USER MOD reduce.3.24.130724 H: found=0, std=0, add=1092, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1092 hydrogens (44 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 80 ASN : amide:sc= -3.29 K(o=-3.3,f=-6.6!) USER MOD Set 1.2: A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 29 TYR OH : rot 165:sc= 0.2 USER MOD Set 2.2: A 97 THR OG1 : rot 45:sc= 0.0137 USER MOD Set 3.1: A 77 SER OG : rot 60:sc= 1.1 USER MOD Set 3.2: A 300 PIO O6 : rot -118:sc= 0.153 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= -0.123 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 146:sc= -0.404 (180deg=-2.11!) USER MOD Single : A 28 GLN : amide:sc= 0.245 K(o=0.24,f=-3!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0554) USER MOD Single : A 33 HIS : no HD1:sc= 0.0075 K(o=0.0075,f=-5.6!) USER MOD Single : A 38 SER OG : rot 180:sc= -0.105 USER MOD Single : A 47 ASN : amide:sc=-0.00583 X(o=-0.0058,f=-0.28) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.574 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 CYS SG : rot 180:sc= -0.337 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 GLN : amide:sc= -0.178 K(o=-0.18,f=-2.3!) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.303 X(o=-0.3,f=-0.33) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot 180:sc= -0.574 USER MOD Single : A 81 THR OG1 : rot -111:sc= -0.986 USER MOD Single : A 86 TYR OH : rot 150:sc= 0 USER MOD Single : A 87 CYS SG : rot 85:sc= -0.685 USER MOD Single : A 89 HIS : +bothHN:sc= -0.0439 K(o=-0.044,f=-4.5!) USER MOD Single : A 90 GLN : amide:sc= -0.475 K(o=-0.47,f=-3.2!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 109 ASN :FLIP amide:sc= 1.17 F(o=-0.22,f=1.2) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= -0.276 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0.0246 USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 ASN : amide:sc= -0.0646 K(o=-0.065,f=-1.2) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 129 SER OG : rot 130:sc= 0 USER MOD Single : A 130 GLN : amide:sc= 0.00825 X(o=0.0082,f=0) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 300 PIO O2 : rot -158:sc= 0.0622 USER MOD Single : A 300 PIO O3 : rot 180:sc= 0.0604 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 5.278 6.547 9.688 1.00 13.00 N ATOM 2 CA GLY A 2 5.884 5.389 10.317 1.00 45.03 C ATOM 3 C GLY A 2 5.978 4.202 9.377 1.00 53.43 C ATOM 4 O GLY A 2 6.041 4.370 8.160 1.00 0.14 O ATOM 0 HA2 GLY A 2 6.882 5.651 10.668 1.00 45.03 H new ATOM 0 HA3 GLY A 2 5.301 5.109 11.194 1.00 45.03 H new ATOM 8 N ALA A 3 5.990 3.000 9.944 1.00 32.34 N ATOM 9 CA ALA A 3 6.078 1.782 9.149 1.00 44.33 C ATOM 10 C ALA A 3 7.349 1.765 8.308 1.00 71.33 C ATOM 11 O ALA A 3 7.343 1.311 7.164 1.00 5.45 O ATOM 12 CB ALA A 3 4.852 1.644 8.258 1.00 52.44 C ATOM 0 H ALA A 3 5.940 2.844 10.951 1.00 32.34 H new ATOM 0 HA ALA A 3 6.115 0.934 9.833 1.00 44.33 H new ATOM 0 HB1 ALA A 3 4.931 0.730 7.670 1.00 52.44 H new ATOM 0 HB2 ALA A 3 3.956 1.601 8.877 1.00 52.44 H new ATOM 0 HB3 ALA A 3 4.790 2.502 7.589 1.00 52.44 H new ATOM 18 N ARG A 4 8.439 2.264 8.882 1.00 64.14 N ATOM 19 CA ARG A 4 9.719 2.308 8.183 1.00 52.44 C ATOM 20 C ARG A 4 10.427 0.959 8.262 1.00 72.32 C ATOM 21 O ARG A 4 10.794 0.502 9.345 1.00 31.33 O ATOM 22 CB ARG A 4 10.610 3.401 8.776 1.00 64.34 C ATOM 23 CG ARG A 4 11.301 4.259 7.729 1.00 3.14 C ATOM 24 CD ARG A 4 11.284 5.729 8.115 1.00 20.22 C ATOM 25 NE ARG A 4 11.122 6.598 6.952 1.00 33.42 N ATOM 26 CZ ARG A 4 11.265 7.918 6.995 1.00 2.01 C ATOM 27 NH1 ARG A 4 11.570 8.518 8.138 1.00 3.12 N ATOM 28 NH2 ARG A 4 11.102 8.641 5.894 1.00 32.51 N ATOM 0 H ARG A 4 8.462 2.643 9.829 1.00 64.14 H new ATOM 0 HA ARG A 4 9.526 2.536 7.135 1.00 52.44 H new ATOM 0 HB2 ARG A 4 10.006 4.042 9.418 1.00 64.34 H new ATOM 0 HB3 ARG A 4 11.366 2.937 9.410 1.00 64.34 H new ATOM 0 HG2 ARG A 4 12.332 3.926 7.606 1.00 3.14 H new ATOM 0 HG3 ARG A 4 10.807 4.129 6.766 1.00 3.14 H new ATOM 0 HD2 ARG A 4 10.471 5.910 8.819 1.00 20.22 H new ATOM 0 HD3 ARG A 4 12.212 5.980 8.629 1.00 20.22 H new ATOM 0 HE ARG A 4 10.886 6.168 6.058 1.00 33.42 H new ATOM 0 HH11 ARG A 4 11.695 7.966 8.986 1.00 3.12 H new ATOM 0 HH12 ARG A 4 11.679 9.532 8.169 1.00 3.12 H new ATOM 0 HH21 ARG A 4 10.867 8.183 5.013 1.00 32.51 H new ATOM 0 HH22 ARG A 4 11.212 9.654 5.928 1.00 32.51 H new ATOM 42 N ALA A 5 10.617 0.328 7.108 1.00 41.22 N ATOM 43 CA ALA A 5 11.283 -0.967 7.047 1.00 61.23 C ATOM 44 C ALA A 5 12.439 -0.943 6.052 1.00 52.45 C ATOM 45 O ALA A 5 13.586 -1.207 6.413 1.00 73.43 O ATOM 46 CB ALA A 5 10.287 -2.056 6.676 1.00 72.41 C ATOM 0 H ALA A 5 10.319 0.693 6.203 1.00 41.22 H new ATOM 0 HA ALA A 5 11.692 -1.185 8.034 1.00 61.23 H new ATOM 0 HB1 ALA A 5 10.798 -3.018 6.634 1.00 72.41 H new ATOM 0 HB2 ALA A 5 9.497 -2.097 7.426 1.00 72.41 H new ATOM 0 HB3 ALA A 5 9.851 -1.834 5.702 1.00 72.41 H new ATOM 52 N SER A 6 12.129 -0.627 4.799 1.00 51.14 N ATOM 53 CA SER A 6 13.142 -0.573 3.751 1.00 74.12 C ATOM 54 C SER A 6 13.659 -1.971 3.424 1.00 15.22 C ATOM 55 O SER A 6 13.303 -2.552 2.399 1.00 4.12 O ATOM 56 CB SER A 6 14.303 0.325 4.182 1.00 62.42 C ATOM 57 OG SER A 6 14.389 1.476 3.361 1.00 20.15 O ATOM 0 H SER A 6 11.185 -0.404 4.484 1.00 51.14 H new ATOM 0 HA SER A 6 12.682 -0.156 2.855 1.00 74.12 H new ATOM 0 HB2 SER A 6 14.168 0.625 5.221 1.00 62.42 H new ATOM 0 HB3 SER A 6 15.238 -0.233 4.130 1.00 62.42 H new ATOM 0 HG SER A 6 15.138 2.034 3.658 1.00 20.15 H new ATOM 63 N VAL A 7 14.501 -2.504 4.302 1.00 71.34 N ATOM 64 CA VAL A 7 15.068 -3.833 4.108 1.00 63.45 C ATOM 65 C VAL A 7 14.432 -4.846 5.056 1.00 72.40 C ATOM 66 O VAL A 7 13.704 -5.740 4.627 1.00 45.43 O ATOM 67 CB VAL A 7 16.593 -3.831 4.325 1.00 63.20 C ATOM 68 CG1 VAL A 7 17.173 -5.211 4.055 1.00 23.54 C ATOM 69 CG2 VAL A 7 17.255 -2.784 3.443 1.00 21.13 C ATOM 0 H VAL A 7 14.806 -2.036 5.155 1.00 71.34 H new ATOM 0 HA VAL A 7 14.856 -4.120 3.078 1.00 63.45 H new ATOM 0 HB VAL A 7 16.794 -3.576 5.366 1.00 63.20 H new ATOM 0 HG11 VAL A 7 18.251 -5.190 4.213 1.00 23.54 H new ATOM 0 HG12 VAL A 7 16.721 -5.935 4.733 1.00 23.54 H new ATOM 0 HG13 VAL A 7 16.963 -5.499 3.025 1.00 23.54 H new ATOM 0 HG21 VAL A 7 18.332 -2.797 3.609 1.00 21.13 H new ATOM 0 HG22 VAL A 7 17.047 -3.006 2.396 1.00 21.13 H new ATOM 0 HG23 VAL A 7 16.861 -1.798 3.690 1.00 21.13 H new ATOM 79 N LEU A 8 14.713 -4.697 6.346 1.00 65.42 N ATOM 80 CA LEU A 8 14.168 -5.598 7.355 1.00 73.45 C ATOM 81 C LEU A 8 12.945 -4.985 8.028 1.00 71.33 C ATOM 82 O LEU A 8 12.921 -3.790 8.326 1.00 24.12 O ATOM 83 CB LEU A 8 15.233 -5.922 8.405 1.00 71.13 C ATOM 84 CG LEU A 8 16.298 -6.938 7.989 1.00 10.21 C ATOM 85 CD1 LEU A 8 17.364 -7.066 9.067 1.00 0.31 C ATOM 86 CD2 LEU A 8 15.662 -8.291 7.704 1.00 1.01 C ATOM 0 H LEU A 8 15.314 -3.962 6.717 1.00 65.42 H new ATOM 0 HA LEU A 8 13.863 -6.519 6.858 1.00 73.45 H new ATOM 0 HB2 LEU A 8 15.733 -4.995 8.684 1.00 71.13 H new ATOM 0 HB3 LEU A 8 14.732 -6.295 9.298 1.00 71.13 H new ATOM 0 HG LEU A 8 16.774 -6.582 7.075 1.00 10.21 H new ATOM 0 HD11 LEU A 8 18.113 -7.793 8.753 1.00 0.31 H new ATOM 0 HD12 LEU A 8 17.841 -6.098 9.224 1.00 0.31 H new ATOM 0 HD13 LEU A 8 16.903 -7.398 9.997 1.00 0.31 H new ATOM 0 HD21 LEU A 8 16.434 -9.001 7.409 1.00 1.01 H new ATOM 0 HD22 LEU A 8 15.159 -8.653 8.601 1.00 1.01 H new ATOM 0 HD23 LEU A 8 14.936 -8.189 6.897 1.00 1.01 H new ATOM 98 N SER A 9 11.932 -5.812 8.267 1.00 15.34 N ATOM 99 CA SER A 9 10.703 -5.350 8.904 1.00 53.14 C ATOM 100 C SER A 9 10.847 -5.349 10.423 1.00 4.32 C ATOM 101 O SER A 9 11.927 -5.597 10.956 1.00 34.30 O ATOM 102 CB SER A 9 9.526 -6.237 8.492 1.00 72.31 C ATOM 103 OG SER A 9 9.303 -7.262 9.444 1.00 11.30 O ATOM 0 H SER A 9 11.937 -6.804 8.030 1.00 15.34 H new ATOM 0 HA SER A 9 10.512 -4.329 8.574 1.00 53.14 H new ATOM 0 HB2 SER A 9 8.627 -5.629 8.390 1.00 72.31 H new ATOM 0 HB3 SER A 9 9.724 -6.680 7.516 1.00 72.31 H new ATOM 0 HG SER A 9 8.545 -7.814 9.159 1.00 11.30 H new ATOM 109 N GLY A 10 9.746 -5.067 11.115 1.00 21.32 N ATOM 110 CA GLY A 10 9.769 -5.038 12.565 1.00 40.22 C ATOM 111 C GLY A 10 10.181 -6.368 13.166 1.00 35.50 C ATOM 112 O GLY A 10 11.067 -6.425 14.017 1.00 75.05 O ATOM 0 H GLY A 10 8.840 -4.858 10.696 1.00 21.32 H new ATOM 0 HA2 GLY A 10 10.459 -4.263 12.899 1.00 40.22 H new ATOM 0 HA3 GLY A 10 8.781 -4.766 12.935 1.00 40.22 H new ATOM 116 N GLY A 11 9.536 -7.442 12.721 1.00 24.23 N ATOM 117 CA GLY A 11 9.853 -8.763 13.231 1.00 60.04 C ATOM 118 C GLY A 11 11.263 -9.196 12.882 1.00 1.14 C ATOM 119 O GLY A 11 11.944 -9.827 13.690 1.00 11.15 O ATOM 0 H GLY A 11 8.799 -7.421 12.016 1.00 24.23 H new ATOM 0 HA2 GLY A 11 9.732 -8.770 14.314 1.00 60.04 H new ATOM 0 HA3 GLY A 11 9.144 -9.485 12.826 1.00 60.04 H new ATOM 123 N GLU A 12 11.701 -8.859 11.674 1.00 23.43 N ATOM 124 CA GLU A 12 13.039 -9.221 11.218 1.00 51.22 C ATOM 125 C GLU A 12 14.103 -8.414 11.958 1.00 4.44 C ATOM 126 O GLU A 12 15.185 -8.919 12.257 1.00 1.44 O ATOM 127 CB GLU A 12 13.168 -8.993 9.710 1.00 11.55 C ATOM 128 CG GLU A 12 11.983 -9.510 8.913 1.00 2.40 C ATOM 129 CD GLU A 12 12.157 -9.323 7.419 1.00 32.25 C ATOM 130 OE1 GLU A 12 12.855 -10.148 6.794 1.00 25.03 O ATOM 131 OE2 GLU A 12 11.596 -8.348 6.874 1.00 54.55 O ATOM 0 H GLU A 12 11.150 -8.336 10.993 1.00 23.43 H new ATOM 0 HA GLU A 12 13.194 -10.278 11.433 1.00 51.22 H new ATOM 0 HB2 GLU A 12 13.284 -7.926 9.521 1.00 11.55 H new ATOM 0 HB3 GLU A 12 14.075 -9.481 9.354 1.00 11.55 H new ATOM 0 HG2 GLU A 12 11.840 -10.569 9.128 1.00 2.40 H new ATOM 0 HG3 GLU A 12 11.079 -8.994 9.237 1.00 2.40 H new ATOM 138 N LEU A 13 13.786 -7.157 12.250 1.00 64.31 N ATOM 139 CA LEU A 13 14.713 -6.279 12.954 1.00 72.31 C ATOM 140 C LEU A 13 15.030 -6.823 14.343 1.00 42.31 C ATOM 141 O LEU A 13 16.160 -6.715 14.820 1.00 42.14 O ATOM 142 CB LEU A 13 14.126 -4.870 13.068 1.00 64.43 C ATOM 143 CG LEU A 13 15.119 -3.754 13.392 1.00 73.13 C ATOM 144 CD1 LEU A 13 15.861 -3.318 12.139 1.00 62.30 C ATOM 145 CD2 LEU A 13 14.403 -2.571 14.028 1.00 44.11 C ATOM 0 H LEU A 13 12.894 -6.724 12.010 1.00 64.31 H new ATOM 0 HA LEU A 13 15.639 -6.235 12.381 1.00 72.31 H new ATOM 0 HB2 LEU A 13 13.631 -4.627 12.128 1.00 64.43 H new ATOM 0 HB3 LEU A 13 13.357 -4.880 13.840 1.00 64.43 H new ATOM 0 HG LEU A 13 15.848 -4.139 14.105 1.00 73.13 H new ATOM 0 HD11 LEU A 13 16.563 -2.523 12.390 1.00 62.30 H new ATOM 0 HD12 LEU A 13 16.406 -4.166 11.725 1.00 62.30 H new ATOM 0 HD13 LEU A 13 15.146 -2.952 11.402 1.00 62.30 H new ATOM 0 HD21 LEU A 13 15.125 -1.786 14.252 1.00 44.11 H new ATOM 0 HD22 LEU A 13 13.652 -2.187 13.338 1.00 44.11 H new ATOM 0 HD23 LEU A 13 13.918 -2.892 14.950 1.00 44.11 H new ATOM 157 N ASP A 14 14.027 -7.410 14.986 1.00 13.41 N ATOM 158 CA ASP A 14 14.198 -7.975 16.320 1.00 34.11 C ATOM 159 C ASP A 14 15.250 -9.080 16.310 1.00 3.13 C ATOM 160 O ASP A 14 16.270 -8.986 16.992 1.00 61.44 O ATOM 161 CB ASP A 14 12.869 -8.523 16.840 1.00 11.20 C ATOM 162 CG ASP A 14 12.991 -9.116 18.230 1.00 63.02 C ATOM 163 OD1 ASP A 14 13.645 -8.488 19.087 1.00 72.13 O ATOM 164 OD2 ASP A 14 12.434 -10.211 18.459 1.00 34.15 O ATOM 0 H ASP A 14 13.086 -7.507 14.605 1.00 13.41 H new ATOM 0 HA ASP A 14 14.538 -7.180 16.984 1.00 34.11 H new ATOM 0 HB2 ASP A 14 12.130 -7.722 16.853 1.00 11.20 H new ATOM 0 HB3 ASP A 14 12.500 -9.286 16.154 1.00 11.20 H new ATOM 169 N LYS A 15 14.992 -10.127 15.534 1.00 73.34 N ATOM 170 CA LYS A 15 15.916 -11.251 15.434 1.00 4.22 C ATOM 171 C LYS A 15 17.249 -10.809 14.840 1.00 65.21 C ATOM 172 O LYS A 15 18.311 -11.261 15.270 1.00 3.32 O ATOM 173 CB LYS A 15 15.307 -12.364 14.576 1.00 55.44 C ATOM 174 CG LYS A 15 14.678 -13.483 15.389 1.00 31.01 C ATOM 175 CD LYS A 15 15.720 -14.486 15.855 1.00 51.32 C ATOM 176 CE LYS A 15 15.649 -14.705 17.359 1.00 34.43 C ATOM 177 NZ LYS A 15 14.587 -15.682 17.727 1.00 53.53 N ATOM 0 H LYS A 15 14.151 -10.221 14.965 1.00 73.34 H new ATOM 0 HA LYS A 15 16.095 -11.632 16.439 1.00 4.22 H new ATOM 0 HB2 LYS A 15 14.550 -11.933 13.920 1.00 55.44 H new ATOM 0 HB3 LYS A 15 16.083 -12.783 13.935 1.00 55.44 H new ATOM 0 HG2 LYS A 15 14.165 -13.062 16.253 1.00 31.01 H new ATOM 0 HG3 LYS A 15 13.925 -13.992 14.788 1.00 31.01 H new ATOM 0 HD2 LYS A 15 15.569 -15.435 15.340 1.00 51.32 H new ATOM 0 HD3 LYS A 15 16.715 -14.131 15.584 1.00 51.32 H new ATOM 0 HE2 LYS A 15 16.613 -15.063 17.720 1.00 34.43 H new ATOM 0 HE3 LYS A 15 15.456 -13.754 17.856 1.00 34.43 H new ATOM 0 HZ1 LYS A 15 14.570 -15.804 18.760 1.00 53.53 H new ATOM 0 HZ2 LYS A 15 13.663 -15.328 17.405 1.00 53.53 H new ATOM 0 HZ3 LYS A 15 14.785 -16.597 17.273 1.00 53.53 H new ATOM 191 N TRP A 16 17.187 -9.925 13.852 1.00 14.21 N ATOM 192 CA TRP A 16 18.391 -9.421 13.200 1.00 13.43 C ATOM 193 C TRP A 16 19.376 -8.871 14.226 1.00 40.50 C ATOM 194 O TRP A 16 20.585 -9.063 14.102 1.00 54.34 O ATOM 195 CB TRP A 16 18.030 -8.333 12.188 1.00 33.01 C ATOM 196 CG TRP A 16 19.225 -7.638 11.610 1.00 61.34 C ATOM 197 CD1 TRP A 16 19.764 -6.453 12.023 1.00 34.34 C ATOM 198 CD2 TRP A 16 20.030 -8.086 10.514 1.00 70.23 C ATOM 199 NE1 TRP A 16 20.854 -6.136 11.250 1.00 71.42 N ATOM 200 CE2 TRP A 16 21.040 -7.123 10.318 1.00 22.45 C ATOM 201 CE3 TRP A 16 19.999 -9.208 9.682 1.00 31.34 C ATOM 202 CZ2 TRP A 16 22.004 -7.249 9.322 1.00 72.41 C ATOM 203 CZ3 TRP A 16 20.956 -9.331 8.693 1.00 71.45 C ATOM 204 CH2 TRP A 16 21.949 -8.358 8.520 1.00 74.13 C ATOM 0 H TRP A 16 16.316 -9.542 13.484 1.00 14.21 H new ATOM 0 HA TRP A 16 18.866 -10.251 12.677 1.00 13.43 H new ATOM 0 HB2 TRP A 16 17.451 -8.778 11.379 1.00 33.01 H new ATOM 0 HB3 TRP A 16 17.389 -7.596 12.671 1.00 33.01 H new ATOM 0 HD1 TRP A 16 19.388 -5.853 12.838 1.00 34.34 H new ATOM 0 HE1 TRP A 16 21.431 -5.301 11.353 1.00 71.42 H new ATOM 0 HE3 TRP A 16 19.240 -9.966 9.810 1.00 31.34 H new ATOM 0 HZ2 TRP A 16 22.769 -6.499 9.186 1.00 72.41 H new ATOM 0 HZ3 TRP A 16 20.938 -10.192 8.042 1.00 71.45 H new ATOM 0 HH2 TRP A 16 22.685 -8.485 7.740 1.00 74.13 H new ATOM 215 N GLU A 17 18.850 -8.188 15.238 1.00 75.12 N ATOM 216 CA GLU A 17 19.685 -7.610 16.285 1.00 31.55 C ATOM 217 C GLU A 17 20.243 -8.697 17.198 1.00 45.23 C ATOM 218 O GLU A 17 21.286 -8.522 17.828 1.00 23.43 O ATOM 219 CB GLU A 17 18.884 -6.599 17.108 1.00 51.02 C ATOM 220 CG GLU A 17 18.850 -5.207 16.499 1.00 63.43 C ATOM 221 CD GLU A 17 18.629 -4.123 17.534 1.00 54.30 C ATOM 222 OE1 GLU A 17 17.857 -4.359 18.487 1.00 22.13 O ATOM 223 OE2 GLU A 17 19.227 -3.035 17.391 1.00 43.11 O ATOM 0 H GLU A 17 17.851 -8.021 15.355 1.00 75.12 H new ATOM 0 HA GLU A 17 20.520 -7.098 15.806 1.00 31.55 H new ATOM 0 HB2 GLU A 17 17.862 -6.962 17.220 1.00 51.02 H new ATOM 0 HB3 GLU A 17 19.312 -6.538 18.109 1.00 51.02 H new ATOM 0 HG2 GLU A 17 19.788 -5.020 15.977 1.00 63.43 H new ATOM 0 HG3 GLU A 17 18.056 -5.160 15.754 1.00 63.43 H new ATOM 230 N LYS A 18 19.540 -9.823 17.265 1.00 51.21 N ATOM 231 CA LYS A 18 19.963 -10.941 18.100 1.00 4.22 C ATOM 232 C LYS A 18 21.086 -11.726 17.431 1.00 32.23 C ATOM 233 O LYS A 18 22.057 -12.116 18.081 1.00 25.13 O ATOM 234 CB LYS A 18 18.778 -11.868 18.385 1.00 73.31 C ATOM 235 CG LYS A 18 18.787 -12.452 19.787 1.00 63.31 C ATOM 236 CD LYS A 18 20.056 -13.245 20.053 1.00 70.23 C ATOM 237 CE LYS A 18 19.786 -14.445 20.947 1.00 60.33 C ATOM 238 NZ LYS A 18 19.432 -14.036 22.335 1.00 75.40 N ATOM 0 H LYS A 18 18.674 -9.985 16.751 1.00 51.21 H new ATOM 0 HA LYS A 18 20.336 -10.538 19.041 1.00 4.22 H new ATOM 0 HB2 LYS A 18 17.851 -11.315 18.237 1.00 73.31 H new ATOM 0 HB3 LYS A 18 18.782 -12.683 17.661 1.00 73.31 H new ATOM 0 HG2 LYS A 18 18.700 -11.648 20.518 1.00 63.31 H new ATOM 0 HG3 LYS A 18 17.919 -13.098 19.919 1.00 63.31 H new ATOM 0 HD2 LYS A 18 20.480 -13.583 19.107 1.00 70.23 H new ATOM 0 HD3 LYS A 18 20.798 -12.599 20.523 1.00 70.23 H new ATOM 0 HE2 LYS A 18 18.974 -15.037 20.525 1.00 