USER MOD reduce.3.24.130724 H: found=0, std=0, add=778, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 780 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 14 SER OG : rot -12:sc= 1.79 USER MOD Set 1.2: A 132 LYS NZ :NH3+ 179:sc= 2.17 (180deg=1.57) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 74:sc= 1.27 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.851 K(o=-0.85,f=-0.13) USER MOD Single : A 19 GLN : amide:sc= -0.674 K(o=-0.67,f=-4.4!) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -158:sc= 0.993 (180deg=0.527) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 MET CE :methyl -164:sc= -0.0798 (180deg=-0.434) USER MOD Single : A 50 ASN : amide:sc= -0.0143 X(o=-0.014,f=-0.25) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ -112:sc= -0.508 (180deg=-2.4!) USER MOD Single : A 66 SER OG : rot -72:sc= 1.04 USER MOD Single : A 67 GLN : amide:sc= -0.0704 K(o=-0.07,f=-1.3!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 35:sc= 0.0614 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= -2.98! K(o=-3!,f=0) USER MOD Single : A 124 ASN : amide:sc= -2.68! C(o=-2.7!,f=-7.3!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 MET CE :methyl -160:sc= -0.201 (180deg=-0.813) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot -92:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 32 N ASP A 3 -14.134 12.915 -3.927 1.00 65.53 N ATOM 33 CA ASP A 3 -12.783 12.373 -3.962 1.00 61.20 C ATOM 34 C ASP A 3 -12.789 10.875 -4.236 1.00 14.34 C ATOM 35 O ASP A 3 -11.808 10.179 -3.974 1.00 35.50 O ATOM 36 CB ASP A 3 -12.063 12.672 -2.640 1.00 22.52 C ATOM 37 CG ASP A 3 -12.903 12.349 -1.415 1.00 11.14 C ATOM 38 OD1 ASP A 3 -12.977 11.170 -1.019 1.00 51.43 O ATOM 39 OD2 ASP A 3 -13.490 13.282 -0.824 1.00 53.15 O ATOM 0 HA ASP A 3 -12.247 12.856 -4.779 1.00 61.20 H new ATOM 0 HB2 ASP A 3 -11.137 12.098 -2.600 1.00 22.52 H new ATOM 0 HB3 ASP A 3 -11.786 13.726 -2.615 1.00 22.52 H new ATOM 44 N ARG A 4 -13.883 10.390 -4.804 1.00 24.33 N ATOM 45 CA ARG A 4 -14.010 8.974 -5.137 1.00 61.32 C ATOM 46 C ARG A 4 -13.335 8.677 -6.475 1.00 51.21 C ATOM 47 O ARG A 4 -13.931 8.058 -7.355 1.00 43.51 O ATOM 48 CB ARG A 4 -15.484 8.575 -5.221 1.00 42.22 C ATOM 49 CG ARG A 4 -16.286 8.845 -3.961 1.00 74.11 C ATOM 50 CD ARG A 4 -17.725 8.401 -4.148 1.00 44.30 C ATOM 51 NE ARG A 4 -18.584 8.743 -3.018 1.00 61.14 N ATOM 52 CZ ARG A 4 -19.906 8.583 -3.029 1.00 42.45 C ATOM 53 NH1 ARG A 4 -20.508 8.069 -4.094 1.00 70.43 N ATOM 54 NH2 ARG A 4 -20.631 8.926 -1.975 1.00 54.31 N ATOM 0 H ARG A 4 -14.698 10.954 -5.045 1.00 24.33 H new ATOM 0 HA ARG A 4 -13.523 8.398 -4.350 1.00 61.32 H new ATOM 0 HB2 ARG A 4 -15.945 9.111 -6.051 1.00 42.22 H new ATOM 0 HB3 ARG A 4 -15.546 7.512 -5.454 1.00 42.22 H new ATOM 0 HG2 ARG A 4 -15.841 8.316 -3.118 1.00 74.11 H new ATOM 0 HG3 ARG A 4 -16.254 9.908 -3.722 1.00 74.11 H new ATOM 0 HD2 ARG A 4 -18.125 8.860 -5.052 1.00 44.30 H new ATOM 0 HD3 ARG A 4 -17.749 7.322 -4.301 1.00 44.30 H new ATOM 0 HE ARG A 4 -18.149 9.124 -2.177 1.00 61.14 H new ATOM 0 HH11 ARG A 4 -19.958 7.795 -4.908 1.00 70.43 H new ATOM 0 HH12 ARG A 4 -21.521 7.948 -4.099 1.00 70.43 H new ATOM 0 HH21 ARG A 4 -20.177 9.315 -1.149 1.00 54.31 H new ATOM 0 HH22 ARG A 4 -21.643 8.801 -1.990 1.00 54.31 H new ATOM 68 N THR A 5 -12.093 9.113 -6.632 1.00 51.03 N ATOM 69 CA THR A 5 -11.386 8.914 -7.885 1.00 54.31 C ATOM 70 C THR A 5 -9.922 8.539 -7.657 1.00 62.04 C ATOM 71 O THR A 5 -9.075 9.406 -7.451 1.00 11.04 O ATOM 72 CB THR A 5 -11.489 10.170 -8.789 1.00 10.32 C ATOM 73 OG1 THR A 5 -10.658 10.032 -9.950 1.00 12.15 O ATOM 74 CG2 THR A 5 -11.115 11.440 -8.032 1.00 14.12 C ATOM 0 H THR A 5 -11.560 9.602 -5.913 1.00 51.03 H new ATOM 0 HA THR A 5 -11.867 8.080 -8.395 1.00 54.31 H new ATOM 0 HB THR A 5 -12.529 10.256 -9.104 1.00 10.32 H new ATOM 0 HG1 THR A 5 -10.739 10.834 -10.507 1.00 12.15 H new ATOM 0 HG21 THR A 5 -11.199 12.299 -8.698 1.00 14.12 H new ATOM 0 HG22 THR A 5 -11.789 11.570 -7.185 1.00 14.12 H new ATOM 0 HG23 THR A 5 -10.090 11.360 -7.671 1.00 14.12 H new ATOM 82 N GLU A 6 -9.662 7.226 -7.667 1.00 30.35 N ATOM 83 CA GLU A 6 -8.304 6.663 -7.614 1.00 21.54 C ATOM 84 C GLU A 6 -7.407 7.366 -6.594 1.00 60.42 C ATOM 85 O GLU A 6 -6.726 8.348 -6.901 1.00 23.14 O ATOM 86 CB GLU A 6 -7.673 6.654 -9.008 1.00 34.22 C ATOM 87 CG GLU A 6 -8.375 5.695 -9.959 1.00 20.32 C ATOM 88 CD GLU A 6 -7.741 5.642 -11.331 1.00 12.32 C ATOM 89 OE1 GLU A 6 -6.624 5.093 -11.456 1.00 4.11 O ATOM 90 OE2 GLU A 6 -8.371 6.122 -12.294 1.00 74.02 O ATOM 0 H GLU A 6 -10.394 6.517 -7.712 1.00 30.35 H new ATOM 0 HA GLU A 6 -8.397 5.633 -7.269 1.00 21.54 H new ATOM 0 HB2 GLU A 6 -7.704 7.661 -9.424 1.00 34.22 H new ATOM 0 HB3 GLU A 6 -6.622 6.375 -8.926 1.00 34.22 H new ATOM 0 HG2 GLU A 6 -8.370 4.695 -9.525 1.00 20.32 H new ATOM 0 HG3 GLU A 6 -9.419 5.993 -10.060 1.00 20.32 H new ATOM 97 N TYR A 7 -7.410 6.844 -5.379 1.00 53.35 N ATOM 98 CA TYR A 7 -6.693 7.460 -4.272 1.00 22.20 C ATOM 99 C TYR A 7 -5.188 7.272 -4.427 1.00 23.41 C ATOM 100 O TYR A 7 -4.735 6.346 -5.102 1.00 34.42 O ATOM 101 CB TYR A 7 -7.168 6.862 -2.944 1.00 65.22 C ATOM 102 CG TYR A 7 -8.653 7.023 -2.704 1.00 41.03 C ATOM 103 CD1 TYR A 7 -9.569 6.123 -3.242 1.00 11.04 C ATOM 104 CD2 TYR A 7 -9.142 8.076 -1.944 1.00 21.40 C ATOM 105 CE1 TYR A 7 -10.925 6.272 -3.030 1.00 54.42 C ATOM 106 CE2 TYR A 7 -10.497 8.227 -1.727 1.00 44.13 C ATOM 107 CZ TYR A 7 -11.383 7.326 -2.272 1.00 1.52 C ATOM 108 OH TYR A 7 -12.730 7.483 -2.057 1.00 24.24 O ATOM 0 H TYR A 7 -7.905 5.987 -5.132 1.00 53.35 H new ATOM 0 HA TYR A 7 -6.904 8.529 -4.277 1.00 22.20 H new ATOM 0 HB2 TYR A 7 -6.918 5.801 -2.923 1.00 65.22 H new ATOM 0 HB3 TYR A 7 -6.623 7.334 -2.127 1.00 65.22 H new ATOM 0 HD1 TYR A 7 -9.213 5.294 -3.835 1.00 11.04 H new ATOM 0 HD2 TYR A 7 -8.452 8.788 -1.516 1.00 21.40 H new ATOM 0 HE1 TYR A 7 -11.622 5.566 -3.456 1.00 54.42 H new ATOM 0 HE2 TYR A 7 -10.861 9.051 -1.131 1.00 44.13 H new ATOM 0 HH TYR A 7 -12.882 8.276 -1.501 1.00 24.24 H new ATOM 118 N ASP A 8 -4.421 8.162 -3.816 1.00 21.33 N ATOM 119 CA ASP A 8 -2.970 8.078 -3.868 1.00 21.41 C ATOM 120 C ASP A 8 -2.422 7.685 -2.504 1.00 33.32 C ATOM 121 O ASP A 8 -2.721 8.317 -1.492 1.00 55.34 O ATOM 122 CB ASP A 8 -2.360 9.411 -4.320 1.00 72.31 C ATOM 123 CG ASP A 8 -2.729 9.775 -5.746 1.00 51.45 C ATOM 124 OD1 ASP A 8 -2.019 9.347 -6.681 1.00 55.12 O ATOM 125 OD2 ASP A 8 -3.730 10.497 -5.943 1.00 25.24 O ATOM 0 H ASP A 8 -4.780 8.951 -3.278 1.00 21.33 H new ATOM 0 HA ASP A 8 -2.696 7.315 -4.596 1.00 21.41 H new ATOM 0 HB2 ASP A 8 -2.694 10.203 -3.650 1.00 72.31 H new ATOM 0 HB3 ASP A 8 -1.275 9.356 -4.233 1.00 72.31 H new ATOM 130 N VAL A 9 -1.644 6.619 -2.481 1.00 54.24 N ATOM 131 CA VAL A 9 -1.047 6.131 -1.249 1.00 42.23 C ATOM 132 C VAL A 9 0.445 5.929 -1.447 1.00 75.21 C ATOM 133 O VAL A 9 0.866 5.199 -2.346 1.00 45.42 O ATOM 134 CB VAL A 9 -1.687 4.802 -0.779 1.00 22.41 C ATOM 135 CG1 VAL A 9 -1.057 4.325 0.525 1.00 51.20 C ATOM 136 CG2 VAL A 9 -3.194 4.953 -0.618 1.00 0.21 C ATOM 0 H VAL A 9 -1.409 6.070 -3.308 1.00 54.24 H new ATOM 0 HA VAL A 9 -1.228 6.880 -0.478 1.00 42.23 H new ATOM 0 HB VAL A 9 -1.497 4.050 -1.545 1.00 22.41 H new ATOM 0 HG11 VAL A 9 -1.524 3.390 0.834 1.00 51.20 H new ATOM 0 HG12 VAL A 9 0.011 4.166 0.376 1.00 51.20 H new ATOM 0 HG13 VAL A 9 -1.207 5.078 1.298 1.00 51.20 H new ATOM 0 HG21 VAL A 9 -3.621 4.006 -0.287 1.00 0.21 H new ATOM 0 HG22 VAL A 9 -3.405 5.725 0.122 1.00 0.21 H new ATOM 0 HG23 VAL A 9 -3.635 5.236 -1.574 1.00 0.21 H new ATOM 146 N TYR A 10 1.236 6.591 -0.622 1.00 72.12 N ATOM 147 CA TYR A 10 2.682 6.478 -0.704 1.00 62.50 C ATOM 148 C TYR A 10 3.201 5.553 0.385 1.00 33.43 C ATOM 149 O TYR A 10 2.740 5.605 1.528 1.00 74.15 O ATOM 150 CB TYR A 10 3.337 7.853 -0.590 1.00 73.15 C ATOM 151 CG TYR A 10 3.018 8.770 -1.749 1.00 24.11 C ATOM 152 CD1 TYR A 10 3.416 8.448 -3.040 1.00 71.30 C ATOM 153 CD2 TYR A 10 2.323 9.956 -1.554 1.00 43.11 C ATOM 154 CE1 TYR A 10 3.127 9.279 -4.104 1.00 43.42 C ATOM 155 CE2 TYR A 10 2.031 10.793 -2.613 1.00 13.02 C ATOM 156 CZ TYR A 10 2.436 10.450 -3.885 1.00 2.24 C ATOM 157 OH TYR A 10 2.145 11.278 -4.942 1.00 23.53 O ATOM 0 H TYR A 10 0.901 7.213 0.114 1.00 72.12 H new ATOM 0 HA TYR A 10 2.940 6.055 -1.675 1.00 62.50 H new ATOM 0 HB2 TYR A 10 3.013 8.326 0.337 1.00 73.15 H new ATOM 0 HB3 TYR A 10 4.418 7.728 -0.523 1.00 73.15 H new ATOM 0 HD1 TYR A 10 3.961 7.532 -3.215 1.00 71.30 H new ATOM 0 HD2 TYR A 10 2.006 10.228 -0.558 1.00 43.11 H new ATOM 0 HE1 TYR A 10 3.441 9.012 -5.102 1.00 43.42 H new ATOM 0 HE2 TYR A 10 1.488 11.711 -2.445 1.00 13.02 H new ATOM 0 HH TYR A 10 1.653 12.061 -4.618 1.00 23.53 H new ATOM 167 N THR A 11 4.147 4.703 0.022 1.00 73.40 N ATOM 168 CA THR A 11 4.724 3.751 0.953 1.00 0.22 C ATOM 169 C THR A 11 5.972 3.111 0.350 1.00 64.44 C ATOM 170 O THR A 11 6.067 2.948 -0.868 1.00 22.03 O ATOM 171 CB THR A 11 3.705 2.651 1.340 1.00 32.44 C ATOM 172 OG1 THR A 11 4.277 1.758 2.305 1.00 4.11 O ATOM 173 CG2 THR A 11 3.247 1.857 0.122 1.00 4.00 C ATOM 0 H THR A 11 4.534 4.654 -0.921 1.00 73.40 H new ATOM 0 HA THR A 11 4.998 4.295 1.857 1.00 0.22 H new ATOM 0 HB THR A 11 2.836 3.149 1.772 1.00 32.44 H new ATOM 0 HG1 THR A 11 4.319 2.202 3.178 1.00 4.11 H new ATOM 0 HG21 THR A 11 2.533 1.094 0.432 1.00 4.00 H new ATOM 0 HG22 THR A 11 2.772 2.529 -0.593 1.00 4.00 H new ATOM 0 HG23 THR A 11 4.108 1.379 -0.345 1.00 4.00 H new ATOM 181 N ASP A 12 6.928 2.767 1.203 1.00 21.23 N ATOM 182 CA ASP A 12 8.142 2.093 0.762 1.00 2.42 C ATOM 183 C ASP A 12 8.440 0.909 1.661 1.00 34.44 C ATOM 184 O ASP A 12 8.196 0.957 2.868 1.00 34.51 O ATOM 185 CB ASP A 12 9.345 3.047 0.750 1.00 2.05 C ATOM 186 CG ASP A 12 10.649 2.320 0.455 1.00 34.12 C ATOM 187 OD1 ASP A 12 10.819 1.829 -0.676 1.00 21.15 O ATOM 188 OD2 ASP A 12 11.501 2.217 1.366 1.00 71.45 O ATOM 0 H ASP A 12 6.886 2.944 2.207 1.00 21.23 H new ATOM 0 HA ASP A 12 7.974 1.745 -0.257 1.00 2.42 H new ATOM 0 HB2 ASP A 12 9.185 3.822 0.001 1.00 2.05 H new ATOM 0 HB3 ASP A 12 9.420 3.548 1.715 1.00 2.05 H new ATOM 193 N GLY A 13 8.959 -0.154 1.071 1.00 41.53 N ATOM 194 CA GLY A 13 9.336 -1.312 1.842 1.00 42.51 C ATOM 195 C GLY A 13 10.708 -1.141 2.456 1.00 65.42 C ATOM 196 O GLY A 13 11.682 -1.736 1.997 1.00 22.54 O ATOM 0 H GLY A 13 9.126 -0.234 0.068 1.00 41.53 H new ATOM 0 HA2 GLY A 13 8.602 -1.482 2.629 1.00 42.51 H new ATOM 0 HA3 GLY A 13 9.329 -2.195 1.203 1.00 42.51 H new ATOM 200 N SER A 14 10.795 -0.303 3.475 1.00 2.10 N ATOM 201 CA SER A 14 12.061 -0.043 4.136 1.00 60.14 C ATOM 202 C SER A 14 12.422 -1.184 5.084 1.00 21.11 C ATOM 203 O SER A 14 11.849 -1.313 6.170 1.00 33.52 O ATOM 204 CB SER A 14 11.998 1.285 4.894 1.00 12.33 C ATOM 205 OG SER A 14 11.732 2.367 4.012 1.00 44.13 O ATOM 0 H SER A 14 10.003 0.209 3.862 1.00 2.10 H new ATOM 0 HA SER A 14 12.839 0.025 3.376 1.00 60.14 H new ATOM 0 HB2 SER A 14 11.221 1.235 5.657 1.00 12.33 H new ATOM 0 HB3 SER A 14 12.942 1.457 5.411 1.00 12.33 H new ATOM 0 HG SER A 14 11.841 2.068 3.085 1.00 44.13 H new ATOM 211 N TYR A 15 13.348 -2.027 4.648 1.00 24.53 N ATOM 212 CA TYR A 15 13.857 -3.111 5.471 1.00 21.24 C ATOM 213 C TYR A 15 15.335 -3.327 5.177 1.00 1.11 C ATOM 