ATOM 1 N MET A 1 2.400 -8.457 -1.710 1.00 2.16 N ATOM 2 CA MET A 1 1.011 -9.007 -1.705 1.00 1.81 C ATOM 3 C MET A 1 0.016 -7.951 -2.203 1.00 1.52 C ATOM 4 O MET A 1 0.049 -6.808 -1.784 1.00 1.58 O ATOM 5 CB MET A 1 0.732 -9.370 -0.247 1.00 1.96 C ATOM 6 CG MET A 1 -0.112 -10.640 -0.196 1.00 2.30 C ATOM 7 SD MET A 1 0.584 -11.775 1.027 1.00 2.92 S ATOM 8 CE MET A 1 -0.526 -13.161 0.684 1.00 3.09 C ATOM 9 HA MET A 1 0.959 -9.891 -2.319 1.00 1.95 H ATOM 10 HB2 MET A 1 1.667 -9.536 0.268 1.00 2.18 H ATOM 11 HB3 MET A 1 0.196 -8.564 0.231 1.00 2.06 H ATOM 12 HG2 MET A 1 -1.126 -10.391 0.080 1.00 2.86 H ATOM 13 HG3 MET A 1 -0.108 -11.113 -1.168 1.00 2.31 H ATOM 14 HE1 MET A 1 -0.587 -13.796 1.555 1.00 3.40 H ATOM 15 HE2 MET A 1 -0.143 -13.729 -0.149 1.00 3.31 H ATOM 16 HE3 MET A 1 -1.506 -12.779 0.436 1.00 3.39 H ATOM 17 N ASP A 2 -0.867 -8.329 -3.096 1.00 1.38 N ATOM 18 CA ASP A 2 -1.863 -7.349 -3.630 1.00 1.15 C ATOM 19 C ASP A 2 -3.254 -7.989 -3.730 1.00 0.98 C ATOM 20 O ASP A 2 -3.413 -9.082 -4.243 1.00 1.23 O ATOM 21 CB ASP A 2 -1.340 -6.974 -5.017 1.00 1.40 C ATOM 22 CG ASP A 2 -1.889 -5.603 -5.419 1.00 1.28 C ATOM 23 OD1 ASP A 2 -1.315 -4.612 -4.998 1.00 1.28 O ATOM 24 OD2 ASP A 2 -2.873 -5.569 -6.140 1.00 1.33 O ATOM 25 H ASP A 2 -0.871 -9.254 -3.421 1.00 1.54 H ATOM 26 HA ASP A 2 -1.899 -6.474 -3.003 1.00 1.05 H ATOM 27 HB2 ASP A 2 -0.259 -6.937 -4.995 1.00 1.61 H ATOM 28 HB3 ASP A 2 -1.658 -7.714 -5.737 1.00 1.54 H ATOM 29 N HIS A 3 -4.260 -7.308 -3.237 1.00 0.75 N ATOM 30 CA HIS A 3 -5.652 -7.853 -3.287 1.00 0.71 C ATOM 31 C HIS A 3 -6.538 -7.003 -4.209 1.00 0.81 C ATOM 32 O HIS A 3 -6.094 -6.030 -4.789 1.00 0.90 O ATOM 33 CB HIS A 3 -6.151 -7.764 -1.843 1.00 0.61 C ATOM 34 CG HIS A 3 -6.014 -9.106 -1.179 1.00 0.65 C ATOM 35 ND1 HIS A 3 -4.789 -9.611 -0.771 1.00 1.36 N ATOM 36 CD2 HIS A 3 -6.941 -10.059 -0.845 1.00 1.00 C ATOM 37 CE1 HIS A 3 -5.010 -10.816 -0.218 1.00 1.54 C ATOM 38 NE2 HIS A 3 -6.306 -11.139 -0.237 1.00 1.24 N ATOM 39 H HIS A 3 -4.098 -6.432 -2.829 1.00 0.81 H ATOM 40 HA HIS A 3 -5.646 -8.881 -3.610 1.00 0.83 H ATOM 41 HB2 HIS A 3 -5.564 -7.034 -1.304 1.00 0.81 H ATOM 42 HB3 HIS A 3 -7.189 -7.465 -1.838 1.00 0.80 H ATOM 43 HD1 HIS A 3 -3.919 -9.172 -0.870 1.00 1.88 H ATOM 44 HD2 HIS A 3 -8.002 -9.983 -1.028 1.00 1.55 H ATOM 45 HE1 HIS A 3 -4.237 -11.445 0.196 1.00 2.16 H ATOM 46 N SER A 4 -7.791 -7.365 -4.342 1.00 0.90 N ATOM 47 CA SER A 4 -8.718 -6.583 -5.220 1.00 1.07 C ATOM 48 C SER A 4 -9.376 -5.447 -4.422 1.00 1.02 C ATOM 49 O SER A 4 -9.457 -4.326 -4.885 1.00 1.07 O ATOM 50 CB SER A 4 -9.766 -7.592 -5.688 1.00 1.28 C ATOM 51 OG SER A 4 -9.132 -8.607 -6.449 1.00 2.18 O ATOM 52 H SER A 4 -8.123 -8.152 -3.861 1.00 0.90 H ATOM 53 HA SER A 4 -8.186 -6.187 -6.070 1.00 1.15 H ATOM 54 HB2 SER A 4 -10.245 -8.040 -4.832 1.00 1.82 H ATOM 55 HB3 SER A 4 -10.508 -7.086 -6.293 1.00 1.12 H ATOM 56 HG SER A 4 -9.775 -9.301 -6.610 1.00 2.49 H ATOM 57 N LEU A 5 -9.843 -5.732 -3.229 1.00 0.99 N ATOM 58 CA LEU A 5 -10.493 -4.668 -2.396 1.00 1.04 C ATOM 59 C LEU A 5 -9.482 -4.074 -1.404 1.00 0.88 C ATOM 60 O LEU A 5 -9.471 -2.882 -1.161 1.00 0.92 O ATOM 61 CB LEU A 5 -11.624 -5.377 -1.637 1.00 1.20 C ATOM 62 CG LEU A 5 -12.953 -5.229 -2.391 1.00 1.45 C ATOM 63 CD1 LEU A 5 -13.352 -3.751 -2.467 1.00 1.60 C ATOM 64 CD2 LEU A 5 -12.811 -5.795 -3.808 1.00 1.50 C ATOM 65 H LEU A 5 -9.763 -6.644 -2.877 1.00 1.00 H ATOM 66 HA LEU A 5 -10.900 -3.894 -3.027 1.00 1.14 H ATOM 67 HB2 LEU A 5 -11.384 -6.425 -1.535 1.00 1.15 H ATOM 68 HB3 LEU A 5 -11.723 -4.937 -0.655 1.00 1.23 H ATOM 69 HG LEU A 5 -13.722 -5.775 -1.863 1.00 1.55 H ATOM 70 HD11 LEU A 5 -14.192 -3.639 -3.137 1.00 1.99 H ATOM 71 HD12 LEU A 5 -12.520 -3.170 -2.834 1.00 1.94 H ATOM 72 HD13 LEU A 5 -13.628 -3.402 -1.483 1.00 1.79 H ATOM 73 HD21 LEU A 5 -13.785 -6.068 -4.185 1.00 1.92 H ATOM 74 HD22 LEU A 5 -12.176 -6.667 -3.784 1.00 1.65 H ATOM 75 HD23 LEU A 5 -12.372 -5.047 -4.452 1.00 1.61 H ATOM 76 N ASN A 6 -8.640 -4.903 -0.829 1.00 0.77 N ATOM 77 CA ASN A 6 -7.627 -4.403 0.155 1.00 