60.33 H new ATOM 0 HE3 LYS A 18 20.668 -15.085 20.971 1.00 60.33 H new ATOM 0 HZ1 LYS A 18 19.256 -14.883 22.912 1.00 75.40 H new ATOM 0 HZ2 LYS A 18 20.217 -13.493 22.748 1.00 75.40 H new ATOM 0 HZ3 LYS A 18 18.576 -13.446 22.315 1.00 75.40 H new ATOM 252 N ILE A 19 20.949 -11.951 16.129 1.00 23.32 N ATOM 253 CA ILE A 19 21.955 -12.687 15.371 1.00 71.12 C ATOM 254 C ILE A 19 23.346 -12.105 15.596 1.00 52.01 C ATOM 255 O ILE A 19 23.546 -10.893 15.507 1.00 11.20 O ATOM 256 CB ILE A 19 21.643 -12.675 13.863 1.00 44.24 C ATOM 257 CG1 ILE A 19 20.266 -13.287 13.600 1.00 3.40 C ATOM 258 CG2 ILE A 19 22.719 -13.428 13.094 1.00 54.02 C ATOM 259 CD1 ILE A 19 19.685 -12.912 12.255 1.00 2.53 C ATOM 0 H ILE A 19 20.152 -11.635 15.577 1.00 23.32 H new ATOM 0 HA ILE A 19 21.932 -13.716 15.730 1.00 71.12 H new ATOM 0 HB ILE A 19 21.632 -11.641 13.517 1.00 44.24 H new ATOM 0 HG12 ILE A 19 20.342 -14.372 13.664 1.00 3.40 H new ATOM 0 HG13 ILE A 19 19.580 -12.968 14.385 1.00 3.40 H new ATOM 0 HG21 ILE A 19 22.485 -13.411 12.030 1.00 54.02 H new ATOM 0 HG22 ILE A 19 23.686 -12.952 13.261 1.00 54.02 H new ATOM 0 HG23 ILE A 19 22.758 -14.461 13.440 1.00 54.02 H new ATOM 0 HD11 ILE A 19 18.708 -13.381 12.137 1.00 2.53 H new ATOM 0 HD12 ILE A 19 19.577 -11.829 12.194 1.00 2.53 H new ATOM 0 HD13 ILE A 19 20.350 -13.255 11.463 1.00 2.53 H new ATOM 271 N ARG A 20 24.307 -12.977 15.886 1.00 21.14 N ATOM 272 CA ARG A 20 25.680 -12.551 16.122 1.00 14.01 C ATOM 273 C ARG A 20 26.532 -12.739 14.869 1.00 55.33 C ATOM 274 O ARG A 20 26.258 -13.613 14.046 1.00 51.42 O ATOM 275 CB ARG A 20 26.286 -13.335 17.287 1.00 73.55 C ATOM 276 CG ARG A 20 25.497 -13.212 18.580 1.00 64.44 C ATOM 277 CD ARG A 20 26.130 -14.027 19.698 1.00 74.43 C ATOM 278 NE ARG A 20 25.129 -14.703 20.518 1.00 22.13 N ATOM 279 CZ ARG A 20 25.428 -15.463 21.566 1.00 15.45 C ATOM 280 NH1 ARG A 20 26.692 -15.639 21.921 1.00 65.55 N ATOM 281 NH2 ARG A 20 24.459 -16.045 22.262 1.00 33.42 N ATOM 0 H ARG A 20 24.159 -13.983 15.963 1.00 21.14 H new ATOM 0 HA ARG A 20 25.667 -11.491 16.374 1.00 14.01 H new ATOM 0 HB2 ARG A 20 26.352 -14.387 17.010 1.00 73.55 H new ATOM 0 HB3 ARG A 20 27.304 -12.986 17.458 1.00 73.55 H new ATOM 0 HG2 ARG A 20 25.444 -12.165 18.877 1.00 64.44 H new ATOM 0 HG3 ARG A 20 24.474 -13.549 18.417 1.00 64.44 H new ATOM 0 HD2 ARG A 20 26.806 -14.766 19.269 1.00 74.43 H new ATOM 0 HD3 ARG A 20 26.732 -13.372 20.328 1.00 74.43 H new ATOM 0 HE ARG A 20 24.146 -14.585 20.273 1.00 22.13 H new ATOM 0 HH11 ARG A 20 27.438 -15.191 21.389 1.00 65.55 H new ATOM 0 HH12 ARG A 20 26.919 -16.223 22.726 1.00 65.55 H new ATOM 0 HH21 ARG A 20 23.485 -15.909 21.992 1.00 33.42 H new ATOM 0 HH22 ARG A 20 24.689 -16.628 23.067 1.00 33.42 H new ATOM 295 N LEU A 21 27.564 -11.914 14.733 1.00 12.43 N ATOM 296 CA LEU A 21 28.455 -11.989 13.581 1.00 60.03 C ATOM 297 C LEU A 21 29.148 -13.346 13.516 1.00 23.41 C ATOM 298 O LEU A 21 29.534 -13.806 12.441 1.00 10.31 O ATOM 299 CB LEU A 21 29.500 -10.873 13.646 1.00 15.13 C ATOM 300 CG LEU A 21 28.954 -9.449 13.757 1.00 33.30 C ATOM 301 CD1 LEU A 21 30.094 -8.443 13.808 1.00 10.13 C ATOM 302 CD2 LEU A 21 28.022 -9.142 12.593 1.00 65.11 C ATOM 0 H LEU A 21 27.804 -11.186 15.406 1.00 12.43 H new ATOM 0 HA LEU A 21 27.855 -11.865 12.680 1.00 60.03 H new ATOM 0 HB2 LEU A 21 30.149 -11.060 14.501 1.00 15.13 H new ATOM 0 HB3 LEU A 21 30.123 -10.933 12.754 1.00 15.13 H new ATOM 0 HG LEU A 21 28.384 -9.370 14.683 1.00 33.30 H new ATOM 0 HD11 LEU A 21 29.687 -7.435 13.887 1.00 10.13 H new ATOM 0 HD12 LEU A 21 30.723 -8.649 14.674 1.00 10.13 H new ATOM 0 HD13 LEU A 21 30.691 -8.523 12.899 1.00 10.13 H new ATOM 0 HD21 LEU A 21 27.643 -8.124 12.689 1.00 65.11 H new ATOM 0 HD22 LEU A 21 28.568 -9.239 11.655 1.00 65.11 H new ATOM 0 HD23 LEU A 21 27.187 -9.842 12.601 1.00 65.11 H new ATOM 314 N ARG A 22 29.301 -13.983 14.672 1.00 51.21 N ATOM 315 CA ARG A 22 29.946 -15.287 14.747 1.00 42.22 C ATOM 316 C ARG A 22 29.228 -16.193 15.743 1.00 54.14 C ATOM 317 O ARG A 22 28.496 -15.735 16.620 1.00 54.00 O ATOM 318 CB ARG A 22 31.415 -15.132 15.148 1.00 43.51 C ATOM 319 CG ARG A 22 32.388 -15.376 14.006 1.00 12.51 C ATOM 320 CD ARG A 22 33.604 -16.161 14.469 1.00 52.23 C ATOM 321 NE ARG A 22 34.852 -15.468 14.160 1.00 23.42 N ATOM 322 CZ ARG A 22 35.309 -14.431 14.853 1.00 13.03 C ATOM 323 NH1 ARG A 22 34.625 -13.969 15.889 1.00 12.32 N ATOM 324 NH2 ARG A 22 36.454 -13.854 14.509 1.00 13.03 N ATOM 0 H ARG A 22 28.986 -13.616 15.570 1.00 51.21 H new ATOM 0 HA ARG A 22 29.893 -15.747 13.760 1.00 42.22 H new ATOM 0 HB2 ARG A 22 31.572 -14.127 15.539 1.00 43.51 H new ATOM 0 HB3 ARG A 22 31.637 -15.827 15.958 1.00 43.51 H new ATOM 0 HG2 ARG A 22 31.884 -15.921 13.207 1.00 12.51 H new ATOM 0 HG3 ARG A 22 32.707 -14.421 13.588 1.00 12.51 H new ATOM 0 HD2 ARG A 22 33.539 -16.329 15.544 1.00 52.23 H new ATOM 0 HD3 ARG A 22 33.606 -17.141 13.992 1.00 52.23 H new ATOM 0 HE ARG A 22 35.403 -15.799 13.368 1.00 23.42 H new ATOM 0 HH11 ARG A 22 33.745 -14.410 16.157 1.00 12.32 H new ATOM 0 HH12 ARG A 22 34.978 -13.173 16.419 1.00 12.32 H new ATOM 0 HH21 ARG A 22 36.984 -14.207 13.712 1.00 13.03 H new ATOM 0 HH22 ARG A 22 36.804 -13.058 15.042 1.00 13.03 H new ATOM 338 N PRO A 23 29.441 -17.510 15.606 1.00 1.41 N ATOM 339 CA PRO A 23 28.823 -18.508 16.485 1.00 3.51 C ATOM 340 C PRO A 23 29.390 -18.465 17.900 1.00 12.12 C ATOM 341 O PRO A 23 28.681 -18.724 18.871 1.00 72.34 O ATOM 342 CB PRO A 23 29.169 -19.838 15.811 1.00 34.55 C ATOM 343 CG PRO A 23 30.410 -19.557 15.035 1.00 61.12 C ATOM 344 CD PRO A 23 30.301 -18.127 14.582 1.00 70.45 C ATOM 0 HA PRO A 23 27.752 -18.340 16.602 1.00 3.51 H new ATOM 0 HB2 PRO A 23 29.332 -20.625 16.548 1.00 34.55 H new ATOM 0 HB3 PRO A 23 28.362 -20.174 15.160 1.00 34.55 H new ATOM 0 HG2 PRO A 23 31.297 -19.705 15.651 1.00 61.12 H new ATOM 0 HG3 PRO A 23 30.498 -20.231 14.183 1.00 61.12 H new ATOM 0 HD2 PRO A 23 31.278 -17.645 14.534 1.00 70.45 H new ATOM 0 HD3 PRO A 23 29.859 -18.053 13.588 1.00 70.45 H new ATOM 352 N GLY A 24 30.674 -18.135 18.008 1.00 13.53 N ATOM 353 CA GLY A 24 31.313 -18.063 19.309 1.00 73.54 C ATOM 354 C GLY A 24 31.693 -16.646 19.690 1.00 70.45 C ATOM 355 O GLY A 24 32.585 -16.435 20.511 1.00 52.42 O ATOM 0 H GLY A 24 31.282 -17.917 17.219 1.00 13.53 H new ATOM 0 HA2 GLY A 24 30.641 -18.471 20.064 1.00 73.54 H new ATOM 0 HA3 GLY A 24 32.206 -18.687 19.307 1.00 73.54 H new ATOM 359 N GLY A 25 31.017 -15.670 19.091 1.00 64.44 N ATOM 360 CA GLY A 25 31.305 -14.279 19.384 1.00 63.02 C ATOM 361 C GLY A 25 30.164 -13.590 20.106 1.00 41.33 C ATOM 362 O GLY A 25 29.124 -14.198 20.360 1.00 1.24 O ATOM 0 H GLY A 25 30.275 -15.819 18.408 1.00 64.44 H new ATOM 0 HA2 GLY A 25 32.206 -14.219 19.994 1.00 63.02 H new ATOM 0 HA3 GLY A 25 31.514 -13.751 18.454 1.00 63.02 H new ATOM 366 N LYS A 26 30.358 -12.319 20.439 1.00 62.14 N ATOM 367 CA LYS A 26 29.338 -11.546 21.136 1.00 3.33 C ATOM 368 C LYS A 26 28.817 -10.413 20.258 1.00 21.42 C ATOM 369 O LYS A 26 27.677 -9.973 20.403 1.00 14.31 O ATOM 370 CB LYS A 26 29.901 -10.976 22.440 1.00 64.32 C ATOM 371 CG LYS A 26 29.129 -11.406 23.676 1.00 72.12 C ATOM 372 CD LYS A 26 29.817 -10.947 24.950 1.00 52.13 C ATOM 373 CE LYS A 26 30.276 -12.127 25.793 1.00 22.33 C ATOM 374 NZ LYS A 26 31.559 -12.697 25.296 1.00 3.42 N ATOM 0 H LYS A 26 31.214 -11.802 20.237 1.00 62.14 H new ATOM 0 HA LYS A 26 28.508 -12.214 21.367 1.00 3.33 H new ATOM 0 HB2 LYS A 26 30.940 -11.288 22.544 1.00 64.32 H new ATOM 0 HB3 LYS A 26 29.899 -9.888 22.381 1.00 64.32 H new ATOM 0 HG2 LYS A 26 28.120 -10.995 23.638 1.00 72.12 H new ATOM 0 HG3 LYS A 26 29.030 -12.491 23.685 1.00 72.12 H new ATOM 0 HD2 LYS A 26 30.675 -10.324 24.697 1.00 52.13 H new ATOM 0 HD3 LYS A 26 29.133 -10.328 25.531 1.00 52.13 H new ATOM 0 HE2 LYS A 26 30.397 -11.809 26.828 1.00 22.33 H new ATOM 0 HE3 LYS A 26 29.508 -12.900 25.785 1.00 22.33 H new ATOM 0 HZ1 LYS A 26 31.838 -13.499 25.897 1.00 3.42 H new ATOM 0 HZ2 LYS A 26 31.437 -13.024 24.316 1.00 3.42 H new ATOM 0 HZ3 LYS A 26 32.299 -11.967 25.328 1.00 3.42 H new ATOM 388 N LYS A 27 29.661 -9.945 19.344 1.00 32.24 N ATOM 389 CA LYS A 27 29.287 -8.864 18.439 1.00 25.42 C ATOM 390 C LYS A 27 27.969 -9.175 17.735 1.00 64.22 C ATOM 391 O LYS A 27 27.921 -10.008 16.830 1.00 63.13 O ATOM 392 CB LYS A 27 30.389 -8.635 17.402 1.00 22.10 C ATOM 393 CG LYS A 27 30.629 -7.169 17.084 1.00 62.14 C ATOM 394 CD LYS A 27 31.996 -6.951 16.457 1.00 64.44 C ATOM 395 CE LYS A 27 31.982 -5.786 15.480 1.00 72.02 C ATOM 396 NZ LYS A 27 33.357 -5.305 15.170 1.00 65.12 N ATOM 0 H LYS A 27 30.609 -10.298 19.210 1.00 32.24 H new ATOM 0 HA LYS A 27 29.158 -7.957 19.030 1.00 25.42 H new ATOM 0 HB2 LYS A 27 31.317 -9.076 17.767 1.00 22.10 H new ATOM 0 HB3 LYS A 27 30.126 -9.159 16.483 1.00 22.10 H new ATOM 0 HG2 LYS A 27 29.855 -6.812 16.405 1.00 62.14 H new ATOM 0 HG3 LYS A 27 30.548 -6.580 17.997 1.00 62.14 H new ATOM 0 HD2 LYS A 27 32.730 -6.762 17.240 1.00 64.44 H new ATOM 0 HD3 LYS A 27 32.309 -7.858 15.939 1.00 64.44 H new ATOM 0 HE2 LYS A 27 31.488 -6.091 14.558 1.00 72.02 H new ATOM 0 HE3 LYS A 27 31.397 -4.967 15.899 1.00 72.02 H new ATOM 0 HZ1 LYS A 27 33.396 -4.979 14.183 1.00 65.12 H new ATOM 0 HZ2 LYS A 27 33.601 -4.518 15.805 1.00 65.12 H new ATOM 0 HZ3 LYS A 27 34.035 -6.082 15.305 1.00 65.12 H new ATOM 410 N GLN A 28 26.904 -8.500 18.157 1.00 63.45 N ATOM 411 CA GLN A 28 25.588 -8.706 17.565 1.00 15.31 C ATOM 412 C GLN A 28 25.440 -7.906 16.275 1.00 73.12 C ATOM 413 O GLN A 28 26.251 -7.028 15.981 1.00 13.14 O ATOM 414 CB GLN A 28 24.493 -8.307 18.556 1.00 35.43 C ATOM 415 CG GLN A 28 24.727 -8.828 19.964 1.00 53.12 C ATOM 416 CD GLN A 28 25.293 -7.771 20.892 1.00 30.14 C ATOM 417 OE1 GLN A 28 25.958 -6.833 20.451 1.00 10.32 O ATOM 418 NE2 GLN A 28 25.032 -7.917 22.186 1.00 4.30 N ATOM 0 H GLN A 28 26.927 -7.807 18.905 1.00 63.45 H new ATOM 0 HA GLN A 28 25.485 -9.765 17.327 1.00 15.31 H new ATOM 0 HB2 GLN A 28 24.422 -7.220 18.587 1.00 35.43 H new ATOM 0 HB3 GLN A 28 23.534 -8.679 18.195 1.00 35.43 H new ATOM 0 HG2 GLN A 28 23.786 -9.197 20.372 1.00 53.12 H new ATOM 0 HG3 GLN A 28 25.412 -9.675 19.924 1.00 53.12 H new ATOM 0 HE21 GLN A 28 24.477 -8.710 22.508 1.00 4.30 H new ATOM 0 HE22 GLN A 28 25.387 -7.236 22.858 1.00 4.30 H new ATOM 427 N TYR A 29 24.400 -8.217 15.509 1.00 33.22 N ATOM 428 CA TYR A 29 24.147 -7.529 14.248 1.00 13.01 C ATOM 429 C TYR A 29 23.343 -6.251 14.476 1.00 44.14 C ATOM 430 O TYR A 29 22.563 -6.156 15.423 1.00 42.51 O ATOM 431 CB TYR A 29 23.401 -8.449 13.281 1.00 51.43 C ATOM 432 CG TYR A 29 24.307 -9.169 12.308 1.00 15.10 C ATOM 433 CD1 TYR A 29 24.874 -8.497 11.231 1.00 42.13 C ATOM 434 CD2 TYR A 29 24.596 -10.518 12.465 1.00 53.12 C ATOM 435 CE1 TYR A 29 25.702 -9.151 10.340 1.00 21.23 C ATOM 436 CE2 TYR A 29 25.424 -11.179 11.579 1.00 31.03 C ATOM 437 CZ TYR A 29 25.974 -10.491 10.517 1.00 72.44 C ATOM 438 OH TYR A 29 26.799 -11.146 9.632 1.00 3.34 O ATOM 0 H TYR A 29 23.719 -8.941 15.739 1.00 33.22 H new ATOM 0 HA TYR A 29 25.109 -7.259 13.812 1.00 13.01 H new ATOM 0 HB2 TYR A 29 22.839 -9.186 13.855 1.00 51.43 H new ATOM 0 HB3 TYR A 29 22.675 -7.861 12.720 1.00 51.43 H new ATOM 0 HD1 TYR A 29 24.664 -7.447 11.089 1.00 42.13 H new ATOM 0 HD2 TYR A 29 24.166 -11.060 13.294 1.00 53.12 H new ATOM 0 HE1 TYR A 29 26.135 -8.615 9.508 1.00 21.23 H new ATOM 0 HE2 TYR A 29 25.640 -12.228 11.717 1.00 31.03 H new ATOM 0 HH TYR A 29 27.081 -12.001 10.019 1.00 3.34 H new ATOM 448 N LYS A 30 23.541 -5.273 13.600 1.00 14.55 N ATOM 449 CA LYS A 30 22.833 -4.001 13.702 1.00 24.40 C ATOM 450 C LYS A 30 22.574 -3.411 12.320 1.00 71.11 C ATOM 451 O LYS A 30 22.796 -4.068 11.301 1.00 14.52 O ATOM 452 CB LYS A 30 23.640 -3.012 14.547 1.00 33.23 C ATOM 453 CG LYS A 30 22.868 -2.448 15.727 1.00 4.24 C ATOM 454 CD LYS A 30 23.799 -1.900 16.794 1.00 71.40 C ATOM 455 CE LYS A 30 23.451 -0.465 17.155 1.00 11.55 C ATOM 456 NZ LYS A 30 23.961 -0.091 18.502 1.00 44.33 N ATOM 0 H LYS A 30 24.185 -5.336 12.812 1.00 14.55 H new ATOM 0 HA LYS A 30 21.873 -4.185 14.185 1.00 24.40 H new ATOM 0 HB2 LYS A 30 24.537 -3.509 14.915 1.00 33.23 H new ATOM 0 HB3 LYS A 30 23.969 -2.189 13.912 1.00 33.23 H new ATOM 0 HG2 LYS A 30 22.203 -1.656 15.382 1.00 4.24 H new ATOM 0 HG3 LYS A 30 22.239 -3.228 16.157 1.00 4.24 H new ATOM 0 HD2 LYS A 30 23.740 -2.525 17.685 1.00 71.40 H new ATOM 0 HD3 LYS A 30 24.828 -1.947 16.439 1.00 71.40 H new ATOM 0 HE2 LYS A 30 23.871 0.209 16.408 1.00 11.55 H new ATOM 0 HE3 LYS A 30 22.369 -0.336 17.128 1.00 11.55 H new ATOM 0 HZ1 LYS A 30 23.703 0.895 18.710 1.00 44.33 H new ATOM 0 HZ2 LYS A 30 23.541 -0.717 19.218 1.00 44.33 H new ATOM 0 HZ3 LYS A 30 24.996 -0.189 18.521 1.00 44.33 H new ATOM 470 N LEU A 31 22.104 -2.168 12.290 1.00 41.12 N ATOM 471 CA LEU A 31 21.815 -1.488 11.032 1.00 63.55 C ATOM 472 C LEU A 31 23.105 -1.080 10.326 1.00 72.01 C ATOM 473 O LEU A 31 23.167 -1.040 9.097 1.00 32.13 O ATOM 474 CB LEU A 31 20.946 -0.256 11.284 1.00 22.12 C ATOM 475 CG LEU A 31 19.434 -0.479 11.227 1.00 35.15 C ATOM 476 CD1 LEU A 31 18.726 0.398 12.249 1.00 73.32 C ATOM 477 CD2 LEU A 31 18.907 -0.200 9.827 1.00 3.55 C ATOM 0 H LEU A 31 21.915 -1.611 13.123 1.00 41.12 H new ATOM 0 HA LEU A 31 21.273 -2.181 10.388 1.00 63.55 H new ATOM 0 HB2 LEU A 31 21.197 0.147 12.265 1.00 22.12 H new ATOM 0 HB3 LEU A 31 21.209 0.506 10.550 1.00 22.12 H new ATOM 0 HG LEU A 31 19.230 -1.522 11.470 1.00 35.15 H new ATOM 0 HD11 LEU A 31 17.651 0.226 12.194 1.00 73.32 H new ATOM 0 HD12 LEU A 31 19.082 0.151 13.249 1.00 73.32 H new ATOM 0 HD13 LEU A 31 18.937 1.446 12.037 1.00 73.32 H new ATOM 0 HD21 LEU A 31 17.830 -0.364 9.804 1.00 3.55 H new ATOM 0 HD22 LEU A 31 19.123 0.834 9.556 1.00 3.55 H new ATOM 0 HD23 LEU A 31 19.391 -0.870 9.116 1.00 3.55 H new ATOM 489 N LYS A 32 24.134 -0.779 11.112 1.00 25.13 N ATOM 490 CA LYS A 32 25.424 -0.377 10.562 1.00 43.54 C ATOM 491 C LYS A 32 25.908 -1.380 9.520 1.00 52.24 C ATOM 492 O LYS A 32 26.513 -1.003 8.517 1.00 72.41 O ATOM 493 CB LYS A 32 26.459 -0.248 11.682 1.00 65.20 C ATOM 494 CG LYS A 32 26.725 1.187 12.103 1.00 24.42 C ATOM 495 CD LYS A 32 27.631 1.899 11.112 1.00 1.21 C ATOM 496 CE LYS A 32 27.721 3.388 11.410 1.00 43.55 C ATOM 497 NZ LYS A 32 28.287 3.650 12.762 1.00 74.31 N ATOM 0 H LYS A 32 24.100 -0.806 12.131 1.00 25.13 H new ATOM 0 HA LYS A 32 25.299 0.591 10.077 1.00 43.54 H new ATOM 0 HB2 LYS A 32 26.117 -0.814 12.548 1.00 65.20 H new ATOM 0 HB3 LYS A 32 27.395 -0.701 11.354 1.00 65.20 H new ATOM 0 HG2 LYS A 32 25.780 1.724 12.185 1.00 24.42 H new ATOM 0 HG3 LYS A 32 27.185 1.198 13.091 1.00 24.42 H new ATOM 0 HD2 LYS A 32 28.628 1.459 11.147 1.00 1.21 H new ATOM 0 HD3 LYS A 32 27.253 1.751 10.100 1.00 1.21 H new ATOM 0 HE2 LYS A 32 28.342 3.872 10.656 1.00 43.55 H new ATOM 0 HE3 LYS A 32 26.729 3.833 11.339 1.00 43.55 H new ATOM 0 HZ1 LYS A 32 28.411 4.674 12.894 1.00 74.31 H new ATOM 0 HZ2 LYS A 32 27.638 3.283 13.487 1.00 74.31 H new ATOM 0 HZ3 LYS A 32 29.208 3.176 12.851 1.00 74.31 H new ATOM 511 N HIS A 33 25.636 -2.658 9.764 1.00 3.52 N ATOM 512 CA HIS A 33 26.042 -3.715 8.845 1.00 62.24 C ATOM 513 C HIS A 33 25.142 -3.739 7.613 1.00 43.23 C ATOM 514 O HIS A 33 25.674 -3.976 6.528 1.00 50.11 O ATOM 515 CB HIS A 33 26.002 -5.074 9.546 1.00 42.31 C ATOM 516 CG HIS A 33 26.631 -5.065 10.905 1.00 52.52 C ATOM 517 ND1 HIS A 33 26.005 -5.562 12.028 1.00 14.14 N ATOM 518 CD2 HIS A 33 27.840 -4.616 11.318 1.00 22.00 C ATOM 519 CE1 HIS A 33 26.800 -5.418 13.074 1.00 20.12 C ATOM 520 NE2 HIS A 33 27.920 -4.847 12.669 1.00 73.23 N ATOM 0 H HIS A 33 25.136 -2.987 10.590 1.00 3.52 H new ATOM 0 HA HIS A 33 27.063 -3.510 8.524 1.00 62.24 H new ATOM 0 HB2 HIS A 33 24.965 -5.396 9.637 1.00 42.31 H new ATOM 0 HB3 HIS A 33 26.511 -5.810 8.924 