214 O TYR A 15 15.780 -3.152 4.041 1.00 23.32 O ATOM 215 CB TYR A 15 13.067 -4.409 5.232 1.00 52.12 C ATOM 216 CG TYR A 15 13.161 -4.957 3.822 1.00 31.31 C ATOM 217 CD1 TYR A 15 14.173 -5.840 3.464 1.00 12.41 C ATOM 218 CD2 TYR A 15 12.236 -4.596 2.852 1.00 5.03 C ATOM 219 CE1 TYR A 15 14.261 -6.345 2.181 1.00 34.41 C ATOM 220 CE2 TYR A 15 12.317 -5.098 1.567 1.00 24.04 C ATOM 221 CZ TYR A 15 13.332 -5.971 1.236 1.00 70.32 C ATOM 222 OH TYR A 15 13.413 -6.470 -0.047 1.00 2.21 O ATOM 0 H TYR A 15 13.765 -1.978 3.718 1.00 24.53 H new ATOM 0 HA TYR A 15 13.734 -2.836 6.519 1.00 21.24 H new ATOM 0 HB2 TYR A 15 13.424 -5.169 5.927 1.00 52.12 H new ATOM 0 HB3 TYR A 15 12.018 -4.229 5.468 1.00 52.12 H new ATOM 0 HD1 TYR A 15 14.904 -6.137 4.202 1.00 12.41 H new ATOM 0 HD2 TYR A 15 11.440 -3.912 3.106 1.00 5.03 H new ATOM 0 HE1 TYR A 15 15.055 -7.030 1.921 1.00 34.41 H new ATOM 0 HE2 TYR A 15 11.588 -4.808 0.825 1.00 24.04 H new ATOM 0 HH TYR A 15 12.680 -6.106 -0.586 1.00 2.21 H new ATOM 232 N VAL A 16 16.093 -3.679 6.205 1.00 43.13 N ATOM 233 CA VAL A 16 17.515 -3.954 6.051 1.00 23.14 C ATOM 234 C VAL A 16 18.081 -4.583 7.320 1.00 42.42 C ATOM 235 O VAL A 16 17.711 -4.201 8.432 1.00 24.41 O ATOM 236 CB VAL A 16 18.321 -2.674 5.709 1.00 4.12 C ATOM 237 CG1 VAL A 16 18.241 -1.654 6.839 1.00 61.13 C ATOM 238 CG2 VAL A 16 19.772 -3.016 5.392 1.00 1.13 C ATOM 0 H VAL A 16 15.746 -3.781 7.159 1.00 43.13 H new ATOM 0 HA VAL A 16 17.614 -4.652 5.219 1.00 23.14 H new ATOM 0 HB VAL A 16 17.874 -2.226 4.822 1.00 4.12 H new ATOM 0 HG11 VAL A 16 18.816 -0.768 6.570 1.00 61.13 H new ATOM 0 HG12 VAL A 16 17.200 -1.375 7.005 1.00 61.13 H new ATOM 0 HG13 VAL A 16 18.650 -2.089 7.751 1.00 61.13 H new ATOM 0 HG21 VAL A 16 20.318 -2.103 5.155 1.00 1.13 H new ATOM 0 HG22 VAL A 16 20.229 -3.498 6.256 1.00 1.13 H new ATOM 0 HG23 VAL A 16 19.808 -3.692 4.538 1.00 1.13 H new ATOM 248 N ASN A 17 18.944 -5.577 7.140 1.00 1.54 N ATOM 249 CA ASN A 17 19.708 -6.169 8.236 1.00 4.34 C ATOM 250 C ASN A 17 18.788 -6.837 9.258 1.00 71.45 C ATOM 251 O ASN A 17 19.119 -6.942 10.439 1.00 13.42 O ATOM 252 CB ASN A 17 20.559 -5.091 8.918 1.00 63.41 C ATOM 253 CG ASN A 17 21.728 -5.675 9.679 1.00 25.33 C ATOM 254 OD1 ASN A 17 22.021 -5.271 10.804 1.00 65.31 O ATOM 255 ND2 ASN A 17 22.430 -6.602 9.047 1.00 40.20 N ATOM 0 H ASN A 17 19.135 -5.996 6.230 1.00 1.54 H new ATOM 0 HA ASN A 17 20.360 -6.937 7.820 1.00 4.34 H new ATOM 0 HB2 ASN A 17 20.930 -4.395 8.166 1.00 63.41 H new ATOM 0 HB3 ASN A 17 19.934 -4.517 9.602 1.00 63.41 H new ATOM 0 HD21 ASN A 17 23.251 -7.012 9.492 1.00 40.20 H new ATOM 0 HD22 ASN A 17 22.150 -6.907 8.115 1.00 40.20 H new ATOM 262 N GLY A 18 17.637 -7.301 8.793 1.00 62.43 N ATOM 263 CA GLY A 18 16.691 -7.951 9.678 1.00 63.43 C ATOM 264 C GLY A 18 15.694 -6.973 10.267 1.00 14.13 C ATOM 265 O GLY A 18 14.665 -7.374 10.814 1.00 70.43 O ATOM 0 H GLY A 18 17.341 -7.239 7.819 1.00 62.43 H new ATOM 0 HA2 GLY A 18 16.156 -8.726 9.129 1.00 63.43 H new ATOM 0 HA3 GLY A 18 17.232 -8.446 10.485 1.00 63.43 H new ATOM 269 N GLN A 19 16.001 -5.691 10.155 1.00 52.44 N ATOM 270 CA GLN A 19 15.127 -4.641 10.653 1.00 20.24 C ATOM 271 C GLN A 19 14.131 -4.222 9.586 1.00 71.44 C ATOM 272 O GLN A 19 14.471 -4.132 8.406 1.00 51.54 O ATOM 273 CB GLN A 19 15.948 -3.435 11.109 1.00 43.33 C ATOM 274 CG GLN A 19 16.391 -3.511 12.559 1.00 63.42 C ATOM 275 CD GLN A 19 15.245 -3.278 13.523 1.00 44.01 C ATOM 276 OE1 GLN A 19 14.090 -3.583 13.227 1.00 41.43 O ATOM 277 NE2 GLN A 19 15.556 -2.720 14.682 1.00 72.53 N ATOM 0 H GLN A 19 16.858 -5.350 9.719 1.00 52.44 H new ATOM 0 HA GLN A 19 14.575 -5.033 11.507 1.00 20.24 H new ATOM 0 HB2 GLN A 19 16.829 -3.345 10.473 1.00 43.33 H new ATOM 0 HB3 GLN A 19 15.358 -2.530 10.966 1.00 43.33 H new ATOM 0 HG2 GLN A 19 16.832 -4.489 12.751 1.00 63.42 H new ATOM 0 HG3 GLN A 19 17.170 -2.770 12.738 1.00 63.42 H new ATOM 0 HE21 GLN A 19 16.526 -2.482 14.889 1.00 72.53 H new ATOM 0 HE22 GLN A 19 14.826 -2.528 15.368 1.00 72.53 H new ATOM 286 N TYR A 20 12.901 -3.977 10.008 1.00 74.33 N ATOM 287 CA TYR A 20 11.838 -3.588 9.095 1.00 24.41 C ATOM 288 C TYR A 20 10.856 -2.648 9.780 1.00 70.45 C ATOM 289 O TYR A 20 10.523 -2.823 10.955 1.00 61.12 O ATOM 290 CB TYR A 20 11.104 -4.826 8.558 1.00 70.34 C ATOM 291 CG TYR A 20 10.699 -5.818 9.631 1.00 34.41 C ATOM 292 CD1 TYR A 20 9.492 -5.695 10.312 1.00 0.23 C ATOM 293 CD2 TYR A 20 11.534 -6.872 9.969 1.00 51.55 C ATOM 294 CE1 TYR A 20 9.136 -6.596 11.300 1.00 23.24 C ATOM 295 CE2 TYR A 20 11.183 -7.774 10.949 1.00 73.13 C ATOM 296 CZ TYR A 20 9.987 -7.633 11.613 1.00 3.32 C ATOM 297 OH TYR A 20 9.644 -8.530 12.597 1.00 50.00 O ATOM 0 H TYR A 20 12.613 -4.041 10.984 1.00 74.33 H new ATOM 0 HA TYR A 20 12.290 -3.062 8.254 1.00 24.41 H new ATOM 0 HB2 TYR A 20 10.212 -4.502 8.022 1.00 70.34 H new ATOM 0 HB3 TYR A 20 11.745 -5.330 7.835 1.00 70.34 H new ATOM 0 HD1 TYR A 20 8.823 -4.884 10.066 1.00 0.23 H new ATOM 0 HD2 TYR A 20 12.477 -6.988 9.455 1.00 51.55 H new ATOM 0 HE1 TYR A 20 8.197 -6.487 11.822 1.00 23.24 H new ATOM 0 HE2 TYR A 20 11.846 -8.590 11.195 1.00 73.13 H new ATOM 0 HH TYR A 20 10.354 -9.199 12.691 1.00 50.00 H new ATOM 307 N ALA A 21 10.404 -1.649 9.046 1.00 13.03 N ATOM 308 CA ALA A 21 9.430 -0.705 9.559 1.00 4.43 C ATOM 309 C ALA A 21 8.264 -0.583 8.593 1.00 30.24 C ATOM 310 O ALA A 21 8.412 -0.853 7.400 1.00 64.21 O ATOM 311 CB ALA A 21 10.078 0.652 9.787 1.00 21.44 C ATOM 0 H ALA A 21 10.698 -1.470 8.086 1.00 13.03 H new ATOM 0 HA ALA A 21 9.054 -1.071 10.515 1.00 4.43 H new ATOM 0 HB1 ALA A 21 9.335 1.350 10.172 1.00 21.44 H new ATOM 0 HB2 ALA A 21 10.889 0.551 10.508 1.00 21.44 H new ATOM 0 HB3 ALA A 21 10.475 1.028 8.844 1.00 21.44 H new ATOM 317 N TRP A 22 7.105 -0.208 9.102 1.00 64.50 N ATOM 318 CA TRP A 22 5.948 -0.002 8.251 1.00 52.34 C ATOM 319 C TRP A 22 5.544 1.463 8.265 1.00 74.05 C ATOM 320 O TRP A 22 5.429 2.079 9.325 1.00 35.44 O ATOM 321 CB TRP A 22 4.774 -0.913 8.659 1.00 73.44 C ATOM 322 CG TRP A 22 4.380 -0.834 10.107 1.00 34.13 C ATOM 323 CD1 TRP A 22 5.008 -1.432 11.161 1.00 31.43 C ATOM 324 CD2 TRP A 22 3.253 -0.137 10.656 1.00 65.32 C ATOM 325 NE1 TRP A 22 4.349 -1.145 12.330 1.00 31.11 N ATOM 326 CE2 TRP A 22 3.267 -0.350 12.047 1.00 13.55 C ATOM 327 CE3 TRP A 22 2.236 0.650 10.106 1.00 43.33 C ATOM 328 CZ2 TRP A 22 2.302 0.195 12.894 1.00 21.11 C ATOM 329 CZ3 TRP A 22 1.282 1.190 10.946 1.00 34.24 C ATOM 330 CH2 TRP A 22 1.319 0.962 12.326 1.00 55.10 C ATOM 0 H TRP A 22 6.940 -0.041 10.095 1.00 64.50 H new ATOM 0 HA TRP A 22 6.221 -0.275 7.232 1.00 52.34 H new ATOM 0 HB2 TRP A 22 3.908 -0.659 8.048 1.00 73.44 H new ATOM 0 HB3 TRP A 22 5.037 -1.945 8.426 1.00 73.44 H new ATOM 0 HD1 TRP A 22 5.895 -2.043 11.086 1.00 31.43 H new ATOM 0 HE1 TRP A 22 4.619 -1.470 13.258 1.00 31.11 H new ATOM 0 HE3 TRP A 22 2.197 0.832 9.042 1.00 43.33 H new ATOM 0 HZ2 TRP A 22 2.329 0.019 13.959 1.00 21.11 H new ATOM 0 HZ3 TRP A 22 0.493 1.799 10.530 1.00 34.24 H new ATOM 0 HH2 TRP A 22 0.558 1.399 12.956 1.00 55.10 H new ATOM 341 N ALA A 23 5.358 2.019 7.079 1.00 22.24 N ATOM 342 CA ALA A 23 5.028 3.423 6.934 1.00 12.01 C ATOM 343 C ALA A 23 4.098 3.622 5.751 1.00 61.50 C ATOM 344 O ALA A 23 4.309 3.040 4.686 1.00 32.12 O ATOM 345 CB ALA A 23 6.296 4.239 6.745 1.00 53.55 C ATOM 0 H ALA A 23 5.431 1.512 6.197 1.00 22.24 H new ATOM 0 HA ALA A 23 4.522 3.761 7.838 1.00 12.01 H new ATOM 0 HB1 ALA A 23 6.038 5.292 6.637 1.00 53.55 H new ATOM 0 HB2 ALA A 23 6.944 4.111 7.612 1.00 53.55 H new ATOM 0 HB3 ALA A 23 6.817 3.899 5.850 1.00 53.55 H new ATOM 351 N TYR A 24 3.074 4.438 5.939 1.00 45.13 N ATOM 352 CA TYR A 24 2.111 4.714 4.884 1.00 1.14 C ATOM 353 C TYR A 24 1.676 6.169 4.929 1.00 73.41 C ATOM 354 O TYR A 24 1.457 6.728 6.007 1.00 4.34 O ATOM 355 CB TYR A 24 0.878 3.807 5.017 1.00 61.53 C ATOM 356 CG TYR A 24 1.144 2.341 4.747 1.00 60.21 C ATOM 357 CD1 TYR A 24 1.040 1.824 3.463 1.00 42.41 C ATOM 358 CD2 TYR A 24 1.495 1.474 5.776 1.00 32.33 C ATOM 359 CE1 TYR A 24 1.279 0.486 3.211 1.00 5.10 C ATOM 360 CE2 TYR A 24 1.737 0.136 5.530 1.00 25.44 C ATOM 361 CZ TYR A 24 1.627 -0.352 4.247 1.00 20.41 C ATOM 362 OH TYR A 24 1.870 -1.684 3.999 1.00 71.04 O ATOM 0 H TYR A 24 2.887 4.923 6.817 1.00 45.13 H new ATOM 0 HA TYR A 24 2.596 4.512 3.929 1.00 1.14 H new ATOM 0 HB2 TYR A 24 0.474 3.910 6.024 1.00 61.53 H new ATOM 0 HB3 TYR A 24 0.110 4.157 4.328 1.00 61.53 H new ATOM 0 HD1 TYR A 24 0.768 2.478 2.648 1.00 42.41 H new ATOM 0 HD2 TYR A 24 1.580 1.853 6.784 1.00 32.33 H new ATOM 0 HE1 TYR A 24 1.193 0.100 2.206 1.00 5.10 H new ATOM 0 HE2 TYR A 24 2.011 -0.524 6.340 1.00 25.44 H new ATOM 0 HH TYR A 24 2.104 -2.135 4.837 1.00 71.04 H new ATOM 372 N ALA A 25 1.566 6.775 3.759 1.00 73.51 N ATOM 373 CA ALA A 25 1.067 8.134 3.643 1.00 73.54 C ATOM 374 C ALA A 25 -0.187 8.157 2.783 1.00 12.11 C ATOM 375 O ALA A 25 -0.117 8.014 1.559 1.00 1.11 O ATOM 376 CB ALA A 25 2.130 9.054 3.062 1.00 61.34 C ATOM 0 H ALA A 25 1.818 6.343 2.870 1.00 73.51 H new ATOM 0 HA ALA A 25 0.817 8.497 4.640 1.00 73.54 H new ATOM 0 HB1 ALA A 25 1.733 10.066 2.985 1.00 61.34 H new ATOM 0 HB2 ALA A 25 3.004 9.056 3.713 1.00 61.34 H new ATOM 0 HB3 ALA A 25 2.416 8.700 2.071 1.00 61.34 H new ATOM 382 N PHE A 26 -1.332 8.312 3.431 1.00 11.44 N ATOM 383 CA PHE A 26 -2.608 8.331 2.731 1.00 4.43 C ATOM 384 C PHE A 26 -2.972 9.756 2.343 1.00 31.13 C ATOM 385 O PHE A 26 -3.474 10.527 3.165 1.00 52.44 O ATOM 386 CB PHE A 26 -3.710 7.720 3.601 1.00 61.14 C ATOM 387 CG PHE A 26 -3.472 6.280 3.956 1.00 5.21 C ATOM 388 CD1 PHE A 26 -3.855 5.271 3.090 1.00 33.42 C ATOM 389 CD2 PHE A 26 -2.865 5.934 5.154 1.00 4.24 C ATOM 390 CE1 PHE A 26 -3.640 3.945 3.410 1.00 32.31 C ATOM 391 CE2 PHE A 26 -2.649 4.609 5.480 1.00 1.22 C ATOM 392 CZ PHE A 26 -3.036 3.612 4.607 1.00 50.24 C ATOM 0 H PHE A 26 -1.404 8.427 4.442 1.00 11.44 H new ATOM 0 HA PHE A 26 -2.514 7.732 1.825 1.00 4.43 H new ATOM 0 HB2 PHE A 26 -3.800 8.301 4.519 1.00 61.14 H new ATOM 0 HB3 PHE A 26 -4.662 7.803 3.077 1.00 61.14 H new ATOM 0 HD1 PHE A 26 -4.328 5.524 2.152 1.00 33.42 H new ATOM 0 HD2 PHE A 26 -2.558 6.709 5.840 1.00 4.24 H new ATOM 0 HE1 PHE A 26 -3.944 3.168 2.724 1.00 32.31 H new ATOM 0 HE2 PHE A 26 -2.178 4.353 6.417 1.00 1.22 H new ATOM 0 HZ PHE A 26 -2.867 2.575 4.859 1.00 50.24 H new ATOM 402 N VAL A 27 -2.707 10.103 1.094 1.00 24.20 N ATOM 403 CA VAL A 27 -2.922 11.458 0.617 1.00 65.31 C ATOM 404 C VAL A 27 -4.144 11.531 -0.297 1.00 54.50 C ATOM 405 O VAL A 27 -4.253 10.801 -1.283 1.00 63.21 O ATOM 406 CB VAL A 27 -1.669 12.009 -0.110 1.00 33.42 C ATOM 407 CG1 VAL A 27 -1.178 11.039 -1.171 1.00 10.21 C ATOM 408 CG2 VAL A 27 -1.947 13.369 -0.729 1.00 10.10 C ATOM 0 H VAL A 27 -2.341 9.462 0.390 1.00 24.20 H new ATOM 0 HA VAL A 27 -3.107 12.084 1.490 1.00 65.31 H new ATOM 0 HB VAL A 27 -0.884 12.126 0.638 1.00 33.42 H new ATOM 0 HG11 VAL A 27 -0.298 11.453 -1.664 1.00 10.21 H new ATOM 0 HG12 VAL A 27 -0.919 10.089 -0.703 1.00 10.21 H new ATOM 0 HG13 VAL A 27 -1.964 10.878 -1.908 1.00 10.21 H new ATOM 0 HG21 VAL A 27 -1.050 13.730 -1.232 1.00 10.10 H new ATOM 0 HG22 VAL A 27 -2.758 13.281 -1.452 1.00 10.10 H new ATOM 0 HG23 VAL A 27 -2.233 14.073 0.053 1.00 