0.69 C ATOM 78 C ASN A 6 -6.645 -3.437 -0.521 1.00 0.58 C ATOM 79 O ASN A 6 -6.327 -2.392 0.017 1.00 0.64 O ATOM 80 CB ASN A 6 -6.895 -5.655 0.647 1.00 0.66 C ATOM 81 CG ASN A 6 -7.102 -5.815 2.154 1.00 1.11 C ATOM 82 OD1 ASN A 6 -7.986 -6.530 2.585 1.00 1.49 O ATOM 83 ND2 ASN A 6 -6.316 -5.177 2.977 1.00 1.50 N ATOM 84 H ASN A 6 -8.679 -5.858 -1.043 1.00 0.81 H ATOM 85 HA ASN A 6 -8.119 -3.917 0.984 1.00 0.81 H ATOM 86 HB2 ASN A 6 -7.284 -6.524 0.137 1.00 0.76 H ATOM 87 HB3 ASN A 6 -5.841 -5.559 0.440 1.00 0.77 H ATOM 88 HD21 ASN A 6 -5.603 -4.601 2.628 1.00 1.61 H ATOM 89 HD22 ASN A 6 -6.438 -5.275 3.944 1.00 1.89 H ATOM 90 N SER A 7 -6.164 -3.775 -1.695 1.00 0.54 N ATOM 91 CA SER A 7 -5.206 -2.870 -2.403 1.00 0.51 C ATOM 92 C SER A 7 -5.915 -1.589 -2.861 1.00 0.52 C ATOM 93 O SER A 7 -5.336 -0.523 -2.848 1.00 0.54 O ATOM 94 CB SER A 7 -4.707 -3.661 -3.613 1.00 0.59 C ATOM 95 OG SER A 7 -3.499 -3.078 -4.085 1.00 0.74 O ATOM 96 H SER A 7 -6.436 -4.622 -2.110 1.00 0.60 H ATOM 97 HA SER A 7 -4.376 -2.628 -1.759 1.00 0.52 H ATOM 98 HB2 SER A 7 -4.520 -4.681 -3.329 1.00 0.67 H ATOM 99 HB3 SER A 7 -5.458 -3.638 -4.392 1.00 0.65 H ATOM 100 HG SER A 7 -3.354 -3.383 -4.984 1.00 1.12 H ATOM 101 N LEU A 8 -7.165 -1.683 -3.259 1.00 0.58 N ATOM 102 CA LEU A 8 -7.908 -0.463 -3.712 1.00 0.64 C ATOM 103 C LEU A 8 -7.990 0.554 -2.566 1.00 0.58 C ATOM 104 O LEU A 8 -7.704 1.723 -2.745 1.00 0.59 O ATOM 105 CB LEU A 8 -9.308 -0.953 -4.096 1.00 0.80 C ATOM 106 CG LEU A 8 -9.917 -0.005 -5.134 1.00 1.18 C ATOM 107 CD1 LEU A 8 -10.177 -0.770 -6.437 1.00 1.41 C ATOM 108 CD2 LEU A 8 -11.235 0.563 -4.597 1.00 1.68 C ATOM 109 H LEU A 8 -7.614 -2.555 -3.259 1.00 0.63 H ATOM 110 HA LEU A 8 -7.423 -0.024 -4.569 1.00 0.67 H ATOM 111 HB2 LEU A 8 -9.238 -1.948 -4.511 1.00 0.73 H ATOM 112 HB3 LEU A 8 -9.936 -0.974 -3.218 1.00 0.92 H ATOM 113 HG LEU A 8 -9.228 0.804 -5.328 1.00 1.50 H ATOM 114 HD11 LEU A 8 -11.191 -0.598 -6.763 1.00 1.81 H ATOM 115 HD12 LEU A 8 -10.026 -1.827 -6.272 1.00 1.82 H ATOM 116 HD13 LEU A 8 -9.492 -0.424 -7.198 1.00 1.88 H ATOM 117 HD21 LEU A 8 -11.905 -0.248 -4.352 1.00 1.91 H ATOM 118 HD22 LEU A 8 -11.690 1.191 -5.348 1.00 2.14 H ATOM 119 HD23 LEU A 8 -11.039 1.148 -3.710 1.00 2.10 H ATOM 120 N ASN A 9 -8.365 0.108 -1.389 1.00 0.59 N ATOM 121 CA ASN A 9 -8.452 1.038 -0.221 1.00 0.60 C ATOM 122 C ASN A 9 -7.057 1.573 0.124 1.00 0.51 C ATOM 123 O ASN A 9 -6.892 2.737 0.439 1.00 0.57 O ATOM 124 CB ASN A 9 -9.003 0.192 0.933 1.00 0.67 C ATOM 125 CG ASN A 9 -10.528 0.108 0.829 1.00 0.78 C ATOM 126 OD1 ASN A 9 -11.054 -0.729 0.123 1.00 1.04 O ATOM 127 ND2 ASN A 9 -11.264 0.948 1.507 1.00 1.09 N ATOM 128 H ASN A 9 -8.577 -0.842 -1.275 1.00 0.64 H ATOM 129 HA ASN A 9 -9.126 1.852 -0.436 1.00 0.64 H ATOM 130 HB2 ASN A 9 -8.582 -0.803 0.885 1.00 0.74 H ATOM 131 HB3 ASN A 9 -8.734 0.649 1.874 1.00 0.76 H ATOM 132 HD21 ASN A 9 -10.840 1.622 2.078 1.00 1.39 H ATOM 133 HD22 ASN A 9 -12.241 0.902 1.447 1.00 1.23 H ATOM 134 N ASN A 10 -6.051 0.732 0.052 1.00 0.43 N ATOM 135 CA ASN A 10 -4.661 1.186 0.361 1.00 0.39 C ATOM 136 C ASN A 10 -4.184 2.180 -0.707 1.00 0.35 C ATOM 137 O ASN A 10 -3.599 3.195 -0.397 1.00 0.37 O ATOM 138 CB ASN A 10 -3.804 -0.085 0.335 1.00 0.41 C ATOM 139 CG ASN A 10 -2.357 0.258 0.705 1.00 0.45 C ATOM 140 OD1 ASN A 10 -1.975 0.176 1.856 1.00 0.54 O ATOM 141 ND2 ASN A 10 -1.530 0.643 -0.230 1.00 0.54 N ATOM 142 H ASN A 10 -6.211 -0.199 -0.214 1.00 0.46 H ATOM 143 HA ASN A 10 -4.621 1.637 1.339 1.00 0.42 H ATOM 144 HB2 ASN A 10 -4.198 -0.798 1.044 1.00 0.47 H ATOM 145 HB3 ASN A 10 -3.826 -0.513 -0.656 1.00 0.44 H ATOM 146 HD21 ASN A 10 -1.835 0.710 -1.160 1.00 0.60 H ATOM 147 HD22 ASN A 10 -0.602 0.864 -0.004 1.00 0.62 H ATOM 148 N PHE A 11 -4.431 1.888 -1.963 1.00 0.37 N ATOM 149 CA PHE A 11 -3.995 2.806 -3.063 1.00 0.36 C ATOM 150 C PHE A 11 -4.561 4.220 -2.858 1.00 0.34 C ATOM 151 O PHE A 11 -3.894 5.198 -3.120 1.00 0.41 O ATOM 152 CB PHE A 11 -4.558 2.189 -4.348 1.00 0.41 C ATOM 153 CG PHE A 11 -3.643 2.497 -5.513 1.00 0.41 C ATOM 154 