 2537 C HIS B 81 -11.608 -0.837 2.710 1.00 0.00 C ATOM 2538 O HIS B 81 -10.824 0.037 2.338 1.00 0.00 O ATOM 2539 CB HIS B 81 -12.056 -1.210 5.147 1.00 0.00 C ATOM 2540 CG HIS B 81 -12.258 -0.424 6.414 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -12.706 0.880 6.512 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -11.615 -0.721 7.581 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -12.262 1.389 7.675 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -11.669 0.407 8.381 1.00 0.00 N ATOM 0 H HIS B 81 -14.312 -1.592 4.283 1.00 0.00 H new ATOM 0 HA HIS B 81 -12.590 0.550 3.989 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -12.557 -2.172 5.253 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -10.992 -1.416 5.033 1.00 0.00 H new ATOM 0 HD1 HIS B 81 -13.275 1.371 5.822 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -11.150 -1.663 7.833 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -12.364 2.417 7.991 1.00 0.00 H new ATOM 2553 N LEU B 82 -11.638 -2.056 2.160 1.00 0.00 N ATOM 2554 CA LEU B 82 -10.748 -2.408 1.050 1.00 0.00 C ATOM 2555 C LEU B 82 -11.197 -1.672 -0.201 1.00 0.00 C ATOM 2556 O LEU B 82 -10.361 -1.060 -0.846 1.00 0.00 O ATOM 2557 CB LEU B 82 -10.669 -3.922 0.797 1.00 0.00 C ATOM 2558 CG LEU B 82 -10.549 -4.794 2.064 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -10.519 -6.267 1.650 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -9.289 -4.465 2.880 1.00 0.00 C ATOM 0 H LEU B 82 -12.260 -2.806 2.461 1.00 0.00 H new ATOM 0 HA LEU B 82 -9.739 -2.099 1.323 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -11.558 -4.229 0.247 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -9.812 -4.123 0.155 1.00 0.00 H new ATOM 0 HG LEU B 82 -11.411 -4.587 2.698 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -10.434 -6.893 2.538 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -11.438 -6.514 1.118 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -9.664 -6.444 0.998 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -9.249 -5.105 3.762 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -8.404 -4.636 2.267 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -9.319 -3.421 3.191 1.00 0.00 H new ATOM 2572 N ALA B 83 -12.507 -1.641 -0.480 1.00 0.00 N ATOM 2573 CA ALA B 83 -13.075 -0.919 -1.621 1.00 0.00 C ATOM 2574 C ALA B 83 -12.632 0.557 -1.665 1.00 0.00 C ATOM 2575 O ALA B 83 -12.363 1.072 -2.746 1.00 0.00 O ATOM 2576 CB ALA B 83 -14.601 -1.059 -1.581 1.00 0.00 C ATOM 0 H ALA B 83 -13.206 -2.121 0.086 1.00 0.00 H new ATOM 0 HA ALA B 83 -12.695 -1.362 -2.542 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -15.038 -0.526 -2.426 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -14.871 -2.113 -1.639 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -14.981 -0.637 -0.650 1.00 0.00 H new ATOM 2582 N ARG B 84 -12.470 1.205 -0.500 1.00 0.00 N ATOM 2583 CA ARG B 84 -11.943 2.572 -0.380 1.00 0.00 C ATOM 2584 C ARG B 84 -10.442 2.679 -0.669 1.00 0.00 C ATOM 2585 O ARG B 84 -10.086 3.293 -1.670 1.00 0.00 O ATOM 2586 CB ARG B 84 -12.261 3.165 1.010 1.00 0.00 C ATOM 2587 CG ARG B 84 -13.373 4.221 0.960 1.00 0.00 C ATOM 2588 CD ARG B 84 -13.147 5.281 2.049 1.00 0.00 C ATOM 2589 NE ARG B 84 -14.164 6.350 1.988 1.00 0.00 N ATOM 2590 CZ ARG B 84 -14.176 7.363 1.124 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -13.241 7.523 0.212 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -15.152 8.247 1.168 1.00 0.00 N ATOM 0 H ARG B 84 -12.706 0.786 0.399 1.00 0.00 H new ATOM 0 HA ARG B 84 -12.450 3.154 -1.150 