USER MOD reduce.3.24.130724 H: found=0, std=0, add=1142, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1140 hydrogens (55 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 29 TYR OH : rot 30:sc= 0.977 USER MOD Set 1.2: A 97 THR OG1 : rot -115:sc= 1.03 USER MOD Set 2.1: A 77 SER OG : rot -121:sc= 1.76 USER MOD Set 2.2: A 300 PBU O6 : rot -7:sc= 1.62 USER MOD Set 3.1: A 72 SER OG : rot 180:sc= -0.0802 USER MOD Set 3.2: A 74 ASN : amide:sc= 0 X(o=-0.08,f=-0.08) USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 SER OG : rot 93:sc= 0.329 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0103) USER MOD Single : A 27 LYS NZ :NH3+ -117:sc= 0.783 (180deg=-0.228) USER MOD Single : A 28 LYS NZ :NH3+ -166:sc= 0.117 (180deg=-0.0707) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= 0.205 K(o=0.21,f=-7.3!) USER MOD Single : A 39 ASN : amide:sc= -0.167 K(o=-0.17,f=-1!) USER MOD Single : A 40 LYS NZ :NH3+ -124:sc= -0.136 (180deg=-1.12) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 132:sc= 0.822 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 CYS SG : rot 120:sc= 0 USER MOD Single : A 58 GLN : amide:sc=-0.00422 X(o=-0.0042,f=-0.48) USER MOD Single : A 59 LYS NZ :NH3+ 139:sc= 0.56 (180deg=-0.115) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 178:sc= -2.37 (180deg=-2.39) USER MOD Single : A 70 THR OG1 : rot -84:sc= 0.465 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= -0.213 K(o=-0.21,f=-1.3) USER MOD Single : A 81 THR OG1 : rot 74:sc= 1.2 USER MOD Single : A 83 CYS SG : rot 150:sc= -0.0231 USER MOD Single : A 87 CYS SG : rot 180:sc= 0 USER MOD Single : A 89 HIS : no HD1:sc= -1.02 K(o=-1,f=-4.3!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 GLN : amide:sc= -0.039 K(o=-0.039,f=-1.6!) USER MOD Single : A 107 HIS : no HD1:sc= -2.04! C(o=-2!,f=-3.3!) USER MOD Single : A 112 THR OG1 : rot 72:sc= 1.18 USER MOD Single : A 114 THR OG1 : rot -52:sc= 1.01 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.0201 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot -48:sc= 0.699 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 ASN : amide:sc=-0.00104 K(o=-0.001,f=-1.4!) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 300 PBU O2 : rot -155:sc= 0.0616 USER MOD Single : A 300 PBU O3 : rot 159:sc= 0.396 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 6.845 9.926 3.385 1.00 62.44 N ATOM 2 CA GLY A 2 7.178 10.055 4.792 1.00 54.32 C ATOM 3 C GLY A 2 5.987 9.804 5.696 1.00 5.44 C ATOM 4 O GLY A 2 4.996 10.532 5.645 1.00 11.41 O ATOM 0 HA2 GLY A 2 7.973 9.351 5.040 1.00 54.32 H new ATOM 0 HA3 GLY A 2 7.568 11.055 4.980 1.00 54.32 H new ATOM 8 N ALA A 3 6.082 8.768 6.523 1.00 50.14 N ATOM 9 CA ALA A 3 5.003 8.423 7.442 1.00 13.44 C ATOM 10 C ALA A 3 5.463 7.388 8.463 1.00 41.04 C ATOM 11 O ALA A 3 6.553 6.829 8.346 1.00 33.01 O ATOM 12 CB ALA A 3 3.798 7.908 6.670 1.00 31.53 C ATOM 0 H ALA A 3 6.894 8.153 6.576 1.00 50.14 H new ATOM 0 HA ALA A 3 4.715 9.325 7.983 1.00 13.44 H new ATOM 0 HB1 ALA A 3 3.000 7.654 7.368 1.00 31.53 H new ATOM 0 HB2 ALA A 3 3.448 8.680 5.984 1.00 31.53 H new ATOM 0 HB3 ALA A 3 4.081 7.021 6.104 1.00 31.53 H new ATOM 18 N ARG A 4 4.625 7.139 9.464 1.00 52.01 N ATOM 19 CA ARG A 4 4.947 6.173 10.507 1.00 64.00 C ATOM 20 C ARG A 4 3.992 4.984 10.459 1.00 64.23 C ATOM 21 O ARG A 4 4.348 3.872 10.847 1.00 54.45 O ATOM 22 CB ARG A 4 4.883 6.837 11.884 1.00 25.22 C ATOM 23 CG ARG A 4 6.207 7.429 12.336 1.00 42.51 C ATOM 24 CD ARG A 4 6.477 8.767 11.664 1.00 61.12 C ATOM 25 NE ARG A 4 6.089 9.892 12.511 1.00 54.50 N ATOM 26 CZ ARG A 4 5.934 11.132 12.060 1.00 2.32 C ATOM 27 NH1 ARG A 4 6.130 11.403 10.777 1.00 14.21 N ATOM 28 NH2 ARG A 4 5.579 12.103 12.892 1.00 14.10 N ATOM 0 H ARG A 4 3.718 7.593 9.575 1.00 52.01 H new ATOM 0 HA ARG A 4 5.960 5.811 10.333 1.00 64.00 H new ATOM 0 HB2 ARG A 4 4.130 7.625 11.863 1.00 25.22 H new ATOM 0 HB3 ARG A 4 4.554 6.101 12.618 1.00 25.22 H new ATOM 0 HG2 ARG A 4 6.198 7.559 13.418 1.00 42.51 H new ATOM 0 HG3 ARG A 4 7.015 6.735 12.105 1.00 42.51 H new ATOM 0 HD2 ARG A 4 7.537 8.844 11.422 1.00 61.12 H new ATOM 0 HD3 ARG A 4 5.931 8.817 10.722 1.00 61.12 H new ATOM 0 HE ARG A 4 5.928 9.716 13.503 1.00 54.50 H new ATOM 0 HH11 ARG A 4 6.400 10.659 10.134 1.00 14.21 H new ATOM 0 HH12 ARG A 4 6.010 12.356 10.433 1.00 14.21 H new ATOM 0 HH21 ARG A 4 5.425 11.898 13.879 1.00 14.10 H new ATOM 0 HH22 ARG A 4 5.460 13.055 12.544 1.00 14.10 H new ATOM 42 N ASN A 5 2.776 5.227 9.980 1.00 25.42 N ATOM 43 CA ASN A 5 1.769 4.176 9.882 1.00 73.34 C ATOM 44 C ASN A 5 1.622 3.694 8.442 1.00 55.51 C ATOM 45 O ASN A 5 1.938 2.548 8.124 1.00 70.12 O ATOM 46 CB ASN A 5 0.422 4.681 10.403 1.00 2.51 C ATOM 47 CG ASN A 5 0.449 4.969 11.891 1.00 70.53 C ATOM 48 OD1 ASN A 5 0.360 6.122 12.314 1.00 24.43 O ATOM 49 ND2 ASN A 5 0.572 3.919 12.695 1.00 34.21 N ATOM 0 H ASN A 5 2.464 6.142 9.654 1.00 25.42 H new ATOM 0 HA ASN A 5 2.096 3.336 10.495 1.00 73.34 H new ATOM 0 HB2 ASN A 5 0.144 5.588 9.865 1.00 2.51 H new ATOM 0 HB3 ASN A 5 -0.347 3.938 10.193 1.00 2.51 H new ATOM 0 HD21 ASN A 5 0.596 4.051 13.706 1.00 34.21 H new ATOM 0 HD22 ASN A 5 0.643 2.981 12.301 1.00 34.21 H new ATOM 56 N SER A 6 1.142 4.580 7.575 1.00 4.35 N ATOM 57 CA SER A 6 0.950 4.246 6.168 1.00 21.31 C ATOM 58 C SER A 6 1.168 5.470 5.284 1.00 22.24 C ATOM 59 O SER A 6 0.981 6.606 5.720 1.00 73.31 O ATOM 60 CB SER A 6 -0.455 3.683 5.942 1.00 74.02 C ATOM 61 OG SER A 6 -0.400 2.338 5.503 1.00 24.41 O ATOM 0 H SER A 6 0.879 5.534 7.822 1.00 4.35 H new ATOM 0 HA SER A 6 1.685 3.488 5.897 1.00 21.31 H new ATOM 0 HB2 SER A 6 -1.028 3.744 6.867 1.00 74.02 H new ATOM 0 HB3 SER A 6 -0.979 4.289 5.203 1.00 74.02 H new ATOM 0 HG SER A 6 -0.460 1.739 6.276 1.00 24.41 H new ATOM 67 N VAL A 7 1.564 5.229 4.038 1.00 54.23 N ATOM 68 CA VAL A 7 1.807 6.311 3.091 1.00 73.34 C ATOM 69 C VAL A 7 0.513 6.751 2.415 1.00 34.12 C ATOM 70 O VAL A 7 0.238 7.945 2.294 1.00 71.55 O ATOM 71 CB VAL A 7 2.822 5.893 2.011 1.00 31.14 C ATOM 72 CG1 VAL A 7 3.082 7.043 1.049 1.00 34.00 C ATOM 73 CG2 VAL A 7 4.118 5.419 2.651 1.00 41.32 C ATOM 0 H VAL A 7 1.723 4.295 3.661 1.00 54.23 H new ATOM 0 HA VAL A 7 2.217 7.145 3.661 1.00 73.34 H new ATOM 0 HB VAL A 7 2.400 5.064 1.443 1.00 31.14 H new ATOM 0 HG11 VAL A 7 3.802 6.729 0.293 1.00 34.00 H new ATOM 0 HG12 VAL A 7 2.149 7.330 0.565 1.00 34.00 H new ATOM 0 HG13 VAL A 7 3.482 7.894 1.599 1.00 34.00 H new ATOM 0 HG21 VAL A 7 4.823 5.128 1.872 1.00 41.32 H new ATOM 0 HG22 VAL A 7 4.547 6.226 3.245 1.00 41.32 H new ATOM 0 HG23 VAL A 7 3.914 4.563 3.295 1.00 41.32 H new ATOM 83 N LEU A 8 -0.277 5.778 1.976 1.00 4.22 N ATOM 84 CA LEU A 8 -1.545 6.064 1.312 1.00 20.02 C ATOM 85 C LEU A 8 -2.542 6.683 2.285 1.00 25.31 C ATOM 86 O LEU A 8 -2.239 6.874 3.463 1.00 30.21 O ATOM 87 CB LEU A 8 -2.129 4.784 0.711 1.00 35.54 C ATOM 88 CG LEU A 8 -1.982 4.627 -0.803 1.00 24.41 C ATOM 89 CD1 LEU A 8 -2.591 3.311 -1.264 1.00 22.31 C ATOM 90 CD2 LEU A 8 -2.631 5.799 -1.526 1.00 32.41 C ATOM 0 H LEU A 8 -0.063 4.785 2.067 1.00 4.22 H new ATOM 0 HA LEU A 8 -1.354 6.780 0.512 1.00 20.02 H new ATOM 0 HB2 LEU A 8 -1.653 3.930 1.193 1.00 35.54 H new ATOM 0 HB3 LEU A 8 -3.189 4.740 0.960 1.00 35.54 H new ATOM 0 HG LEU A 8 -0.920 4.618 -1.047 1.00 24.41 H new ATOM 0 HD11 LEU A 8 -2.477 3.216 -2.344 1.00 22.31 H new ATOM 0 HD12 LEU A 8 -2.082 2.482 -0.771 1.00 22.31 H new ATOM 0 HD13 LEU A 8 -3.650 3.291 -1.007 1.00 22.31 H new ATOM 0 HD21 LEU A 8 -2.517 5.671 -2.602 1.00 32.41 H new ATOM 0 HD22 LEU A 8 -3.691 5.839 -1.276 1.00 32.41 H new ATOM 0 HD23 LEU A 8 -2.150 6.728 -1.218 1.00 32.41 H new ATOM 102 N ARG A 9 -3.735 6.992 1.786 1.00 32.13 N ATOM 103 CA ARG A 9 -4.778 7.588 2.612 1.00 40.34 C ATOM 104 C ARG A 9 -5.113 6.688 3.797 1.00 65.20 C ATOM 105 O ARG A 9 -4.546 5.607 3.949 1.00 3.13 O ATOM 106 CB ARG A 9 -6.035 7.844 1.779 1.00 21.52 C ATOM 107 CG ARG A 9 -5.845 8.892 0.695 1.00 23.13 C ATOM 108 CD ARG A 9 -6.068 8.308 -0.692 1.00 61.24 C ATOM 109 NE ARG A 9 -7.475 8.348 -1.082 1.00 45.10 N ATOM 110 CZ ARG A 9 -7.903 8.106 -2.316 1.00 14.40 C ATOM 111 NH1 ARG A 9 -7.036 7.809 -3.275 1.00 61.14 N ATOM 112 NH2 ARG A 9 -9.199 8.162 -2.593 1.00 1.23 N ATOM 0 H ARG A 9 -4.003 6.839 0.814 1.00 32.13 H new ATOM 0 HA ARG A 9 -4.405 8.538 2.994 1.00 40.34 H new ATOM 0 HB2 ARG A 9 -6.351 6.909 1.317 1.00 21.52 H new ATOM 0 HB3 ARG A 9 -6.841 8.160 2.441 1.00 21.52 H new ATOM 0 HG2 ARG A 9 -6.539 9.717 0.859 1.00 23.13 H new ATOM 0 HG3 ARG A 9 -4.838 9.305 0.759 1.00 23.13 H new ATOM 0 HD2 ARG A 9 -5.474 8.863 -1.419 1.00 61.24 H new ATOM 0 HD3 ARG A 9 -5.715 7.277 -0.712 1.00 61.24 H new ATOM 0 HE ARG A 9 -8.167 8.574 -0.368 1.00 45.10 H new ATOM 0 HH11 ARG A 9 -6.039 7.766 -3.065 1.00 61.14 H new ATOM 0 HH12 ARG A 9 -7.367 7.623 -4.222 1.00 61.14 H new ATOM 0 HH21 ARG A 9 -9.868 8.391 -1.858 1.00 1.23 H new ATOM 0 HH22 ARG A 9 -9.526 7.976 -3.541 1.00 1.23 H new ATOM 126 N GLY A 10 -6.041 7.143 4.635 1.00 32.43 N ATOM 127 CA GLY A 10 -6.436 6.366 5.796 1.00 63.01 C ATOM 128 C GLY A 10 -7.226 5.127 5.423 1.00 70.01 C ATOM 129 O GLY A 10 -6.880 4.017 5.824 1.00 73.53 O ATOM 0 H GLY A 10 -6.525 8.035 4.531 1.00 32.43 H new ATOM 0 HA2 GLY A 10 -5.546 6.072 6.352 1.00 63.01 H new ATOM 0 HA3 GLY A 10 -7.035 6.989 6.460 1.00 63.01 H new ATOM 133 N LYS A 11 -8.294 5.318 4.654 1.00 75.43 N ATOM 134 CA LYS A 11 -9.136 4.207 4.227 1.00 70.31 C ATOM 135 C LYS A 11 -8.339 3.207 3.397 1.00 74.42 C ATOM 136 O LYS A 11 -8.440 1.995 3.599 1.00 40.51 O ATOM 137 CB LYS A 11 -10.325 4.726 3.416 1.00 4.30 C ATOM 138 CG LYS A 11 -11.457 3.721 3.283 1.00 61.25 C ATOM 139 CD LYS A 11 -12.366 4.054 2.113 1.00 14.25 C ATOM 140 CE LYS A 11 -12.981 2.801 1.510 1.00 41.20 C ATOM 141 NZ LYS A 11 -13.313 2.983 0.070 1.00 74.22 N ATOM 0 H LYS A 11 -8.596 6.231 4.314 1.00 75.43 H new ATOM 0 HA LYS A 11 -9.505 3.699 5.118 1.00 70.31 H new ATOM 0 HB2 LYS A 11 -10.708 5.631 3.887 1.00 4.30 H new ATOM 0 HB3 LYS A 11 -9.980 5.006 2.421 1.00 4.30 H new ATOM 0 HG2 LYS A 11 -11.043 2.721 3.150 1.00 61.25 H new ATOM 0 HG3 LYS A 11 -12.040 3.705 4.204 1.00 61.25 H new ATOM 0 HD2 LYS A 11 -13.158 4.725 2.446 1.00 14.25 H new ATOM 0 HD3 LYS A 11 -11.798 4.585 1.349 1.00 14.25 H new ATOM 0 HE2 LYS A 11 -12.288 1.967 1.620 1.00 41.20 H new ATOM 0 HE3 LYS A 11 -13.885 2.539 2.061 1.00 41.20 H new ATOM 0 HZ1 LYS A 11 -13.730 2.107 -0.304 1.00 74.22 H new ATOM 0 HZ2 LYS A 11 -13.994 3.762 -0.033 1.00 74.22 H new ATOM 0 HZ3 LYS A 11 -12.447 3.208 -0.460 1.00 74.22 H new ATOM 155 N LYS A 12 -7.544 3.719 2.463 1.00 72.13 N ATOM 156 CA LYS A 12 -6.727 2.871 1.604 1.00 31.33 C ATOM 157 C LYS A 12 -5.681 2.117 2.419 1.00 40.25 C ATOM 158 O LYS A 12 -5.459 0.925 2.212 1.00 52.21 O ATOM 159 CB LYS A 12 -6.040 3.713 0.527 1.00 54.32 C ATOM 160 CG LYS A 12 -7.010 4.449 -0.381 1.00 20.41 C ATOM 161 CD LYS A 12 -7.442 3.583 -1.552 1.00 3.51 C ATOM 162 CE LYS A 12 -8.766 4.055 -2.135 1.00 62.20 C ATOM 163 NZ LYS A 12 -9.929 3.436 -1.444 1.00 64.34 N ATOM 0 H LYS A 12 -7.449 4.718 2.282 1.00 72.13 H new ATOM 0 HA LYS A 12 -7.382 2.143 1.125 1.00 31.33 H new ATOM 0 HB2 LYS A 12 -5.384 4.439 1.008 1.00 54.32 H new ATOM 0 HB3 LYS A 12 -5.407 3.065 -0.080 1.00 54.32 H new ATOM 0 HG2 LYS A 12 -7.887 4.753 0.191 1.00 20.41 H new ATOM 0 HG3 LYS A 12 -6.541 5.360 -0.754 1.00 20.41 H new ATOM 0 HD2 LYS A 12 -6.674 3.605 -2.325 1.00 3.51 H new ATOM 0 HD3 LYS A 12 -7.536 2.547 -1.225 1.00 3.51 H new ATOM 0 HE2 LYS A 12 -8.832 5.140 -2.055 1.00 62.20 H new ATOM 0 HE3 LYS A 12 -8.803 3.811 -3.197 1.00 62.20 H new ATOM 0 HZ1 LYS A 12 -10.812 3.783 -1.871 1.00 64.34 H new ATOM 0 HZ2 LYS A 12 -9.881 2.402 -1.542 1.00 64.34 H new ATOM 0 HZ3 LYS A 12 -9.909 3.690 -0.436 1.00 64.34 H new ATOM 177 N ALA A 13 -5.041 2.821 3.349 1.00 23.14 N ATOM 178 CA ALA A 13 -4.022 2.218 4.198 1.00 23.34 C ATOM 179 C ALA A 13 -4.543 0.950 4.865 1.00 20.55 C ATOM 180 O ALA A 13 -3.808 -0.024 5.029 1.00 31.13 O ATOM 181 CB ALA A 13 -3.552 3.214 5.247 1.00 60.31 C ATOM 0 H ALA A 13 -5.211 3.810 3.532 1.00 23.14 H new ATOM 0 HA ALA A 13 -3.175 1.944 3.568 1.00 23.34 H new ATOM 0 HB1 ALA A 13 -2.791 2.750 5.874 1.00 60.31 H new ATOM 0 HB2 ALA A 13 -3.131 4.090 4.754 1.00 60.31 H new ATOM 0 HB3 ALA A 13 -4.397 3.517 5.866 1.00 60.31 H new ATOM 187 N ASP A 14 -5.815 0.967 5.247 1.00 54.41 N ATOM 188 CA ASP A 14 -6.435 -0.181 5.896 1.00 74.45 C ATOM 189 C ASP A 14 -6.366 -1.414 5.000 1.00 72.53 C ATOM 190 O ASP A 14 -5.845 -2.456 5.401 1.00 4.31 O ATOM 191 CB ASP A 14 -7.890 0.127 6.248 1.00 3.41 C ATOM 192 CG ASP A 14 -8.340 -0.565 7.519 1.00 75.14 C ATOM 193 OD1 ASP A 14 -7.589 -1.427 8.021 1.00 72.10 O ATOM 194 OD2 ASP A 14 -9.442 -0.247 8.012 1.00 2.52 O ATOM 0 H ASP A 14 -6.437 1.765 5.118 1.00 54.41 H new ATOM 0 HA ASP A 14 -5.884 -0.388 6.814 1.00 74.45 H new ATOM 0 HB2 ASP A 14 -8.012 1.204 6.362 1.00 3.41 H new ATOM 0 HB3 ASP A 14 -8.533 -0.181 5.423 1.00 3.41 H new ATOM 199 N GLU A 15 -6.895 -1.289 3.788 1.00 12.12 N ATOM 200 CA GLU A 15 -6.894 -2.394 2.836 1.00 24.11 C ATOM 201 C GLU A 15 -5.491 -2.971 2.674 1.00 70.33 C ATOM 202 O GLU A 15 -5.311 -4.189 2.618 1.00 10.32 O ATOM 203 CB GLU A 15 -7.426 -1.928 1.479 1.00 72.44 C ATOM 204 CG GLU A 15 -8.730 -2.596 1.074 1.00 73.33 C ATOM 205 CD GLU A 15 -9.940 -1.723 1.340 1.00 52.21 C ATOM 206 OE1 GLU A 15 -9.969 -0.580 0.837 1.00 63.44 O ATOM 207 OE2 GLU A 15 -10.858 -2.183 2.052 1.00 14.00 O ATOM 0 H GLU A 15 -7.330 -0.434 3.441 1.00 12.12 H new ATOM 0 HA GLU A 15 -7.547 -3.176 3.225 1.00 24.11 H new ATOM 0 HB2 GLU A 15 -7.574 -0.848 1.508 1.00 72.44 H new ATOM 0 HB3 GLU A 15 -6.674 -2.126 0.716 1.00 72.44 H new ATOM 0 HG2 GLU A 15 -8.692 -2.845 0.013 1.00 73.33 H new ATOM 0 HG3 GLU A 15 -8.837 -3.535 1.618 1.00 73.33 H new ATOM 214 N LEU A 16 -4.500 -2.091 2.599 1.00 53.42 N ATOM 215 CA LEU A 16 -3.112 -2.511 2.443 1.00 74.24 C ATOM 216 C LEU A 16 -2.648 -3.317 3.652 1.00 34.23 C ATOM 217 O LEU A 16 -2.062 -4.389 3.507 1.00 34.31 O ATOM 218 CB LEU A 16 -2.208 -1.292 2.251 1.00 30.22 C ATOM 219 CG LEU A 16 -0.808 -1.575 1.701 1.00 24.11 C ATOM 220 CD1 LEU A 16 0.063 -2.221 2.767 1.00 12.32 C ATOM 221 CD2 LEU A 16 -0.890 -2.461 0.467 1.00 54.11 C ATOM 0 H LEU A 16 -4.632 -1.081 2.644 1.00 53.42 H new ATOM 0 HA LEU A 16 -3.048 -3.146 1.559 1.00 74.24 H new ATOM 0 HB2 LEU A 16 -2.708 -0.596 1.577 1.00 30.22 H new ATOM 0 HB3 LEU A 16 -2.104 -0.787 3.211 1.00 30.22 H new ATOM 0 HG LEU A 16 -0.352 -0.628 1.414 1.00 24.11 H new ATOM 0 HD11 LEU A 16 1.055 -2.415 2.358 1.00 12.32 H new ATOM 0 HD12 LEU A 16 0.148 -1.551 3.623 1.00 12.32 H new ATOM 0 HD13 LEU A 16 -0.388 -3.161 3.085 1.00 12.32 H new ATOM 0 HD21 LEU A 16 0.114 -2.652 0.089 1.00 54.11 H new ATOM 0 HD22 LEU A 16 -1.365 -3.406 0.729 1.00 54.11 H new ATOM 0 HD23 LEU A 16 -1.478 -1.960 -0.302 1.00 54.11 H new ATOM 233 N GLU A 17 -2.917 -2.794 4.845 1.00 22.23 N ATOM 234 CA GLU A 17 -2.528 -3.467 6.078 1.00 42.31 C ATOM 235 C GLU A 17 -3.351 -4.735 6.289 1.00 21.21 C ATOM 236 O GLU A 17 -3.035 -5.556 7.150 1.00 34.34 O ATOM 237 CB GLU A 17 -2.702 -2.528 7.274 1.00 52.23 C ATOM 238 CG GLU A 17 -1.392 -2.144 7.941 1.00 2.34 C ATOM 239 CD GLU A 17 -1.131 -0.650 7.897 1.00 63.43 C ATOM 240 OE1 GLU A 17 -1.597 0.061 8.811 1.00 51.24 O ATOM 241 OE2 GLU A 17 -0.461 -0.194 6.947 1.00 71.14 O ATOM 0 H GLU A 17 -3.402 -1.907 4.983 1.00 22.23 H new ATOM 0 HA GLU A 17 -1.478 -3.746 5.994 1.00 42.31 H new ATOM 0 HB2 GLU A 17 -3.211 -1.623 6.943 1.00 52.23 H new ATOM 0 HB3 GLU A 17 -3.348 -3.006 8.010 1.00 52.23 H new ATOM 0 HG2 GLU A 17 -1.406 -2.476 8.979 1.00 2.34 H new ATOM 0 HG3 GLU A 17 -0.571 -2.667 7.450 1.00 2.34 H new ATOM 248 N ARG A 18 -4.408 -4.886 5.498 1.00 10.12 N ATOM 249 CA ARG A 18 -5.277 -6.052 5.600 1.00 24.15 C ATOM 250 C ARG A 18 -4.806 -7.164 4.667 1.00 31.01 C ATOM 251 O ARG A 18 -4.730 -8.328 5.061 1.00 11.31 O ATOM 252 CB ARG A 18 -6.720 -5.669 5.266 1.00 31.33 C ATOM 253 CG ARG A 18 -7.751 -6.649 5.803 1.00 13.35 C ATOM 254 CD ARG A 18 -8.417 -6.122 7.064 1.00 54.14 C ATOM 255 NE ARG A 18 -9.025 -7.191 7.850 1.00 63.21 N ATOM 256 CZ ARG A 18 -9.533 -7.013 9.064 1.00 74.22 C ATOM 257 NH1 ARG A 18 -9.505 -5.814 9.629 1.00 50.21 N ATOM 258 NH2 ARG A 18 -10.071 -8.036 9.716 1.00 73.33 N