10.10 H new ATOM 418 N LYS A 28 -5.073 12.404 0.052 1.00 43.31 N ATOM 419 CA LYS A 28 -6.276 12.594 -0.733 1.00 53.43 C ATOM 420 C LYS A 28 -6.529 14.081 -0.939 1.00 73.34 C ATOM 421 O LYS A 28 -6.452 14.864 0.009 1.00 53.25 O ATOM 422 CB LYS A 28 -7.470 11.938 -0.039 1.00 74.42 C ATOM 423 CG LYS A 28 -8.725 11.912 -0.893 1.00 74.35 C ATOM 424 CD LYS A 28 -9.851 11.139 -0.227 1.00 15.52 C ATOM 425 CE LYS A 28 -10.341 11.812 1.043 1.00 52.22 C ATOM 426 NZ LYS A 28 -11.643 11.247 1.496 1.00 64.10 N ATOM 0 H LYS A 28 -5.014 12.996 0.881 1.00 43.31 H new ATOM 0 HA LYS A 28 -6.144 12.122 -1.707 1.00 53.43 H new ATOM 0 HB2 LYS A 28 -7.205 10.917 0.235 1.00 74.42 H new ATOM 0 HB3 LYS A 28 -7.681 12.472 0.887 1.00 74.42 H new ATOM 0 HG2 LYS A 28 -9.052 12.933 -1.088 1.00 74.35 H new ATOM 0 HG3 LYS A 28 -8.497 11.461 -1.859 1.00 74.35 H new ATOM 0 HD2 LYS A 28 -10.682 11.038 -0.925 1.00 15.52 H new ATOM 0 HD3 LYS A 28 -9.508 10.132 0.008 1.00 15.52 H new ATOM 0 HE2 LYS A 28 -9.597 11.690 1.830 1.00 52.22 H new ATOM 0 HE3 LYS A 28 -10.449 12.883 0.870 1.00 52.22 H new ATOM 0 HZ1 LYS A 28 -12.126 11.935 2.108 1.00 64.10 H new ATOM 0 HZ2 LYS A 28 -12.239 11.042 0.669 1.00 64.10 H new ATOM 0 HZ3 LYS A 28 -11.474 10.369 2.028 1.00 64.10 H new ATOM 440 N ASP A 29 -6.784 14.463 -2.192 1.00 52.04 N ATOM 441 CA ASP A 29 -7.021 15.862 -2.570 1.00 30.13 C ATOM 442 C ASP A 29 -5.748 16.685 -2.419 1.00 11.05 C ATOM 443 O ASP A 29 -5.770 17.912 -2.529 1.00 55.23 O ATOM 444 CB ASP A 29 -8.143 16.502 -1.741 1.00 13.21 C ATOM 445 CG ASP A 29 -9.483 15.822 -1.924 1.00 14.55 C ATOM 446 OD1 ASP A 29 -10.126 16.039 -2.973 1.00 24.44 O ATOM 447 OD2 ASP A 29 -9.906 15.084 -1.011 1.00 52.21 O ATOM 0 H ASP A 29 -6.833 13.812 -2.976 1.00 52.04 H new ATOM 0 HA ASP A 29 -7.331 15.857 -3.615 1.00 30.13 H new ATOM 0 HB2 ASP A 29 -7.869 16.472 -0.686 1.00 13.21 H new ATOM 0 HB3 ASP A 29 -8.235 17.553 -2.017 1.00 13.21 H new ATOM 452 N GLY A 30 -4.633 16.004 -2.196 1.00 13.13 N ATOM 453 CA GLY A 30 -3.382 16.689 -1.954 1.00 43.20 C ATOM 454 C GLY A 30 -3.096 16.824 -0.470 1.00 13.13 C ATOM 455 O GLY A 30 -2.093 17.416 -0.073 1.00 74.43 O ATOM 0 H GLY A 30 -4.574 14.986 -2.179 1.00 13.13 H new ATOM 0 HA2 GLY A 30 -2.569 16.143 -2.433 1.00 43.20 H new ATOM 0 HA3 GLY A 30 -3.414 17.678 -2.410 1.00 43.20 H new ATOM 459 N LYS A 31 -3.987 16.274 0.349 1.00 51.42 N ATOM 460 CA LYS A 31 -3.836 16.334 1.796 1.00 75.14 C ATOM 461 C LYS A 31 -3.601 14.941 2.362 1.00 21.02 C ATOM 462 O LYS A 31 -4.369 14.017 2.102 1.00 41.12 O ATOM 463 CB LYS A 31 -5.080 16.937 2.445 1.00 12.15 C ATOM 464 CG LYS A 31 -5.529 18.247 1.818 1.00 25.22 C ATOM 465 CD LYS A 31 -4.445 19.304 1.901 1.00 21.45 C ATOM 466 CE LYS A 31 -4.858 20.581 1.194 1.00 22.30 C ATOM 467 NZ LYS A 31 -3.786 21.606 1.250 1.00 21.34 N ATOM 0 H LYS A 31 -4.822 15.781 0.033 1.00 51.42 H new ATOM 0 HA LYS A 31 -2.976 16.966 2.018 1.00 75.14 H new ATOM 0 HB2 LYS A 31 -5.896 16.217 2.382 1.00 12.15 H new ATOM 0 HB3 LYS A 31 -4.882 17.102 3.504 1.00 12.15 H new ATOM 0 HG2 LYS A 31 -5.796 18.079 0.775 1.00 25.22 H new ATOM 0 HG3 LYS A 31 -6.426 18.604 2.323 1.00 25.22 H new ATOM 0 HD2 LYS A 31 -4.226 19.520 2.947 1.00 21.45 H new ATOM 0 HD3 LYS A 31 -3.527 18.921 1.455 1.00 21.45 H new ATOM 0 HE2 LYS A 31 -5.098 20.361 0.154 1.00 22.30 H new ATOM 0 HE3 LYS A 31 -5.764 20.976 1.654 1.00 22.30 H new ATOM 0 HZ1 LYS A 31 -4.102 22.466 0.757 1.00 21.34 H new ATOM 0 HZ2 LYS A 31 -3.575 21.834 2.243 1.00 21.34 H new ATOM 0 HZ3 LYS A 31 -2.929 21.238 0.789 1.00 21.34 H new ATOM 481 N VAL A 32 -2.542 14.798 3.131 1.00 5.42 N ATOM 482 CA VAL A 32 -2.215 13.524 3.752 1.00 3.04 C ATOM 483 C VAL A 32 -2.967 13.372 5.076 1.00 21.42 C ATOM 484 O VAL A 32 -2.664 14.034 6.070 1.00 3.55 O ATOM 485 CB VAL A 32 -0.685 13.362 3.949 1.00 42.13 C ATOM 486 CG1 VAL A 32 -0.089 14.525 4.735 1.00 31.42 C ATOM 487 CG2 VAL A 32 -0.363 12.035 4.624 1.00 71.53 C ATOM 0 H VAL A 32 -1.887 15.551 3.344 1.00 5.42 H new ATOM 0 HA VAL A 32 -2.535 12.727 3.081 1.00 3.04 H new ATOM 0 HB VAL A 32 -0.228 13.367 2.960 1.00 42.13 H new ATOM 0 HG11 VAL A 32 0.984 14.374 4.851 1.00 31.42 H new ATOM 0 HG12 VAL A 32 -0.268 15.457 4.198 1.00 31.42 H new ATOM 0 HG13 VAL A 32 -0.557 14.577 5.718 1.00 31.42 H new ATOM 0 HG21 VAL A 32 0.716 11.944 4.752 1.00 71.53 H new ATOM 0 HG22 VAL A 32 -0.848 11.996 5.599 1.00 71.53 H new ATOM 0 HG23 VAL A 32 -0.726 11.214 4.005 1.00 71.53 H new ATOM 497 N HIS A 33 -3.974 12.512 5.074 1.00 50.53 N ATOM 498 CA HIS A 33 -4.841 12.358 6.237 1.00 3.12 C ATOM 499 C HIS A 33 -4.152 11.511 7.301 1.00 1.25 C ATOM 500 O HIS A 33 -4.195 11.833 8.486 1.00 63.12 O ATOM 501 CB HIS A 33 -6.175 11.717 5.839 1.00 1.02 C ATOM 502 CG HIS A 33 -7.355 12.220 6.622 1.00 1.31 C ATOM 503 ND1 HIS A 33 -7.579 11.926 7.952 1.00 62.34 N ATOM 504 CD2 HIS A 33 -8.393 13.001 6.237 1.00 63.32 C ATOM 505 CE1 HIS A 33 -8.704 12.502 8.344 1.00 63.45 C ATOM 506 NE2 HIS A 33 -9.214 13.158 7.323 1.00 4.10 N ATOM 0 H HIS A 33 -4.212 11.911 4.285 1.00 50.53 H new ATOM 0 HA HIS A 33 -5.042 13.348 6.646 1.00 3.12 H new ATOM 0 HB2 HIS A 33 -6.352 11.899 4.779 1.00 1.02 H new ATOM 0 HB3 HIS A 33 -6.100 10.637 5.969 1.00 1.02 H new ATOM 0 HD2 HIS A 33 -8.545 13.423 5.254 1.00 63.32 H new ATOM 0 HE1 HIS A 33 -9.131 12.444 9.334 1.00 63.45 H new ATOM 0 HE2 HIS A 33 -10.080 13.696 7.338 1.00 4.10 H new ATOM 515 N TYR A 34 -3.518 10.429 6.869 1.00 4.24 N ATOM 516 CA TYR A 34 -2.810 9.543 7.784 1.00 52.31 C ATOM 517 C TYR A 34 -1.353 9.422 7.372 1.00 23.30 C ATOM 518 O TYR A 34 -1.049 9.308 6.184 1.00 2.31 O ATOM 519 CB TYR A 34 -3.447 8.149 7.795 1.00 33.11 C ATOM 520 CG TYR A 34 -4.867 8.111 8.315 1.00 25.13 C ATOM 521 CD1 TYR A 34 -5.947 8.347 7.471 1.00 50.34 C ATOM 522 CD2 TYR A 34 -5.127 7.826 9.650 1.00 41.31 C ATOM 523 CE1 TYR A 34 -7.244 8.305 7.946 1.00 22.31 C ATOM 524 CE2 TYR A 34 -6.421 7.781 10.130 1.00 61.10 C ATOM 525 CZ TYR A 34 -7.476 8.020 9.274 1.00 32.33 C ATOM 526 OH TYR A 34 -8.766 7.976 9.750 1.00 23.43 O ATOM 0 H TYR A 34 -3.479 10.143 5.891 1.00 4.24 H new ATOM 0 HA TYR A 34 -2.875 9.971 8.785 1.00 52.31 H new ATOM 0 HB2 TYR A 34 -3.434 7.750 6.781 1.00 33.11 H new ATOM 0 HB3 TYR A 34 -2.832 7.488 8.406 1.00 33.11 H new ATOM 0 HD1 TYR A 34 -5.769 8.566 6.429 1.00 50.34 H new ATOM 0 HD2 TYR A 34 -4.304 7.637 10.323 1.00 41.31 H new ATOM 0 HE1 TYR A 34 -8.072 8.495 7.279 1.00 22.31 H new ATOM 0 HE2 TYR A 34 -6.606 7.560 11.171 1.00 61.10 H new ATOM 0 HH TYR A 34 -8.755 7.761 10.706 1.00 23.43 H new ATOM 536 N GLU A 35 -0.466 9.426 8.359 1.00 22.02 N ATOM 537 CA GLU A 35 0.970 9.331 8.118 1.00 41.21 C ATOM 538 C GLU A 35 1.680 8.908 9.399 1.00 61.32 C ATOM 539 O GLU A 35 1.583 9.593 10.421 1.00 3.23 O ATOM 540 CB GLU A 35 1.513 10.683 7.636 1.00 2.44 C ATOM 541 CG GLU A 35 3.017 10.703 7.393 1.00 23.22 C ATOM 542 CD GLU A 35 3.515 12.077 6.992 1.00 34.45 C ATOM 543 OE1 GLU A 35 3.583 12.968 7.869 1.00 72.32 O ATOM 544 OE2 GLU A 35 3.834 12.280 5.807 1.00 51.41 O ATOM 0 H GLU A 35 -0.719 9.495 9.345 1.00 22.02 H new ATOM 0 HA GLU A 35 1.154 8.584 7.346 1.00 41.21 H new ATOM 0 HB2 GLU A 35 1.004 10.958 6.712 1.00 2.44 H new ATOM 0 HB3 GLU A 35 1.266 11.445 8.375 1.00 2.44 H new ATOM 0 HG2 GLU A 35 3.534 10.381 8.297 1.00 23.22 H new ATOM 0 HG3 GLU A 35 3.266 9.986 6.611 1.00 23.22 H new ATOM 551 N ASP A 36 2.375 7.781 9.351 1.00 22.15 N ATOM 552 CA ASP A 36 3.106 7.283 10.513 1.00 24.03 C ATOM 553 C ASP A 36 4.077 6.190 10.088 1.00 33.33 C ATOM 554 O ASP A 36 3.892 5.565 9.043 1.00 45.41 O ATOM 555 CB ASP A 36 2.135 6.737 11.566 1.00 75.33 C ATOM 556 CG ASP A 36 2.770 6.620 12.938 1.00 64.24 C ATOM 557 OD1 ASP A 36 2.879 7.656 13.630 1.00 72.23 O ATOM 558 OD2 ASP A 36 3.157 5.503 13.336 1.00 43.12 O ATOM 0 H ASP A 36 2.450 7.192 8.521 1.00 22.15 H new ATOM 0 HA ASP A 36 3.666 8.110 10.950 1.00 24.03 H new ATOM 0 HB2 ASP A 36 1.265 7.391 11.627 1.00 75.33 H new ATOM 0 HB3 ASP A 36 1.776 5.757 11.251 1.00 75.33 H new ATOM 563 N ALA A 37 5.109 5.972 10.890 1.00 70.25 N ATOM 564 CA ALA A 37 6.095 4.942 10.605 1.00 54.54 C ATOM 565 C ALA A 37 6.566 4.282 11.893 1.00 44.43 C ATOM 566 O ALA A 37 7.287 4.894 12.687 1.00 55.51 O ATOM 567 CB ALA A 37 7.277 5.530 9.854 1.00 32.41 C ATOM 0 H ALA A 37 5.285 6.497 11.746 1.00 70.25 H new ATOM 0 HA ALA A 37 5.626 4.184 9.978 1.00 54.54 H new ATOM 0 HB1 ALA A 37 8.005 4.745 9.649 1.00 32.41 H new ATOM 0 HB2 ALA A 37 6.933 5.960 8.913 1.00 32.41 H new ATOM 0 HB3 ALA A 37 7.743 6.307 10.460 1.00 32.41 H new ATOM 573 N ASP A 38 6.155 3.043 12.103 1.00 34.15 N ATOM 574 CA ASP A 38 6.503 2.322 13.319 1.00 71.41 C ATOM 575 C ASP A 38 7.370 1.115 12.967 1.00 52.40 C ATOM 576 O ASP A 38 7.232 0.540 11.886 1.00 15.44 O ATOM 577 CB ASP A 38 5.231 1.875 14.047 1.00 14.25 C ATOM 578 CG ASP A 38 5.410 1.790 15.551 1.00 23.32 C ATOM 579 OD1 ASP A 38 5.848 0.735 16.050 1.00 31.41 O ATOM 580 OD2 ASP A 38 5.099 2.786 16.246 1.00 12.13 O ATOM 0 H ASP A 38 5.580 2.514 11.448 1.00 34.15 H new ATOM 0 HA ASP A 38 7.065 2.980 13.981 1.00 71.41 H new ATOM 0 HB2 ASP A 38 4.425 2.573 13.821 1.00 14.25 H new ATOM 0 HB3 ASP A 38 4.925 0.900 13.667 1.00 14.25 H new ATOM 585 N VAL A 39 8.277 0.745 13.860 1.00 65.53 N ATOM 586 CA VAL A 39 9.185 -0.358 13.602 1.00 44.43 C ATOM 587 C VAL A 39 8.632 -1.669 14.154 1.00 50.04 C ATOM 588 O VAL A 39 8.123 -1.724 15.275 1.00 24.31 O ATOM 589 CB VAL A 39 10.584 -0.086 14.194 1.00 71.23 C ATOM 590 CG1 VAL A 39 11.261 1.058 13.455 1.00 55.02 C ATOM 591 CG2 VAL A 39 10.500 0.216 15.681 1.00 13.32 C ATOM 0 H VAL A 39 8.402 1.193 14.768 1.00 65.53 H new ATOM 0 HA VAL A 39 9.280 -0.448 12.520 1.00 44.43 H new ATOM 0 HB VAL A 39 11.185 -0.987 14.067 1.00 71.23 H new ATOM 0 HG11 VAL A 39 12.246 1.237 13.885 1.00 55.02 H new ATOM 0 HG12 VAL A 39 11.367 0.799 12.402 1.00 55.02 H new ATOM 0 HG13 VAL A 39 10.656 1.960 13.548 1.00 55.02 H new ATOM 0 HG21 VAL A 39 11.500 0.404 16.071 1.00 13.32 H new ATOM 0 HG22 VAL A 39 9.878 1.097 15.839 1.00 13.32 H new ATOM 0 HG23 VAL A 39 10.061 -0.636 16.201 1.00 13.32 H new ATOM 601 N GLY A 40 8.737 -2.725 13.364 1.00 25.21 N ATOM 602 CA GLY A 40 8.203 -4.008 13.774 1.00 53.40 C ATOM 603 C GLY A 40 6.751 -4.177 13.376 1.00 34.11 C ATOM 604 O GLY A 40 5.862 -3.538 13.942 1.00 4.20 O ATOM 0 H GLY A 40 9.182 -2.718 12.446 1.00 25.21 H new ATOM 0 HA2 GLY A 40 8.796 -4.806 13.327 1.00 53.40 H new ATOM 0 HA3 GLY A 40 8.296 -4.110 14.855 1.00 53.40 H new ATOM 608 N LYS A 41 6.510 -5.031 12.393 1.00 24.23 N ATOM 609 CA LYS A 41 5.157 -5.288 11.920 1.00 70.31 C ATOM 610 C LYS A 41 4.565 -6.474 12.670 1.00 10.12 C ATOM 611 O LYS A 41 4.819 -7.628 12.325 1.00 34.33 O ATOM 612 CB LYS A 41 5.156 -5.565 10.414 1.00 41.20 C ATOM 613 CG LYS A 41 5.864 -4.496 9.597 1.00 3.25 C ATOM 614 CD LYS A 41 5.742 -4.766 8.106 1.00 1.34 C ATOM 615 CE LYS A 41 6.606 -3.815 7.295 1.00 41.20 C ATOM 616 NZ LYS A 41 6.426 -4.015 5.832 1.00 22.44 N ATOM 0 H LYS A 41 7.234 -5.559 11.906 1.00 24.23 H new ATOM 0 HA LYS A 41 4.548 -4.404 12.108 1.00 70.31 H new ATOM 0 HB2 LYS A 41 5.634 -6.527 10.230 1.00 41.20 H new ATOM 0 HB3 LYS A 41 4.125 -5.650 10.070 1.00 41.20 H new ATOM 0 HG2 LYS A 41 5.439 -3.519 9.827 1.00 3.25 H new