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -12.558 2.362 1.684 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -11.358 3.613 1.425 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -13.390 4.695 -0.021 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -14.343 3.745 1.101 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -13.175 4.807 3.030 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -12.154 5.716 1.934 1.00 0.00 H new ATOM 0 HE ARG B 84 -14.924 6.309 2.667 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -12.471 6.857 0.149 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -13.286 8.313 -0.432 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -15.894 8.154 1.862 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -15.166 9.025 0.508 1.00 0.00 H new ATOM 2606 N ALA B 85 -9.552 2.048 0.112 1.00 0.00 N ATOM 2607 CA ALA B 85 -8.098 2.225 -0.094 1.00 0.00 C ATOM 2608 C ALA B 85 -7.613 1.677 -1.458 1.00 0.00 C ATOM 2609 O ALA B 85 -6.556 2.063 -1.956 1.00 0.00 O ATOM 2610 CB ALA B 85 -7.337 1.658 1.109 1.00 0.00 C ATOM 0 H ALA B 85 -9.801 1.422 0.878 1.00 0.00 H new ATOM 0 HA ALA B 85 -7.879 3.291 -0.149 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -6.266 1.789 0.956 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -7.642 2.185 2.013 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -7.562 0.597 1.214 1.00 0.00 H new ATOM 2616 N LEU B 86 -8.414 0.803 -2.070 1.00 0.00 N ATOM 2617 CA LEU B 86 -8.305 0.359 -3.453 1.00 0.00 C ATOM 2618 C LEU B 86 -8.748 1.474 -4.430 1.00 0.00 C ATOM 2619 O LEU B 86 -8.035 1.770 -5.386 1.00 0.00 O ATOM 2620 CB LEU B 86 -9.235 -0.864 -3.532 1.00 0.00 C ATOM 2621 CG LEU B 86 -9.423 -1.518 -4.893 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -8.175 -2.180 -5.449 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -10.502 -2.589 -4.733 1.00 0.00 C ATOM 0 H LEU B 86 -9.197 0.365 -1.585 1.00 0.00 H new ATOM 0 HA LEU B 86 -7.281 0.115 -3.736 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -8.855 -1.620 -2.845 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -10.216 -0.564 -3.165 1.00 0.00 H new ATOM 0 HG LEU B 86 -9.690 -0.731 -5.598 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -8.399 -2.620 -6.421 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -7.387 -1.435 -5.561 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -7.842 -2.961 -4.765 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -10.668 -3.084 -5.690 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -10.179 -3.324 -3.996 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -11.430 -2.124 -4.399 1.00 0.00 H new ATOM 2635 N GLY B 87 -9.921 2.068 -4.175 1.00 0.00 N ATOM 2636 CA GLY B 87 -10.683 2.981 -5.036 1.00 0.00 C ATOM 2637 C GLY B 87 -10.259 4.448 -5.028 1.00 0.00 C ATOM 2638 O GLY B 87 -10.220 5.049 -6.099 1.00 0.00 O ATOM 0 H GLY B 87 -10.400 1.909 -3.289 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -10.619 2.614 -6.061 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -11.732 2.929 -4.743 1.00 0.00 H new ATOM 2642 N GLU B 88 -9.921 5.031 -3.866 1.00 0.00 N ATOM 2643 CA GLU B 88 -9.288 6.363 -3.816 1.00 0.00 C ATOM 2644 C GLU B 88 -7.894 6.351 -4.476 1.00 0.00 C ATOM 2645 O GLU B 88 -7.448 7.381 -4.981 1.00 0.00 O ATOM 2646 CB GLU B 88 -9.309 7.009 -2.407 1.00 0.00 C ATOM 2647 CG GLU B 88 -8.752 6.251 -1.173 1.00 0.00 C ATOM 2648 CD GLU B 88 -9.812 5.772 -0.146 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -11.027 6.046 -0.303 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -9.431 5.095 0.838 1.00 0.00 O ATOM 0 