USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1069 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 12 SER OG : rot -85:sc= 0.78 USER MOD Set 1.2: A 139 THR OG1 : rot 173:sc= 0.983 USER MOD Set 2.1: A 108 SER OG : rot -115:sc= 1.21 USER MOD Set 2.2: A 130 SER OG : rot -10:sc= 0.909 USER MOD Set 3.1: A 42 SER OG : rot -91:sc= 1.65 USER MOD Set 3.2: A 66 THR OG1 : rot -95:sc= 1.57 USER MOD Set 4.1: A 45 TYR OH : rot -107:sc= 0.125 USER MOD Set 4.2: A 63 TYR OH : rot -25:sc= -0.0724 USER MOD Set 5.1: A 60 ASN : amide:sc= -1.84 K(o=-2.9,f=-5!) USER MOD Set 5.2: A 62 TYR OH : rot 180:sc= -1.03 USER MOD Set 6.1: A 53 SER OG : rot 114:sc= 0.128 USER MOD Set 6.2: A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.201 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.165 X(o=-0.17,f=-0.32) USER MOD Single : A 15 GLN : amide:sc= -0.122 X(o=-0.12,f=-0.14) USER MOD Single : A 17 GLN : amide:sc= -0.939 K(o=-0.94,f=-0.22) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= -1.97 K(o=-2,f=0.0065) USER MOD Single : A 20 LYS NZ :NH3+ -124:sc= -0.989 (180deg=-3.14!) USER MOD Single : A 21 MET CE :methyl -158:sc= -0.25 (180deg=-1.33) USER MOD Single : A 25 ASN : amide:sc= -2.92! C(o=-2.9!,f=-7.7!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -0.176 X(o=-0.18,f=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -168:sc= -0.0762 (180deg=-0.434) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 LYS NZ :NH3+ -139:sc= 1.23 (180deg=1) USER MOD Single : A 61 GLN : amide:sc=-0.00242 K(o=-0.0024,f=-1.3) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.35 X(o=-0.35,f=-0.052) USER MOD Single : A 78 SER OG : rot 33:sc= 0.499 USER MOD Single : A 80 TYR OH : rot 180:sc=-0.00835 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 163:sc= -0.785 (180deg=-1.4) USER MOD Single : A 91 GLN : amide:sc= -0.173 X(o=-0.17,f=-0.25) USER MOD Single : A 92 THR OG1 : rot 124:sc= 0.87 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= -1.44 USER MOD Single : A 103 SER OG : rot -31:sc= 0.727 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= 0.144 K(o=0.14,f=-5.4!) USER MOD Single : A 116 ASN : amide:sc= -1.33 K(o=-1.3,f=-6.8!) USER MOD Single : A 118 MET CE :methyl -155:sc= -0.222 (180deg=-1.17) USER MOD Single : A 120 ASN : amide:sc= -0.194 X(o=-0.19,f=0) USER MOD Single : A 126 SER OG : rot 31:sc= 0.974 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 134 SER OG : rot -17:sc= -0.3 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 115.815 -22.106 9.492 1.00 0.00 N ATOM 2 CA ALA A 1 116.567 -23.184 8.789 1.00 0.00 C ATOM 3 C ALA A 1 117.371 -22.578 7.645 1.00 0.00 C ATOM 4 O ALA A 1 118.576 -22.803 7.533 1.00 0.00 O ATOM 5 CB ALA A 1 115.578 -24.217 8.243 1.00 0.00 C ATOM 0 H1 ALA A 1 115.266 -22.518 10.273 1.00 0.00 H new ATOM 0 H2 ALA A 1 116.484 -21.406 9.871 1.00 0.00 H new ATOM 0 H3 ALA A 1 115.169 -21.640 8.823 1.00 0.00 H new ATOM 0 HA ALA A 1 117.249 -23.672 9.485 1.00 0.00 H new ATOM 0 HB1 ALA A 1 116.124 -25.007 7.728 1.00 0.00 H new ATOM 0 HB2 ALA A 1 115.009 -24.647 9.067 1.00 0.00 H new ATOM 0 HB3 ALA A 1 114.895 -23.733 7.544 1.00 0.00 H new ATOM 13 N THR A 2 116.697 -21.807 6.796 1.00 0.00 N ATOM 14 CA THR A 2 117.351 -21.166 5.658 1.00 0.00 C ATOM 15 C THR A 2 117.163 -19.653 5.720 1.00 0.00 C ATOM 16 O THR A 2 116.093 -19.166 6.087 1.00 0.00 O ATOM 17 CB THR A 2 116.762 -21.701 4.351 1.00 0.00 C ATOM 18 OG1 THR A 2 116.842 -23.119 4.346 1.00 0.00 O ATOM 19 CG2 THR A 2 117.549 -21.140 3.165 1.00 0.00 C ATOM 0 H THR A 2 115.699 -21.611 6.874 1.00 0.00 H new ATOM 0 HA THR A 2 118.417 -21.392 5.696 1.00 0.00 H new ATOM 0 HB THR A 2 115.720 -21.393 4.269 1.00 0.00 H new ATOM 0 HG1 THR A 2 116.464 -23.465 3.511 1.00 0.00 H new ATOM 0 HG21 THR A 2 117.128 -21.522 2.235 1.00 0.00 H new ATOM 0 HG22 THR A 2 117.488 -20.052 3.170 1.00 0.00 H new ATOM 0 HG23 THR A 2 118.592 -21.446 3.243 1.00 0.00 H new ATOM 27 N SER A 3 118.208 -18.914 5.358 1.00 0.00 N ATOM 28 CA SER A 3 118.156 -17.454 5.383 1.00 0.00 C ATOM 29 C SER A 3 118.569 -16.889 4.029 1.00 0.00 C ATOM 30 O SER A 3 119.467 -17.421 3.377 1.00 0.00 O ATOM 31 CB SER A 3 119.090 -16.918 6.467 1.00 0.00 C ATOM 32 OG SER A 3 118.942 -15.507 6.556 1.00 0.00 O ATOM 0 H SER A 3 119.099 -19.300 5.045 1.00 0.00 H new ATOM 0 HA SER A 3 117.134 -17.145 5.601 1.00 0.00 H new ATOM 0 HB2 SER A 3 118.857 -17.381 7.426 1.00 0.00 H new ATOM 0 HB3 SER A 3 120.123 -17.173 6.232 1.00 0.00 H new ATOM 0 HG SER A 3 119.538 -15.159 7.252 1.00 0.00 H new ATOM 38 N THR A 4 117.901 -15.820 3.607 1.00 0.00 N ATOM 39 CA THR A 4 118.208 -15.182 2.329 1.00 0.00 C ATOM 40 C THR A 4 118.372 -13.678 2.514 1.00 0.00 C ATOM 41 O THR A 4 117.552 -13.032 3.167 1.00 0.00 O ATOM 42 CB THR A 4 117.087 -15.457 1.325 1.00 0.00 C ATOM 43 OG1 THR A 4 116.864 -16.857 1.238 1.00 0.00 O ATOM 44 CG2 THR A 4 117.485 -14.916 -0.049 1.00 0.00 C ATOM 0 H THR A 4 117.145 -15.377 4.129 1.00 0.00 H new ATOM 0 HA THR A 4 119.142 -15.596 1.949 1.00 0.00 H new ATOM 0 HB THR A 4 116.174 -14.963 1.656 1.00 0.00 H new ATOM 0 HG1 THR A 4 116.145 -17.034 0.596 1.00 0.00 H new ATOM 0 HG21 THR A 4 116.685 -15.113 -0.763 1.00 0.00 H new ATOM 0 HG22 THR A 4 117.655 -13.841 0.018 1.00 0.00 H new ATOM 0 HG23 THR A 4 118.399 -15.408 -0.383 1.00 0.00 H new ATOM 52 N VAL A 5 119.435 -13.121 1.938 1.00 0.00 N ATOM 53 CA VAL A 5 119.692 -11.686 2.046 1.00 0.00 C ATOM 54 C VAL A 5 119.764 -11.072 0.654 1.00 0.00 C ATOM 55 O VAL A 5 120.486 -11.568 -0.208 1.00 0.00 O ATOM 56 CB VAL A 5 121.008 -11.441 2.790 1.00 0.00 C ATOM 57 CG1 VAL A 5 120.895 -11.983 4.216 1.00 0.00 C ATOM 58 CG2 VAL A 5 122.155 -12.153 2.067 1.00 0.00 C ATOM 0 H VAL A 5 120.128 -13.637 1.395 1.00 0.00 H new ATOM 0 HA VAL A 5 118.880 -11.221 2.604 1.00 0.00 H new ATOM 0 HB VAL A 5 121.209 -10.370 2.818 1.00 0.00 H new ATOM 0 HG11 VAL A 5 121.831 -11.809 4.747 1.00 0.00 H new ATOM 0 HG12 VAL A 5 120.083 -11.474 4.736 1.00 0.00 H new ATOM 0 HG13 VAL A 5 120.690 -13.053 4.183 1.00 0.00 H new ATOM 0 HG21 VAL A 5 123.088 -11.975 2.601 1.00 0.00 H new ATOM 0 HG22 VAL A 5 121.955 -13.224 2.034 1.00 0.00 H new ATOM 0 HG23 VAL A 5 122.239 -11.768 1.051 1.00 0.00 H new ATOM 68 N THR A 6 119.006 -10.002 0.441 1.00 0.00 N ATOM 69 CA THR A 6 118.936 -9.368 -0.872 1.00 0.00 C ATOM 70 C THR A 6 119.083 -7.855 -0.740 1.00 0.00 C ATOM 71 O THR A 6 118.631 -7.266 0.239 1.00 0.00 O ATOM 72 CB THR A 6 117.589 -9.700 -1.523 1.00 0.00 C ATOM 73 OG1 THR A 6 117.331 -11.088 -1.374 1.00 0.00 O ATOM 74 CG2 THR A 6 117.606 -9.354 -3.016 1.00 0.00 C ATOM 0 H THR A 6 118.433 -9.556 1.157 1.00 0.00 H new ATOM 0 HA THR A 6 119.749 -9.745 -1.493 1.00 0.00 H new ATOM 0 HB THR A 6 116.811 -9.112 -1.035 1.00 0.00 H new ATOM 0 HG1 THR A 6 116.470 -11.307 -1.787 1.00 0.00 H new ATOM 0 HG21 THR A 6 116.640 -9.598 -3.457 1.00 0.00 H new ATOM 0 HG22 THR A 6 117.803 -8.289 -3.141 1.00 0.00 H new ATOM 0 HG23 THR A 6 118.387 -9.928 -3.514 1.00 0.00 H new ATOM 82 N GLY A 7 119.713 -7.228 -1.727 1.00 0.00 N ATOM 83 CA GLY A 7 119.829 -5.773 -1.743 1.00 0.00 C ATOM 84 C GLY A 7 119.479 -5.256 -3.129 1.00 0.00 C ATOM 85 O GLY A 7 119.686 -5.963 -4.115 1.00 0.00 O ATOM 0 H GLY A 7 120.148 -7.699 -2.520 1.00 0.00 H new ATOM 0 HA2 GLY A 7 119.162 -5.335 -1.000 1.00 0.00 H new ATOM 0 HA3 GLY A 7 120.843 -5.475 -1.476 1.00 0.00 H new ATOM 89 N GLY A 8 118.957 -4.035 -3.205 1.00 0.00 N ATOM 90 CA GLY A 8 118.543 -3.496 -4.496 1.00 0.00 C ATOM 91 C GLY A 8 118.489 -1.976 -4.492 1.00 0.00 C ATOM 92 O GLY A 8 118.575 -1.338 -3.444 1.00 0.00 O ATOM 0 H GLY A 8 118.813 -3.413 -2.409 1.00 0.00 H new ATOM 0 HA2 GLY A 8 119.236 -3.831 -5.267 1.00 0.00 H new ATOM 0 HA3 GLY A 8 117.561 -3.892 -4.756 1.00 0.00 H new ATOM 96 N TYR A 9 118.322 -1.418 -5.686 1.00 0.00 N ATOM 97 CA TYR A 9 118.236 0.027 -5.861 1.00 0.00 C ATOM 98 C TYR A 9 117.029 0.376 -6.726 1.00 0.00 C ATOM 99 O TYR A 9 116.656 -0.388 -7.620 1.00 0.00 O ATOM 100 CB TYR A 9 119.526 0.556 -6.498 1.00 0.00 C ATOM 101 CG TYR A 9 119.733 0.116 -7.931 1.00 0.00 C ATOM 102 CD1 TYR A 9 120.332 -1.119 -8.204 1.00 0.00 C ATOM 103 CD2 TYR A 9 119.328 0.946 -8.983 1.00 0.00 C ATOM 104 CE1 TYR A 9 120.525 -1.526 -9.530 1.00 0.00 C ATOM 105 CE2 TYR A 9 119.522 0.539 -10.309 1.00 0.00 C ATOM 106 CZ TYR A 9 120.120 -0.696 -10.582 1.00 0.00 C ATOM 107 OH TYR A 9 120.311 -1.097 -11.889 1.00 0.00 O ATOM 0 H TYR A 9 118.243 -1.949 -6.553 1.00 0.00 H new ATOM 0 HA TYR A 9 118.112 0.498 -4.886 1.00 0.00 H new ATOM 0 HB2 TYR A 9 119.516 1.645 -6.462 1.00 0.00 H new ATOM 0 HB3 TYR A 9 120.376 0.225 -5.901 1.00 0.00 H new ATOM 0 HD1 TYR A 9 120.645 -1.758 -7.392 1.00 0.00 H new ATOM 0 HD2 TYR A 9 118.866 1.899 -8.772 1.00 0.00 H new ATOM 0 HE1 TYR A 9 120.986 -2.480 -9.741 1.00 0.00 H new ATOM 0 HE2 TYR A 9 119.210 1.179 -11.121 1.00 0.00 H new ATOM 0 HH TYR A 9 119.973 -0.406 -12.496 1.00 0.00 H new ATOM 117 N ALA A 10 116.382 1.495 -6.411 1.00 0.00 N ATOM 118 CA ALA A 10 115.232 1.947 -7.185 1.00 0.00 C ATOM 119 C ALA A 10 115.265 3.459 -7.390 1.00 0.00 C ATOM 120 O ALA A 10 115.773 4.197 -6.545 1.00 0.00 O ATOM 121 CB ALA A 10 113.938 1.550 -6.471 1.00 0.00 C ATOM 0 H ALA A 10 116.633 2.101 -5.630 1.00 0.00 H new ATOM 0 HA ALA A 10 115.272 1.469 -8.164 1.00 0.00 H new ATOM 0 HB1 ALA A 10 113.082 1.890 -7.054 1.00 0.00 H new ATOM 0 HB2 ALA A 10 113.898 0.466 -6.366 1.00 0.00 H new ATOM 0 HB3 ALA A 10 113.911 2.011 -5.484 1.00 0.00 H new ATOM 127 N GLN A 11 114.715 3.904 -8.516 1.00 0.00 N ATOM 128 CA GLN A 11 114.571 5.331 -8.796 1.00 0.00 C ATOM 129 C GLN A 11 113.089 5.678 -8.898 1.00 0.00 C ATOM 130 O GLN A 11 112.312 4.909 -9.463 1.00 0.00 O ATOM 131 CB GLN A 11 115.278 5.685 -10.108 1.00 0.00 C ATOM 132 CG GLN A 11 116.754 5.274 -10.049 1.00 0.00 C ATOM 133 CD GLN A 11 117.468 5.979 -8.897 1.00 0.00 C ATOM 134 OE1 GLN A 11 117.363 7.197 -8.753 1.00 0.00 O ATOM 135 NE2 GLN A 11 118.189 5.281 -8.063 1.00 0.00 N ATOM 0 H GLN A 11 114.360 3.295 -9.253 1.00 0.00 H new ATOM 0 HA GLN A 11 115.026 5.903 -7.987 1.00 0.00 H new ATOM 0 HB2 GLN A 11 114.787 5.181 -10.940 1.00 0.00 H new ATOM 0 HB3 GLN A 11 115.200 6.756 -10.293 1.00 0.00 H new ATOM 0 HG2 GLN A 11 116.831 4.194 -9.924 1.00 0.00 H new ATOM 0 HG3 GLN A 11 117.243 5.521 -10.991 1.00 0.00 H new ATOM 0 HE21 GLN A 11 118.275 4.272 -8.184 1.00 0.00 H new ATOM 0 HE22 GLN A 11 118.667 5.745 -7.290 1.00 0.00 H new ATOM 144 N SER A 12 112.693 6.829 -8.356 1.00 0.00 N ATOM 145 CA SER A 12 111.275 7.184 -8.303 1.00 0.00 C ATOM 146 C SER A 12 111.019 8.509 -9.007 1.00 0.00 C ATOM 147 O SER A 12 111.781 9.462 -8.847 1.00 0.00 O ATOM 148 CB SER A 12 110.829 7.293 -6.844 1.00 0.00 C ATOM 149 OG SER A 12 111.083 6.060 -6.185 1.00 0.00 O ATOM 0 H SER A 12 113.323 7.523 -7.953 1.00 0.00 H new ATOM 0 HA SER A 12 110.707 6.405 -8.810 1.00 0.00 H new ATOM 0 HB2 SER A 12 111.364 8.102 -6.347 1.00 0.00 H new ATOM 0 HB3 SER A 12 109.767 7.535 -6.793 1.00 0.00 H new ATOM 0 HG SER A 12 110.330 5.450 -6.331 1.00 0.00 H new ATOM 155 N ASP A 13 109.927 8.560 -9.764 1.00 0.00 N ATOM 156 CA ASP A 13 109.523 9.778 -10.453 1.00 0.00 C ATOM 157 C ASP A 13 108.193 10.246 -9.883 1.00 0.00 C ATOM 158 O ASP A 13 107.240 9.470 -9.810 1.00 0.00 O ATOM 159 CB ASP A 13 109.380 9.516 -11.953 1.00 0.00 C ATOM 160 CG ASP A 13 109.082 10.819 -12.685 1.00 0.00 C ATOM 161 OD1 ASP A 13 110.022 11.535 -12.987 1.00 0.00 O ATOM 162 OD2 ASP A 13 107.916 11.084 -12.930 1.00 0.00 O ATOM 0 H ASP A 13 109.304 7.767 -9.915 1.00 0.00 H new ATOM 0 HA ASP A 13 110.282 10.547 -10.307 1.00 0.00 H new ATOM 0 HB2 ASP A 13 110.297 9.073 -12.342 1.00 0.00 H new ATOM 0 HB3 ASP A 13 108.579 8.799 -12.130 1.00 0.00 H new ATOM 167 N ALA A 14 108.136 11.502 -9.462 1.00 0.00 N ATOM 168 CA ALA A 14 106.950 12.028 -8.800 1.00 0.00 C ATOM 169 C ALA A 14 106.258 13.048 -9.692 1.00 0.00 C ATOM 170 O ALA A 14 106.745 14.161 -9.888 1.00 0.00 O ATOM 171 CB ALA A 14 107.347 12.682 -7.477 1.00 0.00 C ATOM 0 H ALA A 14 108.896 12.175 -9.567 1.00 0.00 H new ATOM 0 HA ALA A 14 106.260 11.207 -8.605 1.00 0.00 H new ATOM 0 HB1 ALA A 14 106.458 13.075 -6.984 1.00 0.00 H new ATOM 0 HB2 ALA A 14 107.822 11.942 -6.833 1.00 0.00 H new ATOM 0 HB3 ALA A 14 108.045 13.497 -7.669 1.00 0.00 H new ATOM 177 N GLN A 15 105.117 12.645 -10.228 1.00 0.00 N ATOM 178 CA GLN A 15 104.297 13.545 -11.027 1.00 0.00 C ATOM 179 C GLN A 15 103.673 14.599 -10.122 1.00 0.00 C ATOM 180 O GLN A 15 102.938 14.268 -9.187 1.00 0.00 O ATOM 181 CB GLN A 15 103.198 12.758 -11.745 1.00 0.00 C ATOM 182 CG GLN A 15 102.444 13.686 -12.699 1.00 0.00 C ATOM 183 CD GLN A 15 103.299 13.976 -13.928 1.00 0.00 C ATOM 184 OE1 GLN A 15 103.610 13.068 -14.698 1.00 0.00 O ATOM 185 NE2 GLN A 15 103.701 15.197 -14.158 1.00 0.00 N ATOM 0 H GLN A 15 104.738 11.704 -10.126 1.00 0.00 H new ATOM 0 HA GLN A 15 104.923 14.033 -11.774 1.00 0.00 H new ATOM 0 HB2 GLN A 15 103.634 11.927 -12.299 1.00 0.00 H new ATOM 0 HB3 GLN A 15 102.509 12.329 -11.017 1.00 0.00 H new ATOM 0 HG2 GLN A 15 101.503 13.225 -13.001 1.00 0.00 H new ATOM 0 HG3 GLN A 15 102.194 14.618 -12.192 1.00 0.00 H new ATOM 0 HE21 GLN A 15 103.442 15.948 -13.518 1.00 0.00 H new ATOM 0 HE22 GLN A 15 104.274 15.400 -14.977 1.00 0.00 H new ATOM 194 N GLY A 16 103.960 15.857 -10.437 1.00 0.00 N ATOM 195 CA GLY A 16 103.554 16.988 -9.601 1.00 0.00 C ATOM 196 C GLY A 16 104.693 17.505 -8.709 1.00 0.00 C ATOM 197 O GLY A 16 104.592 18.601 -8.155 1.00 0.00 O ATOM 0 H GLY A 16 104.478 16.124 -11.274 1.00 0.00 H new ATOM 0 HA2 GLY A 16 103.202 17.798 -10.239 1.00 0.00 H new ATOM 0 HA3 GLY A 16 102.714 16.688 -8.974 1.00 0.00 H new ATOM 201 N GLN A 17 105.772 16.732 -8.566 1.00 0.00 N ATOM 202 CA GLN A 17 106.968 17.191 -7.863 1.00 0.00 C ATOM 203 C GLN A 17 108.152 17.251 -8.824 1.00 0.00 C ATOM 204 O GLN A 17 108.121 16.642 -9.893 1.00 0.00 O ATOM 205 CB GLN A 17 107.296 16.253 -6.698 1.00 0.00 C ATOM 206 CG GLN A 17 106.122 16.200 -5.715 1.00 0.00 C ATOM 207 CD GLN A 17 105.845 17.587 -5.139 1.00 0.00 C ATOM 208 OE1 GLN A 17 106.762 18.253 -4.659 1.00 0.00 O ATOM 209 NE2 GLN A 17 104.631 18.064 -5.160 1.00 0.00 N ATOM 0 H GLN A 17 105.840 15.782 -8.930 1.00 0.00 H new ATOM 0 HA GLN A 17 106.775 18.189 -7.469 1.00 0.00 H new ATOM 0 HB2 GLN A 17 107.509 15.253 -7.076 1.00 0.00 H new ATOM 0 HB3 GLN A 17 108.194 16.598 -6.185 1.00 0.00 H new ATOM 0 HG2 GLN A 17 105.232 15.826 -6.221 1.00 0.00 H new ATOM 0 HG3 GLN A 17 106.347 15.503 -4.908 1.00 0.00 H new ATOM 0 HE21 GLN A 17 103.872 17.511 -5.558 1.00 0.00 H new ATOM 0 HE22 GLN A 17 104.440 18.990 -4.778 1.00 0.00 H new ATOM 218 N MET A 18 109.192 17.983 -8.440 1.00 0.00 N ATOM 219 CA MET A 18 110.385 18.098 -9.274 1.00 0.00 C ATOM 220 C MET A 18 111.511 17.206 -8.753 1.00 0.00 C ATOM 221 O MET A 18 111.484 16.759 -7.606 1.00 0.00 O ATOM 222 CB MET A 18 110.860 19.552 -9.301 1.00 0.00 C ATOM 223 CG MET A 18 109.827 20.413 -10.028 1.00 0.00 C ATOM 224 SD MET A 18 110.442 22.111 -10.162 1.00 0.00 S ATOM 225 CE MET A 18 108.966 22.829 -10.923 1.00 0.00 C ATOM 0 H MET A 18 109.235 18.503 -7.563 1.00 0.00 H new ATOM 0 HA MET A 18 110.126 17.774 -10.282 1.00 0.00 H new ATOM 0 HB2 MET A 18 111.003 19.918 -8.284 1.00 0.00 H new ATOM 0 HB3 MET A 18 111.825 19.621 -9.803 1.00 0.00 H new ATOM 0 HG2 MET A 18 109.633 20.006 -11.020 1.00 0.00 H new ATOM 0 HG3 MET A 18 108.881 20.399 -9.487 1.00 0.00 H new ATOM 0 HE1 MET A 18 109.128 23.893 -11.098 1.00 0.00 H new ATOM 0 HE2 MET A 18 108.767 22.331 -11.872 1.00 0.00 H new ATOM 0 HE3 MET A 18 108.113 22.696 -10.258 1.00 0.00 H new ATOM 235 N ASN A 19 112.498 16.956 -9.611 1.00 0.00 N ATOM 236 CA ASN A 19 113.691 16.195 -9.233 1.00 0.00 C ATOM 237 C ASN A 19 113.372 14.725 -8.969 1.00 0.00 C ATOM 238 O ASN A 19 112.414 14.396 -8.271 1.00 0.00 O ATOM 239 CB ASN A 19 114.353 16.803 -7.993 1.00 0.00 C ATOM 240 CG ASN A 19 115.796 16.323 -7.887 1.00 0.00 C ATOM 241 OD1 ASN A 19 116.634 16.684 -8.714 1.00 0.00 O ATOM 242 ND2 ASN A 19 116.139 15.522 -6.915 1.00 0.00 N ATOM 0 H ASN A 19 112.496 17.272 -10.581 1.00 0.00 H new ATOM 0 HA ASN A 19 114.379 16.249 -10.077 1.00 0.00 H new ATOM 0 HB2 ASN A 19 114.326 17.891 -8.052 1.00 0.00 H new ATOM 0 HB3 ASN A 19 113.799 16.519 -7.098 1.00 0.00 H new ATOM 0 HD21 ASN A 19 117.102 15.194 -6.840 1.00 0.00 H new ATOM 0 HD22 ASN A 19 115.444 15.224 -6.231 1.00 0.00 H new ATOM 249 N LYS A 20 114.196 13.849 -9.540 1.00 0.00 N ATOM 250 CA LYS A 20 114.069 12.410 -9.331 1.00 0.00 C ATOM 251 C LYS A 20 114.691 12.019 -7.991 1.00 0.00 C ATOM 252 O LYS A 20 115.578 12.712 -7.493 1.00 0.00 O ATOM 253 CB LYS A 20 114.776 11.667 -10.468 1.00 0.00 C ATOM 254 CG LYS A 20 114.514 10.164 -10.356 1.00 0.00 C ATOM 255 CD LYS A 20 115.133 9.443 -11.556 1.00 0.00 C ATOM 256 CE LYS A 20 116.660 9.517 -11.482 1.00 0.00 C ATOM 257 NZ LYS A 20 117.132 10.756 -12.164 1.00 0.00 N ATOM 0 H LYS A 20 114.965 14.115 -10.156 1.00 0.00 H new ATOM 0 HA LYS A 20 113.013 12.140 -9.321 1.00 0.00 H new ATOM 0 HB2 LYS A 20 114.420 12.035 -11.430 1.00 0.00 H new ATOM 0 HB3 LYS A 20 115.848 11.861 -10.429 1.00 0.00 H new ATOM 0 HG2 LYS A 20 114.939 9.779 -9.429 1.00 0.00 H new ATOM 0 HG3 LYS A 20 113.441 9.974 -10.318 1.00 0.00 H new ATOM 0 HD2 LYS A 20 114.812 8.402 -11.570 1.00 0.00 H new ATOM 0 HD3 LYS A 20 114.783 9.897 -12.483 1.00 0.00 H new ATOM 0 HE2 LYS A 20 116.985 9.516 -10.441 1.00 0.00 H new ATOM 0 HE3 LYS A 20 117.100 8.639 -11.