CD1 PHE A 11 -3.426 3.826 -5.904 1.00 0.55 C ATOM 155 CD2 PHE A 11 -3.016 1.455 -6.205 1.00 0.49 C ATOM 156 CE1 PHE A 11 -2.583 4.109 -6.984 1.00 0.62 C ATOM 157 CE2 PHE A 11 -2.172 1.740 -7.285 1.00 0.53 C ATOM 158 CZ PHE A 11 -1.956 3.067 -7.674 1.00 0.54 C ATOM 159 H PHE A 11 -4.906 1.058 -2.182 1.00 0.42 H ATOM 160 HA PHE A 11 -2.918 2.840 -3.115 1.00 0.37 H ATOM 161 HB2 PHE A 11 -4.634 1.118 -4.228 1.00 0.47 H ATOM 162 HB3 PHE A 11 -5.538 2.598 -4.544 1.00 0.46 H ATOM 163 HD1 PHE A 11 -3.910 4.631 -5.372 1.00 0.69 H ATOM 164 HD2 PHE A 11 -3.183 0.431 -5.905 1.00 0.64 H ATOM 165 HE1 PHE A 11 -2.416 5.133 -7.285 1.00 0.80 H ATOM 166 HE2 PHE A 11 -1.689 0.936 -7.819 1.00 0.66 H ATOM 167 HZ PHE A 11 -1.304 3.285 -8.508 1.00 0.62 H ATOM 168 N ASP A 12 -5.786 4.334 -2.403 1.00 0.33 N ATOM 169 CA ASP A 12 -6.393 5.689 -2.196 1.00 0.34 C ATOM 170 C ASP A 12 -5.752 6.406 -0.999 1.00 0.29 C ATOM 171 O ASP A 12 -5.239 7.503 -1.131 1.00 0.30 O ATOM 172 CB ASP A 12 -7.880 5.430 -1.932 1.00 0.41 C ATOM 173 CG ASP A 12 -8.628 5.335 -3.264 1.00 0.49 C ATOM 174 OD1 ASP A 12 -9.051 6.367 -3.758 1.00 0.76 O ATOM 175 OD2 ASP A 12 -8.764 4.232 -3.768 1.00 0.59 O ATOM 176 H ASP A 12 -6.309 3.529 -2.205 1.00 0.38 H ATOM 177 HA ASP A 12 -6.282 6.284 -3.088 1.00 0.36 H ATOM 178 HB2 ASP A 12 -7.993 4.503 -1.386 1.00 0.42 H ATOM 179 HB3 ASP A 12 -8.289 6.242 -1.349 1.00 0.56 H ATOM 180 N PHE A 13 -5.781 5.803 0.167 1.00 0.30 N ATOM 181 CA PHE A 13 -5.179 6.464 1.370 1.00 0.30 C ATOM 182 C PHE A 13 -3.661 6.633 1.194 1.00 0.26 C ATOM 183 O PHE A 13 -3.087 7.607 1.647 1.00 0.28 O ATOM 184 CB PHE A 13 -5.530 5.543 2.560 1.00 0.36 C ATOM 185 CG PHE A 13 -4.287 4.982 3.226 1.00 0.33 C ATOM 186 CD1 PHE A 13 -3.499 5.794 4.057 1.00 0.35 C ATOM 187 CD2 PHE A 13 -3.937 3.643 3.025 1.00 0.35 C ATOM 188 CE1 PHE A 13 -2.367 5.261 4.684 1.00 0.38 C ATOM 189 CE2 PHE A 13 -2.803 3.113 3.649 1.00 0.38 C ATOM 190 CZ PHE A 13 -2.019 3.921 4.480 1.00 0.37 C ATOM 191 H PHE A 13 -6.203 4.922 0.252 1.00 0.34 H ATOM 192 HA PHE A 13 -5.636 7.429 1.519 1.00 0.31 H ATOM 193 HB2 PHE A 13 -6.091 6.109 3.288 1.00 0.42 H ATOM 194 HB3 PHE A 13 -6.141 4.725 2.206 1.00 0.41 H ATOM 195 HD1 PHE A 13 -3.763 6.830 4.212 1.00 0.40 H ATOM 196 HD2 PHE A 13 -4.536 3.021 2.383 1.00 0.41 H ATOM 197 HE1 PHE A 13 -1.760 5.884 5.322 1.00 0.44 H ATOM 198 HE2 PHE A 13 -2.534 2.079 3.491 1.00 0.44 H ATOM 199 HZ PHE A 13 -1.145 3.511 4.963 1.00 0.41 H ATOM 200 N LEU A 14 -3.005 5.704 0.543 1.00 0.23 N ATOM 201 CA LEU A 14 -1.533 5.843 0.355 1.00 0.20 C ATOM 202 C LEU A 14 -1.220 6.755 -0.831 1.00 0.19 C ATOM 203 O LEU A 14 -0.205 7.401 -0.839 1.00 0.22 O ATOM 204 CB LEU A 14 -0.989 4.434 0.103 1.00 0.21 C ATOM 205 CG LEU A 14 0.319 4.209 0.889 1.00 0.23 C ATOM 206 CD1 LEU A 14 1.075 5.528 1.103 1.00 0.28 C ATOM 207 CD2 LEU A 14 -0.024 3.598 2.246 1.00 0.36 C ATOM 208 H LEU A 14 -3.479 4.925 0.181 1.00 0.25 H ATOM 209 HA LEU A 14 -1.091 6.245 1.251 1.00 0.21 H ATOM 210 HB2 LEU A 14 -1.721 3.708 0.420 1.00 0.25 H ATOM 211 HB3 LEU A 14 -0.797 4.308 -0.950 1.00 0.22 H ATOM 212 HG LEU A 14 0.953 3.532 0.340 1.00 0.24 H ATOM 213 HD11 LEU A 14 0.520 6.158 1.781 1.00 0.69 H ATOM 214 HD12 LEU A 14 1.196 6.033 0.157 1.00 0.63 H ATOM 215 HD13 LEU A 14 2.047 5.318 1.524 1.00 0.68 H ATOM 216 HD21 LEU A 14 -0.968 3.077 2.176 1.00 0.95 H ATOM 217 HD22 LEU A 14 -0.101 4.382 2.985 1.00 0.97 H ATOM 218 HD23 LEU A 14 0.749 2.905 2.534 1.00 0.91 H ATOM 219 N ALA A 15 -2.068 6.825 -1.832 1.00 0.22 N ATOM 220 CA ALA A 15 -1.765 7.727 -2.995 1.00 0.23 C ATOM 221 C ALA A 15 -1.356 9.111 -2.470 1.00 0.23 C ATOM 222 O ALA A 15 -0.303 9.630 -2.806 1.00 0.25 O ATOM 223 CB ALA A 15 -3.063 7.815 -3.803 1.00 0.28 C ATOM 224 H ALA A 15 -2.893 6.296 -1.819 1.00 0.27 H ATOM 225 HA ALA A 15 -0.977 7.306 -3.601 1.00 0.24 H ATOM 226 HB1 ALA A 15 -3.170 6.929 -4.409 1.00 0.85 H ATOM 227 HB2 ALA A 15 -3.030 8.685 -4.442 1.00 0.77 H ATOM 228 HB3 ALA A 15 -3.903 7.896 -3.129 1.00 0.79 H ATOM 229 N ARG A 16 -2.170 9.692 -1.619 1.00 0.24 N ATOM 230 CA ARG