ATOM 0 HG3 LYS A 41 6.917 -4.460 9.877 1.00 3.25 H new ATOM 0 HD2 LYS A 41 6.036 -5.795 7.896 1.00 1.34 H new ATOM 0 HD3 LYS A 41 4.701 -4.663 7.801 1.00 1.34 H new ATOM 0 HE2 LYS A 41 6.356 -2.786 7.554 1.00 41.20 H new ATOM 0 HE3 LYS A 41 7.654 -3.964 7.556 1.00 41.20 H new ATOM 0 HZ1 LYS A 41 7.032 -3.348 5.313 1.00 22.44 H new ATOM 0 HZ2 LYS A 41 6.689 -4.989 5.580 1.00 22.44 H new ATOM 0 HZ3 LYS A 41 5.431 -3.848 5.579 1.00 22.44 H new ATOM 630 N ASN A 42 3.797 -6.184 13.711 1.00 44.13 N ATOM 631 CA ASN A 42 3.251 -7.224 14.577 1.00 14.54 C ATOM 632 C ASN A 42 1.774 -6.978 14.863 1.00 42.43 C ATOM 633 O ASN A 42 1.345 -5.830 14.993 1.00 42.33 O ATOM 634 CB ASN A 42 4.029 -7.265 15.893 1.00 74.41 C ATOM 635 CG ASN A 42 5.443 -7.789 15.729 1.00 21.13 C ATOM 636 OD1 ASN A 42 5.692 -8.718 14.963 1.00 30.32 O ATOM 637 ND2 ASN A 42 6.381 -7.177 16.430 1.00 42.41 N ATOM 0 H ASN A 42 3.536 -5.235 13.978 1.00 44.13 H new ATOM 0 HA ASN A 42 3.348 -8.181 14.064 1.00 14.54 H new ATOM 0 HB2 ASN A 42 4.066 -6.262 16.318 1.00 74.41 H new ATOM 0 HB3 ASN A 42 3.495 -7.894 16.605 1.00 74.41 H new ATOM 0 HD21 ASN A 42 7.354 -7.472 16.346 1.00 42.41 H new ATOM 0 HD22 ASN A 42 6.132 -6.410 17.055 1.00 42.41 H new ATOM 644 N PRO A 43 0.983 -8.061 14.973 1.00 64.31 N ATOM 645 CA PRO A 43 -0.458 -7.973 15.252 1.00 43.11 C ATOM 646 C PRO A 43 -0.750 -7.426 16.650 1.00 15.52 C ATOM 647 O PRO A 43 -1.887 -7.079 16.966 1.00 63.14 O ATOM 648 CB PRO A 43 -0.940 -9.424 15.133 1.00 40.23 C ATOM 649 CG PRO A 43 0.276 -10.252 15.363 1.00 44.13 C ATOM 650 CD PRO A 43 1.426 -9.459 14.812 1.00 42.42 C ATOM 0 HA PRO A 43 -0.960 -7.288 14.569 1.00 43.11 H new ATOM 0 HB2 PRO A 43 -1.713 -9.645 15.869 1.00 40.23 H new ATOM 0 HB3 PRO A 43 -1.370 -9.618 14.150 1.00 40.23 H new ATOM 0 HG2 PRO A 43 0.415 -10.455 16.425 1.00 44.13 H new ATOM 0 HG3 PRO A 43 0.192 -11.217 14.863 1.00 44.13 H new ATOM 0 HD2 PRO A 43 2.348 -9.654 15.359 1.00 42.42 H new ATOM 0 HD3 PRO A 43 1.618 -9.702 13.767 1.00 42.42 H new ATOM 658 N ALA A 44 0.292 -7.341 17.474 1.00 52.35 N ATOM 659 CA ALA A 44 0.171 -6.815 18.832 1.00 24.44 C ATOM 660 C ALA A 44 -0.328 -5.371 18.823 1.00 34.33 C ATOM 661 O ALA A 44 -0.895 -4.896 19.807 1.00 44.23 O ATOM 662 CB ALA A 44 1.508 -6.912 19.555 1.00 72.12 C ATOM 0 H ALA A 44 1.237 -7.632 17.222 1.00 52.35 H new ATOM 0 HA ALA A 44 -0.563 -7.419 19.365 1.00 24.44 H new ATOM 0 HB1 ALA A 44 1.405 -6.517 20.566 1.00 72.12 H new ATOM 0 HB2 ALA A 44 1.821 -7.955 19.603 1.00 72.12 H new ATOM 0 HB3 ALA A 44 2.257 -6.333 19.014 1.00 72.12 H new ATOM 668 N ALA A 45 -0.129 -4.686 17.699 1.00 70.31 N ATOM 669 CA ALA A 45 -0.606 -3.318 17.535 1.00 64.05 C ATOM 670 C ALA A 45 -2.129 -3.256 17.631 1.00 15.12 C ATOM 671 O ALA A 45 -2.691 -2.247 18.051 1.00 71.43 O ATOM 672 CB ALA A 45 -0.133 -2.751 16.204 1.00 1.15 C ATOM 0 H ALA A 45 0.361 -5.059 16.886 1.00 70.31 H new ATOM 0 HA ALA A 45 -0.192 -2.712 18.341 1.00 64.05 H new ATOM 0 HB1 ALA A 45 -0.496 -1.729 16.094 1.00 1.15 H new ATOM 0 HB2 ALA A 45 0.957 -2.754 16.174 1.00 1.15 H new ATOM 0 HB3 ALA A 45 -0.520 -3.363 15.390 1.00 1.15 H new ATOM 678 N ALA A 46 -2.787 -4.349 17.262 1.00 23.23 N ATOM 679 CA ALA A 46 -4.241 -4.422 17.312 1.00 74.41 C ATOM 680 C ALA A 46 -4.717 -4.659 18.737 1.00 4.11 C ATOM 681 O ALA A 46 -5.805 -4.232 19.117 1.00 24.32 O ATOM 682 CB ALA A 46 -4.755 -5.525 16.401 1.00 12.23 C ATOM 0 H ALA A 46 -2.335 -5.198 16.924 1.00 23.23 H new ATOM 0 HA ALA A 46 -4.639 -3.469 16.964 1.00 74.41 H new ATOM 0 HB1 ALA A 46 -5.843 -5.563 16.453 1.00 12.23 H new ATOM 0 HB2 ALA A 46 -4.448 -5.322 15.375 1.00 12.23 H new ATOM 0 HB3 ALA A 46 -4.343 -6.482 16.721 1.00 12.23 H new ATOM 688 N THR A 47 -3.897 -5.342 19.517 1.00 1.21 N ATOM 689 CA THR A 47 -4.227 -5.629 20.901 1.00 54.12 C ATOM 690 C THR A 47 -3.944 -4.417 21.784 1.00 34.45 C ATOM 691 O THR A 47 -4.749 -4.054 22.641 1.00 33.41 O ATOM 692 CB THR A 47 -3.415 -6.835 21.413 1.00 22.44 C ATOM 693 OG1 THR A 47 -3.435 -7.882 20.432 1.00 72.11 O ATOM 694 CG2 THR A 47 -3.981 -7.362 22.726 1.00 42.11 C ATOM 0 H THR A 47 -2.995 -5.709 19.213 1.00 1.21 H new ATOM 0 HA THR A 47 -5.290 -5.866 20.949 1.00 54.12 H new ATOM 0 HB THR A 47 -2.390 -6.506 21.586 1.00 22.44 H new ATOM 0 HG1 THR A 47 -2.917 -8.647 20.759 1.00 72.11 H new ATOM 0 HG21 THR A 47 -3.388 -8.212 23.063 1.00 42.11 H new ATOM 0 HG22 THR A 47 -3.947 -6.575 23.479 1.00 42.11 H new ATOM 0 HG23 THR A 47 -5.014 -7.676 22.577 1.00 42.11 H new ATOM 702 N MET A 48 -2.798 -3.787 21.559 1.00 60.03 N ATOM 703 CA MET A 48 -2.384 -2.649 22.366 1.00 4.23 C ATOM 704 C MET A 48 -3.078 -1.365 21.919 1.00 42.03 C ATOM 705 O MET A 48 -3.910 -0.819 22.637 1.00 1.02 O ATOM 706 CB MET A 48 -0.866 -2.470 22.296 1.00 13.23 C ATOM 707 CG MET A 48 -0.348 -1.317 23.145 1.00 72.21 C ATOM 708 SD MET A 48 1.424 -1.046 22.945 1.00 65.04 S ATOM 709 CE MET A 48 2.078 -2.590 23.576 1.00 11.23 C ATOM 0 H MET A 48 -2.140 -4.046 20.824 1.00 60.03 H new ATOM 0 HA MET A 48 -2.676 -2.852 23.396 1.00 4.23 H new ATOM 0 HB2 MET A 48 -0.385 -3.393 22.619 1.00 13.23 H new ATOM 0 HB3 MET A 48 -0.575 -2.305 21.258 1.00 13.23 H new ATOM 0 HG2 MET A 48 -0.883 -0.406 22.878 1.00 72.21 H new ATOM 0 HG3 MET A 48 -0.564 -1.518 24.194 1.00 72.21 H new ATOM 0 HE1 MET A 48 3.142 -2.476 23.785 1.00 11.23 H new ATOM 0 HE2 MET A 48 1.554 -2.859 24.493 1.00 11.23 H new ATOM 0 HE3 MET A 48 1.936 -3.376 22.834 1.00 11.23 H new ATOM 719 N ARG A 49 -2.748 -0.897 20.721 1.00 54.21 N ATOM 720 CA ARG A 49 -3.212 0.409 20.261 1.00 61.11 C ATOM 721 C ARG A 49 -4.557 0.300 19.551 1.00 22.15 C ATOM 722 O ARG A 49 -5.216 1.310 19.300 1.00 44.43 O ATOM 723 CB ARG A 49 -2.175 1.035 19.328 1.00 3.13 C ATOM 724 CG ARG A 49 -0.771 1.060 19.914 1.00 12.10 C ATOM 725 CD ARG A 49 -0.687 1.923 21.163 1.00 4.22 C ATOM 726 NE ARG A 49 -0.612 3.348 20.855 1.00 50.22 N ATOM 727 CZ ARG A 49 -0.585 4.304 21.779 1.00 53.05 C ATOM 728 NH1 ARG A 49 -0.784 4.007 23.060 1.00 20.25 N ATOM 729 NH2 ARG A 49 -0.398 5.561 21.411 1.00 15.22 N ATOM 0 H ARG A 49 -2.164 -1.399 20.052 1.00 54.21 H new ATOM 0 HA ARG A 49 -3.343 1.048 21.134 1.00 61.11 H new ATOM 0 HB2 ARG A 49 -2.159 0.480 18.390 1.00 3.13 H new ATOM 0 HB3 ARG A 49 -2.480 2.054 19.090 1.00 3.13 H new ATOM 0 HG2 ARG A 49 -0.461 0.043 20.155 1.00 12.10 H new ATOM 0 HG3 ARG A 49 -0.073 1.437 19.166 1.00 12.10 H new ATOM 0 HD2 ARG A 49 -1.559 1.736 21.789 1.00 4.22 H new ATOM 0 HD3 ARG A 49 0.190 1.633 21.742 1.00 4.22 H new ATOM 0 HE ARG A 49 -0.578 3.627 19.874 1.00 50.22 H new ATOM 0 HH11 ARG A 49 -0.959 3.041 23.338 1.00 20.25 H new ATOM 0 HH12 ARG A 49 -0.762 4.745 23.764 1.00 20.25 H new ATOM 0 HH21 ARG A 49 -0.276 5.791 20.425 1.00 15.22 H new ATOM 0 HH22 ARG A 49 -0.376 6.300 22.114 1.00 15.22 H new ATOM 743 N ASN A 50 -4.931 -0.933 19.192 1.00 51.33 N ATOM 744 CA ASN A 50 -6.234 -1.234 18.577 1.00 2.33 C ATOM 745 C ASN A 50 -6.325 -0.683 17.149 1.00 0.21 C ATOM 746 O ASN A 50 -7.315 -0.893 16.451 1.00 33.42 O ATOM 747 CB ASN A 50 -7.378 -0.680 19.442 1.00 74.03 C ATOM 748 CG ASN A 50 -8.723 -1.315 19.137 1.00 65.52 C ATOM 749 OD1 ASN A 50 -9.456 -0.870 18.253 1.00 22.32 O ATOM 750 ND2 ASN A 50 -9.067 -2.353 19.883 1.00 21.41 N ATOM 0 H ASN A 50 -4.339 -1.754 19.319 1.00 51.33 H new ATOM 0 HA ASN A 50 -6.330 -2.318 18.519 1.00 2.33 H new ATOM 0 HB2 ASN A 50 -7.139 -0.839 20.494 1.00 74.03 H new ATOM 0 HB3 ASN A 50 -7.450 0.397 19.291 1.00 74.03 H new ATOM 0 HD21 ASN A 50 -9.966 -2.812 19.735 1.00 21.41 H new ATOM 0 HD22 ASN A 50 -8.433 -2.694 20.606 1.00 21.41 H new ATOM 757 N VAL A 51 -5.262 -0.013 16.709 1.00 53.22 N ATOM 758 CA VAL A 51 -5.236 0.650 15.405 1.00 31.22 C ATOM 759 C VAL A 51 -5.531 -0.324 14.266 1.00 50.10 C ATOM 760 O VAL A 51 -6.301 -0.011 13.360 1.00 44.21 O ATOM 761 CB VAL A 51 -3.870 1.330 15.149 1.00 22.22 C ATOM 762 CG1 VAL A 51 -3.848 2.028 13.793 1.00 54.32 C ATOM 763 CG2 VAL A 51 -3.549 2.315 16.263 1.00 30.10 C ATOM 0 H VAL A 51 -4.398 0.086 17.242 1.00 53.22 H new ATOM 0 HA VAL A 51 -6.018 1.408 15.428 1.00 31.22 H new ATOM 0 HB VAL A 51 -3.104 0.555 15.139 1.00 22.22 H new ATOM 0 HG11 VAL A 51 -2.876 2.497 13.641 1.00 54.32 H new ATOM 0 HG12 VAL A 51 -4.026 1.297 13.004 1.00 54.32 H new ATOM 0 HG13 VAL A 51 -4.627 2.790 13.763 1.00 54.32 H new ATOM 0 HG21 VAL A 51 -2.585 2.784 16.067 1.00 30.10 H new ATOM 0 HG22 VAL A 51 -4.323 3.081 16.306 1.00 30.10 H new ATOM 0 HG23 VAL A 51 -3.508 1.787 17.215 1.00 30.10 H new ATOM 773 N ALA A 52 -4.940 -1.511 14.328 1.00 2.10 N ATOM 774 CA ALA A 52 -5.096 -2.498 13.262 1.00 43.24 C ATOM 775 C ALA A 52 -6.550 -2.944 13.115 1.00 52.44 C ATOM 776 O ALA A 52 -6.951 -3.439 12.061 1.00 25.42 O ATOM 777 CB ALA A 52 -4.195 -3.693 13.513 1.00 21.20 C ATOM 0 H ALA A 52 -4.349 -1.815 15.102 1.00 2.10 H new ATOM 0 HA ALA A 52 -4.802 -2.024 12.325 1.00 43.24 H new ATOM 0 HB1 ALA A 52 -4.322 -4.420 12.711 1.00 21.20 H new ATOM 0 HB2 ALA A 52 -3.156 -3.365 13.544 1.00 21.20 H new ATOM 0 HB3 ALA A 52 -4.459 -4.154 14.465 1.00 21.20 H new ATOM 783 N GLY A 53 -7.331 -2.770 14.172 1.00 3.55 N ATOM 784 CA GLY A 53 -8.739 -3.112 14.122 1.00 45.41 C ATOM 785 C GLY A 53 -9.545 -2.106 13.322 1.00 25.22 C ATOM 786 O GLY A 53 -10.290 -2.471 12.411 1.00 32.35 O ATOM 0 H GLY A 53 -7.014 -2.397 15.067 1.00 3.55 H new ATOM 0 HA2 GLY A 53 -8.855 -4.102 13.680 1.00 45.41 H new ATOM 0 HA3 GLY A 53 -9.134 -3.167 15.136 1.00 45.41 H new ATOM 790 N GLU A 54 -9.377 -0.832 13.651 1.00 34.11 N ATOM 791 CA GLU A 54 -10.165 0.230 13.037 1.00 44.43 C ATOM 792 C GLU A 54 -9.767 0.468 11.576 1.00 1.20 C ATOM 793 O GLU A 54 -10.617 0.791 10.743 1.00 73.14 O ATOM 794 CB GLU A 54 -10.043 1.522 13.853 1.00 31.01 C ATOM 795 CG GLU A 54 -8.613 1.999 14.060 1.00 2.30 C ATOM 796 CD GLU A 54 -8.537 3.256 14.900 1.00 24.12 C ATOM 797 OE1 GLU A 54 -8.525 3.144 16.146 1.00 72.33 O ATOM 798 OE2 GLU A 54 -8.493 4.361 14.324 1.00 32.54 O ATOM 0 H GLU A 54 -8.700 -0.508 14.342 1.00 34.11 H new ATOM 0 HA GLU A 54 -11.207 -0.089 13.037 1.00 44.43 H new ATOM 0 HB2 GLU A 54 -10.607 2.309 13.352 1.00 31.01 H new ATOM 0 HB3 GLU A 54 -10.507 1.368 14.827 1.00 31.01 H new ATOM 0 HG2 GLU A 54 -8.036 1.209 14.541 1.00 2.30 H new ATOM 0 HG3 GLU A 54 -8.152 2.186 13.090 1.00 2.30 H new ATOM 805 N ILE A 55 -8.486 0.298 11.263 1.00 32.12 N ATOM 806 CA ILE A 55 -8.000 0.504 9.905 1.00 24.12 C ATOM 807 C ILE A 55 -8.478 -0.598 8.966 1.00 14.22 C ATOM 808 O ILE A 55 -8.644 -0.375 7.769 1.00 42.52 O ATOM 809 CB ILE A 55 -6.465 0.576 9.836 1.00 5.51 C ATOM 810 CG1 ILE A 55 -5.822 -0.689 10.412 1.00 4.44 C ATOM 811 CG2 ILE A 55 -5.961 1.819 10.555 1.00 54.23 C ATOM 812 CD1 ILE A 55 -4.317 -0.734 10.249 1.00 30.54 C ATOM 0 H ILE A 55 -7.768 0.019 11.931 1.00 32.12 H new ATOM 0 HA ILE A 55 -8.411 1.462 9.587 1.00 24.12 H new ATOM 0 HB ILE A 55 -6.175 0.642 8.787 1.00 5.51 H new ATOM 0 HG12 ILE A 55 -6.066 -0.760 11.472 1.00 4.44 H new ATOM 0 HG13 ILE A 55 -6.258 -1.562 9.925 1.00 4.44 H new ATOM 0 HG21 ILE A 55 -4.873 1.856 10.498 1.00 54.23 H new ATOM 0 HG22 ILE A 55 -6.380 2.708 10.083 1.00 54.23 H new ATOM 0 HG23 ILE A 55 -6.268 1.785 11.600 1.00 54.23 H new ATOM 0 HD11 ILE A 55 -3.932 -1.658 10.680 1.00 30.54 H new ATOM 0 HD12 ILE