H GLU B 88 -10.074 4.605 -2.952 1.00 0.00 H new ATOM 0 HA GLU B 88 -9.909 7.027 -4.418 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -8.762 7.949 -2.478 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -10.346 7.260 -2.186 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -8.194 5.383 -1.524 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -8.043 6.900 -0.660 1.00 0.00 H new ATOM 2657 N LEU B 89 -7.281 5.156 -4.530 1.00 0.00 N ATOM 2658 CA LEU B 89 -6.097 4.746 -5.285 1.00 0.00 C ATOM 2659 C LEU B 89 -4.791 5.354 -4.760 1.00 0.00 C ATOM 2660 O LEU B 89 -4.652 6.564 -4.590 1.00 0.00 O ATOM 2661 CB LEU B 89 -6.308 5.011 -6.792 1.00 0.00 C ATOM 2662 CG LEU B 89 -5.198 4.467 -7.716 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -5.032 2.941 -7.617 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -5.502 4.849 -9.171 1.00 0.00 C ATOM 0 H LEU B 89 -7.647 4.375 -3.986 1.00 0.00 H new ATOM 0 HA LEU B 89 -5.978 3.673 -5.137 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -7.258 4.569 -7.093 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -6.393 6.087 -6.947 1.00 0.00 H new ATOM 0 HG LEU B 89 -4.262 4.919 -7.387 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -4.237 2.617 -8.289 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -4.775 2.669 -6.593 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -5.966 2.454 -7.898 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -4.716 4.463 -9.820 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -6.460 4.421 -9.467 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -5.546 5.934 -9.261 1.00 0.00 H new ATOM 2676 N VAL B 90 -3.771 4.505 -4.586 1.00 0.00 N ATOM 2677 CA VAL B 90 -2.442 4.968 -4.153 1.00 0.00 C ATOM 2678 C VAL B 90 -1.948 6.081 -5.071 1.00 0.00 C ATOM 2679 O VAL B 90 -2.067 6.033 -6.295 1.00 0.00 O ATOM 2680 CB VAL B 90 -1.346 3.890 -4.013 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -1.856 2.639 -3.281 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -0.680 3.528 -5.346 1.00 0.00 C ATOM 0 H VAL B 90 -3.837 3.498 -4.737 1.00 0.00 H new ATOM 0 HA VAL B 90 -2.608 5.325 -3.137 1.00 0.00 H new ATOM 0 HB VAL B 90 -0.569 4.340 -3.395 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -1.051 1.908 -3.206 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -2.191 2.914 -2.281 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -2.688 2.206 -3.836 1.00 0.00 H new ATOM 0 HG21 VAL B 90 0.080 2.765 -5.178 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -1.432 3.145 -6.036 1.00 0.00 H new ATOM 0 HG23 VAL B 90 -0.215 4.416 -5.773 1.00 0.00 H new ATOM 2692 N GLN B 91 -1.360 7.091 -4.451 1.00 0.00 N ATOM 2693 CA GLN B 91 -1.139 8.377 -5.087 1.00 0.00 C ATOM 2694 C GLN B 91 -0.092 8.393 -6.204 1.00 0.00 C ATOM 2695 O GLN B 91 -0.039 9.381 -6.924 1.00 0.00 O ATOM 2696 CB GLN B 91 -0.757 9.350 -3.980 1.00 0.00 C ATOM 2697 CG GLN B 91 -1.982 9.986 -3.313 1.00 0.00 C ATOM 2698 CD GLN B 91 -2.645 11.092 -4.132 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -2.294 12.258 -4.048 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -3.598 10.777 -4.984 1.00 0.00 N ATOM 0 H GLN B 91 -1.022 7.041 -3.490 1.00 0.00 H new ATOM 0 HA GLN B 91 -2.060 8.655 -5.600 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -0.168 8.827 -3.227 1.00 0.00 H new ATOM 0 HB3 GLN B 91 -0.123 10.135 -4.392 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -2.718 9.207 -3.115 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -1.683 10.395 -2.348 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -3.906 9.808 -5.070 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -4.028 11.502 -5.559 1.00 0.00 H new ATOM 2709 N VAL B 92 0.693 7.331 -6.393 1.00 0.00 N ATOM 2710 CA VAL B 92 1.793 7.189 -7.386 1.00 0.00 C ATOM 2711 C VAL B 92 1.369 7.268 -8.868 1.00 0.00 C ATOM 2712 O VAL B 92 2.036 6.742 -9.751 1.00 0.00 O ATOM 2713 CB VAL B 92 2.638 5.919 -7.100 1.00 0.00 C ATOM 2714 CG1 VAL B 92 1.992 4.636 -7.653 1.00 0.00 C ATOM 2715 CG2 VAL B 92 4.107 6.074 -7.539 1.00 0.00 C ATOM 0 H VAL B 92 0.582 6.488 -5.829 1.00 0.00 H new ATOM 0 HA VAL B 92 2.412 8.075 -7.242 1.00 0.00 H new ATOM 0 HB VAL B 92 2.652 5.807 -6.016 1.00 0.00 H new ATOM 0 HG11 VAL B 92 2.627 3.781 -7.423 1.00 0.00 H new ATOM 0 HG12 VAL B 92 1.013 4.495 -7.194 1.00 0.00 H new ATOM 0 HG13 VAL B 92 1.877 4.723 -8.733 1.00 0.00 H new ATOM 0 HG21 VAL B 92 4.652 5.157 -7.316 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.148 6.269 -8.611 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.561 6.906 -7.001 1.00 0.00 H new ATOM 2725 N VAL B 93 0.244 7.922 -9.153 1.00 0.00 N ATOM 2726 CA VAL B 93 -0.188 8.310 -10.502 1.00 0.00 C ATOM 2727 C VAL B 93 -0.631 7.080 -11.336 1.00 0.00 C ATOM 2728 O VAL B 93 -0.840 7.191 -12.539 1.00 0.00 O ATOM 2729 CB VAL B 93 0.894 9.204 -11.199 1.00 0.00 C ATOM 2730 CG1 VAL B 93 0.247 10.121 -12.250 1.00 0.00 C ATOM 2731 CG2 VAL B 93 1.619 10.163 -10.208 1.00 0.00 C ATOM 0 H VAL B 93 -0.416 8.207 -8.430 1.00 0.00 H new ATOM 0 HA VAL B 93 -1.080 8.931 -10.420 1.00 0.00 H new ATOM 0 HB VAL B 93 1.603 8.500 -11.635 1.00 0.00 H new ATOM 0 HG11 VAL B 93 1.016 10.733 -12.722 1.00 0.00 H new ATOM 0 HG12 VAL B 93 -0.249 9.513 -13.007 1.00 0.00 H new ATOM 0 HG13 VAL B 93 -0.486 10.768 -11.767 1.00 0.00 H new ATOM 0 HG21 VAL B 93 2.356 10.756 -10.749 1.00 0.00 H new ATOM 0 HG22 VAL B 93 0.889 10.827 -9.744 1.00 0.00 H new ATOM 0 HG23 VAL B 93 2.119 9.578 -9.436 1.00 0.00 H new ATOM 2741 N LEU B 94 -0.788 5.919 -10.664 1.00 0.00 N ATOM 2742 CA LEU B 94 -1.010 4.566 -11.198 1.00 0.00 C ATOM 2743 C LEU B 94 0.330 3.991 -11.708 1.00 0.00 C ATOM 2744 O LEU B 94 0.778 4.318 -12.801 1.00 0.00 O ATOM 2745 CB LEU B 94 -2.149 4.548 -12.249 1.00 0.00 C ATOM 2746 CG LEU B 94 -2.909 3.212 -12.366 1.00 0.00 C ATOM 2747 CD1 LEU B 94 -4.013 3.338 -13.425 1.00 0.00 C ATOM 2748 CD2 LEU B 94 -2.004 2.025 -12.717 1.00 0.00 C ATOM 0 H LEU B 94 -0.759 5.908 -9.644 1.00 0.00 H new ATOM 0 HA LEU B 94 -1.359 3.906 -10.403 1.00 0.00 H new ATOM 0 HB2 LEU B 94 -2.863 5.334 -12.002 1.00 0.00 H new ATOM 0 HB3 LEU B 94 -1.727 4.795 -13.223 1.00 0.00 H new ATOM 0 HG LEU B 94 -3.334 3.008 -11.383 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -4.549 2.392 -13.506 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -4.708 4.125 -13.134 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -3.567 3.586 -14.388 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -2.604 1.117 -12.783 1.00 0.00 H new ATOM 0 HD22 LEU B 94 -1.517 2.209 -13.675 1.00 0.00 H new ATOM 0 HD23 LEU B 94 -1.247 1.903 -11.943 1.00 0.00 H new ATOM 2760 N ALA B 95 0.968 3.139 -10.898 1.00 0.00 N ATOM 2761 CA ALA B 95 2.241 2.496 -11.232 1.00 0.00 C ATOM 2762 C ALA B 95 2.077 1.332 -12.236 1.00 0.00 C ATOM 2763 O ALA B 95 1.003 0.729 -12.321 1.00 0.00 O ATOM 2764 CB ALA B 95 2.916 2.022 -9.932 1.00 0.00 C ATOM 0 H ALA B 95 0.609 2.874 -9.981 1.00 0.00 H new ATOM 0 HA ALA B 95 2.874 3.230 -11.731 1.00 0.00 H new ATOM 0 HB1 ALA B 95 3.865 1.541 -10.169 1.00 0.00 H new ATOM 0 HB2 ALA B 95 3.095 2.878 -9.282 1.00 0.00 H new ATOM 0 HB3 ALA B 95 2.266 1.310 -9.423 1.00 0.00 H new