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 117.814 10.505 -12.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 116.321 11.248 -12.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 117.590 11.381 -11.470 1.00 0.00 H new ATOM 271 N MET A 21 114.230 10.914 -7.404 1.00 0.00 N ATOM 272 CA MET A 21 114.739 10.481 -6.104 1.00 0.00 C ATOM 273 C MET A 21 115.375 9.103 -6.224 1.00 0.00 C ATOM 274 O MET A 21 115.001 8.323 -7.099 1.00 0.00 O ATOM 275 CB MET A 21 113.595 10.429 -5.089 1.00 0.00 C ATOM 276 CG MET A 21 113.042 11.840 -4.872 1.00 0.00 C ATOM 277 SD MET A 21 111.847 11.827 -3.512 1.00 0.00 S ATOM 278 CE MET A 21 110.672 10.657 -4.237 1.00 0.00 C ATOM 0 H MET A 21 113.513 10.309 -7.803 1.00 0.00 H new ATOM 0 HA MET A 21 115.491 11.194 -5.766 1.00 0.00 H new ATOM 0 HB2 MET A 21 112.806 9.769 -5.448 1.00 0.00 H new ATOM 0 HB3 MET A 21 113.951 10.017 -4.145 1.00 0.00 H new ATOM 0 HG2 MET A 21 113.856 12.529 -4.647 1.00 0.00 H new ATOM 0 HG3 MET A 21 112.565 12.198 -5.784 1.00 0.00 H new ATOM 0 HE1 MET A 21 109.694 10.789 -3.774 1.00 0.00 H new ATOM 0 HE2 MET A 21 110.593 10.838 -5.309 1.00 0.00 H new ATOM 0 HE3 MET A 21 111.020 9.638 -4.065 1.00 0.00 H new ATOM 288 N GLY A 22 116.320 8.794 -5.338 1.00 0.00 N ATOM 289 CA GLY A 22 117.013 7.509 -5.399 1.00 0.00 C ATOM 290 C GLY A 22 117.143 6.905 -4.009 1.00 0.00 C ATOM 291 O GLY A 22 117.463 7.611 -3.055 1.00 0.00 O ATOM 0 H GLY A 22 116.620 9.406 -4.579 1.00 0.00 H new ATOM 0 HA2 GLY A 22 116.467 6.825 -6.049 1.00 0.00 H new ATOM 0 HA3 GLY A 22 118.002 7.643 -5.837 1.00 0.00 H new ATOM 295 N GLY A 23 116.879 5.607 -3.894 1.00 0.00 N ATOM 296 CA GLY A 23 116.957 4.945 -2.596 1.00 0.00 C ATOM 297 C GLY A 23 117.446 3.507 -2.720 1.00 0.00 C ATOM 298 O GLY A 23 117.431 2.923 -3.802 1.00 0.00 O ATOM 0 H GLY A 23 116.613 5.001 -4.670 1.00 0.00 H new ATOM 0 HA2 GLY A 23 117.630 5.502 -1.944 1.00 0.00 H new ATOM 0 HA3 GLY A 23 115.975 4.955 -2.124 1.00 0.00 H new ATOM 302 N PHE A 24 117.855 2.944 -1.588 1.00 0.00 N ATOM 303 CA PHE A 24 118.354 1.572 -1.544 1.00 0.00 C ATOM 304 C PHE A 24 117.606 0.793 -0.470 1.00 0.00 C ATOM 305 O PHE A 24 117.072 1.392 0.463 1.00 0.00 O ATOM 306 CB PHE A 24 119.853 1.568 -1.235 1.00 0.00 C ATOM 307 CG PHE A 24 120.683 2.280 -2.276 1.00 0.00 C ATOM 308 CD1 PHE A 24 120.944 3.649 -2.146 1.00 0.00 C ATOM 309 CD2 PHE A 24 121.192 1.572 -3.371 1.00 0.00 C ATOM 310 CE1 PHE A 24 121.715 4.309 -3.110 1.00 0.00 C ATOM 311 CE2 PHE A 24 121.962 2.232 -4.336 1.00 0.00 C ATOM 312 CZ PHE A 24 122.223 3.601 -4.205 1.00 0.00 C ATOM 0 H PHE A 24 117.851 3.418 -0.685 1.00 0.00 H new ATOM 0 HA PHE A 24 118.192 1.102 -2.514 1.00 0.00 H new ATOM 0 HB2 PHE A 24 120.018 2.039 -0.266 1.00 0.00 H new ATOM 0 HB3 PHE A 24 120.196 0.537 -1.151 1.00 0.00 H new ATOM 0 HD1 PHE A 24 120.551 4.196 -1.302 1.00 0.00 H new ATOM 0 HD2 PHE A 24 120.991 0.516 -3.471 1.00 0.00 H new ATOM 0 HE1 PHE A 24 121.918 5.365 -3.009 1.00 0.00 H new ATOM 0 HE2 PHE A 24 122.354 1.685 -5.181 1.00 0.00 H new ATOM 0 HZ PHE A 24 122.817 4.111 -4.949 1.00 0.00 H new ATOM 322 N ASN A 25 117.562 -0.531 -0.600 1.00 0.00 N ATOM 323 CA ASN A 25 116.835 -1.349 0.368 1.00 0.00 C ATOM 324 C ASN A 25 117.561 -2.657 0.668 1.00 0.00 C ATOM 325 O ASN A 25 118.259 -3.201 -0.189 1.00 0.00 O ATOM 326 CB ASN A 25 115.426 -1.643 -0.159 1.00 0.00 C ATOM 327 CG ASN A 25 115.489 -2.483 -1.432 1.00 0.00 C ATOM 328 OD1 ASN A 25 116.521 -2.521 -2.105 1.00 0.00 O ATOM 329 ND2 ASN A 25 114.441 -3.164 -1.806 1.00 0.00 N ATOM 0 H ASN A 25 118.012 -1.053 -1.352 1.00 0.00 H new ATOM 0 HA ASN A 25 116.773 -0.786 1.299 1.00 0.00 H new ATOM 0 HB2 ASN A 25 114.851 -2.170 0.602 1.00 0.00 H new ATOM 0 HB3 ASN A 25 114.905 -0.707 -0.361 1.00 0.00 H new ATOM 0 HD21 ASN A 25 114.476 -3.728 -2.655 1.00 0.00 H new ATOM 0 HD22 ASN A 25 113.587 -3.133 -1.249 1.00 0.00 H new ATOM 336 N LEU A 26 117.369 -3.148 1.891 1.00 0.00 N ATOM 337 CA LEU A 26 117.914 -4.436 2.308 1.00 0.00 C ATOM 338 C LEU A 26 116.767 -5.324 2.778 1.00 0.00 C ATOM 339 O LEU A 26 115.842 -4.844 3.429 1.00 0.00 O ATOM 340 CB LEU A 26 118.923 -4.247 3.444 1.00 0.00 C ATOM 341 CG LEU A 26 120.031 -3.285 3.007 1.00 0.00 C ATOM 342 CD1 LEU A 26 120.975 -3.028 4.183 1.00 0.00 C ATOM 343 CD2 LEU A 26 120.826 -3.902 1.853 1.00 0.00 C ATOM 0 H LEU A 26 116.835 -2.667 2.615 1.00 0.00 H new ATOM 0 HA LEU A 26 118.427 -4.902 1.467 1.00 0.00 H new ATOM 0 HB2 LEU A 26 118.419 -3.856 4.328 1.00 0.00 H new ATOM 0 HB3 LEU A 26 119.354 -5.209 3.722 1.00 0.00 H new ATOM 0 HG LEU A 26 119.583 -2.347 2.680 1.00 0.00 H new ATOM 0 HD11 LEU A 26 121.764 -2.343 3.873 1.00 0.00 H new ATOM 0 HD12 LEU A 26 120.416 -2.588 5.009 1.00 0.00 H new ATOM 0 HD13 LEU A 26 121.418 -3.970 4.506 1.00 0.00 H new ATOM 0 HD21 LEU A 26 121.613 -3.214 1.545 1.00 0.00 H new ATOM 0 HD22 LEU A 26 121.272 -4.841 2.180 1.00 0.00 H new ATOM 0 HD23 LEU A 26 120.159 -4.090 1.012 1.00 0.00 H new ATOM 355 N LYS A 27 116.836 -6.617 2.473 1.00 0.00 N ATOM 356 CA LYS A 27 115.690 -7.502 2.674 1.00 0.00 C ATOM 357 C LYS A 27 116.060 -8.730 3.500 1.00 0.00 C ATOM 358 O LYS A 27 117.149 -9.286 3.362 1.00 0.00 O ATOM 359 CB LYS A 27 115.161 -7.951 1.310 1.00 0.00 C ATOM 360 CG LYS A 27 114.714 -6.724 0.511 1.00 0.00 C ATOM 361 CD LYS A 27 114.354 -7.142 -0.916 1.00 0.00 C ATOM 362 CE LYS A 27 113.074 -7.978 -0.899 1.00 0.00 C ATOM 363 NZ LYS A 27 112.691 -8.328 -2.296 1.00 0.00 N ATOM 0 H LYS A 27 117.664 -7.073 2.089 1.00 0.00 H new ATOM 0 HA LYS A 27 114.926 -6.949 3.221 1.00 0.00 H new ATOM 0 HB2 LYS A 27 115.936 -8.490 0.766 1.00 0.00 H new ATOM 0 HB3 LYS A 27 114.325 -8.639 1.440 1.00 0.00 H new ATOM 0 HG2 LYS A 27 113.854 -6.258 0.992 1.00 0.00 H new ATOM 0 HG3 LYS A 27 115.510 -5.980 0.493 1.00 0.00 H new ATOM 0 HD2 LYS A 27 114.215 -6.259 -1.540 1.00 0.00 H new ATOM 0 HD3 LYS A 27 115.170 -7.717 -1.354 1.00 0.00 H new ATOM 0 HE2 LYS A 27 113.227 -8.885 -0.314 1.00 0.00 H new ATOM 0 HE3 LYS A 27 112.270 -7.421 -0.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 111.820 -8.897 -2.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 112.529 -7.457 -2.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 113.456 -8.875 -2.739 1.00 0.00 H new ATOM 377 N TYR A 28 115.131 -9.141 4.359 1.00 0.00 N ATOM 378 CA TYR A 28 115.292 -10.357 5.150 1.00 0.00 C ATOM 379 C TYR A 28 114.136 -11.313 4.868 1.00 0.00 C ATOM 380 O TYR A 28 112.991 -10.878 4.737 1.00 0.00 O ATOM 381 CB TYR A 28 115.322 -10.012 6.640 1.00 0.00 C ATOM 382 CG TYR A 28 116.442 -9.070 7.015 1.00 0.00 C ATOM 383 CD1 TYR A 28 117.737 -9.565 7.209 1.00 0.00 C ATOM 384 CD2 TYR A 28 116.186 -7.702 7.167 1.00 0.00 C ATOM 385 CE1 TYR A 28 118.775 -8.691 7.557 1.00 0.00 C ATOM 386 CE2 TYR A 28 117.223 -6.829 7.514 1.00 0.00 C ATOM 387 CZ TYR A 28 118.518 -7.323 7.710 1.00 0.00 C ATOM 388 OH TYR A 28 119.542 -6.464 8.052 1.00 0.00 O ATOM 0 H TYR A 28 114.255 -8.647 4.525 1.00 0.00 H new ATOM 0 HA TYR A 28 116.232 -10.836 4.876 1.00 0.00 H new ATOM 0 HB2 TYR A 28 114.370 -9.562 6.921 1.00 0.00 H new ATOM 0 HB3 TYR A 28 115.422 -10.932 7.216 1.00 0.00 H new ATOM 0 HD1 TYR A 28 117.936 -10.620 7.090 1.00 0.00 H new ATOM 0 HD2 TYR A 28 115.187 -7.320 7.016 1.00 0.00 H new ATOM 0 HE1 TYR A 28 119.774 -9.073 7.707 1.00 0.00 H new ATOM 0 HE2 TYR A 28 117.024 -5.774 7.631 1.00 0.00 H new ATOM 0 HH TYR A 28 119.194 -5.550 8.117 1.00 0.00 H new ATOM 398 N ARG A 29 114.444 -12.605 4.756 1.00 0.00 N ATOM 399 CA ARG A 29 113.430 -13.610 4.444 1.00 0.00 C ATOM 400 C ARG A 29 113.535 -14.807 5.388 1.00 0.00 C ATOM 401 O ARG A 29 114.635 -15.246 5.723 1.00 0.00 O ATOM 402 CB ARG A 29 113.598 -14.083 2.998 1.00 0.00 C ATOM 403 CG ARG A 29 112.445 -15.018 2.623 1.00 0.00 C ATOM 404 CD ARG A 29 112.650 -15.536 1.198 1.00 0.00 C ATOM 405 NE ARG A 29 111.496 -16.335 0.779 1.00 0.00 N ATOM 406 CZ ARG A 29 111.254 -16.674 -0.497 1.00 0.00 C ATOM 407 NH1 ARG A 29 112.042 -16.310 -1.480 1.00 0.00 N ATOM 408 NH2 ARG A 29 110.197 -17.389 -0.770 1.00 0.00 N ATOM 0 H ARG A 29 115.385 -12.979 4.876 1.00 0.00 H new ATOM 0 HA ARG A 29 112.448 -13.154 4.572 1.00 0.00 H new ATOM 0 HB2 ARG A 29 113.617 -13.226 2.325 1.00 0.00 H new ATOM 0 HB3 ARG A 29 114.550 -14.600 2.883 1.00 0.00 H new ATOM 0 HG2 ARG A 29 112.398 -15.853 3.322 1.00 0.00 H new ATOM 0 HG3 ARG A 29 111.495 -14.488 2.696 1.00 0.00 H new ATOM 0 HD2 ARG A 29 112.788 -14.698 0.515 1.00 0.00 H new ATOM 0 HD3 ARG A 29 113.556 -16.140 1.150 1.00 0.00 H new ATOM 0 HE ARG A 29 110.842 -16.651 1.495 1.00 0.00 H new ATOM 0 HH11 ARG A 29 112.872 -15.750 -1.287 1.00 0.00 H new ATOM 0 HH12 ARG A 29 111.825 -16.587 -2.437 1.00 0.00 H new ATOM 0 HH21 ARG A 29 109.571 -17.681 -0.020 1.00 0.00 H new ATOM 0 HH22 ARG A 29 109.997 -17.656 -1.734 1.00 0.00 H new ATOM 422 N TYR A 30 112.386 -15.331 5.812 1.00 0.00 N ATOM 423 CA TYR A 30 112.359 -16.475 6.723 1.00 0.00 C ATOM 424 C TYR A 30 111.521 -17.607 6.134 1.00 0.00 C ATOM 425 O TYR A 30 110.489 -17.365 5.506 1.00 0.00 O ATOM 426 CB TYR A 30 111.773 -16.057 8.073 1.00 0.00 C ATOM 427 CG TYR A 30 111.937 -17.107 9.145 1.00 0.00 C ATOM 428 CD1 TYR A 30 113.081 -17.106 9.952 1.00 0.00 C ATOM 429 CD2 TYR A 30 110.948 -18.081 9.333 1.00 0.00 C ATOM 430 CE1 TYR A 30 113.237 -18.078 10.947 1.00 0.00 C ATOM 431 CE2 TYR A 30 111.104 -19.053 10.328 1.00 0.00 C ATOM 432 CZ TYR A 30 112.249 -19.053 11.135 1.00 0.00 C ATOM 433 OH TYR A 30 112.402 -20.012 12.115 1.00 0.00 O ATOM 0 H TYR A 30 111.466 -14.984 5.541 1.00 0.00 H new ATOM 0 HA TYR A 30 113.381 -16.826 6.864 1.00 0.00 H new ATOM 0 HB2 TYR A 30 112.254 -15.135 8.400 1.00 0.00 H new ATOM 0 HB3 TYR A 30 110.713 -15.837 7.949 1.00 0.00 H new ATOM 0 HD1 TYR A 30 113.843 -16.355 9.807 1.00 0.00 H new ATOM 0 HD2 TYR A 30 110.065 -18.082 8.710 1.00 0.00 H new ATOM 0 HE1 TYR A 30 114.119 -18.076 11.570 1.00 0.00 H new ATOM 0 HE2 TYR A 30 110.341 -19.803 10.474 1.00 0.00 H new ATOM 0 HH TYR A 30 111.626 -20.610 12.112 1.00 0.00 H new ATOM 443 N GLU A 31 111.968 -18.845 6.339 1.00 0.00 N ATOM 444 CA GLU A 31 111.290 -20.008 5.766 1.00 0.00 C ATOM 445 C GLU A 31 110.872 -20.991 6.860 1.00 0.00 C ATOM 446 O GLU A 31 111.573 -21.153 7.859 1.00 0.00 O ATOM 447 CB GLU A 31 112.235 -20.709 4.788 1.00 0.00 C ATOM 448 CG GLU A 31 111.461 -21.752 3.975 1.00 0.00 C ATOM 449 CD GLU A 31 110.513 -21.075 2.983 1.00 0.00 C ATOM 450 OE1 GLU A 31 110.777 -19.947 2.595 1.00 0.00 O ATOM 451 OE2 GLU A 31 109.532 -21.701 2.622 1.00 0.00 O ATOM 0 H GLU A 31 112.793 -19.069 6.895 1.00 0.00 H new ATOM 0 HA GLU A 31 110.394 -19.668 5.247 1.00 0.00 H new ATOM 0 HB2 GLU A 31 112.689 -19.978 4.120 1.00 0.00 H new ATOM 0 HB3 GLU A 31 113.047 -21.189 5.334 1.00 0.00 H new ATOM 0 HG2 GLU A 31 112.160 -22.392 3.437 1.00 0.00 H new ATOM 0 HG3 GLU A 31 110.893 -22.395 4.647 1.00 0.00 H new ATOM 458 N GLU A 32 109.728 -21.645 6.667 1.00 0.00 N ATOM 459 CA GLU A 32 109.260 -22.653 7.615 1.00 0.00 C ATOM 460 C GLU A 32 109.565 -24.054 7.089 1.00 0.00 C ATOM 461 O GLU A 32 109.456 -24.311 5.891 1.00 0.00 O ATOM 462 CB GLU A 32 107.754 -22.508 7.840 1.00 0.00 C ATOM 463 CG GLU A 32 107.446 -21.124 8.423 1.00 0.00 C ATOM 464 CD GLU A 32 108.106 -20.930 9.791 1.00 0.00 C ATOM 465 OE1 GLU A 32 108.496 -21.911 10.407 1.00 0.00 O ATOM 466 OE2 GLU A 32 108.207 -19.788 10.209 1.00 0.00 O ATOM 0 H GLU A 32 109.112 -21.496 5.868 1.00 0.00 H new ATOM 0 HA GLU A 32 109.780 -22.505 8.562 1.00 0.00 H new ATOM 0 HB2 GLU A 32 107.222 -22.642 6.898 1.00 0.00 H new ATOM 0 HB3 GLU A 32 107.402 -23.285 8.519 1.00 0.00 H new ATOM 0 HG2 GLU A 32 107.796 -20.353 7.737 1.00 0.00 H new ATOM 0 HG3 GLU A 32 106.367 -21.000 8.518 1.00 0.00 H new ATOM 473 N ASP A 33 109.947 -24.956 7.989 1.00 0.00 N ATOM 474 CA ASP A 33 110.392 -26.285 7.581 1.00 0.00 C ATOM 475 C ASP A 33 109.243 -27.186 7.128 1.00 0.00 C ATOM 476 O ASP A 33 109.354 -27.857 6.101 1.00 0.00 O ATOM 477 CB ASP A 33 111.129 -26.957 8.743 1.00 0.00 C ATOM 478 CG ASP A 33 112.382 -26.166 9.107 1.00 0.00 C ATOM 479 OD1 ASP A 33 112.974 -25.576 8.217 1.00 0.00 O ATOM 480 OD2 ASP A 33 112.734 -26.161 10.276 1.00 0.00 O ATOM 0 H ASP A 33 109.958 -24.794 8.996 1.00 0.00 H new ATOM 0 HA ASP A 33 111.055 -26.149 6.726 1.00 0.00 H new ATOM 0 HB2 ASP A 33 110.470 -27.026 9.609 1.00 0.00 H new ATOM 0 HB3 ASP A 33 111.402 -27.976 8.468 1.00 0.00 H new ATOM 485 N ASN A 34 108.144 -27.209 7.881 1.00 0.00 N ATOM 486 CA ASN A 34 107.045 -28.134 7.580 1.00 0.00 C ATOM 487 C ASN A 34 105.839 -27.462 6.915 1.00 0.00 C ATOM 488 O ASN A 34 104.962 -28.149 6.392 1.00 0.00 O ATOM 489 CB ASN A 34 106.584 -28.808 8.874 1.00 0.00 C ATOM 490 CG ASN A 34 107.752 -29.531 9.534 1.00 0.00 C ATOM 491 OD1 ASN A 34 107.961 -29.403 10.740 1.00 0.00 O ATOM 492 ND2 ASN A 34 108.531 -30.288 8.811 1.00 0.00 N ATOM 0 H ASN A 34 107.989 -26.610 8.692 1.00 0.00 H new ATOM 0 HA ASN A 34 107.437 -28.860 6.868 1.00 0.00 H new ATOM 0 HB2 ASN A 34 106.176 -28.062 9.556 1.00 0.00 H new ATOM 0 HB3 ASN A 34 105.783 -29.515 8.659 1.00 0.00 H new ATOM 0 HD21 ASN A 34 109.315 -30.775 9.245 1.00 0.00 H new ATOM 0 HD22 ASN A 34 108.356 -30.393 7.812 1.00 0.00 H new ATOM 499 N SER A 35 105.785 -26.133 6.929 1.00 0.00 N ATOM 500 CA SER A 35 104.696 -25.409 6.283 1.00 0.00 C ATOM 501 C SER A 35 105.220 -24.082 5.735 1.00 0.00 C ATOM 502 O SER A 35 105.036 -23.038 6.367 1.00 0.00 O ATOM 503 CB SER A 35 103.564 -25.165 7.285 1.00 0.00 C ATOM 504 OG SER A 35 103.016 -26.415 7.684 1.00 0.00 O ATOM 0 H SER A 35 106.480 -25.538 7.379 1.00 0.00 H new ATOM 0 HA SER A 35 104.304 -26.003 5.457 1.00 0.00 H new ATOM 0 HB2 SER A 35 103.941 -24.626 8.154 1.00 0.00 H new ATOM 0 HB3 SER A 35 102.791 -24.543 6.834 1.00 0.00 H new ATOM 0 HG SER A 35 102.292 -26.264 8.327 1.00 0.00 H new ATOM 510 N PRO A 36 105.853 -24.081 4.581 1.00 0.00 N ATOM 511 CA PRO A 36 106.609 -22.875 4.126 1.00 0.00 C ATOM 512 C PRO A 36 105.718 -21.643 3.990 1.00 0.00 C ATOM 513 O PRO A 36 104.625 -21.701 3.427 1.00 0.00 O ATOM 514 CB PRO A 36 107.196 -23.283 2.769 1.00 0.00 C ATOM 515 CG PRO A 36 106.384 -24.446 2.310 1.00 0.00 C ATOM 516 CD PRO A 36 105.912 -25.158 3.575 1.00 0.00 C ATOM 0 HA PRO A 36 107.372 -22.588 4.849 1.00 0.00 H new ATOM 0 HB2 PRO A 36 107.140 -22.461 2.055 1.00 0.00 H new ATOM 0 HB3 PRO A 36 108.248 -23.553 2.863 1.00 0.00 H new ATOM 0 HG2 PRO A 36 105.537 -24.117 1.709 1.00 0.00 H new ATOM 0 HG3 PRO A 36 106.978 -25.114 1.685 1.00 0.00 H new ATOM 0 HD2 PRO A 36 104.938 -25.626 3.431 1.00 0.00 H new ATOM 0 HD3 PRO A 36 106.603 -25.946 3.872 1.00 0.00 H new ATOM 524 N LEU A 37 106.219 -20.531 4.517 1.00 0.00 N ATOM 525 CA LEU A 37 105.597 -19.226 4.334 1.00 0.00 C ATOM 526 C LEU A 37 106.640 -18.262 3.787 1.00 0.00 C ATOM 527 O LEU A 37 107.767 -18.246 4.286 1.00 0.00 O ATOM 528 CB LEU A 37 105.057 -18.704 5.669 1.00 0.00 C ATOM 529 CG LEU A 37 104.059 -19.707 6.254 1.00 0.00 C ATOM 530 CD1 LEU A 37 103.624 -19.239 7.644 1.00 0.00 C ATOM 531 CD2 LEU A 37 102.831 -19.795 5.345 1.00 0.00 C ATOM 0 H LEU A 37 107.067 -20.510 5.083 1.00 0.00 H new ATOM 0 HA LEU A 37 104.765 -19.312 3.635 