ATOM 0 H ARG A 18 -4.683 -4.216 4.780 1.00 10.12 H new ATOM 0 HA ARG A 18 -5.233 -6.419 6.626 1.00 24.15 H new ATOM 0 HB2 ARG A 18 -6.927 -4.679 5.671 1.00 31.33 H new ATOM 0 HB3 ARG A 18 -6.827 -5.599 4.184 1.00 31.33 H new ATOM 0 HG2 ARG A 18 -8.508 -6.836 5.041 1.00 13.35 H new ATOM 0 HG3 ARG A 18 -7.270 -7.604 6.016 1.00 13.35 H new ATOM 0 HD2 ARG A 18 -7.679 -5.600 7.673 1.00 54.14 H new ATOM 0 HD3 ARG A 18 -9.180 -5.393 6.793 1.00 54.14 H new ATOM 0 HE ARG A 18 -9.062 -8.126 7.445 1.00 63.21 H new ATOM 0 HH11 ARG A 18 -9.092 -5.025 9.131 1.00 50.21 H new ATOM 0 HH12 ARG A 18 -9.896 -5.680 10.562 1.00 50.21 H new ATOM 0 HH21 ARG A 18 -10.095 -8.960 9.285 1.00 73.33 H new ATOM 0 HH22 ARG A 18 -10.461 -7.898 10.648 1.00 73.33 H new ATOM 272 N ILE A 19 -4.491 -6.797 3.429 1.00 23.45 N ATOM 273 CA ILE A 19 -4.028 -7.764 2.441 1.00 55.42 C ATOM 274 C ILE A 19 -2.877 -8.600 2.989 1.00 23.03 C ATOM 275 O ILE A 19 -1.926 -8.068 3.560 1.00 51.14 O ATOM 276 CB ILE A 19 -3.570 -7.068 1.145 1.00 51.04 C ATOM 277 CG1 ILE A 19 -4.725 -6.273 0.532 1.00 33.33 C ATOM 278 CG2 ILE A 19 -3.040 -8.092 0.153 1.00 31.34 C ATOM 279 CD1 ILE A 19 -4.296 -4.955 -0.075 1.00 24.23 C ATOM 0 H ILE A 19 -4.548 -5.838 3.087 1.00 23.45 H new ATOM 0 HA ILE A 19 -4.873 -8.415 2.216 1.00 55.42 H new ATOM 0 HB ILE A 19 -2.764 -6.375 1.387 1.00 51.04 H new ATOM 0 HG12 ILE A 19 -5.205 -6.879 -0.237 1.00 33.33 H new ATOM 0 HG13 ILE A 19 -5.473 -6.083 1.301 1.00 33.33 H new ATOM 0 HG21 ILE A 19 -2.720 -7.585 -0.757 1.00 31.34 H new ATOM 0 HG22 ILE A 19 -2.193 -8.619 0.592 1.00 31.34 H new ATOM 0 HG23 ILE A 19 -3.827 -8.807 -0.087 1.00 31.34 H new ATOM 0 HD11 ILE A 19 -5.165 -4.446 -0.490 1.00 24.23 H new ATOM 0 HD12 ILE A 19 -3.843 -4.330 0.695 1.00 24.23 H new ATOM 0 HD13 ILE A 19 -3.570 -5.138 -0.867 1.00 24.23 H new ATOM 291 N ARG A 20 -2.969 -9.914 2.809 1.00 4.51 N ATOM 292 CA ARG A 20 -1.936 -10.825 3.285 1.00 13.14 C ATOM 293 C ARG A 20 -1.127 -11.386 2.119 1.00 12.53 C ATOM 294 O ARG A 20 -1.649 -11.568 1.017 1.00 52.05 O ATOM 295 CB ARG A 20 -2.563 -11.970 4.082 1.00 20.40 C ATOM 296 CG ARG A 20 -2.859 -11.614 5.529 1.00 20.01 C ATOM 297 CD ARG A 20 -4.351 -11.670 5.823 1.00 15.12 C ATOM 298 NE ARG A 20 -4.915 -12.986 5.538 1.00 23.30 N ATOM 299 CZ ARG A 20 -6.196 -13.290 5.714 1.00 30.05 C ATOM 300 NH1 ARG A 20 -7.041 -12.376 6.170 1.00 11.01 N ATOM 301 NH2 ARG A 20 -6.635 -14.511 5.431 1.00 50.24 N ATOM 0 H ARG A 20 -3.749 -10.371 2.337 1.00 4.51 H new ATOM 0 HA ARG A 20 -1.264 -10.265 3.935 1.00 13.14 H new ATOM 0 HB2 ARG A 20 -3.489 -12.276 3.595 1.00 20.40 H new ATOM 0 HB3 ARG A 20 -1.892 -12.828 4.058 1.00 20.40 H new ATOM 0 HG2 ARG A 20 -2.331 -12.302 6.189 1.00 20.01 H new ATOM 0 HG3 ARG A 20 -2.482 -10.614 5.743 1.00 20.01 H new ATOM 0 HD2 ARG A 20 -4.524 -11.420 6.870 1.00 15.12 H new ATOM 0 HD3 ARG A 20 -4.867 -10.917 5.226 1.00 15.12 H new ATOM 0 HE ARG A 20 -4.291 -13.712 5.184 1.00 23.30 H new ATOM 0 HH11 ARG A 20 -6.708 -11.437 6.387 1.00 11.01 H new ATOM 0 HH12 ARG A 20 -8.024 -12.612 6.304 1.00 11.01 H new ATOM 0 HH21 ARG A 20 -5.988 -15.216 5.078 1.00 50.24 H new ATOM 0 HH22 ARG A 20 -7.619 -14.743 5.567 1.00 50.24 H new ATOM 315 N LEU A 21 0.149 -11.658 2.367 1.00 53.24 N ATOM 316 CA LEU A 21 1.031 -12.198 1.338 1.00 53.24 C ATOM 317 C LEU A 21 0.495 -13.519 0.800 1.00 65.42 C ATOM 318 O LEU A 21 0.823 -13.926 -0.315 1.00 62.34 O ATOM 319 CB LEU A 21 2.440 -12.396 1.900 1.00 51.12 C ATOM 320 CG LEU A 21 3.182 -11.126 2.316 1.00 14.12 C ATOM 321 CD1 LEU A 21 4.528 -11.473 2.935 1.00 40.25 C ATOM 322 CD2 LEU A 21 3.366 -10.200 1.122 1.00 74.35 C ATOM 0 H LEU A 21 0.597 -11.514 3.272 1.00 53.24 H new ATOM 0 HA LEU A 21 1.071 -11.483 0.516 1.00 53.24 H new ATOM 0 HB2 LEU A 21 2.375 -13.055 2.766 1.00 51.12 H new ATOM 0 HB3 LEU A 21 3.039 -12.913 1.151 1.00 51.12 H new ATOM 0 HG LEU A 21 2.583 -10.607 3.064 1.00 14.12 H new ATOM 0 HD11 LEU A 21 5.042 -10.557 3.225 1.00 40.25 H new ATOM 0 HD12 LEU A 21 4.374 -12.097 3.815 1.00 40.25 H new ATOM 0 HD13 LEU A 21 5.134 -12.014 2.208 1.00 40.25 H new ATOM 0 HD21 LEU A 21 3.896 -9.301 1.437 1.00 74.35 H new ATOM 0 HD22 LEU A 21 3.943 -10.710 0.351 1.00 74.35 H new ATOM 0 HD23 LEU A 21 2.390 -9.924 0.722 1.00 74.35 H new ATOM 334 N ARG A 22 -0.334 -14.185 1.598 1.00 73.35 N ATOM 335 CA ARG A 22 -0.916 -15.461 1.202 1.00 64.32 C ATOM 336 C ARG A 22 -2.377 -15.550 1.637 1.00 12.54 C ATOM 337 O ARG A 22 -2.830 -14.828 2.525 1.00 23.44 O ATOM 338 CB ARG A 22 -0.121 -16.620 1.808 1.00 5.32 C ATOM 339 CG ARG A 22 0.747 -17.354 0.800 1.00 64.41 C ATOM 340 CD ARG A 22 1.189 -18.711 1.329 1.00 42.44 C ATOM 341 NE ARG A 22 2.625 -18.755 1.589 1.00 44.33 N ATOM 342 CZ ARG A 22 3.245 -19.808 2.108 1.00 33.23 C ATOM 343 NH1 ARG A 22 2.559 -20.899 2.421 1.00 51.35 N ATOM 344 NH2 ARG A 22 4.556 -19.773 2.315 1.00 10.33 N ATOM 0 H ARG A 22 -0.617 -13.861 2.523 1.00 73.35 H new ATOM 0 HA ARG A 22 -0.873 -15.530 0.115 1.00 64.32 H new ATOM 0 HB2 ARG A 22 0.511 -16.236 2.609 1.00 5.32 H new ATOM 0 HB3 ARG A 22 -0.815 -17.328 2.261 1.00 5.32 H new ATOM 0 HG2 ARG A 22 0.194 -17.487 -0.130 1.00 64.41 H new ATOM 0 HG3 ARG A 22 1.624 -16.750 0.565 1.00 64.41 H new ATOM 0 HD2 ARG A 22 0.647 -18.936 2.248 1.00 42.44 H new ATOM 0 HD3 ARG A 22 0.927 -19.484 0.607 1.00 42.44 H new ATOM 0 HE ARG A 22 3.182 -17.932 1.359 1.00 44.33 H new ATOM 0 HH11 ARG A 22 1.552 -20.931 2.263 1.00 51.35 H new ATOM 0 HH12 ARG A 22 3.039 -21.706 2.820 1.00 51.35 H new ATOM 0 HH21 ARG A 22 5.088 -18.936 2.075 1.00 10.33 H new ATOM 0 HH22 ARG A 22 5.031 -20.583 2.714 1.00 10.33 H new ATOM 358 N PRO A 23 -3.131 -16.454 0.995 1.00 63.13 N ATOM 359 CA PRO A 23 -4.551 -16.659 1.298 1.00 73.21 C ATOM 360 C PRO A 23 -4.765 -17.304 2.663 1.00 44.21 C ATOM 361 O PRO A 23 -5.753 -17.028 3.343 1.00 12.43 O ATOM 362 CB PRO A 23 -5.020 -17.598 0.184 1.00 34.32 C ATOM 363 CG PRO A 23 -3.790 -18.321 -0.245 1.00 33.20 C ATOM 364 CD PRO A 23 -2.656 -17.348 -0.076 1.00 40.35 C ATOM 0 HA PRO A 23 -5.099 -15.717 1.339 1.00 73.21 H new ATOM 0 HB2 PRO A 23 -5.781 -18.290 0.544 1.00 34.32 H new ATOM 0 HB3 PRO A 23 -5.461 -17.042 -0.643 1.00 34.32 H new ATOM 0 HG2 PRO A 23 -3.631 -19.214 0.360 1.00 33.20 H new ATOM 0 HG3 PRO A 23 -3.872 -18.649 -1.281 1.00 33.20 H new ATOM 0 HD2 PRO A 23 -1.731 -17.853 0.203 1.00 40.35 H new ATOM 0 HD3 PRO A 23 -2.455 -16.801 -0.997 1.00 40.35 H new ATOM 372 N GLY A 24 -3.833 -18.165 3.059 1.00 32.34 N ATOM 373 CA GLY A 24 -3.939 -18.835 4.341 1.00 72.44 C ATOM 374 C GLY A 24 -2.823 -18.447 5.292 1.00 41.14 C ATOM 375 O GLY A 24 -2.633 -19.081 6.329 1.00 72.13 O ATOM 0 H GLY A 24 -3.006 -18.410 2.514 1.00 32.34 H new ATOM 0 HA2 GLY A 24 -4.900 -18.593 4.795 1.00 72.44 H new ATOM 0 HA3 GLY A 24 -3.922 -19.914 4.186 1.00 72.44 H new ATOM 379 N GLY A 25 -2.082 -17.401 4.938 1.00 3.20 N ATOM 380 CA GLY A 25 -0.989 -16.948 5.777 1.00 34.33 C ATOM 381 C GLY A 25 -1.405 -15.843 6.727 1.00 33.21 C ATOM 382 O GLY A 25 -2.572 -15.451 6.762 1.00 73.44 O ATOM 0 H GLY A 25 -2.220 -16.860 4.085 1.00 3.20 H new ATOM 0 HA2 GLY A 25 -0.603 -17.790 6.351 1.00 34.33 H new ATOM 0 HA3 GLY A 25 -0.174 -16.593 5.146 1.00 34.33 H new ATOM 386 N LYS A 26 -0.450 -15.339 7.502 1.00 33.34 N ATOM 387 CA LYS A 26 -0.722 -14.273 8.457 1.00 62.22 C ATOM 388 C LYS A 26 0.095 -13.028 8.131 1.00 3.54 C ATOM 389 O LYS A 26 -0.134 -11.956 8.693 1.00 30.51 O ATOM 390 CB LYS A 26 -0.409 -14.743 9.880 1.00 64.01 C ATOM 391 CG LYS A 26 -0.725 -13.708 10.946 1.00 21.25 C ATOM 392 CD LYS A 26 -1.103 -14.363 12.264 1.00 31.41 C ATOM 393 CE LYS A 26 -0.724 -13.488 13.449 1.00 63.24 C ATOM 394 NZ LYS A 26 -1.447 -12.187 13.432 1.00 42.22 N ATOM 0 H LYS A 26 0.520 -15.653 7.487 1.00 33.34 H new ATOM 0 HA LYS A 26 -1.780 -14.020 8.388 1.00 62.22 H new ATOM 0 HB2 LYS A 26 -0.976 -15.650 10.087 1.00 64.01 H new ATOM 0 HB3 LYS A 26 0.647 -15.006 9.943 1.00 64.01 H new ATOM 0 HG2 LYS A 26 0.140 -13.062 11.095 1.00 21.25 H new ATOM 0 HG3 LYS A 26 -1.543 -13.073 10.607 1.00 21.25 H new ATOM 0 HD2 LYS A 26 -2.176 -14.556 12.281 1.00 31.41 H new ATOM 0 HD3 LYS A 26 -0.604 -15.328 12.348 1.00 31.41 H new ATOM 0 HE2 LYS A 26 -0.948 -14.016 14.376 1.00 63.24 H new ATOM 0 HE3 LYS A 26 0.351 -13.306 13.437 1.00 63.24 H new ATOM 0 HZ1 LYS A 26 -1.213 -11.648 14.290 1.00 42.22 H new ATOM 0 HZ2 LYS A 26 -1.162 -11.642 12.593 1.00 42.22 H new ATOM 0 HZ3 LYS A 26 -2.472 -12.360 13.401 1.00 42.22 H new ATOM 408 N LYS A 27 1.049 -13.174 7.218 1.00 2.45 N ATOM 409 CA LYS A 27 1.899 -12.061 6.813 1.00 54.21 C ATOM 410 C LYS A 27 1.088 -10.995 6.082 1.00 55.12 C ATOM 411 O LYS A 27 0.438 -11.276 5.076 1.00 21.32 O ATOM 412 CB LYS A 27 3.034 -12.559 5.915 1.00 20.32 C ATOM 413 CG LYS A 27 4.217 -13.120 6.685 1.00 32.05 C ATOM 414 CD LYS A 27 5.265 -13.700 5.750 1.00 23.41 C ATOM 415 CE LYS A 27 6.447 -12.758 5.584 1.00 11.11 C ATOM 416 NZ LYS A 27 7.744 -13.489 5.587 1.00 53.15 N ATOM 0 H LYS A 27 1.253 -14.054 6.744 1.00 2.45 H new ATOM 0 HA LYS A 27 2.325 -11.616 7.712 1.00 54.21 H new ATOM 0 HB2 LYS A 27 2.647 -13.329 5.248 1.00 20.32 H new ATOM 0 HB3 LYS A 27 3.377 -11.737 5.287 1.00 20.32 H new ATOM 0 HG2 LYS A 27 4.665 -12.332 7.291 1.00 32.05 H new ATOM 0 HG3 LYS A 27 3.872 -13.893 7.371 1.00 32.05 H new ATOM 0 HD2 LYS A 27 5.613 -14.656 6.140 1.00 23.41 H new ATOM 0 HD3 LYS A 27 4.816 -13.897 4.776 1.00 23.41 H new ATOM 0 HE2 LYS A 27 6.343 -12.206 4.650 1.00 11.11 H new ATOM 0 HE3 LYS A 27 6.442 -12.024 6.390 1.00 11.11 H new ATOM 0 HZ1 LYS A 27 8.313 -13.184 6.402 1.00 53.15 H new ATOM 0 HZ2 LYS A 27 7.566 -14.512 5.653 1.00 53.15 H new ATOM 0 HZ3 LYS A 27 8.261 -13.283 4.708 1.00 53.15 H new ATOM 430 N LYS A 28 1.134 -9.769 6.594 1.00 63.10 N ATOM 431 CA LYS A 28 0.406 -8.660 5.989 1.00 74.53 C ATOM 432 C LYS A 28 1.369 -7.661 5.355 1.00 11.13 C ATOM 433 O LYS A 28 2.482 -7.460 5.841 1.00 31.24 O ATOM 434 CB LYS A 28 -0.457 -7.957 7.038 1.00 61.24 C ATOM 435 CG LYS A 28 -1.260 -8.912 7.904 1.00 2.51 C ATOM 436 CD LYS A 28 -2.100 -8.166 8.927 1.00 5.32 C ATOM 437 CE LYS A 28 -2.196 -8.933 10.237 1.00 5.34 C ATOM 438 NZ LYS A 28 -2.626 -10.342 10.024 1.00 24.44 N ATOM 0 H LYS A 28 1.668 -9.519 7.426 1.00 63.10 H new ATOM 0 HA LYS A 28 -0.239 -9.063 5.208 1.00 74.53 H new ATOM 0 HB2 LYS A 28 0.185 -7.352 7.678 1.00 61.24 H new ATOM 0 HB3 LYS A 28 -1.141 -7.274 6.535 1.00 61.24 H new ATOM 0 HG2 LYS A 28 -1.909 -9.519 7.272 1.00 2.51 H new ATOM 0 HG3 LYS A 28 -0.583 -9.596 8.417 1.00 2.51 H new ATOM 0 HD2 LYS A 28 -1.664 -7.184 9.110 1.00 5.32 H new ATOM 0 HD3 LYS A 28 -3.100 -8.001 8.527 1.00 5.32 H new ATOM 0 HE2 LYS A 28 -1.228 -8.920 10.737 1.00 5.34 H new ATOM 0 HE3 LYS A 28 -2.903 -8.434 10.899 1.00 5.34 H new ATOM 0 HZ1 LYS A 28 -2.908 -10.760 10.934 1.00 24.44 H new ATOM 0 HZ2 LYS A 28 -3.433 -10.363 9.368 1.00 24.44 H new ATOM 0 HZ3 LYS A 28 -1.838 -10.888 9.621 1.00 24.44 H new ATOM 452 N TYR A 29 0.931 -7.035 4.267 1.00 35.11 N ATOM 453 CA TYR A 29 1.754 -6.056 3.566 1.00 34.15 C ATOM 454 C TYR A 29 2.015 -4.835 4.442 1.00 21.11 C ATOM 455 O TYR A 29 1.134 -4.385 5.175 1.00 53.54 O ATOM 456 CB TYR A 29 1.077 -5.629 2.263 1.00 43.04 C ATOM 457 CG TYR A 29 1.321 -6.579 1.112 1.00 73.12 C ATOM 458 CD1 TYR A 29 2.553 -6.620 0.470 1.00 42.44 C ATOM 459 CD2 TYR A 29 0.322 -7.435 0.668 1.00 0.01 C ATOM 460 CE1 TYR A 29 2.781 -7.486 -0.582 1.00 52.02 C ATOM 461 CE2 TYR A 29 0.541 -8.305 -0.383 1.00 55.05 C ATOM 462 CZ TYR A 29 1.773 -8.327 -1.005 1.00 51.14 C ATOM 463 OH TYR A 29 1.996 -9.191 -2.051 1.00 4.12 O ATOM 0 H TYR A 29 0.012 -7.188 3.852 1.00 35.11 H new ATOM 0 HA TYR A 29 2.711 -6.524 3.334 1.00 34.15 H new ATOM 0 HB2 TYR A 29 0.003 -5.545 2.432 1.00 43.04 H new ATOM 0 HB3 TYR A 29 1.434 -4.637 1.986 1.00 43.04 H new ATOM 0 HD1 TYR A 29 3.345 -5.964 0.799 1.00 42.44 H new ATOM 0 HD2 TYR A 29 -0.643 -7.421 1.153 1.00 0.01 H new ATOM 0 HE1 TYR A 29 3.744 -7.504 -1.071 1.00 52.02 H new ATOM 0 HE2 TYR A 29 -0.247 -8.964 -0.716 1.00 55.05 H new ATOM 0 HH TYR A 29 2.942 -9.445 -2.070 1.00 4.12 H new ATOM 473 N ARG A 30 3.229 -4.303 4.359 1.00 33.35 N ATOM 474 CA ARG A 30 3.607 -3.134 5.144 1.00 2.11 C ATOM 475 C ARG A 30 4.651 -2.299 4.407 1.00 44.42 C ATOM 476 O ARG A 30 5.211 -2.733 3.400 1.00 11.11 O ATOM 477 CB ARG A 30 4.151 -3.563 6.508 1.00 12.21 C ATOM 478 CG ARG A 30 3.377 -2.986 7.681 1.00 4.55 C ATOM 479 CD ARG A 30 4.170 -3.083 8.974 1.00 55.32 C ATOM 480 NE ARG A 30 3.393 -3.690 10.049 1.00 65.43 N ATOM 481 CZ ARG A 30 3.839 -3.830 11.293 1.00 55.22 C ATOM 482 NH1 ARG A 30 5.054 -3.405 11.615 1.00 31.43 N ATOM 483 NH2 ARG A 30 3.072 -4.394 12.216 1.00 54.44 N ATOM 0 H ARG A 30 3.969 -4.663 3.756 1.00 33.35 H new ATOM 0 HA ARG A 30 2.716 -2.523 5.292 1.00 2.11 H new ATOM 0 HB2 ARG A 30 4.132 -4.651 6.571 1.00 12.21 H new ATOM 0 HB3 ARG A 30 5.194 -3.257 6.586 1.00 12.21 H new ATOM 0 HG2 ARG A 30 3.134 -1.943 7.480 1.00 4.55 H new ATOM 0 HG3 ARG A 30 2.432 -3.518 7.792 1.00 4.55 H new ATOM 0 HD2 ARG A 30 5.072 -3.671 8.803 1.00 55.32 H new ATOM 0 HD3 ARG A 30 4.492 -2.087 9.277 1.00 55.32 H new ATOM 0 HE ARG A 30 2.454 -4.026 9.834 1.00 65.43 H new ATOM 0 HH11 ARG A 30 5.646 -2.970 10.907 1.00 31.43 H new ATOM 0 HH12 ARG A 30 5.396 -3.513 12.570 1.00 31.43 H new ATOM 0 HH21 ARG A 30 2.137 -4.722 11.972 1.00 54.44 H new ATOM 0 HH22 ARG A 30 3.417 -4.500 13.170 1.00 54.44 H new ATOM 497 N LEU A 31 4.907 -1.099 4.916 1.00 1.32 N ATOM 498 CA LEU A 31 5.882 -0.201 4.307 1.00 72.23 C ATOM 499 C LEU A 31 7.185 -0.936 4.008 1.00 32.40 C ATOM 500 O LEU A 31 7.865 -0.643 3.024 1.00 13.01 O ATOM 501 CB LEU A 31 6.156 0.988 5.229 1.00 1.42 C ATOM 502 CG LEU A 31 5.374 2.266 4.923 1.00 41.43 C ATOM 503 CD1 LEU A 31 3.933 2.137 5.395 1.00 14.43 C ATOM 504 CD2 LEU A 31 6.043 3.470 5.572 1.00 72.40 C ATOM 0 H LEU A 31 4.453 -0.725 5.749 1.00 1.32 H new ATOM 0 HA LEU A 31 5.466 0.164 3.368 1.00 72.23 H new ATOM 0 HB2 LEU A 31 5.936 0.687 6.253 1.00 1.42 H new ATOM 0 HB3 LEU A 31 7.221 1.218 5.187 1.00 1.42 H new ATOM 0 HG LEU A 31 5.370 2.416 3.843 1.00 41.43 H new ATOM 0 HD11 LEU A 31 3.392 3.056 5.169 1.00 14.43 H new ATOM 0 HD12 LEU A 31 3.456 1.300 4.884 1.00 14.43 H new ATOM 0 HD13 LEU A 31 3.917 1.962 6.471 1.00 14.43 H new ATOM 0 HD21 LEU A 31 5.473 4.370 5.343 1.00 72.40 H new ATOM 0 HD22 LEU A 31 6.079 3.328 6.652 1.00 72.40 H new ATOM 0 HD23 LEU A 31 7.057 3.575 5.186 1.00 72.40 H new ATOM 516 N LYS A 32 7.527 -1.896 4.862 1.00 14.21 N ATOM 517 CA LYS A 32 8.746 -2.677 4.689 1.00 15.30 C ATOM 518 C LYS A 32 8.810 -3.283 3.291 1.00 1.34 C ATOM 519 O LYS A 32 9.858 -3.270 2.645 1.00 15.24 O ATOM 520 CB LYS A 32 8.820 -3.785 5.741 1.00 15.14 C ATOM 521 CG LYS A 32 9.292 -3.303 7.101 1.00 12.24 C ATOM 522 CD LYS A 32 10.763 -3.612 7.322 1.00 54.21 C ATOM 523 CE LYS A 32 11.147 -3.478 8.788 1.00 64.33 C ATOM 524 NZ LYS A 32 12.564 -3.051 8.954 1.00 45.44 N ATOM 0 H LYS A 32 6.976 -2.152 5.681 1.00 14.21 H new ATOM 0 HA LYS A 32 9.597 -2.008 4.815 1.00 15.30 H new ATOM 0 HB2 LYS A 32 7.835 -4.239 5.848 1.00 15.14 H new ATOM 0 HB3 LYS A 32 9.494 -4.565 5.388 1.00 15.14 H new ATOM 0 HG2 LYS A 32 9.128 -2.229 7.184 1.00 12.24 H new ATOM 0 HG3 LYS A 32 8.698 -3.777 7.882 1.00 12.24 H new ATOM 0 HD2 LYS A 32 10.979 -4.624 6.979 1.00 54.21 H new ATOM 0 HD3 LYS A 32 11.372 -2.936 6.722 1.00 54.21 H new ATOM 0 HE2 LYS A 32 10.491 -2.754 9.270 1.00 64.33 H new ATOM 0 HE3 LYS A 32 10.994 -4.432 9.292 1.00 64.33 H new ATOM 0 HZ1 LYS A 32 12.786 -2.971 9.967 1.00 45.44 H new ATOM 0 HZ2 LYS A 32 13.192 -3.755 8.516 1.00 45.44 H new ATOM 0 HZ3 LYS A 32 12.705 -2.128 8.495 1.00 45.44 H new ATOM 538 N HIS A 33 7.681 -3.811 2.828 1.00 31.53 N ATOM 539 CA HIS A 33 7.609 -4.421 1.504 1.00 24.21 C ATOM 540 C HIS A 33 7.718 -3.361 0.413 1.00 23.24 C ATOM 541 O HIS A 33 8.284 -3.682 -0.634 1.00 41.24 O ATOM 542 CB HIS A 33 6.300 -5.197 1.348 1.00 22.43 C ATOM 543 CG HIS A 33 6.125 -6.285 2.363 1.00 45.23 C ATOM 544 ND1 HIS A 33 5.179 -6.233 3.365 1.00 45.44 N ATOM 545 CD2 HIS A 33 6.779 -7.457 2.528 1.00 20.41 C ATOM 546 CE1 HIS A 33 5.260 -7.326 4.102 1.00 74.22 C ATOM 547 NE2 HIS A 33 6.224 -8.086 3.614 1.00 0.25 N ATOM 0 H HIS A 33 6.804 -3.829 3.349 1.00 31.53 H new ATOM 0 HA HIS A 33 8.446 -5.111 1.402 1.00 24.21 H new