A 16 -1.828 11.030 -1.033 1.00 0.27 C ATOM 231 C ARG A 16 -0.609 10.907 -0.102 1.00 0.25 C ATOM 232 O ARG A 16 0.239 11.779 -0.065 1.00 0.31 O ATOM 233 CB ARG A 16 -3.068 11.501 -0.245 1.00 0.31 C ATOM 234 CG ARG A 16 -3.626 10.379 0.651 1.00 0.33 C ATOM 235 CD ARG A 16 -3.308 10.660 2.127 1.00 0.46 C ATOM 236 NE ARG A 16 -4.099 11.875 2.490 1.00 0.83 N ATOM 237 CZ ARG A 16 -4.607 11.989 3.693 1.00 1.74 C ATOM 238 NH1 ARG A 16 -5.791 11.498 3.953 1.00 2.49 N ATOM 239 NH2 ARG A 16 -3.928 12.600 4.633 1.00 2.47 N ATOM 240 H ARG A 16 -2.998 9.236 -1.355 1.00 0.27 H ATOM 241 HA ARG A 16 -1.614 11.732 -1.825 1.00 0.30 H ATOM 242 HB2 ARG A 16 -2.796 12.344 0.371 1.00 0.34 H ATOM 243 HB3 ARG A 16 -3.833 11.808 -0.944 1.00 0.35 H ATOM 244 HG2 ARG A 16 -4.696 10.317 0.522 1.00 0.49 H ATOM 245 HG3 ARG A 16 -3.180 9.440 0.372 1.00 0.37 H ATOM 246 HD2 ARG A 16 -3.613 9.818 2.735 1.00 0.53 H ATOM 247 HD3 ARG A 16 -2.254 10.850 2.254 1.00 0.62 H ATOM 248 HE ARG A 16 -4.233 12.591 1.835 1.00 0.85 H ATOM 249 HH11 ARG A 16 -6.309 11.034 3.236 1.00 2.59 H ATOM 250 HH12 ARG A 16 -6.179 11.587 4.872 1.00 3.25 H ATOM 251 HH21 ARG A 16 -3.023 12.976 4.432 1.00 2.57 H ATOM 252 HH22 ARG A 16 -4.313 12.689 5.553 1.00 3.22 H ATOM 253 N SER A 17 -0.517 9.831 0.648 1.00 0.23 N ATOM 254 CA SER A 17 0.645 9.648 1.578 1.00 0.25 C ATOM 255 C SER A 17 1.929 9.308 0.802 1.00 0.24 C ATOM 256 O SER A 17 3.011 9.662 1.218 1.00 0.33 O ATOM 257 CB SER A 17 0.247 8.487 2.492 1.00 0.27 C ATOM 258 OG SER A 17 -0.282 9.004 3.706 1.00 0.65 O ATOM 259 H SER A 17 -1.214 9.142 0.599 1.00 0.24 H ATOM 260 HA SER A 17 0.791 10.539 2.168 1.00 0.29 H ATOM 261 HB2 SER A 17 -0.504 7.884 2.008 1.00 0.56 H ATOM 262 HB3 SER A 17 1.117 7.876 2.697 1.00 0.47 H ATOM 263 HG SER A 17 -0.561 8.261 4.247 1.00 1.02 H ATOM 264 N PHE A 18 1.817 8.631 -0.319 1.00 0.22 N ATOM 265 CA PHE A 18 3.030 8.272 -1.124 1.00 0.22 C ATOM 266 C PHE A 18 3.806 9.549 -1.465 1.00 0.24 C ATOM 267 O PHE A 18 5.004 9.631 -1.270 1.00 0.30 O ATOM 268 CB PHE A 18 2.501 7.617 -2.409 1.00 0.23 C ATOM 269 CG PHE A 18 2.509 6.109 -2.270 1.00 0.22 C ATOM 270 CD1 PHE A 18 3.715 5.419 -2.085 1.00 0.24 C ATOM 271 CD2 PHE A 18 1.304 5.398 -2.328 1.00 0.23 C ATOM 272 CE1 PHE A 18 3.712 4.022 -1.957 1.00 0.25 C ATOM 273 CE2 PHE A 18 1.305 4.006 -2.201 1.00 0.23 C ATOM 274 CZ PHE A 18 2.504 3.318 -2.016 1.00 0.23 C ATOM 275 H PHE A 18 0.931 8.359 -0.634 1.00 0.28 H ATOM 276 HA PHE A 18 3.650 7.576 -0.579 1.00 0.22 H ATOM 277 HB2 PHE A 18 1.493 7.955 -2.593 1.00 0.25 H ATOM 278 HB3 PHE A 18 3.130 7.902 -3.238 1.00 0.26 H ATOM 279 HD1 PHE A 18 4.646 5.964 -2.040 1.00 0.29 H ATOM 280 HD2 PHE A 18 0.374 5.925 -2.473 1.00 0.27 H ATOM 281 HE1 PHE A 18 4.645 3.491 -1.812 1.00 0.31 H ATOM 282 HE2 PHE A 18 0.376 3.461 -2.244 1.00 0.27 H ATOM 283 HZ PHE A 18 2.494 2.241 -1.922 1.00 0.26 H ATOM 284 N ALA A 19 3.116 10.555 -1.961 1.00 0.25 N ATOM 285 CA ALA A 19 3.795 11.844 -2.303 1.00 0.28 C ATOM 286 C ALA A 19 4.307 12.525 -1.024 1.00 0.28 C ATOM 287 O ALA A 19 5.374 13.110 -1.011 1.00 0.34 O ATOM 288 CB ALA A 19 2.722 12.700 -2.980 1.00 0.32 C ATOM 289 H ALA A 19 2.146 10.461 -2.096 1.00 0.27 H ATOM 290 HA ALA A 19 4.611 11.668 -2.985 1.00 0.30 H ATOM 291 HB1 ALA A 19 1.826 12.697 -2.378 1.00 1.09 H ATOM 292 HB2 ALA A 19 2.502 12.294 -3.956 1.00 1.05 H ATOM 293 HB3 ALA A 19 3.084 13.713 -3.086 1.00 1.01 H ATOM 294 N ARG A 20 3.558 12.437 0.055 1.00 0.27 N ATOM 295 CA ARG A 20 4.003 13.063 1.342 1.00 0.30 C ATOM 296 C ARG A 20 5.235 12.325 1.888 1.00 0.29 C ATOM 297 O ARG A 20 6.141 12.931 2.431 1.00 0.35 O ATOM 298 CB ARG A 20 2.818 12.906 2.298 1.00 0.34 C ATOM 299 CG ARG A 20 3.013 13.827 3.507 1.00 0.54 C ATOM 300 CD ARG A 20 2.754 13.043 4.798 1.00 0.89 C ATOM 301 NE ARG A 20 4.099 12.843 5.416 1.00 1.01 N ATOM 302 CZ ARG A 20 4.305 11.834 6.225 1.00 1.08 C ATOM 303 NH1 ARG A 20 4.055 11.960 7.503 1.00 1.25 N ATOM 304 NH2 ARG A 20 4.766 10.705 5.754 1.00 1.67 N ATOM 305 H ARG A 20 2.708 11.951 0.019 1.00 0.29 H ATOM 306 HA ARG A 20 4.223 14.108 