A 55 -4.064 -0.695 9.189 1.00 30.54 H new ATOM 0 HD13 ILE A 55 -3.870 0.119 10.760 1.00 30.54 H new ATOM 824 N ALA A 56 -8.681 -1.785 9.525 1.00 54.32 N ATOM 825 CA ALA A 56 -9.120 -2.957 8.762 1.00 12.41 C ATOM 826 C ALA A 56 -10.377 -2.675 7.935 1.00 24.31 C ATOM 827 O ALA A 56 -10.627 -3.342 6.931 1.00 43.35 O ATOM 828 CB ALA A 56 -9.360 -4.133 9.695 1.00 22.03 C ATOM 0 H ALA A 56 -8.547 -1.967 10.520 1.00 54.32 H new ATOM 0 HA ALA A 56 -8.321 -3.204 8.063 1.00 12.41 H new ATOM 0 HB1 ALA A 56 -9.686 -4.997 9.115 1.00 22.03 H new ATOM 0 HB2 ALA A 56 -8.436 -4.376 10.220 1.00 22.03 H new ATOM 0 HB3 ALA A 56 -10.131 -3.871 10.420 1.00 22.03 H new ATOM 834 N ALA A 57 -11.162 -1.687 8.361 1.00 10.23 N ATOM 835 CA ALA A 57 -12.365 -1.283 7.636 1.00 73.41 C ATOM 836 C ALA A 57 -12.033 -0.867 6.202 1.00 43.22 C ATOM 837 O ALA A 57 -12.824 -1.077 5.281 1.00 34.15 O ATOM 838 CB ALA A 57 -13.059 -0.143 8.369 1.00 0.45 C ATOM 0 H ALA A 57 -10.985 -1.149 9.209 1.00 10.23 H new ATOM 0 HA ALA A 57 -13.038 -2.140 7.590 1.00 73.41 H new ATOM 0 HB1 ALA A 57 -13.954 0.151 7.821 1.00 0.45 H new ATOM 0 HB2 ALA A 57 -13.338 -0.471 9.370 1.00 0.45 H new ATOM 0 HB3 ALA A 57 -12.382 0.708 8.441 1.00 0.45 H new ATOM 844 N ALA A 58 -10.844 -0.305 6.013 1.00 10.41 N ATOM 845 CA ALA A 58 -10.423 0.167 4.703 1.00 42.24 C ATOM 846 C ALA A 58 -10.125 -0.998 3.764 1.00 74.11 C ATOM 847 O ALA A 58 -10.200 -0.856 2.544 1.00 55.13 O ATOM 848 CB ALA A 58 -9.206 1.067 4.836 1.00 11.52 C ATOM 0 H ALA A 58 -10.155 -0.166 6.753 1.00 10.41 H new ATOM 0 HA ALA A 58 -11.242 0.742 4.271 1.00 42.24 H new ATOM 0 HB1 ALA A 58 -8.900 1.414 3.849 1.00 11.52 H new ATOM 0 HB2 ALA A 58 -9.454 1.925 5.461 1.00 11.52 H new ATOM 0 HB3 ALA A 58 -8.389 0.509 5.293 1.00 11.52 H new ATOM 854 N LEU A 59 -9.807 -2.154 4.340 1.00 12.12 N ATOM 855 CA LEU A 59 -9.487 -3.341 3.554 1.00 70.24 C ATOM 856 C LEU A 59 -10.698 -3.764 2.731 1.00 4.03 C ATOM 857 O LEU A 59 -10.575 -4.116 1.559 1.00 30.14 O ATOM 858 CB LEU A 59 -9.024 -4.479 4.483 1.00 55.44 C ATOM 859 CG LEU A 59 -8.461 -5.733 3.798 1.00 21.44 C ATOM 860 CD1 LEU A 59 -7.535 -6.477 4.748 1.00 50.24 C ATOM 861 CD2 LEU A 59 -9.580 -6.663 3.347 1.00 72.51 C ATOM 0 H LEU A 59 -9.764 -2.294 5.349 1.00 12.12 H new ATOM 0 HA LEU A 59 -8.673 -3.109 2.867 1.00 70.24 H new ATOM 0 HB2 LEU A 59 -8.261 -4.084 5.153 1.00 55.44 H new ATOM 0 HB3 LEU A 59 -9.869 -4.779 5.103 1.00 55.44 H new ATOM 0 HG LEU A 59 -7.902 -5.412 2.919 1.00 21.44 H new ATOM 0 HD11 LEU A 59 -7.142 -7.364 4.252 1.00 50.24 H new ATOM 0 HD12 LEU A 59 -6.709 -5.826 5.036 1.00 50.24 H new ATOM 0 HD13 LEU A 59 -8.090 -6.775 5.638 1.00 50.24 H new ATOM 0 HD21 LEU A 59 -9.151 -7.542 2.866 1.00 72.51 H new ATOM 0 HD22 LEU A 59 -10.166 -6.973 4.212 1.00 72.51 H new ATOM 0 HD23 LEU A 59 -10.225 -6.141 2.640 1.00 72.51 H new ATOM 873 N TYR A 60 -11.875 -3.694 3.340 1.00 25.33 N ATOM 874 CA TYR A 60 -13.101 -4.091 2.660 1.00 73.21 C ATOM 875 C TYR A 60 -13.528 -3.051 1.631 1.00 45.10 C ATOM 876 O TYR A 60 -14.203 -3.375 0.656 1.00 54.05 O ATOM 877 CB TYR A 60 -14.221 -4.371 3.660 1.00 23.23 C ATOM 878 CG TYR A 60 -14.598 -5.833 3.698 1.00 53.50 C ATOM 879 CD1 TYR A 60 -13.645 -6.800 3.990 1.00 63.23 C ATOM 880 CD2 TYR A 60 -15.893 -6.250 3.417 1.00 71.22 C ATOM 881 CE1 TYR A 60 -13.972 -8.140 4.005 1.00 22.31 C ATOM 882 CE2 TYR A 60 -16.227 -7.592 3.427 1.00 54.12 C ATOM 883 CZ TYR A 60 -15.262 -8.532 3.723 1.00 73.41 C ATOM 884 OH TYR A 60 -15.584 -9.869 3.727 1.00 14.54 O ATOM 0 H TYR A 60 -12.006 -3.368 4.298 1.00 25.33 H new ATOM 0 HA TYR A 60 -12.894 -5.017 2.124 1.00 73.21 H new ATOM 0 HB2 TYR A 60 -13.907 -4.052 4.654 1.00 23.23 H new ATOM 0 HB3 TYR A 60 -15.097 -3.778 3.397 1.00 23.23 H new ATOM 0 HD1 TYR A 60 -12.631 -6.498 4.209 1.00 63.23 H new ATOM 0 HD2 TYR A 60 -16.650 -5.515 3.187 1.00 71.22 H new ATOM 0 HE1 TYR A 60 -13.219 -8.879 4.237 1.00 22.31 H new ATOM 0 HE2 TYR A 60 -17.237 -7.902 3.204 1.00 54.12 H new ATOM 0 HH TYR A 60 -16.533 -9.977 3.510 1.00 14.54 H new ATOM 894 N ALA A 61 -13.127 -1.806 1.843 1.00 31.43 N ATOM 895 CA ALA A 61 -13.364 -0.764 0.856 1.00 21.52 C ATOM 896 C ALA A 61 -12.578 -1.071 -0.416 1.00 31.22 C ATOM 897 O ALA A 61 -13.089 -0.935 -1.528 1.00 43.14 O ATOM 898 CB ALA A 61 -12.977 0.599 1.414 1.00 51.05 C ATOM 0 H ALA A 61 -12.640 -1.495 2.683 1.00 31.43 H new ATOM 0 HA ALA A 61 -14.427 -0.739 0.615 1.00 21.52 H new ATOM 0 HB1 ALA A 61 -13.161 1.366 0.662 1.00 51.05 H new ATOM 0 HB2 ALA A 61 -13.573 0.811 2.302 1.00 51.05 H new ATOM 0 HB3 ALA A 61 -11.920 0.597 1.679 1.00 51.05 H new ATOM 904 N VAL A 62 -11.340 -1.516 -0.234 1.00 54.41 N ATOM 905 CA VAL A 62 -10.496 -1.936 -1.346 1.00 32.34 C ATOM 906 C VAL A 62 -11.025 -3.239 -1.950 1.00 73.11 C ATOM 907 O VAL A 62 -10.958 -3.452 -3.160 1.00 62.02 O ATOM 908 CB VAL A 62 -9.029 -2.131 -0.890 1.00 11.25 C ATOM 909 CG1 VAL A 62 -8.149 -2.589 -2.045 1.00 3.43 C ATOM 910 CG2 VAL A 62 -8.483 -0.846 -0.282 1.00 32.01 C ATOM 0 H VAL A 62 -10.896 -1.595 0.681 1.00 54.41 H new ATOM 0 HA VAL A 62 -10.522 -1.150 -2.101 1.00 32.34 H new ATOM 0 HB VAL A 62 -9.016 -2.910 -0.128 1.00 11.25 H new ATOM 0 HG11 VAL A 62 -7.125 -2.717 -1.694 1.00 3.43 H new ATOM 0 HG12 VAL A 62 -8.521 -3.538 -2.432 1.00 3.43 H new ATOM 0 HG13 VAL A 62 -8.170 -1.841 -2.837 1.00 3.43 H new ATOM 0 HG21 VAL A 62 -7.451 -1.002 0.033 1.00 32.01 H new ATOM 0 HG22 VAL A 62 -8.519 -0.048 -1.024 1.00 32.01 H new ATOM 0 HG23 VAL A 62 -9.087 -0.567 0.581 1.00 32.01 H new ATOM 920 N LYS A 63 -11.568 -4.097 -1.091 1.00 71.43 N ATOM 921 CA LYS A 63 -12.155 -5.362 -1.521 1.00 41.31 C ATOM 922 C LYS A 63 -13.296 -5.106 -2.504 1.00 53.23 C ATOM 923 O LYS A 63 -13.392 -5.760 -3.543 1.00 52.23 O ATOM 924 CB LYS A 63 -12.657 -6.143 -0.294 1.00 71.32 C ATOM 925 CG LYS A 63 -13.015 -7.605 -0.551 1.00 71.15 C ATOM 926 CD LYS A 63 -14.373 -7.768 -1.221 1.00 14.32 C ATOM 927 CE LYS A 63 -14.750 -9.233 -1.353 1.00 4.30 C ATOM 928 NZ LYS A 63 -16.043 -9.415 -2.062 1.00 53.11 N ATOM 0 H LYS A 63 -11.614 -3.937 -0.085 1.00 71.43 H new ATOM 0 HA LYS A 63 -11.396 -5.958 -2.028 1.00 41.31 H new ATOM 0 HB2 LYS A 63 -11.889 -6.105 0.479 1.00 71.32 H new ATOM 0 HB3 LYS A 63 -13.536 -5.636 0.104 1.00 71.32 H new ATOM 0 HG2 LYS A 63 -12.248 -8.058 -1.179 1.00 71.15 H new ATOM 0 HG3 LYS A 63 -13.014 -8.147 0.395 1.00 71.15 H new ATOM 0 HD2 LYS A 63 -15.133 -7.246 -0.640 1.00 14.32 H new ATOM 0 HD3 LYS A 63 -14.352 -7.305 -2.208 1.00 14.32 H new ATOM 0 HE2 LYS A 63 -13.964 -9.762 -1.892 1.00 4.30 H new ATOM 0 HE3 LYS A 63 -14.814 -9.681 -0.362 1.00 4.30 H new ATOM 0 HZ1 LYS A 63 -16.262 -10.429 -2.130 1.00 53.11 H new ATOM 0 HZ2 LYS A 63 -16.799 -8.932 -1.535 1.00 53.11 H new ATOM 0 HZ3 LYS A 63 -15.975 -9.011 -3.018 1.00 53.11 H new ATOM 942 N LYS A 64 -14.145 -4.136 -2.180 1.00 3.13 N ATOM 943 CA LYS A 64 -15.287 -3.807 -3.025 1.00 11.12 C ATOM 944 C LYS A 64 -14.834 -3.136 -4.320 1.00 12.44 C ATOM 945 O LYS A 64 -15.498 -3.245 -5.351 1.00 13.43 O ATOM 946 CB LYS A 64 -16.263 -2.888 -2.283 1.00 63.13 C ATOM 947 CG LYS A 64 -17.556 -2.640 -3.047 1.00 21.21 C ATOM 948 CD LYS A 64 -18.453 -1.610 -2.371 1.00 24.44 C ATOM 949 CE LYS A 64 -19.032 -2.107 -1.049 1.00 50.11 C ATOM 950 NZ LYS A 64 -18.078 -1.968 0.083 1.00 1.53 N ATOM 0 H LYS A 64 -14.064 -3.565 -1.339 1.00 3.13 H new ATOM 0 HA LYS A 64 -15.794 -4.739 -3.272 1.00 11.12 H new ATOM 0 HB2 LYS A 64 -16.500 -3.328 -1.314 1.00 63.13 H new ATOM 0 HB3 LYS A 64 -15.775 -1.933 -2.088 1.00 63.13 H new ATOM 0 HG2 LYS A 64 -17.318 -2.302 -4.055 1.00 21.21 H new ATOM 0 HG3 LYS A 64 -18.100 -3.579 -3.146 1.00 21.21 H new ATOM 0 HD2 LYS A 64 -17.882 -0.699 -2.193 1.00 24.44 H new ATOM 0 HD3 LYS A 64 -19.269 -1.348 -3.044 1.00 24.44 H new ATOM 0 HE2 LYS A 64 -19.941 -1.550 -0.823 1.00 50.11 H new ATOM 0 HE3 LYS A 64 -19.317 -3.154 -1.152 1.00 50.11 H new ATOM 0 HZ1 LYS A 64 -17.781 -2.911 0.404 1.00 1.53 H new ATOM 0 HZ2 LYS A 64 -17.245 -1.430 -0.229 1.00 1.53 H new ATOM 0 HZ3 LYS A 64 -18.541 -1.465 0.867 1.00 1.53 H new ATOM 964 N ALA A 65 -13.697 -2.449 -4.261 1.00 64.12 N ATOM 965 CA ALA A 65 -13.180 -1.693 -5.400 1.00 12.31 C ATOM 966 C ALA A 65 -12.999 -2.567 -6.643 1.00 13.13 C ATOM 967 O ALA A 65 -13.227 -2.108 -7.762 1.00 2.42 O ATOM 968 CB ALA A 65 -11.865 -1.022 -5.028 1.00 52.11 C ATOM 0 H ALA A 65 -13.110 -2.400 -3.428 1.00 64.12 H new ATOM 0 HA ALA A 65 -13.919 -0.931 -5.649 1.00 12.31 H new ATOM 0 HB1 ALA A 65 -11.488 -0.461 -5.883 1.00 52.11 H new ATOM 0 HB2 ALA A 65 -12.027 -0.342 -4.191 1.00 52.11 H new ATOM 0 HB3 ALA A 65 -11.137 -1.781 -4.743 1.00 52.11 H new ATOM 974 N SER A 66 -12.610 -3.821 -6.440 1.00 0.52 N ATOM 975 CA SER A 66 -12.407 -4.758 -7.547 1.00 53.11 C ATOM 976 C SER A 66 -13.697 -4.957 -8.340 1.00 63.22 C ATOM 977 O SER A 66 -13.683 -5.043 -9.569 1.00 65.12 O ATOM 978 CB SER A 66 -11.918 -6.106 -7.008 1.00 43.42 C ATOM 979 OG SER A 66 -12.821 -6.634 -6.048 1.00 34.40 O ATOM 0 H SER A 66 -12.428 -4.216 -5.518 1.00 0.52 H new ATOM 0 HA SER A 66 -11.654 -4.338 -8.214 1.00 53.11 H new ATOM 0 HB2 SER A 66 -11.806 -6.811 -7.832 1.00 43.42 H new ATOM 0 HB3 SER A 66 -10.933 -5.984 -6.556 1.00 43.42 H new ATOM 0 HG SER A 66 -12.759 -6.114 -5.220 1.00 34.40 H new ATOM 985 N GLN A 67 -14.807 -4.997 -7.621 1.00 72.34 N ATOM 986 CA GLN A 67 -16.112 -5.241 -8.211 1.00 50.54 C ATOM 987 C GLN A 67 -16.514 -4.083 -9.121 1.00 33.35 C ATOM 988 O GLN A 67 -17.129 -4.284 -10.171 1.00 44.32 O ATOM 989 CB GLN A 67 -17.136 -5.434 -7.094 1.00 44.40 C ATOM 990 CG GLN A 67 -18.366 -6.217 -7.501 1.00 64.45 C ATOM 991 CD GLN A 67 -19.181 -6.655 -6.302 1.00 13.15 C ATOM 992 OE1 GLN A 67 -18.635 -6.903 -5.225 1.00 73.33 O ATOM 993 NE2 GLN A 67 -20.488 -6.744 -6.471 1.00 4.02 N ATOM 0 H GLN A 67 -14.828 -4.861 -6.610 1.00 72.34 H new ATOM 0 HA GLN A 67 -16.072 -6.143 -8.821 1.00 50.54 H new ATOM 0 HB2 GLN A 67 -16.654 -5.945 -6.261 1.00 44.40 H new ATOM 0 HB3 GLN A 67 -17.448 -4.455 -6.730 1.00 44.40 H new ATOM 0 HG2 GLN A 67 -18.985 -5.605 -8.156 1.00 64.45 H new ATOM 0 HG3 GLN A 67 -18.065 -7.094 -8.075 1.00 64.45 H new ATOM 0 HE21 GLN A 67 -20.901 -6.530 -7.379 1.00 4.02 H new ATOM 0 HE22 GLN A 67 -21.085 -7.027 -5.694 1.00 4.02 H new ATOM 1002 N LEU A 68 -16.134 -2.874 -8.721 1.00 41.41 N ATOM 1003 CA LEU A 68 -16.438 -1.675 -9.496 1.00 51.55 C ATOM 1004 C LEU A 68 -15.397 -1.464 -10.590 1.00 53.11 C ATOM 1005 O LEU A 68 -15.674 -0.849 -11.620 1.00 71.41 O ATOM 1006 CB LEU A 68 -16.493 -0.434 -8.589 1.00 32.42 C ATOM 1007 CG LEU A 68 -17.767 -0.268 -7.750 1.00 0.00 C ATOM 1008 CD1 LEU A 68 -17.869 -1.346 -6.682 1.00 71.00 C ATOM 1009 CD2 LEU A 68 -17.800 1.114 -7.118 1.00 13.10 C ATOM 0 H LEU A 68 -15.613 -2.698 -7.862 1.00 41.41 H new ATOM 0 HA LEU A 68 -17.416 -1.817 -9.957 1.00 51.55 H new ATOM 0 HB2 LEU A 68 -15.638 -0.465 -7.913 1.00 32.42 H new ATOM 0 HB3 LEU A 68 -16.375 0.452 -9.212 1.00 32.42 H new ATOM 0 HG LEU A 68 -18.626 -0.375 -8.412 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -18.782 -1.201 -6.105 1.00 71.00 H new ATOM 0 HD12 LEU A 68 -17.892 -2.327 -7.156 1.00 71.00 H new ATOM 0 HD13 LEU A 68 -17.006 -1.284 -6.019 1.00 71.00 H new ATOM 0 HD21 LEU A 68 -18.708 1.221 -6.525 1.00 13.10 H