1.00 0.00 H new ATOM 0 HB2 LEU A 37 105.879 -18.546 6.367 1.00 0.00 H new ATOM 0 HB3 LEU A 37 104.573 -17.738 5.523 1.00 0.00 H new ATOM 0 HG LEU A 37 104.531 -20.687 6.327 1.00 0.00 H new ATOM 0 HD11 LEU A 37 102.913 -19.952 8.062 1.00 0.00 H new ATOM 0 HD12 LEU A 37 104.496 -19.172 8.295 1.00 0.00 H new ATOM 0 HD13 LEU A 37 103.152 -18.259 7.567 1.00 0.00 H new ATOM 0 HD21 LEU A 37 102.120 -20.509 5.761 1.00 0.00 H new ATOM 0 HD22 LEU A 37 102.360 -18.814 5.273 1.00 0.00 H new ATOM 0 HD23 LEU A 37 103.136 -20.124 4.352 1.00 0.00 H new ATOM 543 N GLY A 38 106.286 -17.465 2.780 1.00 0.00 N ATOM 544 CA GLY A 38 107.243 -16.514 2.229 1.00 0.00 C ATOM 545 C GLY A 38 107.037 -15.155 2.874 1.00 0.00 C ATOM 546 O GLY A 38 105.978 -14.550 2.729 1.00 0.00 O ATOM 0 H GLY A 38 105.366 -17.459 2.339 1.00 0.00 H new ATOM 0 HA2 GLY A 38 108.261 -16.862 2.407 1.00 0.00 H new ATOM 0 HA3 GLY A 38 107.116 -16.439 1.149 1.00 0.00 H new ATOM 550 N VAL A 39 108.046 -14.674 3.595 1.00 0.00 N ATOM 551 CA VAL A 39 107.952 -13.367 4.235 1.00 0.00 C ATOM 552 C VAL A 39 109.123 -12.499 3.809 1.00 0.00 C ATOM 553 O VAL A 39 110.275 -12.926 3.850 1.00 0.00 O ATOM 554 CB VAL A 39 107.955 -13.527 5.759 1.00 0.00 C ATOM 555 CG1 VAL A 39 106.725 -14.327 6.189 1.00 0.00 C ATOM 556 CG2 VAL A 39 109.220 -14.268 6.202 1.00 0.00 C ATOM 0 H VAL A 39 108.928 -15.163 3.749 1.00 0.00 H new ATOM 0 HA VAL A 39 107.021 -12.890 3.929 1.00 0.00 H new ATOM 0 HB VAL A 39 107.934 -12.541 6.222 1.00 0.00 H new ATOM 0 HG11 VAL A 39 106.726 -14.441 7.273 1.00 0.00 H new ATOM 0 HG12 VAL A 39 105.822 -13.800 5.881 1.00 0.00 H new ATOM 0 HG13 VAL A 39 106.749 -15.311 5.720 1.00 0.00 H new ATOM 0 HG21 VAL A 39 109.216 -14.378 7.286 1.00 0.00 H new ATOM 0 HG22 VAL A 39 109.246 -15.253 5.737 1.00 0.00 H new ATOM 0 HG23 VAL A 39 110.099 -13.700 5.898 1.00 0.00 H new ATOM 566 N ILE A 40 108.817 -11.278 3.390 1.00 0.00 N ATOM 567 CA ILE A 40 109.853 -10.322 3.018 1.00 0.00 C ATOM 568 C ILE A 40 109.646 -9.027 3.790 1.00 0.00 C ATOM 569 O ILE A 40 108.531 -8.510 3.853 1.00 0.00 O ATOM 570 CB ILE A 40 109.795 -10.049 1.509 1.00 0.00 C ATOM 571 CG1 ILE A 40 109.949 -11.363 0.739 1.00 0.00 C ATOM 572 CG2 ILE A 40 110.926 -9.100 1.106 1.00 0.00 C ATOM 573 CD1 ILE A 40 109.713 -11.115 -0.753 1.00 0.00 C ATOM 0 H ILE A 40 107.864 -10.927 3.299 1.00 0.00 H new ATOM 0 HA ILE A 40 110.832 -10.735 3.262 1.00 0.00 H new ATOM 0 HB ILE A 40 108.834 -9.593 1.271 1.00 0.00 H new ATOM 0 HG12 ILE A 40 110.946 -11.774 0.896 1.00 0.00 H new ATOM 0 HG13 ILE A 40 109.238 -12.100 1.112 1.00 0.00 H new ATOM 0 HG21 ILE A 40 110.878 -8.911 0.034 1.00 0.00 H new ATOM 0 HG22 ILE A 40 110.821 -8.159 1.645 1.00 0.00 H new ATOM 0 HG23 ILE A 40 111.886 -9.553 1.352 1.00 0.00 H new ATOM 0 HD11 ILE A 40 109.823 -12.052 -1.299 1.00 0.00 H new ATOM 0 HD12 ILE A 40 108.707 -10.724 -0.902 1.00 0.00 H new ATOM 0 HD13 ILE A 40 110.441 -10.392 -1.121 1.00 0.00 H new ATOM 585 N GLY A 41 110.718 -8.532 4.398 1.00 0.00 N ATOM 586 CA GLY A 41 110.695 -7.215 5.027 1.00 0.00 C ATOM 587 C GLY A 41 111.853 -6.382 4.499 1.00 0.00 C ATOM 588 O GLY A 41 112.991 -6.849 4.477 1.00 0.00 O ATOM 0 H GLY A 41 111.611 -9.020 4.469 1.00 0.00 H new ATOM 0 HA2 GLY A 41 109.749 -6.716 4.817 1.00 0.00 H new ATOM 0 HA3 GLY A 41 110.769 -7.316 6.110 1.00 0.00 H new ATOM 592 N SER A 42 111.560 -5.159 4.060 1.00 0.00 N ATOM 593 CA SER A 42 112.585 -4.301 3.471 1.00 0.00 C ATOM 594 C SER A 42 112.603 -2.927 4.133 1.00 0.00 C ATOM 595 O SER A 42 111.555 -2.335 4.389 1.00 0.00 O ATOM 596 CB SER A 42 112.333 -4.138 1.971 1.00 0.00 C ATOM 597 OG SER A 42 111.252 -3.239 1.771 1.00 0.00 O ATOM 0 H SER A 42 110.629 -4.743 4.101 1.00 0.00 H new ATOM 0 HA SER A 42 113.552 -4.776 3.633 1.00 0.00 H new ATOM 0 HB2 SER A 42 113.230 -3.762 1.479 1.00 0.00 H new ATOM 0 HB3 SER A 42 112.105 -5.105 1.522 1.00 0.00 H new ATOM 0 HG SER A 42 110.411 -3.741 1.738 1.00 0.00 H new ATOM 603 N PHE A 43 113.805 -2.426 4.403 1.00 0.00 N ATOM 604 CA PHE A 43 113.963 -1.070 4.914 1.00 0.00 C ATOM 605 C PHE A 43 114.526 -0.193 3.804 1.00 0.00 C ATOM 606 O PHE A 43 115.589 -0.490 3.260 1.00 0.00 O ATOM 607 CB PHE A 43 114.920 -1.070 6.107 1.00 0.00 C ATOM 608 CG PHE A 43 114.442 -1.918 7.262 1.00 0.00 C ATOM 609 CD1 PHE A 43 113.586 -1.373 8.225 1.00 0.00 C ATOM 610 CD2 PHE A 43 114.854 -3.253 7.368 1.00 0.00 C ATOM 611 CE1 PHE A 43 113.142 -2.159 9.294 1.00 0.00 C ATOM 612 CE2 PHE A 43 114.410 -4.040 8.437 1.00 0.00 C ATOM 613 CZ PHE A 43 113.554 -3.493 9.400 1.00 0.00 C ATOM 0 H PHE A 43 114.679 -2.936 4.277 1.00 0.00 H new ATOM 0 HA PHE A 43 112.997 -0.684 5.240 1.00 0.00 H new ATOM 0 HB2 PHE A 43 115.895 -1.431 5.780 1.00 0.00 H new ATOM 0 HB3 PHE A 43 115.059 -0.045 6.452 1.00 0.00 H new ATOM 0 HD1 PHE A 43 113.267 -0.344 8.143 1.00 0.00 H new ATOM 0 HD2 PHE A 43 115.514 -3.675 6.625 1.00 0.00 H new ATOM 0 HE1 PHE A 43 112.482 -1.737 10.037 1.00 0.00 H new ATOM 0 HE2 PHE A 43 114.728 -5.069 8.519 1.00 0.00 H new ATOM 0 HZ PHE A 43 113.211 -4.100 10.225 1.00 0.00 H new ATOM 623 N THR A 44 113.828 0.891 3.470 1.00 0.00 N ATOM 624 CA THR A 44 114.217 1.708 2.321 1.00 0.00 C ATOM 625 C THR A 44 114.594 3.117 2.755 1.00 0.00 C ATOM 626 O THR A 44 113.896 3.734 3.560 1.00 0.00 O ATOM 627 CB THR A 44 113.057 1.776 1.325 1.00 0.00 C ATOM 628 OG1 THR A 44 112.630 0.460 1.007 1.00 0.00 O ATOM 629 CG2 THR A 44 113.516 2.486 0.048 1.00 0.00 C ATOM 0 H THR A 44 113.002 1.221 3.970 1.00 0.00 H new ATOM 0 HA THR A 44 115.086 1.247 1.851 1.00 0.00 H new ATOM 0 HB THR A 44 112.231 2.331 1.769 1.00 0.00 H new ATOM 0 HG1 THR A 44 111.886 0.502 0.371 1.00 0.00 H new ATOM 0 HG21 THR A 44 112.688 2.533 -0.660 1.00 0.00 H new ATOM 0 HG22 THR A 44 113.843 3.497 0.291 1.00 0.00 H new ATOM 0 HG23 THR A 44 114.343 1.934 -0.398 1.00 0.00 H new ATOM 637 N TYR A 45 115.701 3.613 2.208 1.00 0.00 N ATOM 638 CA TYR A 45 116.126 4.987 2.447 1.00 0.00 C ATOM 639 C TYR A 45 116.237 5.711 1.113 1.00 0.00 C ATOM 640 O TYR A 45 116.940 5.250 0.215 1.00 0.00 O ATOM 641 CB TYR A 45 117.481 5.004 3.155 1.00 0.00 C ATOM 642 CG TYR A 45 117.469 4.314 4.499 1.00 0.00 C ATOM 643 CD1 TYR A 45 117.757 2.946 4.586 1.00 0.00 C ATOM 644 CD2 TYR A 45 117.172 5.041 5.657 1.00 0.00 C ATOM 645 CE1 TYR A 45 117.748 2.306 5.831 1.00 0.00 C ATOM 646 CE2 TYR A 45 117.162 4.402 6.903 1.00 0.00 C ATOM 647 CZ TYR A 45 117.451 3.034 6.990 1.00 0.00 C ATOM 648 OH TYR A 45 117.443 2.404 8.218 1.00 0.00 O ATOM 0 H TYR A 45 116.320 3.082 1.595 1.00 0.00 H new ATOM 0 HA TYR A 45 115.393 5.487 3.081 1.00 0.00 H new ATOM 0 HB2 TYR A 45 118.222 4.524 2.516 1.00 0.00 H new ATOM 0 HB3 TYR A 45 117.799 6.038 3.289 1.00 0.00 H new ATOM 0 HD1 TYR A 45 117.986 2.385 3.692 1.00 0.00 H new ATOM 0 HD2 TYR A 45 116.950 6.096 5.590 1.00 0.00 H new ATOM 0 HE1 TYR A 45 117.970 1.251 5.898 1.00 0.00 H new ATOM 0 HE2 TYR A 45 116.932 4.963 7.796 1.00 0.00 H new ATOM 0 HH TYR A 45 116.518 2.294 8.523 1.00 0.00 H new ATOM 658 N THR A 46 115.533 6.832 0.987 1.00 0.00 N ATOM 659 CA THR A 46 115.520 7.595 -0.260 1.00 0.00 C ATOM 660 C THR A 46 115.991 9.024 -0.015 1.00 0.00 C ATOM 661 O THR A 46 115.649 9.631 1.001 1.00 0.00 O ATOM 662 CB THR A 46 114.102 7.616 -0.838 1.00 0.00 C ATOM 663 OG1 THR A 46 113.625 6.284 -0.963 1.00 0.00 O ATOM 664 CG2 THR A 46 114.120 8.283 -2.214 1.00 0.00 C ATOM 0 H THR A 46 114.964 7.233 1.732 1.00 0.00 H new ATOM 0 HA THR A 46 116.197 7.117 -0.968 1.00 0.00 H new ATOM 0 HB THR A 46 113.446 8.178 -0.173 1.00 0.00 H new ATOM 0 HG1 THR A 46 112.717 6.295 -1.331 1.00 0.00 H new ATOM 0 HG21 THR A 46 113.110 8.297 -2.625 1.00 0.00 H new ATOM 0 HG22 THR A 46 114.487 9.305 -2.118 1.00 0.00 H new ATOM 0 HG23 THR A 46 114.775 7.723 -2.881 1.00 0.00 H new ATOM 672 N GLU A 47 116.754 9.558 -0.965 1.00 0.00 N ATOM 673 CA GLU A 47 117.339 10.886 -0.822 1.00 0.00 C ATOM 674 C GLU A 47 117.033 11.736 -2.050 1.00 0.00 C ATOM 675 O GLU A 47 116.935 11.218 -3.164 1.00 0.00 O ATOM 676 CB GLU A 47 118.854 10.762 -0.648 1.00 0.00 C ATOM 677 CG GLU A 47 119.455 12.133 -0.318 1.00 0.00 C ATOM 678 CD GLU A 47 120.985 12.079 -0.219 1.00 0.00 C ATOM 679 OE1 GLU A 47 121.563 11.022 -0.429 1.00 0.00 O ATOM 680 OE2 GLU A 47 121.564 13.113 0.069 1.00 0.00 O ATOM 0 H GLU A 47 116.981 9.090 -1.842 1.00 0.00 H new ATOM 0 HA GLU A 47 116.908 11.368 0.055 1.00 0.00 H new ATOM 0 HB2 GLU A 47 119.081 10.054 0.150 1.00 0.00 H new ATOM 0 HB3 GLU A 47 119.303 10.369 -1.560 1.00 0.00 H new ATOM 0 HG2 GLU A 47 119.166 12.850 -1.086 1.00 0.00 H new ATOM 0 HG3 GLU A 47 119.043 12.492 0.625 1.00 0.00 H new ATOM 687 N LYS A 48 116.860 13.034 -1.825 1.00 0.00 N ATOM 688 CA LYS A 48 116.606 13.975 -2.909 1.00 0.00 C ATOM 689 C LYS A 48 117.884 14.731 -3.261 1.00 0.00 C ATOM 690 O LYS A 48 118.634 15.141 -2.375 1.00 0.00 O ATOM 691 CB LYS A 48 115.519 14.968 -2.495 1.00 0.00 C ATOM 692 CG LYS A 48 115.139 15.841 -3.692 1.00 0.00 C ATOM 693 CD LYS A 48 114.113 16.889 -3.254 1.00 0.00 C ATOM 694 CE LYS A 48 113.615 17.660 -4.478 1.00 0.00 C ATOM 695 NZ LYS A 48 114.765 18.337 -5.141 1.00 0.00 N ATOM 0 H LYS A 48 116.891 13.459 -0.898 1.00 0.00 H new ATOM 0 HA LYS A 48 116.270 13.418 -3.784 1.00 0.00 H new ATOM 0 HB2 LYS A 48 114.643 14.432 -2.130 1.00 0.00 H new ATOM 0 HB3 LYS A 48 115.875 15.592 -1.675 1.00 0.00 H new ATOM 0 HG2 LYS A 48 116.026 16.331 -4.095 1.00 0.00 H new ATOM 0 HG3 LYS A 48 114.726 15.223 -4.490 1.00 0.00 H new ATOM 0 HD2 LYS A 48 113.276 16.405 -2.751 1.00 0.00 H new ATOM 0 HD3 LYS A 48 114.563 17.576 -2.537 1.00 0.00 H new ATOM 0 HE2 LYS A 48 113.128 16.979 -5.176 1.00 0.00 H new ATOM 0 HE3 LYS A 48 112.869 18.396 -4.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 114.410 19.018 -5.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 115.331 18.839 -4.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 115.358 17.628 -5.617 1.00 0.00 H new ATOM 709 N SER A 49 118.129 14.910 -4.556 1.00 0.00 N ATOM 710 CA SER A 49 119.335 15.599 -5.001 1.00 0.00 C ATOM 711 C SER A 49 119.096 17.103 -5.074 1.00 0.00 C ATOM 712 O SER A 49 118.053 17.557 -5.542 1.00 0.00 O ATOM 713 CB SER A 49 119.754 15.081 -6.377 1.00 0.00 C ATOM 714 OG SER A 49 120.995 15.671 -6.742 1.00 0.00 O ATOM 0 H SER A 49 117.517 14.592 -5.307 1.00 0.00 H new ATOM 0 HA SER A 49 120.130 15.403 -4.281 1.00 0.00 H new ATOM 0 HB2 SER A 49 119.846 13.995 -6.357 1.00 0.00 H new ATOM 0 HB3 SER A 49 118.991 15.323 -7.117 1.00 0.00 H new ATOM 0 HG SER A 49 121.268 15.340 -7.623 1.00 0.00 H new ATOM 720 N ARG A 50 120.075 17.871 -4.605 1.00 0.00 N ATOM 721 CA ARG A 50 119.952 19.324 -4.573 1.00 0.00 C ATOM 722 C ARG A 50 119.991 19.909 -5.981 1.00 0.00 C ATOM 723 O ARG A 50 120.715 19.420 -6.848 1.00 0.00 O ATOM 724 CB ARG A 50 121.090 19.922 -3.742 1.00 0.00 C ATOM 725 CG ARG A 50 120.974 19.441 -2.295 1.00 0.00 C ATOM 726 CD ARG A 50 122.107 20.047 -1.464 1.00 0.00 C ATOM 727 NE ARG A 50 121.909 21.492 -1.313 1.00 0.00 N ATOM 728 CZ ARG A 50 122.915 22.360 -1.127 1.00 0.00 C ATOM 729 NH1 ARG A 50 124.168 21.977 -1.059 1.00 0.00 N ATOM 730 NH2 ARG A 50 122.637 23.629 -1.007 1.00 0.00 N ATOM 0 H ARG A 50 120.959 17.513 -4.243 1.00 0.00 H new ATOM 0 HA ARG A 50 118.992 19.574 -4.121 1.00 0.00 H new ATOM 0 HB2 ARG A 50 122.053 19.626 -4.158 1.00 0.00 H new ATOM 0 HB3 ARG A 50 121.048 21.011 -3.779 1.00 0.00 H new ATOM 0 HG2 ARG A 50 120.009 19.731 -1.880 1.00 0.00 H new ATOM 0 HG3 ARG A 50 121.023 18.353 -2.257 1.00 0.00 H new ATOM 0 HD2 ARG A 50 122.142 19.573 -0.483 1.00 0.00 H new ATOM 0 HD3 ARG A 50 123.065 19.852 -1.946 1.00 0.00 H new ATOM 0 HE ARG A 50 120.957 21.856 -1.351 1.00 0.00 H new ATOM 0 HH11 ARG A 50 124.405 20.989 -1.149 1.00 0.00 H new ATOM 0 HH12 ARG A 50 124.905 22.667 -0.917 1.00 0.00 H new ATOM 0 HH21 ARG A 50 121.669 23.946 -1.055 1.00 0.00 H new ATOM 0 HH22 ARG A 50 123.388 24.304 -0.865 1.00 0.00 H new ATOM 744 N THR A 51 119.205 20.960 -6.198 1.00 0.00 N ATOM 745 CA THR A 51 119.186 21.650 -7.485 1.00 0.00 C ATOM 746 C THR A 51 119.414 23.144 -7.282 1.00 0.00 C ATOM 747 O THR A 51 119.018 23.707 -6.262 1.00 0.00 O ATOM 748 CB THR A 51 117.841 21.427 -8.182 1.00 0.00 C ATOM 749 OG1 THR A 51 116.803 21.992 -7.394 1.00 0.00 O ATOM 750 CG2 THR A 51 117.594 19.929 -8.364 1.00 0.00 C ATOM 0 H THR A 51 118.573 21.352 -5.500 1.00 0.00 H new ATOM 0 HA THR A 51 119.984 21.247 -8.108 1.00 0.00 H new ATOM 0 HB THR A 51 117.856 21.906 -9.161 1.00 0.00 H new ATOM 0 HG1 THR A 51 115.941 21.852 -7.839 1.00 0.00 H new ATOM 0 HG21 THR A 51 116.636 19.776 -8.860 1.00 0.00 H new ATOM 0 HG22 THR A 51 118.390 19.500 -8.972 1.00 0.00 H new ATOM 0 HG23 THR A 51 117.580 19.442 -7.389 1.00 0.00 H new ATOM 758 N ALA A 52 120.054 23.783 -8.257 1.00 0.00 N ATOM 759 CA ALA A 52 120.332 25.213 -8.165 1.00 0.00 C ATOM 760 C ALA A 52 119.332 26.010 -8.995 1.00 0.00 C ATOM 761 O ALA A 52 119.176 25.772 -10.193 1.00 0.00 O ATOM 762 CB ALA A 52 121.751 25.499 -8.660 1.00 0.00 C ATOM 0 H ALA A 52 120.387 23.338 -9.112 1.00 0.00 H new ATOM 0 HA ALA A 52 120.241 25.515 -7.122 1.00 0.00 H new ATOM 0 HB1 ALA A 52 121.953 26.568 -8.589 1.00 0.00 H new ATOM 0 HB2 ALA A 52 122.467 24.953 -8.046 1.00 0.00 H new ATOM 0 HB3 ALA A 52 121.845 25.180 -9.698 1.00 0.00 H new ATOM 768 N SER A 53 118.659 26.960 -8.352 1.00 0.00 N ATOM 769 CA SER A 53 117.700 27.815 -9.044 1.00 0.00 C ATOM 770 C SER A 53 117.073 28.810 -8.068 1.00 0.00 C ATOM 771 O SER A 53 117.341 30.010 -8.136 1.00 0.00 O ATOM 772 CB SER A 53 116.603 26.969 -9.695 1.00 0.00 C ATOM 773 OG SER A 53 116.126 26.018 -8.752 1.00 0.00 O ATOM 0 H SER A 53 118.760 27.157 -7.356 1.00 0.00 H new ATOM 0 HA SER A 53 118.231 28.366 -9.821 1.00 0.00 H new ATOM 0 HB2 SER A 53 115.786 27.607 -10.031 1.00 0.00 H new ATOM 0 HB3 SER A 53 116.994 26.461 -10.577 1.00 0.00 H new ATOM 0 HG SER A 53 115.194 26.220 -8.527 1.00 0.00 H new ATOM 779 N SER A 54 116.238 28.306 -7.163 1.00 0.00 N ATOM 780 CA SER A 54 115.587 29.159 -6.174 1.00 0.00 C ATOM 781 C SER A 54 116.611 29.852 -5.279 1.00 0.00 C ATOM 782 O SER A 54 116.427 31.005 -4.891 1.00 0.00 O ATOM 783 CB SER A 54 114.638 28.325 -5.313 1.00 0.00 C ATOM 784 OG SER A 54 113.721 27.642 -6.156 1.00 0.00 O ATOM 0 H SER A 54 115.998 27.317 -7.094 1.00 0.00 H new ATOM 0 HA SER A 54 115.025 29.925 -6.708 1.00 0.00 H new ATOM 0 HB2 SER A 54 115.203 27.610 -4.716 1.00 0.00 H new ATOM 0 HB3 SER A 54 114.100 28.968 -4.616 1.00 0.00 H new ATOM 0 HG SER A 54 113.111 27.104 -5.609 1.00 0.00 H new ATOM 790 N GLY A 55 117.691 29.146 -4.953 1.00 0.00 N ATOM 791 CA GLY A 55 118.720 29.699 -4.074 1.00 0.00 C ATOM 792 C GLY A 55 118.417 29.467 -2.590 1.00 0.00 C ATOM 793 O GLY A 55 118.946 30.175 -1.732 1.00 0.00 O ATOM 0 H GLY A 55 117.876 28.198 -5.281 1.00 0.00 H new ATOM 0 HA2 GLY A 55 119.682 29.248 -4.319 1.00 0.00 H new ATOM 0 HA3 GLY A 55 118.813 30.769 -4.259 1.00 0.00 H new ATOM 797 N ASP A 56 117.570 28.482 -2.280 1.00 0.00 N ATOM 798 CA ASP A 56 117.229 28.172 -0.895 1.00 0.00 C ATOM 799 C ASP A 56 117.554 26.714 -0.585 1.00 0.00 C ATOM 800 O ASP A 56 117.254 25.822 -1.379 1.00 0.00 O ATOM 801 CB ASP A 56 115.739 28.425 -0.655 1.00 0.00 C ATOM 802 CG ASP A 56 115.408 28.234 0.820 1.00 0.00 C ATOM 803 OD1 ASP A 56 115.077 27.121 1.194 1.00 0.00 O ATOM 804 OD2 ASP A 56 115.489 29.204 1.555 1.00 0.00 O ATOM 0 H ASP A 56 117.110 27.888 -2.970 1.00 0.00 H new ATOM 0 HA ASP A 56 117.816 28.815 -0.239 1.00 0.00 H new ATOM 0 HB2 ASP A 56 115.479 29.437 -0.966 1.00 0.00 H new ATOM 0 HB3 ASP A 56 115.144 27.742 -1.261 1.00 0.00 H new ATOM 809 N TYR A 57 118.166 26.477 0.571 1.00 0.00 N ATOM 810 CA TYR A 57 118.540 25.122 0.957 1.00 0.00 C ATOM 811 C TYR A 57 117.309 24.319 1.365 1.00 0.00 C ATOM 812 O TYR A 57 116.551 24.728 2.245 1.00 0.00 O ATOM 813 CB TYR A 57 119.531 25.165 2.121 1.00 0.00 C ATOM 814 CG TYR A 57 120.059 23.805 2.512 1.00 0.00 C ATOM 815 CD1 TYR A 57 121.160 23.263 1.839 1.00 0.00 C ATOM 816 CD2 TYR A 57 119.448 23.086 3.546 1.00 0.00 C ATOM 817 CE1 TYR A 57 121.650 22.002 2.200 1.00 0.00 C ATOM 818 CE2 TYR A 57 119.937 21.826 3.907 1.00 0.00 C ATOM 819 CZ TYR A 57 121.038 21.283 3.234 1.00 0.00 C ATOM 820 OH TYR A 57 121.520 20.040 3.590 1.00 0.00 O ATOM 0 H TYR A 57 118.411 27.197 1.250 1.00 0.00 H new ATOM 0 HA TYR A 57 119.007 24.638 0.099 1.00 0.00 H new ATOM 0 HB2 TYR A 57 120.369 25.808 1.851 1.00 0.00 H new ATOM 0 HB3 TYR A 57 119.046 25.620 2.985 1.00 0.00 H new ATOM 0 HD1 TYR A 57 121.632 23.817 1.041 1.00 0.00 H new ATOM 0 HD2 TYR A 57 118.599 23.504 4.065 1.00 0.00 H new ATOM 0 HE1 TYR A 57 122.500 21.584 1.681 1.00 0.00 H new ATOM 0 HE2 TYR A 57 119.465 21.272 4.705 1.00 0.00 H new ATOM 0 HH TYR A 57 120.982 19.679 4.325 1.00 0.00 H new ATOM 830 N ASN A 58 117.119 23.174 0.718 1.00 0.00 N ATOM 831 CA ASN A 58 115.989 22.306 1.027 1.00 0.00 C ATOM 832 C ASN A 58 116.426 20.845 1.023 1.00 0.00 C ATOM 833 O ASN A 58 116.899 20.334 0.007 1.00 0.00 O ATOM 834 CB ASN A 58 114.874 22.511 0.000 1.00 0.00 C ATOM 835 CG ASN A 58 113.634 21.722 0.409 1.00 0.00 C ATOM 836 OD1 ASN A 58 113.336 20.683 -0.180 1.00 0.00 O ATOM 837 ND2 ASN A 58 112.891 22.156 1.390 1.00 0.00 N ATOM 0 H ASN A 58 117.730 22.827 -0.021 1.00 0.00 H new ATOM 0 HA ASN A 58 115.617 22.562 2.019 1.00 0.00 H new ATOM 0 HB2 ASN A 58 114.631 23.571 -0.078 1.00 0.00 H new ATOM 0 HB3 ASN A 58 115.212 22.188 -0.985 1.00 0.00 H new ATOM 0 HD21 ASN A 58 112.061 21.634 1.671 1.00 0.00 H new ATOM 0 HD22 ASN A 58 113.140 23.017 1.876 1.00 0.00 H new ATOM 844 N LYS A 59 116.267 20.174 2.161 1.00 0.00 N ATOM 845 CA LYS A 59 116.666 18.774 2.278 1.00 0.00 C ATOM 846 C LYS A 59 115.519 17.936 2.835 1.00 0.00 C ATOM 847 O LYS A 59 115.003 18.213 3.918 1.00 0.00 O ATOM 848 CB LYS A 59 117.879 18.663 3.207 1.00 0.00 C ATOM 849 CG LYS A 59 118.404 17.224 3.218 1.00 0.00 C ATOM 850 CD LYS A 59 119.166 16.943 1.920 1.00 0.00 C ATOM 851 CE LYS A 59 119.782 15.544 1.978 1.00 0.00 C ATOM 852 NZ LYS A 59 120.967 15.488 1.076 1.00 0.00 N ATOM 0 H LYS A 59 115.867 20.574 3.010 1.00 0.00 H new ATOM 0 HA LYS A 59 116.925 18.400 1.288 1.00 0.00 H new ATOM 0 HB2 LYS A 59 118.664 19.342 2.875 1.00 0.00 H new ATOM 0 HB3 LYS A 59 117.602 18.965 4.217 1.00 0.00 H new ATOM 0 HG2 LYS A 59 119.059 17.072 4.076 1.00 0.00 H new ATOM 0 HG3 LYS A 59 117.574 16.525 3.323 1.00 0.00 H new ATOM 0 HD2 LYS A 59 118.492 17.019 1.067 1.00 0.00 H new ATOM 0 HD3 LYS A 59 119.947 17.689 1.776 1.00 0.00 H new ATOM 0 HE2 LYS A 59 120.077 15.307 3.000 1.00 0.00 H new ATOM 0 HE3 LYS A 59 119.046 14.798 1.