ATOM 0 HB2 HIS A 33 5.464 -4.502 1.424 1.00 22.43 H new ATOM 0 HB3 HIS A 33 6.262 -5.633 0.350 1.00 22.43 H new ATOM 0 HD2 HIS A 33 7.589 -7.829 1.918 1.00 20.41 H new ATOM 0 HE1 HIS A 33 4.643 -7.559 4.958 1.00 74.22 H new ATOM 0 HE2 HIS A 33 6.509 -8.993 3.984 1.00 0.25 H new ATOM 555 N ILE A 34 7.210 -2.150 0.618 1.00 30.14 N ATOM 556 CA ILE A 34 7.291 -1.106 -0.395 1.00 13.42 C ATOM 557 C ILE A 34 8.737 -0.685 -0.636 1.00 11.31 C ATOM 558 O ILE A 34 9.131 -0.398 -1.766 1.00 51.53 O ATOM 559 CB ILE A 34 6.468 0.133 0.005 1.00 72.14 C ATOM 560 CG1 ILE A 34 5.048 -0.278 0.399 1.00 11.21 C ATOM 561 CG2 ILE A 34 6.438 1.140 -1.135 1.00 63.34 C ATOM 562 CD1 ILE A 34 4.191 0.879 0.863 1.00 63.02 C ATOM 0 H ILE A 34 6.738 -1.868 1.477 1.00 30.14 H new ATOM 0 HA ILE A 34 6.879 -1.525 -1.313 1.00 13.42 H new ATOM 0 HB ILE A 34 6.942 0.604 0.866 1.00 72.14 H new ATOM 0 HG12 ILE A 34 4.567 -0.757 -0.454 1.00 11.21 H new ATOM 0 HG13 ILE A 34 5.101 -1.022 1.194 1.00 11.21 H new ATOM 0 HG21 ILE A 34 5.853 2.010 -0.837 1.00 63.34 H new ATOM 0 HG22 ILE A 34 7.455 1.451 -1.372 1.00 63.34 H new ATOM 0 HG23 ILE A 34 5.985 0.681 -2.014 1.00 63.34 H new ATOM 0 HD11 ILE A 34 3.198 0.514 1.126 1.00 63.02 H new ATOM 0 HD12 ILE A 34 4.649 1.344 1.736 1.00 63.02 H new ATOM 0 HD13 ILE A 34 4.107 1.614 0.062 1.00 63.02 H new ATOM 574 N VAL A 35 9.525 -0.653 0.434 1.00 61.00 N ATOM 575 CA VAL A 35 10.928 -0.271 0.340 1.00 13.12 C ATOM 576 C VAL A 35 11.728 -1.306 -0.442 1.00 73.42 C ATOM 577 O VAL A 35 12.603 -0.960 -1.235 1.00 35.35 O ATOM 578 CB VAL A 35 11.558 -0.097 1.734 1.00 64.23 C ATOM 579 CG1 VAL A 35 13.038 0.232 1.616 1.00 21.35 C ATOM 580 CG2 VAL A 35 10.826 0.981 2.519 1.00 24.31 C ATOM 0 H VAL A 35 9.215 -0.887 1.377 1.00 61.00 H new ATOM 0 HA VAL A 35 10.961 0.683 -0.186 1.00 13.12 H new ATOM 0 HB VAL A 35 11.462 -1.038 2.275 1.00 64.23 H new ATOM 0 HG11 VAL A 35 13.465 0.351 2.612 1.00 21.35 H new ATOM 0 HG12 VAL A 35 13.550 -0.577 1.096 1.00 21.35 H new ATOM 0 HG13 VAL A 35 13.161 1.159 1.055 1.00 21.35 H new ATOM 0 HG21 VAL A 35 11.285 1.090 3.502 1.00 24.31 H new ATOM 0 HG22 VAL A 35 10.888 1.928 1.982 1.00 24.31 H new ATOM 0 HG23 VAL A 35 9.780 0.699 2.636 1.00 24.31 H new ATOM 590 N TRP A 36 11.423 -2.578 -0.212 1.00 24.23 N ATOM 591 CA TRP A 36 12.113 -3.665 -0.896 1.00 73.40 C ATOM 592 C TRP A 36 11.771 -3.680 -2.381 1.00 22.21 C ATOM 593 O TRP A 36 12.539 -4.186 -3.200 1.00 45.14 O ATOM 594 CB TRP A 36 11.746 -5.009 -0.262 1.00 54.43 C ATOM 595 CG TRP A 36 12.277 -6.188 -1.019 1.00 34.31 C ATOM 596 CD1 TRP A 36 13.394 -6.917 -0.724 1.00 64.21 C ATOM 597 CD2 TRP A 36 11.715 -6.772 -2.199 1.00 30.32 C ATOM 598 NE1 TRP A 36 13.559 -7.920 -1.648 1.00 14.14 N ATOM 599 CE2 TRP A 36 12.543 -7.853 -2.564 1.00 4.20 C ATOM 600 CE3 TRP A 36 10.593 -6.490 -2.982 1.00 53.32 C ATOM 601 CZ2 TRP A 36 12.281 -8.647 -3.677 1.00 74.43 C ATOM 602 CZ3 TRP A 36 10.336 -7.279 -4.087 1.00 4.21 C ATOM 603 CH2 TRP A 36 11.176 -8.347 -4.426 1.00 22.40 C ATOM 0 H TRP A 36 10.702 -2.882 0.443 1.00 24.23 H new ATOM 0 HA TRP A 36 13.186 -3.502 -0.792 1.00 73.40 H new ATOM 0 HB2 TRP A 36 12.130 -5.038 0.758 1.00 54.43 H new ATOM 0 HB3 TRP A 36 10.661 -5.087 -0.196 1.00 54.43 H new ATOM 0 HD1 TRP A 36 14.051 -6.732 0.113 1.00 64.21 H new ATOM 0 HE1 TRP A 36 14.316 -8.604 -1.651 1.00 14.14 H new ATOM 0 HE3 TRP A 36 9.938 -5.670 -2.728 1.00 53.32 H new ATOM 0 HZ2 TRP A 36 12.927 -9.471 -3.940 1.00 74.43 H new ATOM 0 HZ3 TRP A 36 9.472 -7.068 -4.700 1.00 4.21 H new ATOM 0 HH2 TRP A 36 10.947 -8.945 -5.295 1.00 22.40 H new ATOM 614 N ALA A 37 10.614 -3.122 -2.722 1.00 21.11 N ATOM 615 CA ALA A 37 10.171 -3.069 -4.111 1.00 53.44 C ATOM 616 C ALA A 37 10.811 -1.896 -4.846 1.00 10.14 C ATOM 617 O ALA A 37 11.376 -2.063 -5.926 1.00 0.03 O ATOM 618 CB ALA A 37 8.655 -2.973 -4.177 1.00 0.01 C ATOM 0 H ALA A 37 9.966 -2.700 -2.056 1.00 21.11 H new ATOM 0 HA ALA A 37 10.487 -3.988 -4.604 1.00 53.44 H new ATOM 0 HB1 ALA A 37 8.338 -2.934 -5.219 1.00 0.01 H new ATOM 0 HB2 ALA A 37 8.214 -3.846 -3.696 1.00 0.01 H new ATOM 0 HB3 ALA A 37 8.325 -2.070 -3.663 1.00 0.01 H new ATOM 624 N ALA A 38 10.715 -0.710 -4.254 1.00 54.42 N ATOM 625 CA ALA A 38 11.286 0.490 -4.854 1.00 45.04 C ATOM 626 C ALA A 38 12.757 0.286 -5.201 1.00 63.53 C ATOM 627 O ALA A 38 13.237 0.777 -6.221 1.00 21.45 O ATOM 628 CB ALA A 38 11.124 1.677 -3.914 1.00 21.40 C ATOM 0 H ALA A 38 10.248 -0.554 -3.361 1.00 54.42 H new ATOM 0 HA ALA A 38 10.747 0.695 -5.779 1.00 45.04 H new ATOM 0 HB1 ALA A 38 11.554 2.567 -4.374 1.00 21.40 H new ATOM 0 HB2 ALA A 38 10.065 1.845 -3.720 1.00 21.40 H new ATOM 0 HB3 ALA A 38 11.637 1.470 -2.975 1.00 21.40 H new ATOM 634 N ASN A 39 13.466 -0.443 -4.345 1.00 64.10 N ATOM 635 CA ASN A 39 14.883 -0.713 -4.562 1.00 3.20 C ATOM 636 C ASN A 39 15.113 -1.346 -5.931 1.00 74.43 C ATOM 637 O ASN A 39 16.122 -1.086 -6.586 1.00 25.24 O ATOM 638 CB ASN A 39 15.423 -1.631 -3.464 1.00 22.41 C ATOM 639 CG ASN A 39 16.769 -1.173 -2.936 1.00 25.34 C ATOM 640 OD1 ASN A 39 17.037 0.025 -2.847 1.00 13.01 O ATOM 641 ND2 ASN A 39 17.621 -2.128 -2.583 1.00 14.24 N ATOM 0 H ASN A 39 13.083 -0.857 -3.495 1.00 64.10 H new ATOM 0 HA ASN A 39 15.418 0.236 -4.527 1.00 3.20 H new ATOM 0 HB2 ASN A 39 14.708 -1.670 -2.642 1.00 22.41 H new ATOM 0 HB3 ASN A 39 15.515 -2.645 -3.854 1.00 22.41 H new ATOM 0 HD21 ASN A 39 18.542 -1.881 -2.220 1.00 14.24 H new ATOM 0 HD22 ASN A 39 17.355 -3.108 -2.674 1.00 14.24 H new ATOM 648 N LYS A 40 14.170 -2.180 -6.356 1.00 73.13 N ATOM 649 CA LYS A 40 14.268 -2.851 -7.647 1.00 24.13 C ATOM 650 C LYS A 40 14.061 -1.863 -8.790 1.00 24.13 C ATOM 651 O LYS A 40 14.801 -1.874 -9.775 1.00 52.01 O ATOM 652 CB LYS A 40 13.235 -3.977 -7.739 1.00 63.25 C ATOM 653 CG LYS A 40 13.680 -5.267 -7.072 1.00 73.23 C ATOM 654 CD LYS A 40 14.840 -5.908 -7.816 1.00 25.24 C ATOM 655 CE LYS A 40 14.698 -7.422 -7.869 1.00 1.34 C ATOM 656 NZ LYS A 40 15.567 -8.096 -6.865 1.00 5.44 N ATOM 0 H LYS A 40 13.329 -2.407 -5.825 1.00 73.13 H new ATOM 0 HA LYS A 40 15.268 -3.275 -7.733 1.00 24.13 H new ATOM 0 HB2 LYS A 40 12.304 -3.643 -7.280 1.00 63.25 H new ATOM 0 HB3 LYS A 40 13.020 -4.176 -8.789 1.00 63.25 H new ATOM 0 HG2 LYS A 40 13.975 -5.063 -6.043 1.00 73.23 H new ATOM 0 HG3 LYS A 40 12.843 -5.964 -7.031 1.00 73.23 H new ATOM 0 HD2 LYS A 40 14.888 -5.510 -8.830 1.00 25.24 H new ATOM 0 HD3 LYS A 40 15.778 -5.646 -7.326 1.00 25.24 H new ATOM 0 HE2 LYS A 40 13.658 -7.696 -7.691 1.00 1.34 H new ATOM 0 HE3 LYS A 40 14.955 -7.776 -8.867 1.00 1.34 H new ATOM 0 HZ1 LYS A 40 16.187 -8.779 -7.345 1.00 5.44 H new ATOM 0 HZ2 LYS A 40 16.147 -7.385 -6.375 1.00 5.44 H new ATOM 0 HZ3 LYS A 40 14.974 -8.595 -6.172 1.00 5.44 H new ATOM 670 N LEU A 41 13.051 -1.010 -8.654 1.00 10.11 N ATOM 671 CA LEU A 41 12.748 -0.014 -9.675 1.00 13.30 C ATOM 672 C LEU A 41 13.991 0.795 -10.032 1.00 11.15 C ATOM 673 O LEU A 41 14.127 1.281 -11.156 1.00 44.12 O ATOM 674 CB LEU A 41 11.639 0.922 -9.191 1.00 63.52 C ATOM 675 CG LEU A 41 10.279 0.272 -8.932 1.00 62.11 C ATOM 676 CD1 LEU A 41 9.369 1.224 -8.172 1.00 14.43 C ATOM 677 CD2 LEU A 41 9.634 -0.154 -10.243 1.00 61.34 C ATOM 0 H LEU A 41 12.428 -0.989 -7.846 1.00 10.11 H new ATOM 0 HA LEU A 41 12.408 -0.538 -10.568 1.00 13.30 H new ATOM 0 HB2 LEU A 41 11.972 1.402 -8.270 1.00 63.52 H new ATOM 0 HB3 LEU A 41 11.507 1.711 -9.932 1.00 63.52 H new ATOM 0 HG LEU A 41 10.432 -0.617 -8.320 1.00 62.11 H new ATOM 0 HD11 LEU A 41 8.406 0.745 -7.997 1.00 14.43 H new ATOM 0 HD12 LEU A 41 9.827 1.479 -7.216 1.00 14.43 H new ATOM 0 HD13 LEU A 41 9.221 2.131 -8.758 1.00 14.43 H new ATOM 0 HD21 LEU A 41 8.667 -0.615 -10.040 1.00 61.34 H new ATOM 0 HD22 LEU A 41 9.493 0.719 -10.880 1.00 61.34 H new ATOM 0 HD23 LEU A 41 10.279 -0.872 -10.749 1.00 61.34 H new ATOM 689 N ASP A 42 14.897 0.933 -9.072 1.00 40.15 N ATOM 690 CA ASP A 42 16.132 1.681 -9.285 1.00 5.22 C ATOM 691 C ASP A 42 17.105 0.885 -10.147 1.00 74.13 C ATOM 692 O ASP A 42 17.616 1.386 -11.149 1.00 52.31 O ATOM 693 CB ASP A 42 16.781 2.027 -7.945 1.00 34.12 C ATOM 694 CG ASP A 42 18.018 2.889 -8.107 1.00 40.33 C ATOM 695 OD1 ASP A 42 19.109 2.327 -8.332 1.00 33.01 O ATOM 696 OD2 ASP A 42 17.893 4.129 -8.010 1.00 72.55 O ATOM 0 H ASP A 42 14.801 0.537 -8.137 1.00 40.15 H new ATOM 0 HA ASP A 42 15.884 2.605 -9.807 1.00 5.22 H new ATOM 0 HB2 ASP A 42 16.058 2.548 -7.318 1.00 34.12 H new ATOM 0 HB3 ASP A 42 17.048 1.107 -7.426 1.00 34.12 H new ATOM 701 N ARG A 43 17.361 -0.358 -9.750 1.00 4.12 N ATOM 702 CA ARG A 43 18.275 -1.223 -10.485 1.00 13.15 C ATOM 703 C ARG A 43 17.913 -1.264 -11.967 1.00 4.41 C ATOM 704 O ARG A 43 18.761 -1.535 -12.817 1.00 3.34 O ATOM 705 CB ARG A 43 18.252 -2.638 -9.905 1.00 64.13 C ATOM 706 CG ARG A 43 19.582 -3.365 -10.016 1.00 11.43 C ATOM 707 CD ARG A 43 19.852 -4.223 -8.791 1.00 14.14 C ATOM 708 NE ARG A 43 19.293 -5.565 -8.929 1.00 62.23 N ATOM 709 CZ ARG A 43 19.690 -6.605 -8.204 1.00 34.33 C ATOM 710 NH1 ARG A 43 20.645 -6.458 -7.297 1.00 70.44 N ATOM 711 NH2 ARG A 43 19.133 -7.795 -8.388 1.00 71.34 N ATOM 0 H ARG A 43 16.948 -0.788 -8.923 1.00 4.12 H new ATOM 0 HA ARG A 43 19.280 -0.813 -10.385 1.00 13.15 H new ATOM 0 HB2 ARG A 43 17.963 -2.586 -8.855 1.00 64.13 H new ATOM 0 HB3 ARG A 43 17.486 -3.219 -10.419 1.00 64.13 H new ATOM 0 HG2 ARG A 43 19.582 -3.992 -10.908 1.00 11.43 H new ATOM 0 HG3 ARG A 43 20.386 -2.639 -10.137 1.00 11.43 H new ATOM 0 HD2 ARG A 43 20.927 -4.293 -8.628 1.00 14.14 H new ATOM 0 HD3 ARG A 43 19.426 -3.742 -7.910 1.00 14.14 H new ATOM 0 HE ARG A 43 18.557 -5.712 -9.620 1.00 62.23 H new ATOM 0 HH11 ARG A 43 21.077 -5.545 -7.154 1.00 70.44 H new ATOM 0 HH12 ARG A 43 20.948 -7.258 -6.741 1.00 70.44 H new ATOM 0 HH21 ARG A 43 18.399 -7.912 -9.087 1.00 71.34 H new ATOM 0 HH22 ARG A 43 19.439 -8.593 -7.831 1.00 71.34 H new ATOM 725 N PHE A 44 16.647 -0.994 -12.269 1.00 54.15 N ATOM 726 CA PHE A 44 16.172 -1.001 -13.647 1.00 20.04 C ATOM 727 C PHE A 44 16.143 0.413 -14.221 1.00 51.02 C ATOM 728 O PHE A 44 16.565 0.644 -15.352 1.00 1.34 O ATOM 729 CB PHE A 44 14.776 -1.623 -13.724 1.00 22.02 C ATOM 730 CG PHE A 44 14.735 -3.060 -13.289 1.00 73.01 C ATOM 731 CD1 PHE A 44 15.641 -3.977 -13.797 1.00 54.12 C ATOM 732 CD2 PHE A 44 13.791 -3.494 -12.373 1.00 41.42 C ATOM 733 CE1 PHE A 44 15.606 -5.300 -13.399 1.00 71.40 C ATOM 734 CE2 PHE A 44 13.751 -4.815 -11.971 1.00 61.31 C ATOM 735 CZ PHE A 44 14.660 -5.720 -12.483 1.00 14.31 C ATOM 0 H PHE A 44 15.932 -0.768 -11.578 1.00 54.15 H new ATOM 0 HA PHE A 44 16.863 -1.600 -14.240 1.00 20.04 H new ATOM 0 HB2 PHE A 44 14.094 -1.044 -13.101 1.00 22.02 H new ATOM 0 HB3 PHE A 44 14.411 -1.551 -14.749 1.00 22.02 H new ATOM 0 HD1 PHE A 44 16.383 -3.654 -14.512 1.00 54.12 H new ATOM 0 HD2 PHE A 44 13.078 -2.791 -11.968 1.00 41.42 H new ATOM 0 HE1 PHE A 44 16.317 -6.005 -13.803 1.00 71.40 H new ATOM 0 HE2 PHE A 44 13.009 -5.140 -11.257 1.00 61.31 H new ATOM 0 HZ PHE A 44 14.632 -6.753 -12.169 1.00 14.31 H new ATOM 745 N GLY A 45 15.640 1.356 -13.429 1.00 75.45 N ATOM 746 CA GLY A 45 15.565 2.736 -13.874 1.00 62.22 C ATOM 747 C GLY A 45 14.252 3.394 -13.500 1.00 23.24 C ATOM 748 O GLY A 45 14.227 4.545 -13.064 1.00 15.13 O ATOM 0 H GLY A 45 15.283 1.189 -12.488 1.00 75.45 H new ATOM 0 HA2 GLY A 45 16.389 3.301 -13.437 1.00 62.22 H new ATOM 0 HA3 GLY A 45 15.692 2.773 -14.956 1.00 62.22 H new ATOM 752 N LEU A 46 13.156 2.663 -13.673 1.00 42.31 N ATOM 753 CA LEU A 46 11.830 3.183 -13.352 1.00 55.43 C ATOM 754 C LEU A 46 11.844 3.922 -12.018 1.00 74.34 C ATOM 755 O LEU A 46 12.447 3.462 -11.048 1.00 31.02 O ATOM 756 CB LEU A 46 10.811 2.046 -13.308 1.00 31.53 C ATOM 757 CG LEU A 46 9.971 1.847 -14.570 1.00 51.20 C ATOM 758 CD1 LEU A 46 10.162 0.443 -15.123 1.00 13.15 C ATOM 759 CD2 LEU A 46 8.500 2.111 -14.279 1.00 31.52 C ATOM 0 H LEU A 46 13.159 1.709 -14.034 1.00 42.31 H new ATOM 0 HA LEU A 46 11.544 3.887 -14.133 1.00 55.43 H new ATOM 0 HB2 LEU A 46 11.342 1.117 -13.099 1.00 31.53 H new ATOM 0 HB3 LEU A 46 10.136 2.222 -12.471 1.00 31.53 H new ATOM 0 HG LEU A 46 10.307 2.561 -15.322 1.00 51.20 H new ATOM 0 HD11 LEU A 46 9.556 0.320 -16.021 1.00 13.15 H new ATOM 0 HD12 LEU A 46 11.212 0.289 -15.370 1.00 13.15 H new ATOM 0 HD13 LEU A 46 9.854 -0.288 -14.375 1.00 13.15 H new ATOM 0 HD21 LEU A 46 7.917 1.965 -15.188 1.00 31.52 H new ATOM 0 HD22 LEU A 46 8.152 1.421 -13.510 1.00 31.52 H new ATOM 0 HD23 LEU A 46 8.376 3.136 -13.930 1.00 31.52 H new ATOM 771 N ALA A 47 11.175 5.069 -11.974 1.00 5.13 N ATOM 772 CA ALA A 47 11.106 5.869 -10.758 1.00 24.53 C ATOM 773 C ALA A 47 10.218 5.202 -9.712 1.00 1.14 C ATOM 774 O ALA A 47 9.207 4.584 -10.045 1.00 14.14 O ATOM 775 CB ALA A 47 10.594 7.266 -11.073 1.00 14.11 C ATOM 0 H ALA A 47 10.672 5.466 -12.768 1.00 5.13 H new ATOM 0 HA ALA A 47 12.112 5.947 -10.347 1.00 24.53 H new ATOM 0 HB1 ALA A 47 10.548 7.852 -10.155 1.00 14.11 H new ATOM 0 HB2 ALA A 47 11.269 7.750 -11.779 1.00 14.11 H new ATOM 0 HB3 ALA A 47 9.598 7.198 -11.511 1.00 14.11 H new ATOM 781 N GLU A 48 10.603 5.331 -8.447 1.00 74.02 N ATOM 782 CA GLU A 48 9.842 4.740 -7.352 1.00 22.34 C ATOM 783 C GLU A 48 8.604 5.574 -7.038 1.00 64.51 C ATOM 784 O GLU A 48 7.653 5.087 -6.426 1.00 20.31 O ATOM 785 CB GLU A 48 10.717 4.612 -6.103 1.00 2.23 C ATOM 786 CG GLU A 48 11.371 5.918 -5.682 1.00 22.44 C ATOM 787 CD GLU A 48 11.232 6.187 -4.197 1.00 73.24 C ATOM 788 OE1 GLU A 48 10.098 6.441 -3.742 1.00 35.11 O ATOM 789 OE2 GLU A 48 12.261 6.144 -3.489 1.00 72.41 O ATOM 0 H GLU A 48 11.437 5.839 -8.154 1.00 74.02 H new ATOM 0 HA GLU A 48 9.519 3.746 -7.662 1.00 22.34 H new ATOM 0 HB2 GLU A 48 10.108 4.238 -5.280 1.00 2.23 H new ATOM 0 HB3 GLU A 48 11.493 3.870 -6.288 1.00 2.23 H new ATOM 0 HG2 GLU A 48 12.428 5.892 -5.945 1.00 22.44 H new ATOM 0 HG3 GLU A 48 10.924 6.741 -6.240 1.00 22.44 H new ATOM 796 N SER A 49 8.624 6.834 -7.459 1.00 22.12 N ATOM 797 CA SER A 49 7.506 7.738 -7.218 1.00 4.50 C ATOM 798 C SER A 49 6.272 7.297 -8.000 1.00 42.10 C ATOM 799 O SER A 49 5.170 7.806 -7.785 1.00 33.41 O ATOM 800 CB SER A 49 7.885 9.168 -7.608 1.00 61.11 C ATOM 801 OG SER A 49 8.718 9.761 -6.625 1.00 25.35 O ATOM 0 H SER A 49 9.402 7.252 -7.969 1.00 22.12 H new ATOM 0 HA SER A 49 7.271 7.709 -6.154 1.00 4.50 H new ATOM 0 HB2 SER A 49 8.399 9.162 -8.569 1.00 61.11 H new ATOM 0 HB3 SER A 49 6.982 9.766 -7.733 1.00 61.11 H new ATOM 0 HG SER A 49 8.948 10.674 -6.898 1.00 25.35 H new ATOM 807 N LEU A 50 6.464 6.347 -8.908 1.00 22.22 N ATOM 808 CA LEU A 50 5.367 5.835 -9.724 1.00 15.43 C ATOM 809 C LEU A 50 4.563 4.789 -8.959 1.00 25.22 C ATOM 810 O LEU A 50 3.611 4.213 -9.489 1.00 11.22 O ATOM 811 CB LEU A 50 5.909 5.231 -11.021 1.00 51.32 C ATOM 812 CG LEU A 50 6.757 6.159 -11.891 1.00 43.14 C ATOM 813 CD1 LEU A 50 7.544 5.359 -12.916 1.00 34.52 C ATOM 814 CD2 LEU A 50 5.879 7.194 -12.580 1.00 64.13 C ATOM 0 H LEU A 50 7.368 5.915 -9.098 1.00 22.22 H new ATOM 0 HA LEU A 50 4.707 6.668 -9.967 1.00 15.43 H new ATOM 0 HB2 LEU A 50 6.507 4.356 -10.768 1.00 51.32 H new ATOM 0 HB3 LEU A 50 5.065 4.880 -11.615 1.00 51.32 H new ATOM 0 HG LEU A 50 7.465 6.682 -11.248 1.00 43.14 H new ATOM 0 HD11 LEU A 50 8.141 6.037 -13.526 1.00 34.52 H new ATOM 0 HD12 LEU A 50 8.202 4.657 -12.403 1.00 34.52 H new ATOM 0 HD13 LEU A 50 6.854 4.808 -13.555 1.00 34.52 H new ATOM 0 HD21 LEU A 50 6.499 7.846 -13.195 1.00 64.13 H new ATOM 0 HD22 LEU A 50 5.147 6.689 -13.211 1.00 64.13 H new ATOM 0 HD23 LEU A 50 5.361 7.790 -11.829 1.00 64.13 H new ATOM 826 N LEU A 51 4.950 4.549 -7.712 1.00 65.01 N ATOM 827 CA LEU A 51 4.262 3.573 -6.872 1.00 53.32 C ATOM 828 C LEU A 51 2.992 4.168 -6.275 1.00 43.24 C ATOM 829 O LEU A 51 2.276 3.502 -5.527 1.00 1.31 O ATOM 830 CB LEU A 51 5.188 3.091 -5.754 1.00 71.31 C ATOM 831 CG LEU A 51 5.956 1.797 -6.030 1.00 43.43 C ATOM 832 CD1 LEU A 51 7.181 1.702 -5.133 1.00 23.13 C ATOM 833 CD2 LEU A 51 5.053 0.588 -5.831 1.00 45.41 C ATOM 0 H LEU A 51 5.736 5.016 -7.259 1.00 65.01 H new ATOM 0 HA LEU A 51 3.984 2.724 -7.497 1.00 53.32 H new ATOM 0 HB2 LEU A 51 5.909 3.880 -5.541 1.00 71.31 H new ATOM 0 HB3 LEU A 51 4.593 2.951 -4.851 1.00 71.31 H new ATOM 0 HG LEU A 51 6.290 1.810 -7.067 1.00 43.43 H new ATOM 0 HD11 LEU A 51 7.715 0.775 -5.343 1.00 23.13 H new ATOM 0 HD12 LEU