1.00 42.31 H new ATOM 0 HD2 HIS A 33 28.600 -4.161 10.700 1.00 22.00 H new ATOM 0 HE1 HIS A 33 26.573 -5.716 14.087 1.00 20.12 H new ATOM 0 HE2 HIS A 33 28.716 -4.615 13.264 1.00 73.23 H new ATOM 528 N ILE A 34 23.840 -3.509 7.746 1.00 0.54 N ATOM 529 CA ILE A 34 22.941 -3.520 6.598 1.00 20.02 C ATOM 530 C ILE A 34 23.302 -2.419 5.607 1.00 22.22 C ATOM 531 O ILE A 34 23.261 -2.623 4.393 1.00 4.51 O ATOM 532 CB ILE A 34 21.473 -3.345 7.030 1.00 71.35 C ATOM 533 CG1 ILE A 34 21.101 -4.391 8.084 1.00 54.11 C ATOM 534 CG2 ILE A 34 20.550 -3.449 5.826 1.00 33.30 C ATOM 535 CD1 ILE A 34 19.730 -4.180 8.687 1.00 13.03 C ATOM 0 H ILE A 34 23.384 -3.313 8.637 1.00 0.54 H new ATOM 0 HA ILE A 34 23.056 -4.491 6.117 1.00 20.02 H new ATOM 0 HB ILE A 34 21.355 -2.354 7.469 1.00 71.35 H new ATOM 0 HG12 ILE A 34 21.141 -5.382 7.631 1.00 54.11 H new ATOM 0 HG13 ILE A 34 21.846 -4.374 8.880 1.00 54.11 H new ATOM 0 HG21 ILE A 34 19.516 -3.323 6.148 1.00 33.30 H new ATOM 0 HG22 ILE A 34 20.803 -2.671 5.105 1.00 33.30 H new ATOM 0 HG23 ILE A 34 20.668 -4.427 5.360 1.00 33.30 H new ATOM 0 HD11 ILE A 34 19.534 -4.958 9.425 1.00 13.03 H new ATOM 0 HD12 ILE A 34 19.691 -3.203 9.169 1.00 13.03 H new ATOM 0 HD13 ILE A 34 18.976 -4.227 7.901 1.00 13.03 H new ATOM 547 N VAL A 35 23.658 -1.251 6.131 1.00 40.52 N ATOM 548 CA VAL A 35 24.029 -0.117 5.294 1.00 61.21 C ATOM 549 C VAL A 35 25.454 -0.263 4.773 1.00 32.43 C ATOM 550 O VAL A 35 25.749 0.096 3.632 1.00 50.42 O ATOM 551 CB VAL A 35 23.908 1.212 6.061 1.00 15.43 C ATOM 552 CG1 VAL A 35 24.335 2.378 5.182 1.00 1.24 C ATOM 553 CG2 VAL A 35 22.487 1.408 6.567 1.00 30.14 C ATOM 0 H VAL A 35 23.697 -1.065 7.133 1.00 40.52 H new ATOM 0 HA VAL A 35 23.336 -0.105 4.453 1.00 61.21 H new ATOM 0 HB VAL A 35 24.574 1.175 6.923 1.00 15.43 H new ATOM 0 HG11 VAL A 35 24.242 3.309 5.742 1.00 1.24 H new ATOM 0 HG12 VAL A 35 25.372 2.241 4.874 1.00 1.24 H new ATOM 0 HG13 VAL A 35 23.697 2.421 4.299 1.00 1.24 H new ATOM 0 HG21 VAL A 35 22.420 2.353 7.107 1.00 30.14 H new ATOM 0 HG22 VAL A 35 21.799 1.423 5.722 1.00 30.14 H new ATOM 0 HG23 VAL A 35 22.223 0.589 7.235 1.00 30.14 H new ATOM 563 N TRP A 36 26.334 -0.792 5.615 1.00 21.43 N ATOM 564 CA TRP A 36 27.731 -0.986 5.238 1.00 51.20 C ATOM 565 C TRP A 36 27.841 -1.811 3.962 1.00 35.22 C ATOM 566 O TRP A 36 28.750 -1.609 3.158 1.00 15.14 O ATOM 567 CB TRP A 36 28.495 -1.672 6.372 1.00 21.12 C ATOM 568 CG TRP A 36 29.892 -2.062 5.995 1.00 75.11 C ATOM 569 CD1 TRP A 36 31.041 -1.390 6.301 1.00 53.41 C ATOM 570 CD2 TRP A 36 30.287 -3.212 5.240 1.00 51.11 C ATOM 571 NE1 TRP A 36 32.126 -2.053 5.783 1.00 62.11 N ATOM 572 CE2 TRP A 36 31.690 -3.175 5.128 1.00 31.40 C ATOM 573 CE3 TRP A 36 29.592 -4.272 4.651 1.00 74.11 C ATOM 574 CZ2 TRP A 36 32.409 -4.156 4.449 1.00 73.10 C ATOM 575 CZ3 TRP A 36 30.306 -5.244 3.977 1.00 52.12 C ATOM 576 CH2 TRP A 36 31.703 -5.181 3.881 1.00 3.33 C ATOM 0 H TRP A 36 26.106 -1.094 6.562 1.00 21.43 H new ATOM 0 HA TRP A 36 28.171 -0.006 5.053 1.00 51.20 H new ATOM 0 HB2 TRP A 36 28.531 -1.004 7.232 1.00 21.12 H new ATOM 0 HB3 TRP A 36 27.948 -2.562 6.683 1.00 21.12 H new ATOM 0 HD1 TRP A 36 31.089 -0.472 6.867 1.00 53.41 H new ATOM 0 HE1 TRP A 36 33.099 -1.758 5.871 1.00 62.11 H new ATOM 0 HE3 TRP A 36 28.516 -4.330 4.721 1.00 74.11 H new ATOM 0 HZ2 TRP A 36 33.485 -4.109 4.374 1.00 73.10 H new ATOM 0 HZ3 TRP A 36 29.779 -6.066 3.516 1.00 52.12 H new ATOM 0 HH2 TRP A 36 32.232 -5.957 3.348 1.00 3.33 H new ATOM 587 N ALA A 37 26.909 -2.742 3.781 1.00 14.15 N ATOM 588 CA ALA A 37 26.902 -3.595 2.600 1.00 4.55 C ATOM 589 C ALA A 37 26.286 -2.874 1.405 1.00 61.53 C ATOM 590 O ALA A 37 26.658 -3.125 0.258 1.00 0.30 O ATOM 591 CB ALA A 37 26.146 -4.885 2.886 1.00 33.21 C ATOM 0 H ALA A 37 26.150 -2.924 4.437 1.00 14.15 H new ATOM 0 HA ALA A 37 27.935 -3.838 2.352 1.00 4.55 H new ATOM 0 HB1 ALA A 37 26.148 -5.513 1.995 1.00 33.21 H new ATOM 0 HB2 ALA A 37 26.630 -5.416 3.706 1.00 33.21 H new ATOM 0 HB3 ALA A 37 25.118 -4.651 3.162 1.00 33.21 H new ATOM 597 N SER A 38 25.344 -1.979 1.680 1.00 40.51 N ATOM 598 CA SER A 38 24.674 -1.225 0.628 1.00 11.22 C ATOM 599 C SER A 38 25.649 -0.278 -0.066 1.00 24.23 C ATOM 600 O SER A 38 25.597 -0.098 -1.282 1.00 25.04 O ATOM 601 CB SER A 38 23.500 -0.432 1.207 1.00 24.53 C ATOM 602 OG SER A 38 23.330 0.798 0.524 1.00 51.32 O ATOM 0 H SER A 38 25.027 -1.758 2.624 1.00 40.51 H new ATOM 0 HA SER A 38 24.296 -1.934 -0.108 1.00 11.22 H new ATOM 0 HB2 SER A 38 22.587 -1.022 1.133 1.00 24.53 H new ATOM 0 HB3 SER A 38 23.672 -0.243 2.267 1.00 24.53 H new ATOM 0 HG SER A 38 22.573 1.285 0.911 1.00 51.32 H new ATOM 608 N ARG A 39 26.537 0.326 0.718 1.00 24.31 N ATOM 609 CA ARG A 39 27.523 1.255 0.180 1.00 64.14 C ATOM 610 C ARG A 39 28.581 0.515 -0.634 1.00 50.12 C ATOM 611 O ARG A 39 28.988 0.972 -1.701 1.00 41.22 O ATOM 612 CB ARG A 39 28.190 2.035 1.314 1.00 54.01 C ATOM 613 CG ARG A 39 29.312 2.949 0.847 1.00 11.24 C ATOM 614 CD ARG A 39 28.780 4.095 -0.001 1.00 52.41 C ATOM 615 NE ARG A 39 28.157 5.135 0.814 1.00 75.23 N ATOM 616 CZ ARG A 39 27.883 6.355 0.366 1.00 4.20 C ATOM 617 NH1 ARG A 39 28.173 6.686 -0.885 1.00 25.02 N ATOM 618 NH2 ARG A 39 27.314 7.246 1.168 1.00 71.43 N ATOM 0 H ARG A 39 26.593 0.188 1.727 1.00 24.31 H new ATOM 0 HA ARG A 39 27.006 1.953 -0.478 1.00 64.14 H new ATOM 0 HB2 ARG A 39 27.435 2.632 1.826 1.00 54.01 H new ATOM 0 HB3 ARG A 39 28.587 1.330 2.044 1.00 54.01 H new ATOM 0 HG2 ARG A 39 29.840 3.350 1.712 1.00 11.24 H new ATOM 0 HG3 ARG A 39 30.036 2.373 0.270 1.00 11.24 H new ATOM 0 HD2 ARG A 39 29.597 4.528 -0.579 1.00 52.41 H new ATOM 0 HD3 ARG A 39 28.053 3.710 -0.716 1.00 52.41 H new ATOM 0 HE ARG A 39 27.919 4.912 1.781 1.00 75.23 H new ATOM 0 HH11 ARG A 39 28.607 6.003 -1.506 1.00 25.02 H new ATOM 0 HH12 ARG A 39 27.962 7.624 -1.227 1.00 25.02 H new ATOM 0 HH21 ARG A 39 27.086 6.994 2.130 1.00 71.43 H new ATOM 0 HH22 ARG A 39 27.104 8.183 0.823 1.00 71.43 H new ATOM 632 N GLU A 40 29.022 -0.629 -0.120 1.00 41.22 N ATOM 633 CA GLU A 40 30.033 -1.431 -0.799 1.00 41.53 C ATOM 634 C GLU A 40 29.436 -2.154 -2.003 1.00 34.23 C ATOM 635 O GLU A 40 30.142 -2.474 -2.962 1.00 1.51 O ATOM 636 CB GLU A 40 30.644 -2.447 0.169 1.00 23.15 C ATOM 637 CG GLU A 40 32.139 -2.641 -0.016 1.00 24.43 C ATOM 638 CD GLU A 40 32.959 -1.607 0.732 1.00 4.23 C ATOM 639 OE1 GLU A 40 32.610 -1.299 1.891 1.00 3.23 O ATOM 640 OE2 GLU A 40 33.949 -1.108 0.158 1.00 14.55 O ATOM 0 H GLU A 40 28.695 -1.021 0.763 1.00 41.22 H new ATOM 0 HA GLU A 40 30.816 -0.760 -1.152 1.00 41.53 H new ATOM 0 HB2 GLU A 40 30.452 -2.123 1.192 1.00 23.15 H new ATOM 0 HB3 GLU A 40 30.143 -3.406 0.040 1.00 23.15 H new ATOM 0 HG2 GLU A 40 32.417 -3.637 0.327 1.00 24.43 H new ATOM 0 HG3 GLU A 40 32.379 -2.591 -1.078 1.00 24.43 H new ATOM 647 N LEU A 41 28.134 -2.408 -1.947 1.00 34.44 N ATOM 648 CA LEU A 41 27.441 -3.092 -3.033 1.00 65.33 C ATOM 649 C LEU A 41 27.392 -2.221 -4.284 1.00 1.42 C ATOM 650 O LEU A 41 27.806 -2.643 -5.363 1.00 4.42 O ATOM 651 CB LEU A 41 26.021 -3.467 -2.603 1.00 61.14 C ATOM 652 CG LEU A 41 25.840 -4.880 -2.048 1.00 24.01 C ATOM 653 CD1 LEU A 41 24.400 -5.100 -1.610 1.00 22.11 C ATOM 654 CD2 LEU A 41 26.248 -5.917 -3.084 1.00 33.23 C ATOM 0 H LEU A 41 27.537 -2.151 -1.161 1.00 34.44 H new ATOM 0 HA LEU A 41 27.995 -4.001 -3.268 1.00 65.33 H new ATOM 0 HB2 LEU A 41 25.692 -2.756 -1.845 1.00 61.14 H new ATOM 0 HB3 LEU A 41 25.359 -3.347 -3.461 1.00 61.14 H new ATOM 0 HG LEU A 41 26.485 -4.993 -1.177 1.00 24.01 H new ATOM 0 HD11 LEU A 41 24.289 -6.111 -1.218 1.00 22.11 H new ATOM 0 HD12 LEU A 41 24.142 -4.379 -0.834 1.00 22.11 H new ATOM 0 HD13 LEU A 41 23.736 -4.968 -2.464 1.00 22.11 H new ATOM 0 HD21 LEU A 41 26.112 -6.917 -2.671 1.00 33.23 H new ATOM 0 HD22 LEU A 41 25.629 -5.805 -3.974 1.00 33.23 H new ATOM 0 HD23 LEU A 41 27.295 -5.773 -3.350 1.00 33.23 H new ATOM 666 N GLU A 42 26.884 -1.002 -4.130 1.00 34.12 N ATOM 667 CA GLU A 42 26.783 -0.070 -5.247 1.00 4.30 C ATOM 668 C GLU A 42 28.140 0.126 -5.918 1.00 5.21 C ATOM 669 O GLU A 42 28.217 0.439 -7.105 1.00 23.34 O ATOM 670 CB GLU A 42 26.239 1.278 -4.769 1.00 62.14 C ATOM 671 CG GLU A 42 24.828 1.570 -5.248 1.00 42.22 C ATOM 672 CD GLU A 42 24.752 2.806 -6.122 1.00 12.14 C ATOM 673 OE1 GLU A 42 25.399 3.817 -5.777 1.00 74.32 O ATOM 674 OE2 GLU A 42 24.046 2.765 -7.151 1.00 45.43 O ATOM 0 H GLU A 42 26.536 -0.637 -3.243 1.00 34.12 H new ATOM 0 HA GLU A 42 26.094 -0.493 -5.978 1.00 4.30 H new ATOM 0 HB2 GLU A 42 26.256 1.301 -3.679 1.00 62.14 H new ATOM 0 HB3 GLU A 42 26.902 2.071 -5.115 1.00 62.14 H new ATOM 0 HG2 GLU A 42 24.453 0.712 -5.806 1.00 42.22 H new ATOM 0 HG3 GLU A 42 24.175 1.699 -4.385 1.00 42.22 H new ATOM 681 N ARG A 43 29.206 -0.062 -5.147 1.00 11.20 N ATOM 682 CA ARG A 43 30.560 0.095 -5.665 1.00 60.20 C ATOM 683 C ARG A 43 30.891 -1.011 -6.664 1.00 71.11 C ATOM 684 O ARG A 43 31.690 -0.814 -7.580 1.00 42.12 O ATOM 685 CB ARG A 43 31.573 0.081 -4.519 1.00 12.44 C ATOM 686 CG ARG A 43 32.659 1.136 -4.653 1.00 10.03 C ATOM 687 CD ARG A 43 33.769 0.925 -3.635 1.00 11.44 C ATOM 688 NE ARG A 43 35.093 1.000 -4.245 1.00 14.22 N ATOM 689 CZ ARG A 43 35.581 0.071 -5.059 1.00 22.22 C ATOM 690 NH1 ARG A 43 34.857 -0.999 -5.359 1.00 54.25 N ATOM 691 NH2 ARG A 43 36.795 0.211 -5.575 1.00 61.33 N ATOM 0 H ARG A 43 29.158 -0.323 -4.162 1.00 11.20 H new ATOM 0 HA ARG A 43 30.616 1.055 -6.179 1.00 60.20 H new ATOM 0 HB2 ARG A 43 31.046 0.232 -3.577 1.00 12.44 H new ATOM 0 HB3 ARG A 43 32.039 -0.903 -4.469 1.00 12.44 H new ATOM 0 HG2 ARG A 43 33.076 1.105 -5.660 1.00 10.03 H new ATOM 0 HG3 ARG A 43 32.224 2.126 -4.519 1.00 10.03 H new ATOM 0 HD2 ARG A 43 33.689 1.677 -2.850 1.00 11.44 H new ATOM 0 HD3 ARG A 43 33.644 -0.047 -3.159 1.00 11.44 H new ATOM 0 HE ARG A 43 35.675 1.810 -4.035 1.00 14.22 H new ATOM 0 HH11 ARG A 43 33.923 -1.110 -4.964 1.00 54.25 H new ATOM 0 HH12 ARG A 43 35.234 -1.711 -5.984 1.00 54.25 H new ATOM 0 HH21 ARG A 43 37.355 1.033 -5.347 1.00 61.33 H new ATOM 0 HH22 ARG A 43 37.169 -0.503 -6.200 1.00 61.33 H new ATOM 705 N PHE A 44 30.273 -2.173 -6.479 1.00 73.14 N ATOM 706 CA PHE A 44 30.504 -3.310 -7.362 1.00 21.13 C ATOM 707 C PHE A 44 29.432 -3.383 -8.446 1.00 23.20 C ATOM 708 O PHE A 44 29.128 -4.458 -8.961 1.00 10.21 O ATOM 709 CB PHE A 44 30.522 -4.611 -6.558 1.00 64.10 C ATOM 710 CG PHE A 44 31.642 -4.684 -5.560 1.00 15.12 C ATOM 711 CD1 PHE A 44 32.954 -4.481 -5.955 1.00 44.05 C ATOM 712 CD2 PHE A 44 31.382 -4.953 -4.225 1.00 5.34 C ATOM 713 CE1 PHE A 44 33.986 -4.549 -5.038 1.00 0.00 C ATOM 714 CE2 PHE A 44 32.410 -5.021 -3.305 1.00 41.42 C ATOM 715 CZ PHE A 44 33.713 -4.818 -3.711 1.00 20.40 C ATOM 0 H PHE A 44 29.609 -2.352 -5.726 1.00 73.14 H new ATOM 0 HA PHE A 44 31.473 -3.175 -7.843 1.00 21.13 H new ATOM 0 HB2 PHE A 44 29.572 -4.718 -6.034 1.00 64.10 H new ATOM 0 HB3 PHE A 44 30.604 -5.453 -7.246 1.00 64.10 H new ATOM 0 HD1 PHE A 44 33.173 -4.267 -6.991 1.00 44.05 H new ATOM 0 HD2 PHE A 44 30.364 -5.111 -3.901 1.00 5.34 H new ATOM 0 HE1 PHE A 44 35.005 -4.392 -5.359 1.00 0.00 H new ATOM 0 HE2 PHE A 44 32.194 -5.233 -2.268 1.00 41.42 H new ATOM 0 HZ PHE A 44 34.518 -4.869 -2.993 1.00 20.40 H new ATOM 725 N ALA A 45 28.864 -2.231 -8.786 1.00 55.02 N ATOM 726 CA ALA A 45 27.827 -2.163 -9.808 1.00 34.32 C ATOM 727 C ALA A 45 26.583 -2.934 -9.381 1.00 33.35 C ATOM 728 O ALA A 45 25.775 -3.339 -10.216 1.00 24.42 O ATOM 729 CB ALA A 45 28.354 -2.700 -11.131 1.00 74.43 C ATOM 0 H ALA A 45 29.105 -1.332 -8.369 1.00 55.02 H new ATOM 0 HA ALA A 45 27.548 -1.117 -9.937 1.00 34.32 H new ATOM 0 HB1 ALA A 45 27.569 -2.643 -11.885 1.00 74.43 H new ATOM 0 HB2 ALA A 45 29.209 -2.104 -11.451 1.00 74.43 H new ATOM 0 HB3 ALA A 45 28.662 -3.738 -11.005 1.00 74.43 H new ATOM 735 N VAL A 46 26.435 -3.133 -8.075 1.00 63.23 N ATOM 736 CA VAL A 46 25.289 -3.855 -7.537 1.00 63.53 C ATOM 737 C VAL A 46 24.458 -2.964 -6.621 1.00 71.51 C ATOM 738 O VAL A 46 24.923 -2.539 -5.564 1.00 11.54 O ATOM 739 CB VAL A 46 25.731 -5.107 -6.755 1.00 14.15 C ATOM 740 CG1 VAL A 46 24.525 -5.822 -6.166 1.00 30.42 C ATOM 741 CG2 VAL A 46 26.530 -6.041 -7.651 1.00 50.31 C ATOM 0 H VAL A 46 27.095 -2.804 -7.370 1.00 63.23 H new ATOM 0 HA VAL A 46 24.681 -4.163 -8.388 1.00 63.53 H new ATOM 0 HB VAL A 46 26.374 -4.792 -5.933 1.00 14.15 H new ATOM 0 HG11 VAL A 46 24.857 -6.704 -5.617 1.00 30.42 H new ATOM 0 HG12 VAL A 46 23.999 -5.150 -5.488 1.00 30.42 H new ATOM 0 HG13 VAL A 46 23.854 -6.126 -6.969 1.00 30.42 H new ATOM 0 HG21 VAL A 46 26.834 -6.920 -7.082 1.00 50.31 H new ATOM 0 HG22 VAL A 46 25.914 -6.351 -8.495 1.00 50.31 H new ATOM 0 HG23 VAL A 46 27.416 -5.523 -8.019 1.00 50.31 H new ATOM 751 N ASN A 47 23.227 -2.685 -7.035 1.00 52.21 N ATOM 752 CA ASN A 47 22.330 -1.843 -6.251 1.00 1.45 C ATOM 753 C ASN A 47 22.016 -2.489 -4.905 1.00 2.41 C ATOM 754 O ASN A 47 21.897 -3.708 -4.786 1.00 62.25 O ATOM 755 CB ASN A 47 21.034 -1.587 -7.021 1.00 4.25 C ATOM 756 CG ASN A 47 20.940 -0.166 -7.540 1.00 35.24 C ATOM 757 OD1 ASN A 47 20.242 0.671 -6.968 1.00 73.10 O ATOM 758 ND2 ASN A 47 21.645 0.113 -8.631 1.00 53.44 N ATOM 0 H ASN A 47 22.827 -3.029 -7.908 1.00 52.21 H new ATOM 0 HA ASN A 47 22.831 -0.892 -6.070 1.00 1.45 H new ATOM 0 HB2 ASN A 47 20.969 -2.282 -7.859 1.00 4.25 H new ATOM 0 HB3 ASN A 47 20.183 -1.791 -6.371 1.00 4.25 H new ATOM 0 HD21 ASN A 47 21.621 1.053 -9.027 1.00 53.44 H new ATOM 0 HD22 ASN A 47 22.210 -0.612 -9.072 1.00 53.44 H new ATOM 765 N PRO A 48 21.876 -1.652 -3.865 1.00 60.22 N ATOM 766 CA PRO A 48 21.572 -2.118 -2.509 1.00 21.12 C ATOM 767 C PRO A 48 20.153 -2.663 -2.387 1.00 22.32 C ATOM 768 O PRO A 48 19.805 -3.297 -1.393 1.00 1.41 O ATOM 769 CB PRO A 48 21.737 -0.859 -1.655 1.00 32.54 C ATOM 770 CG PRO A 48 21.492 0.270 -2.597 1.00 54.31 C ATOM 771 CD PRO A 48 22.004 -0.187 -3.934 1.00 1.34 C ATOM 0 HA PRO A 48 22.219 -2.942 -2.207 1.00 21.12 H new ATOM 0 HB2 PRO A 48 21.028 -0.846 -0.827 1.00 32.54 H new ATOM 0 HB3 PRO A 48 22.735 -0.803 -1.220 1.00 32.54 H new ATOM 0 HG2 PRO A 48 20.430 0.512 -2.648 1.00 54.31 H new ATOM 0 HG3 PRO A 48 22.009 1.171 -2.269 1.00 54.31 H new ATOM 0 HD2 PRO A 48 21.417 0.230 -4.753 1.00 1.34 H new ATOM 0 HD3 PRO A 48 23.038 0.119 -4.095 1.00 1.34 H new ATOM 779 N GLY A 49 19.338 -2.410 -3.408 1.00 51.35 N ATOM 780 CA GLY A 49 17.965 -2.883 -3.394 1.00 34.32 C ATOM 781 C GLY A 49 17.872 -4.395 -3.444 1.00 34.51 C ATOM 782 O GLY A 49 16.800 -4.966 -3.237 1.00 53.34 O ATOM 0 H GLY A 49 19.603 -1.887 -4.243 1.00 51.35 H new ATOM 0 HA2 GLY A 49 17.469 -2.521 -2.494 1.00 34.32 H new ATOM 0 HA3 GLY A 49 17.430 -2.461 -4.245 1.00 34.32 H new ATOM 786 N LEU A 50 18.997 -5.046 -3.721 1.00 32.24 N ATOM 787 CA LEU A 50 19.038 -6.502 -3.799 1.00 2.31 C ATOM 788 C LEU A 50 19.044 -7.122 -2.406 1.00 44.44 C ATOM 789 O LEU A 50 18.663 -8.281 -2.228 1.00 35.23 O ATOM 790 CB LEU A 50 20.273 -6.956 -4.578 1.00 62.22 C ATOM 791 CG LEU A 50 20.410 -6.409 -5.999 1.00 11.33 C ATOM 792 CD1 LEU A 50 21.610 -7.029 -6.697 1.00 61.11 C ATOM 793 CD2 LEU A 50 19.137 -6.666 -6.794 1.00 51.10 C ATOM 0 H LEU A 50 19.892 -4.589 -3.895 1.00 32.24 H new ATOM 0 HA LEU A 50 18.143 -6.839 -4.322 1.00 2.31 H new ATOM 0 HB2 LEU A 50 21.160 -6.669 -4.013 1.00 62.22 H new ATOM 0 HB3 LEU A 50 20.266 -8.045 -4.629 1.00 62.22 H new ATOM 0 HG LEU A 50 20.567 -5.332 -5.939 1.00 11.33 H new ATOM 0 HD11 LEU A 50 21.691 -6.627 -7.707 1.00 61.11 H new ATOM 0 HD12 LEU A 50 22.517 -6.794 -6.139 1.00 61.11 H new ATOM 0 HD13 LEU A 50 21.484 -8.111 -6.746 1.00 61.11 H new ATOM 0 HD21 LEU A 50 19.252 -6.270 -7.803 1.00 51.10 H new ATOM 0 HD22 LEU A 50 18.950 -7.739 -6.844 1.00 51.10 H new ATOM 0 HD23 LEU A 50 18.297 -6.173 -6.305 1.00 51.10 H new ATOM 805 N LEU A 51 19.477 -6.345 -1.420 1.00 55.24 N ATOM 806 CA LEU A 51 19.530 -6.817 -0.041 1.00 73.54 C ATOM 807 C LEU A 51 18.150 -6.767 0.606 1.00 74.13 C ATOM 808 O LEU A 51 17.896 -7.447 1.600 1.00 2.15 O ATOM 809 CB LEU A 51 20.517 -5.974 0.769 1.00 55.34 C ATOM 810 CG LEU A 51 21.964 -5.971 0.273 1.00 43.34 C ATOM 811 CD1 LEU A 51 22.839 -5.125 1.183 1.00 53.45 C ATOM 812 CD2 LEU A 51 22.500 -7.393 0.185 1.00 43.10 C ATOM 0 H LEU A 51 19.797 -5.385 -1.550 1.00 55.24 H new ATOM 0 HA LEU A 51 19.868 -7.853 -0.050 1.00 73.54 H new ATOM 0 HB2 LEU A 51 20.157 -4.945 0.785 1.00 55.34 H new ATOM 0 HB3 LEU A 51 20.508 -6.330 1.799 1.00 55.34 H new ATOM 0 HG LEU A 51 21.985 -5.533 -0.725 1.00 43.34 H new ATOM 0 HD11 LEU A 51 23.865 -5.135 0.814 1.00 53.45 H new ATOM 0 HD12 LEU A 51 22.468 -4.100 1.195 1.00 53.45 H new ATOM 0 HD13 LEU A 51 22.813 -5.532 2.194 1.00 53.45 H new ATOM 0 HD21 LEU A 51 23.531 -7.372 -0.170 1.00 43.10 H new ATOM 0 HD22 LEU A 51 22.465 -7.857 1.171 1.00 43.10 H new ATOM 0 HD23 LEU A 51 21.889 -7.970 -0.509 1.00 43.10 H new ATOM 824 N GLU A 52 17.264 -5.958 0.036 1.00 32.33 N ATOM 825 CA GLU A 52 15.909 -5.821 0.556 1.00 55.42 C ATOM 826 C GLU A 52 14.946 -6.745 -0.182 1.00 21.21 C ATOM 827 O GLU A 52 13.737 -6.510 -0.210 1.00 34.43 O ATOM 828 CB GLU A 52 15.436 -4.371 0.434 1.00 40.53 C ATOM 829 CG GLU A 52 15.294 -3.895 -1.002 1.00 61.23 C ATOM 830 CD GLU A 52 14.452 -2.640 -1.121 1.00 73.14 C ATOM 831 OE1 GLU A 52 13.488 -2.496 -0.341 1.00 2.12 O ATOM 832 OE2 GLU A 52 14.758 -1.802 -1.994 1.00 72.23 O ATOM 0 H GLU A 52 17.460 -5.387 -0.786 1.00 32.33 H new ATOM 0 HA GLU A 52 15.922 -6.104 1.608 1.00 55.42 H new ATOM 0 HB2 GLU A 52 14.475 -4.268 0.939 1.00 40.53 H new ATOM 0 HB3 GLU A 52 16.141 -3.723 0.955 1.00 40.53 H new ATOM 0 HG2 GLU A 52 16.284 -3.704 -1.417 1.00 61.23 H new ATOM 0 HG3 GLU A 52 14.845 -4.687 -1.601 1.00 61.23 H new ATOM 839 N THR A 53 15.490 -7.800 -0.782 1.00 11.12 N ATOM 840 CA THR A 53 14.680 -8.760 -1.523 1.00 71.31 C ATOM 841 C THR A 53 15.207 -10.179 -1.342 1.00 34.21 C ATOM 842 O THR A 53 16.343 -10.480 -1.709 1.00 40.42 O ATOM 843 CB THR A 53 14.646 -8.424 -3.026 1.00 70.20 C ATOM 844 OG1 THR A 53 14.071 -9.512 -3.758 1.00 0.35 O ATOM 845 CG2 THR A 53 16.047 -8.140 -3.548 1.00 33.33 C ATOM 0 H THR A 53 16.488 -8.011 -0.769 1.00 11.12 H new ATOM 0 HA THR A 53 13.669 -8.697 -1.122 1.00 71.31 H new ATOM 0 HB THR A 53 14.036 -7.531 -3.163 1.00 70.20 H new ATOM 0 HG1 THR A 53 14.052 -9.290 -4.712 1.00 0.35 H new ATOM 0 HG21 THR A 53 15.998 -7.905 -4.611 1.00 33.33 H new ATOM 0 HG22 THR A 53 16.472 -7.293 -3.008 1.00 33.33 H new ATOM 0 HG23 THR A 53 16.676 -9.018 -3.399 1.00 33.33 H new ATOM 853 N SER A 54 14.375 -11.046 -0.776 1.00 51.24 N ATOM 854 CA SER A 54 14.759 -12.434 -0.544 1.00 52.22 C ATOM 855 C SER A 54 15.122 -13.123 -1.856 1.00 42.44 C ATOM 856 O SER A 54 15.829 -14.131 -1.864 1.00 11.43 O ATOM 857 CB SER A 54 13.623 -13.191 0.147 1.00 0.02 C ATOM 858 OG SER A 54 12.893 -13.973 -0.782 1.00 24.41 O ATOM 0 H SER A 54 13.431 -10.813 -0.469 1.00 51.24 H new ATOM 0 HA SER A 54 15.636 -12.440 0.104 1.00 52.22 H new ATOM 0 HB2 SER A 54 14.032 -13.834 0.927 1.00 0.02 H new ATOM 0 HB3 SER A 54 12.954 -12.483 0.636 1.00 0.02 H new ATOM 0 HG SER A 54 12.174 -14.448 -0.316 1.00 24.41 H new ATOM 864 N GLU A 55 14.631 -12.573 -2.962 1.00 71.14 N ATOM 865 CA GLU A 55 14.903 -13.135 -4.279 1.00 4.11 C ATOM 866 C GLU A 55 16.170 -12.533 -4.878 1.00 73.51 C ATOM 867 O GLU A 55 17.087 -13.253 -5.271 1.00 72.14 O ATOM 868 CB GLU A 55 13.717 -12.892 -5.217 1.00 72.34 C ATOM 869 CG GLU A 55 13.521 -13.993 -6.246 1.00 15.34 C ATOM 870 CD GLU A 55 14.098 -13.634 -7.602 1.00 54.45 C ATOM 871 OE1 GLU A 55 15.147 -12.958 -7.639 1.00 31.31 O ATOM 872 OE2 GLU A 55 13.500 -14.030 -8.624 1.00 14.52 O ATOM 0 H GLU A 55 14.043 -11.739 -2.972 1.00 71.14 H new ATOM 0 HA GLU A 55 15.052 -14.208 -4.163 1.00 4.11 H new ATOM 0 HB2 GLU A 55 12.808 -12.795 -4.623 1.00 72.34 H new ATOM 0 HB3 GLU A 55 13.862 -11.944 -5.735 1.00 72.34 H new ATOM 0 HG2 GLU A 55 13.990 -14.909 -5.887 1.00 15.34 H new ATOM 0 HG3 GLU A 55 12.456 -14.201 -6.352 1.00 15.34 H new ATOM 879 N GLY A 56 16.214 -11.205 -4.944 1.00 4.43 N ATOM 880 CA GLY A 56 17.372 -10.527 -5.496 1.00 44.33 C ATOM 881 C GLY A 56 18.644 -10.838 -4.732 1.00 53.22 C ATOM 882 O GLY A 56 19.746 -10.649 -5.247 1.00 60.23 O ATOM 0 H GLY A 56 15.468 -10.587 -4.625 1.00 4.43 H new ATOM 0 HA2 GLY A 56 17.497 -10.819 -6.539 1.00 44.33 H new ATOM 0 HA3 GLY A 56 17.199 -9.451 -5.485 1.00 44.33 H new ATOM 886 N CYS A 57 18.492 -11.313 -3.501 1.00 34.33 N ATOM 887 CA CYS A 57 19.638 -11.647 -2.664 1.00 52.51 C ATOM 888 C CYS A 57 20.351 -12.889 -3.188 1.00 34.21 C ATOM 889 O CYS A 57 21.576 -12.910 -3.307 1.00 55.20 O ATOM 890 CB CYS A 57 19.191 -11.873 -1.218 1.00 23.43 C ATOM 891 SG CYS A 57 19.815 -10.641 -0.051 1.00 71.34 S ATOM 0 H CYS A 57 17.586 -11.475 -3.061 1.00 34.33 H new ATOM 0 HA CYS A 57 20.335 -10.810 -2.695 1.00 52.51 H new ATOM 0 HB2 CYS A 57 18.102 -11.873 -1.182 1.00 23.43 H new ATOM 0 HB3 CYS A 57 19.521 -12.861 -0.897 1.00 23.43 H new ATOM 0 HG CYS A 57 19.381 -10.916 1.143 1.00 71.34 H new ATOM 897 N ARG A 58 19.576 -13.922 -3.500 1.00 70.31 N ATOM 898 CA ARG A 58 20.133 -15.169 -4.010 1.00 70.44 C ATOM 899 C ARG A 58 21.055 -14.907 -5.197 1.00 21.34 C ATOM 900 O ARG A 58 22.097 -15.546 -5.339 1.00 34.32 O ATOM 901 CB ARG A 58 19.012 -16.124 -4.422 1.00 12.24 C ATOM 902 CG ARG A 58 19.139 -17.511 -3.814 1.00 11.42 C ATOM 903 CD ARG A 58 17.880 -18.334 -4.038 1.00 50.45 C ATOM 904 NE ARG A 58 17.603 -18.537 -5.457 1.00 43.25 N ATOM 905 CZ ARG A 58 16.530 -19.174 -5.913 1.00 72.22 C ATOM 906 NH1 ARG A 58 15.637 -19.666 -5.066 1.00 31.01 N ATOM 907 NH2 ARG A 58 16.348 -19.319 -7.220 1.00 60.34 N ATOM 0 H ARG A 58 18.560 -13.920 -3.409 1.00 70.31 H new ATOM 0 HA ARG A 58 20.717 -15.629 -3.213 1.00 70.44 H new ATOM 0 HB2 ARG A 58 18.054 -15.694 -4.129 1.00 12.24 H new ATOM 0 HB3 ARG A 58 19.002 -16.212 -5.508 1.00 12.24 H new ATOM 0 HG2 ARG A 58 19.994 -18.025 -4.253 1.00 11.42 H new ATOM 0 HG3 ARG A 58 19.333 -17.425 -2.745 1.00 11.42 H new ATOM 0 HD2 ARG A 58 17.988 -19.302 -3.548 1.00 50.45 H new ATOM 0 HD3 ARG A 58 17.032 -17.833 -3.571 1.00 50.45 H new ATOM 0 HE ARG A 58 18.270 -18.170 -6.136 1.00 43.25 H new ATOM 0 HH11 ARG A 58 15.773 -19.556 -4.061 1.00 31.01 H new ATOM 0 HH12 ARG A 58 14.814 -20.155 -5.419 1.00 31.01 H new ATOM 0 HH21 ARG A 58 17.032 -18.941 -7.875 1.00 60.34 H new ATOM 0 HH22 ARG A 58 15.524 -19.808 -7.569 1.00 60.34 H new ATOM 921 N GLN A 59 20.661 -13.965 -6.048 1.00 22.44 N ATOM 922 CA GLN A 59 21.452 -13.621 -7.225 1.00 14.50 C ATOM 923 C GLN A 59 22.825 -13.093 -6.823 1.00 30.10 C ATOM 924 O GLN A 59 23.809 -13.288 -7.537 1.00 1.44 O ATOM 925 CB GLN A 59 20.718 -12.577 -8.071 1.00 53.44 C ATOM 926 CG GLN A 59 19.876 -13.179 -9.183 1.00 52.13 C ATOM 927 CD GLN A 59 20.209 -12.600 -10.545 1.00 61.14 C ATOM 928 OE1 GLN A 59 19.638 -11.592 -10.960 1.00 73.02 O ATOM 929 NE2 GLN A 59 21.138 -13.238 -11.247 1.00 25.01 N ATOM 0 H GLN A 59 19.801 -13.427 -5.945 1.00 22.44 H new ATOM 0 HA GLN A 59 21.590 -14.526 -7.816 1.00 14.50 H new ATOM 0 HB2 GLN A 59 20.076 -11.982 -7.422 1.00 53.44 H new ATOM 0 HB3 GLN A 59 21.449 -11.896 -8.508 1.00 53.44 H new ATOM 0 HG2 GLN A 59 20.027 -14.258 -9.204 1.00 52.13 H new ATOM 0 HG3 GLN A 59 18.821 -13.009 -8.968 1.00 52.13 H new ATOM 0 HE21 GLN A 59 21.585 -14.070 -10.863 1.00 25.01 H new ATOM 0 HE22 GLN A 59 21.404 -12.896 -12.170 1.00 25.01 H new ATOM 938 N ILE A 60 22.883 -12.424 -5.676 1.00 44.04 N ATOM 939 CA ILE A 60 24.136 -11.869 -5.179 1.00 62.41 C ATOM 940 C ILE A 60 25.077 -12.973 -4.706 1.00 35.10 C ATOM 941 O ILE A 60 26.184 -13.123 -5.222 1.00 25.52 O ATOM 942 CB ILE A 60 23.895 -10.883 -4.021 1.00 72.31 C ATOM 943 CG1 ILE A 60 22.872 -9.822 -4.429 1.00 20.33 C ATOM 944 CG2 ILE A 60 25.203 -10.231 -3.600 1.00 71.12 C ATOM 945 CD1 ILE A 60 22.446 -8.922 -3.291 1.00 34.32 C ATOM 0 H ILE A 60 22.077 -12.253 -5.074 1.00 44.04 H new ATOM 0 HA ILE A 60 24.596 -11.334 -6.010 1.00 62.41 H new ATOM 0 HB ILE A 60 23.497 -11.436 -3.170 1.00 72.31 H new ATOM 0 HG12 ILE A 60 23.294 -9.210 -5.226 1.00 20.33 H new ATOM 0 HG13 ILE A 60 21.992 -10.317 -4.839 1.00 20.33 H new ATOM 0 HG21 ILE A 60 25.016 -9.537 -2.781 1.00 71.12 H new ATOM 0 HG22 ILE A 60 25.903 -10.999 -3.272 1.00 71.12 H new ATOM 0 HG23 ILE A 60 25.628 -9.689 -4.445 1.00 71.12 H new ATOM 0 HD11 ILE A 60 21.720 -8.195 -3.654 1.00 34.32 H new ATOM 0 HD12 ILE A 60 21.994 -9.523 -2.502 1.00 34.32 H new ATOM 0 HD13 ILE A 60 23.317 -8.399 -2.895 1.00 34.32 H new ATOM 957 N LEU A 61 24.628 -13.742 -3.721 1.00 1.02 N ATOM 958 CA LEU A 61 25.428 -14.834 -3.178 1.00 61.50 C ATOM 959 C LEU A 61 25.882 -15.780 -4.286 1.00 60.33 C ATOM 960 O LEU A 61 26.922 -16.428 -4.175 1.00 43.22 O ATOM 961 CB LEU A 61 24.627 -15.608 -2.129 1.00 53.44 C ATOM 962 CG LEU A 61 24.058 -14.780 -0.976 1.00 4.40 C ATOM 963 CD1 LEU A 61 22.801 -15.433 -0.420 1.00 35.31 C ATOM 964 CD2 LEU A 61 25.099 -14.606 0.120 1.00 52.22 C ATOM 0 H LEU A 61 23.714 -13.630 -3.282 1.00 1.02 H new ATOM 0 HA LEU A 61 26.312 -14.404 -2.707 1.00 61.50 H new ATOM 0 HB2 LEU A 61 23.801 -16.112 -2.630 1.00 53.44 H new ATOM 0 HB3 LEU A 61 25.268 -16.384 -1.711 1.00 53.44 H new ATOM 0 HG LEU A 61 23.793 -13.794 -1.358 1.00 4.40 H new ATOM 0 HD11 LEU A 61 22.410 -14.830 0.400 1.00 35.31 H new ATOM 0 HD12 LEU A 61 22.050 -15.506 -1.207 1.00 35.31 H new ATOM 0 HD13 LEU A 61 23.041 -16.431 -0.054 1.00 35.31 H new ATOM 0 HD21 LEU A 61 24.677 -14.014 0.932 1.00 52.22 H new ATOM 0 HD22 LEU A 61 25.395 -15.584 0.499 1.00 52.22 H new ATOM 0 HD23 LEU A 61 25.972 -14.095 -0.285 1.00 52.22 H new ATOM 976 N GLY A 62 25.096 -15.851 -5.355 1.00 31.04 N ATOM 977 CA GLY A 62 25.435 -16.718 -6.469 1.00 53.40 C ATOM 978 C GLY A 62 26.713 -16.294 -7.165 1.00 63.32 C ATOM 979 O GLY A 62 27.333 -17.088 -7.873 1.00 74.23 O ATOM 0 H GLY A 62 24.230 -15.324 -5.470 1.00 31.04 H new ATOM 0 HA2 GLY A 62 25.543 -17.741 -6.109 1.00 53.40 H new ATOM 0 HA3 GLY A 62 24.616 -16.718 -7.188 1.00 53.40 H new ATOM 983 N GLN A 63 27.107 -15.041 -6.964 1.00 12.11 N ATOM 984 CA GLN A 63 28.320 -14.514 -7.580 1.00 1.54 C ATOM 985 C GLN A 63 29.472 -14.490 -6.582 1.00 1.11 C ATOM 986 O GLN A 63 30.621 -14.756 -6.938 1.00 14.31 O ATOM 987 CB GLN A 63 28.070 -13.105 -8.123 1.00 12.20 C ATOM 988 CG GLN A 63 27.826 -13.065 -9.622 1.00 23.14 C ATOM 989 CD GLN A 63 28.287 -11.767 -10.254 1.00 34.12 C ATOM 990 OE1 GLN A 63 28.882 -10.917 -9.591 1.00 74.23 O ATOM 991 NE2 GLN A 63 28.016 -11.606 -11.544 1.00 3.42 N ATOM 0 H GLN A 63 26.605 -14.372 -6.380 1.00 12.11 H new ATOM 0 HA GLN A 63 28.593 -15.171 -8.405 1.00 1.54 H new ATOM 0 HB2 GLN A 63 27.209 -12.675 -7.612 1.00 12.20 H new ATOM 0 HB3 GLN A 63 28.928 -12.476 -7.886 1.00 12.20 H new ATOM 0 HG2 GLN A 63 28.346 -13.899 -10.093 1.00 23.14 H new ATOM 0 HG3 GLN A 63 26.762 -13.202 -9.817 1.00 23.14 H new ATOM 0 HE21 GLN A 63 27.521 -12.336 -12.056 1.00 3.42 H new ATOM 0 HE22 GLN A 63 28.303 -10.752 -12.023 1.00 3.42 H new ATOM 1000 N LEU A 64 29.157 -14.171 -5.331 1.00 33.44 N ATOM 1001 CA LEU A 64 30.168 -14.113 -4.280 1.00 1.43 C ATOM 1002 C LEU A 64 30.573 -15.515 -3.837 1.00 55.31 C ATOM 1003 O LEU A 64 31.684 -15.723 -3.348 1.00 3.30 O ATOM 1004 CB LEU A 64 29.641 -13.319 -3.084 1.00 53.42 C ATOM 1005 CG LEU A 64 29.194 -11.886 -3.372 1.00 30.44 C ATOM 1006 CD1 LEU A 64 28.764 -11.191 -2.090 1.00 41.21 C ATOM 1007 CD2 LEU A 64 30.308 -11.107 -4.055 1.00 74.33 C ATOM 0 H LEU A 64 28.211 -13.949 -5.020 1.00 33.44 H new ATOM 0 HA LEU A 64 31.048 -13.611 -4.682 1.00 1.43 H new ATOM 0 HB2 LEU A 64 28.798 -13.862 -2.656 1.00 53.42 H new ATOM 0 HB3 LEU A 64 30.420 -13.289 -2.322 1.00 53.42 H new ATOM 0 HG LEU A 64 28.337 -11.923 -4.045 1.00 30.44 H new ATOM 0 HD11 LEU A 64 28.449 -10.172 -2.316 1.00 41.21 H new ATOM 0 HD12 LEU A 64 27.933 -11.736 -1.642 1.00 41.21 H new ATOM 0 HD13 LEU A 64 29.601 -11.166 -1.392 1.00 41.21 H new ATOM 0 HD21 LEU A 64 29.972 -10.089 -4.252 1.00 74.33 H new ATOM 0 HD22 LEU A 64 31.184 -11.081 -3.407 1.00 74.33 H new ATOM 0 HD23 LEU A 64 30.567 -11.592 -4.996 1.00 74.33 H new ATOM 1019 N GLN A 65 29.667 -16.471 -4.011 1.00 33.12 N ATOM 1020 CA GLN A 65 29.932 -17.853 -3.630 1.00 1.13 C ATOM 1021 C GLN A 65 31.244 -18.342 -4.235 1.00 11.12 C ATOM 1022 O GLN A 65 32.187 -18.698 -3.528 1.00 5.21 O ATOM 1023 CB GLN A 65 28.782 -18.756 -4.077 1.00 43.00 C ATOM 1024 CG GLN A 65 27.772 -19.045 -2.978 1.00 74.24 C ATOM 1025 CD GLN A 65 26.479 -19.628 -3.512 1.00 13.54 C ATOM 1026 OE1 GLN A 65 25.422 -18.999 -3.433 1.00 70.43 O ATOM 1027 NE2 GLN A 65 26.554 -20.835 -4.059 1.00 53.51 N ATOM 0 H GLN A 65 28.743 -16.314 -4.413 1.00 33.12 H new ATOM 0 HA GLN A 65 30.016 -17.895 -2.544 1.00 1.13 H new ATOM 0 HB2 GLN A 65 28.269 -18.287 -4.917 1.00 43.00 H new ATOM 0 HB3 GLN A 65 29.191 -19.699 -4.440 1.00 43.00 H new ATOM 0 HG2 GLN A 65 28.210 -19.739 -2.261 1.00 74.24 H new ATOM 0 HG3 GLN A 65 27.555 -18.123 -2.438 1.00 74.24 H new ATOM 0 HE21 GLN A 65 27.450 -21.320 -4.103 1.00 53.51 H new ATOM 0 HE22 GLN A 65 25.715 -21.278 -4.435 1.00 53.51 H new ATOM 1036 N PRO A 66 31.308 -18.361 -5.575 1.00 11.22 N ATOM 1037 CA PRO A 66 32.499 -18.806 -6.304 1.00 33.44 C ATOM 1038 C PRO A 66 33.661 -17.828 -6.165 1.00 41.13 C ATOM 1039 O PRO A 66 34.810 -18.173 -6.442 1.00 54.02 O ATOM 1040 CB PRO A 66 32.023 -18.865 -7.758 1.00 43.54 C ATOM 1041 CG PRO A 66 30.890 -17.900 -7.826 1.00 62.52 C ATOM 1042 CD PRO A 66 30.221 -17.950 -6.481 1.00 41.35 C ATOM 0 HA PRO A 66 32.878 -19.755 -5.926 1.00 33.44 H new ATOM 0 HB2 PRO A 66 32.821 -18.588 -8.447 1.00 43.54 H new ATOM 0 HB3 PRO A 66 31.703 -19.871 -8.029 1.00 43.54 H new ATOM 0 HG2 PRO A 66 31.247 -16.894 -8.047 1.00 62.52 H new ATOM 0 HG3 PRO A 66 30.193 -18.172 -8.619 1.00 62.52 H new ATOM 0 HD2 PRO A 66 29.809 -16.981 -6.201 1.00 41.35 H new ATOM 0 HD3 PRO A 66 29.396 -18.663 -6.469 1.00 41.35 H new ATOM 1050 N SER A 67 33.355 -16.609 -5.734 1.00 71.44 N ATOM 1051 CA SER A 67 34.375 -15.580 -5.561 1.00 43.44 C ATOM 1052 C SER A 67 34.714 -15.395 -4.085 1.00 32.24 C ATOM 1053 O SER A 67 35.144 -14.320 -3.665 1.00 13.12 O ATOM 1054 CB SER A 67 33.898 -14.255 -6.157 1.00 31.23 C ATOM 1055 OG SER A 67 33.800 -14.336 -7.568 1.00 23.30 O ATOM 0 H SER A 67 32.409 -16.309 -5.498 1.00 71.44 H new ATOM 0 HA SER A 67 35.275 -15.902 -6.085 1.00 43.44 H new ATOM 0 HB2 SER A 67 32.927 -13.992 -5.737 1.00 31.23 H new ATOM 0 HB3 SER A 67 34.590 -13.459 -5.883 1.00 31.23 H new ATOM 0 HG SER A 67 33.491 -13.477 -7.924 1.00 23.30 H new ATOM 1061 N LEU A 68 34.519 -16.450 -3.302 1.00 1.21 N ATOM 1062 CA LEU A 68 34.804 -16.406 -1.872 1.00 11.32 C ATOM 1063 C LEU A 68 36.296 -16.576 -1.609 1.00 71.32 C ATOM 1064 O LEU A 68 36.867 -15.895 -0.757 1.00 23.52 O ATOM 1065 CB LEU A 68 34.018 -17.496 -1.141 1.00 33.24 C ATOM 1066 CG LEU A 68 32.700 -17.057 -0.501 1.00 61.20 C ATOM 1067 CD1 LEU A 68 31.896 -18.268 -0.054 1.00 52.41 C ATOM 1068 CD2 LEU A 68 32.961 -16.125 0.673 1.00 33.53 C ATOM 0 H LEU A 68 34.164 -17.347 -3.633 1.00 1.21 H new ATOM 0 HA LEU A 68 34.496 -15.431 -1.495 1.00 11.32 H new ATOM 0 HB2 LEU A 68 33.806 -18.299 -1.847 1.00 33.24 H new ATOM 0 HB3 LEU A 68 34.655 -17.916 -0.362 1.00 33.24 H new ATOM 0 HG LEU A 68 32.119 -16.515 -1.247 1.00 61.20 H new ATOM 0 HD11 LEU A 68 30.961 -17.937 0.399 1.00 52.41 H new ATOM 0 HD12 LEU A 68 31.678 -18.898 -0.916 1.00 52.41 H new ATOM 0 HD13 LEU A 68 32.471 -18.838 0.676 1.00 52.41 H new ATOM 0 HD21 LEU A 68 32.012 -15.823 1.116 1.00 33.53 H new ATOM 0 HD22 LEU A 68 33.562 -16.642 1.421 1.00 33.53 H new ATOM 0 HD23 LEU A 68 33.496 -15.242 0.324 1.00 33.53 H new ATOM 1080 N GLN A 69 36.922 -17.488 -2.347 1.00 71.15 N ATOM 1081 CA GLN A 69 38.349 -17.746 -2.193 1.00 21.34 C ATOM 1082 C GLN A 69 39.174 -16.586 -2.740 1.00 22.41 C ATOM 1083 O GLN A 69 40.153 -16.161 -2.126 1.00 53.15 O ATOM 1084 CB GLN A 69 38.734 -19.042 -2.908 1.00 1.52 C ATOM 1085 CG GLN A 69 40.147 -19.510 -2.600 1.00 42.01 C ATOM 1086 CD GLN A 69 41.168 -18.973 -3.584 1.00 3.54 C ATOM 1087 OE1 GLN A 69 41.982 -18.115 -3.245 1.00 70.14 O ATOM 1088 NE2 GLN A 69 41.126 -19.476 -4.813 1.00 73.21 N ATOM 0 H GLN A 69 36.464 -18.060 -3.057 1.00 71.15 H new ATOM 0 HA GLN A 69 38.561 -17.849 -1.129 1.00 21.34 H new ATOM 0 HB2 GLN A 69 38.031 -19.826 -2.626 1.00 1.52 H new ATOM 0 HB3 GLN A 69 38.635 -18.897 -3.984 1.00 1.52 H new ATOM 0 HG2 GLN A 69 40.418 -19.195 -1.593 1.00 42.01 H new ATOM 0 HG3 GLN A 69 40.175 -20.600 -2.611 1.00 42.01 H new ATOM 0 HE21 GLN A 69 40.434 -20.186 -5.050 1.00 73.21 H new ATOM 0 HE22 GLN A 69 41.786 -19.152 -5.520 1.00 73.21 H new ATOM 1097 N THR A 70 38.772 -16.076 -3.901 1.00 60.25 N ATOM 1098 CA THR A 70 39.475 -14.966 -4.532 1.00 53.11 C ATOM 1099 C THR A 70 38.805 -13.635 -4.208 1.00 24.40 C ATOM 1100 O THR A 70 38.859 -12.694 -4.998 1.00 23.11 O ATOM 1101 CB THR A 70 39.538 -15.137 -6.061 1.00 72.41 C ATOM 1102 OG1 THR A 70 38.234 -14.965 -6.628 1.00 73.12 O ATOM 1103 CG2 THR A 70 40.079 -16.511 -6.430 1.00 13.14 C ATOM 0 H THR A 70 37.963 -16.414 -4.423 1.00 60.25 H new ATOM 0 HA THR A 70 40.489 -14.966 -4.132 1.00 53.11 H new ATOM 0 HB THR A 70 40.211 -14.379 -6.461 1.00 72.41 H new ATOM 0 HG1 THR A 70 38.283 -15.074 -7.601 1.00 73.12 H new ATOM 0 HG21 THR A 70 40.114 -16.609 -7.515 1.00 13.14 H new ATOM 0 HG22 THR A 70 41.083 -16.628 -6.022 1.00 13.14 H new ATOM 0 HG23 THR A 70 39.428 -17.281 -6.017 1.00 13.14 H new ATOM 1111 N GLY A 71 38.174 -13.565 -3.040 1.00 51.41 N ATOM 1112 CA GLY A 71 37.503 -12.345 -2.633 1.00 11.43 C ATOM 1113 C GLY A 71 38.191 -11.666 -1.465 1.00 44.52 C ATOM 1114 O GLY A 71 38.410 -12.282 -0.422 1.00 13.13 O ATOM 0 H GLY A 71 38.116 -14.331 -2.369 1.00 51.41 H new ATOM 0 HA2 GLY A 71 37.464 -11.657 -3.477 1.00 11.43 H new ATOM 0 HA3 GLY A 71 36.473 -12.574 -2.360 1.00 11.43 H new ATOM 1118 N SER A 72 38.533 -10.394 -1.640 1.00 74.40 N ATOM 1119 CA SER A 72 39.207 -9.633 -0.594 1.00 14.44 C ATOM 1120 C SER A 72 38.373 -9.612 0.684 1.00 10.02 C ATOM 1121 O SER A 72 37.291 -10.194 0.741 1.00 22.14 O ATOM 1122 CB SER A 72 39.473 -8.202 -1.066 1.00 61.15 C ATOM 1123 OG SER A 72 38.305 -7.621 -1.618 1.00 23.54 O ATOM 0 H SER A 72 38.355 -9.868 -2.496 1.00 74.40 H new ATOM 0 HA SER A 72 40.158 -10.120 -0.379 1.00 14.44 H new ATOM 0 HB2 SER A 72 39.822 -7.598 -0.228 1.00 61.15 H new ATOM 0 HB3 SER A 72 40.269 -8.204 -1.811 1.00 61.15 H new ATOM 0 HG SER A 72 38.501 -6.706 -1.910 1.00 23.54 H new ATOM 1129 N GLU A 73 38.887 -8.935 1.707 1.00 44.21 N ATOM 1130 CA GLU A 73 38.191 -8.839 2.985 1.00 5.03 C ATOM 1131 C GLU A 73 36.800 -8.237 2.803 1.00 31.41 C ATOM 1132 O GLU A 73 35.871 -8.563 3.539 1.00 44.25 O ATOM 1133 CB GLU A 73 39.000 -7.992 3.969 1.00 72.35 C ATOM 1134 CG GLU A 73 39.087 -6.525 3.583 1.00 25.14 C ATOM 1135 CD GLU A 73 40.390 -5.883 4.015 1.00 64.23 C ATOM 1136 OE1 GLU A 73 41.383 -5.991 3.266 1.00 43.31 O ATOM 1137 OE2 GLU A 73 40.417 -5.272 5.105 1.00 21.13 O ATOM 0 H GLU A 73 39.781 -8.446 1.675 1.00 44.21 H new ATOM 0 HA GLU A 73 38.083 -9.846 3.387 1.00 5.03 H new ATOM 0 HB2 GLU A 73 38.551 -8.072 4.959 1.00 72.35 H new ATOM 0 HB3 GLU A 73 40.008 -8.400 4.043 1.00 72.35 H new ATOM 0 HG2 GLU A 73 38.981 -6.431 2.502 1.00 25.14 H new ATOM 0 HG3 GLU A 73 38.254 -5.985 4.033 1.00 25.14 H new ATOM 1144 N GLU A 74 36.668 -7.356 1.816 1.00 30.14 N ATOM 1145 CA GLU A 74 35.392 -6.707 1.538 1.00 24.13 C ATOM 1146 C GLU A 74 34.343 -7.730 1.112 1.00 23.41 C ATOM 1147 O GLU A 74 33.261 -7.808 1.696 1.00 21.52 O ATOM 1148 CB GLU A 74 35.560 -5.647 0.447 1.00 64.20 C ATOM 1149 CG GLU A 74 36.333 -4.422 0.904 1.00 35.13 C ATOM 1150 CD GLU A 74 37.261 -3.884 -0.169 1.00 2.11 C ATOM 1151 OE1 GLU A 74 36.968 -4.093 -1.365 1.00 44.34 O ATOM 1152 OE2 GLU A 74 38.279 -3.255 0.188 1.00 3.50 O ATOM 0 H GLU A 74 37.428 -7.076 1.196 1.00 30.14 H new ATOM 0 HA GLU A 74 35.052 -6.224 2.454 1.00 24.13 H new ATOM 0 HB2 GLU A 74 36.073 -6.093 -0.405 1.00 64.20 H new ATOM 0 HB3 GLU A 74 34.575 -5.336 0.099 1.00 64.20 H new ATOM 0 HG2 GLU A 74 35.630 -3.642 1.196 1.00 35.13 H new ATOM 0 HG3 GLU A 74 36.916 -4.674 1.790 1.00 35.13 H new ATOM 1159 N LEU A 75 34.670 -8.513 0.090 1.00 20.51 N ATOM 1160 CA LEU A 75 33.757 -9.531 -0.417 1.00 65.41 C ATOM 1161 C LEU A 75 33.355 -10.501 0.689 1.00 74.13 C ATOM 1162 O LEU A 75 32.212 -10.956 0.745 1.00 31.44 O ATOM 1163 CB LEU A 75 34.406 -10.298 -1.571 1.00 73.54 C ATOM 1164 CG LEU A 75 33.449 -11.019 -2.521 1.00 13.43 C ATOM 1165 CD1 LEU A 75 33.972 -10.965 -3.948 1.00 22.10 C ATOM 1166 CD2 LEU A 75 33.244 -12.460 -2.080 1.00 50.34 C ATOM 0 H LEU A 75 35.561 -8.462 -0.404 1.00 20.51 H new ATOM 0 HA LEU A 75 32.860 -9.030 -0.780 1.00 65.41 H new ATOM 0 HB2 LEU A 75 35.006 -9.599 -2.154 1.00 73.54 H new ATOM 0 HB3 LEU A 75 35.092 -11.034 -1.151 1.00 73.54 H new ATOM 0 HG LEU A 75 32.485 -10.511 -2.490 1.00 13.43 H new ATOM 0 HD11 LEU A 75 33.278 -11.483 -4.610 1.00 22.10 H new ATOM 0 HD12 LEU A 75 34.065 -9.925 -4.262 1.00 22.10 H new ATOM 0 HD13 LEU A 75 34.948 -11.448 -3.996 1.00 22.10 H new ATOM 0 HD21 LEU A 75 32.560 -12.957 -2.768 1.00 50.34 H new ATOM 0 HD22 LEU A 75 34.202 -12.981 -2.081 1.00 50.34 H new ATOM 0 HD23 LEU A 75 32.823 -12.476 -1.075 1.00 50.34 H new ATOM 1178 N ARG A 76 34.301 -10.811 1.570 1.00 32.03 N ATOM 1179 CA ARG A 76 34.044 -11.726 2.676 1.00 74.52 C ATOM 1180 C ARG A 76 32.940 -11.188 3.581 1.00 71.14 C ATOM 1181 O ARG A 76 31.953 -11.873 3.849 1.00 63.02 O ATOM 1182 CB ARG A 76 35.322 -11.948 3.489 1.00 12.34 C ATOM 1183 CG ARG A 76 36.186 -13.083 2.965 1.00 54.00 C ATOM 1184 CD ARG A 76 36.219 -14.252 3.937 1.00 2.33 C ATOM 1185 NE ARG A 76 36.782 -13.874 5.230 1.00 41.50 N ATOM 1186 CZ ARG A 76 38.068 -13.603 5.420 1.00 33.13 C ATOM 1187 NH1 ARG A 76 38.920 -13.666 4.406 1.00 32.42 N ATOM 1188 NH2 ARG A 76 38.506 -13.266 6.627 1.00 14.44 N ATOM 0 H ARG A 76 35.252 -10.442 1.539 1.00 32.03 H new ATOM 0 HA ARG A 76 33.716 -12.678 2.259 1.00 74.52 H new ATOM 0 HB2 ARG A 76 35.907 -11.028 3.490 1.00 12.34 H new ATOM 0 HB3 ARG A 76 35.053 -12.156 4.525 1.00 12.34 H new ATOM 0 HG2 ARG A 76 35.802 -13.420 2.002 1.00 54.00 H new ATOM 0 HG3 ARG A 76 37.200 -12.721 2.795 1.00 54.00 H new ATOM 0 HD2 ARG A 76 35.208 -14.633 4.080 1.00 2.33 H new ATOM 0 HD3 ARG A 76 36.808 -15.063 3.509 1.00 2.33 H new ATOM 0 HE ARG A 76 36.153 -13.815 6.031 1.00 41.50 H new ATOM 0 HH11 ARG A 76 38.588 -13.923 3.476 1.00 32.42 H new ATOM 0 HH12 ARG A 76 39.907 -13.457 4.556 1.00 32.42 H new ATOM 0 HH21 ARG A 76 37.854 -13.215 7.410 1.00 14.44 H new ATOM 0 HH22 ARG A 76 39.494 -13.058 6.771 1.00 14.44 H new ATOM 1202 N SER A 77 33.114 -9.957 4.051 1.00 14.02 N ATOM 1203 CA SER A 77 32.135 -9.328 4.930 1.00 15.42 C ATOM 1204 C SER A 77 30.761 -9.282 4.268 1.00 65.13 C ATOM 1205 O SER A 77 29.732 -9.369 4.940 1.00 22.42 O ATOM 1206 CB SER A 77 32.583 -7.911 5.298 1.00 64.24 C ATOM 1207 OG SER A 77 33.536 -7.934 6.346 1.00 64.31 O ATOM 0 H SER A 77 33.924 -9.375 3.838 1.00 14.02 H new ATOM 0 HA SER A 77 32.063 -9.926 5.838 1.00 15.42 H new ATOM 0 HB2 SER A 77 33.012 -7.423 4.423 1.00 64.24 H new ATOM 0 HB3 SER A 77 31.719 -7.320 5.601 1.00 64.24 H new ATOM 0 HG SER A 77 34.322 -8.447 6.063 1.00 64.31 H new ATOM 1213 N LEU A 78 30.752 -9.147 2.947 1.00 23.11 N ATOM 1214 CA LEU A 78 29.505 -9.090 2.192 1.00 21.21 C ATOM 1215 C LEU A 78 28.735 -10.400 2.315 1.00 3.24 C ATOM 1216 O LEU A 78 27.581 -10.416 2.747 1.00 71.41 O ATOM 1217 CB LEU A 78 29.790 -8.789 0.720 1.00 62.00 C ATOM 1218 CG LEU A 78 29.509 -7.358 0.260 1.00 65.21 C ATOM 1219 CD1 LEU A 78 28.057 -6.990 0.521 1.00 15.15 C ATOM 1220 CD2 LEU A 78 30.442 -6.380 0.959 1.00 61.52 C ATOM 0 H LEU A 78 31.594 -9.075 2.376 1.00 23.11 H new ATOM 0 HA LEU A 78 28.893 -8.289 2.608 1.00 21.21 H new ATOM 0 HB2 LEU A 78 30.838 -9.014 0.520 1.00 62.00 H new ATOM 0 HB3 LEU A 78 29.196 -9.469 0.109 1.00 62.00 H new ATOM 0 HG LEU A 78 29.691 -7.299 -0.813 1.00 65.21 H new ATOM 0 HD11 LEU A 78 27.875 -5.968 0.188 1.00 15.15 H new ATOM 0 HD12 LEU A 78 27.405 -7.672 -0.025 1.00 15.15 H new ATOM 0 HD13 LEU A 78 27.849 -7.066 1.588 1.00 15.15 H new ATOM 0 HD21 LEU A 78 30.228 -5.367 0.619 1.00 61.52 H new ATOM 0 HD22 LEU A 78 30.292 -6.441 2.037 1.00 61.52 H new ATOM 0 HD23 LEU A 78 31.476 -6.631 0.722 1.00 61.52 H new ATOM 1232 N TYR A 79 29.378 -11.498 1.933 1.00 75.22 N ATOM 1233 CA TYR A 79 28.754 -12.814 2.001 1.00 20.14 C ATOM 1234 C TYR A 79 28.180 -13.074 3.391 1.00 22.13 C ATOM 1235 O TYR A 79 27.192 -13.792 3.542 1.00 72.12 O ATOM 1236 CB TYR A 79 29.767 -13.901 1.643 1.00 42.11 C ATOM 1237 CG TYR A 79 29.132 -15.192 1.175 1.00 14.14 C ATOM 1238 CD1 TYR A 79 28.423 -15.246 -0.019 1.00 61.11 C ATOM 1239 CD2 TYR A 79 29.238 -16.354 1.927 1.00 60.41 C ATOM 1240 CE1 TYR A 79 27.840 -16.422 -0.450 1.00 12.32 C ATOM 1241 CE2 TYR A 79 28.660 -17.535 1.502 1.00 52.33 C ATOM 1242 CZ TYR A 79 27.962 -17.563 0.314 1.00 25.05 C ATOM 1243 OH TYR A 79 27.382 -18.737 -0.111 1.00 64.01 O ATOM 0 H TYR A 79 30.332 -11.503 1.573 1.00 75.22 H new ATOM 0 HA TYR A 79 27.936 -12.838 1.280 1.00 20.14 H new ATOM 0 HB2 TYR A 79 30.428 -13.527 0.861 1.00 42.11 H new ATOM 0 HB3 TYR A 79 30.389 -14.107 2.514 1.00 42.11 H new ATOM 0 HD1 TYR A 79 28.326 -14.354 -0.620 1.00 61.11 H new ATOM 0 HD2 TYR A 79 29.781 -16.335 2.860 1.00 60.41 H new ATOM 0 HE1 TYR A 79 27.292 -16.447 -1.380 1.00 12.32 H new ATOM 0 HE2 TYR A 79 28.755 -18.431 2.097 1.00 52.33 H new ATOM 0 HH TYR A 79 27.563 -19.446 0.541 1.00 64.01 H new ATOM 1253 N ASN A 80 28.808 -12.483 4.402 1.00 45.34 N ATOM 1254 CA ASN A 80 28.362 -12.651 5.780 1.00 5.40 C ATOM 1255 C ASN A 80 27.004 -11.988 5.997 1.00 64.34 C ATOM 1256 O ASN A 80 26.046 -12.633 6.424 1.00 61.41 O ATOM 1257 CB ASN A 80 29.390 -12.061 6.747 1.00 72.21 C ATOM 1258 CG ASN A 80 30.424 -13.081 7.185 1.00 0.41 C ATOM 1259 OD1 ASN A 80 30.171 -14.286 7.165 1.00 11.02 O ATOM 1260 ND2 ASN A 80 31.596 -12.602 7.584 1.00 74.11 N ATOM 0 H ASN A 80 29.626 -11.884 4.293 1.00 45.34 H new ATOM 0 HA ASN A 80 28.261 -13.719 5.975 1.00 5.40 H new ATOM 0 HB2 ASN A 80 29.893 -11.220 6.270 1.00 72.21 H new ATOM 0 HB3 ASN A 80 28.876 -11.669 7.625 1.00 72.21 H new ATOM 0 HD21 ASN A 80 32.330 -13.240 7.890 1.00 74.11 H new ATOM 0 HD22 ASN A 80 31.762 -11.596 7.584 1.00 74.11 H new ATOM 1267 N THR A 81 26.930 -10.695 5.699 1.00 11.32 N ATOM 1268 CA THR A 81 25.692 -9.943 5.861 1.00 21.23 C ATOM 1269 C THR A 81 24.604 -10.468 4.930 1.00 55.03 C ATOM 1270 O THR A 81 23.484 -10.741 5.363 1.00 24.43 O ATOM 1271 CB THR A 81 25.905 -8.442 5.587 1.00 71.41 C ATOM 1272 OG1 THR A 81 26.889 -7.916 6.485 1.00 13.11 O ATOM 1273 CG2 THR A 81 24.604 -7.672 5.746 1.00 3.24 C ATOM 0 H THR A 81 27.713 -10.146 5.344 1.00 11.32 H new ATOM 0 HA THR A 81 25.376 -10.074 6.896 1.00 21.23 H new ATOM 0 HB THR A 81 26.252 -8.328 4.560 1.00 71.41 H new ATOM 0 HG1 THR A 81 26.460 -7.304 7.119 1.00 13.11 H new ATOM 0 HG21 THR A 81 24.780 -6.615 5.547 1.00 3.24 H new ATOM 0 HG22 THR A 81 23.866 -8.055 5.042 1.00 3.24 H new ATOM 0 HG23 THR A 81 24.232 -7.793 6.763 1.00 3.24 H new ATOM 1281 N ILE A 82 24.942 -10.608 3.653 1.00 11.24 N ATOM 1282 CA ILE A 82 23.994 -11.101 2.662 1.00 45.42 C ATOM 1283 C ILE A 82 23.433 -12.460 3.068 1.00 42.24 C ATOM 1284 O ILE A 82 22.334 -12.837 2.662 1.00 74.40 O ATOM 1285 CB ILE A 82 24.644 -11.222 1.272 1.00 24.14 C ATOM 1286 CG1 ILE A 82 25.187 -9.865 0.820 1.00 51.12 C ATOM 1287 CG2 ILE A 82 23.640 -11.759 0.263 1.00 43.21 C ATOM 1288 CD1 ILE A 82 26.209 -9.962 -0.291 1.00 2.10 C ATOM 0 H ILE A 82 25.865 -10.387 3.280 1.00 11.24 H new ATOM 0 HA ILE A 82 23.183 -10.375 2.612 1.00 45.42 H new ATOM 0 HB ILE A 82 25.476 -11.923 1.336 1.00 24.14 H new ATOM 0 HG12 ILE A 82 24.356 -9.244 0.485 1.00 51.12 H new ATOM 0 HG13 ILE A 82 25.638 -9.361 1.674 1.00 51.12 H new ATOM 0 HG21 ILE A 82 24.114 -11.839 -0.715 1.00 43.21 H new ATOM 0 HG22 ILE A 82 23.296 -12.743 0.581 1.00 43.21 H new ATOM 0 HG23 ILE A 82 22.790 -11.080 0.199 1.00 43.21 H new ATOM 0 HD11 ILE A 82 26.550 -8.962 -0.560 1.00 2.10 H new ATOM 0 HD12 ILE A 82 27.058 -10.556 0.047 1.00 2.10 H new ATOM 0 HD13 ILE A 82 25.756 -10.438 -1.161 1.00 2.10 H new ATOM 1300 N ALA A 83 24.196 -13.192 3.874 1.00 4.21 N ATOM 1301 CA ALA A 83 23.774 -14.508 4.339 1.00 32.52 C ATOM 1302 C ALA A 83 22.733 -14.390 5.447 1.00 44.25 C ATOM 1303 O ALA A 83 21.592 -14.825 5.289 1.00 54.12 O ATOM 1304 CB ALA A 83 24.975 -15.308 4.822 1.00 13.51 C ATOM 0 H ALA A 83 25.109 -12.896 4.218 1.00 4.21 H new ATOM 0 HA ALA A 83 23.316 -15.033 3.501 1.00 32.52 H new ATOM 0 HB1 ALA A 83 24.645 -16.288 5.166 1.00 13.51 H new ATOM 0 HB2 ALA A 83 25.684 -15.431 4.003 1.00 13.51 H new ATOM 0 HB3 ALA A 83 25.458 -14.779 5.643 1.00 13.51 H new ATOM 1310 N VAL A 84 23.134 -13.802 6.569 1.00 40.22 N ATOM 1311 CA VAL A 84 22.236 -13.628 7.705 1.00 41.31 C ATOM 1312 C VAL A 84 20.949 -12.928 7.284 1.00 45.42 C ATOM 1313 O VAL A 84 19.866 -13.246 7.780 1.00 62.21 O ATOM 1314 CB VAL A 84 22.905 -12.816 8.830 1.00 42.10 C ATOM 1315 CG1 VAL A 84 22.001 -12.753 10.052 1.00 35.25 C ATOM 1316 CG2 VAL A 84 24.257 -13.415 9.188 1.00 5.12 C ATOM 0 H VAL A 84 24.075 -13.438 6.716 1.00 40.22 H new ATOM 0 HA VAL A 84 22.000 -14.624 8.078 1.00 41.31 H new ATOM 0 HB VAL A 84 23.067 -11.799 8.474 1.00 42.10 H new ATOM 0 HG11 VAL A 84 22.490 -12.176 10.837 1.00 35.25 H new ATOM 0 HG12 VAL A 84 21.059 -12.275 9.783 1.00 35.25 H new ATOM 0 HG13 VAL A 84 21.806 -13.763 10.413 1.00 35.25 H new ATOM 0 HG21 VAL A 84 24.715 -12.829 9.984 1.00 5.12 H new ATOM 0 HG22 VAL A 84 24.122 -14.443 9.526 1.00 5.12 H new ATOM 0 HG23 VAL A 84 24.904 -13.404 8.311 1.00 5.12 H new ATOM 1326 N LEU A 85 21.072 -11.975 6.367 1.00 45.22 N ATOM 1327 CA LEU A 85 19.917 -11.231 5.878 1.00 32.13 C ATOM 1328 C LEU A 85 18.985 -12.134 5.077 1.00 52.33 C ATOM 1329 O LEU A 85 17.795 -12.234 5.375 1.00 11.53 O ATOM 1330 CB LEU A 85 20.374 -10.055 5.012 1.00 55.21 C ATOM 1331 CG LEU A 85 19.398 -8.882 4.904 1.00 62.23 C ATOM 1332 CD1 LEU A 85 19.363 -8.095 6.204 1.00 14.30 C ATOM 1333 CD2 LEU A 85 19.778 -7.978 3.741 1.00 1.31 C ATOM 0 H LEU A 85 21.960 -11.699 5.947 1.00 45.22 H new ATOM 0 HA LEU A 85 19.370 -10.850 6.740 1.00 32.13 H new ATOM 0 HB2 LEU A 85 21.317 -9.681 5.410 1.00 55.21 H new ATOM 0 HB3 LEU A 85 20.577 -10.427 4.008 1.00 55.21 H new ATOM 0 HG LEU A 85 18.401 -9.280 4.718 1.00 62.23 H new ATOM 0 HD11 LEU A 85 18.663 -7.265 6.108 1.00 14.30 H new ATOM 0 HD12 LEU A 85 19.042 -8.748 7.016 1.00 14.30 H new ATOM 0 HD13 LEU A 85 20.358 -7.707 6.422 1.00 14.30 H new ATOM 0 HD21 LEU A 85 19.073 -7.149 3.679 1.00 1.31 H new ATOM 0 HD22 LEU A 85 20.784 -7.588 3.897 1.00 1.31 H new ATOM 0 HD23 LEU A 85 19.750 -8.548 2.813 1.00 1.31 H new ATOM 1345 N TYR A 86 19.534 -12.792 4.063 1.00 14.25 N ATOM 1346 CA TYR A 86 18.752 -13.687 3.219 1.00 11.21 C ATOM 1347 C TYR A 86 17.985 -14.700 4.064 1.00 71.33 C ATOM 1348 O TYR A 86 16.779 -14.883 3.892 1.00 62.13 O ATOM 1349 CB TYR A 86 19.662 -14.417 2.230 1.00 74.31 C ATOM 1350 CG TYR A 86 18.964 -15.513 1.458 1.00 54.14 C ATOM 1351 CD1 TYR A 86 18.318 -15.241 0.259 1.00 1.43 C ATOM 1352 CD2 TYR A 86 18.952 -16.820 1.927 1.00 50.52 C ATOM 1353 CE1 TYR A 86 17.677 -16.239 -0.449 1.00 1.11 C ATOM 1354 CE2 TYR A 86 18.315 -17.825 1.225 1.00 45.43 C ATOM 1355 CZ TYR A 86 17.679 -17.530 0.038 1.00 72.30 C ATOM 1356 OH TYR A 86 17.043 -18.528 -0.666 1.00 75.23 O ATOM 0 H TYR A 86 20.518 -12.722 3.805 1.00 14.25 H new ATOM 0 HA TYR A 86 18.033 -13.085 