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 120.974 14.581 0.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 120.919 16.269 0.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 121.837 15.575 1.640 1.00 0.00 H new ATOM 866 N ASN A 60 115.127 16.910 2.085 1.00 0.00 N ATOM 867 CA ASN A 60 114.052 16.017 2.511 1.00 0.00 C ATOM 868 C ASN A 60 114.507 14.563 2.438 1.00 0.00 C ATOM 869 O ASN A 60 115.064 14.129 1.430 1.00 0.00 O ATOM 870 CB ASN A 60 112.824 16.215 1.619 1.00 0.00 C ATOM 871 CG ASN A 60 111.597 15.543 2.233 1.00 0.00 C ATOM 872 OD1 ASN A 60 111.720 14.693 3.116 1.00 0.00 O ATOM 873 ND2 ASN A 60 110.408 15.878 1.813 1.00 0.00 N ATOM 0 H ASN A 60 115.536 16.676 1.181 1.00 0.00 H new ATOM 0 HA ASN A 60 113.793 16.255 3.543 1.00 0.00 H new ATOM 0 HB2 ASN A 60 112.633 17.280 1.486 1.00 0.00 H new ATOM 0 HB3 ASN A 60 113.016 15.799 0.630 1.00 0.00 H new ATOM 0 HD21 ASN A 60 109.582 15.436 2.216 1.00 0.00 H new ATOM 0 HD22 ASN A 60 110.305 16.582 1.082 1.00 0.00 H new ATOM 880 N GLN A 61 114.267 13.814 3.511 1.00 0.00 N ATOM 881 CA GLN A 61 114.649 12.403 3.556 1.00 0.00 C ATOM 882 C GLN A 61 113.424 11.541 3.829 1.00 0.00 C ATOM 883 O GLN A 61 112.535 11.945 4.577 1.00 0.00 O ATOM 884 CB GLN A 61 115.689 12.180 4.657 1.00 0.00 C ATOM 885 CG GLN A 61 116.966 12.953 4.318 1.00 0.00 C ATOM 886 CD GLN A 61 117.989 12.818 5.443 1.00 0.00 C ATOM 887 OE1 GLN A 61 117.642 12.460 6.570 1.00 0.00 O ATOM 888 NE2 GLN A 61 119.244 13.084 5.202 1.00 0.00 N ATOM 0 H GLN A 61 113.812 14.157 4.357 1.00 0.00 H new ATOM 0 HA GLN A 61 115.077 12.122 2.594 1.00 0.00 H new ATOM 0 HB2 GLN A 61 115.294 12.512 5.617 1.00 0.00 H new ATOM 0 HB3 GLN A 61 115.910 11.117 4.754 1.00 0.00 H new ATOM 0 HG2 GLN A 61 117.389 12.576 3.387 1.00 0.00 H new ATOM 0 HG3 GLN A 61 116.729 14.005 4.158 1.00 0.00 H new ATOM 0 HE21 GLN A 61 119.533 13.380 4.270 1.00 0.00 H new ATOM 0 HE22 GLN A 61 119.936 12.995 5.946 1.00 0.00 H new ATOM 897 N TYR A 62 113.377 10.361 3.215 1.00 0.00 N ATOM 898 CA TYR A 62 112.240 9.457 3.386 1.00 0.00 C ATOM 899 C TYR A 62 112.693 8.084 3.870 1.00 0.00 C ATOM 900 O TYR A 62 113.682 7.539 3.381 1.00 0.00 O ATOM 901 CB TYR A 62 111.499 9.304 2.056 1.00 0.00 C ATOM 902 CG TYR A 62 110.950 10.604 1.519 1.00 0.00 C ATOM 903 CD1 TYR A 62 109.659 11.017 1.869 1.00 0.00 C ATOM 904 CD2 TYR A 62 111.732 11.396 0.670 1.00 0.00 C ATOM 905 CE1 TYR A 62 109.150 12.222 1.370 1.00 0.00 C ATOM 906 CE2 TYR A 62 111.223 12.601 0.170 1.00 0.00 C ATOM 907 CZ TYR A 62 109.931 13.014 0.520 1.00 0.00 C ATOM 908 OH TYR A 62 109.430 14.201 0.028 1.00 0.00 O ATOM 0 H TYR A 62 114.108 10.009 2.597 1.00 0.00 H new ATOM 0 HA TYR A 62 111.577 9.887 4.137 1.00 0.00 H new ATOM 0 HB2 TYR A 62 112.177 8.873 1.319 1.00 0.00 H new ATOM 0 HB3 TYR A 62 110.678 8.598 2.185 1.00 0.00 H new ATOM 0 HD1 TYR A 62 109.056 10.406 2.524 1.00 0.00 H new ATOM 0 HD2 TYR A 62 112.728 11.078 0.401 1.00 0.00 H new ATOM 0 HE1 TYR A 62 108.154 12.541 1.641 1.00 0.00 H new ATOM 0 HE2 TYR A 62 111.826 13.212 -0.485 1.00 0.00 H new ATOM 0 HH TYR A 62 110.101 14.627 -0.545 1.00 0.00 H new ATOM 918 N TYR A 63 111.952 7.529 4.825 1.00 0.00 N ATOM 919 CA TYR A 63 112.226 6.188 5.335 1.00 0.00 C ATOM 920 C TYR A 63 110.954 5.349 5.263 1.00 0.00 C ATOM 921 O TYR A 63 109.885 5.820 5.645 1.00 0.00 O ATOM 922 CB TYR A 63 112.712 6.280 6.783 1.00 0.00 C ATOM 923 CG TYR A 63 113.134 4.956 7.372 1.00 0.00 C ATOM 924 CD1 TYR A 63 113.922 4.072 6.623 1.00 0.00 C ATOM 925 CD2 TYR A 63 112.746 4.615 8.673 1.00 0.00 C ATOM 926 CE1 TYR A 63 114.320 2.849 7.175 1.00 0.00 C ATOM 927 CE2 TYR A 63 113.142 3.391 9.225 1.00 0.00 C ATOM 928 CZ TYR A 63 113.929 2.508 8.476 1.00 0.00 C ATOM 929 OH TYR A 63 114.322 1.303 9.021 1.00 0.00 O ATOM 0 H TYR A 63 111.154 7.989 5.263 1.00 0.00 H new ATOM 0 HA TYR A 63 113.000 5.717 4.730 1.00 0.00 H new ATOM 0 HB2 TYR A 63 113.553 6.972 6.830 1.00 0.00 H new ATOM 0 HB3 TYR A 63 111.916 6.702 7.397 1.00 0.00 H new ATOM 0 HD1 TYR A 63 114.222 4.334 5.619 1.00 0.00 H new ATOM 0 HD2 TYR A 63 112.140 5.297 9.252 1.00 0.00 H new ATOM 0 HE1 TYR A 63 114.928 2.168 6.598 1.00 0.00 H new ATOM 0 HE2 TYR A 63 112.841 3.128 10.228 1.00 0.00 H new ATOM 0 HH TYR A 63 114.500 0.661 8.302 1.00 0.00 H new ATOM 939 N GLY A 64 111.059 4.116 4.767 1.00 0.00 N ATOM 940 CA GLY A 64 109.871 3.295 4.535 1.00 0.00 C ATOM 941 C GLY A 64 110.013 1.897 5.132 1.00 0.00 C ATOM 942 O GLY A 64 111.065 1.269 5.010 1.00 0.00 O ATOM 0 H GLY A 64 111.942 3.668 4.521 1.00 0.00 H new ATOM 0 HA2 GLY A 64 109.001 3.787 4.969 1.00 0.00 H new ATOM 0 HA3 GLY A 64 109.690 3.214 3.463 1.00 0.00 H new ATOM 946 N ILE A 65 108.943 1.426 5.769 1.00 0.00 N ATOM 947 CA ILE A 65 108.912 0.078 6.329 1.00 0.00 C ATOM 948 C ILE A 65 107.847 -0.732 5.603 1.00 0.00 C ATOM 949 O ILE A 65 106.708 -0.281 5.480 1.00 0.00 O ATOM 950 CB ILE A 65 108.582 0.127 7.825 1.00 0.00 C ATOM 951 CG1 ILE A 65 109.550 1.060 8.569 1.00 0.00 C ATOM 952 CG2 ILE A 65 108.670 -1.283 8.415 1.00 0.00 C ATOM 953 CD1 ILE A 65 111.003 0.600 8.398 1.00 0.00 C ATOM 0 H ILE A 65 108.085 1.959 5.910 1.00 0.00 H new ATOM 0 HA ILE A 65 109.890 -0.385 6.202 1.00 0.00 H new ATOM 0 HB ILE A 65 107.570 0.514 7.944 1.00 0.00 H new ATOM 0 HG12 ILE A 65 109.441 2.077 8.193 1.00 0.00 H new ATOM 0 HG13 ILE A 65 109.295 1.083 9.629 1.00 0.00 H new ATOM 0 HG21 ILE A 65 108.435 -1.248 9.479 1.00 0.00 H new ATOM 0 HG22 ILE A 65 107.958 -1.935 7.908 1.00 0.00 H new ATOM 0 HG23 ILE A 65 109.679 -1.672 8.279 1.00 0.00 H new ATOM 0 HD11 ILE A 65 111.665 1.279 8.935 1.00 0.00 H new ATOM 0 HD12 ILE A 65 111.115 -0.408 8.798 1.00 0.00 H new ATOM 0 HD13 ILE A 65 111.263 0.601 7.339 1.00 0.00 H new ATOM 965 N THR A 66 108.216 -1.911 5.106 1.00 0.00 N ATOM 966 CA THR A 66 107.293 -2.703 4.293 1.00 0.00 C ATOM 967 C THR A 66 107.306 -4.172 4.711 1.00 0.00 C ATOM 968 O THR A 66 108.242 -4.637 5.363 1.00 0.00 O ATOM 969 CB THR A 66 107.672 -2.606 2.810 1.00 0.00 C ATOM 970 OG1 THR A 66 108.904 -3.278 2.595 1.00 0.00 O ATOM 971 CG2 THR A 66 107.803 -1.145 2.362 1.00 0.00 C ATOM 0 H THR A 66 109.133 -2.335 5.248 1.00 0.00 H new ATOM 0 HA THR A 66 106.292 -2.300 4.448 1.00 0.00 H new ATOM 0 HB THR A 66 106.881 -3.072 2.223 1.00 0.00 H new ATOM 0 HG1 THR A 66 109.640 -2.632 2.631 1.00 0.00 H new ATOM 0 HG21 THR A 66 108.072 -1.111 1.306 1.00 0.00 H new ATOM 0 HG22 THR A 66 106.853 -0.632 2.511 1.00 0.00 H new ATOM 0 HG23 THR A 66 108.577 -0.652 2.950 1.00 0.00 H new ATOM 979 N ALA A 67 106.256 -4.895 4.328 1.00 0.00 N ATOM 980 CA ALA A 67 106.180 -6.332 4.574 1.00 0.00 C ATOM 981 C ALA A 67 105.255 -6.974 3.546 1.00 0.00 C ATOM 982 O ALA A 67 104.309 -6.332 3.087 1.00 0.00 O ATOM 983 CB ALA A 67 105.654 -6.599 5.984 1.00 0.00 C ATOM 0 H ALA A 67 105.445 -4.508 3.845 1.00 0.00 H new ATOM 0 HA ALA A 67 107.177 -6.763 4.486 1.00 0.00 H new ATOM 0 HB1 ALA A 67 105.602 -7.674 6.155 1.00 0.00 H new ATOM 0 HB2 ALA A 67 106.325 -6.147 6.714 1.00 0.00 H new ATOM 0 HB3 ALA A 67 104.659 -6.166 6.089 1.00 0.00 H new ATOM 989 N GLY A 68 105.539 -8.219 3.161 1.00 0.00 N ATOM 990 CA GLY A 68 104.710 -8.889 2.161 1.00 0.00 C ATOM 991 C GLY A 68 104.726 -10.420 2.308 1.00 0.00 C ATOM 992 O GLY A 68 105.799 -10.988 2.510 1.00 0.00 O ATOM 0 H GLY A 68 106.318 -8.773 3.517 1.00 0.00 H new ATOM 0 HA2 GLY A 68 103.684 -8.530 2.246 1.00 0.00 H new ATOM 0 HA3 GLY A 68 105.060 -8.620 1.165 1.00 0.00 H new ATOM 996 N PRO A 69 103.597 -11.105 2.250 1.00 0.00 N ATOM 997 CA PRO A 69 103.592 -12.598 2.140 1.00 0.00 C ATOM 998 C PRO A 69 103.958 -13.070 0.731 1.00 0.00 C ATOM 999 O PRO A 69 103.888 -12.286 -0.218 1.00 0.00 O ATOM 1000 CB PRO A 69 102.158 -12.999 2.490 1.00 0.00 C ATOM 1001 CG PRO A 69 101.327 -11.823 2.113 1.00 0.00 C ATOM 1002 CD PRO A 69 102.212 -10.591 2.301 1.00 0.00 C ATOM 0 HA PRO A 69 104.332 -13.052 2.799 1.00 0.00 H new ATOM 0 HB2 PRO A 69 101.852 -13.890 1.942 1.00 0.00 H new ATOM 0 HB3 PRO A 69 102.060 -13.228 3.551 1.00 0.00 H new ATOM 0 HG2 PRO A 69 100.987 -11.903 1.081 1.00 0.00 H new ATOM 0 HG3 PRO A 69 100.436 -11.760 2.738 1.00 0.00 H new ATOM 0 HD2 PRO A 69 102.035 -9.854 1.517 1.00 0.00 H new ATOM 0 HD3 PRO A 69 102.008 -10.100 3.252 1.00 0.00 H new ATOM 1010 N ALA A 70 104.323 -14.348 0.585 1.00 0.00 N ATOM 1011 CA ALA A 70 104.652 -14.895 -0.733 1.00 0.00 C ATOM 1012 C ALA A 70 103.937 -16.229 -0.947 1.00 0.00 C ATOM 1013 O ALA A 70 103.595 -16.918 0.013 1.00 0.00 O ATOM 1014 CB ALA A 70 106.171 -15.064 -0.871 1.00 0.00 C ATOM 0 H ALA A 70 104.397 -15.015 1.353 1.00 0.00 H new ATOM 0 HA ALA A 70 104.312 -14.198 -1.499 1.00 0.00 H new ATOM 0 HB1 ALA A 70 106.404 -15.471 -1.855 1.00 0.00 H new ATOM 0 HB2 ALA A 70 106.657 -14.095 -0.755 1.00 0.00 H new ATOM 0 HB3 ALA A 70 106.533 -15.746 -0.101 1.00 0.00 H new ATOM 1020 N TYR A 71 103.711 -16.586 -2.211 1.00 0.00 N ATOM 1021 CA TYR A 71 102.974 -17.801 -2.541 1.00 0.00 C ATOM 1022 C TYR A 71 103.835 -18.716 -3.401 1.00 0.00 C ATOM 1023 O TYR A 71 104.417 -18.271 -4.392 1.00 0.00 O ATOM 1024 CB TYR A 71 101.693 -17.446 -3.296 1.00 0.00 C ATOM 1025 CG TYR A 71 100.750 -16.571 -2.503 1.00 0.00 C ATOM 1026 CD1 TYR A 71 100.851 -15.178 -2.583 1.00 0.00 C ATOM 1027 CD2 TYR A 71 99.775 -17.156 -1.686 1.00 0.00 C ATOM 1028 CE1 TYR A 71 99.977 -14.368 -1.847 1.00 0.00 C ATOM 1029 CE2 TYR A 71 98.901 -16.347 -0.950 1.00 0.00 C ATOM 1030 CZ TYR A 71 99.001 -14.953 -1.031 1.00 0.00 C ATOM 1031 OH TYR A 71 98.140 -14.155 -0.306 1.00 0.00 O ATOM 0 H TYR A 71 104.028 -16.051 -3.020 1.00 0.00 H new ATOM 0 HA TYR A 71 102.715 -18.317 -1.616 1.00 0.00 H new ATOM 0 HB2 TYR A 71 101.956 -16.937 -4.223 1.00 0.00 H new ATOM 0 HB3 TYR A 71 101.177 -18.365 -3.573 1.00 0.00 H new ATOM 0 HD1 TYR A 71 101.603 -14.727 -3.213 1.00 0.00 H new ATOM 0 HD2 TYR A 71 99.697 -18.231 -1.624 1.00 0.00 H new ATOM 0 HE1 TYR A 71 100.056 -13.293 -1.909 1.00 0.00 H new ATOM 0 HE2 TYR A 71 98.149 -16.799 -0.320 1.00 0.00 H new ATOM 0 HH TYR A 71 97.524 -14.719 0.207 1.00 0.00 H new ATOM 1041 N ARG A 72 103.920 -19.982 -3.006 1.00 0.00 N ATOM 1042 CA ARG A 72 104.710 -20.959 -3.747 1.00 0.00 C ATOM 1043 C ARG A 72 103.794 -21.927 -4.489 1.00 0.00 C ATOM 1044 O ARG A 72 102.851 -22.473 -3.917 1.00 0.00 O ATOM 1045 CB ARG A 72 105.607 -21.740 -2.786 1.00 0.00 C ATOM 1046 CG ARG A 72 106.599 -20.782 -2.121 1.00 0.00 C ATOM 1047 CD ARG A 72 107.501 -21.553 -1.155 1.00 0.00 C ATOM 1048 NE ARG A 72 108.425 -22.421 -1.891 1.00 0.00 N ATOM 1049 CZ ARG A 72 108.166 -23.705 -2.184 1.00 0.00 C ATOM 1050 NH1 ARG A 72 107.031 -24.282 -1.871 1.00 0.00 N ATOM 1051 NH2 ARG A 72 109.072 -24.401 -2.816 1.00 0.00 N ATOM 0 H ARG A 72 103.453 -20.355 -2.179 1.00 0.00 H new ATOM 0 HA ARG A 72 105.329 -20.429 -4.471 1.00 0.00 H new ATOM 0 HB2 ARG A 72 105.001 -22.236 -2.028 1.00 0.00 H new ATOM 0 HB3 ARG A 72 106.144 -22.520 -3.326 1.00 0.00 H new ATOM 0 HG2 ARG A 72 107.204 -20.287 -2.880 1.00 0.00 H new ATOM 0 HG3 ARG A 72 106.060 -20.002 -1.584 1.00 0.00 H new ATOM 0 HD2 ARG A 72 108.065 -20.853 -0.539 1.00 0.00 H new ATOM 0 HD3 ARG A 72 106.891 -22.153 -0.480 1.00 0.00 H new ATOM 0 HE ARG A 72 109.315 -22.027 -2.198 1.00 0.00 H new ATOM 0 HH11 ARG A 72 106.306 -23.752 -1.387 1.00 0.00 H new ATOM 0 HH12 ARG A 72 106.873 -25.261 -2.112 1.00 0.00 H new ATOM 0 HH21 ARG A 72 109.957 -23.967 -3.078 1.00 0.00 H new ATOM 0 HH22 ARG A 72 108.894 -25.378 -3.048 1.00 0.00 H new ATOM 1065 N ILE A 73 104.086 -22.131 -5.769 1.00 0.00 N ATOM 1066 CA ILE A 73 103.292 -23.019 -6.610 1.00 0.00 C ATOM 1067 C ILE A 73 104.203 -24.081 -7.218 1.00 0.00 C ATOM 1068 O ILE A 73 105.418 -23.891 -7.286 1.00 0.00 O ATOM 1069 CB ILE A 73 102.604 -22.209 -7.719 1.00 0.00 C ATOM 1070 CG1 ILE A 73 101.729 -21.118 -7.092 1.00 0.00 C ATOM 1071 CG2 ILE A 73 101.721 -23.130 -8.567 1.00 0.00 C ATOM 1072 CD1 ILE A 73 101.265 -20.141 -8.175 1.00 0.00 C ATOM 0 H ILE A 73 104.871 -21.691 -6.249 1.00 0.00 H new ATOM 0 HA ILE A 73 102.525 -23.506 -6.008 1.00 0.00 H new ATOM 0 HB ILE A 73 103.368 -21.754 -8.350 1.00 0.00 H new ATOM 0 HG12 ILE A 73 100.866 -21.568 -6.601 1.00 0.00 H new ATOM 0 HG13 ILE A 73 102.290 -20.585 -6.324 1.00 0.00 H new ATOM 0 HG21 ILE A 73 101.236 -22.548 -9.351 1.00 0.00 H new ATOM 0 HG22 ILE A 73 102.336 -23.908 -9.019 1.00 0.00 H new ATOM 0 HG23 ILE A 73 100.962 -23.590 -7.934 1.00 0.00 H new ATOM 0 HD11 ILE A 73 100.643 -19.367 -7.725 1.00 0.00 H new ATOM 0 HD12 ILE A 73 102.134 -19.680 -8.646 1.00 0.00 H new ATOM 0 HD13 ILE A 73 100.687 -20.679 -8.927 1.00 0.00 H new ATOM 1084 N ASN A 74 103.628 -25.199 -7.663 1.00 0.00 N ATOM 1085 CA ASN A 74 104.409 -26.280 -8.273 1.00 0.00 C ATOM 1086 C ASN A 74 105.400 -25.752 -9.318 1.00 0.00 C ATOM 1087 O ASN A 74 106.479 -26.317 -9.502 1.00 0.00 O ATOM 1088 CB ASN A 74 103.467 -27.288 -8.935 1.00 0.00 C ATOM 1089 CG ASN A 74 102.551 -27.912 -7.888 1.00 0.00 C ATOM 1090 OD1 ASN A 74 101.341 -28.009 -8.099 1.00 0.00 O ATOM 1091 ND2 ASN A 74 103.056 -28.342 -6.765 1.00 0.00 N ATOM 0 H ASN A 74 102.626 -25.381 -7.613 1.00 0.00 H new ATOM 0 HA ASN A 74 104.980 -26.761 -7.479 1.00 0.00 H new ATOM 0 HB2 ASN A 74 102.872 -26.792 -9.702 1.00 0.00 H new ATOM 0 HB3 ASN A 74 104.046 -28.066 -9.434 1.00 0.00 H new ATOM 0 HD21 ASN A 74 102.449 -28.759 -6.060 1.00 0.00 H new ATOM 0 HD22 ASN A 74 104.058 -28.261 -6.592 1.00 0.00 H new ATOM 1098 N ASP A 75 105.026 -24.670 -9.995 1.00 0.00 N ATOM 1099 CA ASP A 75 105.938 -24.001 -10.913 1.00 0.00 C ATOM 1100 C ASP A 75 107.031 -23.286 -10.124 1.00 0.00 C ATOM 1101 O ASP A 75 106.760 -22.659 -9.101 1.00 0.00 O ATOM 1102 CB ASP A 75 105.174 -22.988 -11.769 1.00 0.00 C ATOM 1103 CG ASP A 75 106.088 -22.401 -12.842 1.00 0.00 C ATOM 1104 OD1 ASP A 75 106.966 -23.111 -13.305 1.00 0.00 O ATOM 1105 OD2 ASP A 75 105.897 -21.246 -13.184 1.00 0.00 O ATOM 0 H ASP A 75 104.103 -24.241 -9.925 1.00 0.00 H new ATOM 0 HA ASP A 75 106.392 -24.746 -11.566 1.00 0.00 H new ATOM 0 HB2 ASP A 75 104.317 -23.471 -12.237 1.00 0.00 H new ATOM 0 HB3 ASP A 75 104.784 -22.189 -11.138 1.00 0.00 H new ATOM 1110 N TRP A 76 108.265 -23.387 -10.605 1.00 0.00 N ATOM 1111 CA TRP A 76 109.409 -22.812 -9.900 1.00 0.00 C ATOM 1112 C TRP A 76 109.182 -21.345 -9.531 1.00 0.00 C ATOM 1113 O TRP A 76 109.680 -20.876 -8.508 1.00 0.00 O ATOM 1114 CB TRP A 76 110.660 -22.931 -10.773 1.00 0.00 C ATOM 1115 CG TRP A 76 110.524 -22.258 -12.103 1.00 0.00 C ATOM 1116 CD1 TRP A 76 109.815 -22.741 -13.148 1.00 0.00 C ATOM 1117 CD2 TRP A 76 111.101 -20.995 -12.548 1.00 0.00 C ATOM 1118 NE1 TRP A 76 109.916 -21.857 -14.205 1.00 0.00 N ATOM 1119 CE2 TRP A 76 110.699 -20.765 -13.887 1.00 0.00 C ATOM 1120 CE3 TRP A 76 111.924 -20.038 -11.930 1.00 0.00 C ATOM 1121 CZ2 TRP A 76 111.101 -19.624 -14.586 1.00 0.00 C ATOM 1122 CZ3 TRP A 76 112.330 -18.891 -12.629 1.00 0.00 C ATOM 1123 CH2 TRP A 76 111.920 -18.683 -13.952 1.00 0.00 C ATOM 0 H TRP A 76 108.500 -23.860 -11.478 1.00 0.00 H new ATOM 0 HA TRP A 76 109.539 -23.370 -8.972 1.00 0.00 H new ATOM 0 HB2 TRP A 76 111.508 -22.499 -10.241 1.00 0.00 H new ATOM 0 HB3 TRP A 76 110.886 -23.986 -10.929 1.00 0.00 H new ATOM 0 HD1 TRP A 76 109.260 -23.667 -13.155 1.00 0.00 H new ATOM 0 HE1 TRP A 76 109.467 -21.994 -15.110 1.00 0.00 H new ATOM 0 HE3 TRP A 76 112.246 -20.186 -10.910 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 110.783 -19.470 -15.606 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 112.963 -18.163 -12.143 1.00 0.00 H new ATOM 0 HH2 TRP A 76 112.236 -17.797 -14.483 1.00 0.00 H new ATOM 1134 N ALA A 77 108.434 -20.625 -10.361 1.00 0.00 N ATOM 1135 CA ALA A 77 108.197 -19.205 -10.122 1.00 0.00 C ATOM 1136 C ALA A 77 107.413 -18.983 -8.830 1.00 0.00 C ATOM 1137 O ALA A 77 106.489 -19.735 -8.515 1.00 0.00 O ATOM 1138 CB ALA A 77 107.424 -18.603 -11.298 1.00 0.00 C ATOM 0 H ALA A 77 107.985 -20.997 -11.198 1.00 0.00 H new ATOM 0 HA ALA A 77 109.165 -18.714 -10.024 1.00 0.00 H new ATOM 0 HB1 ALA A 77 107.250 -17.543 -11.114 1.00 0.00 H new ATOM 0 HB2 ALA A 77 108.003 -18.722 -12.213 1.00 0.00 H new ATOM 0 HB3 ALA A 77 106.468 -19.115 -11.405 1.00 0.00 H new ATOM 1144 N SER A 78 107.791 -17.945 -8.090 1.00 0.00 N ATOM 1145 CA SER A 78 107.093 -17.576 -6.860 1.00 0.00 C ATOM 1146 C SER A 78 106.633 -16.125 -6.947 1.00 0.00 C ATOM 1147 O SER A 78 107.266 -15.316 -7.627 1.00 0.00 O ATOM 1148 CB SER A 78 108.023 -17.751 -5.657 1.00 0.00 C ATOM 1149 OG SER A 78 107.293 -17.502 -4.464 1.00 0.00 O ATOM 0 H SER A 78 108.580 -17.341 -8.321 1.00 0.00 H new ATOM 0 HA SER A 78 106.225 -18.224 -6.735 1.00 0.00 H new ATOM 0 HB2 SER A 78 108.433 -18.761 -5.643 1.00 0.00 H new ATOM 0 HB3 SER A 78 108.867 -17.065 -5.731 1.00 0.00 H new ATOM 0 HG SER A 78 106.363 -17.785 -4.585 1.00 0.00 H new ATOM 1155 N ILE A 79 105.537 -15.789 -6.265 1.00 0.00 N ATOM 1156 CA ILE A 79 104.989 -14.433 -6.354 1.00 0.00 C ATOM 1157 C ILE A 79 104.860 -13.850 -4.953 1.00 0.00 C ATOM 1158 O ILE A 79 104.692 -14.600 -3.995 1.00 0.00 O ATOM 1159 CB ILE A 79 103.607 -14.467 -7.021 1.00 0.00 C ATOM 1160 CG1 ILE A 79 103.706 -15.141 -8.394 1.00 0.00 C ATOM 1161 CG2 ILE A 79 103.088 -13.039 -7.203 1.00 0.00 C ATOM 1162 CD1 ILE A 79 102.301 -15.370 -8.956 1.00 0.00 C ATOM 0 H ILE A 79 105.019 -16.422 -5.656 1.00 0.00 H new ATOM 0 HA ILE A 79 105.658 -13.814 -6.952 1.00 0.00 H new ATOM 0 HB ILE A 79 102.923 -15.031 -6.387 1.00 0.00 H new ATOM 0 HG12 ILE A 79 104.284 -14.517 -9.076 1.00 0.00 H new ATOM 0 HG13 ILE A 79 104.233 -16.091 -8.307 1.00 0.00 H new ATOM 0 HG21 ILE A 79 102.107 -13.066 -7.677 1.00 0.00 H new ATOM 0 HG22 ILE A 79 103.008 -12.554 -6.230 1.00 0.00 H new ATOM 0 HG23 ILE A 79 103.779 -12.478 -7.832 1.00 0.00 H new ATOM 0 HD11 ILE A 79 102.373 -15.849 -9.932 1.00 0.00 H new ATOM 0 HD12 ILE A 79 101.738 -16.011 -8.278 1.00 0.00 H new ATOM 0 HD13 ILE A 79 101.790 -14.413 -9.059 1.00 0.00 H new ATOM 1174 N TYR A 80 104.944 -12.526 -4.831 1.00 0.00 N ATOM 1175 CA TYR A 80 104.715 -11.895 -3.536 1.00 0.00 C ATOM 1176 C TYR A 80 104.096 -10.514 -3.699 1.00 0.00 C ATOM 1177 O TYR A 80 104.213 -9.892 -4.754 1.00 0.00 O ATOM 1178 CB TYR A 80 106.030 -11.812 -2.751 1.00 0.00 C ATOM 1179 CG TYR A 80 107.026 -10.812 -3.292 1.00 0.00 C ATOM 1180 CD1 TYR A 80 107.869 -11.165 -4.352 1.00 0.00 C ATOM 1181 CD2 TYR A 80 107.113 -9.536 -2.724 1.00 0.00 C ATOM 1182 CE1 TYR A 80 108.800 -10.243 -4.844 1.00 0.00 C ATOM 1183 CE2 TYR A 80 108.042 -8.612 -3.218 1.00 0.00 C ATOM 1184 CZ TYR A 80 108.886 -8.965 -4.278 1.00 0.00 C ATOM 1185 OH TYR A 80 109.802 -8.056 -4.764 1.00 0.00 O ATOM 0 H TYR A 80 105.163 -11.885 -5.593 1.00 0.00 H new ATOM 0 HA TYR A 80 104.010 -12.509 -2.975 1.00 0.00 H new ATOM 0 HB2 TYR A 80 105.804 -11.556 -1.716 1.00 0.00 H new ATOM 0 HB3 TYR A 80 106.494 -12.798 -2.741 1.00 0.00 H new ATOM 0 HD1 TYR A 80 107.801 -12.150 -4.791 1.00 0.00 H new ATOM 0 HD2 TYR A 80 106.464 -9.264 -1.905 1.00 0.00 H new ATOM 0 HE1 TYR A 80 109.452 -10.517 -5.660 1.00 0.00 H new ATOM 0 HE2 TYR A 80 108.108 -7.626 -2.781 1.00 0.00 H new ATOM 0 HH TYR A 80 109.730 -7.218 -4.261 1.00 0.00 H new ATOM 1195 N GLY A 81 103.459 -10.039 -2.636 1.00 0.00 N ATOM 1196 CA GLY A 81 102.868 -8.703 -2.638 1.00 0.00 C ATOM 1197 C GLY A 81 103.258 -7.975 -1.362 1.00 0.00 C ATOM 1198 O GLY A 81 103.350 -8.588 -0.300 1.00 0.00 O ATOM 0 H GLY A 81 103.338 -10.555 -1.764 1.00 0.00 H new ATOM 0 HA2 GLY A 81 103.211 -8.143 -3.508 1.00 0.00 H new ATOM 0 HA3 GLY A 81 101.783 -8.774 -2.712 1.00 0.00 H new ATOM 1202 N VAL A 82 103.447 -6.662 -1.456 1.00 0.00 N ATOM 1203 CA VAL A 82 104.027 -5.910 -0.347 1.00 0.00 C ATOM 1204 C VAL A 82 103.287 -4.593 -0.141 1.00 0.00 C ATOM 1205 O VAL A 82 102.808 -3.989 -1.099 1.00 0.00 O ATOM 1206 CB VAL A 82 105.508 -5.619 -0.631 1.00 0.00 C ATOM 1207 CG1 VAL A 82 106.145 -4.977 0.600 1.00 0.00 C ATOM 1208 CG2 VAL A 82 106.268 -6.912 -0.952 1.00 0.00 C ATOM 0 H VAL A 82 103.211 -6.103 -2.276 1.00 0.00 H new ATOM 0 HA VAL A 82 103.936 -6.511 0.557 1.00 0.00 H new ATOM 0 HB VAL A 82 105.565 -4.948 -1.488 1.00 0.00 H new ATOM 0 HG11 VAL A 82 107.196 -4.770 0.400 1.00 0.00 H new ATOM 0 HG12 VAL A 82 105.630 -4.045 0.832 1.00 0.00 H new ATOM 0 HG13 VAL A 82 106.064 -5.657 1.448 1.00 0.00 H new ATOM 0 HG21 VAL A 82 107.314 -6.679 -1.149 1.00 0.00 H new ATOM 0 HG22 VAL A 82 106.201 -7.593 -0.104 1.00 0.00 H new ATOM 0 HG23 VAL A 82 105.829 -7.383 -1.831 1.00 0.00 H new ATOM 1218 N VAL A 83 103.190 -4.173 1.117 1.00 0.00 N ATOM 1219 CA VAL A 83 102.626 -2.871 1.453 1.00 0.00 C ATOM 1220 C VAL A 83 103.424 -2.264 2.601 1.00 0.00 C ATOM 1221 O VAL A 83 104.043 -3.005 3.367 1.00 0.00 O ATOM 1222 CB VAL A 83 101.155 -3.013 1.852 1.00 0.00 C ATOM 1223 CG1 VAL A 83 100.355 -3.553 0.666 1.00 0.00 C ATOM 1224 CG2 VAL A 83 101.031 -3.986 3.028 1.00 0.00 C ATOM 0 H VAL A 83 103.496 -4.718 1.923 1.00 0.00 H new ATOM 0 HA VAL A 83 102.682 -2.218 0.582 1.00 0.00 H new ATOM 0 HB VAL A 83 100.766 -2.037 2.144 1.00 0.00 H new ATOM 0 HG11 VAL A 83 99.307 -3.654 0.950 1.00 0.00 H new ATOM 0 HG12 VAL A 83 100.439 -2.863 -0.174 1.00 0.00 H new ATOM 0 HG13 VAL A 83 100.748 -4.527 0.375 1.00 0.00 H new ATOM 0 HG21 VAL A 83 99.983 -4.085 3.310 1.00 0.00 H new ATOM 0 HG22 VAL A 83 101.422 -4.961 2.736 1.00 0.00 H new ATOM 0 HG23 VAL A 83 101.600 -3.606 3.876 1.00 0.00 H new ATOM 1234 N GLY A 84 103.438 -0.936 2.711 1.00 0.00 N ATOM 1235 CA GLY A 84 104.169 -0.296 3.801 1.00 0.00 C ATOM 1236 C GLY A 84 103.883 1.196 3.875 1.00 0.00 C ATOM 1237 O GLY A 84 103.045 1.715 3.137 1.00 0.00 O ATOM 0 H GLY A 84 102.963 -0.296 2.074 1.00 0.00 H new ATOM 0 HA2 GLY A 84 103.896 -0.765 4.746 1.00 0.00 H new ATOM 0 HA3 GLY A 84 105.239 -0.454 3.663 1.00 0.00 H new ATOM 1241 N VAL A 85 104.618 1.883 4.745 1.00 0.00 N ATOM 1242 CA VAL A 85 104.390 3.305 4.975 1.00 0.00 C ATOM 1243 C VAL A 85 105.720 4.052 4.970 1.00 0.00 C ATOM 1244 O VAL A 85 106.729 3.537 5.447 1.00 0.00 O ATOM 1245 CB VAL A 85 103.658 3.503 6.310 1.00 0.00 C ATOM 1246 CG1 VAL A 85 104.515 2.982 7.467 1.00 0.00 C ATOM 1247 CG2 VAL A 85 103.363 4.990 6.525 1.00 0.00 C ATOM 0 H VAL A 85 105.373 1.480 5.300 1.00 0.00 H new ATOM 0 HA VAL A 85 103.768 3.707 4.176 1.00 0.00 H new ATOM 0 HB VAL A 85 102.722 2.946 6.281 1.00 0.00 H new ATOM 0 HG11 VAL A 85 103.984 3.129 8.408 1.00 0.00 H new ATOM 0 HG12 VAL A 85 104.713 1.920 7.324 1.00 0.00 H new ATOM 0 HG13 VAL A 85 105.459 3.526 7.494 1.00 0.00 H new ATOM 0 HG21 VAL A 85 102.844 5.124 7.474 1.00 0.00 H new ATOM 0 HG22 VAL A 85 104.299 5.548 6.542 1.00 0.00 H new ATOM 0 HG23 VAL A 85 102.736 5.358 5.713 1.00 0.00 H new ATOM 1257 N GLY A 86 105.711 5.260 4.420 1.00 0.00 N ATOM 1258 CA GLY A 86 106.920 6.074 4.351 1.00 0.00 C ATOM 1259 C GLY A 86 106.687 7.437 4.989 1.00 0.00 C ATOM 1260 O GLY A 86 105.619 8.026 4.831 1.00 0.00 O ATOM 0 H GLY A 86 104.883 5.697 4.016 1.00 0.00 H new ATOM 0 HA2 GLY A 86 107.738 5.564 4.860 1.00 0.00 H new ATOM 0 HA3 GLY A 86 107.221 6.200 3.311 1.00 0.00 H new ATOM 1264 N TYR A 87 107.691 7.922 5.715 1.00 0.00 N ATOM 1265 CA TYR A 87 107.609 9.228 6.362 1.00 0.00 C ATOM 1266 C TYR A 87 108.707 10.141 5.830 1.00 0.00 C ATOM 1267 O TYR A 87 109.846 9.712 5.652 1.00 0.00 O ATOM 1268 CB TYR A 87 107.759 9.070 7.875 1.00 0.00 C ATOM 1269 CG TYR A 87 106.685 8.210 8.497 1.00 0.00 C ATOM 1270 CD1 TYR A 87 105.429 8.757 8.782 1.00 0.00 C ATOM 1271 CD2 TYR A 87 106.946 6.865 8.790 1.00 0.00 C ATOM 1272 CE1 TYR A 87 104.432 7.959 9.359 1.00 0.00 C ATOM 1273 CE2 TYR A 87 105.950 6.068 9.366 1.00 0.00 C ATOM 1274 CZ TYR A 87 104.693 6.615 9.651 1.00 0.00 C ATOM 1275 OH TYR A 87 103.711 5.829 10.219 1.00 0.00 O ATOM 0 H TYR A 87 108.571 7.430 5.870 1.00 0.00 H new ATOM 0 HA TYR A 87 106.638 9.671 6.143 1.00 0.00 H new ATOM 0 HB2 TYR A 87 108.734 8.635 8.093 1.00 0.00 H new ATOM 0 HB3 TYR A 87 107.739 10.056 8.340 1.00 0.00 H new ATOM 0 HD1 TYR A 87 105.228 9.794 8.557 1.00 0.00 H new ATOM 0 HD2 TYR A 87 107.916 6.443 8.571 1.00 0.00 H new ATOM 0 HE1 TYR A 87 103.462 8.381 9.578 1.00 0.00 H new ATOM 0 HE2 TYR A 87 106.151 5.031 9.591 1.00 0.00 H new ATOM 0 HH TYR A 87 104.056 4.922 10.356 1.00 0.00 H new ATOM 1285 N GLY A 88 108.346 11.393 5.564 1.00 0.00 N ATOM 1286 CA GLY A 88 109.294 12.374 5.047 1.00 0.00 C ATOM 1287 C GLY A 88 109.482 13.525 6.030 1.00 0.00 C ATOM 1288 O GLY A 88 108.510 14.041 6.589 1.00 0.00 O ATOM 0 H GLY A 88 107.401 11.753 5.699 1.00 0.00 H new ATOM 0 HA2 GLY A 88 110.253 11.893 4.858 1.00 0.00 H new ATOM 0 HA3 GLY A 88 108.938 12.761 4.092 1.00 0.00 H new ATOM 1292 N LYS A 89 110.743 13.912 6.217 1.00 0.00 N ATOM 1293 CA LYS A 89 111.097 14.998 7.125 1.00 0.00 C ATOM 1294 C LYS A 89 111.977 16.014 6.402 1.00 0.00 C ATOM 1295 O LYS A 89 112.835 15.633 5.606 1.00 0.00 O ATOM 1296 CB LYS A 89 111.864 14.448 8.331 1.00 0.00 C ATOM 1297 CG LYS A 89 111.037 13.374 9.041 1.00 0.00 C ATOM 1298 CD LYS A 89 109.776 14.006 9.636 1.00 0.00 C ATOM 1299 CE LYS A 89 109.050 12.991 10.524 1.00 0.00 C ATOM 1300 NZ LYS A 89 108.331 13.715 11.611 1.00 0.00 N ATOM 0 H LYS A 89 111.541 13.485 5.747 1.00 0.00 H new ATOM 0 HA LYS A 89 110.180 15.479 7.464 1.00 0.00 H new ATOM 0 HB2 LYS A 89 112.815 14.028 8.005 1.00 0.00 H new ATOM 0 HB3 LYS A 89 112.094 15.257 9.024 1.00 0.00 H new ATOM 0 HG2 LYS A 89 110.764 12.587 8.338 1.00 0.00 H new ATOM 0 HG3 LYS A 89 111.628 12.907 9.829 1.00 0.00 H new ATOM 0 HD2 LYS A 89 110.042 14.887 10.220 1.00 0.00 H new ATOM 0 HD3 LYS A 89 109.115 14.340 8.836 1.00 0.00 H new ATOM 0 HE2 LYS A 89 108.345 12.409 9.930 1.00 0.00 H new ATOM 0 HE3 LYS A 89 109.764 12.287 10.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 107.619 13.087 12.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 109.011 14.009 12.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 107.861 14.555 11.217 1.00 0.00 H new ATOM 1314 N PHE A 90 111.761 17.297 6.677 1.00 0.00 N ATOM 1315 CA PHE A 90 112.569 18.351 6.067 1.00 0.00 C ATOM 1316 C PHE A 90 113.060 19.328 7.133 1.00 0.00 C ATOM 1317 O PHE A 90 112.453 19.453 8.196 1.00 0.00 O ATOM 1318 CB PHE A 90 111.743 19.103 5.022 1.00 0.00 C ATOM 1319 CG PHE A 90 110.555 19.834 5.602 1.00 0.00 C ATOM 1320 CD1 PHE A 90 109.347 19.156 5.804 1.00 0.00 C ATOM 1321 CD2 PHE A 90 110.661 21.189 5.935 1.00 0.00 C ATOM 1322 CE1 PHE A 90 108.245 19.833 6.340 1.00 0.00 C ATOM 1323 CE2 PHE A 90 109.559 21.866 6.471 1.00 0.00 C ATOM 1324 CZ PHE A 90 108.351 21.188 6.673 1.00 0.00 C ATOM 0 H PHE A 90 111.038 17.632 7.314 1.00 0.00 H new ATOM 0 HA PHE A 90 113.432 17.892 5.584 1.00 0.00 H new ATOM 0 HB2 PHE A 90 112.385 19.820 4.510 1.00 0.00 H new ATOM 0 HB3 PHE A 90 111.392 18.396 4.270 1.00 0.00 H new ATOM 0 HD1 PHE A 90 109.265 18.110 5.546 1.00 0.00 H new ATOM 0 HD2 PHE A 90 111.593 21.712 5.779 1.00 0.00 H new ATOM 0 HE1 PHE A 90 107.313 19.310 6.496 1.00 0.00 H new ATOM 0 HE2 PHE A 90 109.641 22.912 6.729 1.00 0.00 H new ATOM 0 HZ PHE A 90 107.501 21.711 7.086 1.00 0.00 H new ATOM 1334 N GLN A 91 114.162 20.017 6.844 1.00 0.00 N ATOM 1335 CA GLN A 91 114.728 20.972 7.795 1.00 0.00 C ATOM 1336 C GLN A 91 114.483 22.406 7.333 1.00 0.00 C ATOM 1337 O GLN A 91 114.924 22.809 6.257 1.00 0.00 O ATOM 1338 CB GLN A 91 116.236 20.734 7.933 1.00 0.00 C ATOM 1339 CG GLN A 91 116.513 19.287 8.359 1.00 0.00 C ATOM 1340 CD GLN A 91 115.837 18.972 9.691 1.00 0.00 C ATOM 1341 OE1 GLN A 91 115.975 19.731 10.651 1.00 0.00 O ATOM 1342 NE2 GLN A 91 115.112 17.894 9.807 1.00 0.00 N ATOM 0 H GLN A 91 114.677 19.934 5.968 1.00 0.00 H new ATOM 0 HA GLN A 91 114.241 20.826 8.759 1.00 0.00 H new ATOM 0 HB2 GLN A 91 116.731 20.942 6.985 1.00 0.00 H new ATOM 0 HB3 GLN A 91 116.653 21.422 8.668 1.00 0.00 H new ATOM 0 HG2 GLN A 91 116.151 18.602 7.592 1.00 0.00 H new ATOM 0 HG3 GLN A 91 117.588 19.129 8.446 1.00 0.00 H new ATOM 0 HE21 GLN A 91 114.999 17.267 9.010 1.00 0.00 H new ATOM 0 HE22 GLN A 91 114.658 17.678 10.694 1.00 0.00 H new ATOM 1351 N THR A 92 113.776 23.168 8.161 1.00 0.00 N ATOM 1352 CA THR A 92 113.510 24.573 7.869 1.00 0.00 C ATOM 1353 C THR A 92 113.501 25.382 9.163 1.00 0.00 C ATOM 1354 O THR A 92 113.311 24.822 10.243 1.00 0.00 O ATOM 1355 CB THR A 92 112.161 24.712 7.161 1.00 0.00 C ATOM 1356 OG1 THR A 92 112.138 23.865 6.021 1.00 0.00 O ATOM 1357 CG2 THR A 92 111.956 26.163 6.723 1.00 0.00 C ATOM 0 H THR A 92 113.377 22.837 9.039 1.00 0.00 H new ATOM 0 HA THR A 92 114.296 24.954 7.217 1.00 0.00 H new ATOM 0 HB THR A 92 111.362 24.426 7.845 1.00 0.00 H new ATOM 0 HG1 THR A 92 111.369 23.260 6.078 1.00 0.00 H new ATOM 0 HG21 THR A 92 110.994 26.259 6.219 1.00 0.00 H new ATOM 0 HG22 THR A 92 111.973 26.813 7.598 1.00 0.00 H new ATOM 0 HG23 THR A 92 112.754 26.453 6.040 1.00 0.00 H new ATOM 1365 N THR A 93 113.703 26.694 9.056 1.00 0.00 N ATOM 1366 CA THR A 93 113.607 27.559 10.228 1.00 0.00 C ATOM 1367 C THR A 93 112.238 28.229 10.254 1.00 0.00 C ATOM 1368 O THR A 93 111.856 28.911 9.303 1.00 0.00 O ATOM 1369 CB THR A 93 114.702 28.627 10.184 1.00 0.00 C ATOM 1370 OG1 THR A 93 115.969 27.998 10.049 1.00 0.00 O ATOM 1371 CG2 THR A 93 114.671 29.445 11.476 1.00 0.00 C ATOM 0 H THR A 93 113.930 27.174 8.185 1.00 0.00 H new ATOM 0 HA THR A 93 113.736 26.957 11.128 1.00 0.00 H new ATOM 0 HB THR A 93 114.532 29.288 9.334 1.00 0.00 H new ATOM 0 HG1 THR A 93 116.672 28.681 10.019 1.00 0.00 H new ATOM 0 HG21 THR A 93 115.451 30.205 11.444 1.00 0.00 H new ATOM 0 HG22 THR A 93 113.699 29.927 11.578 1.00 0.00 H new ATOM 0 HG23 THR A 93 114.841 28.786 12.328 1.00 0.00 H new ATOM 1379 N GLU A 94 111.538 28.072 11.375 1.00 0.00 N ATOM 1380 CA GLU A 94 110.141 28.489 11.488 1.00 0.00 C ATOM 1381 C GLU A 94 109.592 28.058 12.844 1.00 0.00 C ATOM 1382 O GLU A 94 110.027 27.042 13.391 1.00 0.00 O ATOM 1383 CB GLU A 94 109.292 27.843 10.383 1.00 0.00 C ATOM 1384 CG GLU A 94 107.884 28.454 10.367 1.00 0.00 C ATOM 1385 CD GLU A 94 106.982 27.788 9.321 1.00 0.00 C ATOM 1386 OE1 GLU A 94 107.420 26.862 8.654 1.00 0.00 O ATOM 1387 OE2 GLU A 94 105.849 28.222 9.203 1.00 0.00 O ATOM 0 H GLU A 94 111.919 27.656 12.225 1.00 0.00 H new ATOM 0 HA GLU A 94 110.094 29.573 11.387 1.00 0.00 H new ATOM 0 HB2 GLU A 94 109.770 27.990 9.415 1.00 0.00 H new ATOM 0 HB3 GLU A 94 109.227 26.767 10.547 1.00 0.00 H new ATOM 0 HG2 GLU A 94 107.433 