new ATOM 0 HD22 LEU A 68 -16.929 1.241 -6.475 1.00 13.10 H new ATOM 0 HD23 LEU A 68 -17.786 1.872 -7.901 1.00 13.10 H new ATOM 1021 N GLY A 69 -14.202 -1.990 -10.364 1.00 31.14 N ATOM 1022 CA GLY A 69 -13.126 -1.831 -11.322 1.00 74.14 C ATOM 1023 C GLY A 69 -12.304 -0.592 -11.047 1.00 42.45 C ATOM 1024 O GLY A 69 -11.592 -0.099 -11.926 1.00 71.10 O ATOM 0 H GLY A 69 -13.957 -2.526 -9.531 1.00 31.14 H new ATOM 0 HA2 GLY A 69 -12.481 -2.709 -11.292 1.00 74.14 H new ATOM 0 HA3 GLY A 69 -13.541 -1.775 -12.328 1.00 74.14 H new ATOM 1028 N VAL A 70 -12.409 -0.081 -9.828 1.00 32.44 N ATOM 1029 CA VAL A 70 -11.646 1.089 -9.422 1.00 23.42 C ATOM 1030 C VAL A 70 -10.425 0.660 -8.619 1.00 53.55 C ATOM 1031 O VAL A 70 -10.393 -0.440 -8.068 1.00 70.41 O ATOM 1032 CB VAL A 70 -12.497 2.087 -8.603 1.00 11.44 C ATOM 1033 CG1 VAL A 70 -13.598 2.682 -9.463 1.00 44.53 C ATOM 1034 CG2 VAL A 70 -13.086 1.419 -7.370 1.00 23.14 C ATOM 0 H VAL A 70 -13.017 -0.460 -9.102 1.00 32.44 H new ATOM 0 HA VAL A 70 -11.327 1.603 -10.329 1.00 23.42 H new ATOM 0 HB VAL A 70 -11.843 2.893 -8.271 1.00 11.44 H new ATOM 0 HG11 VAL A 70 -14.186 3.382 -8.869 1.00 44.53 H new ATOM 0 HG12 VAL A 70 -13.155 3.207 -10.309 1.00 44.53 H new ATOM 0 HG13 VAL A 70 -14.245 1.885 -9.829 1.00 44.53 H new ATOM 0 HG21 VAL A 70 -13.680 2.143 -6.812 1.00 23.14 H new ATOM 0 HG22 VAL A 70 -13.721 0.587 -7.675 1.00 23.14 H new ATOM 0 HG23 VAL A 70 -12.280 1.047 -6.738 1.00 23.14 H new ATOM 1044 N LYS A 71 -9.421 1.519 -8.565 1.00 12.31 N ATOM 1045 CA LYS A 71 -8.147 1.166 -7.953 1.00 24.40 C ATOM 1046 C LYS A 71 -7.445 2.416 -7.436 1.00 41.12 C ATOM 1047 O LYS A 71 -7.977 3.521 -7.544 1.00 61.52 O ATOM 1048 CB LYS A 71 -7.272 0.464 -8.994 1.00 74.33 C ATOM 1049 CG LYS A 71 -6.987 1.337 -10.206 1.00 1.41 C ATOM 1050 CD LYS A 71 -6.507 0.530 -11.399 1.00 25.51 C ATOM 1051 CE LYS A 71 -7.572 -0.447 -11.874 1.00 73.22 C ATOM 1052 NZ LYS A 71 -7.253 -1.019 -13.209 1.00 11.20 N ATOM 0 H LYS A 71 -9.462 2.468 -8.938 1.00 12.31 H new ATOM 0 HA LYS A 71 -8.322 0.497 -7.110 1.00 24.40 H new ATOM 0 HB2 LYS A 71 -6.329 0.172 -8.532 1.00 74.33 H new ATOM 0 HB3 LYS A 71 -7.765 -0.452 -9.319 1.00 74.33 H new ATOM 0 HG2 LYS A 71 -7.891 1.882 -10.479 1.00 1.41 H new ATOM 0 HG3 LYS A 71 -6.233 2.080 -9.946 1.00 1.41 H new ATOM 0 HD2 LYS A 71 -6.241 1.204 -12.213 1.00 25.51 H new ATOM 0 HD3 LYS A 71 -5.603 -0.017 -11.130 1.00 25.51 H new ATOM 0 HE2 LYS A 71 -7.671 -1.255 -11.149 1.00 73.22 H new ATOM 0 HE3 LYS A 71 -8.535 0.061 -11.919 1.00 73.22 H new ATOM 0 HZ1 LYS A 71 -8.005 -1.679 -13.493 1.00 11.20 H new ATOM 0 HZ2 LYS A 71 -7.184 -0.252 -13.908 1.00 11.20 H new ATOM 0 HZ3 LYS A 71 -6.347 -1.527 -13.161 1.00 11.20 H new ATOM 1066 N ILE A 72 -6.267 2.236 -6.859 1.00 43.32 N ATOM 1067 CA ILE A 72 -5.421 3.362 -6.496 1.00 62.11 C ATOM 1068 C ILE A 72 -4.155 3.318 -7.338 1.00 31.21 C ATOM 1069 O ILE A 72 -4.031 2.468 -8.224 1.00 34.24 O ATOM 1070 CB ILE A 72 -5.057 3.375 -4.993 1.00 30.33 C ATOM 1071 CG1 ILE A 72 -4.143 2.203 -4.635 1.00 55.13 C ATOM 1072 CG2 ILE A 72 -6.320 3.346 -4.146 1.00 1.40 C ATOM 1073 CD1 ILE A 72 -3.651 2.243 -3.205 1.00 2.43 C ATOM 0 H ILE A 72 -5.875 1.322 -6.632 1.00 43.32 H new ATOM 0 HA ILE A 72 -5.981 4.277 -6.690 1.00 62.11 H new ATOM 0 HB ILE A 72 -4.514 4.297 -4.783 1.00 30.33 H new ATOM 0 HG12 ILE A 72 -4.680 1.269 -4.801 1.00 55.13 H new ATOM 0 HG13 ILE A 72 -3.285 2.202 -5.307 1.00 55.13 H new ATOM 0 HG21 ILE A 72 -6.050 3.355 -3.090 1.00 1.40 H new ATOM 0 HG22 ILE A 72 -6.930 4.220 -4.372 1.00 1.40 H new ATOM 0 HG23 ILE A 72 -6.886 2.441 -4.368 1.00 1.40 H new ATOM 0 HD11 ILE A 72 -3.008 1.383 -3.017 1.00 2.43 H new ATOM 0 HD12 ILE A 72 -3.087 3.161 -3.040 1.00 2.43 H new ATOM 0 HD13 ILE A 72 -4.503 2.214 -2.526 1.00 2.43 H new ATOM 1085 N ARG A 73 -3.227 4.225 -7.096 1.00 73.21 N ATOM 1086 CA ARG A 73 -2.008 4.248 -7.883 1.00 44.42 C ATOM 1087 C ARG A 73 -0.780 4.368 -6.992 1.00 62.15 C ATOM 1088 O ARG A 73 -0.635 5.332 -6.239 1.00 63.30 O ATOM 1089 CB ARG A 73 -2.047 5.397 -8.892 1.00 14.24 C ATOM 1090 CG ARG A 73 -1.040 5.242 -10.017 1.00 35.44 C ATOM 1091 CD ARG A 73 -1.259 6.271 -11.112 1.00 3.13 C ATOM 1092 NE ARG A 73 -0.502 5.948 -12.320 1.00 3.05 N ATOM 1093 CZ ARG A 73 -0.719 6.510 -13.509 1.00 40.10 C ATOM 1094 NH1 ARG A 73 -1.637 7.460 -13.646 1.00 71.24 N ATOM 1095 NH2 ARG A 73 -0.010 6.128 -14.562 1.00 51.30 N ATOM 0 H ARG A 73 -3.291 4.943 -6.375 1.00 73.21 H new ATOM 0 HA ARG A 73 -1.940 3.305 -8.425 1.00 44.42 H new ATOM 0 HB2 ARG A 73 -3.049 5.465 -9.317 1.00 14.24 H new ATOM 0 HB3 ARG A 73 -1.858 6.336 -8.371 1.00 14.24 H new ATOM 0 HG2 ARG A 73 -0.031 5.344 -9.619 1.00 35.44 H new ATOM 0 HG3 ARG A 73 -1.117 4.240 -10.439 1.00 35.44 H new ATOM 0 HD2 ARG A 73 -2.321 6.326 -11.352 1.00 3.13 H new ATOM 0 HD3 ARG A 73 -0.963 7.256 -10.750 1.00 3.13 H new ATOM 0 HE ARG A 73 0.238 5.250 -12.249 1.00 3.05 H new ATOM 0 HH11 ARG A 73 -2.181 7.764 -12.838 1.00 71.24 H new ATOM 0 HH12 ARG A 73 -1.798 7.886 -14.559 1.00 71.24 H new ATOM 0 HH21 ARG A 73 0.702 5.404 -14.462 1.00 51.30 H new ATOM 0 HH22 ARG A 73 -0.176 6.558 -15.472 1.00 51.30 H new ATOM 1109 N ILE A 74 0.090 3.372 -7.069 1.00 64.14 N ATOM 1110 CA ILE A 74 1.349 3.407 -6.346 1.00 72.03 C ATOM 1111 C ILE A 74 2.485 3.793 -7.296 1.00 32.11 C ATOM 1112 O ILE A 74 2.807 3.056 -8.232 1.00 15.31 O ATOM 1113 CB ILE A 74 1.659 2.050 -5.651 1.00 63.11 C ATOM 1114 CG1 ILE A 74 3.028 2.092 -4.967 1.00 53.03 C ATOM 1115 CG2 ILE A 74 1.585 0.887 -6.635 1.00 61.40 C ATOM 1116 CD1 ILE A 74 3.088 3.034 -3.783 1.00 11.51 C ATOM 0 H ILE A 74 -0.054 2.530 -7.626 1.00 64.14 H new ATOM 0 HA ILE A 74 1.262 4.159 -5.562 1.00 72.03 H new ATOM 0 HB ILE A 74 0.896 1.888 -4.890 1.00 63.11 H new ATOM 0 HG12 ILE A 74 3.289 1.087 -4.634 1.00 53.03 H new ATOM 0 HG13 ILE A 74 3.780 2.392 -5.697 1.00 53.03 H new ATOM 0 HG21 ILE A 74 1.807 -0.045 -6.115 1.00 61.40 H new ATOM 0 HG22 ILE A 74 0.583 0.834 -7.062 1.00 61.40 H new ATOM 0 HG23 ILE A 74 2.312 1.039 -7.433 1.00 61.40 H new ATOM 0 HD11 ILE A 74 4.088 3.011 -3.350 1.00 11.51 H new ATOM 0 HD12 ILE A 74 2.859 4.047 -4.112 1.00 11.51 H new ATOM 0 HD13 ILE A 74 2.360 2.723 -3.033 1.00 11.51 H new ATOM 1643 N ARG A 107 -6.443 -8.573 -8.344 1.00 3.02 N ATOM 1644 CA ARG A 107 -5.667 -7.448 -8.860 1.00 31.24 C ATOM 1645 C ARG A 107 -5.036 -6.622 -7.738 1.00 43.21 C ATOM 1646 O ARG A 107 -5.520 -6.606 -6.602 1.00 72.42 O ATOM 1647 CB ARG A 107 -6.560 -6.552 -9.711 1.00 25.21 C ATOM 1648 CG ARG A 107 -6.967 -7.156 -11.045 1.00 14.23 C ATOM 1649 CD ARG A 107 -5.796 -7.251 -12.007 1.00 34.40 C ATOM 1650 NE ARG A 107 -6.224 -7.690 -13.334 1.00 1.14 N ATOM 1651 CZ ARG A 107 -6.606 -6.857 -14.304 1.00 64.23 C ATOM 1652 NH1 ARG A 107 -6.617 -5.547 -14.092 1.00 52.24 N ATOM 1653 NH2 ARG A 107 -6.977 -7.332 -15.484 1.00 54.11 N ATOM 0 HA ARG A 107 -4.859 -7.858 -9.466 1.00 31.24 H new ATOM 0 HB2 ARG A 107 -7.460 -6.313 -9.144 1.00 25.21 H new ATOM 0 HB3 ARG A 107 -6.041 -5.612 -9.895 1.00 25.21 H new ATOM 0 HG2 ARG A 107 -7.383 -8.150 -10.881 1.00 14.23 H new ATOM 0 HG3 ARG A 107 -7.755 -6.550 -11.492 1.00 14.23 H new ATOM 0 HD2 ARG A 107 -5.308 -6.279 -12.084 1.00 34.40 H new ATOM 0 HD3 ARG A 107 -5.057 -7.948 -11.613 1.00 34.40 H new ATOM 0 HE ARG A 107 -6.231 -8.691 -13.530 1.00 1.14 H new ATOM 0 HH11 ARG A 107 -6.333 -5.175 -13.186 1.00 52.24 H new ATOM 0 HH12 ARG A 107 -6.909 -4.913 -14.835 1.00 52.24 H new ATOM 0 HH21 ARG A 107 -6.971 -8.338 -15.654 1.00 54.11 H new ATOM 0 HH22 ARG A 107 -7.268 -6.692 -16.223 1.00 54.11 H new ATOM 1667 N GLY A 108 -3.949 -5.938 -8.070 1.00 4.12 N ATOM 1668 CA GLY A 108 -3.287 -5.078 -7.109 1.00 45.31 C ATOM 1669 C GLY A 108 -3.991 -3.747 -6.967 1.00 74.22 C ATOM 1670 O GLY A 108 -3.482 -2.716 -7.399 1.00 55.01 O ATOM 0 H GLY A 108 -3.513 -5.964 -8.992 1.00 4.12 H new ATOM 0 HA2 GLY A 108 -3.252 -5.576 -6.140 1.00 45.31 H new ATOM 0 HA3 GLY A 108 -2.256 -4.912 -7.420 1.00 45.31 H new ATOM 1674 N ILE A 109 -5.176 -3.785 -6.374 1.00 2.24 N ATOM 1675 CA ILE A 109 -5.995 -2.593 -6.182 1.00 21.21 C ATOM 1676 C ILE A 109 -5.312 -1.610 -5.238 1.00 4.23 C ATOM 1677 O ILE A 109 -5.467 -0.398 -5.365 1.00 44.15 O ATOM 1678 CB ILE A 109 -7.372 -2.964 -5.596 1.00 73.31 C ATOM 1679 CG1 ILE A 109 -7.969 -4.149 -6.349 1.00 51.01 C ATOM 1680 CG2 ILE A 109 -8.317 -1.768 -5.654 1.00 31.32 C ATOM 1681 CD1 ILE A 109 -9.159 -4.760 -5.650 1.00 35.03 C ATOM 0 H ILE A 109 -5.598 -4.641 -6.012 1.00 2.24 H new ATOM 0 HA ILE A 109 -6.126 -2.128 -7.159 1.00 21.21 H new ATOM 0 HB ILE A 109 -7.237 -3.248 -4.552 1.00 73.31 H new ATOM 0 HG12 ILE A 109 -8.269 -3.824 -7.345 1.00 51.01 H new ATOM 0 HG13 ILE A 109 -7.202 -4.912 -6.480 1.00 51.01 H new ATOM 0 HG21 ILE A 109 -9.284 -2.048 -5.236 1.00 31.32 H new ATOM 0 HG22 ILE A 109 -7.897 -0.944 -5.077 1.00 31.32 H new ATOM 0 HG23 ILE A 109 -8.446 -1.456 -6.690 1.00 31.32 H new ATOM 0 HD11 ILE A 109 -9.536 -5.597 -6.238 1.00 35.03 H new ATOM 0 HD12 ILE A 109 -8.859 -5.115 -4.664 1.00 35.03 H new ATOM 0 HD13 ILE A 109 -9.943 -4.010 -5.543 1.00 35.03 H new ATOM 1693 N TYR A 110 -4.555 -2.153 -4.296 1.00 24.20 N ATOM 1694 CA TYR A 110 -3.889 -1.353 -3.284 1.00 21.04 C ATOM 1695 C TYR A 110 -2.404 -1.205 -3.601 1.00 1.12 C ATOM 1696 O TYR A 110 -1.881 -1.861 -4.501 1.00 2.10 O ATOM 1697 CB TYR A 110 -4.095 -1.966 -1.891 1.00 14.05 C ATOM 1698 CG TYR A 110 -3.849 -3.462 -1.829 1.00 11.24 C ATOM 1699 CD1 TYR A 110 -4.852 -4.358 -2.173 1.00 74.31 C ATOM 1700 CD2 TYR A 110 -2.621 -3.976 -1.424 1.00 12.50 C ATOM 1701 CE1 TYR A 110 -4.642 -5.720 -2.120 1.00 11.20 C ATOM 1702 CE2 TYR A 110 -2.404 -5.341 -1.369 1.00 55.21 C ATOM 1703 CZ TYR A 110 -3.419 -6.208 -1.719 1.00 21.23 C ATOM 1704 OH TYR A 110 -3.211 -7.567 -1.678 1.00 43.15 O ATOM 0 H TYR A 110 -4.387 -3.156 -4.213 1.00 24.20 H new ATOM 0 HA TYR A 110 -4.333 -0.358 -3.287 1.00 21.04 H new ATOM 0 HB2 TYR A 110 -3.429 -1.470 -1.185 1.00 14.05 H new ATOM 0 HB3 TYR A 110 -5.115 -1.763 -1.564 1.00 14.05 H new ATOM 0 HD1 TYR A 110 -5.814 -3.982 -2.488 1.00 74.31 H new ATOM 0 HD2 TYR A 110 -1.826 -3.299 -1.149 1.00 12.50 H new ATOM 0 HE1 TYR A 110 -5.434 -6.401 -2.392 1.00 11.20 H new ATOM 0 HE2 TYR A 110 -1.445 -5.726 -1.054 1.00 55.21 H new ATOM 0 HH TYR A 110 -2.297 -7.749 -1.376 1.00 43.15 H new ATOM 1714 N SER A 111 -1.737 -0.348 -2.845 1.00 54.53 N ATOM 1715 CA SER A 111 -0.355 0.008 -3.111 1.00 44.01 C ATOM 1716 C SER A 111 0.617 -1.055 -2.608 1.00 32.13 C ATOM 1717 O SER A 111 0.527 -1.507 -1.466 1.00 0.50 O ATOM 1718 CB SER A 111 -0.053 1.352 -2.450 1.00 11.11 C ATOM 1719 OG SER A 111 -0.496 1.359 -1.102 1.00 54.21 O ATOM 0 H SER A 111 -2.138 0.119 -2.032 1.00 54.53 H new ATOM 0 HA SER A 111 -0.221 0.079 -4.190 1.00 44.01 H new ATOM 0 HB2 SER A 111 1.019 1.548 -2.487 1.00 11.11 H new ATOM 0 HB3 SER A 111 -0.543 2.153 -3.003 1.00 11.11 H new ATOM 0 HG SER A 111 -0.379 0.467 -0.714 1.00 54.21 H new ATOM 1725 N PHE A 112 1.539 -1.447 -3.475 1.00 20.10 N ATOM 1726 CA PHE A 112 2.613 -2.351 -3.103 1.00 21.22 C ATOM 1727 C PHE A 112 3.926 -1.586 -3.067 1.00 43.30 C ATOM 1728 O PHE A 112 3.981 -0.428 -3.473 1.00 43.33 O ATOM 1729 CB PHE A 112 2.729 -3.512 -4.098 1.00 32.43 C ATOM 1730 CG PHE