2.663 1.00 11.21 H new ATOM 0 HB2 TYR A 86 20.073 -13.694 1.526 1.00 74.31 H new ATOM 0 HB3 TYR A 86 20.504 -14.847 2.773 1.00 74.31 H new ATOM 0 HD1 TYR A 86 18.317 -14.232 -0.126 1.00 1.43 H new ATOM 0 HD2 TYR A 86 19.449 -17.055 2.857 1.00 50.52 H new ATOM 0 HE1 TYR A 86 17.177 -16.010 -1.379 1.00 1.11 H new ATOM 0 HE2 TYR A 86 18.315 -18.836 1.604 1.00 45.43 H new ATOM 0 HH TYR A 86 17.496 -19.382 -0.505 1.00 75.23 H new ATOM 1366 N CYS A 87 18.694 -15.355 4.978 1.00 1.25 N ATOM 1367 CA CYS A 87 18.081 -16.350 5.850 1.00 62.14 C ATOM 1368 C CYS A 87 16.853 -15.779 6.550 1.00 30.21 C ATOM 1369 O CYS A 87 15.845 -16.466 6.718 1.00 41.22 O ATOM 1370 CB CYS A 87 19.093 -16.840 6.888 1.00 55.24 C ATOM 1371 SG CYS A 87 20.081 -18.254 6.348 1.00 72.00 S ATOM 0 H CYS A 87 19.692 -15.215 5.134 1.00 1.25 H new ATOM 0 HA CYS A 87 17.765 -17.192 5.234 1.00 62.14 H new ATOM 0 HB2 CYS A 87 19.763 -16.019 7.142 1.00 55.24 H new ATOM 0 HB3 CYS A 87 18.560 -17.110 7.800 1.00 55.24 H new ATOM 0 HG CYS A 87 21.104 -17.833 5.665 1.00 72.00 H new ATOM 1377 N VAL A 88 16.943 -14.517 6.955 1.00 14.21 N ATOM 1378 CA VAL A 88 15.839 -13.852 7.638 1.00 31.13 C ATOM 1379 C VAL A 88 14.688 -13.573 6.677 1.00 41.22 C ATOM 1380 O VAL A 88 13.539 -13.922 6.950 1.00 70.41 O ATOM 1381 CB VAL A 88 16.291 -12.526 8.278 1.00 21.13 C ATOM 1382 CG1 VAL A 88 15.120 -11.833 8.957 1.00 4.21 C ATOM 1383 CG2 VAL A 88 17.421 -12.770 9.266 1.00 64.22 C ATOM 0 H VAL A 88 17.769 -13.934 6.822 1.00 14.21 H new ATOM 0 HA VAL A 88 15.499 -14.528 8.423 1.00 31.13 H new ATOM 0 HB VAL A 88 16.662 -11.871 7.490 1.00 21.13 H new ATOM 0 HG11 VAL A 88 15.459 -10.898 9.403 1.00 4.21 H new ATOM 0 HG12 VAL A 88 14.345 -11.623 8.220 1.00 4.21 H new ATOM 0 HG13 VAL A 88 14.715 -12.480 9.735 1.00 4.21 H new ATOM 0 HG21 VAL A 88 17.728 -11.823 9.709 1.00 64.22 H new ATOM 0 HG22 VAL A 88 17.078 -13.444 10.052 1.00 64.22 H new ATOM 0 HG23 VAL A 88 18.268 -13.219 8.747 1.00 64.22 H new ATOM 1393 N HIS A 89 15.004 -12.942 5.551 1.00 31.22 N ATOM 1394 CA HIS A 89 13.997 -12.616 4.547 1.00 30.00 C ATOM 1395 C HIS A 89 13.186 -13.853 4.171 1.00 4.33 C ATOM 1396 O HIS A 89 11.989 -13.693 3.933 1.00 74.51 O ATOM 1397 CB HIS A 89 14.659 -12.028 3.300 1.00 45.30 C ATOM 1398 CG HIS A 89 15.076 -10.598 3.461 1.00 4.35 C ATOM 1399 ND1 HIS A 89 14.533 -9.759 4.411 1.00 4.11 N ATOM 1400 CD2 HIS A 89 15.988 -9.861 2.787 1.00 23.53 C ATOM 1401 CE1 HIS A 89 15.094 -8.567 4.313 1.00 21.42 C ATOM 1402 NE2 HIS A 89 15.981 -8.602 3.334 1.00 43.41 N ATOM 0 H HIS A 89 15.950 -12.646 5.310 1.00 31.22 H new ATOM 0 HA HIS A 89 13.321 -11.874 4.973 1.00 30.00 H new ATOM 0 HB2 HIS A 89 15.534 -12.627 3.047 1.00 45.30 H new ATOM 0 HB3 HIS A 89 13.967 -12.104 2.461 1.00 45.30 H new ATOM 0 HD1 HIS A 89 13.811 -10.018 5.084 1.00 4.11 H new ATOM 0 HD2 HIS A 89 16.607 -10.200 1.970 1.00 23.53 H new ATOM 0 HE1 HIS A 89 14.866 -7.709 4.929 1.00 21.42 H new ATOM 0 HE2 HIS A 89 16.565 -7.821 3.034 1.00 43.41 H new ATOM 1411 N GLN A 90 13.783 -15.039 4.115 1.00 71.41 N ATOM 1412 CA GLN A 90 13.050 -16.248 3.759 1.00 12.52 C ATOM 1413 C GLN A 90 12.257 -16.773 4.952 1.00 14.22 C ATOM 1414 O GLN A 90 11.026 -16.745 4.952 1.00 20.44 O ATOM 1415 CB GLN A 90 14.012 -17.325 3.257 1.00 51.32 C ATOM 1416 CG GLN A 90 13.319 -18.479 2.551 1.00 14.12 C ATOM 1417 CD GLN A 90 12.941 -19.600 3.498 1.00 64.32 C ATOM 1418 OE1 GLN A 90 13.517 -19.738 4.578 1.00 74.32 O ATOM 1419 NE2 GLN A 90 11.969 -20.412 3.099 1.00 24.21 N ATOM 0 H GLN A 90 14.773 -15.188 4.312 1.00 71.41 H new ATOM 0 HA GLN A 90 12.350 -15.997 2.962 1.00 12.52 H new ATOM 0 HB2 GLN A 90 14.729 -16.870 2.574 1.00 51.32 H new ATOM 0 HB3 GLN A 90 14.580 -17.715 4.102 1.00 51.32 H new ATOM 0 HG2 GLN A 90 12.422 -18.110 2.055 1.00 14.12 H new ATOM 0 HG3 GLN A 90 13.975 -18.871 1.774 1.00 14.12 H new ATOM 0 HE21 GLN A 90 11.518 -20.262 2.197 1.00 24.21 H new ATOM 0 HE22 GLN A 90 11.674 -21.185 3.695 1.00 24.21 H new ATOM 1428 N ARG A 91 12.971 -17.253 5.966 1.00 15.25 N ATOM 1429 CA ARG A 91 12.333 -17.785 7.164 1.00 23.52 C ATOM 1430 C ARG A 91 13.378 -18.250 8.174 1.00 21.03 C ATOM 1431 O ARG A 91 13.188 -18.118 9.383 1.00 13.11 O ATOM 1432 CB ARG A 91 11.406 -18.947 6.800 1.00 71.24 C ATOM 1433 CG ARG A 91 10.004 -18.810 7.370 1.00 30.25 C ATOM 1434 CD ARG A 91 9.795 -19.728 8.563 1.00 43.14 C ATOM 1435 NE ARG A 91 9.529 -21.105 8.155 1.00 35.32 N ATOM 1436 CZ ARG A 91 9.266 -22.087 9.009 1.00 74.25 C ATOM 1437 NH1 ARG A 91 9.233 -21.846 10.312 1.00 74.14 N ATOM 1438 NH2 ARG A 91 9.035 -23.315 8.561 1.00 11.03 N ATOM 0 H ARG A 91 13.990 -17.284 5.981 1.00 15.25 H new ATOM 0 HA ARG A 91 11.744 -16.988 7.617 1.00 23.52 H new ATOM 0 HB2 ARG A 91 11.342 -19.023 5.715 1.00 71.24 H new ATOM 0 HB3 ARG A 91 11.846 -19.877 7.159 1.00 71.24 H new ATOM 0 HG2 ARG A 91 9.832 -17.776 7.670 1.00 30.25 H new ATOM 0 HG3 ARG A 91 9.272 -19.044 6.597 1.00 30.25 H new ATOM 0 HD2 ARG A 91 10.680 -19.703 9.199 1.00 43.14 H new ATOM 0 HD3 ARG A 91 8.962 -19.360 9.162 1.00 43.14 H new ATOM 0 HE ARG A 91 9.546 -21.324 7.159 1.00 35.32 H new ATOM 0 HH11 ARG A 91 9.410 -20.904 10.661 1.00 74.14 H new ATOM 0 HH12 ARG A 91 9.031 -22.602 10.966 1.00 74.14 H new ATOM 0 HH21 ARG A 91 9.059 -23.505 7.559 1.00 11.03 H new ATOM 0 HH22 ARG A 91 8.833 -24.068 9.219 1.00 11.03 H new ATOM 1452 N ILE A 92 14.479 -18.797 7.670 1.00 32.12 N ATOM 1453 CA ILE A 92 15.553 -19.281 8.528 1.00 32.24 C ATOM 1454 C ILE A 92 15.983 -18.211 9.526 1.00 41.22 C ATOM 1455 O ILE A 92 16.487 -17.155 9.141 1.00 51.43 O ATOM 1456 CB ILE A 92 16.778 -19.720 7.704 1.00 14.23 C ATOM 1457 CG1 ILE A 92 16.385 -20.817 6.712 1.00 11.31 C ATOM 1458 CG2 ILE A 92 17.890 -20.203 8.623 1.00 11.13 C ATOM 1459 CD1 ILE A 92 16.872 -20.560 5.302 1.00 50.54 C ATOM 0 H ILE A 92 14.651 -18.916 6.672 1.00 32.12 H new ATOM 0 HA ILE A 92 15.161 -20.143 9.068 1.00 32.24 H new ATOM 0 HB ILE A 92 17.146 -18.862 7.142 1.00 14.23 H new ATOM 0 HG12 ILE A 92 16.786 -21.769 7.058 1.00 11.31 H new ATOM 0 HG13 ILE A 92 15.299 -20.914 6.701 1.00 11.31 H new ATOM 0 HG21 ILE A 92 18.748 -20.510 8.025 1.00 11.13 H new ATOM 0 HG22 ILE A 92 18.184 -19.396 9.293 1.00 11.13 H new ATOM 0 HG23 ILE A 92 17.535 -21.050 9.210 1.00 11.13 H new ATOM 0 HD11 ILE A 92 16.557 -21.378 4.654 1.00 50.54 H new ATOM 0 HD12 ILE A 92 16.450 -19.624 4.936 1.00 50.54 H new ATOM 0 HD13 ILE A 92 17.960 -20.493 5.299 1.00 50.54 H new ATOM 1471 N ASP A 93 15.782 -18.491 10.809 1.00 62.04 N ATOM 1472 CA ASP A 93 16.152 -17.555 11.863 1.00 51.44 C ATOM 1473 C ASP A 93 17.398 -18.033 12.602 1.00 53.33 C ATOM 1474 O ASP A 93 17.353 -18.310 13.801 1.00 52.31 O ATOM 1475 CB ASP A 93 14.995 -17.380 12.848 1.00 40.52 C ATOM 1476 CG ASP A 93 13.776 -16.749 12.204 1.00 31.51 C ATOM 1477 OD1 ASP A 93 13.845 -15.553 11.850 1.00 1.03 O ATOM 1478 OD2 ASP A 93 12.755 -17.451 12.053 1.00 70.22 O ATOM 0 H ASP A 93 15.365 -19.359 11.144 1.00 62.04 H new ATOM 0 HA ASP A 93 16.373 -16.593 11.400 1.00 51.44 H new ATOM 0 HB2 ASP A 93 14.723 -18.352 13.260 1.00 40.52 H new ATOM 0 HB3 ASP A 93 15.323 -16.760 13.683 1.00 40.52 H new ATOM 1483 N VAL A 94 18.509 -18.129 11.879 1.00 72.21 N ATOM 1484 CA VAL A 94 19.767 -18.574 12.466 1.00 61.14 C ATOM 1485 C VAL A 94 20.116 -17.755 13.703 1.00 52.12 C ATOM 1486 O VAL A 94 19.490 -16.732 13.982 1.00 51.14 O ATOM 1487 CB VAL A 94 20.925 -18.475 11.455 1.00 3.22 C ATOM 1488 CG1 VAL A 94 20.703 -19.433 10.294 1.00 53.33 C ATOM 1489 CG2 VAL A 94 21.074 -17.046 10.956 1.00 74.25 C ATOM 0 H VAL A 94 18.563 -17.904 10.886 1.00 72.21 H new ATOM 0 HA VAL A 94 19.631 -19.617 12.751 1.00 61.14 H new ATOM 0 HB VAL A 94 21.850 -18.759 11.958 1.00 3.22 H new ATOM 0 HG11 VAL A 94 21.531 -19.349 9.590 1.00 53.33 H new ATOM 0 HG12 VAL A 94 20.649 -20.454 10.670 1.00 53.33 H new ATOM 0 HG13 VAL A 94 19.770 -19.182 9.789 1.00 53.33 H new ATOM 0 HG21 VAL A 94 21.896 -16.994 10.243 1.00 74.25 H new ATOM 0 HG22 VAL A 94 20.151 -16.733 10.469 1.00 74.25 H new ATOM 0 HG23 VAL A 94 21.282 -16.386 11.798 1.00 74.25 H new ATOM 1499 N LYS A 95 21.121 -18.212 14.444 1.00 33.40 N ATOM 1500 CA LYS A 95 21.557 -17.521 15.652 1.00 22.13 C ATOM 1501 C LYS A 95 22.849 -16.749 15.402 1.00 43.24 C ATOM 1502 O LYS A 95 23.131 -15.758 16.075 1.00 11.42 O ATOM 1503 CB LYS A 95 21.760 -18.522 16.791 1.00 60.24 C ATOM 1504 CG LYS A 95 21.002 -18.165 18.058 1.00 44.10 C ATOM 1505 CD LYS A 95 20.495 -19.407 18.772 1.00 41.31 C ATOM 1506 CE LYS A 95 19.004 -19.313 19.061 1.00 62.23 C ATOM 1507 NZ LYS A 95 18.518 -20.477 19.853 1.00 53.05 N ATOM 0 H LYS A 95 21.649 -19.058 14.229 1.00 33.40 H new ATOM 0 HA LYS A 95 20.780 -16.811 15.935 1.00 22.13 H new ATOM 0 HB2 LYS A 95 21.445 -19.510 16.455 1.00 60.24 H new ATOM 0 HB3 LYS A 95 22.824 -18.588 17.020 1.00 60.24 H new ATOM 0 HG2 LYS A 95 21.653 -17.600 18.726 1.00 44.10 H new ATOM 0 HG3 LYS A 95 20.161 -17.518 17.810 1.00 44.10 H new ATOM 0 HD2 LYS A 95 20.693 -20.287 18.160 1.00 41.31 H new ATOM 0 HD3 LYS A 95 21.040 -19.539 19.706 1.00 41.31 H new ATOM 0 HE2 LYS A 95 18.797 -18.392 19.605 1.00 62.23 H new ATOM 0 HE3 LYS A 95 18.455 -19.258 18.121 1.00 62.23 H new ATOM 0 HZ1 LYS A 95 17.498 -20.376 20.029 1.00 53.05 H new ATOM 0 HZ2 LYS A 95 18.692 -21.355 19.323 1.00 53.05 H new ATOM 0 HZ3 LYS A 95 19.024 -20.515 20.761 1.00 53.05 H new ATOM 1521 N ASP A 96 23.629 -17.210 14.430 1.00 4.53 N ATOM 1522 CA ASP A 96 24.889 -16.562 14.089 1.00 73.23 C ATOM 1523 C ASP A 96 25.117 -16.573 12.581 1.00 3.50 C ATOM 1524 O ASP A 96 24.369 -17.205 11.834 1.00 0.14 O ATOM 1525 CB ASP A 96 26.053 -17.257 14.799 1.00 23.25 C ATOM 1526 CG ASP A 96 25.998 -18.766 14.659 1.00 34.13 C ATOM 1527 OD1 ASP A 96 25.367 -19.418 15.516 1.00 0.43 O ATOM 1528 OD2 ASP A 96 26.587 -19.294 13.693 1.00 62.03 O ATOM 0 H ASP A 96 23.410 -18.030 13.865 1.00 4.53 H new ATOM 0 HA ASP A 96 24.837 -15.525 14.422 1.00 73.23 H new ATOM 0 HB2 ASP A 96 26.995 -16.891 14.390 1.00 23.25 H new ATOM 0 HB3 ASP A 96 26.040 -16.992 15.856 1.00 23.25 H new ATOM 1533 N THR A 97 26.155 -15.871 12.138 1.00 61.02 N ATOM 1534 CA THR A 97 26.479 -15.798 10.719 1.00 72.04 C ATOM 1535 C THR A 97 26.819 -17.177 10.162 1.00 34.35 C ATOM 1536 O THR A 97 26.343 -17.559 9.093 1.00 20.12 O ATOM 1537 CB THR A 97 27.664 -14.847 10.462 1.00 4.40 C ATOM 1538 OG1 THR A 97 27.380 -13.554 11.007 1.00 70.44 O ATOM 1539 CG2 THR A 97 27.944 -14.725 8.972 1.00 73.42 C ATOM 0 H THR A 97 26.786 -15.345 12.742 1.00 61.02 H new ATOM 0 HA THR A 97 25.595 -15.411 10.212 1.00 72.04 H new ATOM 0 HB THR A 97 28.547 -15.260 10.949 1.00 4.40 H new ATOM 0 HG1 THR A 97 27.001 -13.654 11.905 1.00 70.44 H new ATOM 0 HG21 THR A 97 28.784 -14.049 8.814 1.00 73.42 H new ATOM 0 HG22 THR A 97 28.187 -15.707 8.566 1.00 73.42 H new ATOM 0 HG23 THR A 97 27.062 -14.332 8.467 1.00 73.42 H new ATOM 1547 N LYS A 98 27.643 -17.918 10.894 1.00 5.14 N ATOM 1548 CA LYS A 98 28.045 -19.256 10.474 1.00 2.05 C ATOM 1549 C LYS A 98 26.826 -20.138 10.228 1.00 41.32 C ATOM 1550 O LYS A 98 26.756 -20.850 9.227 1.00 3.02 O ATOM 1551 CB LYS A 98 28.946 -19.896 11.532 1.00 13.45 C ATOM 1552 CG LYS A 98 30.428 -19.769 11.226 1.00 55.12 C ATOM 1553 CD LYS A 98 30.851 -18.315 11.105 1.00 13.30 C ATOM 1554 CE LYS A 98 31.223 -17.960 9.674 1.00 23.02 C ATOM 1555 NZ LYS A 98 31.439 -16.496 9.503 1.00 61.31 N ATOM 0 H LYS A 98 28.046 -17.615 11.781 1.00 5.14 H new ATOM 0 HA LYS A 98 28.600 -19.165 9.540 1.00 2.05 H new ATOM 0 HB2 LYS A 98 28.742 -19.434 12.498 1.00 13.45 H new ATOM 0 HB3 LYS A 98 28.692 -20.952 11.623 1.00 13.45 H new ATOM 0 HG2 LYS A 98 31.006 -20.252 12.014 1.00 55.12 H new ATOM 0 HG3 LYS A 98 30.655 -20.293 10.298 1.00 55.12 H new ATOM 0 HD2 LYS A 98 30.040 -17.670 11.442 1.00 13.30 H new ATOM 0 HD3 LYS A 98 31.701 -18.127 11.760 1.00 13.30 H new ATOM 0 HE2 LYS A 98 32.129 -18.496 9.391 1.00 23.02 H new ATOM 0 HE3 LYS A 98 30.433 -18.291 9.001 1.00 23.02 H new ATOM 0 HZ1 LYS A 98 31.691 -16.295 8.514 1.00 61.31 H new ATOM 0 HZ2 LYS A 98 30.567 -15.985 9.749 1.00 61.31 H new ATOM 0 HZ3 LYS A 98 32.210 -16.184 10.127 1.00 61.31 H new ATOM 1569 N GLU A 99 25.867 -20.085 11.148 1.00 44.12 N ATOM 1570 CA GLU A 99 24.651 -20.880 11.029 1.00 3.12 C ATOM 1571 C GLU A 99 23.952 -20.611 9.700 1.00 21.15 C ATOM 1572 O GLU A 99 23.582 -21.539 8.980 1.00 53.25 O ATOM 1573 CB GLU A 99 23.700 -20.574 12.188 1.00 44.42 C ATOM 1574 CG GLU A 99 23.811 -21.556 13.343 1.00 22.12 C ATOM 1575 CD GLU A 99 22.494 -22.240 13.656 1.00 32.23 C ATOM 1576 OE1 GLU A 99 21.828 -22.706 12.707 1.00 50.41 O ATOM 1577 OE2 GLU A 99 22.129 -22.309 14.848 1.00 22.22 O ATOM 0 H GLU A 99 25.909 -19.500 11.983 1.00 44.12 H new ATOM 0 HA GLU A 99 24.931 -21.933 11.066 1.00 3.12 H new ATOM 0 HB2 GLU A 99 23.902 -19.568 12.557 1.00 44.42 H new ATOM 0 HB3 GLU A 99 22.675 -20.577 11.817 1.00 44.42 H new ATOM 0 HG2 GLU A 99 24.560 -22.311 13.103 1.00 22.12 H new ATOM 0 HG3 GLU A 99 24.162 -21.029 14.230 1.00 22.12 H new ATOM 1584 N ALA A 100 23.775 -19.334 9.379 1.00 54.41 N ATOM 1585 CA ALA A 100 23.122 -18.941 8.135 1.00 40.15 C ATOM 1586 C ALA A 100 23.936 -19.386 6.925 1.00 53.43 C ATOM 1587 O ALA A 100 23.391 -19.590 5.839 1.00 3.34 O ATOM 1588 CB ALA A 100 22.907 -17.435 8.105 1.00 52.14 C ATOM 0 H ALA A 100 24.074 -18.553 9.963 1.00 54.41 H new ATOM 0 HA ALA A 100 22.152 -19.436 8.090 1.00 40.15 H new ATOM 0 HB1 ALA A 100 22.419 -17.156 7.171 1.00 52.14 H new ATOM 0 HB2 ALA A 100 22.278 -17.140 8.945 1.00 52.14 H new ATOM 0 HB3 ALA A 100 23.870 -16.929 8.177 1.00 52.14 H new ATOM 1594 N LEU A 101 25.241 -19.534 7.117 1.00 62.15 N ATOM 1595 CA LEU A 101 26.131 -19.954 6.040 1.00 43.43 C ATOM 1596 C LEU A 101 25.960 -21.441 5.742 1.00 41.04 C ATOM 1597 O LEU A 101 26.318 -21.912 4.663 1.00 65.02 O ATOM 1598 CB LEU A 101 27.586 -19.660 6.410 1.00 4.11 C ATOM 1599 CG LEU A 101 28.458 -19.085 5.294 1.00 60.14 C ATOM 1600 CD1 LEU A 101 28.573 -20.072 4.143 1.00 30.45 C ATOM 1601 CD2 LEU A 101 27.894 -17.758 4.806 1.00 42.12 C ATOM 0 H LEU A 101 25.708 -19.369 8.009 1.00 62.15 H new ATOM 0 HA LEU A 101 25.870 -19.390 5.145 1.00 43.43 H new ATOM 0 HB2 LEU A 101 27.593 -18.961 7.246 1.00 4.11 H new ATOM 0 HB3 LEU A 101 28.044 -20.584 6.763 1.00 4.11 H new ATOM 0 HG LEU A 101 29.456 -18.908 5.695 1.00 60.14 H new ATOM 0 HD11 LEU A 101 29.197 -19.645 3.358 1.00 30.45 H new ATOM 0 HD12 LEU A 101 29.023 -20.998 4.501 1.00 30.45 H new ATOM 0 HD13 LEU A 101 27.581 -20.282 3.743 1.00 30.45 H new ATOM 0 HD21 LEU A 101 28.528 -17.363 4.012 1.00 42.12 H new ATOM 0 HD22 LEU A 101 26.885 -17.910 4.423 1.00 42.12 H new ATOM 0 HD23 LEU A 101 27.865 -17.049 5.633 1.00 42.12 H new ATOM 1613 N ASP A 102 25.411 -22.173 6.705 1.00 51.35 N ATOM 1614 CA ASP A 102 25.189 -23.605 6.545 1.00 65.25 C ATOM 1615 C ASP A 102 23.810 -23.879 5.955 1.00 45.00 C ATOM 1616 O ASP A 102 23.651 -24.743 5.092 1.00 54.02 O ATOM 1617 CB ASP A 102 25.334 -24.319 7.889 1.00 54.15 C ATOM 1618 CG ASP A 102 24.913 -25.773 7.821 1.00 64.53 C ATOM 1619 OD1 ASP A 102 25.150 -26.410 6.774 1.00 62.34 O ATOM 1620 OD2 ASP A 102 24.347 -26.275 8.815 1.00 20.34 O ATOM 0 H ASP A 102 25.111 -21.798 7.605 1.00 51.35 H new ATOM 0 HA ASP A 102 25.941 -23.989 5.856 1.00 65.25 H new ATOM 0 HB2 ASP A 102 26.371 -24.259 8.219 1.00 54.15 H new ATOM 0 HB3 ASP A 102 24.732 -23.804 8.637 1.00 54.15 H new ATOM 1625 N LYS A 103 22.812 -23.139 6.428 1.00 73.12 N ATOM 1626 CA LYS A 103 21.445 -23.301 5.949 1.00 14.44 C ATOM 1627 C LYS A 103 21.298 -22.760 4.531 1.00 25.44 C ATOM 1628 O LYS A 103 20.432 -23.202 3.774 1.00 74.41 O ATOM 1629 CB LYS A 103 20.467 -22.585 6.883 1.00 20.04 C ATOM 1630 CG LYS A 103 20.339 -23.239 8.248 1.00 22.32 C ATOM 1631 CD LYS A 103 19.625 -24.577 8.160 1.00 42.23 C ATOM 1632 CE LYS A 103 18.343 -24.578 8.978 1.00 3.21 C