28.351 11.354 1.00 0.00 H new ATOM 0 HG3 GLU A 94 107.954 29.522 10.159 1.00 0.00 H new ATOM 1394 N TYR A 95 108.647 28.822 13.387 1.00 0.00 N ATOM 1395 CA TYR A 95 107.984 28.414 14.620 1.00 0.00 C ATOM 1396 C TYR A 95 106.904 27.389 14.255 1.00 0.00 C ATOM 1397 O TYR A 95 105.943 27.742 13.569 1.00 0.00 O ATOM 1398 CB TYR A 95 107.336 29.624 15.293 1.00 0.00 C ATOM 1399 CG TYR A 95 106.903 29.362 16.716 1.00 0.00 C ATOM 1400 CD1 TYR A 95 107.860 29.270 17.734 1.00 0.00 C ATOM 1401 CD2 TYR A 95 105.543 29.210 17.017 1.00 0.00 C ATOM 1402 CE1 TYR A 95 107.459 29.028 19.052 1.00 0.00 C ATOM 1403 CE2 TYR A 95 105.142 28.967 18.336 1.00 0.00 C ATOM 1404 CZ TYR A 95 106.099 28.876 19.354 1.00 0.00 C ATOM 1405 OH TYR A 95 105.704 28.635 20.654 1.00 0.00 O ATOM 0 H TYR A 95 108.328 29.711 13.001 1.00 0.00 H new ATOM 0 HA TYR A 95 108.708 27.981 15.311 1.00 0.00 H new ATOM 0 HB2 TYR A 95 108.041 30.456 15.283 1.00 0.00 H new ATOM 0 HB3 TYR A 95 106.469 29.934 14.709 1.00 0.00 H new ATOM 0 HD1 TYR A 95 108.908 29.386 17.501 1.00 0.00 H new ATOM 0 HD2 TYR A 95 104.805 29.280 16.232 1.00 0.00 H new ATOM 0 HE1 TYR A 95 108.198 28.958 19.837 1.00 0.00 H new ATOM 0 HE2 TYR A 95 104.094 28.850 18.569 1.00 0.00 H new ATOM 0 HH TYR A 95 104.728 28.556 20.690 1.00 0.00 H new ATOM 1415 N PRO A 96 107.013 26.149 14.681 1.00 0.00 N ATOM 1416 CA PRO A 96 106.225 25.048 14.054 1.00 0.00 C ATOM 1417 C PRO A 96 104.744 25.050 14.422 1.00 0.00 C ATOM 1418 O PRO A 96 104.373 25.212 15.584 1.00 0.00 O ATOM 1419 CB PRO A 96 106.906 23.778 14.565 1.00 0.00 C ATOM 1420 CG PRO A 96 107.472 24.150 15.892 1.00 0.00 C ATOM 1421 CD PRO A 96 107.801 25.642 15.824 1.00 0.00 C ATOM 0 HA PRO A 96 106.222 25.148 12.969 1.00 0.00 H new ATOM 0 HB2 PRO A 96 106.194 22.958 14.656 1.00 0.00 H new ATOM 0 HB3 PRO A 96 107.688 23.447 13.881 1.00 0.00 H new ATOM 0 HG2 PRO A 96 106.757 23.947 16.689 1.00 0.00 H new ATOM 0 HG3 PRO A 96 108.366 23.566 16.110 1.00 0.00 H new ATOM 0 HD2 PRO A 96 107.528 26.150 16.749 1.00 0.00 H new ATOM 0 HD3 PRO A 96 108.868 25.806 15.673 1.00 0.00 H new ATOM 1429 N THR A 97 103.912 24.864 13.402 1.00 0.00 N ATOM 1430 CA THR A 97 102.491 24.599 13.598 1.00 0.00 C ATOM 1431 C THR A 97 102.174 23.224 13.019 1.00 0.00 C ATOM 1432 O THR A 97 102.885 22.753 12.129 1.00 0.00 O ATOM 1433 CB THR A 97 101.646 25.667 12.898 1.00 0.00 C ATOM 1434 OG1 THR A 97 101.872 25.604 11.498 1.00 0.00 O ATOM 1435 CG2 THR A 97 102.028 27.053 13.419 1.00 0.00 C ATOM 0 H THR A 97 104.201 24.892 12.424 1.00 0.00 H new ATOM 0 HA THR A 97 102.256 24.623 14.662 1.00 0.00 H new ATOM 0 HB THR A 97 100.591 25.486 13.105 1.00 0.00 H new ATOM 0 HG1 THR A 97 101.331 26.286 11.048 1.00 0.00 H new ATOM 0 HG21 THR A 97 101.424 27.809 12.918 1.00 0.00 H new ATOM 0 HG22 THR A 97 101.850 27.100 14.493 1.00 0.00 H new ATOM 0 HG23 THR A 97 103.083 27.239 13.218 1.00 0.00 H new ATOM 1443 N TYR A 98 101.118 22.579 13.511 1.00 0.00 N ATOM 1444 CA TYR A 98 100.782 21.235 13.045 1.00 0.00 C ATOM 1445 C TYR A 98 99.281 21.062 12.835 1.00 0.00 C ATOM 1446 O TYR A 98 98.477 21.352 13.721 1.00 0.00 O ATOM 1447 CB TYR A 98 101.291 20.199 14.052 1.00 0.00 C ATOM 1448 CG TYR A 98 100.569 20.224 15.381 1.00 0.00 C ATOM 1449 CD1 TYR A 98 100.973 21.115 16.381 1.00 0.00 C ATOM 1450 CD2 TYR A 98 99.499 19.352 15.611 1.00 0.00 C ATOM 1451 CE1 TYR A 98 100.306 21.136 17.612 1.00 0.00 C ATOM 1452 CE2 TYR A 98 98.830 19.373 16.841 1.00 0.00 C ATOM 1453 CZ TYR A 98 99.234 20.266 17.841 1.00 0.00 C ATOM 1454 OH TYR A 98 98.576 20.286 19.054 1.00 0.00 O ATOM 0 H TYR A 98 100.490 22.957 14.220 1.00 0.00 H new ATOM 0 HA TYR A 98 101.267 21.086 12.080 1.00 0.00 H new ATOM 0 HB2 TYR A 98 101.193 19.205 13.616 1.00 0.00 H new ATOM 0 HB3 TYR A 98 102.354 20.368 14.225 1.00 0.00 H new ATOM 0 HD1 TYR A 98 101.800 21.787 16.203 1.00 0.00 H new ATOM 0 HD2 TYR A 98 99.189 18.663 14.840 1.00 0.00 H new ATOM 0 HE1 TYR A 98 100.619 21.823 18.384 1.00 0.00 H new ATOM 0 HE2 TYR A 98 98.003 18.701 17.018 1.00 0.00 H new ATOM 0 HH TYR A 98 97.857 19.621 19.047 1.00 0.00 H new ATOM 1464 N LYS A 99 98.919 20.586 11.648 1.00 0.00 N ATOM 1465 CA LYS A 99 97.537 20.222 11.353 1.00 0.00 C ATOM 1466 C LYS A 99 97.451 18.717 11.128 1.00 0.00 C ATOM 1467 O LYS A 99 98.111 18.184 10.238 1.00 0.00 O ATOM 1468 CB LYS A 99 97.057 20.961 10.102 1.00 0.00 C ATOM 1469 CG LYS A 99 95.569 20.684 9.870 1.00 0.00 C ATOM 1470 CD LYS A 99 94.731 21.486 10.868 1.00 0.00 C ATOM 1471 CE LYS A 99 93.245 21.282 10.566 1.00 0.00 C ATOM 1472 NZ LYS A 99 92.437 21.670 11.757 1.00 0.00 N ATOM 0 H LYS A 99 99.566 20.443 10.872 1.00 0.00 H new ATOM 0 HA LYS A 99 96.902 20.503 12.193 1.00 0.00 H new ATOM 0 HB2 LYS A 99 97.223 22.032 10.216 1.00 0.00 H new ATOM 0 HB3 LYS A 99 97.635 20.640 9.235 1.00 0.00 H new ATOM 0 HG2 LYS A 99 95.294 20.954 8.850 1.00 0.00 H new ATOM 0 HG3 LYS A 99 95.366 19.619 9.983 1.00 0.00 H new ATOM 0 HD2 LYS A 99 94.953 21.166 11.886 1.00 0.00 H new ATOM 0 HD3 LYS A 99 94.984 22.544 10.804 1.00 0.00 H new ATOM 0 HE2 LYS A 99 92.953 21.882 9.704 1.00 0.00 H new ATOM 0 HE3 LYS A 99 93.055 20.240 10.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 91.427 21.531 11.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 92.709 21.080 12.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 92.610 22.670 11.983 1.00 0.00 H new ATOM 1486 N HIS A 100 96.624 18.045 11.924 1.00 0.00 N ATOM 1487 CA HIS A 100 96.505 16.591 11.855 1.00 0.00 C ATOM 1488 C HIS A 100 97.850 15.919 12.158 1.00 0.00 C ATOM 1489 O HIS A 100 98.097 15.526 13.298 1.00 0.00 O ATOM 1490 CB HIS A 100 95.956 16.166 10.487 1.00 0.00 C ATOM 1491 CG HIS A 100 95.736 14.682 10.368 1.00 0.00 C ATOM 1492 ND1 HIS A 100 94.787 14.013 11.124 1.00 0.00 N ATOM 1493 CD2 HIS A 100 96.335 13.725 9.586 1.00 0.00 C ATOM 1494 CE1 HIS A 100 94.841 12.713 10.785 1.00 0.00 C ATOM 1495 NE2 HIS A 100 95.768 12.481 9.852 1.00 0.00 N ATOM 0 H HIS A 100 96.026 18.484 12.624 1.00 0.00 H new ATOM 0 HA HIS A 100 95.798 16.261 12.616 1.00 0.00 H new ATOM 0 HB2 HIS A 100 95.013 16.682 10.306 1.00 0.00 H new ATOM 0 HB3 HIS A 100 96.649 16.487 9.710 1.00 0.00 H new ATOM 0 HD2 HIS A 100 97.125 13.909 8.873 1.00 0.00 H new ATOM 0 HE1 HIS A 100 94.211 11.949 11.215 1.00 0.00 H new ATOM 0 HE2 HIS A 100 96.009 11.586 9.426 1.00 0.00 H new ATOM 1503 N ASP A 101 98.722 15.782 11.157 1.00 0.00 N ATOM 1504 CA ASP A 101 100.046 15.202 11.371 1.00 0.00 C ATOM 1505 C ASP A 101 101.123 16.098 10.766 1.00 0.00 C ATOM 1506 O ASP A 101 101.096 16.397 9.572 1.00 0.00 O ATOM 1507 CB ASP A 101 100.117 13.813 10.732 1.00 0.00 C ATOM 1508 CG ASP A 101 101.445 13.139 11.069 1.00 0.00 C ATOM 1509 OD1 ASP A 101 101.961 13.385 12.148 1.00 0.00 O ATOM 1510 OD2 ASP A 101 101.929 12.386 10.240 1.00 0.00 O ATOM 0 H ASP A 101 98.535 16.064 10.195 1.00 0.00 H new ATOM 0 HA ASP A 101 100.218 15.116 12.444 1.00 0.00 H new ATOM 0 HB2 ASP A 101 99.290 13.199 11.088 1.00 0.00 H new ATOM 0 HB3 ASP A 101 100.009 13.897 9.651 1.00 0.00 H new ATOM 1515 N THR A 102 102.071 16.521 11.596 1.00 0.00 N ATOM 1516 CA THR A 102 103.135 17.409 11.140 1.00 0.00 C ATOM 1517 C THR A 102 103.967 16.753 10.041 1.00 0.00 C ATOM 1518 O THR A 102 104.322 17.394 9.053 1.00 0.00 O ATOM 1519 CB THR A 102 104.045 17.775 12.315 1.00 0.00 C ATOM 1520 OG1 THR A 102 103.257 18.284 13.381 1.00 0.00 O ATOM 1521 CG2 THR A 102 105.055 18.837 11.873 1.00 0.00 C ATOM 0 H THR A 102 102.125 16.265 12.582 1.00 0.00 H new ATOM 0 HA THR A 102 102.673 18.309 10.734 1.00 0.00 H new ATOM 0 HB THR A 102 104.580 16.886 12.649 1.00 0.00 H new ATOM 0 HG1 THR A 102 103.838 18.517 14.135 1.00 0.00 H new ATOM 0 HG21 THR A 102 105.702 19.096 12.712 1.00 0.00 H new ATOM 0 HG22 THR A 102 105.660 18.446 11.055 1.00 0.00 H new ATOM 0 HG23 THR A 102 104.523 19.727 11.537 1.00 0.00 H new ATOM 1529 N SER A 103 104.276 15.473 10.220 1.00 0.00 N ATOM 1530 CA SER A 103 105.107 14.754 9.260 1.00 0.00 C ATOM 1531 C SER A 103 104.312 14.412 8.005 1.00 0.00 C ATOM 1532 O SER A 103 103.082 14.371 8.032 1.00 0.00 O ATOM 1533 CB SER A 103 105.635 13.468 9.895 1.00 0.00 C ATOM 1534 OG SER A 103 104.586 12.510 9.954 1.00 0.00 O ATOM 0 H SER A 103 103.966 14.915 11.015 1.00 0.00 H new ATOM 0 HA SER A 103 105.942 15.396 8.980 1.00 0.00 H new ATOM 0 HB2 SER A 103 106.469 13.076 9.312 1.00 0.00 H new ATOM 0 HB3 SER A 103 106.014 13.672 10.896 1.00 0.00 H new ATOM 0 HG SER A 103 103.728 12.971 10.061 1.00 0.00 H new ATOM 1540 N ASP A 104 105.020 14.165 6.906 1.00 0.00 N ATOM 1541 CA ASP A 104 104.361 13.765 5.667 1.00 0.00 C ATOM 1542 C ASP A 104 104.372 12.245 5.539 1.00 0.00 C ATOM 1543 O ASP A 104 105.436 11.633 5.579 1.00 0.00 O ATOM 1544 CB ASP A 104 105.074 14.389 4.466 1.00 0.00 C ATOM 1545 CG ASP A 104 104.305 14.083 3.185 1.00 0.00 C ATOM 1546 OD1 ASP A 104 103.368 14.808 2.893 1.00 0.00 O ATOM 1547 OD2 ASP A 104 104.662 13.128 2.516 1.00 0.00 O ATOM 0 H ASP A 104 106.036 14.234 6.848 1.00 0.00 H new ATOM 0 HA ASP A 104 103.329 14.116 5.689 1.00 0.00 H new ATOM 0 HB2 ASP A 104 105.156 15.467 4.602 1.00 0.00 H new ATOM 0 HB3 ASP A 104 106.089 13.999 4.392 1.00 0.00 H new ATOM 1552 N TYR A 105 103.197 11.636 5.396 1.00 0.00 N ATOM 1553 CA TYR A 105 103.104 10.178 5.316 1.00 0.00 C ATOM 1554 C TYR A 105 102.438 9.734 4.015 1.00 0.00 C ATOM 1555 O TYR A 105 101.528 10.393 3.512 1.00 0.00 O ATOM 1556 CB TYR A 105 102.318 9.646 6.519 1.00 0.00 C ATOM 1557 CG TYR A 105 100.852 10.018 6.514 1.00 0.00 C ATOM 1558 CD1 TYR A 105 99.919 9.176 5.897 1.00 0.00 C ATOM 1559 CD2 TYR A 105 100.428 11.203 7.127 1.00 0.00 C ATOM 1560 CE1 TYR A 105 98.562 9.519 5.894 1.00 0.00 C ATOM 1561 CE2 TYR A 105 99.071 11.546 7.124 1.00 0.00 C ATOM 1562 CZ TYR A 105 98.138 10.704 6.507 1.00 0.00 C ATOM 1563 OH TYR A 105 96.799 11.042 6.503 1.00 0.00 O ATOM 0 H TYR A 105 102.303 12.123 5.333 1.00 0.00 H new ATOM 0 HA TYR A 105 104.114 9.769 5.330 1.00 0.00 H new ATOM 0 HB2 TYR A 105 102.406 8.560 6.545 1.00 0.00 H new ATOM 0 HB3 TYR A 105 102.775 10.025 7.434 1.00 0.00 H new ATOM 0 HD1 TYR A 105 100.246 8.262 5.424 1.00 0.00 H new ATOM 0 HD2 TYR A 105 101.148 11.853 7.602 1.00 0.00 H new ATOM 0 HE1 TYR A 105 97.842 8.869 5.419 1.00 0.00 H new ATOM 0 HE2 TYR A 105 98.744 12.460 7.597 1.00 0.00 H new ATOM 0 HH TYR A 105 96.675 11.894 6.972 1.00 0.00 H new ATOM 1573 N GLY A 106 102.904 8.607 3.482 1.00 0.00 N ATOM 1574 CA GLY A 106 102.337 8.053 2.258 1.00 0.00 C ATOM 1575 C GLY A 106 102.213 6.537 2.347 1.00 0.00 C ATOM 1576 O GLY A 106 102.894 5.900 3.152 1.00 0.00 O ATOM 0 H GLY A 106 103.670 8.062 3.878 1.00 0.00 H new ATOM 0 HA2 GLY A 106 101.355 8.491 2.078 1.00 0.00 H new ATOM 0 HA3 GLY A 106 102.966 8.320 1.409 1.00 0.00 H new ATOM 1580 N PHE A 107 101.369 5.967 1.491 1.00 0.00 N ATOM 1581 CA PHE A 107 101.153 4.521 1.475 1.00 0.00 C ATOM 1582 C PHE A 107 101.688 3.926 0.176 1.00 0.00 C ATOM 1583 O PHE A 107 101.499 4.507 -0.892 1.00 0.00 O ATOM 1584 CB PHE A 107 99.660 4.215 1.601 1.00 0.00 C ATOM 1585 CG PHE A 107 99.355 2.740 1.715 1.00 0.00 C ATOM 1586 CD1 PHE A 107 99.406 2.108 2.963 1.00 0.00 C ATOM 1587 CD2 PHE A 107 99.020 2.004 0.572 1.00 0.00 C ATOM 1588 CE1 PHE A 107 99.122 0.742 3.069 1.00 0.00 C ATOM 1589 CE2 PHE A 107 98.736 0.637 0.677 1.00 0.00 C ATOM 1590 CZ PHE A 107 98.787 0.006 1.926 1.00 0.00 C ATOM 0 H PHE A 107 100.824 6.482 0.800 1.00 0.00 H new ATOM 0 HA PHE A 107 101.684 4.078 2.317 1.00 0.00 H new ATOM 0 HB2 PHE A 107 99.265 4.729 2.477 1.00 0.00 H new ATOM 0 HB3 PHE A 107 99.140 4.620 0.733 1.00 0.00 H new ATOM 0 HD1 PHE A 107 99.665 2.675 3.845 1.00 0.00 H new ATOM 0 HD2 PHE A 107 98.981 2.491 -0.391 1.00 0.00 H new ATOM 0 HE1 PHE A 107 99.161 0.255 4.032 1.00 0.00 H new ATOM 0 HE2 PHE A 107 98.478 0.070 -0.205 1.00 0.00 H new ATOM 0 HZ PHE A 107 98.568 -1.048 2.008 1.00 0.00 H new ATOM 1600 N SER A 108 102.361 2.778 0.262 1.00 0.00 N ATOM 1601 CA SER A 108 102.952 2.163 -0.924 1.00 0.00 C ATOM 1602 C SER A 108 102.572 0.690 -1.019 1.00 0.00 C ATOM 1603 O SER A 108 102.460 0.006 -0.002 1.00 0.00 O ATOM 1604 CB SER A 108 104.474 2.290 -0.869 1.00 0.00 C ATOM 1605 OG SER A 108 104.824 3.664 -0.762 1.00 0.00 O ATOM 0 H SER A 108 102.509 2.262 1.129 1.00 0.00 H new ATOM 0 HA SER A 108 102.569 2.681 -1.803 1.00 0.00 H new ATOM 0 HB2 SER A 108 104.867 1.735 -0.017 1.00 0.00 H new ATOM 0 HB3 SER A 108 104.920 1.857 -1.765 1.00 0.00 H new ATOM 0 HG SER A 108 105.314 3.940 -1.565 1.00 0.00 H new ATOM 1611 N TYR A 109 102.379 0.211 -2.245 1.00 0.00 N ATOM 1612 CA TYR A 109 102.076 -1.198 -2.469 1.00 0.00 C ATOM 1613 C TYR A 109 102.581 -1.653 -3.838 1.00 0.00 C ATOM 1614 O TYR A 109 102.827 -0.830 -4.718 1.00 0.00 O ATOM 1615 CB TYR A 109 100.565 -1.431 -2.351 1.00 0.00 C ATOM 1616 CG TYR A 109 99.755 -0.814 -3.469 1.00 0.00 C ATOM 1617 CD1 TYR A 109 99.361 0.527 -3.391 1.00 0.00 C ATOM 1618 CD2 TYR A 109 99.400 -1.583 -4.584 1.00 0.00 C ATOM 1619 CE1 TYR A 109 98.612 1.099 -4.425 1.00 0.00 C ATOM 1620 CE2 TYR A 109 98.650 -1.012 -5.619 1.00 0.00 C ATOM 1621 CZ TYR A 109 98.257 0.329 -5.540 1.00 0.00 C ATOM 1622 OH TYR A 109 97.518 0.893 -6.561 1.00 0.00 O ATOM 0 H TYR A 109 102.427 0.775 -3.094 1.00 0.00 H new ATOM 0 HA TYR A 109 102.587 -1.788 -1.709 1.00 0.00 H new ATOM 0 HB2 TYR A 109 100.375 -2.504 -2.328 1.00 0.00 H new ATOM 0 HB3 TYR A 109 100.219 -1.026 -1.400 1.00 0.00 H new ATOM 0 HD1 TYR A 109 99.636 1.121 -2.532 1.00 0.00 H new ATOM 0 HD2 TYR A 109 99.705 -2.617 -4.646 1.00 0.00 H new ATOM 0 HE1 TYR A 109 98.308 2.133 -4.364 1.00 0.00 H new ATOM 0 HE2 TYR A 109 98.375 -1.606 -6.478 1.00 0.00 H new ATOM 0 HH TYR A 109 97.359 0.223 -7.258 1.00 0.00 H new ATOM 1632 N GLY A 110 102.746 -2.963 -4.009 1.00 0.00 N ATOM 1633 CA GLY A 110 103.165 -3.505 -5.298 1.00 0.00 C ATOM 1634 C GLY A 110 103.345 -5.018 -5.234 1.00 0.00 C ATOM 1635 O GLY A 110 103.050 -5.640 -4.217 1.00 0.00 O ATOM 0 H GLY A 110 102.598 -3.661 -3.280 1.00 0.00 H new ATOM 0 HA2 GLY A 110 102.423 -3.257 -6.057 1.00 0.00 H new ATOM 0 HA3 GLY A 110 104.101 -3.038 -5.603 1.00 0.00 H new ATOM 1639 N ALA A 111 103.836 -5.601 -6.324 1.00 0.00 N ATOM 1640 CA ALA A 111 104.069 -7.042 -6.379 1.00 0.00 C ATOM 1641 C ALA A 111 105.396 -7.332 -7.075 1.00 0.00 C ATOM 1642 O ALA A 111 105.905 -6.489 -7.815 1.00 0.00 O ATOM 1643 CB ALA A 111 102.931 -7.729 -7.137 1.00 0.00 C ATOM 0 H ALA A 111 104.080 -5.100 -7.179 1.00 0.00 H new ATOM 0 HA ALA A 111 104.107 -7.429 -5.361 1.00 0.00 H new ATOM 0 HB1 ALA A 111 103.114 -8.803 -7.173 1.00 0.00 H new ATOM 0 HB2 ALA A 111 101.987 -7.538 -6.627 1.00 0.00 H new ATOM 0 HB3 ALA A 111 102.881 -7.336 -8.152 1.00 0.00 H new ATOM 1649 N GLY A 112 105.954 -8.519 -6.839 1.00 0.00 N ATOM 1650 CA GLY A 112 107.251 -8.855 -7.417 1.00 0.00 C ATOM 1651 C GLY A 112 107.367 -10.344 -7.723 1.00 0.00 C ATOM 1652 O GLY A 112 106.591 -11.155 -7.217 1.00 0.00 O ATOM 0 H GLY A 112 105.537 -9.250 -6.263 1.00 0.00 H new ATOM 0 HA2 GLY A 112 107.400 -8.283 -8.333 1.00 0.00 H new ATOM 0 HA3 GLY A 112 108.043 -8.563 -6.727 1.00 0.00 H new ATOM 1656 N LEU A 113 108.361 -10.682 -8.543 1.00 0.00 N ATOM 1657 CA LEU A 113 108.595 -12.063 -8.951 1.00 0.00 C ATOM 1658 C LEU A 113 110.047 -12.446 -8.685 1.00 0.00 C ATOM 1659 O LEU A 113 110.937 -11.598 -8.765 1.00 0.00 O ATOM 1660 CB LEU A 113 108.294 -12.233 -10.444 1.00 0.00 C ATOM 1661 CG LEU A 113 106.868 -11.773 -10.757 1.00 0.00 C ATOM 1662 CD1 LEU A 113 106.623 -11.864 -12.265 1.00 0.00 C ATOM 1663 CD2 LEU A 113 105.866 -12.672 -10.029 1.00 0.00 C ATOM 0 H LEU A 113 109.020 -10.012 -8.939 1.00 0.00 H new ATOM 0 HA LEU A 113 107.935 -12.711 -8.374 1.00 0.00 H new ATOM 0 HB2 LEU A 113 109.007 -11.656 -11.033 1.00 0.00 H new ATOM 0 HB3 LEU A 113 108.417 -13.278 -10.730 1.00 0.00 H new ATOM 0 HG LEU A 113 106.741 -10.743 -10.425 1.00 0.00 H new ATOM 0 HD11 LEU A 113 105.608 -11.537 -12.489 1.00 0.00 H new ATOM 0 HD12 LEU A 113 107.334 -11.225 -12.788 1.00 0.00 H new ATOM 0 HD13 LEU A 113 106.752 -12.895 -12.593 1.00 0.00 H new ATOM 0 HD21 LEU A 113 104.852 -12.342 -10.253 1.00 0.00 H new ATOM 0 HD22 LEU A 113 105.994 -13.703 -10.360 1.00 0.00 H new ATOM 0 HD23 LEU A 113 106.037 -12.612 -8.954 1.00 0.00 H new ATOM 1675 N GLN A 114 110.277 -13.717 -8.367 1.00 0.00 N