A 51 7.838 2.551 -5.323 1.00 23.13 H new ATOM 0 HD13 LEU A 51 6.869 1.712 -4.089 1.00 23.13 H new ATOM 0 HD21 LEU A 51 5.616 -0.324 -6.032 1.00 45.41 H new ATOM 0 HD22 LEU A 51 4.689 0.571 -4.804 1.00 45.41 H new ATOM 0 HD23 LEU A 51 4.207 0.650 -6.515 1.00 45.41 H new ATOM 845 N GLU A 52 2.718 5.425 -6.610 1.00 44.13 N ATOM 846 CA GLU A 52 1.532 6.109 -6.107 1.00 34.42 C ATOM 847 C GLU A 52 0.597 6.489 -7.251 1.00 55.32 C ATOM 848 O GLU A 52 -0.043 7.540 -7.219 1.00 63.12 O ATOM 849 CB GLU A 52 1.932 7.359 -5.322 1.00 14.31 C ATOM 850 CG GLU A 52 2.918 8.250 -6.057 1.00 0.45 C ATOM 851 CD GLU A 52 2.836 9.700 -5.618 1.00 62.32 C ATOM 852 OE1 GLU A 52 2.950 9.957 -4.401 1.00 20.52 O ATOM 853 OE2 GLU A 52 2.658 10.576 -6.490 1.00 62.40 O ATOM 0 H GLU A 52 3.301 5.990 -7.227 1.00 44.13 H new ATOM 0 HA GLU A 52 1.004 5.426 -5.442 1.00 34.42 H new ATOM 0 HB2 GLU A 52 1.036 7.935 -5.092 1.00 14.31 H new ATOM 0 HB3 GLU A 52 2.369 7.056 -4.370 1.00 14.31 H new ATOM 0 HG2 GLU A 52 3.930 7.881 -5.890 1.00 0.45 H new ATOM 0 HG3 GLU A 52 2.729 8.188 -7.129 1.00 0.45 H new ATOM 860 N SER A 53 0.526 5.629 -8.261 1.00 21.51 N ATOM 861 CA SER A 53 -0.326 5.877 -9.418 1.00 22.13 C ATOM 862 C SER A 53 -0.509 4.605 -10.240 1.00 1.44 C ATOM 863 O SER A 53 0.462 3.947 -10.613 1.00 73.45 O ATOM 864 CB SER A 53 0.272 6.981 -10.291 1.00 14.13 C ATOM 865 OG SER A 53 0.907 6.438 -11.436 1.00 31.41 O ATOM 0 H SER A 53 1.048 4.754 -8.302 1.00 21.51 H new ATOM 0 HA SER A 53 -1.303 6.199 -9.057 1.00 22.13 H new ATOM 0 HB2 SER A 53 -0.514 7.671 -10.600 1.00 14.13 H new ATOM 0 HB3 SER A 53 0.992 7.558 -9.711 1.00 14.13 H new ATOM 0 HG SER A 53 0.615 6.926 -12.234 1.00 31.41 H new ATOM 871 N LYS A 54 -1.763 4.265 -10.521 1.00 72.42 N ATOM 872 CA LYS A 54 -2.076 3.073 -11.300 1.00 21.34 C ATOM 873 C LYS A 54 -1.270 3.042 -12.595 1.00 25.15 C ATOM 874 O LYS A 54 -0.620 2.045 -12.908 1.00 55.25 O ATOM 875 CB LYS A 54 -3.572 3.024 -11.616 1.00 3.35 C ATOM 876 CG LYS A 54 -4.118 4.326 -12.179 1.00 64.23 C ATOM 877 CD LYS A 54 -5.636 4.318 -12.231 1.00 45.13 C ATOM 878 CE LYS A 54 -6.227 5.478 -11.444 1.00 44.42 C ATOM 879 NZ LYS A 54 -7.539 5.913 -11.998 1.00 21.23 N ATOM 0 H LYS A 54 -2.579 4.799 -10.221 1.00 72.42 H new ATOM 0 HA LYS A 54 -1.808 2.200 -10.705 1.00 21.34 H new ATOM 0 HB2 LYS A 54 -3.758 2.223 -12.331 1.00 3.35 H new ATOM 0 HB3 LYS A 54 -4.119 2.773 -10.707 1.00 3.35 H new ATOM 0 HG2 LYS A 54 -3.779 5.160 -11.564 1.00 64.23 H new ATOM 0 HG3 LYS A 54 -3.720 4.486 -13.181 1.00 64.23 H new ATOM 0 HD2 LYS A 54 -5.966 4.375 -13.268 1.00 45.13 H new ATOM 0 HD3 LYS A 54 -6.010 3.376 -11.829 1.00 45.13 H new ATOM 0 HE2 LYS A 54 -6.352 5.183 -10.402 1.00 44.42 H new ATOM 0 HE3 LYS A 54 -5.531 6.317 -11.456 1.00 44.42 H new ATOM 0 HZ1 LYS A 54 -7.908 6.705 -11.434 1.00 21.23 H new ATOM 0 HZ2 LYS A 54 -7.415 6.218 -12.984 1.00 21.23 H new ATOM 0 HZ3 LYS A 54 -8.211 5.120 -11.963 1.00 21.23 H new ATOM 893 N GLU A 55 -1.319 4.140 -13.343 1.00 2.32 N ATOM 894 CA GLU A 55 -0.593 4.237 -14.604 1.00 11.51 C ATOM 895 C GLU A 55 0.881 3.890 -14.411 1.00 41.52 C ATOM 896 O GLU A 55 1.447 3.099 -15.164 1.00 4.23 O ATOM 897 CB GLU A 55 -0.725 5.646 -15.187 1.00 52.03 C ATOM 898 CG GLU A 55 -0.923 5.666 -16.693 1.00 71.31 C ATOM 899 CD GLU A 55 0.142 6.472 -17.411 1.00 1.24 C ATOM 900 OE1 GLU A 55 1.280 5.973 -17.536 1.00 43.33 O ATOM 901 OE2 GLU A 55 -0.163 7.602 -17.847 1.00 12.11 O ATOM 0 H GLU A 55 -1.853 4.974 -13.098 1.00 2.32 H new ATOM 0 HA GLU A 55 -1.029 3.521 -15.301 1.00 11.51 H new ATOM 0 HB2 GLU A 55 -1.567 6.149 -14.712 1.00 52.03 H new ATOM 0 HB3 GLU A 55 0.169 6.218 -14.939 1.00 52.03 H new ATOM 0 HG2 GLU A 55 -0.915 4.643 -17.070 1.00 71.31 H new ATOM 0 HG3 GLU A 55 -1.904 6.083 -16.921 1.00 71.31 H new ATOM 908 N GLY A 56 1.495 4.489 -13.396 1.00 74.31 N ATOM 909 CA GLY A 56 2.897 4.232 -13.122 1.00 2.04 C ATOM 910 C GLY A 56 3.172 2.770 -12.831 1.00 60.41 C ATOM 911 O GLY A 56 4.170 2.215 -13.294 1.00 44.33 O ATOM 0 H GLY A 56 1.047 5.147 -12.759 1.00 74.31 H new ATOM 0 HA2 GLY A 56 3.495 4.548 -13.977 1.00 2.04 H new ATOM 0 HA3 GLY A 56 3.214 4.835 -12.271 1.00 2.04 H new ATOM 915 N CYS A 57 2.289 2.146 -12.060 1.00 2.02 N ATOM 916 CA CYS A 57 2.442 0.739 -11.706 1.00 74.23 C ATOM 917 C CYS A 57 2.180 -0.157 -12.911 1.00 22.42 C ATOM 918 O CYS A 57 2.699 -1.271 -12.992 1.00 15.52 O ATOM 919 CB CYS A 57 1.491 0.372 -10.565 1.00 14.12 C ATOM 920 SG CYS A 57 2.284 0.286 -8.942 1.00 12.11 S ATOM 0 H CYS A 57 1.460 2.592 -11.668 1.00 2.02 H new ATOM 0 HA CYS A 57 3.469 0.583 -11.377 1.00 74.23 H new ATOM 0 HB2 CYS A 57 0.687 1.107 -10.526 1.00 14.12 H new ATOM 0 HB3 CYS A 57 1.032 -0.592 -10.785 1.00 14.12 H new ATOM 0 HG CYS A 57 1.730 1.148 -8.142 1.00 12.11 H new ATOM 926 N GLN A 58 1.371 0.334 -13.843 1.00 50.13 N ATOM 927 CA GLN A 58 1.037 -0.424 -15.043 1.00 33.34 C ATOM 928 C GLN A 58 2.276 -0.653 -15.903 1.00 5.03 C ATOM 929 O GLN A 58 2.495 -1.752 -16.415 1.00 55.23 O ATOM 930 CB GLN A 58 -0.033 0.308 -15.855 1.00 51.25 C ATOM 931 CG GLN A 58 -1.203 -0.575 -16.254 1.00 21.25 C ATOM 932 CD GLN A 58 -2.389 0.221 -16.762 1.00 44.41 C ATOM 933 OE1 GLN A 58 -2.808 1.197 -16.138 1.00 11.03 O ATOM 934 NE2 GLN A 58 -2.937 -0.191 -17.899 1.00 62.13 N ATOM 0 H GLN A 58 0.934 1.254 -13.791 1.00 50.13 H new ATOM 0 HA GLN A 58 0.646 -1.393 -14.733 1.00 33.34 H new ATOM 0 HB2 GLN A 58 -0.406 1.150 -15.273 1.00 51.25 H new ATOM 0 HB3 GLN A 58 0.424 0.720 -16.755 1.00 51.25 H new ATOM 0 HG2 GLN A 58 -0.880 -1.272 -17.027 1.00 21.25 H new ATOM 0 HG3 GLN A 58 -1.512 -1.172 -15.396 1.00 21.25 H new ATOM 0 HE21 GLN A 58 -2.557 -1.005 -18.383 1.00 62.13 H new ATOM 0 HE22 GLN A 58 -3.738 0.306 -18.289 1.00 62.13 H new ATOM 943 N LYS A 59 3.084 0.390 -16.059 1.00 20.12 N ATOM 944 CA LYS A 59 4.301 0.304 -16.857 1.00 74.52 C ATOM 945 C LYS A 59 5.327 -0.603 -16.186 1.00 61.41 C ATOM 946 O LYS A 59 6.298 -1.029 -16.813 1.00 12.33 O ATOM 947 CB LYS A 59 4.897 1.698 -17.067 1.00 34.43 C ATOM 948 CG LYS A 59 4.830 2.176 -18.507 1.00 4.23 C ATOM 949 CD LYS A 59 3.409 2.539 -18.908 1.00 12.55 C ATOM 950 CE LYS A 59 3.154 4.031 -18.766 1.00 54.13 C ATOM 951 NZ LYS A 59 2.197 4.531 -19.791 1.00 34.24 N ATOM 0 H LYS A 59 2.918 1.306 -15.643 1.00 20.12 H new ATOM 0 HA LYS A 59 4.042 -0.123 -17.826 1.00 74.52 H new ATOM 0 HB2 LYS A 59 4.369 2.409 -16.432 1.00 34.43 H new ATOM 0 HB3 LYS A 59 5.938 1.692 -16.743 1.00 34.43 H new ATOM 0 HG2 LYS A 59 5.478 3.043 -18.634 1.00 4.23 H new ATOM 0 HG3 LYS A 59 5.208 1.396 -19.168 1.00 4.23 H new ATOM 0 HD2 LYS A 59 3.232 2.235 -19.940 1.00 12.55 H new ATOM 0 HD3 LYS A 59 2.703 1.987 -18.288 1.00 12.55 H new ATOM 0 HE2 LYS A 59 2.761 4.239 -17.771 1.00 54.13 H new ATOM 0 HE3 LYS A 59 4.097 4.571 -18.856 1.00 54.13 H new ATOM 0 HZ1 LYS A 59 1.541 5.209 -19.352 1.00 34.24 H new ATOM 0 HZ2 LYS A 59 2.722 5.002 -20.555 1.00 34.24 H new ATOM 0 HZ3 LYS A 59 1.659 3.732 -20.182 1.00 34.24 H new ATOM 965 N ILE A 60 5.106 -0.898 -14.909 1.00 44.11 N ATOM 966 CA ILE A 60 6.010 -1.757 -14.156 1.00 52.41 C ATOM 967 C ILE A 60 5.713 -3.230 -14.415 1.00 35.24 C ATOM 968 O ILE A 60 6.628 -4.046 -14.544 1.00 44.53 O ATOM 969 CB ILE A 60 5.915 -1.485 -12.643 1.00 34.21 C ATOM 970 CG1 ILE A 60 6.401 -0.070 -12.326 1.00 44.44 C ATOM 971 CG2 ILE A 60 6.723 -2.514 -11.868 1.00 70.34 C ATOM 972 CD1 ILE A 60 6.004 0.412 -10.947 1.00 23.53 C ATOM 0 H ILE A 60 4.308 -0.554 -14.375 1.00 44.11 H new ATOM 0 HA ILE A 60 7.020 -1.527 -14.496 1.00 52.41 H new ATOM 0 HB ILE A 60 4.872 -1.567 -12.339 1.00 34.21 H new ATOM 0 HG12 ILE A 60 7.487 -0.040 -12.414 1.00 44.44 H new ATOM 0 HG13 ILE A 60 6.002 0.618 -13.071 1.00 44.44 H new ATOM 0 HG21 ILE A 60 6.646 -2.308 -10.800 1.00 70.34 H new ATOM 0 HG22 ILE A 60 6.335 -3.512 -12.074 1.00 70.34 H new ATOM 0 HG23 ILE A 60 7.768 -2.461 -12.173 1.00 70.34 H new ATOM 0 HD11 ILE A 60 6.383 1.422 -10.792 1.00 23.53 H new ATOM 0 HD12 ILE A 60 4.917 0.414 -10.861 1.00 23.53 H new ATOM 0 HD13 ILE A 60 6.426 -0.253 -10.194 1.00 23.53 H new ATOM 984 N LEU A 61 4.430 -3.564 -14.494 1.00 20.33 N ATOM 985 CA LEU A 61 4.012 -4.940 -14.742 1.00 61.12 C ATOM 986 C LEU A 61 4.544 -5.439 -16.081 1.00 43.51 C ATOM 987 O LEU A 61 4.978 -6.585 -16.202 1.00 1.31 O ATOM 988 CB LEU A 61 2.486 -5.042 -14.716 1.00 12.10 C ATOM 989 CG LEU A 61 1.832 -4.973 -13.335 1.00 30.14 C ATOM 990 CD1 LEU A 61 0.317 -4.994 -13.461 1.00 4.40 C ATOM 991 CD2 LEU A 61 2.312 -6.122 -12.460 1.00 12.22 C ATOM 0 H LEU A 61 3.661 -2.902 -14.390 1.00 20.33 H new ATOM 0 HA LEU A 61 4.426 -5.567 -13.952 1.00 61.12 H new ATOM 0 HB2 LEU A 61 2.078 -4.239 -15.330 1.00 12.10 H new ATOM 0 HB3 LEU A 61 2.197 -5.982 -15.186 1.00 12.10 H new ATOM 0 HG LEU A 61 2.124 -4.035 -12.862 1.00 30.14 H new ATOM 0 HD11 LEU A 61 -0.131 -4.944 -12.469 1.00 4.40 H new ATOM 0 HD12 LEU A 61 -0.011 -4.138 -14.051 1.00 4.40 H new ATOM 0 HD13 LEU A 61 0.006 -5.915 -13.954 1.00 4.40 H new ATOM 0 HD21 LEU A 61 1.837 -6.057 -11.481 1.00 12.22 H new ATOM 0 HD22 LEU A 61 2.050 -7.070 -12.929 1.00 12.22 H new ATOM 0 HD23 LEU A 61 3.394 -6.062 -12.342 1.00 12.22 H new ATOM 1003 N THR A 62 4.509 -4.569 -17.087 1.00 12.00 N ATOM 1004 CA THR A 62 4.988 -4.920 -18.417 1.00 12.35 C ATOM 1005 C THR A 62 6.474 -5.258 -18.395 1.00 12.14 C ATOM 1006 O THR A 62 6.945 -6.084 -19.177 1.00 34.14 O ATOM 1007 CB THR A 62 4.748 -3.776 -19.421 1.00 12.41 C ATOM 1008 OG1 THR A 62 4.527 -4.311 -20.731 1.00 73.12 O ATOM 1009 CG2 THR A 62 5.934 -2.824 -19.451 1.00 71.35 C ATOM 0 H THR A 62 4.154 -3.616 -17.004 1.00 12.00 H new ATOM 0 HA THR A 62 4.424 -5.797 -18.735 1.00 12.35 H new ATOM 0 HB THR A 62 3.865 -3.222 -19.101 1.00 12.41 H new ATOM 0 HG1 THR A 62 4.374 -3.577 -21.362 1.00 73.12 H new ATOM 0 HG21 THR A 62 5.741 -2.025 -20.167 1.00 71.35 H new ATOM 0 HG22 THR A 62 6.082 -2.395 -18.460 1.00 71.35 H new ATOM 0 HG23 THR A 62 6.830 -3.369 -19.748 1.00 71.35 H new ATOM 1017 N VAL A 63 7.209 -4.614 -17.494 1.00 71.41 N ATOM 1018 CA VAL A 63 8.644 -4.849 -17.369 1.00 44.34 C ATOM 1019 C VAL A 63 8.925 -6.122 -16.580 1.00 34.01 C ATOM 1020 O VAL A 63 9.802 -6.908 -16.941 1.00 11.15 O ATOM 1021 CB VAL A 63 9.347 -3.664 -16.680 1.00 30.02 C ATOM 1022 CG1 VAL A 63 10.810 -3.990 -16.421 1.00 11.34 C ATOM 1023 CG2 VAL A 63 9.214 -2.404 -17.522 1.00 55.31 C ATOM 0 H VAL A 63 6.836 -3.926 -16.840 1.00 71.41 H new ATOM 0 HA VAL A 63 9.038 -4.958 -18.380 1.00 44.34 H new ATOM 0 HB VAL A 63 8.864 -3.484 -15.720 1.00 30.02 H new ATOM 0 HG11 VAL A 63 11.291 -3.142 -15.934 1.00 11.34 H new ATOM 0 HG12 VAL A 63 10.879 -4.866 -15.776 1.00 11.34 H new ATOM 0 HG13 VAL A 63 11.310 -4.196 -17.367 1.00 11.34 H new ATOM 0 HG21 VAL A 63 9.716 -1.577 -17.021 1.00 55.31 H new ATOM 0 HG22 VAL A 63 9.671 -2.568 -18.498 1.00 55.31 H new ATOM 0 HG23 VAL A 63 8.159 -2.163 -17.652 1.00 55.31 H new ATOM 1033 N LEU A 64 8.177 -6.320 -15.500 1.00 22.21 N ATOM 1034 CA LEU A 64 8.346 -7.499 -14.659 1.00 62.53 C ATOM 1035 C LEU A 64 7.772 -8.739 -15.337 1.00 43.13 C ATOM 1036 O LEU A 64 8.148 -9.866 -15.014 1.00 65.24 O ATOM 1037 CB LEU A 64 7.668 -7.285 -13.304 1.00 44.21 C ATOM 1038 CG LEU A 64 8.390 -6.351 -12.332 1.00 11.41 C ATOM 1039 CD1 LEU A 64 7.424 -5.818 -11.286 1.00 44.51 C ATOM 1040 CD2 LEU A 64 9.555 -7.068 -11.668 1.00 33.51 C ATOM 0 H LEU A 64 7.448 -5.679 -15.186 1.00 22.21 H new ATOM 0 HA LEU A 64 9.414 -7.654 -14.504 1.00 62.53 H new ATOM 0 HB2 LEU A 64 6.667 -6.891 -13.479 1.00 44.21 H new ATOM 0 HB3 LEU A 64 7.549 -8.256 -12.823 1.00 44.21 H new ATOM 0 HG LEU A 64 8.784 -5.506 -12.897 1.00 11.41 H new ATOM 0 HD11 LEU A 64 7.956 -5.155 -10.603 1.00 44.51 H new ATOM 0 HD12 LEU A 64 6.624 -5.265 -11.778 1.00 44.51 H new ATOM 0 HD13 LEU A 64 6.999 -6.651 -10.726 1.00 44.51 H new ATOM 0 HD21 LEU A 64 10.057 -6.387 -10.980 1.00 33.51 H new ATOM 0 HD22 LEU A 64 9.184 -7.933 -11.117 1.00 33.51 H new ATOM 0 HD23 LEU A 64 10.261 -7.399 -12.430 1.00 33.51 H new ATOM 1052 N ASP A 65 6.860 -8.522 -16.278 1.00 25.20 N ATOM 1053 CA ASP A 65 6.235 -9.622 -17.005 1.00 34.52 C ATOM 1054 C ASP A 65 7.291 -10.538 -17.617 1.00 13.20 C ATOM 1055 O ASP A 65 7.377 -11.725 -17.301 1.00 11.55 O ATOM 1056 CB ASP A 65 5.315 -9.081 -18.099 1.00 12.24 C ATOM 1057 CG ASP A 65 5.252 -9.996 -19.308 1.00 53.54 C ATOM 1058 OD1 ASP A 65 5.041 -11.211 -19.120 1.00 71.43 O ATOM 1059 OD2 ASP A 65 5.416 -9.494 -20.441 1.00 65.43 O ATOM 0 H ASP A 65 6.537 -7.595 -16.556 1.00 25.20 H new ATOM 0 HA ASP A 65 5.642 -10.202 -16.298 1.00 34.52 H new ATOM 0 HB2 ASP A 65 4.312 -8.950 -17.694 1.00 12.24 H new ATOM 0 HB3 ASP A 65 5.665 -8.097 -18.410 1.00 12.24 H new ATOM 1064 N PRO A 66 8.115 -9.975 -18.514 1.00 24.10 N ATOM 1065 CA PRO A 66 9.179 -10.724 -19.190 1.00 52.44 C ATOM 1066 C PRO A 66 10.312 -11.103 -18.242 1.00 23.22 C ATOM 1067 O PRO A 66 11.134 -11.963 -18.556 1.00 24.12 O ATOM 1068 CB PRO A 66 9.678 -9.746 -20.256 1.00 52.44 C ATOM 1069 CG PRO A 66 9.343 -8.396 -19.719 1.00 32.54 C ATOM 1070 CD PRO A 66 8.069 -8.566 -18.938 1.00 51.40 C ATOM 0 HA PRO A 66 8.819 -11.670 -19.595 1.00 52.44 H new ATOM 0 HB2 PRO A 66 10.750 -9.852 -20.419 1.00 52.44 H new ATOM 0 HB3 PRO A 66 9.190 -9.923 -21.215 1.00 52.44 H new ATOM 0 HG2 PRO A 66 10.144 -8.019 -19.083 1.00 32.54 H new ATOM 0 HG3 PRO A 66 9.213 -7.676 -20.527 1.00 32.54 H new ATOM 0 HD2 PRO A 66 8.028 -7.890 -18.084 1.00 51.40 H new ATOM 0 HD3 PRO A 66 7.191 -8.359 -19.550 1.00 51.40 H new ATOM 1078 N MET A 67 10.349 -10.456 -17.082 1.00 3.30 N ATOM 1079 CA MET A 67 11.381 -10.727 -16.089 1.00 24.00 C ATOM 1080 C MET A 67 11.050 -11.985 -15.292 1.00 72.03 C ATOM 1081 O MET A 67 11.930 -12.595 -14.683 1.00 2.41 O ATOM 1082 CB MET A 67 11.534 -9.534 -15.142 1.00 34.55 C ATOM 1083 CG MET A 67 12.200 -8.329 -15.787 1.00 63.14 C ATOM 1084 SD MET A 67 12.071 -6.842 -14.776 1.00 22.22 S ATOM 1085 CE MET A 67 13.300 -5.797 -15.554 1.00 50.34 C ATOM 0 H MET A 67 9.676 -9.740 -16.807 1.00 3.30 H new ATOM 0 HA MET A 67 12.323 -10.888 -16.614 1.00 24.00 H new ATOM 0 HB2 MET A 67 10.550 -9.242 -14.776 1.00 34.55 H new ATOM 0 HB3 MET A 67 12.118 -9.841 -14.275 1.00 34.55 H new ATOM 0 HG2 MET A 67 13.252 -8.552 -15.966 1.00 63.14 H new ATOM 0 HG3 MET A 67 11.744 -8.144 -16.759 1.00 63.14 H new ATOM 0 HE1 MET A 67 13.315 -4.824 -15.062 1.00 50.34 H new ATOM 0 HE2 MET A 67 14.282 -6.263 -15.466 1.00 50.34 H new ATOM 0 HE3 MET A 67 13.053 -5.667 -16.608 1.00 50.34 H new ATOM 1095 N VAL A 68 9.777 -12.367 -15.298 1.00 10.35 N ATOM 1096 CA VAL A 68 9.331 -13.552 -14.576 1.00 22.50 C ATOM 1097 C VAL A 68 10.080 -14.795 -15.044 1.00 61.22 C ATOM 1098 O VAL A 68 10.743 -15.481 -14.265 1.00 42.21 O ATOM 1099 CB VAL A 68 7.819 -13.782 -14.754 1.00 44.34 C ATOM 1100 CG1 VAL A 68 7.484 -15.260 -14.631 1.00 63.14 C ATOM 1101 CG2 VAL A 68 7.033 -12.963 -13.740 1.00 73.22 C ATOM 0 H VAL A 68 9.036 -11.873 -15.795 1.00 10.35 H new ATOM 0 HA VAL A 68 9.543 -13.378 -13.521 1.00 22.50 H new ATOM 0 HB VAL A 68 7.535 -13.452 -15.753 1.00 44.34 H new ATOM 0 HG11 VAL A 68 6.411 -15.402 -14.760 1.00 63.14 H new ATOM 0 HG12 VAL A 68 8.019 -15.819 -15.399 1.00 63.14 H new ATOM 0 HG13 VAL A 68 7.782 -15.620 -13.646 1.00 63.14 H new ATOM 0 HG21 VAL A 68 5.966 -13.137 -13.880 1.00 73.22 H new ATOM 0 HG22 VAL A 68 7.320 -13.260 -12.731 1.00 73.22 H new ATOM 0 HG23 VAL A 68 7.249 -11.904 -13.882 1.00 73.22 H new ATOM 1111 N PRO A 69 9.975 -15.094 -16.347 1.00 1.10 N ATOM 1112 CA PRO A 69 10.637 -16.256 -16.949 1.00 40.32 C ATOM 1113 C PRO A 69 12.152 -16.093 -17.008 1.00 32.31 C ATOM 1114 O PRO A 69 12.864 -16.979 -17.482 1.00 1.10 O ATOM 1115 CB PRO A 69 10.049 -16.306 -18.361 1.00 31.24 C ATOM 1116 CG PRO A 69 9.635 -14.905 -18.650 1.00 43.40 C ATOM 1117 CD PRO A 69 9.202 -14.321 -17.333 1.00 10.44 C ATOM 0 HA PRO A 69 10.471 -17.165 -16.371 1.00 40.32 H new ATOM 0 HB2 PRO A 69 10.785 -16.658 -19.084 1.00 31.24 H new ATOM 0 HB3 PRO A 69 9.200 -16.988 -18.412 1.00 31.24 H new ATOM 0 HG2 PRO A 69 10.460 -14.335 -19.078 1.00 43.40 H new ATOM 0 HG3 PRO A 69 8.821 -14.880 -19.374 1.00 43.40 H new ATOM 0 HD2 PRO A 69 9.425 -13.256 -17.273 1.00 10.44 H new ATOM 0 HD3 PRO A 69 8.129 -14.431 -17.178 1.00 10.44 H new ATOM 1125 N THR A 70 12.640 -14.956 -16.524 1.00 45.53 N ATOM 1126 