A 112 1.538 -4.426 -4.126 1.00 22.41 C ATOM 1731 CD1 PHE A 112 1.455 -5.501 -3.257 1.00 31.10 C ATOM 1732 CD2 PHE A 112 0.508 -4.217 -5.030 1.00 74.24 C ATOM 1733 CE1 PHE A 112 0.364 -6.349 -3.287 1.00 75.12 C ATOM 1734 CE2 PHE A 112 -0.581 -5.061 -5.066 1.00 21.24 C ATOM 1735 CZ PHE A 112 -0.655 -6.129 -4.194 1.00 11.35 C ATOM 0 H PHE A 112 1.563 -1.149 -4.450 1.00 20.10 H new ATOM 0 HA PHE A 112 2.390 -2.763 -2.119 1.00 21.22 H new ATOM 0 HB2 PHE A 112 2.882 -3.104 -5.097 1.00 32.43 H new ATOM 0 HB3 PHE A 112 3.615 -4.097 -3.853 1.00 32.43 H new ATOM 0 HD1 PHE A 112 2.251 -5.679 -2.549 1.00 31.10 H new ATOM 0 HD2 PHE A 112 0.560 -3.383 -5.714 1.00 74.24 H new ATOM 0 HE1 PHE A 112 0.308 -7.182 -2.602 1.00 75.12 H new ATOM 0 HE2 PHE A 112 -1.376 -4.887 -5.776 1.00 21.24 H new ATOM 0 HZ PHE A 112 -1.508 -6.791 -4.221 1.00 11.35 H new ATOM 1745 N GLU A 113 4.978 -2.221 -2.587 1.00 30.33 N ATOM 1746 CA GLU A 113 6.289 -1.604 -2.607 1.00 72.21 C ATOM 1747 C GLU A 113 7.055 -2.073 -3.835 1.00 11.20 C ATOM 1748 O GLU A 113 7.309 -3.265 -4.018 1.00 12.33 O ATOM 1749 CB GLU A 113 7.079 -1.901 -1.327 1.00 12.21 C ATOM 1750 CG GLU A 113 7.237 -3.379 -1.004 1.00 20.53 C ATOM 1751 CD GLU A 113 5.983 -3.988 -0.417 1.00 41.32 C ATOM 1752 OE1 GLU A 113 5.725 -3.783 0.785 1.00 74.21 O ATOM 1753 OE2 GLU A 113 5.240 -4.665 -1.160 1.00 43.43 O ATOM 0 H GLU A 113 4.951 -3.157 -2.182 1.00 30.33 H new ATOM 0 HA GLU A 113 6.156 -0.523 -2.655 1.00 72.21 H new ATOM 0 HB2 GLU A 113 8.070 -1.455 -1.416 1.00 12.21 H new ATOM 0 HB3 GLU A 113 6.583 -1.411 -0.489 1.00 12.21 H new ATOM 0 HG2 GLU A 113 7.506 -3.918 -1.912 1.00 20.53 H new ATOM 0 HG3 GLU A 113 8.061 -3.507 -0.302 1.00 20.53 H new ATOM 1760 N LYS A 114 7.399 -1.127 -4.685 1.00 72.42 N ATOM 1761 CA LYS A 114 8.042 -1.437 -5.950 1.00 34.34 C ATOM 1762 C LYS A 114 8.924 -0.273 -6.379 1.00 63.21 C ATOM 1763 O LYS A 114 8.544 0.888 -6.220 1.00 34.23 O ATOM 1764 CB LYS A 114 6.983 -1.714 -7.024 1.00 34.14 C ATOM 1765 CG LYS A 114 7.516 -2.471 -8.230 1.00 73.10 C ATOM 1766 CD LYS A 114 7.910 -3.892 -7.852 1.00 71.44 C ATOM 1767 CE LYS A 114 8.455 -4.665 -9.039 1.00 2.31 C ATOM 1768 NZ LYS A 114 8.809 -6.060 -8.665 1.00 22.22 N ATOM 0 H LYS A 114 7.244 -0.132 -4.523 1.00 72.42 H new ATOM 0 HA LYS A 114 8.660 -2.326 -5.826 1.00 34.34 H new ATOM 0 HB2 LYS A 114 6.168 -2.285 -6.579 1.00 34.14 H new ATOM 0 HB3 LYS A 114 6.562 -0.766 -7.359 1.00 34.14 H new ATOM 0 HG2 LYS A 114 6.757 -2.496 -9.012 1.00 73.10 H new ATOM 0 HG3 LYS A 114 8.380 -1.947 -8.640 1.00 73.10 H new ATOM 0 HD2 LYS A 114 8.661 -3.862 -7.063 1.00 71.44 H new ATOM 0 HD3 LYS A 114 7.043 -4.413 -7.447 1.00 71.44 H new ATOM 0 HE2 LYS A 114 7.713 -4.678 -9.837 1.00 2.31 H new ATOM 0 HE3 LYS A 114 9.336 -4.158 -9.431 1.00 2.31 H new ATOM 0 HZ1 LYS A 114 9.178 -6.560 -9.499 1.00 22.22 H new ATOM 0 HZ2 LYS A 114 9.535 -6.046 -7.920 1.00 22.22 H new ATOM 0 HZ3 LYS A 114 7.962 -6.551 -8.314 1.00 22.22 H new ATOM 1782 N VAL A 115 10.101 -0.580 -6.906 1.00 33.42 N ATOM 1783 CA VAL A 115 11.011 0.457 -7.368 1.00 21.03 C ATOM 1784 C VAL A 115 10.531 1.066 -8.691 1.00 12.15 C ATOM 1785 O VAL A 115 10.721 0.506 -9.773 1.00 3.14 O ATOM 1786 CB VAL A 115 12.466 -0.069 -7.494 1.00 23.04 C ATOM 1787 CG1 VAL A 115 12.545 -1.302 -8.386 1.00 52.23 C ATOM 1788 CG2 VAL A 115 13.396 1.026 -7.999 1.00 11.20 C ATOM 0 H VAL A 115 10.446 -1.533 -7.024 1.00 33.42 H new ATOM 0 HA VAL A 115 11.012 1.244 -6.614 1.00 21.03 H new ATOM 0 HB VAL A 115 12.794 -0.366 -6.498 1.00 23.04 H new ATOM 0 HG11 VAL A 115 13.579 -1.640 -8.449 1.00 52.23 H new ATOM 0 HG12 VAL A 115 11.929 -2.096 -7.964 1.00 52.23 H new ATOM 0 HG13 VAL A 115 12.183 -1.053 -9.384 1.00 52.23 H new ATOM 0 HG21 VAL A 115 14.410 0.634 -8.079 1.00 11.20 H new ATOM 0 HG22 VAL A 115 13.060 1.366 -8.979 1.00 11.20 H new ATOM 0 HG23 VAL A 115 13.385 1.863 -7.301 1.00 11.20 H new ATOM 1798 N LYS A 116 9.868 2.207 -8.583 1.00 21.00 N ATOM 1799 CA LYS A 116 9.408 2.943 -9.751 1.00 54.51 C ATOM 1800 C LYS A 116 10.017 4.335 -9.750 1.00 13.45 C ATOM 1801 O LYS A 116 9.728 5.140 -8.863 1.00 33.14 O ATOM 1802 CB LYS A 116 7.880 3.040 -9.773 1.00 73.45 C ATOM 1803 CG LYS A 116 7.170 1.703 -9.947 1.00 32.41 C ATOM 1804 CD LYS A 116 7.547 1.032 -11.261 1.00 52.53 C ATOM 1805 CE LYS A 116 6.662 -0.171 -11.554 1.00 62.21 C ATOM 1806 NZ LYS A 116 7.013 -0.825 -12.845 1.00 43.41 N ATOM 0 H LYS A 116 9.635 2.646 -7.692 1.00 21.00 H new ATOM 0 HA LYS A 116 9.726 2.406 -10.645 1.00 54.51 H new ATOM 0 HB2 LYS A 116 7.543 3.499 -8.843 1.00 73.45 H new ATOM 0 HB3 LYS A 116 7.581 3.705 -10.583 1.00 73.45 H new ATOM 0 HG2 LYS A 116 7.425 1.045 -9.116 1.00 32.41 H new ATOM 0 HG3 LYS A 116 6.091 1.857 -9.913 1.00 32.41 H new ATOM 0 HD2 LYS A 116 7.463 1.752 -12.075 1.00 52.53 H new ATOM 0 HD3 LYS A 116 8.589 0.716 -11.222 1.00 52.53 H new ATOM 0 HE2 LYS A 116 6.756 -0.895 -10.744 1.00 62.21 H new ATOM 0 HE3 LYS A 116 5.619 0.145 -11.580 1.00 62.21 H new ATOM 0 HZ1 LYS A 116 6.385 -1.639 -13.004 1.00 43.41 H new ATOM 0 HZ2 LYS A 116 6.899 -0.143 -13.622 1.00 43.41 H new ATOM 0 HZ3 LYS A 116 8.000 -1.150 -12.812 1.00 43.41 H new ATOM 1820 N ALA A 117 10.867 4.594 -10.745 1.00 12.52 N ATOM 1821 CA ALA A 117 11.612 5.848 -10.852 1.00 3.31 C ATOM 1822 C ALA A 117 12.650 5.946 -9.739 1.00 44.11 C ATOM 1823 O ALA A 117 12.799 5.025 -8.933 1.00 40.33 O ATOM 1824 CB ALA A 117 10.679 7.055 -10.840 1.00 24.55 C ATOM 0 H ALA A 117 11.058 3.937 -11.502 1.00 12.52 H new ATOM 0 HA ALA A 117 12.132 5.850 -11.810 1.00 3.31 H new ATOM 0 HB1 ALA A 117 11.266 7.970 -10.921 1.00 24.55 H new ATOM 0 HB2 ALA A 117 9.990 6.990 -11.682 1.00 24.55 H new ATOM 0 HB3 ALA A 117 10.113 7.068 -9.908 1.00 24.55 H new ATOM 1830 N HIS A 118 13.387 7.043 -9.699 1.00 4.25 N ATOM 1831 CA HIS A 118 14.429 7.195 -8.695 1.00 1.32 C ATOM 1832 C HIS A 118 14.396 8.593 -8.087 1.00 71.13 C ATOM 1833 O HIS A 118 15.249 8.944 -7.277 1.00 51.32 O ATOM 1834 CB HIS A 118 15.803 6.920 -9.322 1.00 11.23 C ATOM 1835 CG HIS A 118 16.803 6.338 -8.368 1.00 34.13 C ATOM 1836 ND1 HIS A 118 16.979 4.981 -8.215 1.00 64.34 N ATOM 1837 CD2 HIS A 118 17.695 6.925 -7.532 1.00 12.31 C ATOM 1838 CE1 HIS A 118 17.931 4.755 -7.331 1.00 41.44 C ATOM 1839 NE2 HIS A 118 18.384 5.915 -6.900 1.00 23.14 N ATOM 0 H HIS A 118 13.287 7.831 -10.339 1.00 4.25 H new ATOM 0 HA HIS A 118 14.250 6.474 -7.898 1.00 1.32 H new ATOM 0 HB2 HIS A 118 15.677 6.237 -10.162 1.00 11.23 H new ATOM 0 HB3 HIS A 118 16.200 7.852 -9.725 1.00 11.23 H new ATOM 0 HD2 HIS A 118 17.838 7.986 -7.389 1.00 12.31 H new ATOM 0 HE1 HIS A 118 18.280 3.784 -7.014 1.00 41.44 H new ATOM 0 HE2 HIS A 118 19.125 6.043 -6.210 1.00 23.14 H new ATOM 1848 N SER A 119 13.399 9.385 -8.467 1.00 72.24 N ATOM 1849 CA SER A 119 13.332 10.771 -8.026 1.00 13.41 C ATOM 1850 C SER A 119 12.666 10.900 -6.658 1.00 43.04 C ATOM 1851 O SER A 119 13.074 11.723 -5.835 1.00 61.43 O ATOM 1852 CB SER A 119 12.533 11.588 -9.039 1.00 54.10 C ATOM 1853 OG SER A 119 12.889 11.250 -10.368 1.00 25.11 O ATOM 0 H SER A 119 12.633 9.093 -9.074 1.00 72.24 H new ATOM 0 HA SER A 119 14.354 11.143 -7.947 1.00 13.41 H new ATOM 0 HB2 SER A 119 11.467 11.414 -8.890 1.00 54.10 H new ATOM 0 HB3 SER A 119 12.709 12.651 -8.872 1.00 54.10 H new ATOM 0 HG SER A 119 12.361 11.787 -10.995 1.00 25.11 H new ATOM 1859 N GLY A 120 11.670 10.057 -6.400 1.00 43.03 N ATOM 1860 CA GLY A 120 10.902 10.167 -5.179 1.00 1.14 C ATOM 1861 C GLY A 120 10.033 11.415 -5.155 1.00 1.03 C ATOM 1862 O GLY A 120 10.305 12.395 -5.845 1.00 25.13 O ATOM 0 H GLY A 120 11.383 9.299 -7.019 1.00 43.03 H new ATOM 0 HA2 GLY A 120 10.271 9.285 -5.069 1.00 1.14 H new ATOM 0 HA3 GLY A 120 11.580 10.183 -4.326 1.00 1.14 H new ATOM 1866 N ASN A 121 8.962 11.368 -4.387 1.00 41.21 N ATOM 1867 CA ASN A 121 8.120 12.543 -4.172 1.00 52.12 C ATOM 1868 C ASN A 121 8.230 12.972 -2.720 1.00 55.50 C ATOM 1869 O ASN A 121 8.377 12.126 -1.842 1.00 31.04 O ATOM 1870 CB ASN A 121 6.658 12.250 -4.528 1.00 41.53 C ATOM 1871 CG ASN A 121 6.384 12.271 -6.025 1.00 52.04 C ATOM 1872 OD1 ASN A 121 5.306 12.665 -6.464 1.00 51.14 O ATOM 1873 ND2 ASN A 121 7.355 11.852 -6.821 1.00 13.35 N ATOM 0 H ASN A 121 8.648 10.530 -3.898 1.00 41.21 H new ATOM 0 HA ASN A 121 8.464 13.347 -4.823 1.00 52.12 H new ATOM 0 HB2 ASN A 121 6.384 11.273 -4.130 1.00 41.53 H new ATOM 0 HB3 ASN A 121 6.018 12.985 -4.039 1.00 41.53 H new ATOM 0 HD21 ASN A 121 7.220 11.850 -7.832 1.00 13.35 H new ATOM 0 HD22 ASN A 121 8.238 11.531 -6.423 1.00 13.35 H new ATOM 1880 N GLU A 122 8.143 14.269 -2.460 1.00 45.42 N ATOM 1881 CA GLU A 122 8.375 14.788 -1.117 1.00 34.51 C ATOM 1882 C GLU A 122 7.194 14.520 -0.192 1.00 41.15 C ATOM 1883 O GLU A 122 7.331 14.575 1.030 1.00 72.22 O ATOM 1884 CB GLU A 122 8.709 16.276 -1.154 1.00 0.40 C ATOM 1885 CG GLU A 122 10.014 16.576 -1.873 1.00 22.23 C ATOM 1886 CD GLU A 122 10.467 18.009 -1.700 1.00 22.21 C ATOM 1887 OE1 GLU A 122 9.855 18.908 -2.313 1.00 12.20 O ATOM 1888 OE2 GLU A 122 11.441 18.242 -0.954 1.00 65.34 O ATOM 0 H GLU A 122 7.915 14.979 -3.156 1.00 45.42 H new ATOM 0 HA GLU A 122 9.234 14.255 -0.711 1.00 34.51 H new ATOM 0 HB2 GLU A 122 7.898 16.812 -1.647 1.00 0.40 H new ATOM 0 HB3 GLU A 122 8.768 16.655 -0.134 1.00 0.40 H new ATOM 0 HG2 GLU A 122 10.790 15.908 -1.500 1.00 22.23 H new ATOM 0 HG3 GLU A 122 9.894 16.364 -2.935 1.00 22.23 H new ATOM 1895 N PHE A 123 6.036 14.224 -0.766 1.00 52.31 N ATOM 1896 CA PHE A 123 4.911 13.762 0.034 1.00 2.31 C ATOM 1897 C PHE A 123 5.231 12.386 0.613 1.00 23.13 C ATOM 1898 O PHE A 123 4.877 12.075 1.747 1.00 25.02 O ATOM 1899 CB PHE A 123 3.630 13.711 -0.798 1.00 63.42 C ATOM 1900 CG PHE A 123 3.046 15.066 -1.084 1.00 74.04 C ATOM 1901 CD1 PHE A 123 3.425 15.781 -2.209 1.00 62.43 C ATOM 1902 CD2 PHE A 123 2.115 15.626 -0.221 1.00 73.54 C ATOM 1903 CE1 PHE A 123 2.886 17.026 -2.469 1.00 55.42 C ATOM 1904 CE2 PHE A 123 1.572 16.871 -0.477 1.00 40.34 C ATOM 1905 CZ PHE A 123 1.959 17.573 -1.603 1.00 43.00 C ATOM 0 H PHE A 123 5.852 14.294 -1.767 1.00 52.31 H new ATOM 0 HA PHE A 123 4.746 14.466 0.849 1.00 2.31 H new ATOM 0 HB2 PHE A 123 3.839 13.208 -1.742 1.00 63.42 H new ATOM 0 HB3 PHE A 123 2.889 13.108 -0.273 1.00 63.42 H new ATOM 0 HD1 PHE A 123 4.150 15.360 -2.890 1.00 62.43 H new ATOM 0 HD2 PHE A 123 1.811 15.083 0.661 1.00 73.54 H new ATOM 0 HE1 PHE A 123 3.190 17.572 -3.350 1.00 55.42 H new ATOM 0 HE2 PHE A 123 0.847 17.295 0.202 1.00 40.34 H new ATOM 0 HZ PHE A 123 1.538 18.547 -1.805 1.00 43.00 H new ATOM 1915 N ASN A 124 5.922 11.575 -0.185 1.00 1.23 N ATOM 1916 CA ASN A 124 6.411 10.276 0.267 1.00 44.41 C ATOM 1917 C ASN A 124 7.659 10.462 1.124 1.00 12.30 C ATOM 1918 O ASN A 124 7.868 9.748 2.094 1.00 5.30 O ATOM 1919 CB ASN A 124 6.733 9.373 -0.934 1.00 44.53 C ATOM 1920 CG ASN A 124 7.190 7.982 -0.520 1.00 10.33 C ATOM 1921 OD1 ASN A 124 6.375 7.082 -0.344 1.00 33.45 O ATOM 1922 ND2 ASN A 124 8.496 7.791 -0.374 1.00 72.02 N ATOM 0 H ASN A 124 6.156 11.797 -1.153 1.00 1.23 H new ATOM 0 HA ASN A 124 5.632 9.799 0.862 1.00 44.41 H new ATOM 0 HB2 ASN A 124 5.849 9.287 -1.565 1.00 44.53 H new ATOM 0 HB3 ASN A 124 7.511 9.842 -1.537 1.00 44.53 H new ATOM 0 HD21 ASN A 124 8.850 6.872 -0.107 