ATOM 1676 CA GLN A 114 111.631 -14.213 -8.129 1.00 0.00 C ATOM 1677 C GLN A 114 112.057 -15.143 -9.262 1.00 0.00 C ATOM 1678 O GLN A 114 111.323 -16.059 -9.631 1.00 0.00 O ATOM 1679 CB GLN A 114 111.684 -14.968 -6.799 1.00 0.00 C ATOM 1680 CG GLN A 114 113.131 -15.363 -6.490 1.00 0.00 C ATOM 1681 CD GLN A 114 113.228 -16.074 -5.140 1.00 0.00 C ATOM 1682 OE1 GLN A 114 112.258 -16.135 -4.383 1.00 0.00 O ATOM 1683 NE2 GLN A 114 114.359 -16.622 -4.789 1.00 0.00 N ATOM 0 H GLN A 114 109.546 -14.421 -8.268 1.00 0.00 H new ATOM 0 HA GLN A 114 112.313 -13.364 -8.089 1.00 0.00 H new ATOM 0 HB2 GLN A 114 111.288 -14.343 -5.998 1.00 0.00 H new ATOM 0 HB3 GLN A 114 111.056 -15.858 -6.849 1.00 0.00 H new ATOM 0 HG2 GLN A 114 113.510 -16.015 -7.277 1.00 0.00 H new ATOM 0 HG3 GLN A 114 113.761 -14.474 -6.483 1.00 0.00 H new ATOM 0 HE21 GLN A 114 115.164 -16.574 -5.413 1.00 0.00 H new ATOM 0 HE22 GLN A 114 114.438 -17.099 -3.891 1.00 0.00 H new ATOM 1692 N PHE A 115 113.246 -14.906 -9.812 1.00 0.00 N ATOM 1693 CA PHE A 115 113.740 -15.702 -10.934 1.00 0.00 C ATOM 1694 C PHE A 115 115.081 -16.340 -10.595 1.00 0.00 C ATOM 1695 O PHE A 115 115.807 -15.843 -9.735 1.00 0.00 O ATOM 1696 CB PHE A 115 113.897 -14.813 -12.170 1.00 0.00 C ATOM 1697 CG PHE A 115 112.597 -14.209 -12.645 1.00 0.00 C ATOM 1698 CD1 PHE A 115 111.754 -14.940 -13.492 1.00 0.00 C ATOM 1699 CD2 PHE A 115 112.233 -12.920 -12.240 1.00 0.00 C ATOM 1700 CE1 PHE A 115 110.549 -14.381 -13.932 1.00 0.00 C ATOM 1701 CE2 PHE A 115 111.029 -12.361 -12.681 1.00 0.00 C ATOM 1702 CZ PHE A 115 110.186 -13.091 -13.527 1.00 0.00 C ATOM 0 H PHE A 115 113.883 -14.173 -9.501 1.00 0.00 H new ATOM 0 HA PHE A 115 113.018 -16.493 -11.138 1.00 0.00 H new ATOM 0 HB2 PHE A 115 114.600 -14.011 -11.944 1.00 0.00 H new ATOM 0 HB3 PHE A 115 114.332 -15.401 -12.978 1.00 0.00 H new ATOM 0 HD1 PHE A 115 112.034 -15.935 -13.805 1.00 0.00 H new ATOM 0 HD2 PHE A 115 112.882 -12.356 -11.586 1.00 0.00 H new ATOM 0 HE1 PHE A 115 109.899 -14.945 -14.584 1.00 0.00 H new ATOM 0 HE2 PHE A 115 110.750 -11.366 -12.369 1.00 0.00 H new ATOM 0 HZ PHE A 115 109.256 -12.659 -13.867 1.00 0.00 H new ATOM 1712 N ASN A 116 115.398 -17.431 -11.289 1.00 0.00 N ATOM 1713 CA ASN A 116 116.651 -18.151 -11.075 1.00 0.00 C ATOM 1714 C ASN A 116 116.680 -18.787 -9.679 1.00 0.00 C ATOM 1715 O ASN A 116 117.363 -18.287 -8.782 1.00 0.00 O ATOM 1716 CB ASN A 116 117.858 -17.223 -11.265 1.00 0.00 C ATOM 1717 CG ASN A 116 117.769 -16.503 -12.608 1.00 0.00 C ATOM 1718 OD1 ASN A 116 116.908 -15.644 -12.797 1.00 0.00 O ATOM 1719 ND2 ASN A 116 118.612 -16.806 -13.556 1.00 0.00 N ATOM 0 H ASN A 116 114.800 -17.838 -12.009 1.00 0.00 H new ATOM 0 HA ASN A 116 116.712 -18.946 -11.819 1.00 0.00 H new ATOM 0 HB2 ASN A 116 117.895 -16.494 -10.456 1.00 0.00 H new ATOM 0 HB3 ASN A 116 118.781 -17.801 -11.215 1.00 0.00 H new ATOM 0 HD21 ASN A 116 118.559 -16.331 -14.457 1.00 0.00 H new ATOM 0 HD22 ASN A 116 119.324 -17.518 -13.396 1.00 0.00 H new ATOM 1726 N PRO A 117 115.950 -19.863 -9.463 1.00 0.00 N ATOM 1727 CA PRO A 117 115.950 -20.558 -8.144 1.00 0.00 C ATOM 1728 C PRO A 117 117.082 -21.576 -8.029 1.00 0.00 C ATOM 1729 O PRO A 117 117.857 -21.549 -7.072 1.00 0.00 O ATOM 1730 CB PRO A 117 114.587 -21.248 -8.106 1.00 0.00 C ATOM 1731 CG PRO A 117 114.244 -21.533 -9.531 1.00 0.00 C ATOM 1732 CD PRO A 117 115.037 -20.553 -10.400 1.00 0.00 C ATOM 0 HA PRO A 117 116.109 -19.869 -7.315 1.00 0.00 H new ATOM 0 HB2 PRO A 117 114.629 -22.167 -7.521 1.00 0.00 H new ATOM 0 HB3 PRO A 117 113.836 -20.608 -7.642 1.00 0.00 H new ATOM 0 HG2 PRO A 117 114.495 -22.562 -9.787 1.00 0.00 H new ATOM 0 HG3 PRO A 117 113.174 -21.415 -9.699 1.00 0.00 H new ATOM 0 HD2 PRO A 117 115.592 -21.076 -11.179 1.00 0.00 H new ATOM 0 HD3 PRO A 117 114.376 -19.845 -10.900 1.00 0.00 H new ATOM 1740 N MET A 118 117.174 -22.472 -9.008 1.00 0.00 N ATOM 1741 CA MET A 118 118.233 -23.479 -9.008 1.00 0.00 C ATOM 1742 C MET A 118 119.607 -22.812 -8.966 1.00 0.00 C ATOM 1743 O MET A 118 120.519 -23.294 -8.293 1.00 0.00 O ATOM 1744 CB MET A 118 118.128 -24.341 -10.271 1.00 0.00 C ATOM 1745 CG MET A 118 116.783 -25.076 -10.311 1.00 0.00 C ATOM 1746 SD MET A 118 116.596 -26.150 -8.865 1.00 0.00 S ATOM 1747 CE MET A 118 117.980 -27.263 -9.216 1.00 0.00 C ATOM 0 H MET A 118 116.537 -22.523 -9.803 1.00 0.00 H new ATOM 0 HA MET A 118 118.115 -24.105 -8.123 1.00 0.00 H new ATOM 0 HB2 MET A 118 118.232 -23.713 -11.156 1.00 0.00 H new ATOM 0 HB3 MET A 118 118.944 -25.063 -10.294 1.00 0.00 H new ATOM 0 HG2 MET A 118 115.968 -24.352 -10.340 1.00 0.00 H new ATOM 0 HG3 MET A 118 116.715 -25.670 -11.222 1.00 0.00 H new ATOM 0 HE1 MET A 118 117.802 -28.227 -8.739 1.00 0.00 H new ATOM 0 HE2 MET A 118 118.071 -27.402 -10.293 1.00 0.00 H new ATOM 0 HE3 MET A 118 118.902 -26.831 -8.827 1.00 0.00 H new ATOM 1757 N GLU A 119 119.749 -21.703 -9.685 1.00 0.00 N ATOM 1758 CA GLU A 119 120.988 -20.936 -9.666 1.00 0.00 C ATOM 1759 C GLU A 119 121.275 -20.472 -8.241 1.00 0.00 C ATOM 1760 O GLU A 119 120.354 -20.327 -7.437 1.00 0.00 O ATOM 1761 CB GLU A 119 120.847 -19.730 -10.604 1.00 0.00 C ATOM 1762 CG GLU A 119 122.207 -19.047 -10.808 1.00 0.00 C ATOM 1763 CD GLU A 119 122.091 -17.797 -11.688 1.00 0.00 C ATOM 1764 OE1 GLU A 119 120.992 -17.451 -12.100 1.00 0.00 O ATOM 1765 OE2 GLU A 119 123.120 -17.193 -11.942 1.00 0.00 O ATOM 0 H GLU A 119 119.022 -21.316 -10.287 1.00 0.00 H new ATOM 0 HA GLU A 119 121.817 -21.556 -10.006 1.00 0.00 H new ATOM 0 HB2 GLU A 119 120.448 -20.054 -11.565 1.00 0.00 H new ATOM 0 HB3 GLU A 119 120.135 -19.018 -10.187 1.00 0.00 H new ATOM 0 HG2 GLU A 119 122.624 -18.772 -9.839 1.00 0.00 H new ATOM 0 HG3 GLU A 119 122.902 -19.751 -11.266 1.00 0.00 H new ATOM 1772 N ASN A 120 122.547 -20.241 -7.928 1.00 0.00 N ATOM 1773 CA ASN A 120 122.920 -19.819 -6.577 1.00 0.00 C ATOM 1774 C ASN A 120 122.704 -18.316 -6.339 1.00 0.00 C ATOM 1775 O ASN A 120 123.078 -17.801 -5.285 1.00 0.00 O ATOM 1776 CB ASN A 120 124.390 -20.158 -6.325 1.00 0.00 C ATOM 1777 CG ASN A 120 124.623 -21.652 -6.525 1.00 0.00 C ATOM 1778 OD1 ASN A 120 125.583 -22.048 -7.187 1.00 0.00 O ATOM 1779 ND2 ASN A 120 123.799 -22.510 -5.989 1.00 0.00 N ATOM 0 H ASN A 120 123.327 -20.336 -8.578 1.00 0.00 H new ATOM 0 HA ASN A 120 122.271 -20.356 -5.885 1.00 0.00 H new ATOM 0 HB2 ASN A 120 125.025 -19.589 -7.004 1.00 0.00 H new ATOM 0 HB3 ASN A 120 124.669 -19.871 -5.311 1.00 0.00 H new ATOM 0 HD21 ASN A 120 123.949 -23.511 -6.118 1.00 0.00 H new ATOM 0 HD22 ASN A 120 123.004 -22.180 -5.441 1.00 0.00 H new ATOM 1786 N VAL A 121 122.107 -17.609 -7.301 1.00 0.00 N ATOM 1787 CA VAL A 121 121.746 -16.209 -7.113 1.00 0.00 C ATOM 1788 C VAL A 121 120.310 -15.984 -7.576 1.00 0.00 C ATOM 1789 O VAL A 121 119.881 -16.548 -8.583 1.00 0.00 O ATOM 1790 CB VAL A 121 122.698 -15.308 -7.905 1.00 0.00 C ATOM 1791 CG1 VAL A 121 124.123 -15.488 -7.379 1.00 0.00 C ATOM 1792 CG2 VAL A 121 122.655 -15.686 -9.388 1.00 0.00 C ATOM 0 H VAL A 121 121.865 -17.986 -8.217 1.00 0.00 H new ATOM 0 HA VAL A 121 121.826 -15.959 -6.055 1.00 0.00 H new ATOM 0 HB VAL A 121 122.391 -14.269 -7.788 1.00 0.00 H new ATOM 0 HG11 VAL A 121 124.802 -14.847 -7.942 1.00 0.00 H new ATOM 0 HG12 VAL A 121 124.158 -15.216 -6.324 1.00 0.00 H new ATOM 0 HG13 VAL A 121 124.425 -16.529 -7.496 1.00 0.00 H new ATOM 0 HG21 VAL A 121 123.334 -15.042 -9.947 1.00 0.00 H new ATOM 0 HG22 VAL A 121 122.960 -16.726 -9.507 1.00 0.00 H new ATOM 0 HG23 VAL A 121 121.641 -15.560 -9.766 1.00 0.00 H new ATOM 1802 N ALA A 122 119.568 -15.162 -6.840 1.00 0.00 N ATOM 1803 CA ALA A 122 118.168 -14.901 -7.170 1.00 0.00 C ATOM 1804 C ALA A 122 117.979 -13.441 -7.562 1.00 0.00 C ATOM 1805 O ALA A 122 118.610 -12.555 -6.987 1.00 0.00 O ATOM 1806 CB ALA A 122 117.281 -15.223 -5.966 1.00 0.00 C ATOM 0 H ALA A 122 119.909 -14.667 -6.016 1.00 0.00 H new ATOM 0 HA ALA A 122 117.886 -15.535 -8.011 1.00 0.00 H new ATOM 0 HB1 ALA A 122 116.239 -15.026 -6.219 1.00 0.00 H new ATOM 0 HB2 ALA A 122 117.398 -16.273 -5.699 1.00 0.00 H new ATOM 0 HB3 ALA A 122 117.573 -14.599 -5.121 1.00 0.00 H new ATOM 1812 N LEU A 123 117.103 -13.201 -8.534 1.00 0.00 N ATOM 1813 CA LEU A 123 116.826 -11.845 -8.998 1.00 0.00 C ATOM 1814 C LEU A 123 115.401 -11.467 -8.614 1.00 0.00 C ATOM 1815 O LEU A 123 114.489 -12.279 -8.757 1.00 0.00 O ATOM 1816 CB LEU A 123 116.979 -11.729 -10.527 1.00 0.00 C ATOM 1817 CG LEU A 123 118.404 -12.035 -11.039 1.00 0.00 C ATOM 1818 CD1 LEU A 123 119.477 -11.292 -10.233 1.00 0.00 C ATOM 1819 CD2 LEU A 123 118.682 -13.540 -10.996 1.00 0.00 C ATOM 0 H LEU A 123 116.573 -13.928 -9.015 1.00 0.00 H new ATOM 0 HA LEU A 123 117.544 -11.172 -8.529 1.00 0.00 H new ATOM 0 HB2 LEU A 123 116.277 -12.412 -11.005 1.00 0.00 H new ATOM 0 HB3 LEU A 123 116.702 -10.721 -10.834 1.00 0.00 H new ATOM 0 HG LEU A 123 118.452 -11.685 -12.070 1.00 0.00 H new ATOM 0 HD11 LEU A 123 120.463 -11.537 -10.628 1.00 0.00 H new ATOM 0 HD12 LEU A 123 119.311 -10.217 -10.311 1.00 0.00 H new ATOM 0 HD13 LEU A 123 119.420 -11.593 -9.187 1.00 0.00 H new ATOM 0 HD21 LEU A 123 119.691 -13.734 -11.361 1.00 0.00 H new ATOM 0 HD22 LEU A 123 118.592 -13.897 -9.970 1.00 0.00 H new ATOM 0 HD23 LEU A 123 117.962 -14.061 -11.626 1.00 0.00 H new ATOM 1831 N ASP A 124 115.208 -10.243 -8.128 1.00 0.00 N ATOM 1832 CA ASP A 124 113.880 -9.797 -7.717 1.00 0.00 C ATOM 1833 C ASP A 124 113.470 -8.562 -8.507 1.00 0.00 C ATOM 1834 O ASP A 124 114.214 -7.582 -8.561 1.00 0.00 O ATOM 1835 CB ASP A 124 113.886 -9.465 -6.222 1.00 0.00 C ATOM 1836 CG ASP A 124 114.216 -10.711 -5.403 1.00 0.00 C ATOM 1837 OD1 ASP A 124 113.854 -11.796 -5.828 1.00 0.00 O ATOM 1838 OD2 ASP A 124 114.830 -10.559 -4.359 1.00 0.00 O ATOM 0 H ASP A 124 115.946 -9.549 -8.010 1.00 0.00 H new ATOM 0 HA ASP A 124 113.166 -10.598 -7.912 1.00 0.00 H new ATOM 0 HB2 ASP A 124 114.619 -8.684 -6.019 1.00 0.00 H new ATOM 0 HB3 ASP A 124 112.913 -9.074 -5.926 1.00 0.00 H new ATOM 1843 N PHE A 125 112.293 -8.628 -9.126 1.00 0.00 N ATOM 1844 CA PHE A 125 111.749 -7.488 -9.858 1.00 0.00 C ATOM 1845 C PHE A 125 110.380 -7.133 -9.292 1.00 0.00 C ATOM 1846 O PHE A 125 109.549 -8.017 -9.096 1.00 0.00 O ATOM 1847 CB PHE A 125 111.618 -7.835 -11.343 1.00 0.00 C ATOM 1848 CG PHE A 125 112.938 -8.160 -12.003 1.00 0.00 C ATOM 1849 CD1 PHE A 125 113.741 -7.129 -12.505 1.00 0.00 C ATOM 1850 CD2 PHE A 125 113.357 -9.491 -12.111 1.00 0.00 C ATOM 1851 CE1 PHE A 125 114.965 -7.431 -13.116 1.00 0.00 C ATOM 1852 CE2 PHE A 125 114.580 -9.792 -12.722 1.00 0.00 C ATOM 1853 CZ PHE A 125 115.384 -8.763 -13.224 1.00 0.00 C ATOM 0 H PHE A 125 111.699 -9.457 -9.135 1.00 0.00 H new ATOM 0 HA PHE A 125 112.421 -6.637 -9.751 1.00 0.00 H new ATOM 0 HB2 PHE A 125 110.947 -8.687 -11.451 1.00 0.00 H new ATOM 0 HB3 PHE A 125 111.156 -6.997 -11.865 1.00 0.00 H new ATOM 0 HD1 PHE A 125 113.417 -6.102 -12.421 1.00 0.00 H new ATOM 0 HD2 PHE A 125 112.737 -10.286 -11.723 1.00 0.00 H new ATOM 0 HE1 PHE A 125 115.585 -6.637 -13.504 1.00 0.00 H new ATOM 0 HE2 PHE A 125 114.903 -10.819 -12.806 1.00 0.00 H new ATOM 0 HZ PHE A 125 116.328 -8.996 -13.695 1.00 0.00 H new ATOM 1863 N SER A 126 110.149 -5.850 -9.031 1.00 0.00 N ATOM 1864 CA SER A 126 108.887 -5.429 -8.429 1.00 0.00 C ATOM 1865 C SER A 126 108.420 -4.093 -8.995 1.00 0.00 C ATOM 1866 O SER A 126 109.230 -3.243 -9.367 1.00 0.00 O ATOM 1867 CB SER A 126 109.053 -5.309 -6.914 1.00 0.00 C ATOM 1868 OG SER A 126 107.791 -5.013 -6.328 1.00 0.00 O ATOM 0 H SER A 126 110.807 -5.094 -9.223 1.00 0.00 H new ATOM 0 HA SER A 126 108.134 -6.182 -8.663 1.00 0.00 H new ATOM 0 HB2 SER A 126 109.449 -6.238 -6.505 1.00 0.00 H new ATOM 0 HB3 SER A 126 109.771 -4.525 -6.676 1.00 0.00 H new ATOM 0 HG SER A 126 107.078 -5.421 -6.863 1.00 0.00 H new ATOM 1874 N TYR A 127 107.103 -3.918 -9.053 1.00 0.00 N ATOM 1875 CA TYR A 127 106.517 -2.650 -9.471 1.00 0.00 C ATOM 1876 C TYR A 127 105.847 -1.989 -8.272 1.00 0.00 C ATOM 1877 O TYR A 127 104.914 -2.544 -7.691 1.00 0.00 O ATOM 1878 CB TYR A 127 105.478 -2.891 -10.567 1.00 0.00 C ATOM 1879 CG TYR A 127 106.010 -3.681 -11.740 1.00 0.00 C ATOM 1880 CD1 TYR A 127 106.699 -3.030 -12.770 1.00 0.00 C ATOM 1881 CD2 TYR A 127 105.813 -5.066 -11.796 1.00 0.00 C ATOM 1882 CE1 TYR A 127 107.190 -3.764 -13.856 1.00 0.00 C ATOM 1883 CE2 TYR A 127 106.304 -5.800 -12.883 1.00 0.00 C ATOM 1884 CZ TYR A 127 106.992 -5.149 -13.912 1.00 0.00 C ATOM 1885 OH TYR A 127 107.477 -5.872 -14.983 1.00 0.00 O ATOM 0 H TYR A 127 106.422 -4.639 -8.816 1.00 0.00 H new ATOM 0 HA TYR A 127 107.301 -2.001 -9.861 1.00 0.00 H new ATOM 0 HB2 TYR A 127 104.627 -3.420 -10.139 1.00 0.00 H new ATOM 0 HB3 TYR A 127 105.109 -1.930 -10.924 1.00 0.00 H new ATOM 0 HD1 TYR A 127 106.852 -1.962 -12.727 1.00 0.00 H new ATOM 0 HD2 TYR A 127 105.282 -5.568 -11.001 1.00 0.00 H new ATOM 0 HE1 TYR A 127 107.722 -3.262 -14.651 1.00 0.00 H new ATOM 0 HE2 TYR A 127 106.151 -6.868 -12.927 1.00 0.00 H new ATOM 0 HH TYR A 127 107.255 -6.819 -14.866 1.00 0.00 H new ATOM 1895 N GLU A 128 106.321 -0.803 -7.902 1.00 0.00 N ATOM 1896 CA GLU A 128 105.819 -0.123 -6.710 1.00 0.00 C ATOM 1897 C GLU A 128 105.198 1.225 -7.059 1.00 0.00 C ATOM 1898 O GLU A 128 105.756 2.000 -7.834 1.00 0.00 O ATOM 1899 CB GLU A 128 106.967 0.093 -5.721 1.00 0.00 C ATOM 1900 CG GLU A 128 106.411 0.636 -4.399 1.00 0.00 C ATOM 1901 CD GLU A 128 107.525 0.959 -3.397 1.00 0.00 C ATOM 1902 OE1 GLU A 128 108.692 0.795 -3.724 1.00 0.00 O ATOM 1903 OE2 GLU A 128 107.189 1.371 -2.300 1.00 0.00 O ATOM 0 H GLU A 128 107.048 -0.295 -8.406 1.00 0.00 H new ATOM 0 HA GLU A 128 105.049 -0.751 -6.263 1.00 0.00 H new ATOM 0 HB2 GLU A 128 107.493 -0.846 -5.548 1.00 0.00 H new ATOM 0 HB3 GLU A 128 107.692 0.792 -6.137 1.00 0.00 H new ATOM 0 HG2 GLU A 128 105.827 1.535 -4.594 1.00 0.00 H new ATOM 0 HG3 GLU A 128 105.732 -0.097 -3.963 1.00 0.00 H new ATOM 1910 N GLN A 129 104.031 1.489 -6.480 1.00 0.00 N ATOM 1911 CA GLN A 129 103.379 2.787 -6.620 1.00 0.00 C ATOM 1912 C GLN A 129 103.106 3.369 -5.239 1.00 0.00 C ATOM 1913 O GLN A 129 102.742 2.637 -4.317 1.00 0.00 O ATOM 1914 CB GLN A 129 102.062 2.632 -7.384 1.00 0.00 C ATOM 1915 CG GLN A 129 102.352 2.151 -8.809 1.00 0.00 C ATOM 1916 CD GLN A 129 101.050 1.904 -9.567 1.00 0.00 C ATOM 1917 OE1 GLN A 129 99.985 1.763 -8.962 1.00 0.00 O ATOM 1918 NE2 GLN A 129 101.070 1.845 -10.871 1.00 0.00 N ATOM 0 H GLN A 129 103.516 0.820 -5.908 1.00 0.00 H new ATOM 0 HA GLN A 129 104.033 3.459 -7.175 1.00 0.00 H new ATOM 0 HB2 GLN A 129 101.414 1.920 -6.873 1.00 0.00 H new ATOM 0 HB3 GLN A 129 101.531 3.583 -7.411 1.00 0.00 H new ATOM 0 HG2 GLN A 129 102.950 2.895 -9.335 1.00 0.00 H new ATOM 0 HG3 GLN A 129 102.940 1.234 -8.777 1.00 0.00 H new ATOM 0 HE21 GLN A 129 101.950 1.961 -11.373 1.00 0.00 H new ATOM 0 HE22 GLN A 129 100.206 1.683 -11.387 1.00 0.00 H new ATOM 1927 N SER A 130 103.292 4.679 -5.094 1.00 0.00 N ATOM 1928 CA SER A 130 103.078 5.337 -3.808 1.00 0.00 C ATOM 1929 C SER A 130 102.213 6.577 -3.986 1.00 0.00 C ATOM 1930 O SER A 130 102.396 7.339 -4.935 1.00 0.00 O ATOM 1931 CB SER A 130 104.423 5.733 -3.197 1.00 0.00 C ATOM 1932 OG SER A 130 105.227 4.572 -3.047 1.00 0.00 O ATOM 0 H SER A 130 103.588 5.302 -5.845 1.00 0.00 H new ATOM 0 HA SER A 130 102.567 4.642 -3.141 1.00 0.00 H new ATOM 0 HB2 SER A 130 104.927 6.459 -3.836 1.00 0.00 H new ATOM 0 HB3 SER A 130 104.270 6.212 -2.230 1.00 0.00 H new ATOM 0 HG SER A 130 104.685 3.774 -3.221 1.00 0.00 H new ATOM 1938 N ARG A 131 101.265 6.770 -3.074 1.00 0.00 N ATOM 1939 CA ARG A 131 100.373 7.925 -3.133 1.00 0.00 C ATOM 1940 C ARG A 131 100.519 8.786 -1.882 1.00 0.00 C ATOM 1941 O ARG A 131 100.472 8.274 -0.761 1.00 0.00 O ATOM 1942 CB ARG A 131 98.923 7.445 -3.260 1.00 0.00 C ATOM 1943 CG ARG A 131 97.974 8.635 -3.445 1.00 0.00 C ATOM 1944 CD ARG A 131 98.073 9.167 -4.877 1.00 0.00 C ATOM 1945 NE ARG A 131 97.210 10.340 -5.040 1.00 0.00 N ATOM 1946 CZ ARG A 131 96.889 10.864 -6.234 1.00 0.00 C ATOM 1947 NH1 ARG A 131 97.329 10.357 -7.361 1.00 0.00 N ATOM 1948 NH2 ARG A 131 96.112 11.912 -6.275 1.00 0.00 N ATOM 0 H ARG A 131 101.094 6.144 -2.287 1.00 0.00 H new ATOM 0 HA ARG A 131 100.641 8.527 -4.001 1.00 0.00 H new ATOM 0 HB2 ARG A 131 98.832 6.766 -4.107 1.00 0.00 