1.198 1.00 0.34 H ATOM 307 HB2 ARG A 20 1.904 13.173 1.785 1.00 0.52 H ATOM 308 HB3 ARG A 20 2.757 11.882 2.633 1.00 0.48 H ATOM 309 HG2 ARG A 20 4.024 14.208 3.510 1.00 0.67 H ATOM 310 HG3 ARG A 20 2.320 14.653 3.445 1.00 0.80 H ATOM 311 HD2 ARG A 20 2.117 13.614 5.458 1.00 1.20 H ATOM 312 HD3 ARG A 20 2.304 12.087 4.574 1.00 1.27 H ATOM 313 HE ARG A 20 4.827 13.467 5.220 1.00 1.43 H ATOM 314 HH11 ARG A 20 3.705 12.826 7.861 1.00 1.55 H ATOM 315 HH12 ARG A 20 4.210 11.190 8.122 1.00 1.49 H ATOM 316 HH21 ARG A 20 4.959 10.614 4.778 1.00 2.08 H ATOM 317 HH22 ARG A 20 4.923 9.931 6.369 1.00 1.93 H ATOM 318 N MET A 21 5.274 11.022 1.735 1.00 0.28 N ATOM 319 CA MET A 21 6.444 10.227 2.228 1.00 0.28 C ATOM 320 C MET A 21 7.692 10.529 1.382 1.00 0.31 C ATOM 321 O MET A 21 8.807 10.320 1.820 1.00 0.39 O ATOM 322 CB MET A 21 6.037 8.759 2.061 1.00 0.31 C ATOM 323 CG MET A 21 4.879 8.423 3.006 1.00 0.38 C ATOM 324 SD MET A 21 5.497 7.443 4.396 1.00 0.72 S ATOM 325 CE MET A 21 3.899 6.796 4.949 1.00 0.92 C ATOM 326 H MET A 21 4.532 10.564 1.286 1.00 0.31 H ATOM 327 HA MET A 21 6.634 10.440 3.267 1.00 0.30 H ATOM 328 HB2 MET A 21 5.729 8.587 1.040 1.00 0.36 H ATOM 329 HB3 MET A 21 6.881 8.126 2.292 1.00 0.32 H ATOM 330 HG2 MET A 21 4.437 9.335 3.376 1.00 0.64 H ATOM 331 HG3 MET A 21 4.132 7.855 2.469 1.00 0.68 H ATOM 332 HE1 MET A 21 3.864 6.805 6.030 1.00 1.34 H ATOM 333 HE2 MET A 21 3.777 5.786 4.596 1.00 1.40 H ATOM 334 HE3 MET A 21 3.104 7.413 4.552 1.00 1.48 H ATOM 335 N HIS A 22 7.511 11.018 0.173 1.00 0.32 N ATOM 336 CA HIS A 22 8.683 11.334 -0.702 1.00 0.39 C ATOM 337 C HIS A 22 9.593 12.377 -0.035 1.00 0.43 C ATOM 338 O HIS A 22 10.802 12.239 -0.032 1.00 0.54 O ATOM 339 CB HIS A 22 8.079 11.894 -1.993 1.00 0.44 C ATOM 340 CG HIS A 22 9.131 11.932 -3.065 1.00 0.45 C ATOM 341 ND1 HIS A 22 9.522 10.798 -3.760 1.00 0.42 N ATOM 342 CD2 HIS A 22 9.889 12.959 -3.568 1.00 0.67 C ATOM 343 CE1 HIS A 22 10.475 11.166 -4.634 1.00 0.52 C ATOM 344 NE2 HIS A 22 10.737 12.474 -4.559 1.00 0.67 N ATOM 345 H HIS A 22 6.603 11.175 -0.159 1.00 0.32 H ATOM 346 HA HIS A 22 9.238 10.439 -0.920 1.00 0.43 H ATOM 347 HB2 HIS A 22 7.262 11.262 -2.311 1.00 0.49 H ATOM 348 HB3 HIS A 22 7.710 12.894 -1.814 1.00 0.52 H ATOM 349 HD1 HIS A 22 9.166 9.894 -3.638 1.00 0.48 H ATOM 350 HD2 HIS A 22 9.835 13.988 -3.245 1.00 0.87 H ATOM 351 HE1 HIS A 22 10.969 10.488 -5.313 1.00 0.60 H ATOM 352 N ALA A 23 9.022 13.412 0.530 1.00 0.44 N ATOM 353 CA ALA A 23 9.851 14.462 1.200 1.00 0.54 C ATOM 354 C ALA A 23 10.227 14.030 2.625 1.00 0.54 C ATOM 355 O ALA A 23 11.275 14.390 3.131 1.00 0.67 O ATOM 356 CB ALA A 23 8.967 15.712 1.233 1.00 0.59 C ATOM 357 H ALA A 23 8.044 13.497 0.515 1.00 0.44 H ATOM 358 HA ALA A 23 10.740 14.660 0.622 1.00 0.62 H ATOM 359 HB1 ALA A 23 8.931 16.101 2.241 1.00 1.19 H ATOM 360 HB2 ALA A 23 7.969 15.458 0.910 1.00 1.19 H ATOM 361 HB3 ALA A 23 9.379 16.462 0.574 1.00 1.19 H ATOM 362 N GLU A 24 9.382 13.265 3.277 1.00 0.48 N ATOM 363 CA GLU A 24 9.693 12.813 4.672 1.00 0.54 C ATOM 364 C GLU A 24 10.772 11.719 4.669 1.00 0.52 C ATOM 365 O GLU A 24 11.503 11.563 5.630 1.00 0.62 O ATOM 366 CB GLU A 24 8.373 12.256 5.216 1.00 0.56 C ATOM 367 CG GLU A 24 7.908 13.100 6.405 1.00 0.71 C ATOM 368 CD GLU A 24 8.361 12.440 7.710 1.00 0.89 C ATOM 369 OE1 GLU A 24 9.498 12.658 8.097 1.00 1.06 O ATOM 370 OE2 GLU A 24 7.563 11.730 8.300 1.00 1.06 O ATOM 371 H GLU A 24 8.544 12.989 2.850 1.00 0.48 H ATOM 372 HA GLU A 24 10.012 13.650 5.274 1.00 0.63 H ATOM 373 HB2 GLU A 24 7.622 12.285 4.439 1.00 0.61 H ATOM 374 HB3 GLU A 24 8.517 11.235 5.536 1.00 0.53 H ATOM 375 HG2 GLU A 24 8.335 14.090 6.333 1.00 0.76 H ATOM 376 HG3 GLU A 24 6.831 13.172 6.396 1.00 0.81 H ATOM 377 N GLY A 25 10.876 10.960 3.603 1.00 0.47 N ATOM 378 CA GLY A 25 11.902 9.875 3.543 1.00 0.50 C ATOM 379 C GLY A 25 11.437 8.680 4.384 1.00 0.45 C ATOM 380 O GLY A 25 12.231 8.013 5.020 1.00 0.54 O ATOM 381 H GLY A 25 10.274 11.099 2.842 1.00 0.45 H ATOM 382 HA2 GLY A 25 12.037 9.565 2.517 1.00 0.52 H ATOM 383 HA3 