1.00 72.02 H new ATOM 0 HD22 ASN A 124 9.145 8.563 -0.529 1.00 72.02 H new ATOM 1929 N ASP A 125 8.468 11.450 0.753 1.00 50.34 N ATOM 1930 CA ASP A 125 9.760 11.716 1.397 1.00 74.24 C ATOM 1931 C ASP A 125 9.640 11.855 2.911 1.00 51.32 C ATOM 1932 O ASP A 125 10.513 11.405 3.643 1.00 12.10 O ATOM 1933 CB ASP A 125 10.384 12.985 0.806 1.00 21.43 C ATOM 1934 CG ASP A 125 11.647 13.435 1.521 1.00 51.23 C ATOM 1935 OD1 ASP A 125 12.702 12.785 1.352 1.00 55.11 O ATOM 1936 OD2 ASP A 125 11.594 14.463 2.231 1.00 4.32 O ATOM 0 H ASP A 125 8.249 12.095 -0.006 1.00 50.34 H new ATOM 0 HA ASP A 125 10.402 10.857 1.201 1.00 74.24 H new ATOM 0 HB2 ASP A 125 10.615 12.810 -0.245 1.00 21.43 H new ATOM 0 HB3 ASP A 125 9.650 13.790 0.842 1.00 21.43 H new ATOM 1941 N TYR A 126 8.561 12.460 3.382 1.00 53.24 N ATOM 1942 CA TYR A 126 8.404 12.684 4.812 1.00 33.22 C ATOM 1943 C TYR A 126 8.145 11.371 5.553 1.00 50.44 C ATOM 1944 O TYR A 126 8.763 11.105 6.585 1.00 30.42 O ATOM 1945 CB TYR A 126 7.286 13.686 5.092 1.00 74.41 C ATOM 1946 CG TYR A 126 7.527 14.488 6.354 1.00 62.30 C ATOM 1947 CD1 TYR A 126 7.084 14.037 7.591 1.00 71.12 C ATOM 1948 CD2 TYR A 126 8.218 15.692 6.303 1.00 5.22 C ATOM 1949 CE1 TYR A 126 7.320 14.768 8.742 1.00 43.44 C ATOM 1950 CE2 TYR A 126 8.461 16.427 7.449 1.00 63.12 C ATOM 1951 CZ TYR A 126 8.010 15.962 8.665 1.00 13.22 C ATOM 1952 OH TYR A 126 8.257 16.694 9.809 1.00 64.45 O ATOM 0 H TYR A 126 7.791 12.801 2.806 1.00 53.24 H new ATOM 0 HA TYR A 126 9.339 13.104 5.183 1.00 33.22 H new ATOM 0 HB2 TYR A 126 7.192 14.366 4.246 1.00 74.41 H new ATOM 0 HB3 TYR A 126 6.339 13.153 5.179 1.00 74.41 H new ATOM 0 HD1 TYR A 126 6.547 13.102 7.655 1.00 71.12 H new ATOM 0 HD2 TYR A 126 8.572 16.061 5.351 1.00 5.22 H new ATOM 0 HE1 TYR A 126 6.966 14.407 9.696 1.00 43.44 H new ATOM 0 HE2 TYR A 126 9.001 17.360 7.391 1.00 63.12 H new ATOM 0 HH TYR A 126 8.754 17.506 9.577 1.00 64.45 H new ATOM 1962 N VAL A 127 7.246 10.543 5.024 1.00 55.12 N ATOM 1963 CA VAL A 127 6.958 9.251 5.642 1.00 1.01 C ATOM 1964 C VAL A 127 8.111 8.276 5.383 1.00 71.12 C ATOM 1965 O VAL A 127 8.386 7.385 6.190 1.00 52.22 O ATOM 1966 CB VAL A 127 5.614 8.652 5.141 1.00 10.35 C ATOM 1967 CG1 VAL A 127 5.699 8.201 3.691 1.00 0.30 C ATOM 1968 CG2 VAL A 127 5.168 7.506 6.036 1.00 15.12 C ATOM 0 H VAL A 127 6.710 10.740 4.179 1.00 55.12 H new ATOM 0 HA VAL A 127 6.858 9.412 6.715 1.00 1.01 H new ATOM 0 HB VAL A 127 4.867 9.444 5.192 1.00 10.35 H new ATOM 0 HG11 VAL A 127 4.739 7.789 3.381 1.00 0.30 H new ATOM 0 HG12 VAL A 127 5.949 9.053 3.059 1.00 0.30 H new ATOM 0 HG13 VAL A 127 6.470 7.437 3.592 1.00 0.30 H new ATOM 0 HG21 VAL A 127 4.225 7.102 5.667 1.00 15.12 H new ATOM 0 HG22 VAL A 127 5.926 6.723 6.029 1.00 15.12 H new ATOM 0 HG23 VAL A 127 5.032 7.871 7.054 1.00 15.12 H new ATOM 1978 N ASP A 128 8.794 8.474 4.261 1.00 34.31 N ATOM 1979 CA ASP A 128 9.991 7.712 3.921 1.00 0.15 C ATOM 1980 C ASP A 128 11.083 8.007 4.936 1.00 64.21 C ATOM 1981 O ASP A 128 11.692 7.095 5.505 1.00 10.33 O ATOM 1982 CB ASP A 128 10.468 8.087 2.514 1.00 45.00 C ATOM 1983 CG ASP A 128 11.738 7.372 2.105 1.00 63.02 C ATOM 1984 OD1 ASP A 128 12.838 7.866 2.427 1.00 1.33 O ATOM 1985 OD2 ASP A 128 11.640 6.316 1.455 1.00 35.15 O ATOM 0 H ASP A 128 8.533 9.168 3.560 1.00 34.31 H new ATOM 0 HA ASP A 128 9.759 6.647 3.940 1.00 0.15 H new ATOM 0 HB2 ASP A 128 9.681 7.855 1.797 1.00 45.00 H new ATOM 0 HB3 ASP A 128 10.634 9.163 2.468 1.00 45.00 H new ATOM 1990 N MET A 129 11.295 9.296 5.171 1.00 13.01 N ATOM 1991 CA MET A 129 12.262 9.771 6.150 1.00 3.32 C ATOM 1992 C MET A 129 11.965 9.176 7.519 1.00 1.42 C ATOM 1993 O MET A 129 12.876 8.754 8.227 1.00 53.53 O ATOM 1994 CB MET A 129 12.215 11.300 6.225 1.00 5.21 C ATOM 1995 CG MET A 129 13.274 11.913 7.124 1.00 73.40 C ATOM 1996 SD MET A 129 13.107 13.706 7.254 1.00 53.55 S ATOM 1997 CE MET A 129 13.208 14.184 5.530 1.00 44.24 C ATOM 0 H MET A 129 10.799 10.043 4.686 1.00 13.01 H new ATOM 0 HA MET A 129 13.259 9.456 5.841 1.00 3.32 H new ATOM 0 HB2 MET A 129 12.329 11.705 5.220 1.00 5.21 H new ATOM 0 HB3 MET A 129 11.231 11.605 6.582 1.00 5.21 H new ATOM 0 HG2 MET A 129 13.204 11.471 8.118 1.00 73.40 H new ATOM 0 HG3 MET A 129 14.263 11.670 6.735 1.00 73.40 H new ATOM 0 HE1 MET A 129 13.476 15.238 5.460 1.00 44.24 H new ATOM 0 HE2 MET A 129 13.967 13.583 5.030 1.00 44.24 H new ATOM 0 HE3 MET A 129 12.243 14.022 5.050 1.00 44.24 H new ATOM 2007 N LYS A 130 10.685 9.137 7.877 1.00 50.33 N ATOM 2008 CA LYS A 130 10.253 8.577 9.155 1.00 24.22 C ATOM 2009 C LYS A 130 10.762 7.150 9.338 1.00 53.03 C ATOM 2010 O LYS A 130 11.415 6.835 10.331 1.00 35.44 O ATOM 2011 CB LYS A 130 8.724 8.578 9.243 1.00 71.43 C ATOM 2012 CG LYS A 130 8.106 9.945 9.471 1.00 12.51 C ATOM 2013 CD LYS A 130 8.458 10.493 10.841 1.00 63.24 C ATOM 2014 CE LYS A 130 7.714 11.786 11.126 1.00 23.34 C ATOM 2015 NZ LYS A 130 8.091 12.366 12.441 1.00 32.51 N ATOM 0 H LYS A 130 9.924 9.489 7.296 1.00 50.33 H new ATOM 0 HA LYS A 130 10.671 9.201 9.945 1.00 24.22 H new ATOM 0 HB2 LYS A 130 8.320 8.160 8.321 1.00 71.43 H new ATOM 0 HB3 LYS A 130 8.419 7.916 10.054 1.00 71.43 H new ATOM 0 HG2 LYS A 130 8.453 10.635 8.702 1.00 12.51 H new ATOM 0 HG3 LYS A 130 7.023 9.877 9.373 1.00 12.51 H new ATOM 0 HD2 LYS A 130 8.213 9.754 11.604 1.00 63.24 H new ATOM 0 HD3 LYS A 130 9.532 10.668 10.900 1.00 63.24 H new ATOM 0 HE2 LYS A 130 7.926 12.508 10.337 1.00 23.34 H new ATOM 0 HE3 LYS A 130 6.640 11.599 11.107 1.00 23.34 H new ATOM 0 HZ1 LYS A 130 7.561 13.247 12.597 1.00 32.51 H new ATOM 0 HZ2 LYS A 130 7.866 11.688 13.197 1.00 32.51 H new ATOM 0 HZ3 LYS A 130 9.111 12.569 12.451 1.00 32.51 H new ATOM 2029 N ALA A 131 10.480 6.301 8.362 1.00 75.53 N ATOM 2030 CA ALA A 131 10.835 4.891 8.450 1.00 75.45 C ATOM 2031 C ALA A 131 12.346 4.690 8.403 1.00 13.02 C ATOM 2032 O ALA A 131 12.909 3.942 9.202 1.00 52.22 O ATOM 2033 CB ALA A 131 10.164 4.111 7.330 1.00 52.41 C ATOM 0 H ALA A 131 10.006 6.563 7.498 1.00 75.53 H new ATOM 0 HA ALA A 131 10.480 4.516 9.410 1.00 75.45 H new ATOM 0 HB1 ALA A 131 10.437 3.058 7.406 1.00 52.41 H new ATOM 0 HB2 ALA A 131 9.082 4.213 7.413 1.00 52.41 H new ATOM 0 HB3 ALA A 131 10.492 4.502 6.367 1.00 52.41 H new ATOM 2039 N LYS A 132 13.001 5.378 7.483 1.00 54.01 N ATOM 2040 CA LYS A 132 14.423 5.166 7.249 1.00 74.20 C ATOM 2041 C LYS A 132 15.289 5.708 8.383 1.00 51.15 C ATOM 2042 O LYS A 132 16.309 5.106 8.726 1.00 12.44 O ATOM 2043 CB LYS A 132 14.824 5.759 5.912 1.00 33.32 C ATOM 2044 CG LYS A 132 14.224 4.970 4.773 1.00 63.22 C ATOM 2045 CD LYS A 132 14.830 5.330 3.440 1.00 13.15 C ATOM 2046 CE LYS A 132 14.411 4.326 2.389 1.00 2.12 C ATOM 2047 NZ LYS A 132 12.934 4.253 2.241 1.00 31.14 N ATOM 0 H LYS A 132 12.574 6.087 6.886 1.00 54.01 H new ATOM 0 HA LYS A 132 14.597 4.090 7.222 1.00 74.20 H new ATOM 0 HB2 LYS A 132 14.494 6.796 5.855 1.00 33.32 H new ATOM 0 HB3 LYS A 132 15.910 5.765 5.823 1.00 33.32 H new ATOM 0 HG2 LYS A 132 14.367 3.905 4.958 1.00 63.22 H new ATOM 0 HG3 LYS A 132 13.149 5.146 4.739 1.00 63.22 H new ATOM 0 HD2 LYS A 132 14.512 6.330 3.146 1.00 13.15 H new ATOM 0 HD3 LYS A 132 15.917 5.352 3.520 1.00 13.15 H new ATOM 0 HE2 LYS A 132 14.858 4.596 1.432 1.00 2.12 H new ATOM 0 HE3 LYS A 132 14.797 3.342 2.654 1.00 2.12 H new ATOM 0 HZ1 LYS A 132 12.693 3.565 1.499 1.00 31.14 H new ATOM 0 HZ2 LYS A 132 12.509 3.953 3.142 1.00 31.14 H new ATOM 0 HZ3 LYS A 132 12.565 5.189 1.979 1.00 31.14 H new ATOM 2061 N SER A 133 14.885 6.820 8.983 1.00 70.34 N ATOM 2062 CA SER A 133 15.634 7.381 10.103 1.00 2.21 C ATOM 2063 C SER A 133 15.435 6.533 11.357 1.00 25.32 C ATOM 2064 O SER A 133 16.319 6.449 12.212 1.00 14.44 O ATOM 2065 CB SER A 133 15.231 8.836 10.366 1.00 44.31 C ATOM 2066 OG SER A 133 13.841 8.952 10.620 1.00 50.24 O ATOM 0 H SER A 133 14.053 7.347 8.718 1.00 70.34 H new ATOM 0 HA SER A 133 16.692 7.370 9.840 1.00 2.21 H new ATOM 0 HB2 SER A 133 15.791 9.222 11.218 1.00 44.31 H new ATOM 0 HB3 SER A 133 15.497 9.450 9.505 1.00 44.31 H new ATOM 0 HG SER A 133 13.369 9.133 9.780 1.00 50.24 H new ATOM 2072 N ALA A 134 14.269 5.900 11.458 1.00 25.23 N ATOM 2073 CA ALA A 134 13.968 5.023 12.580 1.00 21.35 C ATOM 2074 C ALA A 134 14.723 3.701 12.458 1.00 61.22 C ATOM 2075 O ALA A 134 14.895 2.978 13.442 1.00 64.15 O ATOM 2076 CB ALA A 134 12.472 4.773 12.667 1.00 73.33 C ATOM 0 H ALA A 134 13.517 5.980 10.773 1.00 25.23 H new ATOM 0 HA ALA A 134 14.295 5.516 13.495 1.00 21.35 H new ATOM 0 HB1 ALA A 134 12.261 4.116 13.511 1.00 73.33 H new ATOM 0 HB2 ALA A 134 11.952 5.721 12.807 1.00 73.33 H new ATOM 0 HB3 ALA A 134 12.127 4.303 11.746 1.00 73.33 H new ATOM 2082 N LEU A 135 15.167 3.390 11.246 1.00 73.34 N ATOM 2083 CA LEU A 135 15.943 2.184 11.005 1.00 42.24 C ATOM 2084 C LEU A 135 17.433 2.483 11.080 1.00 71.55 C ATOM 2085 O LEU A 135 18.247 1.576 11.243 1.00 22.30 O ATOM 2086 CB LEU A 135 15.600 1.580 9.639 1.00 62.02 C ATOM 2087 CG LEU A 135 14.176 1.045 9.501 1.00 72.43 C ATOM 2088 CD1 LEU A 135 13.954 0.489 8.105 1.00 70.31 C ATOM 2089 CD2 LEU A 135 13.902 -0.022 10.552 1.00 32.54 C ATOM 0 H LEU A 135 15.002 3.958 10.415 1.00 73.34 H new ATOM 0 HA LEU A 135 15.689 1.460 11.780 1.00 42.24 H new ATOM 0 HB2 LEU A 135 15.761 2.339 8.874 1.00 62.02 H new ATOM 0 HB3 LEU A 135 16.297 0.768 9.434 1.00 62.02 H new ATOM 0 HG LEU A 135 13.480 1.868 9.660 1.00 72.43 H new ATOM 0 HD11 LEU A 135 12.935 0.111 8.022 1.00 70.31 H new ATOM 0 HD12 LEU A 135 14.110 1.279 7.370 1.00 70.31 H new ATOM 0 HD13 LEU A 135 14.658 -0.323 7.920 1.00 70.31 H new ATOM 0 HD21 LEU A 135 12.883 -0.391 10.438 1.00 32.54 H new ATOM 0 HD22 LEU A 135 14.603 -0.847 10.425 1.00 32.54 H new ATOM 0 HD23 LEU A 135 14.023 0.407 11.547 1.00 32.54 H new ATOM 2101 N GLY A 136 17.791 3.758 10.974 1.00 14.33 N ATOM 2102 CA GLY A 136 19.183 4.137 11.105 1.00 62.02 C ATOM 2103 C GLY A 136 19.878 4.340 9.772 1.00 43.22 C ATOM 2104 O GLY A 136 21.091 4.180 9.674 1.00 43.12 O ATOM 0 H GLY A 136 17.147 4.530 10.801 1.00 14.33 H new ATOM 0 HA2 GLY A 136 19.249 5.058 11.685 1.00 62.02 H new ATOM 0 HA3 GLY A 136 19.710 3.367 11.668 1.00 62.02 H new ATOM 2108 N ILE A 137 19.120 4.663 8.738 1.00 42.33 N ATOM 2109 CA ILE A 137 19.697 4.874 7.413 1.00 43.34 C ATOM 2110 C ILE A 137 20.305 6.274 7.296 1.00 43.23 C ATOM 2111 O ILE A 137 19.608 7.278 7.461 1.00 22.31 O ATOM 2112 CB ILE A 137 18.638 4.681 6.303 1.00 3.32 C ATOM 2113 CG1 ILE A 137 18.061 3.262 6.353 1.00 24.43 C ATOM 2114 CG2 ILE A 137 19.235 4.967 4.930 1.00 14.11 C ATOM 2115 CD1 ILE A 137 19.098 2.173 6.174 1.00 54.41 C ATOM 0 H ILE A 137 18.108 4.785 8.785 1.00 42.33 H new ATOM 0 HA ILE A 137 20.484 4.131 7.283 1.00 43.34 H new ATOM 0 HB ILE A 137 17.829 5.390 6.477 1.00 3.32 H new ATOM 0 HG12 ILE A 137 17.558 3.118 7.309 1.00 24.43 H new ATOM 0 HG13 ILE A 137 17.303 3.160 5.576 1.00 24.43 H new ATOM 0 HG21 ILE A 137 18.472 4.825 4.165 1.00 14.11 H new ATOM 0 HG22 ILE A 137 19.595 5.995 4.897 1.00 14.11 H new ATOM 0 HG23 ILE A 137 20.065 4.286 4.745 1.00 14.11 H new ATOM 0 HD11 ILE A 137 18.613 1.198 6.221 1.00 54.41 H new ATOM 0 HD12 ILE A 137 19.585 2.290 5.206 1.00 54.41 H new ATOM 0 HD13 ILE A 137 19.843 2.247 6.966 1.00 54.41 H new