ATOM 1633 NZ LYS A 103 17.282 -25.410 8.345 1.00 23.41 N ATOM 0 H LYS A 103 22.925 -22.421 7.143 1.00 73.12 H new ATOM 0 HA LYS A 103 21.214 -24.366 5.939 1.00 14.44 H new ATOM 0 HB2 LYS A 103 20.792 -21.553 7.013 1.00 20.04 H new ATOM 0 HB3 LYS A 103 19.485 -22.553 6.411 1.00 20.04 H new ATOM 0 HG2 LYS A 103 21.330 -23.382 8.678 1.00 22.32 H new ATOM 0 HG3 LYS A 103 19.792 -22.577 8.920 1.00 22.32 H new ATOM 0 HD2 LYS A 103 19.394 -24.800 7.118 1.00 42.23 H new ATOM 0 HD3 LYS A 103 20.286 -25.368 8.516 1.00 42.23 H new ATOM 0 HE2 LYS A 103 18.551 -24.955 9.979 1.00 3.21 H new ATOM 0 HE3 LYS A 103 17.983 -23.555 9.091 1.00 3.21 H new ATOM 0 HZ1 LYS A 103 16.424 -25.385 8.933 1.00 23.41 H new ATOM 0 HZ2 LYS A 103 17.065 -25.035 7.399 1.00 23.41 H new ATOM 0 HZ3 LYS A 103 17.615 -26.392 8.260 1.00 23.41 H new ATOM 1647 N ILE A 104 22.149 -21.803 4.175 1.00 71.02 N ATOM 1648 CA ILE A 104 22.114 -21.205 2.847 1.00 74.24 C ATOM 1649 C ILE A 104 22.432 -22.237 1.771 1.00 34.11 C ATOM 1650 O ILE A 104 21.980 -22.120 0.633 1.00 1.15 O ATOM 1651 CB ILE A 104 23.110 -20.035 2.731 1.00 30.41 C ATOM 1652 CG1 ILE A 104 22.863 -19.255 1.437 1.00 72.44 C ATOM 1653 CG2 ILE A 104 24.541 -20.550 2.780 1.00 3.30 C ATOM 1654 CD1 ILE A 104 22.277 -17.880 1.664 1.00 13.42 C ATOM 0 H ILE A 104 22.871 -21.426 4.789 1.00 71.02 H new ATOM 0 HA ILE A 104 21.103 -20.827 2.697 1.00 74.24 H new ATOM 0 HB ILE A 104 22.958 -19.362 3.575 1.00 30.41 H new ATOM 0 HG12 ILE A 104 23.805 -19.155 0.897 1.00 72.44 H new ATOM 0 HG13 ILE A 104 22.189 -19.828 0.800 1.00 72.44 H new ATOM 0 HG21 ILE A 104 25.232 -19.712 2.697 1.00 3.30 H new ATOM 0 HG22 ILE A 104 24.709 -21.067 3.725 1.00 3.30 H new ATOM 0 HG23 ILE A 104 24.708 -21.241 1.954 1.00 3.30 H new ATOM 0 HD11 ILE A 104 22.129 -17.385 0.704 1.00 13.42 H new ATOM 0 HD12 ILE A 104 21.319 -17.973 2.177 1.00 13.42 H new ATOM 0 HD13 ILE A 104 22.960 -17.290 2.275 1.00 13.42 H new ATOM 1666 N GLU A 105 23.211 -23.249 2.141 1.00 25.14 N ATOM 1667 CA GLU A 105 23.588 -24.303 1.206 1.00 60.02 C ATOM 1668 C GLU A 105 22.468 -25.330 1.064 1.00 21.20 C ATOM 1669 O GLU A 105 22.281 -25.916 -0.002 1.00 31.11 O ATOM 1670 CB GLU A 105 24.872 -24.993 1.672 1.00 33.23 C ATOM 1671 CG GLU A 105 26.074 -24.701 0.789 1.00 41.20 C ATOM 1672 CD GLU A 105 27.288 -25.528 1.165 1.00 12.23 C ATOM 1673 OE1 GLU A 105 27.318 -26.060 2.294 1.00 43.13 O ATOM 1674 OE2 GLU A 105 28.209 -25.643 0.329 1.00 13.25 O ATOM 0 H GLU A 105 23.593 -23.361 3.080 1.00 25.14 H new ATOM 0 HA GLU A 105 23.763 -23.845 0.233 1.00 60.02 H new ATOM 0 HB2 GLU A 105 25.095 -24.677 2.691 1.00 33.23 H new ATOM 0 HB3 GLU A 105 24.706 -26.070 1.701 1.00 33.23 H new ATOM 0 HG2 GLU A 105 25.813 -24.898 -0.251 1.00 41.20 H new ATOM 0 HG3 GLU A 105 26.324 -23.642 0.860 1.00 41.20 H new ATOM 1681 N GLU A 106 21.727 -25.543 2.147 1.00 70.42 N ATOM 1682 CA GLU A 106 20.627 -26.500 2.144 1.00 24.52 C ATOM 1683 C GLU A 106 19.433 -25.954 1.367 1.00 21.22 C ATOM 1684 O GLU A 106 18.668 -26.712 0.771 1.00 52.11 O ATOM 1685 CB GLU A 106 20.208 -26.833 3.577 1.00 2.40 C ATOM 1686 CG GLU A 106 21.236 -27.654 4.337 1.00 33.02 C ATOM 1687 CD GLU A 106 21.088 -29.143 4.096 1.00 54.40 C ATOM 1688 OE1 GLU A 106 19.940 -29.635 4.116 1.00 51.33 O ATOM 1689 OE2 GLU A 106 22.119 -29.816 3.890 1.00 44.23 O ATOM 0 H GLU A 106 21.869 -25.066 3.037 1.00 70.42 H new ATOM 0 HA GLU A 106 20.972 -27.410 1.653 1.00 24.52 H new ATOM 0 HB2 GLU A 106 20.025 -25.905 4.118 1.00 2.40 H new ATOM 0 HB3 GLU A 106 19.265 -27.379 3.553 1.00 2.40 H new ATOM 0 HG2 GLU A 106 22.237 -27.340 4.041 1.00 33.02 H new ATOM 0 HG3 GLU A 106 21.141 -27.451 5.404 1.00 33.02 H new ATOM 1696 N GLU A 107 19.282 -24.633 1.377 1.00 4.54 N ATOM 1697 CA GLU A 107 18.179 -23.985 0.675 1.00 65.44 C ATOM 1698 C GLU A 107 18.343 -24.122 -0.837 1.00 43.12 C ATOM 1699 O GLU A 107 17.361 -24.155 -1.577 1.00 14.33 O ATOM 1700 CB GLU A 107 18.099 -22.507 1.059 1.00 3.12 C ATOM 1701 CG GLU A 107 16.685 -21.953 1.053 1.00 3.54 C ATOM 1702 CD GLU A 107 15.876 -22.403 2.256 1.00 23.54 C ATOM 1703 OE1 GLU A 107 16.351 -23.296 2.988 1.00 74.41 O ATOM 1704 OE2 GLU A 107 14.770 -21.863 2.463 1.00 22.02 O ATOM 0 H GLU A 107 19.908 -23.991 1.863 1.00 4.54 H new ATOM 0 HA GLU A 107 17.253 -24.479 0.970 1.00 65.44 H new ATOM 0 HB2 GLU A 107 18.528 -22.375 2.052 1.00 3.12 H new ATOM 0 HB3 GLU A 107 18.710 -21.927 0.368 1.00 3.12 H new ATOM 0 HG2 GLU A 107 16.726 -20.864 1.034 1.00 3.54 H new ATOM 0 HG3 GLU A 107 16.179 -22.269 0.141 1.00 3.54 H new ATOM 1711 N GLN A 108 19.592 -24.201 -1.286 1.00 73.21 N ATOM 1712 CA GLN A 108 19.884 -24.332 -2.708 1.00 33.40 C ATOM 1713 C GLN A 108 19.772 -25.785 -3.155 1.00 65.53 C ATOM 1714 O GLN A 108 19.160 -26.084 -4.179 1.00 25.43 O ATOM 1715 CB GLN A 108 21.285 -23.798 -3.013 1.00 23.41 C ATOM 1716 CG GLN A 108 21.407 -22.290 -2.869 1.00 3.12 C ATOM 1717 CD GLN A 108 21.211 -21.560 -4.184 1.00 63.52 C ATOM 1718 OE1 GLN A 108 20.340 -21.914 -4.980 1.00 53.03 O ATOM 1719 NE2 GLN A 108 22.022 -20.535 -4.419 1.00 10.00 N ATOM 0 H GLN A 108 20.417 -24.177 -0.686 1.00 73.21 H new ATOM 0 HA GLN A 108 19.151 -23.744 -3.260 1.00 33.40 H new ATOM 0 HB2 GLN A 108 22.001 -24.277 -2.345 1.00 23.41 H new ATOM 0 HB3 GLN A 108 21.559 -24.081 -4.029 1.00 23.41 H new ATOM 0 HG2 GLN A 108 20.669 -21.937 -2.148 1.00 3.12 H new ATOM 0 HG3 GLN A 108 22.390 -22.046 -2.465 1.00 3.12 H new ATOM 0 HE21 GLN A 108 22.730 -20.277 -3.731 1.00 10.00 H new ATOM 0 HE22 GLN A 108 21.937 -20.006 -5.287 1.00 10.00 H new ATOM 1728 N ASN A 109 20.369 -26.686 -2.380 1.00 34.53 N ATOM 1729 CA ASN A 109 20.338 -28.108 -2.697 1.00 4.24 C ATOM 1730 C ASN A 109 18.902 -28.591 -2.884 1.00 64.23 C ATOM 1731 O ASN A 109 18.644 -29.524 -3.646 1.00 23.22 O ATOM 1732 CB ASN A 109 21.019 -28.915 -1.589 1.00 1.22 C ATOM 1733 CG ASN A 109 22.529 -28.926 -1.728 1.00 1.12 C ATOM 1734 OD1 ASN A 109 23.077 -30.068 -2.127 1.00 25.43 O flip ATOM 1735 ND2 ASN A 109 23.194 -27.920 -1.479 1.00 33.20 N flip ATOM 0 H ASN A 109 20.880 -26.455 -1.528 1.00 34.53 H new ATOM 0 HA ASN A 109 20.879 -28.259 -3.631 1.00 4.24 H new ATOM 0 HB2 ASN A 109 20.749 -28.496 -0.620 1.00 1.22 H new ATOM 0 HB3 ASN A 109 20.647 -29.940 -1.608 1.00 1.22 H new ATOM 0 HD21 ASN A 109 22.730 -27.064 -1.175 1.00 33.20 H new ATOM 0 HD22 ASN A 109 24.209 -27.943 -1.577 1.00 33.20 H new ATOM 1742 N LYS A 110 17.972 -27.951 -2.186 1.00 54.51 N ATOM 1743 CA LYS A 110 16.563 -28.313 -2.274 1.00 42.33 C ATOM 1744 C LYS A 110 15.813 -27.357 -3.196 1.00 53.31 C ATOM 1745 O LYS A 110 14.640 -27.056 -2.972 1.00 74.11 O ATOM 1746 CB LYS A 110 15.924 -28.304 -0.884 1.00 11.12 C ATOM 1747 CG LYS A 110 16.213 -29.556 -0.074 1.00 54.44 C ATOM 1748 CD LYS A 110 14.932 -30.239 0.373 1.00 42.43 C ATOM 1749 CE LYS A 110 15.153 -31.074 1.626 1.00 55.01 C ATOM 1750 NZ LYS A 110 13.881 -31.650 2.140 1.00 42.31 N ATOM 0 H LYS A 110 18.169 -27.177 -1.551 1.00 54.51 H new ATOM 0 HA LYS A 110 16.498 -29.318 -2.690 1.00 42.33 H new ATOM 0 HB2 LYS A 110 16.283 -27.434 -0.334 1.00 11.12 H new ATOM 0 HB3 LYS A 110 14.845 -28.191 -0.990 1.00 11.12 H new ATOM 0 HG2 LYS A 110 16.806 -30.248 -0.672 1.00 54.44 H new ATOM 0 HG3 LYS A 110 16.811 -29.296 0.799 1.00 54.44 H new ATOM 0 HD2 LYS A 110 14.166 -29.488 0.566 1.00 42.43 H new ATOM 0 HD3 LYS A 110 14.559 -30.876 -0.429 1.00 42.43 H new ATOM 0 HE2 LYS A 110 15.854 -31.879 1.407 1.00 55.01 H new ATOM 0 HE3 LYS A 110 15.610 -30.456 2.399 1.00 55.01 H new ATOM 0 HZ1 LYS A 110 14.074 -32.212 2.994 1.00 42.31 H new ATOM 0 HZ2 LYS A 110 13.221 -30.881 2.374 1.00 42.31 H new ATOM 0 HZ3 LYS A 110 13.457 -32.261 1.412 1.00 42.31 H new ATOM 1764 N SER A 111 16.497 -26.882 -4.233 1.00 51.41 N ATOM 1765 CA SER A 111 15.895 -25.959 -5.187 1.00 14.34 C ATOM 1766 C SER A 111 16.840 -25.693 -6.354 1.00 34.35 C ATOM 1767 O SER A 111 16.898 -24.581 -6.881 1.00 24.21 O ATOM 1768 CB SER A 111 15.537 -24.641 -4.496 1.00 22.05 C ATOM 1769 OG SER A 111 14.367 -24.071 -5.060 1.00 62.32 O ATOM 0 H SER A 111 17.468 -27.122 -4.433 1.00 51.41 H new ATOM 0 HA SER A 111 14.985 -26.417 -5.575 1.00 14.34 H new ATOM 0 HB2 SER A 111 15.384 -24.815 -3.431 1.00 22.05 H new ATOM 0 HB3 SER A 111 16.367 -23.941 -4.588 1.00 22.05 H new ATOM 0 HG SER A 111 14.158 -23.231 -4.601 1.00 62.32 H new ATOM 1775 N LYS A 112 17.580 -26.721 -6.754 1.00 3.03 N ATOM 1776 CA LYS A 112 18.522 -26.602 -7.861 1.00 40.01 C ATOM 1777 C LYS A 112 17.871 -27.015 -9.177 1.00 72.51 C ATOM 1778 O LYS A 112 17.965 -26.305 -10.178 1.00 31.33 O ATOM 1779 CB LYS A 112 19.759 -27.463 -7.598 1.00 20.34 C ATOM 1780 CG LYS A 112 21.043 -26.661 -7.476 1.00 70.25 C ATOM 1781 CD LYS A 112 22.201 -27.530 -7.012 1.00 52.30 C ATOM 1782 CE LYS A 112 23.542 -26.880 -7.316 1.00 51.25 C ATOM 1783 NZ LYS A 112 24.657 -27.867 -7.278 1.00 24.34 N ATOM 0 H LYS A 112 17.546 -27.647 -6.328 1.00 3.03 H new ATOM 0 HA LYS A 112 18.824 -25.557 -7.939 1.00 40.01 H new ATOM 0 HB2 LYS A 112 19.607 -28.032 -6.681 1.00 20.34 H new ATOM 0 HB3 LYS A 112 19.867 -28.186 -8.407 1.00 20.34 H new ATOM 0 HG2 LYS A 112 21.286 -26.213 -8.439 1.00 70.25 H new ATOM 0 HG3 LYS A 112 20.896 -25.842 -6.772 1.00 70.25 H new ATOM 0 HD2 LYS A 112 22.117 -27.708 -5.940 1.00 52.30 H new ATOM 0 HD3 LYS A 112 22.147 -28.502 -7.502 1.00 52.30 H new ATOM 0 HE2 LYS A 112 23.504 -26.412 -8.300 1.00 51.25 H new ATOM 0 HE3 LYS A 112 23.734 -26.087 -6.593 1.00 51.25 H new ATOM 0 HZ1 LYS A 112 25.554 -27.386 -7.490 1.00 24.34 H new ATOM 0 HZ2 LYS A 112 24.709 -28.295 -6.332 1.00 24.34 H new ATOM 0 HZ3 LYS A 112 24.487 -28.610 -7.985 1.00 24.34 H new ATOM 1797 N LYS A 113 17.210 -28.168 -9.168 1.00 24.42 N ATOM 1798 CA LYS A 113 16.541 -28.675 -10.360 1.00 62.11 C ATOM 1799 C LYS A 113 15.250 -27.907 -10.628 1.00 63.30 C ATOM 1800 O LYS A 113 14.795 -27.817 -11.769 1.00 40.24 O ATOM 1801 CB LYS A 113 16.237 -30.167 -10.203 1.00 5.24 C ATOM 1802 CG LYS A 113 17.072 -31.057 -11.108 1.00 14.31 C ATOM 1803 CD LYS A 113 18.497 -31.188 -10.599 1.00 14.40 C ATOM 1804 CE LYS A 113 18.648 -32.379 -9.664 1.00 30.33 C ATOM 1805 NZ LYS A 113 19.444 -32.036 -8.453 1.00 43.24 N ATOM 0 H LYS A 113 17.123 -28.769 -8.348 1.00 24.42 H new ATOM 0 HA LYS A 113 17.209 -28.534 -11.209 1.00 62.11 H new ATOM 0 HB2 LYS A 113 16.407 -30.457 -9.166 1.00 5.24 H new ATOM 0 HB3 LYS A 113 15.181 -30.338 -10.413 1.00 5.24 H new ATOM 0 HG2 LYS A 113 16.615 -32.045 -11.171 1.00 14.31 H new ATOM 0 HG3 LYS A 113 17.081 -30.645 -12.117 1.00 14.31 H new ATOM 0 HD2 LYS A 113 19.177 -31.298 -11.443 1.00 14.40 H new ATOM 0 HD3 LYS A 113 18.783 -30.275 -10.076 1.00 14.40 H new ATOM 0 HE2 LYS A 113 17.662 -32.731 -9.362 1.00 30.33 H new ATOM 0 HE3 LYS A 113 19.131 -33.199 -10.196 1.00 30.33 H new ATOM 0 HZ1 LYS A 113 19.524 -32.873 -7.842 1.00 43.24 H new ATOM 0 HZ2 LYS A 113 20.394 -31.724 -8.739 1.00 43.24 H new ATOM 0 HZ3 LYS A 113 18.971 -31.271 -7.932 1.00 43.24 H new ATOM 1819 N LYS A 114 14.667 -27.354 -9.571 1.00 1.50 N ATOM 1820 CA LYS A 114 13.430 -26.592 -9.692 1.00 54.12 C ATOM 1821 C LYS A 114 13.643 -25.140 -9.273 1.00 41.32 C ATOM 1822 O LYS A 114 12.767 -24.524 -8.665 1.00 25.43 O ATOM 1823 CB LYS A 114 12.331 -27.224 -8.835 1.00 3.41 C ATOM 1824 CG LYS A 114 11.834 -28.556 -9.370 1.00 3.43 C ATOM 1825 CD LYS A 114 12.490 -29.725 -8.655 1.00 72.03 C ATOM 1826 CE LYS A 114 11.872 -31.050 -9.069 1.00 61.45 C ATOM 1827 NZ LYS A 114 10.693 -31.400 -8.228 1.00 34.21 N ATOM 0 H LYS A 114 15.031 -27.419 -8.620 1.00 1.50 H new ATOM 0 HA LYS A 114 13.122 -26.610 -10.738 1.00 54.12 H new ATOM 0 HB2 LYS A 114 12.708 -27.366 -7.822 1.00 3.41 H new ATOM 0 HB3 LYS A 114 11.491 -26.533 -8.768 1.00 3.41 H new ATOM 0 HG2 LYS A 114 10.752 -28.616 -9.250 1.00 3.43 H new ATOM 0 HG3 LYS A 114 12.041 -28.620 -10.438 1.00 3.43 H new ATOM 0 HD2 LYS A 114 13.557 -29.735 -8.876 1.00 72.03 H new ATOM 0 HD3 LYS A 114 12.389 -29.596 -7.577 1.00 72.03 H new ATOM 0 HE2 LYS A 114 11.569 -30.998 -10.115 1.00 61.45 H new ATOM 0 HE3 LYS A 114 12.620 -31.839 -8.992 1.00 61.45 H new ATOM 0 HZ1 LYS A 114 10.300 -32.310 -8.542 1.00 34.21 H new ATOM 0 HZ2 LYS A 114 10.986 -31.474 -7.233 1.00 34.21 H new ATOM 0 HZ3 LYS A 114 9.968 -30.660 -8.321 1.00 34.21 H new ATOM 1841 N ALA A 115 14.811 -24.599 -9.603 1.00 22.44 N ATOM 1842 CA ALA A 115 15.137 -23.219 -9.265 1.00 52.25 C ATOM 1843 C ALA A 115 14.153 -22.249 -9.908 1.00 4.43 C ATOM 1844 O ALA A 115 13.922 -21.154 -9.396 1.00 60.12 O ATOM 1845 CB ALA A 115 16.560 -22.893 -9.694 1.00 22.14 C ATOM 0 H ALA A 115 15.548 -25.096 -10.104 1.00 22.44 H new ATOM 0 HA ALA A 115 15.061 -23.108 -8.183 1.00 52.25 H new ATOM 0 HB1 ALA A 115 16.790 -21.859 -9.436 1.00 22.14 H new ATOM 0 HB2 ALA A 115 17.256 -23.558 -9.183 1.00 22.14 H new ATOM 0 HB3 ALA A 115 16.655 -23.027 -10.772 1.00 22.14 H new ATOM 1851 N GLN A 116 13.575 -22.658 -11.033 1.00 10.41 N ATOM 1852 CA GLN A 116 12.615 -21.823 -11.746 1.00 61.24 C ATOM 1853 C GLN A 116 11.221 -21.958 -11.143 1.00 52.53 C ATOM 1854 O GLN A 116 10.492 -20.975 -11.016 1.00 21.33 O ATOM 1855 CB GLN A 116 12.581 -22.201 -13.228 1.00 71.12 C ATOM 1856 CG GLN A 116 13.880 -21.907 -13.961 1.00 21.10 C ATOM 1857 CD GLN A 116 13.833 -20.602 -14.732 1.00 43.30 C ATOM 1858 OE1 GLN A 116 13.444 -19.565 -14.195 1.00 31.51 O ATOM 1859 NE2 GLN A 116 14.229 -20.649 -15.998 1.00 75.23 N ATOM 0 H GLN A 116 13.755 -23.562 -11.470 1.00 10.41 H new ATOM 0 HA GLN A 116 12.933 -20.785 -11.649 1.00 61.24 H new ATOM 0 HB2 GLN A 116 12.355 -23.264 -13.318 1.00 71.12 H new ATOM 0 HB3 GLN A 116 11.769 -21.660 -13.714 1.00 71.12 H new ATOM 0 HG2 GLN A 116 14.698 -21.870 -13.242 1.00 21.10 H new ATOM 0 HG3 GLN A 116 14.097 -22.724 -14.649 1.00 21.10 H new ATOM 0 HE21 GLN A 116 14.544 -21.531 -16.401 1.00 75.23 H new ATOM 0 HE22 GLN A 116 14.219 -19.803 -16.567 1.00 75.23 H new ATOM 1868 N GLN A 117 10.858 -23.182 -10.772 1.00 70.44 N ATOM 1869 CA GLN A 117 9.550 -23.445 -10.182 1.00 74.04 C ATOM 1870 C GLN A 117 9.453 -22.842 -8.785 1.00 51.20 C ATOM 1871 O GLN A 117 8.550 -22.056 -8.498 1.00 33.25 O ATOM 1872 CB GLN A 117 9.289 -24.950 -10.121 1.00 53.34 C ATOM 1873 CG GLN A 117 8.188 -25.415 -11.059 1.00 24.35 C ATOM 1874 CD GLN A 117 7.426 -26.610 -10.521 1.00 55.43 C ATOM 1875 OE1 GLN A 117 6.520 -26.463 -9.699 1.00 64.40 O ATOM 1876 NE2 GLN A 117 7.789 -27.801 -10.981 1.00 74.14 N ATOM 0 H GLN A 117 11.451 -24.006 -10.869 1.00 70.44 H new ATOM 0 HA GLN A 117 8.793 -22.978 -10.812 1.00 74.04 H new ATOM 0 HB2 GLN A 117 10.210 -25.480 -10.364 1.00 53.34 H new ATOM 0 HB3 GLN A 117 9.024 -25.223 -9.100 1.00 53.34 H new ATOM 0 HG2 GLN A 117 7.493 -24.594 -11.231 1.00 24.35 H new ATOM 0 HG3 GLN A 117 8.624 -25.672 -12.025 1.00 24.35 H new ATOM 0 HE21 GLN A 117 8.545 -27.876 -11.662 1.00 74.14 H new ATOM 0 HE22 GLN A 117 7.312 -28.641 -10.654 1.00 74.14 H new ATOM 1885 N ALA A 118 10.388 -23.216 -7.918 1.00 11.51 N ATOM 1886 CA ALA A 118 10.408 -22.711 -6.550 1.00 3.41 C ATOM 1887 C ALA A 118 10.493 -21.189 -6.528 1.00 75.50 C ATOM 1888 O ALA A 118 10.033 -20.545 -5.585 1.00 23.25 O ATOM 1889 CB ALA A 118 11.570 -23.318 -5.780 1.00 70.43 C ATOM 0 H ALA A 118 11.142 -23.867 -8.138 1.00 11.51 H new ATOM 0 HA ALA A 118 9.475 -23.003 -6.068 1.00 3.41 H new ATOM 0 HB1 ALA A 118 11.572 -22.932 -4.761 1.00 70.43 H new ATOM 0 HB2 ALA A 118 11.464 -24.403 -5.757 1.00 70.43 H new ATOM 0 HB3 ALA A 118 12.508 -23.055 -6.270 1.00 70.43 H new ATOM 1895 N ALA A 119 11.087 -20.619 -7.573 1.00 42.25 N ATOM 1896 CA ALA A 119 11.232 -19.172 -7.673 1.00 1.24 C ATOM 1897 C ALA A 119 10.136 -18.570 -8.546 1.00 62.33 C ATOM 1898 O ALA A 119 10.414 -17.996 -9.598 1.00 12.54 O ATOM 1899 CB ALA A 119 12.604 -18.817 -8.224 1.00 31.42 C ATOM 0 H ALA A 119 11.475 -21.137 -8.361 1.00 42.25 H new ATOM 0 HA ALA A 119 11.135 -18.751 -6.672 1.00 1.24 H new ATOM 0 HB1 ALA A 119 12.699 -17.733 -8.294 1.00 31.42 H new ATOM 0 HB2 ALA A 119 13.375 -19.207 -7.559 1.00 31.42 H new ATOM 0 HB3 ALA A 119 12.723 -19.256 -9.215 1.00 31.42 H new ATOM 1905 N ALA A 120 8.890 -18.707 -8.103 1.00 32.01 N ATOM 1906 CA ALA A 120 7.753 -18.175 -8.843 1.00 20.34 C ATOM 1907 C ALA A 120 6.543 -17.990 -7.934 1.00 61.20 C ATOM 1908 O ALA A 120 5.400 -18.061 -8.384 1.00 30.31 O ATOM 1909 CB ALA A 120 7.406 -19.092 -10.007 1.00 31.42 C ATOM 0 H ALA A 120 8.643 -19.182 -7.235 1.00 32.01 H new ATOM 0 HA ALA A 120 8.032 -17.197 -9.235 1.00 20.34 H new ATOM 0 HB1 ALA A 120 6.555 -18.683 -10.551 1.00 31.42 H new ATOM 0 HB2 ALA A 120 8.262 -19.169 -10.677 1.00 31.42 H new ATOM 0 HB3 ALA A 120 7.152 -20.082 -9.627 1.00 31.42 H new ATOM 1915 N ASP A 121 6.804 -17.754 -6.653 1.00 13.53 N ATOM 1916 CA ASP A 121 5.735 -17.558 -5.679 1.00 65.25 C ATOM 1917 C ASP A 121 6.002 -16.327 -4.820 1.00 55.32 C ATOM 1918 O ASP A 121 5.713 -16.316 -3.622 1.00 32.34 O ATOM 1919 CB ASP A 121 5.594 -18.795 -4.790 1.00 22.24 C ATOM 1920 CG ASP A 121 4.152 -19.078 -4.418 1.00 10.45 C ATOM 1921 OD1 ASP A 121 3.372 -19.462 -5.314 1.00 62.44 O ATOM 1922 OD2 ASP A 121 3.802 -18.914 -3.230 1.00 72.23 O ATOM 0 H ASP A 121 7.745 -17.694 -6.265 1.00 13.53 H new ATOM 0 HA ASP A 121 4.804 -17.403 -6.224 1.00 65.25 H new ATOM 0 HB2 ASP A 121 6.009 -19.660 -5.307 1.00 22.24 H new ATOM 0 HB3 ASP A 121 6.180 -18.655 -3.882 1.00 22.24 H new ATOM 1927 N THR A 122 6.556 -15.289 -5.438 1.00 35.33 N ATOM 1928 CA THR A 122 6.864 -14.052 -4.731 1.00 73.23 C ATOM 1929 C THR A 122 5.699 -13.073 -4.801 1.00 11.44 C ATOM 1930 O THR A 122 4.832 -13.186 -5.667 1.00 22.24 O ATOM 1931 CB THR A 122 8.123 -13.375 -5.303 1.00 62.42 C ATOM 1932 OG1 THR A 122 8.100 -13.427 -6.734 1.00 33.04 O ATOM 1933 CG2 THR A 122 9.384 -14.053 -4.787 1.00 23.22 C ATOM 0 H THR A 122 6.801 -15.280 -6.428 1.00 35.33 H new ATOM 0 HA THR A 122 7.047 -14.321 -3.691 1.00 73.23 H new ATOM 0 HB THR A 122 8.129 -12.335 -4.977 1.00 62.42 H new ATOM 0 HG1 THR A 122 8.903 -12.993 -7.090 1.00 33.04 H new ATOM 0 HG21 THR A 122 10.260 -13.558 -5.205 1.00 23.22 H new ATOM 0 HG22 THR A 122 9.414 -13.987 -3.699 1.00 23.22 H new ATOM 0 HG23 THR A 122 9.382 -15.101 -5.087 1.00 23.22 H new ATOM 1941 N GLY A 123 5.683 -12.110 -3.885 1.00 53.21 N ATOM 1942 CA GLY A 123 4.619 -11.123 -3.861 1.00 5.41 C ATOM 1943 C GLY A 123 4.377 -10.564 -2.474 1.00 12.54 C ATOM 1944 O GLY A 123 5.046 -10.950 -1.516 1.00 30.14 O ATOM 0 H GLY A 123 6.389 -11.995 -3.158 1.00 53.21 H new ATOM 0 HA2 GLY A 123 4.869 -10.307 -4.539 1.00 5.41 H new ATOM 0 HA3 GLY A 123 3.700 -11.576 -4.232 1.00 5.41 H new ATOM 1948 N ASN A 124 3.418 -9.650 -2.365 1.00 11.51 N ATOM 1949 CA ASN A 124 3.090 -9.035 -1.084 1.00 74.41 C ATOM 1950 C ASN A 124 4.276 -8.242 -0.543 1.00 52.51 C ATOM 1951 O ASN A 124 5.376 -8.300 -1.090 1.00 70.51 O ATOM 1952 CB ASN A 124 2.673 -10.104 -0.072 1.00 52.13 C ATOM 1953 CG ASN A 124 1.251 -9.913 0.418 1.00 35.23 C ATOM 1954 OD1 ASN A 124 0.301 -9.965 -0.363 1.00 21.20 O ATOM 1955 ND2 ASN A 124 1.098 -9.690 1.718 1.00 52.25 N ATOM 0 H ASN A 124 2.855 -9.319 -3.148 1.00 11.51 H new ATOM 0 HA ASN A 124 2.257 -8.349 -1.241 1.00 74.41 H new ATOM 0 HB2 ASN A 124 2.768 -11.089 -0.529 1.00 52.13 H new ATOM 0 HB3 ASN A 124 3.354 -10.080 0.779 1.00 52.13 H new ATOM 0 HD21 ASN A 124 0.164 -9.554 2.106 1.00 52.25 H new ATOM 0 HD22 ASN A 124 1.914 -9.655 2.329 1.00 52.25 H new ATOM 1962 N ASN A 125 4.043 -7.500 0.535 1.00 41.45 N ATOM 1963 CA ASN A 125 5.092 -6.696 1.151 1.00 13.51 C ATOM 1964 C ASN A 125 4.651 -6.181 2.519 1.00 30.43 C ATOM 1965 O ASN A 125 3.509 -6.384 2.930 1.00 13.41 O ATOM 1966 CB ASN A 125 5.458 -5.519 0.245 1.00 31.12 C ATOM 1967 CG ASN A 125 4.236 -4.783 -0.271 1.00 3.13 C ATOM 1968 OD1 ASN A 125 3.395 -4.334 0.507 1.00 1.33 O ATOM 1969 ND2 ASN A 125 4.133 -4.658 -1.589 1.00 25.11 N ATOM 0 H ASN A 125 3.137 -7.439 1.000 1.00 41.45 H new ATOM 0 HA ASN A 125 5.969 -7.329 1.286 1.00 13.51 H new ATOM 0 HB2 ASN A 125 6.092 -4.824 0.796 1.00 31.12 H new ATOM 0 HB3 ASN A 125 6.043 -5.883 -0.600 1.00 31.12 H new ATOM 0 HD21 ASN A 125 3.332 -4.174 -1.994 1.00 25.11 H new ATOM 0 HD22 ASN A 125 4.855 -5.046 -2.196 1.00 25.11 H new ATOM 1976 N SER A 126 5.564 -5.513 3.216 1.00 64.21 N ATOM 1977 CA SER A 126 5.272 -4.973 4.538 1.00 53.10 C ATOM 1978 C SER A 126 4.039 -4.075 4.496 1.00 41.54 C ATOM 1979 O SER A 126 3.633 -3.609 3.432 1.00 75.14 O ATOM 1980 CB SER A 126 6.472 -4.186 5.068 1.00 24.14 C ATOM 1981 OG SER A 126 6.652 -4.403 6.456 1.00 51.35 O ATOM 0 H SER A 126 6.513 -5.333 2.887 1.00 64.21 H new ATOM 0 HA SER A 126 5.070 -5.808 5.209 1.00 53.10 H new ATOM 0 HB2 SER A 126 7.372 -4.484 4.531 1.00 24.14 H new ATOM 0 HB3 SER A 126 6.325 -3.123 4.879 1.00 24.14 H new ATOM 0 HG SER A 126 7.426 -3.890 6.770 1.00 51.35 H new ATOM 1987 N GLN A 127 3.448 -3.838 5.663 1.00 14.03 N ATOM 1988 CA GLN A 127 2.260 -2.997 5.760 1.00 73.03 C ATOM 1989 C GLN A 127 2.371 -2.034 6.939 1.00 20.23 C ATOM 1990 O GLN A 127 2.425 -0.818 6.757 1.00 33.33 O ATOM 1991 CB GLN A 127 1.008 -3.861 5.909 1.00 2.12 C ATOM 1992 CG GLN A 127 -0.287 -3.067 5.872 1.00 4.25 C ATOM 1993 CD GLN A 127 -1.491 -3.929 5.546 1.00 10.24 C ATOM 1994 OE1 GLN A 127 -2.231 -3.652 4.601 1.00 71.01 O ATOM 1995 NE2 GLN A 127 -1.696 -4.982 6.329 1.00 13.21 N ATOM 0 H GLN A 127 3.772 -4.216 6.553 1.00 14.03 H new ATOM 0 HA GLN A 127 2.182 -2.414 4.843 1.00 73.03 H new ATOM 0 HB2 GLN A 127 0.992 -4.603 5.111 1.00 2.12 H new ATOM 0 HB3 GLN A 127 1.063 -4.407 6.851 1.00 2.12 H new ATOM 0 HG2 GLN A 127 -0.441 -2.585 6.837 1.00 4.25 H new ATOM 0 HG3 GLN A 127 -0.201 -2.274 5.130 1.00 4.25 H new ATOM 0 HE21 GLN A 127 -1.058 -5.175 7.101 1.00 13.21 H new ATOM 0 HE22 GLN A 127 -2.491 -5.598 6.158 1.00 13.21 H new ATOM 2004 N VAL A 128 2.403 -2.587 8.147 1.00 33.40 N ATOM 2005 CA VAL A 128 2.507 -1.777 9.355 1.00 73.13 C ATOM 2006 C VAL A 128 3.556 -2.342 10.307 1.00 4.24 C ATOM 2007 O VAL A 128 3.685 -3.558 10.453 1.00 20.51 O ATOM 2008 CB VAL A 128 1.157 -1.689 10.091 1.00 23.41 C ATOM 2009 CG1 VAL A 128 0.757 -3.052 10.637 1.00 32.45 C ATOM 2010 CG2 VAL A 128 1.224 -0.658 11.206 1.00 32.03 C ATOM 0 H VAL A 128 2.358 -3.592 8.315 1.00 33.40 H new ATOM 0 HA VAL A 128 2.806 -0.777 9.040 1.00 73.13 H new ATOM 0 HB VAL A 128 0.395 -1.371 9.379 1.00 23.41 H new ATOM 0 HG11 VAL A 128 -0.199 -2.971 11.154 1.00 32.45 H new ATOM 0 HG12 VAL A 128 0.666 -3.761 9.814 1.00 32.45 H new ATOM 0 HG13 VAL A 128 1.518 -3.402 11.335 1.00 32.45 H new ATOM 0 HG21 VAL A 128 0.261 -0.609 11.715 1.00 32.03 H new ATOM 0 HG22 VAL A 128 1.998 -0.943 11.919 1.00 32.03 H new ATOM 0 HG23 VAL A 128 1.461 0.319 10.785 1.00 32.03 H new ATOM 2020 N SER A 129 4.302 -1.452 10.952 1.00 60.52 N ATOM 2021 CA SER A 129 5.344 -1.862 11.888 1.00 1.45 C ATOM 2022 C SER A 129 5.690 -0.727 12.846 1.00 13.24 C ATOM 2023 O SER A 129 6.158 0.333 12.427 1.00 5.51 O ATOM 2024 CB SER A 129 6.596 -2.303 11.129 1.00 63.11 C ATOM 2025 OG SER A 129 6.840 -3.688 11.310 1.00 24.50 O ATOM 0 H SER A 129 4.205 -0.442 10.844 1.00 60.52 H new ATOM 0 HA SER A 129 4.966 -2.703 12.469 1.00 1.45 H new ATOM 0 HB2 SER A 129 6.477 -2.087 10.067 1.00 63.11 H new ATOM 0 HB3 SER A 129 7.456 -1.730 11.476 1.00 63.11 H new ATOM 0 HG SER A 129 6.981 -4.112 10.438 1.00 24.50 H new ATOM 2031 N GLN A 130 5.457 -0.956 14.134 1.00 4.45 N ATOM 2032 CA GLN A 130 5.743 0.048 15.153 1.00 63.02 C ATOM 2033 C GLN A 130 5.872 -0.596 16.529 1.00 41.33 C ATOM 2034 O GLN A 130 5.102 -1.487 16.883 1.00 51.12 O ATOM 2035 CB GLN A 130 4.644 1.111 15.175 1.00 3.12 C ATOM 2036 CG GLN A 130 5.079 2.424 15.805 1.00 70.22 C ATOM 2037 CD GLN A 130 4.029 3.005 16.729 1.00 4.54 C ATOM 2038 OE1 GLN A 130 2.875 3.188 16.340 1.00 21.02 O ATOM 2039 NE2 GLN A 130 4.422 3.297 17.963 1.00 13.12 N ATOM 0 H GLN A 130 5.071 -1.828 14.497 1.00 4.45 H new ATOM 0 HA GLN A 130 6.692 0.523 14.903 1.00 63.02 H new ATOM 0 HB2 GLN A 130 4.313 1.300 14.154 1.00 3.12 H new ATOM 0 HB3 GLN A 130 3.785 0.722 15.722 1.00 3.12 H new ATOM 0 HG2 GLN A 130 6.002 2.266 16.364 1.00 70.22 H new ATOM 0 HG3 GLN A 130 5.302 3.144 15.017 1.00 70.22 H new ATOM 0 HE21 GLN A 130 5.388 3.129 18.244 1.00 13.12 H new ATOM 0 HE22 GLN A 130 3.758 3.689 18.630 1.00 13.12 H new ATOM 2048 N ASN A 131 6.852 -0.138 17.301 1.00 73.43 N ATOM 2049 CA ASN A 131 7.084 -0.669 18.640 1.00 5.13 C ATOM 2050 C ASN A 131 7.376 0.455 19.629 1.00 23.20 C ATOM 2051 O ASN A 131 7.951 1.481 19.265 1.00 14.11 O ATOM 2052 CB ASN A 131 8.245 -1.664 18.622 1.00 65.13 C ATOM 2053 CG ASN A 131 7.813 -3.066 19.010 1.00 13.42 C ATOM 2054 OD1 ASN A 131 7.966 -3.478 20.160 1.00 1.01 O ATOM 2055 ND2 ASN A 131 7.270 -3.804 18.049 1.00 33.00 N ATOM 0 H ASN A 131 7.499 0.600 17.022 1.00 73.43 H new ATOM 0 HA ASN A 131 6.179 -1.184 18.962 1.00 5.13 H new ATOM 0 HB2 ASN A 131 8.686 -1.686 17.625 1.00 65.13 H new ATOM 0 HB3 ASN A 131 9.022 -1.324 19.307 1.00 65.13 H new ATOM 0 HD21 ASN A 131 6.960 -4.755 18.250 1.00 33.00 H new ATOM 0 HD22 ASN A 131 7.163 -3.420 17.110 1.00 33.00 H new ATOM 2062 N TYR A 132 6.979 0.252 20.880 1.00 13.21 N ATOM 2063 CA TYR A 132 7.198 1.250 21.921 1.00 1.22 C ATOM 2064 C TYR A 132 8.276 0.790 22.897 1.00 51.54 C ATOM 2065 O TYR A 132 7.968 0.053 23.833 1.00 74.34 O ATOM 2066 CB TYR A 132 5.895 1.523 22.675 1.00 55.12 C ATOM 2067 CG TYR A 132 5.359 2.922 22.469 1.00 30.35 C ATOM 2068 CD1 TYR A 132 5.084 3.401 21.194 1.00 1.11 C ATOM 2069 CD2 TYR A 132 5.126 3.765 23.549 1.00 20.13 C ATOM 2070 CE1 TYR A 132 4.595 4.678 21.000 1.00 75.12 C ATOM 2071 CE2 TYR A 132 4.635 5.043 23.365 1.00 74.35 C ATOM 2072 CZ TYR A 132 4.372 5.496 22.089 1.00 2.21 C ATOM 2073 OH TYR A 132 3.884 6.769 21.901 1.00 3.11 O ATOM 0 H TYR A 132 6.505 -0.593 21.198 1.00 13.21 H new ATOM 0 HA TYR A 132 7.534 2.170 21.443 1.00 1.22 H new ATOM 0 HB2 TYR A 132 5.142 0.803 22.354 1.00 55.12 H new ATOM 0 HB3 TYR A 132 6.060 1.359 23.740 1.00 55.12 H new ATOM 0 HD1 TYR A 132 5.256 2.763 20.339 1.00 1.11 H new ATOM 0 HD2 TYR A 132 5.332 3.415 24.550 1.00 20.13 H new ATOM 0 HE1 TYR A 132 4.388 5.034 20.002 1.00 75.12 H new ATOM 0 HE2 TYR A 132 4.458 5.684 24.216 1.00 74.35 H new ATOM 0 HH TYR A 132 3.783 7.212 22.769 1.00 3.11 H new TER 2083 TYR A 132 HETATM 2084 C1 PIO A 300 34.304 -6.902 11.126 1.00 40.53 C HETATM 2085 C2 PIO A 300 34.730 -7.332 12.572 1.00 71.42 C HETATM 2086 C3 PIO A 300 34.395 -8.821 12.818 1.00 32.54 C HETATM 2087 C4 PIO A 300 35.076 -9.747 11.738 1.00 45.12 C HETATM 2088 C5 PIO A 300 34.612 -9.280 10.301 1.00 11.52 C HETATM 2089 C6 PIO A 300 34.928 -7.787 10.031 1.00 43.23 C HETATM 2090 O1 PIO A 300 34.623 -5.450 10.751 1.00 54.12 O HETATM 2091 O2 PIO A 300 36.115 -7.119 12.832 1.00 33.15 O HETATM 2092 O3 PIO A 300 34.814 -9.151 14.149 1.00 72.32 O HETATM 2093 O4 PIO A 300 34.680 -11.192 11.989 1.00 24.22 O HETATM 2094 O5 PIO A 300 35.292 -10.100 9.298 1.00 65.03 O HETATM 2095 O6 PIO A 300 34.401 -7.336 8.775 1.00 22.10 O HETATM 2096 P1 PIO A 300 34.151 -3.987 11.405 1.00 54.54 P HETATM 2097 O11 PIO A 300 32.821 -4.328 12.083 1.00 43.14 O HETATM 2098 O12 PIO A 300 35.298 -3.595 12.299 1.00 51.43 O HETATM 2099 O13 PIO A 300 34.019 -3.017 10.268 1.00 1.53 O HETATM 2100 P4 PIO A 300 35.109 -12.598 11.202 1.00 53.32 P HETATM 2101 O41 PIO A 300 34.488 -13.602 12.170 1.00 22.45 O HETATM 2102 O42 PIO A 300 34.439 -12.527 9.857 1.00 2.01 O HETATM 2103 O43 PIO A 300 36.620 -12.671 11.061 1.00 74.24 O HETATM 2104 P5 PIO A 300 35.030 -10.384 7.695 1.00 42.23 P HETATM 2105 O53 PIO A 300 35.709 -9.214 7.022 1.00 2.45 O HETATM 2106 O52 PIO A 300 33.513 -10.396 7.584 1.00 60.14 O HETATM 2107 O51 PIO A 300 35.755 -11.706 7.530 1.00 34.01 O HETATM 2108 C1C PIO A 300 33.400 -3.444 9.073 1.00 42.02 C HETATM 2109 C2C PIO A 300 31.861 -3.525 9.227 1.00 24.04 C HETATM 2110 C3C PIO A 300 31.240 -2.152 9.577 1.00 12.34 C HETATM 2111 O2C PIO A 300 31.309 -3.983 8.003 1.00 33.43 O HETATM 2112 O3C PIO A 300 32.030 -1.126 9.012 1.00 73.14 O HETATM 2113 C1A PIO A 300 30.127 -4.759 8.068 1.00 54.54 C HETATM 2114 O1A PIO A 300 29.084 -4.329 7.629 1.00 2.33 O HETATM 2115 C2A PIO A 300 30.172 -6.167 8.689 1.00 53.24 C HETATM 2116 C3A PIO A 300 29.327 -7.145 7.852 1.00 23.22 C HETATM 2117 C4A PIO A 300 29.711 -8.592 8.212 1.00 13.11 C HETATM 2118 C5A PIO A 300 29.264 -8.900 9.654 1.00 34.34 C HETATM 2119 C6A PIO A 300 30.385 -9.653 10.391 1.00 73.43 C HETATM 2120 C7A PIO A 300 30.225 -11.167 10.160 1.00 62.55 C HETATM 2121 C8A PIO A 300 31.444 -11.908 10.743 1.00 53.42 C HETATM 2122 C1B PIO A 300 32.708 -0.182 9.809 1.00 14.22 C HETATM 2123 O1B PIO A 300 33.403 -0.459 10.768 1.00 70.23 O HETATM 2124 C2B PIO A 300 32.470 1.306 9.426 1.00 50.21 C HETATM 2125 C3B PIO A 300 33.279 1.759 8.199 1.00 52.00 C HETATM 2126 C4B PIO A 300 34.785 1.805 8.513 1.00 31.21 C HETATM 2127 C5B PIO A 300 35.578 1.349 7.273 1.00 51.12 C HETATM 2128 C6B PIO A 300 36.475 2.502 6.787 1.00 24.31 C HETATM 2129 C7B PIO A 300 36.943 2.216 5.348 1.00 73.21 C HETATM 2130 C8B PIO A 300 36.197 3.148 4.373 1.00 64.31 C HETATM 0 H8BB PIO A 300 35.124 2.970 4.449 1.00 64.31 H new HETATM 0 H8BA PIO A 300 36.412 4.186 4.626 1.00 64.31 H new HETATM 0 H8AB PIO A 300 32.352 -11.560 10.250 1.00 53.42 H new HETATM 0 H8AA PIO A 300 31.513 -11.709 11.813 1.00 53.42 H new HETATM 0 H7BA PIO A 300 38.019 2.371 5.266 1.00 73.21 H new HETATM 0 H7AA PIO A 300 29.310 -11.523 10.633 1.00 62.55 H new HETATM 0 H6BA PIO A 300 35.927 3.443 6.822 1.00 24.31 H new HETATM 0 H6AA PIO A 300 31.359 -9.320 10.031 1.00 73.43 H new HETATM 0 H5BA PIO A 300 36.187 0.478 7.517 1.00 51.12 H new HETATM 0 H5AA PIO A 300 29.028 -7.974 10.178 1.00 34.34 H new HETATM 0 H4BA PIO A 300 35.079 2.816 8.795 1.00 31.21 H new HETATM 0 H4AA PIO A 300 29.240 -9.288 7.518 1.00 13.11 H new HETATM 0 H3CA PIO A 300 30.220 -2.093 9.196 1.00 12.34 H new HETATM 0 H3BA PIO A 300 33.098 1.076 7.369 1.00 52.00 H new HETATM 0 H3AA PIO A 300 28.266 -6.981 8.042 1.00 23.22 H new HETATM 0 H2BA PIO A 300 31.409 1.457 9.228 1.00 50.21 H new HETATM 0 H2AA PIO A 300 31.203 -6.517 8.740 1.00 53.24 H new HETATM 0 H1CA PIO A 300 33.650 -2.755 8.266 1.00 42.02 H new HETATM 0 HO6 PIO A 300 33.897 -8.062 8.352 1.00 22.10 H new HETATM 0 HO3 PIO A 300 34.611 -10.092 14.332 1.00 72.32 H new HETATM 0 HO2 PIO A 300 36.402 -7.697 13.570 1.00 33.15 H new HETATM 0 H8B PIO A 300 36.527 2.947 3.354 1.00 64.31 H new HETATM 0 H8A PIO A 300 31.331 -12.980 10.580 1.00 53.42 H new HETATM 0 H7B PIO A 300 36.751 1.174 5.092 1.00 73.21 H new HETATM 0 H7A PIO A 300 30.135 -11.375 9.094 1.00 62.55 H new HETATM 0 H6B PIO A 300 37.336 2.610 7.446 1.00 24.31 H new HETATM 0 H6A PIO A 300 30.347 -9.431 11.457 1.00 73.43 H new HETATM 0 H6 PIO A 300 36.015 -7.704 10.020 1.00 43.23 H new HETATM 0 H5B PIO A 300 34.893 1.047 6.480 1.00 51.12 H new HETATM 0 H5A PIO A 300 28.354 -9.501 9.643 1.00 34.34 H new HETATM 0 H5 PIO A 300 33.530 -9.401 10.245 1.00 11.52 H new HETATM 0 H4B PIO A 300 35.011 1.159 9.361 1.00 31.21 H new HETATM 0 H4A PIO A 300 30.788 -8.728 8.117 1.00 13.11 H new HETATM 0 H4 PIO A 300 36.161 -9.671 11.803 1.00 45.12 H new HETATM 0 H3C PIO A 300 31.184 -2.030 10.659 1.00 12.34 H new HETATM 0 H3B PIO A 300 32.941 2.745 7.881 1.00 52.00 H new HETATM 0 H3A PIO A 300 29.492 -6.967 6.789 1.00 23.22 H new HETATM 0 H3 PIO A 300 33.322 -8.987 12.722 1.00 32.54 H new HETATM 0 H2C PIO A 300 31.635 -4.210 10.044 1.00 24.04 H new HETATM 0 H2B PIO A 300 32.729 1.938 10.276 1.00 50.21 H new HETATM 0 H2A PIO A 300 29.796 -6.134 9.712 1.00 53.24 H new HETATM 0 H2 PIO A 300 34.163 -6.699 13.254 1.00 71.42 H new HETATM 0 H1C PIO A 300 33.790 -4.422 8.789 1.00 42.02 H new HETATM 0 H1 PIO A 300 33.221 -7.022 11.167 1.00 40.53 H new