GLY A 25 12.838 10.242 3.935 1.00 0.59 H ATOM 384 N ARG A 26 10.153 8.406 4.389 1.00 0.38 N ATOM 385 CA ARG A 26 9.625 7.257 5.185 1.00 0.36 C ATOM 386 C ARG A 26 9.327 6.069 4.260 1.00 0.31 C ATOM 387 O ARG A 26 9.166 6.245 3.069 1.00 0.31 O ATOM 388 CB ARG A 26 8.332 7.778 5.823 1.00 0.39 C ATOM 389 CG ARG A 26 8.659 8.852 6.866 1.00 0.44 C ATOM 390 CD ARG A 26 9.264 8.195 8.111 1.00 0.48 C ATOM 391 NE ARG A 26 10.638 8.765 8.222 1.00 0.70 N ATOM 392 CZ ARG A 26 11.598 8.055 8.753 1.00 0.75 C ATOM 393 NH1 ARG A 26 12.322 7.270 8.000 1.00 1.12 N ATOM 394 NH2 ARG A 26 11.833 8.133 10.037 1.00 1.09 N ATOM 395 H ARG A 26 9.535 8.960 3.866 1.00 0.41 H ATOM 396 HA ARG A 26 10.327 6.973 5.952 1.00 0.40 H ATOM 397 HB2 ARG A 26 7.702 8.203 5.056 1.00 0.45 H ATOM 398 HB3 ARG A 26 7.812 6.961 6.301 1.00 0.42 H ATOM 399 HG2 ARG A 26 9.363 9.557 6.448 1.00 0.51 H ATOM 400 HG3 ARG A 26 7.753 9.371 7.142 1.00 0.54 H ATOM 401 HD2 ARG A 26 8.680 8.445 8.986 1.00 0.73 H ATOM 402 HD3 ARG A 26 9.317 7.125 7.985 1.00 0.49 H ATOM 403 HE ARG A 26 10.822 9.673 7.901 1.00 1.11 H ATOM 404 HH11 ARG A 26 12.140 7.213 7.018 1.00 1.40 H ATOM 405 HH12 ARG A 26 13.058 6.727 8.404 1.00 1.37 H ATOM 406 HH21 ARG A 26 11.277 8.735 10.611 1.00 1.37 H ATOM 407 HH22 ARG A 26 12.567 7.592 10.446 1.00 1.33 H ATOM 408 N PRO A 27 9.264 4.892 4.841 1.00 0.31 N ATOM 409 CA PRO A 27 8.983 3.667 4.049 1.00 0.30 C ATOM 410 C PRO A 27 7.527 3.650 3.566 1.00 0.28 C ATOM 411 O PRO A 27 6.599 3.860 4.326 1.00 0.32 O ATOM 412 CB PRO A 27 9.265 2.529 5.026 1.00 0.38 C ATOM 413 CG PRO A 27 9.092 3.129 6.381 1.00 0.42 C ATOM 414 CD PRO A 27 9.442 4.592 6.268 1.00 0.38 C ATOM 415 HA PRO A 27 9.654 3.600 3.211 1.00 0.30 H ATOM 416 HB2 PRO A 27 8.561 1.722 4.875 1.00 0.41 H ATOM 417 HB3 PRO A 27 10.277 2.173 4.907 1.00 0.39 H ATOM 418 HG2 PRO A 27 8.067 3.015 6.704 1.00 0.47 H ATOM 419 HG3 PRO A 27 9.758 2.650 7.081 1.00 0.48 H ATOM 420 HD2 PRO A 27 8.771 5.188 6.872 1.00 0.44 H ATOM 421 HD3 PRO A 27 10.468 4.760 6.558 1.00 0.42 H ATOM 422 N VAL A 28 7.339 3.407 2.296 1.00 0.25 N ATOM 423 CA VAL A 28 5.966 3.374 1.703 1.00 0.24 C ATOM 424 C VAL A 28 5.849 2.124 0.833 1.00 0.24 C ATOM 425 O VAL A 28 6.677 1.889 -0.027 1.00 0.29 O ATOM 426 CB VAL A 28 5.851 4.647 0.844 1.00 0.22 C ATOM 427 CG1 VAL A 28 4.406 5.132 0.837 1.00 0.26 C ATOM 428 CG2 VAL A 28 6.731 5.765 1.414 1.00 0.25 C ATOM 429 H VAL A 28 8.112 3.246 1.717 1.00 0.25 H ATOM 430 HA VAL A 28 5.211 3.372 2.473 1.00 0.26 H ATOM 431 HB VAL A 28 6.158 4.424 -0.170 1.00 0.22 H ATOM 432 HG11 VAL A 28 4.326 6.003 0.202 1.00 0.33 H ATOM 433 HG12 VAL A 28 4.109 5.391 1.840 1.00 0.31 H ATOM 434 HG13 VAL A 28 3.766 4.350 0.460 1.00 0.32 H ATOM 435 HG21 VAL A 28 7.766 5.559 1.191 1.00 0.31 H ATOM 436 HG22 VAL A 28 6.596 5.821 2.485 1.00 0.35 H ATOM 437 HG23 VAL A 28 6.447 6.705 0.967 1.00 0.28 H ATOM 438 N ASP A 29 4.852 1.306 1.058 1.00 0.27 N ATOM 439 CA ASP A 29 4.723 0.059 0.244 1.00 0.28 C ATOM 440 C ASP A 29 4.341 0.391 -1.205 1.00 0.25 C ATOM 441 O ASP A 29 3.177 0.374 -1.579 1.00 0.26 O ATOM 442 CB ASP A 29 3.610 -0.744 0.927 1.00 0.32 C ATOM 443 CG ASP A 29 3.962 -2.232 0.919 1.00 0.45 C ATOM 444 OD1 ASP A 29 3.846 -2.844 -0.131 1.00 0.74 O ATOM 445 OD2 ASP A 29 4.334 -2.738 1.966 1.00 0.72 O ATOM 446 H ASP A 29 4.204 1.502 1.768 1.00 0.32 H ATOM 447 HA ASP A 29 5.645 -0.500 0.269 1.00 0.31 H ATOM 448 HB2 ASP A 29 3.499 -0.407 1.948 1.00 0.52 H ATOM 449 HB3 ASP A 29 2.681 -0.593 0.397 1.00 0.58 H ATOM 450 N ILE A 30 5.318 0.653 -2.040 1.00 0.25 N ATOM 451 CA ILE A 30 5.002 0.948 -3.466 1.00 0.24 C ATOM 452 C ILE A 30 4.444 -0.319 -4.113 1.00 0.26 C ATOM 453 O ILE A 30 3.610 -0.250 -4.989 1.00 0.27 O ATOM 454 CB ILE A 30 6.319 1.366 -4.131 1.00 0.27 C ATOM 455 CG1 ILE A 30 6.733 2.761 -3.640 1.00 0.24 C ATOM 456 CG2 ILE A 30 6.128 1.404 -5.651 1.00 0.33 C ATOM 457 CD1 ILE A 30 5.730 3.812 -4.128 1.00 0.24 C ATOM 458 H ILE A 30 6.250 0.629 -1.734 1.00 0.27 H ATOM 459 HA ILE A 30 4.284 1.750 -3.528 1.00 0.23 H ATOM 460 HB ILE A 30 7.091 0.651 -3.884 1.00 0.32 H ATOM 461 HG12 ILE A 30 6.767 2.769 -2.561 1.00 0.28 H ATOM 462 HG13 ILE A 30 7.707 2.998 -4.028 1.00 0.25 H ATOM 463 HG21 ILE A 30 6.353 0.434 -6.066 1.00 0.45 H ATOM 464 HG22 ILE A 30 6.790 2.142 -6.079 1.00 0.34 H ATOM 465 HG23 ILE A 30 5.106 1.665 -5.879 1.00 0.40 H ATOM 466 HD11 ILE A 30 5.687 4.625 -3.419 1.00 0.29 H ATOM 467 HD12 ILE A 30 4.752 3.364 -4.222 1.00 0.34 H ATOM 468 HD13 ILE A 30 6.046 4.189 -5.089 1.00 0.32 H ATOM 469 N LEU A 31 4.886 -1.475 -3.661 1.00 0.29 N ATOM 470 CA LEU A 31 4.366 -2.759 -4.222 1.00 0.32 C ATOM 471 C LEU A 31 2.835 -2.740 -4.189 1.00 0.31 C ATOM 472 O LEU A 31 2.182 -3.153 -5.129 1.00 0.34 O ATOM 473 CB LEU A 31 4.947 -3.855 -3.307 1.00 0.37 C ATOM 474 CG LEU A 31 4.184 -5.183 -3.463 1.00 0.39 C ATOM 475 CD1 LEU A 31 2.848 -5.105 -2.715 1.00 0.41 C ATOM 476 CD2 LEU A 31 3.932 -5.480 -4.948 1.00 0.42 C ATOM 477 H LEU A 31 5.548 -1.495 -2.939 1.00 0.31 H ATOM 478 HA LEU A 31 4.715 -2.891 -5.232 1.00 0.34 H ATOM 479 HB2 LEU A 31 5.984 -4.013 -3.561 1.00 0.41 H ATOM 480 HB3 LEU A 31 4.882 -3.529 -2.280 1.00 0.38 H ATOM 481 HG LEU A 31 4.777 -5.980 -3.036 1.00 0.43 H ATOM 482 HD11 LEU A 31 2.838 -4.226 -2.087 1.00 0.45 H ATOM 483 HD12 LEU A 31 2.726 -5.984 -2.103 1.00 0.52 H ATOM 484 HD13 LEU A 31 2.039 -5.046 -3.428 1.00 0.49 H ATOM 485 HD21 LEU A 31 4.103 -4.587 -5.530 1.00 0.95 H ATOM 486 HD22 LEU A 31 2.912 -5.806 -5.083 1.00 0.91 H ATOM 487 HD23 LEU A 31 4.606 -6.256 -5.278 1.00 0.99 H ATOM 488 N ALA A 32 2.263 -2.229 -3.124 1.00 0.29 N ATOM 489 CA ALA A 32 0.775 -2.137 -3.039 1.00 0.31 C ATOM 490 C ALA A 32 0.258 -1.385 -4.271 1.00 0.31 C ATOM 491 O ALA A 32 -0.769 -1.711 -4.833 1.00 0.37 O ATOM 492 CB ALA A 32 0.511 -1.329 -1.768 1.00 0.32 C ATOM 493 H ALA A 32 2.816 -1.882 -2.392 1.00 0.29 H ATOM 494 HA ALA A 32 0.330 -3.116 -2.966 1.00 0.36 H ATOM 495 HB1 ALA A 32 1.163 -1.676 -0.979 1.00 0.73 H ATOM 496 HB2 ALA A 32 -0.516 -1.453 -1.468 1.00 0.67 H ATOM 497 HB3 ALA A 32 0.708 -0.284 -1.961 1.00 0.73 H ATOM 498 N VAL A 33 0.991 -0.381 -4.686 1.00 0.27 N ATOM 499 CA VAL A 33 0.596 0.423 -5.885 1.00 0.29 C ATOM 500 C VAL A 33 1.011 -0.275 -7.198 1.00 0.31 C ATOM 501 O VAL A 33 0.445 -0.014 -8.243 1.00 0.38 O ATOM 502 CB VAL A 33 1.348 1.747 -5.708 1.00 0.29 C ATOM 503 CG1 VAL A 33 1.471 2.477 -7.048 1.00 0.29 C ATOM 504 CG2 VAL A 33 0.582 2.631 -4.726 1.00 0.35 C ATOM 505 H VAL A 33 1.819 -0.152 -4.198 1.00 0.27 H ATOM 506 HA VAL A 33 -0.461 0.602 -5.881 1.00 0.32 H ATOM 507 HB VAL A 33 2.337 1.543 -5.318 1.00 0.32 H ATOM 508 HG11 VAL A 33 1.698 3.518 -6.870 1.00 0.85 H ATOM 509 HG12 VAL A 33 0.540 2.398 -7.589 1.00 0.88 H ATOM 510 HG13 VAL A 33 2.264 2.031 -7.627 1.00 0.84 H ATOM 511 HG21 VAL A 33 1.088 3.580 -4.626 1.00 0.61 H ATOM 512 HG22 VAL A 33 0.537 2.144 -3.763 1.00 0.74 H ATOM 513 HG23 VAL A 33 -0.420 2.796 -5.093 1.00 0.61 H ATOM 514 N THR A 34 1.992 -1.141 -7.157 1.00 0.31 N ATOM 515 CA THR A 34 2.441 -1.830 -8.414 1.00 0.35 C ATOM 516 C THR A 34 1.546 -3.038 -8.727 1.00 0.38 C ATOM 517 O THR A 34 1.371 -3.399 -9.876 1.00 0.43 O ATOM 518 CB THR A 34 3.895 -2.276 -8.166 1.00 0.36 C ATOM 519 OG1 THR A 34 3.908 -3.523 -7.485 1.00 0.39 O ATOM 520 CG2 THR A 34 4.633 -1.234 -7.324 1.00 0.34 C ATOM 521 H THR A 34 2.441 -1.333 -6.308 1.00 0.32 H ATOM 522 HA THR A 34 2.414 -1.135 -9.240 1.00 0.37 H ATOM 523 HB THR A 34 4.403 -2.380 -9.114 1.00 0.40 H ATOM 524 HG1 THR A 34 4.500 -4.113 -7.958 1.00 0.59 H ATOM 525 HG21 THR A 34 4.725 -1.594 -6.312 1.00 0.38 H ATOM 526 HG22 THR A 34 4.074 -0.309 -7.325 1.00 0.36 H ATOM 527 HG23 THR A 34 5.612 -1.064 -7.738 1.00 0.46 H ATOM 528 N GLY A 35 0.973 -3.660 -7.721 1.00 0.42 N ATOM 529 CA GLY A 35 0.084 -4.837 -7.968 1.00 0.46 C ATOM 530 C GLY A 35 -1.079 -4.414 -8.873 1.00 0.50 C ATOM 531 O GLY A 35 -1.496 -5.154 -9.744 1.00 0.59 O ATOM 532 H GLY A 35 1.123 -3.351 -6.803 1.00 0.46 H ATOM 533 HA2 GLY A 35 0.651 -5.620 -8.451 1.00 0.48 H ATOM 534 HA3 GLY A 35 -0.306 -5.198 -7.032 1.00 0.50 H ATOM 535 N ASN A 36 -1.592 -3.222 -8.681 1.00 0.52 