H new ATOM 0 HB3 ARG A 131 98.641 6.883 -2.369 1.00 0.00 H new ATOM 0 HG2 ARG A 131 96.949 8.330 -3.232 1.00 0.00 H new ATOM 0 HG3 ARG A 131 98.225 9.425 -2.737 1.00 0.00 H new ATOM 0 HD2 ARG A 131 99.106 9.431 -5.104 1.00 0.00 H new ATOM 0 HD3 ARG A 131 97.780 8.390 -5.583 1.00 0.00 H new ATOM 0 HE ARG A 131 96.833 10.782 -4.202 1.00 0.00 H new ATOM 0 HH11 ARG A 131 97.936 9.538 -7.349 1.00 0.00 H new ATOM 0 HH12 ARG A 131 97.064 10.782 -8.249 1.00 0.00 H new ATOM 0 HH21 ARG A 131 95.759 12.319 -5.409 1.00 0.00 H new ATOM 0 HH22 ARG A 131 95.858 12.323 -7.173 1.00 0.00 H new ATOM 1962 N ILE A 132 100.729 10.086 -2.086 1.00 0.00 N ATOM 1963 CA ILE A 132 100.639 11.052 -1.000 1.00 0.00 C ATOM 1964 C ILE A 132 99.681 12.115 -1.492 1.00 0.00 C ATOM 1965 O ILE A 132 100.089 12.907 -2.335 1.00 0.00 O ATOM 1966 CB ILE A 132 102.007 11.679 -0.714 1.00 0.00 C ATOM 1967 CG1 ILE A 132 102.998 10.586 -0.318 1.00 0.00 C ATOM 1968 CG2 ILE A 132 101.883 12.686 0.431 1.00 0.00 C ATOM 1969 CD1 ILE A 132 104.418 11.156 -0.317 1.00 0.00 C ATOM 0 H ILE A 132 100.962 10.491 -2.993 1.00 0.00 H new ATOM 0 HA ILE A 132 100.302 10.583 -0.075 1.00 0.00 H new ATOM 0 HB ILE A 132 102.362 12.188 -1.610 1.00 0.00 H new ATOM 0 HG12 ILE A 132 102.751 10.197 0.670 1.00 0.00 H new ATOM 0 HG13 ILE A 132 102.931 9.751 -1.015 1.00 0.00 H new ATOM 0 HG21 ILE A 132 102.858 13.130 0.632 1.00 0.00 H new ATOM 0 HG22 ILE A 132 101.178 13.469 0.152 1.00 0.00 H new ATOM 0 HG23 ILE A 132 101.525 12.177 1.326 1.00 0.00 H new ATOM 0 HD11 ILE A 132 105.123 10.375 -0.034 1.00 0.00 H new ATOM 0 HD12 ILE A 132 104.663 11.523 -1.314 1.00 0.00 H new ATOM 0 HD13 ILE A 132 104.480 11.977 0.398 1.00 0.00 H new ATOM 1981 N ARG A 133 98.448 12.139 -0.969 1.00 0.00 N ATOM 1982 CA ARG A 133 97.331 12.788 -1.668 1.00 0.00 C ATOM 1983 C ARG A 133 97.699 14.149 -2.269 1.00 0.00 C ATOM 1984 O ARG A 133 97.623 15.191 -1.621 1.00 0.00 O ATOM 1985 CB ARG A 133 96.125 12.876 -0.718 1.00 0.00 C ATOM 1986 CG ARG A 133 96.452 13.696 0.537 1.00 0.00 C ATOM 1987 CD ARG A 133 95.350 13.476 1.576 1.00 0.00 C ATOM 1988 NE ARG A 133 95.574 14.336 2.741 1.00 0.00 N ATOM 1989 CZ ARG A 133 94.753 14.376 3.801 1.00 0.00 C ATOM 1990 NH1 ARG A 133 93.671 13.638 3.876 1.00 0.00 N ATOM 1991 NH2 ARG A 133 95.041 15.175 4.792 1.00 0.00 N ATOM 0 H ARG A 133 98.200 11.721 -0.072 1.00 0.00 H new ATOM 0 HA ARG A 133 97.066 12.172 -2.527 1.00 0.00 H new ATOM 0 HB2 ARG A 133 95.282 13.329 -1.240 1.00 0.00 H new ATOM 0 HB3 ARG A 133 95.817 11.872 -0.427 1.00 0.00 H new ATOM 0 HG2 ARG A 133 97.418 13.395 0.943 1.00 0.00 H new ATOM 0 HG3 ARG A 133 96.528 14.754 0.286 1.00 0.00 H new ATOM 0 HD2 ARG A 133 94.377 13.693 1.136 1.00 0.00 H new ATOM 0 HD3 ARG A 133 95.334 12.431 1.884 1.00 0.00 H new ATOM 0 HE ARG A 133 96.398 14.936 2.746 1.00 0.00 H new ATOM 0 HH11 ARG A 133 93.430 13.007 3.112 1.00 0.00 H new ATOM 0 HH12 ARG A 133 93.070 13.695 4.698 1.00 0.00 H new ATOM 0 HH21 ARG A 133 95.879 15.756 4.752 1.00 0.00 H new ATOM 0 HH22 ARG A 133 94.428 15.219 5.606 1.00 0.00 H new ATOM 2005 N SER A 134 98.059 14.070 -3.560 1.00 0.00 N ATOM 2006 CA SER A 134 98.536 15.187 -4.389 1.00 0.00 C ATOM 2007 C SER A 134 99.505 14.652 -5.443 1.00 0.00 C ATOM 2008 O SER A 134 99.350 14.918 -6.635 1.00 0.00 O ATOM 2009 CB SER A 134 99.282 16.270 -3.598 1.00 0.00 C ATOM 2010 OG SER A 134 100.290 15.658 -2.805 1.00 0.00 O ATOM 0 H SER A 134 98.024 13.190 -4.075 1.00 0.00 H new ATOM 0 HA SER A 134 97.645 15.639 -4.825 1.00 0.00 H new ATOM 0 HB2 SER A 134 99.728 16.993 -4.280 1.00 0.00 H new ATOM 0 HB3 SER A 134 98.586 16.818 -2.963 1.00 0.00 H new ATOM 0 HG SER A 134 100.110 14.698 -2.731 1.00 0.00 H new ATOM 2016 N VAL A 135 100.507 13.894 -4.990 1.00 0.00 N ATOM 2017 CA VAL A 135 101.603 13.469 -5.858 1.00 0.00 C ATOM 2018 C VAL A 135 101.519 11.973 -6.147 1.00 0.00 C ATOM 2019 O VAL A 135 101.292 11.169 -5.240 1.00 0.00 O ATOM 2020 CB VAL A 135 102.952 13.796 -5.198 1.00 0.00 C ATOM 2021 CG1 VAL A 135 104.100 13.447 -6.150 1.00 0.00 C ATOM 2022 CG2 VAL A 135 103.022 15.290 -4.870 1.00 0.00 C ATOM 0 H VAL A 135 100.580 13.563 -4.028 1.00 0.00 H new ATOM 0 HA VAL A 135 101.521 14.008 -6.802 1.00 0.00 H new ATOM 0 HB VAL A 135 103.042 13.211 -4.283 1.00 0.00 H new ATOM 0 HG11 VAL A 135 105.052 13.682 -5.674 1.00 0.00 H new ATOM 0 HG12 VAL A 135 104.066 12.384 -6.387 1.00 0.00 H new ATOM 0 HG13 VAL A 135 104.001 14.027 -7.068 1.00 0.00 H new ATOM 0 HG21 VAL A 135 103.980 15.515 -4.402 1.00 0.00 H new ATOM 0 HG22 VAL A 135 102.921 15.869 -5.788 1.00 0.00 H new ATOM 0 HG23 VAL A 135 102.214 15.551 -4.186 1.00 0.00 H new ATOM 2032 N ASP A 136 101.710 11.621 -7.415 1.00 0.00 N ATOM 2033 CA ASP A 136 101.745 10.218 -7.824 1.00 0.00 C ATOM 2034 C ASP A 136 103.186 9.789 -8.088 1.00 0.00 C ATOM 2035 O ASP A 136 103.845 10.354 -8.959 1.00 0.00 O ATOM 2036 CB ASP A 136 100.908 10.017 -9.090 1.00 0.00 C ATOM 2037 CG ASP A 136 100.834 8.536 -9.448 1.00 0.00 C ATOM 2038 OD1 ASP A 136 100.842 7.720 -8.540 1.00 0.00 O ATOM 2039 OD2 ASP A 136 100.772 8.237 -10.629 1.00 0.00 O ATOM 0 H ASP A 136 101.843 12.286 -8.177 1.00 0.00 H new ATOM 0 HA ASP A 136 101.329 9.608 -7.022 1.00 0.00 H new ATOM 0 HB2 ASP A 136 99.904 10.411 -8.936 1.00 0.00 H new ATOM 0 HB3 ASP A 136 101.347 10.576 -9.916 1.00 0.00 H new ATOM 2044 N VAL A 137 103.679 8.791 -7.355 1.00 0.00 N ATOM 2045 CA VAL A 137 105.076 8.372 -7.493 1.00 0.00 C ATOM 2046 C VAL A 137 105.156 6.952 -8.050 1.00 0.00 C ATOM 2047 O VAL A 137 104.461 6.054 -7.580 1.00 0.00 O ATOM 2048 CB VAL A 137 105.780 8.428 -6.130 1.00 0.00 C ATOM 2049 CG1 VAL A 137 107.265 8.097 -6.295 1.00 0.00 C ATOM 2050 CG2 VAL A 137 105.651 9.833 -5.530 1.00 0.00 C ATOM 0 H VAL A 137 103.141 8.263 -6.668 1.00 0.00 H new ATOM 0 HA VAL A 137 105.572 9.053 -8.185 1.00 0.00 H new ATOM 0 HB VAL A 137 105.311 7.700 -5.467 1.00 0.00 H new ATOM 0 HG11 VAL A 137 107.757 8.139 -5.323 1.00 0.00 H new ATOM 0 HG12 VAL A 137 107.370 7.096 -6.712 1.00 0.00 H new ATOM 0 HG13 VAL A 137 107.727 8.820 -6.967 1.00 0.00 H new ATOM 0 HG21 VAL A 137 106.153 9.863 -4.563 1.00 0.00 H new ATOM 0 HG22 VAL A 137 106.111 10.559 -6.201 1.00 0.00 H new ATOM 0 HG23 VAL A 137 104.597 10.077 -5.399 1.00 0.00 H new ATOM 2060 N GLY A 138 106.021 6.762 -9.045 1.00 0.00 N ATOM 2061 CA GLY A 138 106.240 5.442 -9.627 1.00 0.00 C ATOM 2062 C GLY A 138 107.706 5.055 -9.480 1.00 0.00 C ATOM 2063 O GLY A 138 108.590 5.848 -9.800 1.00 0.00 O ATOM 0 H GLY A 138 106.580 7.505 -9.463 1.00 0.00 H new ATOM 0 HA2 GLY A 138 105.608 4.706 -9.131 1.00 0.00 H new ATOM 0 HA3 GLY A 138 105.959 5.447 -10.680 1.00 0.00 H new ATOM 2067 N THR A 139 107.965 3.850 -8.986 1.00 0.00 N ATOM 2068 CA THR A 139 109.335 3.423 -8.709 1.00 0.00 C ATOM 2069 C THR A 139 109.642 2.080 -9.361 1.00 0.00 C ATOM 2070 O THR A 139 108.835 1.151 -9.311 1.00 0.00 O ATOM 2071 CB THR A 139 109.534 3.312 -7.195 1.00 0.00 C ATOM 2072 OG1 THR A 139 109.154 4.534 -6.579 1.00 0.00 O ATOM 2073 CG2 THR A 139 111.004 3.020 -6.885 1.00 0.00 C ATOM 0 H THR A 139 107.251 3.154 -8.770 1.00 0.00 H new ATOM 0 HA THR A 139 110.015 4.166 -9.126 1.00 0.00 H new ATOM 0 HB THR A 139 108.918 2.500 -6.809 1.00 0.00 H new ATOM 0 HG1 THR A 139 109.173 4.429 -5.605 1.00 0.00 H new ATOM 0 HG21 THR A 139 111.140 2.942 -5.806 1.00 0.00 H new ATOM 0 HG22 THR A 139 111.296 2.081 -7.356 1.00 0.00 H new ATOM 0 HG23 THR A 139 111.625 3.828 -7.271 1.00 0.00 H new ATOM 2081 N TRP A 140 110.817 1.991 -9.976 1.00 0.00 N ATOM 2082 CA TRP A 140 111.299 0.730 -10.527 1.00 0.00 C ATOM 2083 C TRP A 140 112.446 0.214 -9.666 1.00 0.00 C ATOM 2084 O TRP A 140 113.445 0.910 -9.475 1.00 0.00 O ATOM 2085 CB TRP A 140 111.788 0.938 -11.961 1.00 0.00 C ATOM 2086 CG TRP A 140 110.715 1.395 -12.897 1.00 0.00 C ATOM 2087 CD1 TRP A 140 110.281 2.670 -13.020 1.00 0.00 C ATOM 2088 CD2 TRP A 140 109.938 0.605 -13.846 1.00 0.00 C ATOM 2089 NE1 TRP A 140 109.286 2.715 -13.979 1.00 0.00 N ATOM 2090 CE2 TRP A 140 109.039 1.469 -14.518 1.00 0.00 C ATOM 2091 CE3 TRP A 140 109.925 -0.759 -14.183 1.00 0.00 C ATOM 2092 CZ2 TRP A 140 108.158 0.991 -15.493 1.00 0.00 C ATOM 2093 CZ3 TRP A 140 109.042 -1.241 -15.161 1.00 0.00 C ATOM 2094 CH2 TRP A 140 108.161 -0.370 -15.814 1.00 0.00 C ATOM 0 H TRP A 140 111.453 2.778 -10.105 1.00 0.00 H new ATOM 0 HA TRP A 140 110.486 0.004 -10.533 1.00 0.00 H new ATOM 0 HB2 TRP A 140 112.594 1.672 -11.959 1.00 0.00 H new ATOM 0 HB3 TRP A 140 112.209 0.004 -12.332 1.00 0.00 H new ATOM 0 HD1 TRP A 140 110.652 3.516 -12.460 1.00 0.00 H new ATOM 0 HE1 TRP A 140 108.795 3.565 -14.254 1.00 0.00 H new ATOM 0 HE3 TRP A 140 110.599 -1.441 -13.686 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 107.481 1.667 -15.994 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 109.042 -2.291 -15.412 1.00 0.00 H new ATOM 0 HH2 TRP A 140 107.484 -0.749 -16.565 1.00 0.00 H new ATOM 2105 N ILE A 141 112.309 -1.003 -9.147 1.00 0.00 N ATOM 2106 CA ILE A 141 113.305 -1.550 -8.229 1.00 0.00 C ATOM 2107 C ILE A 141 113.766 -2.936 -8.678 1.00 0.00 C ATOM 2108 O ILE A 141 112.961 -3.770 -9.091 1.00 0.00 O ATOM 2109 CB ILE A 141 112.710 -1.612 -6.815 1.00 0.00 C ATOM 2110 CG1 ILE A 141 113.763 -2.114 -5.822 1.00 0.00 C ATOM 2111 CG2 ILE A 141 111.499 -2.550 -6.793 1.00 0.00 C ATOM 2112 CD1 ILE A 141 113.323 -1.779 -4.394 1.00 0.00 C ATOM 0 H ILE A 141 111.525 -1.625 -9.344 1.00 0.00 H new ATOM 0 HA ILE A 141 114.179 -0.898 -8.228 1.00 0.00 H new ATOM 0 HB ILE A 141 112.393 -0.610 -6.527 1.00 0.00 H new ATOM 0 HG12 ILE A 141 113.895 -3.191 -5.930 1.00 0.00 H new ATOM 0 HG13 ILE A 141 114.727 -1.652 -6.034 1.00 0.00 H new ATOM 0 HG21 ILE A 141 111.085 -2.586 -5.785 1.00 0.00 H new ATOM 0 HG22 ILE A 141 110.741 -2.181 -7.484 1.00 0.00 H new ATOM 0 HG23 ILE A 141 111.808 -3.551 -7.094 1.00 0.00 H new ATOM 0 HD11 ILE A 141 114.073 -2.137 -3.689 1.00 0.00 H new ATOM 0 HD12 ILE A 141 113.214 -0.699 -4.291 1.00 0.00 H new ATOM 0 HD13 ILE A 141 112.369 -2.262 -4.185 1.00 0.00 H new ATOM 2124 N ALA A 142 115.072 -3.167 -8.588 1.00 0.00 N ATOM 2125 CA ALA A 142 115.632 -4.483 -8.879 1.00 0.00 C ATOM 2126 C ALA A 142 116.740 -4.804 -7.882 1.00 0.00 C ATOM 2127 O ALA A 142 117.472 -3.908 -7.460 1.00 0.00 O ATOM 2128 CB ALA A 142 116.193 -4.512 -10.302 1.00 0.00 C ATOM 0 H ALA A 142 115.760 -2.464 -8.317 1.00 0.00 H new ATOM 0 HA ALA A 142 114.843 -5.230 -8.794 1.00 0.00 H new ATOM 0 HB1 ALA A 142 116.608 -5.498 -10.509 1.00 0.00 H new ATOM 0 HB2 ALA A 142 115.394 -4.298 -11.012 1.00 0.00 H new ATOM 0 HB3 ALA A 142 116.976 -3.760 -10.400 1.00 0.00 H new ATOM 2134 N GLY A 143 116.855 -6.076 -7.498 1.00 0.00 N ATOM 2135 CA GLY A 143 117.869 -6.464 -6.521 1.00 0.00 C ATOM 2136 C GLY A 143 118.333 -7.902 -6.719 1.00 0.00 C ATOM 2137 O GLY A 143 117.757 -8.651 -7.508 1.00 0.00 O ATOM 0 H GLY A 143 116.272 -6.839 -7.841 1.00 0.00 H new ATOM 0 HA2 GLY A 143 118.724 -5.793 -6.601 1.00 0.00 H new ATOM 0 HA3 GLY A 143 117.466 -6.349 -5.515 1.00 0.00 H new ATOM 2141 N VAL A 144 119.366 -8.281 -5.971 1.00 0.00 N ATOM 2142 CA VAL A 144 119.925 -9.627 -6.051 1.00 0.00 C ATOM 2143 C VAL A 144 120.150 -10.155 -4.638 1.00 0.00 C ATOM 2144 O VAL A 144 120.481 -9.382 -3.740 1.00 0.00 O ATOM 2145 CB VAL A 144 121.251 -9.614 -6.820 1.00 0.00 C ATOM 2146 CG1 VAL A 144 121.769 -11.045 -6.973 1.00 0.00 C ATOM 2147 CG2 VAL A 144 121.040 -9.000 -8.207 1.00 0.00 C ATOM 0 H VAL A 144 119.834 -7.672 -5.300 1.00 0.00 H new ATOM 0 HA VAL A 144 119.227 -10.274 -6.582 1.00 0.00 H new ATOM 0 HB VAL A 144 121.979 -9.019 -6.268 1.00 0.00 H new ATOM 0 HG11 VAL A 144 122.712 -11.034 -7.520 1.00 0.00 H new ATOM 0 HG12 VAL A 144 121.926 -11.482 -5.987 1.00 0.00 H new ATOM 0 HG13 VAL A 144 121.038 -11.640 -7.521 1.00 0.00 H new ATOM 0 HG21 VAL A 144 121.985 -8.993 -8.749 1.00 0.00 H new ATOM 0 HG22 VAL A 144 120.309 -9.591 -8.759 1.00 0.00 H new ATOM 0 HG23 VAL A 144 120.675 -7.978 -8.101 1.00 0.00 H new ATOM 2157 N GLY A 145 119.954 -11.456 -4.438 1.00 0.00 N ATOM 2158 CA GLY A 145 120.097 -12.033 -3.103 1.00 0.00 C ATOM 2159 C GLY A 145 120.764 -13.402 -3.144 1.00 0.00 C ATOM 2160 O GLY A 145 120.799 -14.059 -4.184 1.00 0.00 O ATOM 0 H GLY A 145 119.700 -12.121 -5.169 1.00 0.00 H new ATOM 0 HA2 GLY A 145 120.686 -11.361 -2.478 1.00 0.00 H new ATOM 0 HA3 GLY A 145 119.115 -12.122 -2.639 1.00 0.00 H new ATOM 2164 N TYR A 146 121.277 -13.824 -1.991 1.00 0.00 N ATOM 2165 CA TYR A 146 121.960 -15.107 -1.872 1.00 0.00 C ATOM 2166 C TYR A 146 121.336 -15.921 -0.745 1.00 0.00 C ATOM 2167 O TYR A 146 120.930 -15.363 0.274 1.00 0.00 O ATOM 2168 CB TYR A 146 123.445 -14.883 -1.579 1.00 0.00 C ATOM 2169 CG TYR A 146 124.148 -14.057 -2.630 1.00 0.00 C ATOM 2170 CD1 TYR A 146 124.747 -14.685 -3.729 1.00 0.00 C ATOM 2171 CD2 TYR A 146 124.201 -12.664 -2.505 1.00 0.00 C ATOM 2172 CE1 TYR A 146 125.399 -13.919 -4.703 1.00 0.00 C ATOM 2173 CE2 TYR A 146 124.853 -11.898 -3.479 1.00 0.00 C ATOM 2174 CZ TYR A 146 125.451 -12.525 -4.578 1.00 0.00 C ATOM 2175 OH TYR A 146 126.093 -11.771 -5.539 1.00 0.00 O ATOM 0 H TYR A 146 121.231 -13.292 -1.122 1.00 0.00 H new ATOM 0 HA TYR A 146 121.858 -15.651 -2.811 1.00 0.00 H new ATOM 0 HB2 TYR A 146 123.546 -14.389 -0.612 1.00 0.00 H new ATOM 0 HB3 TYR A 146 123.941 -15.850 -1.496 1.00 0.00 H new ATOM 0 HD1 TYR A 146 124.706 -15.760 -3.825 1.00 0.00 H new ATOM 0 HD2 TYR A 146 123.739 -12.180 -1.657 1.00 0.00 H new ATOM 0 HE1 TYR A 146 125.862 -14.403 -5.550 1.00 0.00 H new ATOM 0 HE2 TYR A 146 124.894 -10.823 -3.382 1.00 0.00 H new ATOM 0 HH TYR A 146 126.036 -10.822 -5.302 1.00 0.00 H new ATOM 2185 N ARG A 147 121.245 -17.235 -0.938 1.00 0.00 N ATOM 2186 CA ARG A 147 120.653 -18.116 0.066 1.00 0.00 C ATOM 2187 C ARG A 147 121.708 -19.038 0.676 1.00 0.00 C ATOM 2188 O ARG A 147 122.587 -19.542 -0.024 1.00 0.00 O ATOM 2189 CB ARG A 147 119.523 -18.936 -0.573 1.00 0.00 C ATOM 2190 CG ARG A 147 120.077 -19.859 -1.662 1.00 0.00 C ATOM 2191 CD ARG A 147 118.920 -20.514 -2.419 1.00 0.00 C ATOM 2192 NE ARG A 147 119.432 -21.493 -3.381 1.00 0.00 N ATOM 2193 CZ ARG A 147 118.644 -22.294 -4.112 1.00 0.00 C ATOM 2194 NH1 ARG A 147 117.337 -22.262 -4.022 1.00 0.00 N ATOM 2195 NH2 ARG A 147 119.198 -23.134 -4.944 1.00 0.00 N ATOM 0 H ARG A 147 121.573 -17.712 -1.778 1.00 0.00 H new ATOM 0 HA ARG A 147 120.242 -17.506 0.870 1.00 0.00 H new ATOM 0 HB2 ARG A 147 119.019 -19.528 0.191 1.00 0.00 H new ATOM 0 HB3 ARG A 147 118.777 -18.266 -1.001 1.00 0.00 H new ATOM 0 HG2 ARG A 147 120.700 -19.290 -2.352 1.00 0.00 H new ATOM 0 HG3 ARG A 147 120.712 -20.624 -1.216 1.00 0.00 H new ATOM 0 HD2 ARG A 147 118.247 -21.003 -1.715 1.00 0.00 H new ATOM 0 HD3 ARG A 147 118.339 -19.752 -2.939 1.00 0.00 H new ATOM 0 HE ARG A 147 120.442 -21.569 -3.501 1.00 0.00 H new ATOM 0 HH11 ARG A 147 116.886 -21.611 -3.379 1.00 0.00 H new ATOM 0 HH12 ARG A 147 116.771 -22.888 -4.595 1.00 0.00 H new ATOM 0 HH21 ARG A 147 120.214 -23.173 -5.029 1.00 0.00 H new ATOM 0 HH22 ARG A 147 118.615 -23.752 -5.509 1.00 0.00 H new ATOM 2209 N PHE A 148 121.609 -19.254 1.983 1.00 0.00 N ATOM 2210 CA PHE A 148 122.548 -20.125 2.679 1.00 0.00 C ATOM 2211 C PHE A 148 121.847 -20.876 3.808 1.00 0.00 C ATOM 2212 O PHE A 148 120.847 -20.372 4.292 1.00 0.00 O ATOM 2213 CB PHE A 148 123.702 -19.300 3.253 1.00 0.00 C ATOM 2214 CG PHE A 148 124.776 -20.139 3.903 1.00 0.00 C ATOM 2215 CD1 PHE A 148 124.691 -20.452 5.265 1.00 0.00 C ATOM 2216 CD2 PHE A 148 125.857 -20.605 3.144 1.00 0.00 C ATOM 2217 CE1 PHE A 148 125.687 -21.230 5.868 1.00 0.00 C ATOM 2218 CE2 PHE A 148 126.852 -21.382 3.747 1.00 0.00 C ATOM 2219 CZ PHE A 148 126.768 -21.695 5.109 1.00 0.00 C ATOM 2220 OXT PHE A 148 122.320 -21.939 4.170 1.00 0.00 O ATOM 0 H PHE A 148 120.892 -18.840 2.579 1.00 0.00 H new ATOM 0 HA PHE A 148 122.940 -20.848 1.964 1.00 0.00 H new ATOM 0 HB2 PHE A 148 124.148 -18.708 2.454 1.00 0.00 H new ATOM 0 HB3 PHE A 148 123.307 -18.598 3.987 1.00 0.00 H new ATOM 0 HD1 PHE A 148 123.857 -20.093 5.851 1.00 0.00 H new ATOM 0 HD2 PHE A 148 125.922 -20.364 2.093 1.00 0.00 H new ATOM 0 HE1 PHE A 148 125.621 -21.471 6.919 1.00 0.00 H new ATOM 0 HE2 PHE A 148 127.686 -21.741 3.161 1.00 0.00 H new ATOM 0 HZ PHE A 148 127.536 -22.295 5.574 1.00 0.00 H new TER 2230 PHE A 148