CA THR A 70 14.070 -14.676 -16.522 1.00 33.20 C ATOM 1127 C THR A 70 14.495 -13.989 -15.230 1.00 72.35 C ATOM 1128 O THR A 70 15.312 -13.068 -15.244 1.00 64.02 O ATOM 1129 CB THR A 70 14.471 -13.791 -17.717 1.00 74.32 C ATOM 1130 OG1 THR A 70 13.812 -12.523 -17.631 1.00 53.21 O ATOM 1131 CG2 THR A 70 14.115 -14.465 -19.034 1.00 51.45 C ATOM 0 H THR A 70 12.065 -14.213 -16.128 1.00 45.53 H new ATOM 0 HA THR A 70 14.579 -15.636 -16.603 1.00 33.20 H new ATOM 0 HB THR A 70 15.550 -13.642 -17.684 1.00 74.32 H new ATOM 0 HG1 THR A 70 12.913 -12.595 -18.015 1.00 53.21 H new ATOM 0 HG21 THR A 70 14.408 -13.821 -19.863 1.00 51.45 H new ATOM 0 HG22 THR A 70 14.642 -15.416 -19.110 1.00 51.45 H new ATOM 0 HG23 THR A 70 13.040 -14.641 -19.074 1.00 51.45 H new ATOM 1139 N GLY A 71 13.936 -14.442 -14.112 1.00 32.20 N ATOM 1140 CA GLY A 71 14.270 -13.859 -12.826 1.00 12.02 C ATOM 1141 C GLY A 71 14.164 -14.858 -11.690 1.00 33.15 C ATOM 1142 O GLY A 71 13.821 -16.020 -11.908 1.00 62.33 O ATOM 0 H GLY A 71 13.258 -15.203 -14.074 1.00 32.20 H new ATOM 0 HA2 GLY A 71 15.285 -13.462 -12.863 1.00 12.02 H new ATOM 0 HA3 GLY A 71 13.606 -13.018 -12.629 1.00 12.02 H new ATOM 1146 N SER A 72 14.463 -14.407 -10.477 1.00 44.21 N ATOM 1147 CA SER A 72 14.404 -15.271 -9.304 1.00 22.33 C ATOM 1148 C SER A 72 13.375 -14.758 -8.301 1.00 21.25 C ATOM 1149 O SER A 72 12.596 -13.855 -8.603 1.00 21.31 O ATOM 1150 CB SER A 72 15.780 -15.359 -8.640 1.00 31.01 C ATOM 1151 OG SER A 72 15.912 -14.395 -7.610 1.00 25.13 O ATOM 0 H SER A 72 14.749 -13.448 -10.280 1.00 44.21 H new ATOM 0 HA SER A 72 14.101 -16.266 -9.631 1.00 22.33 H new ATOM 0 HB2 SER A 72 15.925 -16.358 -8.228 1.00 31.01 H new ATOM 0 HB3 SER A 72 16.558 -15.206 -9.388 1.00 31.01 H new ATOM 0 HG SER A 72 16.799 -14.473 -7.201 1.00 25.13 H new ATOM 1157 N GLU A 73 13.380 -15.343 -7.107 1.00 43.32 N ATOM 1158 CA GLU A 73 12.446 -14.946 -6.060 1.00 44.24 C ATOM 1159 C GLU A 73 12.566 -13.454 -5.761 1.00 75.11 C ATOM 1160 O GLU A 73 11.566 -12.770 -5.546 1.00 3.12 O ATOM 1161 CB GLU A 73 12.699 -15.754 -4.786 1.00 71.23 C ATOM 1162 CG GLU A 73 14.120 -15.632 -4.260 1.00 41.30 C ATOM 1163 CD GLU A 73 14.505 -16.780 -3.348 1.00 60.25 C ATOM 1164 OE1 GLU A 73 14.021 -16.814 -2.198 1.00 64.14 O ATOM 1165 OE2 GLU A 73 15.291 -17.646 -3.786 1.00 11.03 O ATOM 0 H GLU A 73 14.019 -16.092 -6.841 1.00 43.32 H new ATOM 0 HA GLU A 73 11.435 -15.148 -6.415 1.00 44.24 H new ATOM 0 HB2 GLU A 73 12.005 -15.424 -4.013 1.00 71.23 H new ATOM 0 HB3 GLU A 73 12.482 -16.804 -4.983 1.00 71.23 H new ATOM 0 HG2 GLU A 73 14.813 -15.593 -5.101 1.00 41.30 H new ATOM 0 HG3 GLU A 73 14.223 -14.692 -3.718 1.00 41.30 H new ATOM 1172 N ASN A 74 13.798 -12.956 -5.748 1.00 31.44 N ATOM 1173 CA ASN A 74 14.051 -11.547 -5.474 1.00 45.43 C ATOM 1174 C ASN A 74 13.383 -10.660 -6.521 1.00 24.23 C ATOM 1175 O ASN A 74 13.189 -9.464 -6.305 1.00 43.40 O ATOM 1176 CB ASN A 74 15.556 -11.273 -5.444 1.00 71.21 C ATOM 1177 CG ASN A 74 16.235 -11.908 -4.245 1.00 42.50 C ATOM 1178 OD1 ASN A 74 16.341 -11.297 -3.182 1.00 63.55 O ATOM 1179 ND2 ASN A 74 16.700 -13.140 -4.414 1.00 65.14 N ATOM 0 H ASN A 74 14.637 -13.508 -5.924 1.00 31.44 H new ATOM 0 HA ASN A 74 13.626 -11.311 -4.498 1.00 45.43 H new ATOM 0 HB2 ASN A 74 16.010 -11.653 -6.359 1.00 71.21 H new ATOM 0 HB3 ASN A 74 15.726 -10.197 -5.427 1.00 71.21 H new ATOM 0 HD21 ASN A 74 17.168 -13.619 -3.644 1.00 65.14 H new ATOM 0 HD22 ASN A 74 16.589 -13.608 -5.314 1.00 65.14 H new ATOM 1186 N LEU A 75 13.033 -11.257 -7.655 1.00 11.35 N ATOM 1187 CA LEU A 75 12.385 -10.523 -8.737 1.00 13.10 C ATOM 1188 C LEU A 75 10.886 -10.807 -8.767 1.00 74.21 C ATOM 1189 O LEU A 75 10.068 -9.893 -8.664 1.00 44.21 O ATOM 1190 CB LEU A 75 13.014 -10.896 -10.081 1.00 65.12 C ATOM 1191 CG LEU A 75 12.517 -10.110 -11.295 1.00 30.34 C ATOM 1192 CD1 LEU A 75 13.672 -9.788 -12.231 1.00 70.11 C ATOM 1193 CD2 LEU A 75 11.435 -10.890 -12.029 1.00 0.13 C ATOM 0 H LEU A 75 13.187 -12.246 -7.849 1.00 11.35 H new ATOM 0 HA LEU A 75 12.530 -9.458 -8.558 1.00 13.10 H new ATOM 0 HB2 LEU A 75 14.093 -10.763 -10.004 1.00 65.12 H new ATOM 0 HB3 LEU A 75 12.836 -11.956 -10.261 1.00 65.12 H new ATOM 0 HG LEU A 75 12.087 -9.172 -10.945 1.00 30.34 H new ATOM 0 HD11 LEU A 75 13.300 -9.229 -13.089 1.00 70.11 H new ATOM 0 HD12 LEU A 75 14.413 -9.190 -11.702 1.00 70.11 H new ATOM 0 HD13 LEU A 75 14.132 -10.715 -12.574 1.00 70.11 H new ATOM 0 HD21 LEU A 75 11.093 -10.316 -12.890 1.00 0.13 H new ATOM 0 HD22 LEU A 75 11.840 -11.844 -12.367 1.00 0.13 H new ATOM 0 HD23 LEU A 75 10.596 -11.070 -11.356 1.00 0.13 H new ATOM 1205 N LYS A 76 10.534 -12.080 -8.908 1.00 40.05 N ATOM 1206 CA LYS A 76 9.134 -12.487 -8.948 1.00 41.12 C ATOM 1207 C LYS A 76 8.363 -11.899 -7.771 1.00 40.33 C ATOM 1208 O LYS A 76 7.189 -11.550 -7.898 1.00 71.23 O ATOM 1209 CB LYS A 76 9.025 -14.013 -8.932 1.00 61.12 C ATOM 1210 CG LYS A 76 9.803 -14.691 -10.046 1.00 43.35 C ATOM 1211 CD LYS A 76 10.538 -15.922 -9.543 1.00 20.13 C ATOM 1212 CE LYS A 76 9.798 -17.201 -9.906 1.00 51.41 C ATOM 1213 NZ LYS A 76 8.897 -17.649 -8.810 1.00 64.54 N ATOM 0 H LYS A 76 11.199 -12.848 -8.997 1.00 40.05 H new ATOM 0 HA LYS A 76 8.697 -12.107 -9.872 1.00 41.12 H new ATOM 0 HB2 LYS A 76 9.384 -14.384 -7.972 1.00 61.12 H new ATOM 0 HB3 LYS A 76 7.975 -14.295 -9.010 1.00 61.12 H new ATOM 0 HG2 LYS A 76 9.120 -14.975 -10.847 1.00 43.35 H new ATOM 0 HG3 LYS A 76 10.518 -13.988 -10.472 1.00 43.35 H new ATOM 0 HD2 LYS A 76 11.541 -15.947 -9.969 1.00 20.13 H new ATOM 0 HD3 LYS A 76 10.653 -15.862 -8.461 1.00 20.13 H new ATOM 0 HE2 LYS A 76 9.215 -17.038 -10.812 1.00 51.41 H new ATOM 0 HE3 LYS A 76 10.519 -17.988 -10.128 1.00 51.41 H new ATOM 0 HZ1 LYS A 76 8.411 -18.523 -9.096 1.00 64.54 H new ATOM 0 HZ2 LYS A 76 9.457 -17.829 -7.952 1.00 64.54 H new ATOM 0 HZ3 LYS A 76 8.193 -16.909 -8.615 1.00 64.54 H new ATOM 1227 N SER A 77 9.030 -11.789 -6.627 1.00 20.30 N ATOM 1228 CA SER A 77 8.406 -11.245 -5.426 1.00 12.43 C ATOM 1229 C SER A 77 7.814 -9.866 -5.700 1.00 23.41 C ATOM 1230 O SER A 77 6.723 -9.542 -5.229 1.00 41.25 O ATOM 1231 CB SER A 77 9.427 -11.158 -4.290 1.00 1.44 C ATOM 1232 OG SER A 77 9.633 -12.425 -3.691 1.00 73.35 O ATOM 0 H SER A 77 10.003 -12.069 -6.506 1.00 20.30 H new ATOM 0 HA SER A 77 7.600 -11.915 -5.129 1.00 12.43 H new ATOM 0 HB2 SER A 77 10.373 -10.776 -4.675 1.00 1.44 H new ATOM 0 HB3 SER A 77 9.080 -10.449 -3.538 1.00 1.44 H new ATOM 0 HG SER A 77 9.409 -12.377 -2.738 1.00 73.35 H new ATOM 1238 N LEU A 78 8.539 -9.058 -6.465 1.00 60.23 N ATOM 1239 CA LEU A 78 8.087 -7.714 -6.803 1.00 41.33 C ATOM 1240 C LEU A 78 6.918 -7.762 -7.783 1.00 53.13 C ATOM 1241 O LEU A 78 5.988 -6.959 -7.697 1.00 71.23 O ATOM 1242 CB LEU A 78 9.237 -6.902 -7.403 1.00 23.44 C ATOM 1243 CG LEU A 78 8.857 -5.559 -8.026 1.00 50.35 C ATOM 1244 CD1 LEU A 78 8.294 -4.621 -6.969 1.00 51.43 C ATOM 1245 CD2 LEU A 78 10.060 -4.930 -8.712 1.00 14.22 C ATOM 0 H LEU A 78 9.443 -9.311 -6.863 1.00 60.23 H new ATOM 0 HA LEU A 78 7.749 -7.231 -5.886 1.00 41.33 H new ATOM 0 HB2 LEU A 78 9.974 -6.721 -6.621 1.00 23.44 H new ATOM 0 HB3 LEU A 78 9.724 -7.509 -8.166 1.00 23.44 H new ATOM 0 HG LEU A 78 8.086 -5.734 -8.776 1.00 50.35 H new ATOM 0 HD11 LEU A 78 8.029 -3.670 -7.431 1.00 51.43 H new ATOM 0 HD12 LEU A 78 7.406 -5.068 -6.522 1.00 51.43 H new ATOM 0 HD13 LEU A 78 9.043 -4.453 -6.196 1.00 51.43 H new ATOM 0 HD21 LEU A 78 9.771 -3.975 -9.150 1.00 14.22 H new ATOM 0 HD22 LEU A 78 10.853 -4.769 -7.981 1.00 14.22 H new ATOM 0 HD23 LEU A 78 10.420 -5.595 -9.497 1.00 14.22 H new ATOM 1257 N PHE A 79 6.972 -8.710 -8.712 1.00 22.22 N ATOM 1258 CA PHE A 79 5.917 -8.864 -9.708 1.00 21.10 C ATOM 1259 C PHE A 79 4.562 -9.070 -9.037 1.00 43.11 C ATOM 1260 O PHE A 79 3.544 -8.559 -9.502 1.00 71.42 O ATOM 1261 CB PHE A 79 6.226 -10.045 -10.631 1.00 61.44 C ATOM 1262 CG PHE A 79 5.266 -10.177 -11.778 1.00 32.10 C ATOM 1263 CD1 PHE A 79 4.955 -9.082 -12.568 1.00 71.11 C ATOM 1264 CD2 PHE A 79 4.674 -11.396 -12.065 1.00 1.44 C ATOM 1265 CE1 PHE A 79 4.073 -9.200 -13.624 1.00 22.12 C ATOM 1266 CE2 PHE A 79 3.791 -11.521 -13.122 1.00 43.24 C ATOM 1267 CZ PHE A 79 3.489 -10.421 -13.901 1.00 0.10 C ATOM 0 H PHE A 79 7.734 -9.383 -8.797 1.00 22.22 H new ATOM 0 HA PHE A 79 5.875 -7.950 -10.300 1.00 21.10 H new ATOM 0 HB2 PHE A 79 7.236 -9.934 -11.024 1.00 61.44 H new ATOM 0 HB3 PHE A 79 6.211 -10.965 -10.047 1.00 61.44 H new ATOM 0 HD1 PHE A 79 5.408 -8.125 -12.355 1.00 71.11 H new ATOM 0 HD2 PHE A 79 4.904 -12.258 -11.457 1.00 1.44 H new ATOM 0 HE1 PHE A 79 3.840 -8.339 -14.233 1.00 22.12 H new ATOM 0 HE2 PHE A 79 3.338 -12.477 -13.338 1.00 43.24 H new ATOM 0 HZ PHE A 79 2.798 -10.515 -14.725 1.00 0.10 H new ATOM 1277 N ASN A 80 4.559 -9.822 -7.941 1.00 30.23 N ATOM 1278 CA ASN A 80 3.330 -10.097 -7.206 1.00 5.45 C ATOM 1279 C ASN A 80 2.928 -8.900 -6.350 1.00 15.12 C ATOM 1280 O ASN A 80 1.746 -8.580 -6.224 1.00 4.50 O ATOM 1281 CB ASN A 80 3.504 -11.334 -6.324 1.00 24.03 C ATOM 1282 CG ASN A 80 2.950 -12.589 -6.972 1.00 72.11 C ATOM 1283 OD1 ASN A 80 3.110 -12.803 -8.174 1.00 71.34 O ATOM 1284 ND2 ASN A 80 2.295 -13.426 -6.176 1.00 4.21 N ATOM 0 H ASN A 80 5.394 -10.252 -7.542 1.00 30.23 H new ATOM 0 HA ASN A 80 2.538 -10.285 -7.931 1.00 5.45 H new ATOM 0 HB2 ASN A 80 4.563 -11.477 -6.108 1.00 24.03 H new ATOM 0 HB3 ASN A 80 3.003 -11.170 -5.370 1.00 24.03 H new ATOM 0 HD21 ASN A 80 1.900 -14.287 -6.555 1.00 4.21 H new ATOM 0 HD22 ASN A 80 2.186 -13.208 -5.185 1.00 4.21 H new ATOM 1291 N THR A 81 3.922 -8.240 -5.762 1.00 73.31 N ATOM 1292 CA THR A 81 3.675 -7.080 -4.917 1.00 63.02 C ATOM 1293 C THR A 81 3.065 -5.935 -5.719 1.00 75.53 C ATOM 1294 O THR A 81 2.111 -5.295 -5.279 1.00 1.51 O ATOM 1295 CB THR A 81 4.969 -6.588 -4.244 1.00 15.23 C ATOM 1296 OG1 THR A 81 5.609 -7.671 -3.561 1.00 2.01 O ATOM 1297 CG2 THR A 81 4.677 -5.464 -3.262 1.00 45.00 C ATOM 0 H THR A 81 4.906 -8.491 -5.857 1.00 73.31 H new ATOM 0 HA THR A 81 2.972 -7.395 -4.146 1.00 63.02 H new ATOM 0 HB THR A 81 5.632 -6.206 -5.020 1.00 15.23 H new ATOM 0 HG1 THR A 81 6.022 -8.272 -4.216 1.00 2.01 H new ATOM 0 HG21 THR A 81 5.607 -5.134 -2.800 1.00 45.00 H new ATOM 0 HG22 THR A 81 4.218 -4.629 -3.791 1.00 45.00 H new ATOM 0 HG23 THR A 81 3.996 -5.823 -2.490 1.00 45.00 H new ATOM 1305 N VAL A 82 3.623 -5.684 -6.899 1.00 51.24 N ATOM 1306 CA VAL A 82 3.133 -4.617 -7.765 1.00 73.24 C ATOM 1307 C VAL A 82 1.624 -4.711 -7.952 1.00 45.44 C ATOM 1308 O VAL A 82 0.902 -3.730 -7.764 1.00 74.32 O ATOM 1309 CB VAL A 82 3.815 -4.657 -9.145 1.00 62.53 C ATOM 1310 CG1 VAL A 82 3.211 -3.610 -10.069 1.00 4.13 C ATOM 1311 CG2 VAL A 82 5.316 -4.454 -9.004 1.00 13.32 C ATOM 0 H VAL A 82 4.414 -6.205 -7.277 1.00 51.24 H new ATOM 0 HA VAL A 82 3.377 -3.674 -7.275 1.00 73.24 H new ATOM 0 HB VAL A 82 3.645 -5.639 -9.587 1.00 62.53 H new ATOM 0 HG11 VAL A 82 3.705 -3.653 -11.040 1.00 4.13 H new ATOM 0 HG12 VAL A 82 2.146 -3.807 -10.195 1.00 4.13 H new ATOM 0 HG13 VAL A 82 3.348 -2.619 -9.635 1.00 4.13 H new ATOM 0 HG21 VAL A 82 5.782 -4.485 -9.989 1.00 13.32 H new ATOM 0 HG22 VAL A 82 5.510 -3.486 -8.541 1.00 13.32 H new ATOM 0 HG23 VAL A 82 5.733 -5.245 -8.380 1.00 13.32 H new ATOM 1321 N CYS A 83 1.152 -5.896 -8.321 1.00 2.20 N ATOM 1322 CA CYS A 83 -0.274 -6.119 -8.534 1.00 50.23 C ATOM 1323 C CYS A 83 -1.093 -5.537 -7.387 1.00 54.04 C ATOM 1324 O CYS A 83 -2.134 -4.918 -7.604 1.00 1.23 O ATOM 1325 CB CYS A 83 -0.562 -7.614 -8.676 1.00 51.23 C ATOM 1326 SG CYS A 83 -0.306 -8.260 -10.345 1.00 43.24 S ATOM 0 H CYS A 83 1.735 -6.718 -8.479 1.00 2.20 H new ATOM 0 HA CYS A 83 -0.562 -5.612 -9.455 1.00 50.23 H new ATOM 0 HB2 CYS A 83 0.076 -8.163 -7.984 1.00 51.23 H new ATOM 0 HB3 CYS A 83 -1.593 -7.804 -8.379 1.00 51.23 H new ATOM 0 HG CYS A 83 0.055 -9.507 -10.277 1.00 43.24 H new ATOM 1332 N VAL A 84 -0.616 -5.742 -6.162 1.00 12.13 N ATOM 1333 CA VAL A 84 -1.303 -5.238 -4.979 1.00 23.43 C ATOM 1334 C VAL A 84 -1.404 -3.718 -5.008 1.00 52.02 C ATOM 1335 O VAL A 84 -2.471 -3.151 -4.770 1.00 22.13 O ATOM 1336 CB VAL A 84 -0.585 -5.670 -3.687 1.00 23.30 C ATOM 1337 CG1 VAL A 84 -1.267 -5.065 -2.470 1.00 13.10 C ATOM 1338 CG2 VAL A 84 -0.543 -7.188 -3.584 1.00 61.21 C ATOM 0 H VAL A 84 0.244 -6.254 -5.964 1.00 12.13 H new ATOM 0 HA VAL A 84 -2.306 -5.665 -4.989 1.00 23.43 H new ATOM 0 HB VAL A 84 0.440 -5.301 -3.721 1.00 23.30 H new ATOM 0 HG11 VAL A 84 -0.746 -5.381 -1.566 1.00 13.10 H new ATOM 0 HG12 VAL A 84 -1.242 -3.978 -2.542 1.00 13.10 H new ATOM 0 HG13 VAL A 84 -2.303 -5.402 -2.428 1.00 13.10 H new ATOM 0 HG21 VAL A 84 -0.032 -7.476 -2.665 1.00 61.21 H new ATOM 0 HG22 VAL A 84 -1.560 -7.580 -3.572 1.00 61.21 H new ATOM 0 HG23 VAL A 84 -0.007 -7.596 -4.441 1.00 61.21 H new ATOM 1348 N ILE A 85 -0.286 -3.062 -5.301 1.00 51.31 N ATOM 1349 CA ILE A 85 -0.248 -1.605 -5.362 1.00 63.41 C ATOM 1350 C ILE A 85 -1.156 -1.078 -6.468 1.00 73.33 C ATOM 1351 O ILE A 85 -2.028 -0.244 -6.224 1.00 24.35 O ATOM 1352 CB ILE A 85 1.183 -1.089 -5.598 1.00 73.21 C ATOM 1353 CG1 ILE A 85 2.139 -1.678 -4.558 1.00 14.53 C ATOM 1354 CG2 ILE A 85 1.211 0.432 -5.551 1.00 11.15 C ATOM 1355 CD1 ILE A 85 1.912 -1.146 -3.160 1.00 34.11 C ATOM 0 H ILE A 85 0.606 -3.516 -5.500 1.00 51.31 H new ATOM 0 HA ILE A 85 -0.603 -1.239 -4.399 1.00 63.41 H new ATOM 0 HB ILE A 85 1.511 -1.409 -6.587 1.00 73.21 H new ATOM 0 HG12 ILE A 85 2.029 -2.762 -4.548 1.00 14.53 H new ATOM 0 HG13 ILE A 85 3.165 -1.465 -4.857 1.00 14.53 H new ATOM 0 HG21 ILE A 85 2.229 0.783 -5.719 1.00 11.15 H new ATOM 0 HG22 ILE A 85 0.557 0.832 -6.326 1.00 11.15 H new ATOM 0 HG23 ILE A 85 0.867 0.772 -4.574 1.00 11.15 H new ATOM 0 HD11 ILE A 85 2.624 -1.606 -2.475 1.00 34.11 H new ATOM 0 HD12 ILE A 85 2.051 -0.065 -3.155 1.00 34.11 H new ATOM 0 HD13 ILE A 85 0.897 -1.383 -2.841 1.00 34.11 H new ATOM 1367 N TRP A 86 -0.946 -1.572 -7.683 1.00 2.11 N ATOM 1368 CA TRP A 86 -1.748 -1.151 -8.827 1.00 73.21 C ATOM 1369 C TRP A 86 -3.236 -1.263 -8.519 1.00 1.23 C ATOM 1370 O TRP A 86 -4.012 -0.356 -8.824 1.00 24.40 O ATOM 1371 CB TRP A 86 -1.403 -1.996 -10.055 1.00 31.32 C ATOM 1372 CG TRP A 86 -2.146 -1.582 -11.289 1.00 53.43 C ATOM 1373 CD1 TRP A 86 -1.686 -0.776 -12.291 1.00 34.11 C ATOM 1374 CD2 TRP A 86 -3.482 -1.950 -11.649 1.00 32.34 C ATOM 1375 NE1 TRP A 86 -2.654 -0.622 -13.253 1.00 21.42 N ATOM 1376 CE2 TRP A 86 -3.765 -1.333 -12.883 1.00 11.41 C ATOM 1377 CE3 TRP A 86 -4.465 -2.743 -11.051 1.00 72.14 C ATOM 1378 CZ2 TRP A 86 -4.991 -1.485 -13.526 1.00 14.24 C ATOM 1379 CZ3 TRP A 86 -5.680 -2.892 -11.690 1.00 31.44 C ATOM 1380 CH2 TRP A 86 -5.935 -2.266 -12.918 1.00 73.01 C ATOM 0 H TRP A 86 -0.229 -2.263 -7.902 1.00 2.11 H new ATOM 0 HA TRP A 86 -1.518 -0.106 -9.037 1.00 73.21 H new ATOM 0 HB2 TRP A 86 -0.332 -1.928 -10.245 1.00 31.32 H new ATOM 0 HB3 TRP A 86 -1.623 -3.042 -9.841 1.00 31.32 H new ATOM 0 HD1 TRP A 86 -0.705 -0.326 -12.322 1.00 34.11 H new ATOM 0 HE1 TRP A 86 -2.561 -0.068 -14.105 1.00 21.42 H new ATOM 0 HE3 TRP A 86 -4.278 -3.231 -10.106 1.00 72.14 H new ATOM 0 HZ2 TRP A 86 -5.189 -1.003 -14.472 1.00 14.24 H new ATOM 0 HZ3 TRP A 86 -6.447 -3.501 -11.236 1.00 31.44 H new ATOM 0 HH2 TRP A 86 -6.895 -2.403 -13.393 1.00 73.01 H new ATOM 1391 N CYS A 87 -3.630 -2.378 -7.914 1.00 34.53 N ATOM 1392 CA CYS A 87 -5.027 -2.608 -7.567 1.00 62.43 C ATOM 1393 C CYS A 87 -5.582 -1.445 -6.750 1.00 1.01 C ATOM 1394 O CYS A 87 -6.588 -0.839 -7.120 1.00 41.12 O ATOM 1395 CB CYS A 87 -5.170 -3.913 -6.782 1.00 65.02 C ATOM 1396 SG CYS A 87 -5.947 -5.254 -7.714 1.00 55.40 S ATOM 0 H CYS A 87 -3.001 -3.137 -7.654 1.00 34.53 H new ATOM 0 HA CYS A 87 -5.599 -2.684 -8.492 1.00 62.43 H new ATOM 0 HB2 CYS A 87 -4.182 -4.237 -6.454 1.00 65.02 H new ATOM 0 HB3 CYS A 87 -5.757 -3.722 -5.884 1.00 65.02 H new ATOM 0 HG CYS A 87 -6.021 -6.315 -6.967 1.00 55.40 H new ATOM 1402 N ILE A 88 -4.920 -1.141 -5.639 1.00 70.02 N ATOM 1403 CA ILE A 88 -5.348 -0.052 -4.770 1.00 63.33 C ATOM 1404 C ILE A 88 -5.577 1.229 -5.565 1.00 20.31 C ATOM 1405 O ILE A 88 -6.498 1.994 -5.280 1.00 44.55 O ATOM 1406 CB ILE A 88 -4.314 0.223 -3.661 1.00 3.41 C ATOM 1407 CG1 ILE A 88 -4.085 -1.036 -2.823 1.00 1.34 C ATOM 1408 CG2 ILE A 88 -4.775 1.376 -2.781 1.00 10.33 C ATOM 1409 CD1 ILE A 88 -2.798 -1.008 -2.030 1.00 52.20 C ATOM 0 H ILE A 88 -4.086 -1.633 -5.320 1.00 70.02 H new ATOM 0 HA ILE A 88 -6.286 -0.365 -4.312 1.00 63.33 H new ATOM 0 HB ILE A 88 -3.369 0.503 -4.127 1.00 3.41 H new ATOM 0 HG12 ILE A 88 -4.922 -1.163 -2.137 1.00 1.34 H new ATOM 0 HG13 ILE A 88 -4.078 -1.905 -3.481 1.00 1.34 H new ATOM 0 HG21 ILE A 88 -4.034 1.558 -2.002 1.00 10.33 H new ATOM 0 HG22 ILE A 88 -4.891 2.274 -3.389 1.00 10.33 H new ATOM 0 HG23 ILE A 88 -5.730 1.123 -2.321 1.00 10.33 H new ATOM 0 HD11 ILE A 88 -2.702 -1.932 -1.460 1.00 52.20 H new ATOM 0 HD12 ILE A 88 -1.953 -0.912 -2.712 1.00 52.20 H new ATOM 0 HD13 ILE A 88 -2.810 -0.159 -1.346 1.00 52.20 H new ATOM 1421 N HIS A 89 -4.734 1.455 -6.568 1.00 72.24 N ATOM 1422 CA HIS A 89 -4.844 2.642 -7.408 1.00 71.01 C ATOM 1423 C HIS A 89 -6.005 2.506 -8.389 1.00 22.33 C ATOM 1424 O HIS A 89 -6.575 3.538 -8.738 1.00 1.20 O ATOM 1425 CB HIS A 89 -3.541 2.875 -8.173 1.00 52.43 C ATOM 1426 CG HIS A 89 -2.358 3.107 -7.283 1.00 32.15 C ATOM 1427 ND1 HIS A 89 -2.365 4.010 -6.242 1.00 61.22 N ATOM 1428 CD2 HIS A 89 -1.127 2.545 -7.285 1.00 75.24 C ATOM 1429 CE1 HIS A 89 -1.188 3.994 -5.641 1.00 4.52 C ATOM 1430 NE2 HIS A 89 -0.419 3.113 -6.254 1.00 13.01 N ATOM 0 H HIS A 89 -3.967 0.831 -6.819 1.00 72.24 H new ATOM 0 HA HIS A 89 -5.034 3.498 -6.761 1.00 71.01 H new ATOM 0 HB2 HIS A 89 -3.343 2.012 -8.809 1.00 52.43 H new ATOM 0 HB3 HIS A 89 -3.664 3.735 -8.831 1.00 52.43 H new ATOM 0 HD2 HIS A 89 -0.768 1.791 -7.970 1.00 75.24 H new ATOM 0 HE1 HIS A 89 -0.904 4.599 -4.793 1.00 4.52 H new ATOM 0 HE2 HIS A 89 0.544 2.890 -6.003 1.00 13.01 H new ATOM 1438 N ALA A 90 -6.358 1.301 -8.827 1.00 54.15 N ATOM 1439 CA ALA A 90 -7.461 1.122 -9.763 1.00 60.43 C ATOM 1440 C ALA A 90 -8.776 0.891 -9.024 1.00 51.25 C ATOM 1441 O ALA A 90 -9.726 0.347 -9.584 1.00 1.25 O ATOM 1442 CB ALA A 90 -7.172 -0.039 -10.702 1.00 25.42 C ATOM 0 H ALA A 90 -5.896 0.435 -8.549 1.00 54.15 H new ATOM 0 HA ALA A 90 -7.559 2.035 -10.350 1.00 60.43 H new ATOM 0 HB1 ALA A 90 -8.004 -0.162 -11.396 1.00 25.42 H new ATOM 0 HB2 ALA A 90 -6.259 0.165 -11.262 1.00 25.42 H new ATOM 0 HB3 ALA A 90 -7.045 -0.953 -10.122 1.00 25.42 H new ATOM 1448 N GLU A 91 -8.821 1.309 -7.762 1.00 14.33 N ATOM 1449 CA GLU A 91 -10.019 1.147 -6.947 1.00 10.44 C ATOM 1450 C GLU A 91 -10.396 -0.326 -6.822 1.00 73.05 C ATOM 1451 O GLU A 91 -11.521 -0.717 -7.129 1.00 31.14 O ATOM 1452 CB GLU A 91 -11.185 1.933 -7.552 1.00 53.13 C ATOM 1453 CG GLU A 91 -11.172 3.410 -7.196 1.00 1.13 C ATOM 1454 CD GLU A 91 -11.687 4.286 -8.322 1.00 50.35 C ATOM 1455 OE1 GLU A 91 -10.982 4.417 -9.343 1.00 12.23 O ATOM 1456 OE2 GLU A 91 -12.798 4.840 -8.180 1.00 11.44 O ATOM 0 H GLU A 91 -8.042 1.762 -7.283 1.00 14.33 H new ATOM 0 HA GLU A 91 -9.805 1.536 -5.951 1.00 10.44 H new ATOM 0 HB2 GLU A 91 -11.159 1.829 -8.637 1.00 53.13 H new ATOM 0 HB3 GLU A 91 -12.123 1.494 -7.212 1.00 53.13 H new ATOM 0 HG2 GLU A 91 -11.782 3.571 -6.307 1.00 1.13 H new ATOM 0 HG3 GLU A 91 -10.155 3.710 -6.943 1.00 1.13 H new ATOM 1463 N GLU A 92 -9.446 -1.137 -6.368 1.00 73.44 N ATOM 1464 CA GLU A 92 -9.678 -2.568 -6.202 1.00 1.21 C ATOM 1465 C GLU A 92 -9.251 -3.032 -4.812 1.00 14.50 C ATOM 1466 O GLU A 92 -8.202 -2.630 -4.306 1.00 63.10 O ATOM 1467 CB GLU A 92 -8.919 -3.356 -7.271 1.00 72.20 C ATOM 1468 CG GLU A 92 -9.565 -3.299 -8.644 1.00 30.54 C ATOM 1469 CD GLU A 92 -10.368 -4.545 -8.964 1.00 35.32 C ATOM 1470 OE1 GLU A 92 -10.767 -5.254 -8.017 1.00 4.41 O ATOM 1471 OE2 GLU A 92 -10.595 -4.812 -10.163 1.00 70.11 O ATOM 0 H GLU A 92 -8.509 -0.828 -6.109 1.00 73.44 H new ATOM 0 HA GLU A 92 -10.746 -2.753 -6.314 1.00 1.21 H new ATOM 0 HB2 GLU A 92 -7.902 -2.970 -7.341 1.00 72.20 H new ATOM 0 HB3 GLU A 92 -8.844 -4.397 -6.957 1.00 72.20 H new ATOM 0 HG2 GLU A 92 -10.217 -2.427 -8.699 1.00 30.54 H new ATOM 0 HG3 GLU A 92 -8.791 -3.166 -9.400 1.00 30.54 H new ATOM 1478 N LYS A 93 -10.071 -3.878 -4.200 1.00 14.24 N ATOM 1479 CA LYS A 93 -9.780 -4.398 -2.869 1.00 31.32 C ATOM 1480 C LYS A 93 -9.570 -5.908 -2.909 1.00 22.12 C ATOM 1481 O LYS A 93 -10.290 -6.627 -3.602 1.00 64.44 O ATOM 1482 CB LYS A 93 -10.918 -4.056 -1.906 1.00 23.31 C ATOM 1483 CG LYS A 93 -12.254 -4.662 -2.303 1.00 51.43 C ATOM 1484 CD LYS A 93 -13.341 -3.604 -2.390 1.00 64.31 C ATOM 1485 CE LYS A 93 -14.098 -3.474 -1.077 1.00 42.14 C ATOM 1486 NZ LYS A 93 -14.880 -2.207 -1.011 1.00 71.12 N ATOM 0 H LYS A 93 -10.943 -4.219 -4.604 1.00 14.24 H new ATOM 0 HA LYS A 93 -8.861 -3.930 -2.516 1.00 31.32 H new ATOM 0 HB2 LYS A 93 -10.654 -4.403 -0.907 1.00 23.31 H new ATOM 0 HB3 LYS A 93 -11.022 -2.972 -1.850 1.00 23.31 H new ATOM 0 HG2 LYS A 93 -12.155 -5.164 -3.265 1.00 51.43 H new ATOM 0 HG3 LYS A 93 -12.541 -5.421 -1.575 1.00 51.43 H new ATOM 0 HD2 LYS A 93 -12.896 -2.644 -2.651 1.00 64.31 H new ATOM 0 HD3 LYS A 93 -14.037 -3.861 -3.189 1.00 64.31 H new ATOM 0 HE2 LYS A 93 -14.771 -4.323 -0.960 1.00 42.14 H new ATOM 0 HE3 LYS A 93 -13.393 -3.510 -0.246 1.00 42.14 H new ATOM 0 HZ1 LYS A 93 -15.382 -2.156 -0.101 1.00 71.12 H new ATOM 0 HZ2 LYS A 93 -14.235 -1.396 -1.097 1.00 71.12 H new ATOM 0 HZ3 LYS A 93 -15.570 -2.184 -1.789 1.00 71.12 H new ATOM 1500 N VAL A 94 -8.579 -6.384 -2.162 1.00 65.44 N ATOM 1501 CA VAL A 94 -8.277 -7.809 -2.110 1.00 73.53 C ATOM 1502 C VAL A 94 -7.906 -8.241 -0.695 1.00 73.41 C ATOM 1503 O VAL A 94 -7.384 -7.450 0.091 1.00 74.20 O ATOM 1504 CB VAL A 94 -7.124 -8.173 -3.064 1.00 1.12 C ATOM 1505 CG1 VAL A 94 -7.521 -7.902 -4.507 1.00 23.34 C ATOM 1506 CG2 VAL A 94 -5.864 -7.405 -2.697 1.00 42.25 C ATOM 0 H VAL A 94 -7.971 -5.803 -1.584 1.00 65.44 H new ATOM 0 HA VAL A 94 -9.179 -8.335 -2.423 1.00 73.53 H new ATOM 0 HB VAL A 94 -6.914 -9.238 -2.962 1.00 1.12 H new ATOM 0 HG11 VAL A 94 -6.695 -8.165 -5.167 1.00 23.34 H new ATOM 0 HG12 VAL A 94 -8.395 -8.502 -4.763 1.00 23.34 H new ATOM 0 HG13 VAL A 94 -7.759 -6.845 -4.627 1.00 23.34 H new ATOM 0 HG21 VAL A 94 -5.061 -7.675 -3.382 1.00 42.25 H new ATOM 0 HG22 VAL A 94 -6.057 -6.335 -2.768 1.00 42.25 H new ATOM 0 HG23 VAL A 94 -5.570 -7.654 -1.677 1.00 42.25 H new ATOM 1516 N LYS A 95 -8.180 -9.502 -0.376 1.00 13.33 N ATOM 1517 CA LYS A 95 -7.873 -10.042 0.942 1.00 72.42 C ATOM 1518 C LYS A 95 -6.441 -10.562 0.998 1.00 33.51 C ATOM 1519 O LYS A 95 -5.792 -10.511 2.043 1.00 40.34 O ATOM 1520 CB LYS A 95 -8.850 -11.166 1.295 1.00 50.00 C ATOM 1521 CG LYS A 95 -10.259 -10.678 1.587 1.00 60.32 C ATOM 1522 CD LYS A 95 -11.261 -11.249 0.598 1.00 45.52 C ATOM 1523 CE LYS A 95 -12.304 -10.213 0.202 1.00 31.43 C ATOM 1524 NZ LYS A 95 -13.603 -10.441 0.893 1.00 11.22 N ATOM 0 H LYS A 95 -8.615 -10.169 -1.014 1.00 13.33 H new ATOM 0 HA LYS A 95 -7.976 -9.237 1.670 1.00 72.42 H new ATOM 0 HB2 LYS A 95 -8.885 -11.878 0.471 1.00 50.00 H new ATOM 0 HB3 LYS A 95 -8.473 -11.704 2.165 1.00 50.00 H new ATOM 0 HG2 LYS A 95 -10.542 -10.964 2.600 1.00 60.32 H new ATOM 0 HG3 LYS A 95 -10.284 -9.589 1.545 1.00 60.32 H new ATOM 0 HD2 LYS A 95 -10.737 -11.599 -0.292 1.00 45.52 H new ATOM 0 HD3 LYS A 95 -11.755 -12.115 1.038 1.00 45.52 H new ATOM 0 HE2 LYS A 95 -11.935 -9.216 0.442 1.00 31.43 H new ATOM 0 HE3 LYS A 95 -12.456 -10.245 -0.877 1.00 31.43 H new ATOM 0 HZ1 LYS A 95 -14.286 -9.715 0.597 1.00 11.22 H new ATOM 0 HZ2 LYS A 95 -13.968 -11.382 0.644 1.00 11.22 H new ATOM 0 HZ3 LYS A 95 -13.463 -10.385 1.922 1.00 11.22 H new ATOM 1538 N ASP A 96 -5.953 -11.062 -0.132 1.00 65.41 N ATOM 1539 CA ASP A 96 -4.597 -11.591 -0.212 1.00 74.31 C ATOM 1540 C ASP A 96 -3.932 -11.185 -1.525 1.00 63.04 C ATOM 1541 O ASP A 96 -4.500 -10.428 -2.313 1.00 72.05 O ATOM 1542 CB ASP A 96 -4.611 -13.115 -0.083 1.00 13.51 C ATOM 1543 CG ASP A 96 -5.454 -13.778 -1.154 1.00 23.30 C ATOM 1544 OD1 ASP A 96 -4.913 -14.067 -2.242 1.00 1.42 O ATOM 1545 OD2 ASP A 96 -6.655 -14.011 -0.903 1.00 44.10 O ATOM 0 H ASP A 96 -6.477 -11.112 -1.006 1.00 65.41 H new ATOM 0 HA ASP A 96 -4.021 -11.171 0.612 1.00 74.31 H new ATOM 0 HB2 ASP A 96 -3.590 -13.491 -0.144 1.00 13.51 H new ATOM 0 HB3 ASP A 96 -4.994 -13.390 0.900 1.00 13.51 H new ATOM 1550 N THR A 97 -2.725 -11.693 -1.752 1.00 23.02 N ATOM 1551 CA THR A 97 -1.982 -11.382 -2.967 1.00 24.10 C ATOM 1552 C THR A 97 -2.517 -12.174 -4.155 1.00 14.33 C ATOM 1553 O THR A 97 -2.654 -11.640 -5.256 1.00 21.01 O ATOM 1554 CB THR A 97 -0.481 -11.681 -2.799 1.00 74.40 C ATOM 1555 OG1 THR A 97 0.010 -11.067 -1.603 1.00 53.43 O ATOM 1556 CG2 THR A 97 0.309 -11.174 -3.997 1.00 53.11 C ATOM 0 H THR A 97 -2.241 -12.321 -1.111 1.00 23.02 H new ATOM 0 HA THR A 97 -2.113 -10.316 -3.155 1.00 24.10 H new ATOM 0 HB THR A 97 -0.354 -12.761 -2.731 1.00 74.40 H new ATOM 0 HG1 THR A 97 0.662 -10.373 -1.835 1.00 53.43 H new ATOM 0 HG21 THR A 97 1.367 -11.396 -3.856 1.00 53.11 H new ATOM 0 HG22 THR A 97 -0.048 -11.665 -4.902 1.00 53.11 H new ATOM 0 HG23 THR A 97 0.174 -10.097 -4.092 1.00 53.11 H new ATOM 1564 N GLU A 98 -2.817 -13.448 -3.925 1.00 13.04 N ATOM 1565 CA GLU A 98 -3.335 -14.312 -4.979 1.00 1.01 C ATOM 1566 C GLU A 98 -4.576 -13.700 -5.624 1.00 41.25 C ATOM 1567 O GLU A 98 -4.804 -13.850 -6.823 1.00 55.12 O ATOM 1568 CB GLU A 98 -3.670 -15.695 -4.417 1.00 21.40 C ATOM 1569 CG GLU A 98 -2.726 -16.789 -4.887 1.00 24.11 C ATOM 1570 CD GLU A 98 -2.932 -17.149 -6.346 1.00 41.10 C ATOM 1571 OE1 GLU A 98 -2.887 -16.235 -7.196 1.00 74.51 O ATOM 1572 OE2 GLU A 98 -3.138 -18.346 -6.637 1.00 34.23 O ATOM 0 H GLU A 98 -2.710 -13.904 -3.019 1.00 13.04 H new ATOM 0 HA GLU A 98 -2.563 -14.414 -5.741 1.00 1.01 H new ATOM 0 HB2 GLU A 98 -3.647 -15.650 -3.328 1.00 21.40 H new ATOM 0 HB3 GLU A 98 -4.688 -15.958 -4.704 1.00 21.40 H new ATOM 0 HG2 GLU A 98 -1.696 -16.464 -4.739 1.00 24.11 H new ATOM 0 HG3 GLU A 98 -2.871 -17.678 -4.273 1.00 24.11 H new ATOM 1579 N GLY A 99 -5.375 -13.008 -4.816 1.00 1.21 N ATOM 1580 CA GLY A 99 -6.582 -12.384 -5.325 1.00 50.02 C ATOM 1581 C GLY A 99 -6.288 -11.218 -6.249 1.00 73.32 C ATOM 1582 O GLY A 99 -6.907 -11.082 -7.303 1.00 30.32 O ATOM 0 H GLY A 99 -5.208 -12.869 -3.819 1.00 1.21 H new ATOM 0 HA2 GLY A 99 -7.173 -13.127 -5.860 1.00 50.02 H new ATOM 0 HA3 GLY A 99 -7.188 -12.036 -4.488 1.00 50.02 H new ATOM 1586 N ALA A 100 -5.340 -10.375 -5.852 1.00 60.41 N ATOM 1587 CA ALA A 100 -4.964 -9.217 -6.652 1.00 34.43 C ATOM 1588 C ALA A 100 -4.368 -9.644 -7.990 1.00 53.30 C ATOM 1589 O ALA A 100 -4.673 -9.062 -9.031 1.00 43.52 O ATOM 1590 CB ALA A 100 -3.980 -8.344 -5.888 1.00 20.13 C ATOM 0 H ALA A 100 -4.819 -10.473 -4.981 1.00 60.41 H new ATOM 0 HA ALA A 100 -5.865 -8.638 -6.854 1.00 34.43 H new ATOM 0 HB1 ALA A 100 -3.708 -7.483 -6.498 1.00 20.13 H new ATOM 0 HB2 ALA A 100 -4.441 -8.001 -4.961 1.00 20.13 H new ATOM 0 HB3 ALA A 100 -3.085 -8.922 -5.656 1.00 20.13 H new ATOM 1596 N LYS A 101 -3.515 -10.663 -7.955 1.00 44.44 N ATOM 1597 CA LYS A 101 -2.877 -11.167 -9.164 1.00 74.42 C ATOM 1598 C LYS A 101 -3.916 -11.682 -10.154 1.00 30.24 C ATOM 1599 O LYS A 101 -3.714 -11.620 -11.366 1.00 21.33 O ATOM 1600 CB LYS A 101 -1.892 -12.286 -8.815 1.00 53.22 C ATOM 1601 CG LYS A 101 -0.524 -12.111 -9.452 1.00 75.33 C ATOM 1602 CD LYS A 101 0.143 -13.451 -9.717 1.00 72.21 C ATOM 1603 CE LYS A 101 -0.150 -13.950 -11.123 1.00 71.24 C ATOM 1604 NZ LYS A 101 0.128 -15.407 -11.263 1.00 2.33 N ATOM 0 H LYS A 101 -3.250 -11.155 -7.102 1.00 44.44 H new ATOM 0 HA LYS A 101 -2.335 -10.344 -9.629 1.00 74.42 H new ATOM 0 HB2 LYS A 101 -1.776 -12.332 -7.732 1.00 53.22 H new ATOM 0 HB3 LYS A 101 -2.312 -13.241 -9.132 1.00 53.22 H new ATOM 0 HG2 LYS A 101 -0.625 -11.562 -10.388 1.00 75.33 H new ATOM 0 HG3 LYS A 101 0.109 -11.511 -8.798 1.00 75.33 H new ATOM 0 HD2 LYS A 101 1.220 -13.356 -9.581 1.00 72.21 H new ATOM 0 HD3 LYS A 101 -0.207 -14.183 -8.989 1.00 72.21 H new ATOM 0 HE2 LYS A 101 -1.194 -13.754 -11.368 1.00 71.24 H new ATOM 0 HE3 LYS A 101 0.455 -13.394 -11.839 1.00 71.24 H new ATOM 0 HZ1 LYS A 101 -0.084 -15.709 -12.235 1.00 2.33 H new ATOM 0 HZ2 LYS A 101 1.130 -15.591 -11.054 1.00 2.33 H new ATOM 0 HZ3 LYS A 101 -0.468 -15.940 -10.597 1.00 2.33 H new ATOM 1618 N GLN A 102 -5.028 -12.188 -9.630 1.00 73.41 N ATOM 1619 CA GLN A 102 -6.098 -12.712 -10.469 1.00 45.44 C ATOM 1620 C GLN A 102 -6.858 -11.580 -11.153 1.00 60.04 C ATOM 1621 O GLN A 102 -7.178 -11.662 -12.339 1.00 51.10 O ATOM 1622 CB GLN A 102 -7.062 -13.558 -9.634 1.00 53.32 C ATOM 1623 CG GLN A 102 -6.715 -15.038 -9.619 1.00 62.12 C ATOM 1624 CD GLN A 102 -7.460 -15.800 -8.541 1.00 44.22 C ATOM 1625 OE1 GLN A 102 -8.067 -15.204 -7.649 1.00 31.55 O ATOM 1626 NE2 GLN A 102 -7.418 -17.126 -8.616 1.00 40.42 N ATOM 0 H GLN A 102 -5.211 -12.246 -8.628 1.00 73.41 H new ATOM 0 HA GLN A 102 -5.648 -13.339 -11.238 1.00 45.44 H new ATOM 0 HB2 GLN A 102 -7.067 -13.184 -8.610 1.00 53.32 H new ATOM 0 HB3 GLN A 102 -8.072 -13.434 -10.024 1.00 53.32 H new ATOM 0 HG2 GLN A 102 -6.947 -15.472 -10.592 1.00 62.12 H new ATOM 0 HG3 GLN A 102 -5.642 -15.154 -9.466 1.00 62.12 H new ATOM 0 HE21 GLN A 102 -6.903 -17.578 -9.372 1.00 40.42 H new ATOM 0 HE22 GLN A 102 -7.900 -17.692 -7.918 1.00 40.42 H new ATOM 1635 N ILE A 103 -7.144 -10.525 -10.397 1.00 73.42 N ATOM 1636 CA ILE A 103 -7.865 -9.376 -10.930 1.00 63.33 C ATOM 1637 C ILE A 103 -7.078 -8.706 -12.050 1.00 4.34 C ATOM 1638 O ILE A 103 -7.607 -8.465 -13.137 1.00 34.40 O ATOM 1639 CB ILE A 103 -8.161 -8.338 -9.832 1.00 1.31 C ATOM 1640 CG1 ILE A 103 -8.998 -8.967 -8.717 1.00 72.33 C ATOM 1641 CG2 ILE A 103 -8.877 -7.132 -10.422 1.00 12.13 C ATOM 1642 CD1 ILE A 103 -9.142 -8.083 -7.497 1.00 75.53 C ATOM 0 H ILE A 103 -6.887 -10.442 -9.413 1.00 73.42 H new ATOM 0 HA ILE A 103 -8.809 -9.751 -11.326 1.00 63.33 H new ATOM 0 HB ILE A 103 -7.215 -8.003 -9.406 1.00 1.31 H new ATOM 0 HG12 ILE A 103 -9.989 -9.200 -9.106 1.00 72.33 H new ATOM 0 HG13 ILE A 103 -8.542 -9.911 -8.420 1.00 72.33 H new ATOM 0 HG21 ILE A 103 -9.079 -6.407 -9.633 1.00 12.13 H new ATOM 0 HG22 ILE A 103 -8.248 -6.673 -11.184 1.00 12.13 H new ATOM 0 HG23 ILE A 103 -9.817 -7.451 -10.871 1.00 12.13 H new ATOM 0 HD11 ILE A 103 -9.747 -8.593 -6.748 1.00 75.53 H new ATOM 0 HD12 ILE A 103 -8.156 -7.870 -7.084 1.00 75.53 H new ATOM 0 HD13 ILE A 103 -9.626 -7.148 -7.780 1.00 75.53 H new ATOM 1654 N VAL A 104 -5.813 -8.406 -11.780 1.00 54.43 N ATOM 1655 CA VAL A 104 -4.950 -7.764 -12.766 1.00 25.44 C ATOM 1656 C VAL A 104 -4.843 -8.608 -14.032 1.00 12.23 C ATOM 1657 O VAL A 104 -5.001 -8.100 -15.142 1.00 21.15 O ATOM 1658 CB VAL A 104 -3.537 -7.521 -12.203 1.00 24.52 C ATOM 1659 CG1 VAL A 104 -2.633 -6.928 -13.272 1.00 74.34 C ATOM 1660 CG2 VAL A 104 -3.600 -6.617 -10.982 1.00 15.54 C ATOM 0 H VAL A 104 -5.361 -8.597 -10.886 1.00 54.43 H new ATOM 0 HA VAL A 104 -5.405 -6.804 -13.009 1.00 25.44 H new ATOM 0 HB VAL A 104 -3.115 -8.478 -11.896 1.00 24.52 H new ATOM 0 HG11 VAL A 104 -1.639 -6.763 -12.857 1.00 74.34 H new ATOM 0 HG12 VAL A 104 -2.565 -7.617 -14.114 1.00 74.34 H new ATOM 0 HG13 VAL A 104 -3.046 -5.979 -13.612 1.00 74.34 H new ATOM 0 HG21 VAL A 104 -2.593 -6.455 -10.597 1.00 15.54 H new ATOM 0 HG22 VAL A 104 -4.040 -5.659 -11.261 1.00 15.54 H new ATOM 0 HG23 VAL A 104 -4.212 -7.087 -10.212 1.00 15.54 H new ATOM 1670 N ARG A 105 -4.574 -9.897 -13.857 1.00 4.02 N ATOM 1671 CA ARG A 105 -4.445 -10.810 -14.986 1.00 71.34 C ATOM 1672 C ARG A 105 -5.667 -10.727 -15.896 1.00 11.52 C ATOM 1673 O ARG A 105 -5.541 -10.512 -17.102 1.00 74.11 O ATOM 1674 CB ARG A 105 -4.264 -12.246 -14.490 1.00 72.40 C ATOM 1675 CG ARG A 105 -3.554 -13.150 -15.484 1.00 21.11 C ATOM 1676 CD ARG A 105 -2.632 -14.135 -14.782 1.00 11.43 C ATOM 1677 NE ARG A 105 -2.990 -15.520 -15.070 1.00 23.42 N ATOM 1678 CZ ARG A 105 -2.706 -16.131 -16.214 1.00 30.10 C ATOM 1679 NH1 ARG A 105 -2.061 -15.482 -17.174 1.00 61.51 N ATOM 1680 NH2 ARG A 105 -3.066 -17.395 -16.401 1.00 74.23 N ATOM 0 H ARG A 105 -4.441 -10.333 -12.944 1.00 4.02 H new ATOM 0 HA ARG A 105 -3.566 -10.516 -15.559 1.00 71.34 H new ATOM 0 HB2 ARG A 105 -3.699 -12.231 -13.558 1.00 72.40 H new ATOM 0 HB3 ARG A 105 -5.243 -12.669 -14.262 1.00 72.40 H new ATOM 0 HG2 ARG A 105 -4.292 -13.696 -16.072 1.00 21.11 H new ATOM 0 HG3 ARG A 105 -2.977 -12.543 -16.181 1.00 21.11 H new ATOM 0 HD2 ARG A 105 -1.603 -13.954 -15.094 1.00 11.43 H new ATOM 0 HD3 ARG A 105 -2.673 -13.966 -13.706 1.00 11.43 H new ATOM 0 HE ARG A 105 -3.486 -16.048 -14.352 1.00 23.42 H new ATOM 0 HH11 ARG A 105 -1.782 -14.511 -17.034 1.00 61.51 H new ATOM 0 HH12 ARG A 105 -1.844 -15.954 -18.052 1.00 61.51 H new ATOM 0 HH21 ARG A 105 -3.562 -17.898 -15.665 1.00 74.23 H new ATOM 0 HH22 ARG A 105 -2.847 -17.863 -17.281 1.00 74.23 H new ATOM 1694 N ARG A 106 -6.847 -10.897 -15.311 1.00 45.30 N ATOM 1695 CA ARG A 106 -8.092 -10.842 -16.069 1.00 52.23 C ATOM 1696 C ARG A 106 -8.232 -9.503 -16.788 1.00 73.32 C ATOM 1697 O ARG A 106 -8.811 -9.425 -17.871 1.00 10.24 O ATOM 1698 CB ARG A 106 -9.288 -11.063 -15.143 1.00 64.52 C ATOM 1699 CG ARG A 106 -10.299 -12.063 -15.681 1.00 33.43 C ATOM 1700 CD ARG A 106 -10.387 -13.296 -14.796 1.00 22.10 C ATOM 1701 NE ARG A 106 -11.121 -14.381 -15.441 1.00 65.43 N ATOM 1702 CZ ARG A 106 -10.653 -15.074 -16.474 1.00 41.23 C ATOM 1703 NH1 ARG A 106 -9.458 -14.796 -16.975 1.00 53.43 N ATOM 1704 NH2 ARG A 106 -11.381 -16.048 -17.006 1.00 51.20 N ATOM 0 H ARG A 106 -6.968 -11.074 -14.314 1.00 45.30 H new ATOM 0 HA ARG A 106 -8.069 -11.635 -16.816 1.00 52.23 H new ATOM 0 HB2 ARG A 106 -8.928 -11.409 -14.174 1.00 64.52 H new ATOM 0 HB3 ARG A 106 -9.788 -10.109 -14.975 1.00 64.52 H new ATOM 0 HG2 ARG A 106 -11.279 -11.591 -15.748 1.00 33.43 H new ATOM 0 HG3 ARG A 106 -10.018 -12.358 -16.692 1.00 33.43 H new ATOM 0 HD2 ARG A 106 -9.382 -13.636 -14.547 1.00 22.10 H new ATOM 0 HD3 ARG A 106 -10.876 -13.035 -13.858 1.00 22.10 H new ATOM 0 HE ARG A 106 -12.044 -14.620 -15.079 1.00 65.43 H new ATOM 0 HH11 ARG A 106 -8.895 -14.049 -16.568 1.00 53.43 H new ATOM 0 HH12 ARG A 106 -9.101 -15.329 -17.768 1.00 53.43 H new ATOM 0 HH21 ARG A 106 -12.301 -16.265 -16.622 1.00 51.20 H new ATOM 0 HH22 ARG A 106 -11.021 -16.579 -17.799 1.00 51.20 H new ATOM 1718 N HIS A 107 -7.697 -8.450 -16.176 1.00 64.11 N ATOM 1719 CA HIS A 107 -7.763 -7.113 -16.756 1.00 15.12 C ATOM 1720 C HIS A 107 -6.824 -6.996 -17.954 1.00 32.21 C ATOM 1721 O HIS A 107 -7.136 -6.202 -18.842 1.00 15.23 O ATOM 1722 CB HIS A 107 -7.402 -6.060 -15.708 1.00 40.20 C ATOM 1723 CG HIS A 107 -8.509 -5.777 -14.739 1.00 74.40 C ATOM 1724 ND1 HIS A 107 -9.803 -5.508 -15.132 1.00 43.21 N ATOM 1725 CD2 HIS A 107 -8.510 -5.722 -13.387 1.00 72.54 C ATOM 1726 CE1 HIS A 107 -10.551 -5.300 -14.064 1.00 61.31 C ATOM 1727 NE2 HIS A 107 -9.790 -5.426 -12.991 1.00 15.22 N ATOM 0 H HIS A 107 -7.213 -8.497 -15.279 1.00 64.11 H new ATOM 0 HA HIS A 107 -8.784 -6.941 -17.096 1.00 15.12 H new ATOM 0 HB2 HIS A 107 -6.523 -6.394 -15.156 1.00 40.20 H new ATOM 0 HB3 HIS A 107 -7.127 -5.134 -16.214 1.00 40.20 H new ATOM 0 HD2 HIS A 107 -7.661 -5.882 -12.739 1.00 72.54 H new ATOM 0 HE1 HIS A 107 -11.605 -5.067 -14.067 1.00 61.31 H new ATOM 0 HE2 HIS A 107 -10.103 -5.320 -12.026 1.00 15.22 H new ATOM 1735 N LEU A 108 -5.724 -7.739 -18.002 1.00 12.44 N ATOM 1736 CA LEU A 108 -4.797 -7.662 -19.127 1.00 53.54 C ATOM 1737 C LEU A 108 -5.309 -8.475 -20.310 1.00 32.44 C ATOM 1738 O LEU A 108 -5.283 -8.014 -21.452 1.00 45.04 O ATOM 1739 CB LEU A 108 -3.413 -8.162 -18.708 1.00 63.24 C ATOM 1740 CG LEU A 108 -2.656 -7.286 -17.711 1.00 61.43 C ATOM 1741 CD1 LEU A 108 -1.771 -8.139 -16.815 1.00 60.04 C ATOM 1742 CD2 LEU A 108 -1.826 -6.240 -18.441 1.00 33.21 C ATOM 0 H LEU A 108 -5.452 -8.401 -17.276 1.00 12.44 H new ATOM 0 HA LEU A 108 -4.721 -6.619 -19.434 1.00 53.54 H new ATOM 0 HB2 LEU A 108 -3.524 -9.157 -18.276 1.00 63.24 H new ATOM 0 HB3 LEU A 108 -2.801 -8.270 -19.604 1.00 63.24 H new ATOM 0 HG LEU A 108 -3.384 -6.771 -17.085 1.00 61.43 H new ATOM 0 HD11 LEU A 108 -1.240 -7.498 -16.112 1.00 60.04 H new ATOM 0 HD12 LEU A 108 -2.388 -8.849 -16.264 1.00 60.04 H new ATOM 0 HD13 LEU A 108 -1.050 -8.682 -17.426 1.00 60.04 H new ATOM 0 HD21 LEU A 108 -1.294 -5.626 -17.714 1.00 33.21 H new ATOM 0 HD22 LEU A 108 -1.107 -6.736 -19.093 1.00 33.21 H new ATOM 0 HD23 LEU A 108 -2.482 -5.608 -19.040 1.00 33.21 H new ATOM 1754 N VAL A 109 -5.775 -9.689 -20.031 1.00 14.04 N ATOM 1755 CA VAL A 109 -6.296 -10.566 -21.072 1.00 13.03 C ATOM 1756 C VAL A 109 -7.416 -9.887 -21.854 1.00 73.22 C ATOM 1757 O VAL A 109 -7.570 -10.107 -23.054 1.00 12.55 O ATOM 1758 CB VAL A 109 -6.824 -11.887 -20.481 1.00 55.52 C ATOM 1759 CG1 VAL A 109 -7.352 -12.792 -21.584 1.00 53.22 C ATOM 1760 CG2 VAL A 109 -5.735 -12.585 -19.681 1.00 20.04 C ATOM 0 H VAL A 109 -5.802 -10.087 -19.092 1.00 14.04 H new ATOM 0 HA VAL A 109 -5.468 -10.784 -21.746 1.00 13.03 H new ATOM 0 HB VAL A 109 -7.649 -11.660 -19.806 1.00 55.52 H new ATOM 0 HG11 VAL A 109 -7.721 -13.720 -21.148 1.00 53.22 H new ATOM 0 HG12 VAL A 109 -8.165 -12.290 -22.109 1.00 53.22 H new ATOM 0 HG13 VAL A 109 -6.549 -13.015 -22.287 1.00 53.22 H new ATOM 0 HG21 VAL A 109 -6.125 -13.516 -19.271 1.00 20.04 H new ATOM 0 HG22 VAL A 109 -4.888 -12.802 -20.332 1.00 20.04 H new ATOM 0 HG23 VAL A 109 -5.410 -11.938 -18.866 1.00 20.04 H new ATOM 1770 N ALA A 110 -8.195 -9.061 -21.163 1.00 34.33 N ATOM 1771 CA ALA A 110 -9.299 -8.348 -21.792 1.00 72.10 C ATOM 1772 C ALA A 110 -8.789 -7.334 -22.810 1.00 14.23 C ATOM 1773 O ALA A 110 -9.485 -7.000 -23.768 1.00 14.24 O ATOM 1774 CB ALA A 110 -10.150 -7.657 -20.737 1.00 2.10 C ATOM 0 H ALA A 110 -8.082 -8.869 -20.168 1.00 34.33 H new ATOM 0 HA ALA A 110 -9.915 -9.076 -22.321 1.00 72.10 H new ATOM 0 HB1 ALA A 110 -10.971 -7.128 -21.221 1.00 2.10 H new ATOM 0 HB2 ALA A 110 -10.553 -8.401 -20.050 1.00 2.10 H new ATOM 0 HB3 ALA A 110 -9.537 -6.946 -20.183 1.00 2.10 H new ATOM 1780 N GLU A 111 -7.571 -6.848 -22.595 1.00 54.14 N ATOM 1781 CA GLU A 111 -6.968 -5.870 -23.495 1.00 64.34 C ATOM 1782 C GLU A 111 -6.096 -6.558 -24.540 1.00 11.22 C ATOM 1783 O GLU A 111 -5.933 -6.060 -25.655 1.00 73.23 O ATOM 1784 CB GLU A 111 -6.135 -4.861 -22.702 1.00 51.21 C ATOM 1785 CG GLU A 111 -5.591 -3.723 -23.549 1.00 75.52 C ATOM 1786 CD GLU A 111 -6.670 -2.752 -23.985 1.00 42.11 C ATOM 1787 OE1 GLU A 111 -7.287 -2.985 -25.045 1.00 13.02 O ATOM 1788 OE2 GLU A 111 -6.899 -1.758 -23.264 1.00 13.21 O ATOM 0 H GLU A 111 -6.982 -7.115 -21.806 1.00 54.14 H new ATOM 0 HA GLU A 111 -7.771 -5.342 -24.009 1.00 64.34 H new ATOM 0 HB2 GLU A 111 -6.747 -4.446 -21.901 1.00 51.21 H new ATOM 0 HB3 GLU A 111 -5.302 -5.382 -22.229 1.00 51.21 H new ATOM 0 HG2 GLU A 111 -4.831 -3.185 -22.983 1.00 75.52 H new ATOM 0 HG3 GLU A 111 -5.100 -4.134 -24.431 1.00 75.52 H new ATOM 1795 N THR A 112 -5.536 -7.706 -24.173 1.00 64.53 N ATOM 1796 CA THR A 112 -4.678 -8.462 -25.077 1.00 62.14 C ATOM 1797 C THR A 112 -5.465 -9.549 -25.801 1.00 41.42 C ATOM 1798 O THR A 112 -4.911 -10.575 -26.191 1.00 61.44 O ATOM 1799 CB THR A 112 -3.503 -9.112 -24.324 1.00 12.42 C ATOM 1800 OG1 THR A 112 -3.233 -8.389 -23.118 1.00 2.41 O ATOM 1801 CG2 THR A 112 -2.254 -9.142 -25.193 1.00 2.32 C ATOM 0 H THR A 112 -5.661 -8.133 -23.255 1.00 64.53 H new ATOM 0 HA THR A 112 -4.285 -7.753 -25.806 1.00 62.14 H new ATOM 0 HB THR A 112 -3.781 -10.137 -24.078 1.00 12.42 H new ATOM 0 HG1 THR A 112 -3.950 -8.554 -22.470 1.00 2.41 H new ATOM 0 HG21 THR A 112 -1.437 -9.606 -24.640 1.00 2.32 H new ATOM 0 HG22 THR A 112 -2.453 -9.718 -26.097 1.00 2.32 H new ATOM 0 HG23 THR A 112 -1.976 -8.124 -25.466 1.00 2.32 H new ATOM 1809 N GLY A 113 -6.762 -9.315 -25.979 1.00 44.55 N ATOM 1810 CA GLY A 113 -7.604 -10.283 -26.657 1.00 45.25 C ATOM 1811 C GLY A 113 -8.460 -9.651 -27.737 1.00 22.32 C ATOM 1812 O GLY A 113 -9.543 -10.146 -28.051 1.00 23.13 O ATOM 0 H GLY A 113 -7.244 -8.473 -25.666 1.00 44.55 H new ATOM 0 HA2 GLY A 113 -6.978 -11.057 -27.101 1.00 45.25 H new ATOM 0 HA3 GLY A 113 -8.248 -10.774 -25.927 1.00 45.25 H new ATOM 1816 N THR A 114 -7.974 -8.552 -28.307 1.00 4.24 N ATOM 1817 CA THR A 114 -8.704 -7.850 -29.357 1.00 75.43 C ATOM 1818 C THR A 114 -7.763 -7.386 -30.463 1.00 63.40 C ATOM 1819 O THR A 114 -8.040 -6.407 -31.155 1.00 32.33 O ATOM 1820 CB THR A 114 -9.459 -6.631 -28.795 1.00 4.12 C ATOM 1821 OG1 THR A 114 -10.264 -6.039 -29.822 1.00 73.33 O ATOM 1822 CG2 THR A 114 -8.488 -5.597 -28.247 1.00 74.02 C ATOM 0 H THR A 114 -7.079 -8.129 -28.060 1.00 4.24 H new ATOM 0 HA THR A 114 -9.425 -8.556 -29.770 1.00 75.43 H new ATOM 0 HB THR A 114 -10.099 -6.971 -27.981 1.00 4.12 H new ATOM 0 HG1 THR A 114 -9.711 -5.866 -30.612 1.00 73.33 H new ATOM 0 HG21 THR A 114 -9.045 -4.746 -27.856 1.00 74.02 H new ATOM 0 HG22 THR A 114 -7.896 -6.042 -27.447 1.00 74.02 H new ATOM 0 HG23 THR A 114 -7.825 -5.261 -29.045 1.00 74.02 H new ATOM 1830 N ALA A 115 -6.651 -8.096 -30.624 1.00 12.41 N ATOM 1831 CA ALA A 115 -5.671 -7.757 -31.649 1.00 75.23 C ATOM 1832 C ALA A 115 -4.812 -8.965 -32.007 1.00 21.01 C ATOM 1833 O ALA A 115 -3.591 -8.937 -31.856 1.00 45.42 O ATOM 1834 CB ALA A 115 -4.794 -6.604 -31.181 1.00 21.20 C ATOM 0 H ALA A 115 -6.406 -8.909 -30.058 1.00 12.41 H new ATOM 0 HA ALA A 115 -6.210 -7.448 -32.544 1.00 75.23 H new ATOM 0 HB1 ALA A 115 -4.067 -6.362 -31.956 1.00 21.20 H new ATOM 0 HB2 ALA A 115 -5.416 -5.731 -30.981 1.00 21.20 H new ATOM 0 HB3 ALA A 115 -4.270 -6.892 -30.270 1.00 21.20 H new ATOM 1840 N GLU A 116 -5.459 -10.025 -32.482 1.00 73.43 N ATOM 1841 CA GLU A 116 -4.753 -11.243 -32.859 1.00 34.33 C ATOM 1842 C GLU A 116 -4.892 -11.512 -34.356 1.00 43.33 C ATOM 1843 O GLU A 116 -4.877 -12.661 -34.796 1.00 31.33 O ATOM 1844 CB GLU A 116 -5.286 -12.437 -32.064 1.00 5.31 C ATOM 1845 CG GLU A 116 -4.379 -13.655 -32.111 1.00 40.44 C ATOM 1846 CD GLU A 116 -5.033 -14.844 -32.788 1.00 54.23 C ATOM 1847 OE1 GLU A 116 -6.186 -15.167 -32.436 1.00 61.43 O ATOM 1848 OE2 GLU A 116 -4.390 -15.451 -33.669 1.00 15.33 O ATOM 0 H GLU A 116 -6.470 -10.064 -32.615 1.00 73.43 H new ATOM 0 HA GLU A 116 -3.697 -11.105 -32.628 1.00 34.33 H new ATOM 0 HB2 GLU A 116 -5.425 -12.138 -31.025 1.00 5.31 H new ATOM 0 HB3 GLU A 116 -6.268 -12.711 -32.451 1.00 5.31 H new ATOM 0 HG2 GLU A 116 -3.461 -13.400 -32.641 1.00 40.44 H new ATOM 0 HG3 GLU A 116 -4.095 -13.931 -31.096 1.00 40.44 H new ATOM 1855 N LYS A 117 -5.029 -10.442 -35.131 1.00 11.02 N ATOM 1856 CA LYS A 117 -5.171 -10.560 -36.578 1.00 4.32 C ATOM 1857 C LYS A 117 -3.835 -10.331 -37.277 1.00 53.43 C ATOM 1858 O LYS A 117 -3.792 -9.906 -38.431 1.00 3.02 O ATOM 1859 CB LYS A 117 -6.206 -9.556 -37.093 1.00 44.54 C ATOM 1860 CG LYS A 117 -6.928 -10.016 -38.347 1.00 2.12 C ATOM 1861 CD LYS A 117 -8.386 -9.589 -38.339 1.00 42.41 C ATOM 1862 CE LYS A 117 -9.201 -10.367 -39.362 1.00 61.35 C ATOM 1863 NZ LYS A 117 -10.599 -10.592 -38.901 1.00 10.43 N ATOM 0 H LYS A 117 -5.045 -9.484 -34.782 1.00 11.02 H new ATOM 0 HA LYS A 117 -5.510 -11.571 -36.803 1.00 4.32 H new ATOM 0 HB2 LYS A 117 -6.940 -9.369 -36.309 1.00 44.54 H new ATOM 0 HB3 LYS A 117 -5.709 -8.607 -37.297 1.00 44.54 H new ATOM 0 HG2 LYS A 117 -6.432 -9.604 -39.226 1.00 2.12 H new ATOM 0 HG3 LYS A 117 -6.866 -11.101 -38.426 1.00 2.12 H new ATOM 0 HD2 LYS A 117 -8.806 -9.743 -37.345 1.00 42.41 H new ATOM 0 HD3 LYS A 117 -8.455 -8.522 -38.553 1.00 42.41 H new ATOM 0 HE2 LYS A 117 -9.213 -9.823 -40.307 1.00 61.35 H new ATOM 0 HE3 LYS A 117 -8.722 -11.327 -39.553 1.00 61.35 H new ATOM 0 HZ1 LYS A 117 -11.122 -11.125 -39.625 1.00 10.43 H new ATOM 0 HZ2 LYS A 117 -10.589 -11.133 -38.013 1.00 10.43 H new ATOM 0 HZ3 LYS A 117 -11.064 -9.675 -38.743 1.00 10.43 H new ATOM 1877 N MET A 118 -2.746 -10.616 -36.570 1.00 63.24 N ATOM 1878 CA MET A 118 -1.408 -10.443 -37.123 1.00 4.43 C ATOM 1879 C MET A 118 -1.151 -8.982 -37.477 1.00 51.02 C ATOM 1880 O MET A 118 -1.220 -8.577 -38.637 1.00 21.13 O ATOM 1881 CB MET A 118 -1.230 -11.319 -38.365 1.00 2.33 C ATOM 1882 CG MET A 118 0.223 -11.598 -38.710 1.00 51.43 C ATOM 1883 SD MET A 118 0.550 -11.496 -40.480 1.00 22.21 S ATOM 1884 CE MET A 118 1.693 -12.859 -40.692 1.00 22.04 C ATOM 0 H MET A 118 -2.764 -10.968 -35.613 1.00 63.24 H new ATOM 0 HA MET A 118 -0.686 -10.747 -36.365 1.00 4.43 H new ATOM 0 HB2 MET A 118 -1.746 -12.266 -38.208 1.00 2.33 H new ATOM 0 HB3 MET A 118 -1.709 -10.832 -39.214 1.00 2.33 H new ATOM 0 HG2 MET A 118 0.860 -10.886 -38.185 1.00 51.43 H new ATOM 0 HG3 MET A 118 0.493 -12.591 -38.351 1.00 51.43 H new ATOM 0 HE1 MET A 118 1.989 -12.926 -41.739 1.00 22.04 H new ATOM 0 HE2 MET A 118 2.576 -12.692 -40.075 1.00 22.04 H new ATOM 0 HE3 MET A 118 1.210 -13.789 -40.391 1.00 22.04 H new ATOM 1894 N PRO A 119 -0.847 -8.170 -36.454 1.00 43.31 N ATOM 1895 CA PRO A 119 -0.572 -6.740 -36.632 1.00 62.43 C ATOM 1896 C PRO A 119 0.748 -6.489 -37.352 1.00 22.34 C ATOM 1897 O PRO A 119 0.906 -5.485 -38.045 1.00 10.51 O ATOM 1898 CB PRO A 119 -0.509 -6.210 -35.197 1.00 4.32 C ATOM 1899 CG PRO A 119 -0.125 -7.390 -34.373 1.00 12.14 C ATOM 1900 CD PRO A 119 -0.747 -8.584 -35.044 1.00 11.44 C ATOM 0 HA PRO A 119 -1.328 -6.253 -37.248 1.00 62.43 H new ATOM 0 HB2 PRO A 119 0.222 -5.407 -35.103 1.00 4.32 H new ATOM 0 HB3 PRO A 119 -1.470 -5.804 -34.883 1.00 4.32 H new ATOM 0 HG2 PRO A 119 0.959 -7.493 -34.320 1.00 12.14 H new ATOM 0 HG3 PRO A 119 -0.486 -7.285 -33.350 1.00 12.14 H new ATOM 0 HD2 PRO A 119 -0.130 -9.476 -34.930 1.00 11.44 H new ATOM 0 HD3 PRO A 119 -1.725 -8.817 -34.623 1.00 11.44 H new ATOM 1908 N SER A 120 1.693 -7.408 -37.182 1.00 0.34 N ATOM 1909 CA SER A 120 3.002 -7.284 -37.814 1.00 13.53 C ATOM 1910 C SER A 120 3.694 -5.995 -37.382 1.00 43.34 C ATOM 1911 O SER A 120 3.848 -5.063 -38.172 1.00 34.12 O ATOM 1912 CB SER A 120 2.861 -7.314 -39.338 1.00 73.43 C ATOM 1913 OG SER A 120 1.853 -8.225 -39.738 1.00 34.51 O ATOM 0 H SER A 120 1.577 -8.246 -36.612 1.00 0.34 H new ATOM 0 HA SER A 120 3.613 -8.129 -37.496 1.00 13.53 H new ATOM 0 HB2 SER A 120 2.620 -6.316 -39.704 1.00 73.43 H new ATOM 0 HB3 SER A 120 3.812 -7.598 -39.789 1.00 73.43 H new ATOM 0 HG SER A 120 1.781 -8.225 -40.715 1.00 34.51 H new ATOM 1919 N THR A 121 4.108 -5.948 -36.120 1.00 50.05 N ATOM 1920 CA THR A 121 4.782 -4.774 -35.579 1.00 41.31 C ATOM 1921 C THR A 121 5.724 -5.154 -34.443 1.00 62.13 C ATOM 1922 O THR A 121 6.844 -4.652 -34.359 1.00 34.23 O ATOM 1923 CB THR A 121 3.770 -3.731 -35.065 1.00 30.34 C ATOM 1924 OG1 THR A 121 2.500 -4.353 -34.839 1.00 42.33 O ATOM 1925 CG2 THR A 121 3.614 -2.592 -36.060 1.00 42.20 C ATOM 0 H THR A 121 3.988 -6.710 -35.453 1.00 50.05 H new ATOM 0 HA THR A 121 5.359 -4.338 -36.395 1.00 41.31 H new ATOM 0 HB THR A 121 4.146 -3.322 -34.127 1.00 30.34 H new ATOM 0 HG1 THR A 121 1.862 -3.685 -34.511 1.00 42.33 H new ATOM 0 HG21 THR A 121 2.895 -1.869 -35.675 1.00 42.20 H new ATOM 0 HG22 THR A 121 4.577 -2.103 -36.207 1.00 42.20 H new ATOM 0 HG23 THR A 121 3.258 -2.986 -37.012 1.00 42.20 H new ATOM 1933 N SER A 122 5.262 -6.045 -33.571 1.00 54.11 N ATOM 1934 CA SER A 122 6.064 -6.491 -32.437 1.00 24.15 C ATOM 1935 C SER A 122 6.778 -7.800 -32.759 1.00 63.44 C ATOM 1936 O SER A 122 6.297 -8.602 -33.559 1.00 32.23 O ATOM 1937 CB SER A 122 5.181 -6.668 -31.200 1.00 15.42 C ATOM 1938 OG SER A 122 5.966 -6.896 -30.043 1.00 10.21 O ATOM 0 H SER A 122 4.337 -6.472 -33.628 1.00 54.11 H new ATOM 0 HA SER A 122 6.816 -5.729 -32.232 1.00 24.15 H new ATOM 0 HB2 SER A 122 4.567 -5.779 -31.057 1.00 15.42 H new ATOM 0 HB3 SER A 122 4.500 -7.505 -31.352 1.00 15.42 H new ATOM 0 HG SER A 122 5.379 -7.004 -29.266 1.00 10.21 H new ATOM 1944 N ARG A 123 7.928 -8.009 -32.128 1.00 75.51 N ATOM 1945 CA ARG A 123 8.710 -9.221 -32.346 1.00 55.15 C ATOM 1946 C ARG A 123 8.515 -10.209 -31.200 1.00 45.34 C ATOM 1947 O ARG A 123 8.193 -9.833 -30.072 1.00 53.31 O ATOM 1948 CB ARG A 123 10.194 -8.876 -32.489 1.00 21.42 C ATOM 1949 CG ARG A 123 10.735 -8.025 -31.352 1.00 21.41 C ATOM 1950 CD ARG A 123 12.243 -7.861 -31.446 1.00 33.45 C ATOM 1951 NE ARG A 123 12.868 -7.768 -30.129 1.00 20.41 N ATOM 1952 CZ ARG A 123 14.114 -7.352 -29.935 1.00 30.44 C ATOM 1953 NH1 ARG A 123 14.865 -6.994 -30.967 1.00 73.34 N ATOM 1954 NH2 ARG A 123 14.612 -7.295 -28.706 1.00 62.13 N ATOM 0 H ARG A 123 8.340 -7.355 -31.462 1.00 75.51 H new ATOM 0 HA ARG A 123 8.361 -9.687 -33.267 1.00 55.15 H new ATOM 0 HB2 ARG A 123 10.769 -9.800 -32.545 1.00 21.42 H new ATOM 0 HB3 ARG A 123 10.346 -8.348 -33.430 1.00 21.42 H new ATOM 0 HG2 ARG A 123 10.260 -7.044 -31.372 1.00 21.41 H new ATOM 0 HG3 ARG A 123 10.477 -8.485 -30.398 1.00 21.41 H new ATOM 0 HD2 ARG A 123 12.666 -8.706 -31.989 1.00 33.45 H new ATOM 0 HD3 ARG A 123 12.475 -6.965 -32.021 1.00 33.45 H new ATOM 0 HE ARG A 123 12.317 -8.037 -29.314 1.00 20.41 H new ATOM 0 HH11 ARG A 123 14.486 -7.038 -31.913 1.00 73.34 H new ATOM 0 HH12 ARG A 123 15.822 -6.675 -30.815 1.00 73.34 H new ATOM 0 HH21 ARG A 123 14.037 -7.571 -27.910 1.00 62.13 H new ATOM 0 HH22 ARG A 123 15.569 -6.975 -28.558 1.00 62.13 H new ATOM 1968 N PRO A 124 8.713 -11.502 -31.493 1.00 63.41 N ATOM 1969 CA PRO A 124 8.563 -12.570 -30.499 1.00 35.35 C ATOM 1970 C PRO A 124 9.664 -12.540 -29.446 1.00 33.30 C ATOM 1971 O PRO A 124 10.849 -12.646 -29.767 1.00 72.15 O ATOM 1972 CB PRO A 124 8.659 -13.849 -31.337 1.00 52.22 C ATOM 1973 CG PRO A 124 9.450 -13.457 -32.537 1.00 73.44 C ATOM 1974 CD PRO A 124 9.097 -12.022 -32.816 1.00 51.12 C ATOM 0 HA PRO A 124 7.632 -12.479 -29.939 1.00 35.35 H new ATOM 0 HB2 PRO A 124 9.150 -14.649 -30.783 1.00 52.22 H new ATOM 0 HB3 PRO A 124 7.671 -14.214 -31.616 1.00 52.22 H new ATOM 0 HG2 PRO A 124 10.519 -13.567 -32.353 1.00 73.44 H new ATOM 0 HG3 PRO A 124 9.206 -14.091 -33.389 1.00 73.44 H new ATOM 0 HD2 PRO A 124 9.942 -11.474 -33.233 1.00 51.12 H new ATOM 0 HD3 PRO A 124 8.279 -11.941 -33.532 1.00 51.12 H new ATOM 1982 N THR A 125 9.268 -12.396 -28.185 1.00 22.00 N ATOM 1983 CA THR A 125 10.221 -12.351 -27.084 1.00 42.24 C ATOM 1984 C THR A 125 10.471 -13.743 -26.516 1.00 10.44 C ATOM 1985 O THR A 125 10.777 -13.896 -25.333 1.00 12.15 O ATOM 1986 CB THR A 125 9.730 -11.427 -25.952 1.00 23.54 C ATOM 1987 OG1 THR A 125 10.770 -11.239 -24.987 1.00 23.21 O ATOM 1988 CG2 THR A 125 8.500 -12.012 -25.273 1.00 33.31 C ATOM 0 H THR A 125 8.292 -12.308 -27.901 1.00 22.00 H new ATOM 0 HA THR A 125 11.152 -11.954 -27.488 1.00 42.24 H new ATOM 0 HB THR A 125 9.462 -10.464 -26.388 1.00 23.54 H new ATOM 0 HG1 THR A 125 11.157 -12.107 -24.750 1.00 23.21 H new ATOM 0 HG21 THR A 125 8.171 -11.343 -24.478 1.00 33.31 H new ATOM 0 HG22 THR A 125 7.700 -12.127 -26.005 1.00 33.31 H new ATOM 0 HG23 THR A 125 8.747 -12.986 -24.850 1.00 33.31 H new ATOM 1996 N ALA A 126 10.340 -14.756 -27.366 1.00 63.53 N ATOM 1997 CA ALA A 126 10.554 -16.137 -26.949 1.00 52.34 C ATOM 1998 C ALA A 126 11.941 -16.317 -26.342 1.00 12.31 C ATOM 1999 O ALA A 126 12.888 -15.603 -26.674 1.00 43.41 O ATOM 2000 CB ALA A 126 10.364 -17.080 -28.128 1.00 14.20 C ATOM 0 H ALA A 126 10.087 -14.647 -28.348 1.00 63.53 H new ATOM 0 HA ALA A 126 9.817 -16.379 -26.183 1.00 52.34 H new ATOM 0 HB1 ALA A 126 10.527 -18.107 -27.802 1.00 14.20 H new ATOM 0 HB2 ALA A 126 9.350 -16.979 -28.515 1.00 14.20 H new ATOM 0 HB3 ALA A 126 11.079 -16.831 -28.912 1.00 14.20 H new ATOM 2006 N PRO A 127 12.067 -17.293 -25.431 1.00 73.12 N ATOM 2007 CA PRO A 127 13.335 -17.589 -24.758 1.00 3.03 C ATOM 2008 C PRO A 127 14.361 -18.205 -25.703 1.00 55.13 C ATOM 2009 O PRO A 127 14.101 -18.374 -26.893 1.00 11.02 O ATOM 2010 CB PRO A 127 12.935 -18.594 -23.675 1.00 74.34 C ATOM 2011 CG PRO A 127 11.698 -19.240 -24.195 1.00 40.45 C ATOM 2012 CD PRO A 127 10.980 -18.182 -24.987 1.00 34.11 C ATOM 0 HA PRO A 127 13.811 -16.689 -24.369 1.00 3.03 H new ATOM 0 HB2 PRO A 127 13.723 -19.328 -23.505 1.00 74.34 H new ATOM 0 HB3 PRO A 127 12.752 -18.097 -22.722 1.00 74.34 H new ATOM 0 HG2 PRO A 127 11.940 -20.099 -24.821 1.00 40.45 H new ATOM 0 HG3 PRO A 127 11.076 -19.606 -23.378 1.00 40.45 H new ATOM 0 HD2 PRO A 127 10.440 -18.609 -25.832 1.00 34.11 H new ATOM 0 HD3 PRO A 127 10.249 -17.650 -24.378 1.00 34.11 H new ATOM 2020 N SER A 128 15.530 -18.539 -25.163 1.00 15.22 N ATOM 2021 CA SER A 128 16.598 -19.132 -25.960 1.00 65.21 C ATOM 2022 C SER A 128 16.766 -20.612 -25.624 1.00 14.15 C ATOM 2023 O SER A 128 16.756 -21.465 -26.511 1.00 34.11 O ATOM 2024 CB SER A 128 17.914 -18.391 -25.720 1.00 13.43 C ATOM 2025 OG SER A 128 17.894 -17.108 -26.323 1.00 44.31 O ATOM 0 H SER A 128 15.761 -18.409 -24.178 1.00 15.22 H new ATOM 0 HA SER A 128 16.326 -19.043 -27.012 1.00 65.21 H new ATOM 0 HB2 SER A 128 18.088 -18.290 -24.649 1.00 13.43 H new ATOM 0 HB3 SER A 128 18.742 -18.973 -26.124 1.00 13.43 H new ATOM 0 HG SER A 128 18.746 -16.654 -26.154 1.00 44.31 H new ATOM 2031 N SER A 129 16.921 -20.907 -24.338 1.00 73.00 N ATOM 2032 CA SER A 129 17.096 -22.281 -23.884 1.00 33.04 C ATOM 2033 C SER A 129 15.790 -22.841 -23.331 1.00 21.04 C ATOM 2034 O SER A 129 14.943 -22.097 -22.839 1.00 3.20 O ATOM 2035 CB SER A 129 18.189 -22.353 -22.816 1.00 71.12 C ATOM 2036 OG SER A 129 19.420 -21.858 -23.311 1.00 15.52 O ATOM 0 H SER A 129 16.929 -20.212 -23.591 1.00 73.00 H new ATOM 0 HA SER A 129 17.396 -22.885 -24.741 1.00 33.04 H new ATOM 0 HB2 SER A 129 17.886 -21.776 -21.942 1.00 71.12 H new ATOM 0 HB3 SER A 129 18.314 -23.385 -22.488 1.00 71.12 H new ATOM 0 HG SER A 129 20.101 -21.913 -22.609 1.00 15.52 H new ATOM 2042 N GLU A 130 15.635 -24.159 -23.416 1.00 44.31 N ATOM 2043 CA GLU A 130 14.431 -24.819 -22.925 1.00 65.33 C ATOM 2044 C GLU A 130 14.706 -26.286 -22.607 1.00 72.03 C ATOM 2045 O GLU A 130 14.503 -27.163 -23.447 1.00 73.21 O ATOM 2046 CB GLU A 130 13.306 -24.710 -23.956 1.00 30.40 C ATOM 2047 CG GLU A 130 13.723 -25.121 -25.357 1.00 34.22 C ATOM 2048 CD GLU A 130 13.809 -23.943 -26.309 1.00 24.12 C ATOM 2049 OE1 GLU A 130 12.863 -23.126 -26.327 1.00 72.51 O ATOM 2050 OE2 GLU A 130 14.818 -23.838 -27.036 1.00 32.24 O ATOM 0 H GLU A 130 16.327 -24.790 -23.820 1.00 44.31 H new ATOM 0 HA GLU A 130 14.122 -24.319 -22.007 1.00 65.33 H new ATOM 0 HB2 GLU A 130 12.471 -25.333 -23.637 1.00 30.40 H new ATOM 0 HB3 GLU A 130 12.945 -23.682 -23.980 1.00 30.40 H new ATOM 0 HG2 GLU A 130 14.692 -25.619 -25.312 1.00 34.22 H new ATOM 0 HG3 GLU A 130 13.009 -25.847 -25.746 1.00 34.22 H new ATOM 2057 N LYS A 131 15.169 -26.545 -21.389 1.00 24.03 N ATOM 2058 CA LYS A 131 15.472 -27.905 -20.958 1.00 25.03 C ATOM 2059 C LYS A 131 14.450 -28.392 -19.936 1.00 23.21 C ATOM 2060 O LYS A 131 14.283 -27.791 -18.875 1.00 34.04 O ATOM 2061 CB LYS A 131 16.879 -27.971 -20.361 1.00 71.22 C ATOM 2062 CG LYS A 131 17.984 -27.757 -21.380 1.00 13.24 C ATOM 2063 CD LYS A 131 18.810 -29.016 -21.579 1.00 34.24 C ATOM 2064 CE LYS A 131 20.255 -28.686 -21.924 1.00 21.42 C ATOM 2065 NZ LYS A 131 20.458 -28.552 -23.393 1.00 4.23 N ATOM 0 H LYS A 131 15.343 -25.830 -20.682 1.00 24.03 H new ATOM 0 HA LYS A 131 15.424 -28.556 -21.831 1.00 25.03 H new ATOM 0 HB2 LYS A 131 16.968 -27.218 -19.578 1.00 71.22 H new ATOM 0 HB3 LYS A 131 17.018 -28.942 -19.886 1.00 71.22 H new ATOM 0 HG2 LYS A 131 17.549 -27.452 -22.332 1.00 13.24 H new ATOM 0 HG3 LYS A 131 18.631 -26.944 -21.051 1.00 13.24 H new ATOM 0 HD2 LYS A 131 18.780 -29.619 -20.672 1.00 34.24 H new ATOM 0 HD3 LYS A 131 18.373 -29.617 -22.376 1.00 34.24 H new ATOM 0 HE2 LYS A 131 20.543 -27.757 -21.431 1.00 21.42 H new ATOM 0 HE3 LYS A 131 20.908 -29.468 -21.537 1.00 21.42 H new ATOM 0 HZ1 LYS A 131 21.455 -28.327 -23.587 1.00 4.23 H new ATOM 0 HZ2 LYS A 131 20.208 -29.446 -23.861 1.00 4.23 H new ATOM 0 HZ3 LYS A 131 19.854 -27.789 -23.759 1.00 4.23 H new ATOM 2079 N GLY A 132 13.768 -29.487 -20.261 1.00 54.11 N ATOM 2080 CA GLY A 132 12.774 -30.036 -19.360 1.00 5.10 C ATOM 2081 C GLY A 132 12.934 -31.530 -19.159 1.00 34.12 C ATOM 2082 O GLY A 132 13.833 -32.147 -19.730 1.00 1.02 O ATOM 0 H GLY A 132 13.887 -30.003 -21.133 1.00 54.11 H new ATOM 0 HA2 GLY A 132 12.846 -29.533 -18.396 1.00 5.10 H new ATOM 0 HA3 GLY A 132 11.779 -29.830 -19.754 1.00 5.10 H new ATOM 2086 N GLY A 133 12.063 -32.114 -18.343 1.00 65.03 N ATOM 2087 CA GLY A 133 12.131 -33.539 -18.081 1.00 72.01 C ATOM 2088 C GLY A 133 11.291 -33.951 -16.888 1.00 51.21 C ATOM 2089 O GLY A 133 10.363 -33.243 -16.500 1.00 15.31 O ATOM 0 H GLY A 133 11.311 -31.625 -17.858 1.00 65.03 H new ATOM 0 HA2 GLY A 133 11.795 -34.084 -18.963 1.00 72.01 H new ATOM 0 HA3 GLY A 133 13.169 -33.824 -17.906 1.00 72.01 H new ATOM 2093 N ASN A 134 11.617 -35.101 -16.305 1.00 44.34 N ATOM 2094 CA ASN A 134 10.883 -35.606 -15.151 1.00 45.33 C ATOM 2095 C ASN A 134 11.705 -35.455 -13.874 1.00 13.10 C ATOM 2096 O ASN A 134 12.200 -36.438 -13.322 1.00 20.01 O ATOM 2097 CB ASN A 134 10.511 -37.075 -15.360 1.00 34.41 C ATOM 2098 CG ASN A 134 9.439 -37.256 -16.417 1.00 51.14 C ATOM 2099 OD1 ASN A 134 8.687 -36.329 -16.717 1.00 3.24 O ATOM 2100 ND2 ASN A 134 9.365 -38.454 -16.985 1.00 5.32 N ATOM 0 H ASN A 134 12.384 -35.699 -16.613 1.00 44.34 H new ATOM 0 HA ASN A 134 9.971 -35.018 -15.047 1.00 45.33 H new ATOM 0 HB2 ASN A 134 11.401 -37.634 -15.649 1.00 34.41 H new ATOM 0 HB3 ASN A 134 10.162 -37.496 -14.417 1.00 34.41 H new ATOM 0 HD21 ASN A 134 8.663 -38.636 -17.702 1.00 5.32 H new ATOM 0 HD22 ASN A 134 10.010 -39.192 -16.704 1.00 5.32 H new ATOM 2107 N TYR A 135 11.847 -34.217 -13.412 1.00 34.30 N ATOM 2108 CA TYR A 135 12.611 -33.937 -12.202 1.00 34.10 C ATOM 2109 C TYR A 135 11.921 -32.871 -11.356 1.00 13.14 C ATOM 2110 O TYR A 135 12.594 -32.168 -10.605 1.00 61.54 O ATOM 2111 CB TYR A 135 14.026 -33.480 -12.562 1.00 72.52 C ATOM 2112 CG TYR A 135 14.958 -34.619 -12.912 1.00 12.35 C ATOM 2113 CD1 TYR A 135 15.481 -35.444 -11.925 1.00 71.14 C ATOM 2114 CD2 TYR A 135 15.315 -34.869 -14.232 1.00 61.11 C ATOM 2115 CE1 TYR A 135 16.334 -36.484 -12.241 1.00 64.02 C ATOM 2116 CE2 TYR A 135 16.166 -35.907 -14.557 1.00 33.12 C ATOM 2117 CZ TYR A 135 16.673 -36.712 -13.558 1.00 35.23 C ATOM 2118 OH TYR A 135 17.521 -37.748 -13.877 1.00 62.20 O ATOM 0 H TYR A 135 11.443 -33.393 -13.857 1.00 34.30 H new ATOM 0 HA TYR A 135 12.670 -34.856 -11.619 1.00 34.10 H new ATOM 0 HB2 TYR A 135 13.973 -32.792 -13.406 1.00 72.52 H new ATOM 0 HB3 TYR A 135 14.444 -32.924 -11.723 1.00 72.52 H new ATOM 0 HD1 TYR A 135 15.216 -35.270 -10.893 1.00 71.14 H new ATOM 0 HD2 TYR A 135 14.920 -34.241 -15.017 1.00 61.11 H new ATOM 0 HE1 TYR A 135 16.733 -37.115 -11.461 1.00 64.02 H new ATOM 0 HE2 TYR A 135 16.433 -36.088 -15.588 1.00 33.12 H new ATOM 0 HH TYR A 135 17.657 -37.772 -14.847 1.00 62.20 H new TER 2128 TYR A 135 HETATM 2129 C1 MYR A 1 7.713 10.288 2.446 1.00 15.42 C HETATM 2130 O2 MYR A 1 8.826 10.745 2.703 1.00 14.33 O HETATM 2131 C2 MYR A 1 7.309 10.142 0.977 1.00 71.35 C HETATM 2132 C3 MYR A 1 7.980 8.959 0.241 1.00 74.32 C HETATM 2133 C4 MYR A 1 7.486 7.597 0.761 1.00 31.10 C HETATM 2134 C5 MYR A 1 8.513 6.475 0.517 1.00 22.21 C HETATM 2135 C6 MYR A 1 7.839 5.106 0.305 1.00 75.41 C HETATM 2136 C7 MYR A 1 7.304 4.936 -1.129 1.00 33.34 C HETATM 2137 C8 MYR A 1 5.793 5.217 -1.225 1.00 21.24 C HETATM 2138 C9 MYR A 1 4.992 3.966 -1.634 1.00 71.54 C HETATM 2139 C10 MYR A 1 3.678 4.325 -2.359 1.00 33.23 C HETATM 2140 C11 MYR A 1 2.400 3.963 -1.574 1.00 74.10 C HETATM 2141 C12 MYR A 1 1.920 2.511 -1.776 1.00 62.35 C HETATM 2142 C13 MYR A 1 1.038 2.022 -0.613 1.00 33.10 C HETATM 2143 C14 MYR A 1 1.188 0.513 -0.379 1.00 14.12 C HETATM 0 H143 MYR A 1 0.895 -0.026 -1.280 1.00 14.12 H new HETATM 0 H142 MYR A 1 2.226 0.283 -0.140 1.00 14.12 H new HETATM 0 H141 MYR A 1 0.549 0.208 0.450 1.00 14.12 H new HETATM 0 H132 MYR A 1 1.306 2.559 0.297 1.00 33.10 H new HETATM 0 H131 MYR A 1 -0.005 2.255 -0.825 1.00 33.10 H new HETATM 0 H122 MYR A 1 1.360 2.442 -2.708 1.00 62.35 H new HETATM 0 H121 MYR A 1 2.785 1.855 -1.874 1.00 62.35 H new HETATM 0 H112 MYR A 1 2.581 4.129 -0.512 1.00 74.10 H new HETATM 0 H111 MYR A 1 1.601 4.642 -1.871 1.00 74.10 H new HETATM 0 H102 MYR A 1 3.672 5.395 -2.567 1.00 33.23 H new HETATM 0 H101 MYR A 1 3.656 3.814 -3.321 1.00 33.23 H new HETATM 0 H92 MYR A 1 5.604 3.341 -2.284 1.00 71.54 H new HETATM 0 H91 MYR A 1 4.765 3.376 -0.746 1.00 71.54 H new HETATM 0 H82 MYR A 1 5.431 5.579 -0.263 1.00 21.24 H new HETATM 0 H81 MYR A 1 5.618 6.011 -1.951 1.00 21.24 H new HETATM 0 H72 MYR A 1 7.840 5.610 -1.797 1.00 33.34 H new HETATM 0 H71 MYR A 1 7.505 3.921 -1.472 1.00 33.34 H new HETATM 0 H62 MYR A 1 8.556 4.313 0.520 1.00 75.41 H new HETATM 0 H61 MYR A 1 7.018 4.994 1.013 1.00 75.41 H new HETATM 0 H52 MYR A 1 9.116 6.720 -0.357 1.00 22.21 H new HETATM 0 H51 MYR A 1 9.193 6.416 1.367 1.00 22.21 H new HETATM 0 H42 MYR A 1 7.278 7.671 1.828 1.00 31.10 H new HETATM 0 H41 MYR A 1 6.547 7.341 0.270 1.00 31.10 H new HETATM 0 H32 MYR A 1 7.776 9.034 -0.827 1.00 74.32 H new HETATM 0 H31 MYR A 1 9.061 9.023 0.364 1.00 74.32 H new HETATM 0 H22 MYR A 1 6.227 10.021 0.921 1.00 71.35 H new HETATM 0 H21 MYR A 1 7.554 11.066 0.453 1.00 71.35 H new HETATM 2171 P1 PBU A 300 9.953 -12.756 2.556 1.00 2.34 P HETATM 2172 P4 PBU A 300 3.923 -15.737 -1.782 1.00 14.21 P HETATM 2173 P5 PBU A 300 7.111 -16.242 -4.217 1.00 34.43 P HETATM 2174 C3' PBU A 300 11.839 -11.829 1.184 1.00 11.34 C HETATM 2175 C2' PBU A 300 11.560 -10.320 0.976 1.00 41.23 C HETATM 2176 O2' PBU A 300 11.164 -10.114 -0.370 1.00 45.34 O HETATM 2177 C1' PBU A 300 12.808 -9.454 1.272 1.00 51.34 C HETATM 2178 O1' PBU A 300 13.464 -9.958 2.418 1.00 35.24 O HETATM 2179 C1 PBU A 300 8.336 -14.172 0.561 1.00 24.43 C HETATM 2180 O1 PBU A 300 9.642 -13.704 1.216 1.00 11.55 O HETATM 2181 C2 PBU A 300 7.439 -15.107 1.443 1.00 15.00 C HETATM 2182 O2 PBU A 300 8.126 -16.267 1.904 1.00 24.24 O HETATM 2183 C3 PBU A 300 6.179 -15.544 0.664 1.00 3.21 C HETATM 2184 O3 PBU A 300 5.408 -16.399 1.521 1.00 1.12 O HETATM 2185 C4 PBU A 300 6.560 -16.257 -0.691 1.00 1.51 C HETATM 2186 O4 PBU A 300 5.293 -16.624 -1.444 1.00 42.11 O HETATM 2187 C5 PBU A 300 7.457 -15.275 -1.545 1.00 1.14 C HETATM 2188 O5 PBU A 300 7.860 -15.961 -2.775 1.00 33.35 O HETATM 2189 C6 PBU A 300 8.724 -14.814 -0.785 1.00 70.11 C HETATM 2190 O6 PBU A 300 9.474 -13.834 -1.518 1.00 51.33 O HETATM 2191 C7 PBU A 300 9.792 -10.282 -0.679 1.00 31.53 C HETATM 2192 O7 PBU A 300 9.427 -11.209 -1.368 1.00 34.22 O HETATM 2193 C8 PBU A 300 8.756 -9.292 -0.122 1.00 40.34 C HETATM 2194 C9 PBU A 300 7.687 -8.983 -1.187 1.00 55.32 C HETATM 2195 C10 PBU A 300 6.321 -9.507 -0.709 1.00 62.30 C HETATM 2196 C11 PBU A 300 13.453 -9.271 3.647 1.00 63.25 C HETATM 2197 O11 PBU A 300 14.277 -8.442 3.982 1.00 34.41 O HETATM 2198 C12 PBU A 300 12.320 -9.681 4.629 1.00 63.31 C HETATM 2199 C13 PBU A 300 12.698 -10.862 5.541 1.00 11.45 C HETATM 2200 C14 PBU A 300 11.622 -11.099 6.617 1.00 14.43 C HETATM 2201 O41 PBU A 300 3.433 -15.516 -0.354 1.00 41.24 O HETATM 2202 O42 PBU A 300 4.410 -14.493 -2.475 1.00 54.43 O HETATM 2203 O43 PBU A 300 2.995 -16.539 -2.678 1.00 13.45 O HETATM 2204 O51 PBU A 300 8.314 -16.338 -5.134 1.00 23.13 O HETATM 2205 O52 PBU A 300 6.320 -17.514 -3.959 1.00 34.41 O HETATM 2206 O53 PBU A 300 6.273 -15.001 -4.418 1.00 31.02 O HETATM 2207 OP1 PBU A 300 11.369 -12.277 2.438 1.00 12.52 O HETATM 2208 OP2 PBU A 300 8.912 -11.639 2.438 1.00 71.32 O HETATM 2209 OP3 PBU A 300 9.814 -13.706 3.716 1.00 31.14 O HETATM 0 H3'2 PBU A 300 11.359 -12.401 0.390 1.00 11.34 H new HETATM 0 H3'1 PBU A 300 12.910 -12.015 1.109 1.00 11.34 H new HETATM 0 H143 PBU A 300 11.518 -10.204 7.231 1.00 14.43 H new HETATM 0 H142 PBU A 300 10.669 -11.322 6.136 1.00 14.43 H new HETATM 0 H141 PBU A 300 11.916 -11.939 7.246 1.00 14.43 H new HETATM 0 H132 PBU A 300 12.821 -11.764 4.941 1.00 11.45 H new HETATM 0 H131 PBU A 300 13.657 -10.664 6.019 1.00 11.45 H new HETATM 0 H122 PBU A 300 12.058 -8.823 5.248 1.00 63.31 H new HETATM 0 H121 PBU A 300 11.431 -9.944 4.056 1.00 63.31 H new HETATM 0 H1'2 PBU A 300 13.484 -9.465 0.417 1.00 51.34 H new HETATM 0 H1'1 PBU A 300 12.515 -8.416 1.433 1.00 51.34 H new HETATM 0 H92 PBU A 300 7.635 -7.909 -1.364 1.00 55.32 H new HETATM 0 H91 PBU A 300 7.956 -9.450 -2.134 1.00 55.32 H new HETATM 0 H82 PBU A 300 8.284 -9.711 0.767 1.00 40.34 H new HETATM 0 H81 PBU A 300 9.251 -8.371 0.184 1.00 40.34 H new HETATM 0 H6 PBU A 300 9.334 -15.706 -0.642 1.00 70.11 H new HETATM 0 H5 PBU A 300 6.866 -14.385 -1.760 1.00 1.14 H new HETATM 0 H4 PBU A 300 7.119 -17.172 -0.496 1.00 1.51 H new HETATM 0 H3 PBU A 300 5.586 -14.672 0.387 1.00 3.21 H new HETATM 0 H2' PBU A 300 10.774 -10.020 1.669 1.00 41.23 H new HETATM 0 H2 PBU A 300 7.159 -14.519 2.317 1.00 15.00 H new HETATM 0 H13 PBU A 300 6.379 -10.584 -0.554 1.00 62.30 H new HETATM 0 H12 PBU A 300 6.052 -9.019 0.228 1.00 62.30 H new HETATM 0 H11 PBU A 300 5.564 -9.289 -1.462 1.00 62.30 H new HETATM 0 H1 PBU A 300 7.688 -13.307 0.419 1.00 24.43 H new HETATM 0 H06 PBU A 300 9.456 -12.981 -1.036 1.00 51.33 H new HETATM 0 H03 PBU A 300 4.477 -16.416 1.214 1.00 1.12 H new HETATM 0 H02 PBU A 300 7.478 -16.979 2.090 1.00 24.24 H new