N ATOM 536 CA ASN A 36 -2.715 -2.734 -9.540 1.00 0.59 C ATOM 537 C ASN A 36 -2.215 -2.489 -10.972 1.00 0.58 C ATOM 538 O ASN A 36 -2.954 -2.654 -11.925 1.00 0.69 O ATOM 539 CB ASN A 36 -3.176 -1.424 -8.893 1.00 0.64 C ATOM 540 CG ASN A 36 -4.133 -1.734 -7.738 1.00 0.69 C ATOM 541 OD1 ASN A 36 -3.703 -2.115 -6.667 1.00 1.04 O ATOM 542 ND2 ASN A 36 -5.420 -1.587 -7.909 1.00 1.08 N ATOM 543 H ASN A 36 -1.227 -2.641 -7.980 1.00 0.54 H ATOM 544 HA ASN A 36 -3.523 -3.449 -9.542 1.00 0.66 H ATOM 545 HB2 ASN A 36 -2.318 -0.887 -8.517 1.00 0.84 H ATOM 546 HB3 ASN A 36 -3.687 -0.819 -9.629 1.00 0.86 H ATOM 547 HD21 ASN A 36 -5.768 -1.279 -8.772 1.00 1.39 H ATOM 548 HD22 ASN A 36 -6.038 -1.788 -7.175 1.00 1.30 H ATOM 549 N MET A 37 -0.960 -2.108 -11.122 1.00 0.51 N ATOM 550 CA MET A 37 -0.373 -1.855 -12.481 1.00 0.56 C ATOM 551 C MET A 37 -1.114 -0.717 -13.193 1.00 0.59 C ATOM 552 O MET A 37 -2.155 -0.915 -13.793 1.00 0.75 O ATOM 553 CB MET A 37 -0.524 -3.175 -13.250 1.00 0.67 C ATOM 554 CG MET A 37 0.854 -3.805 -13.464 1.00 0.93 C ATOM 555 SD MET A 37 0.700 -5.220 -14.584 1.00 1.52 S ATOM 556 CE MET A 37 1.312 -6.486 -13.446 1.00 2.21 C ATOM 557 H MET A 37 -0.394 -1.991 -10.331 1.00 0.47 H ATOM 558 HA MET A 37 0.672 -1.608 -12.388 1.00 0.54 H ATOM 559 HB2 MET A 37 -1.145 -3.854 -12.685 1.00 0.86 H ATOM 560 HB3 MET A 37 -0.980 -2.983 -14.209 1.00 0.81 H ATOM 561 HG2 MET A 37 1.521 -3.075 -13.897 1.00 1.31 H ATOM 562 HG3 MET A 37 1.249 -4.136 -12.514 1.00 1.30 H ATOM 563 HE1 MET A 37 0.828 -6.372 -12.484 1.00 2.42 H ATOM 564 HE2 MET A 37 2.377 -6.379 -13.324 1.00 2.59 H ATOM 565 HE3 MET A 37 1.096 -7.466 -13.850 1.00 2.80 H ATOM 566 N ASP A 38 -0.579 0.476 -13.132 1.00 0.53 N ATOM 567 CA ASP A 38 -1.243 1.632 -13.802 1.00 0.58 C ATOM 568 C ASP A 38 -0.324 2.233 -14.870 1.00 0.57 C ATOM 569 O ASP A 38 0.887 2.150 -14.780 1.00 0.55 O ATOM 570 CB ASP A 38 -1.511 2.648 -12.685 1.00 0.56 C ATOM 571 CG ASP A 38 -2.507 2.062 -11.678 1.00 0.82 C ATOM 572 OD1 ASP A 38 -3.698 2.199 -11.903 1.00 1.20 O ATOM 573 OD2 ASP A 38 -2.060 1.487 -10.697 1.00 1.03 O ATOM 574 H ASP A 38 0.261 0.609 -12.644 1.00 0.54 H ATOM 575 HA ASP A 38 -2.173 1.323 -14.245 1.00 0.67 H ATOM 576 HB2 ASP A 38 -0.585 2.879 -12.183 1.00 0.66 H ATOM 577 HB3 ASP A 38 -1.924 3.549 -13.112 1.00 0.70 H ATOM 578 N GLU A 39 -0.897 2.843 -15.880 1.00 0.66 N ATOM 579 CA GLU A 39 -0.065 3.464 -16.959 1.00 0.68 C ATOM 580 C GLU A 39 0.817 4.563 -16.363 1.00 0.59 C ATOM 581 O GLU A 39 1.995 4.651 -16.655 1.00 0.60 O ATOM 582 CB GLU A 39 -1.063 4.063 -17.953 1.00 0.79 C ATOM 583 CG GLU A 39 -1.454 3.005 -18.990 1.00 1.00 C ATOM 584 CD GLU A 39 -2.590 2.136 -18.439 1.00 1.20 C ATOM 585 OE1 GLU A 39 -3.733 2.552 -18.543 1.00 1.30 O ATOM 586 OE2 GLU A 39 -2.297 1.069 -17.924 1.00 1.41 O ATOM 587 H GLU A 39 -1.875 2.899 -15.924 1.00 0.73 H ATOM 588 HA GLU A 39 0.540 2.716 -17.446 1.00 0.71 H ATOM 589 HB2 GLU A 39 -1.944 4.395 -17.422 1.00 0.82 H ATOM 590 HB3 GLU A 39 -0.608 4.905 -18.454 1.00 0.79 H ATOM 591 HG2 GLU A 39 -1.782 3.494 -19.896 1.00 1.01 H ATOM 592 HG3 GLU A 39 -0.600 2.381 -19.207 1.00 1.13 H ATOM 593 N GLU A 40 0.253 5.393 -15.518 1.00 0.57 N ATOM 594 CA GLU A 40 1.054 6.481 -14.885 1.00 0.52 C ATOM 595 C GLU A 40 2.000 5.891 -13.829 1.00 0.44 C ATOM 596 O GLU A 40 3.055 6.434 -13.565 1.00 0.42 O ATOM 597 CB GLU A 40 0.028 7.410 -14.229 1.00 0.59 C ATOM 598 CG GLU A 40 0.572 8.843 -14.206 1.00 0.70 C ATOM 599 CD GLU A 40 1.306 9.099 -12.886 1.00 1.05 C ATOM 600 OE1 GLU A 40 0.640 9.195 -11.867 1.00 1.25 O ATOM 601 OE2 GLU A 40 2.522 9.197 -12.918 1.00 1.45 O ATOM 602 H GLU A 40 -0.695 5.291 -15.294 1.00 0.62 H ATOM 603 HA GLU A 40 1.611 7.016 -15.637 1.00 0.55 H ATOM 604 HB2 GLU A 40 -0.894 7.384 -14.793 1.00 0.70 H ATOM 605 HB3 GLU A 40 -0.159 7.083 -13.217 1.00 0.65 H ATOM 606 HG2 GLU A 40 1.255 8.982 -15.032 1.00 0.93 H ATOM 607 HG3 GLU A 40 -0.249 9.540 -14.299 1.00 0.74 H ATOM 608 N HIS A 41 1.630 4.779 -13.229 1.00 0.42 N ATOM 609 CA HIS A 41 2.505 4.146 -12.193 1.00 0.37 C ATOM 610 C HIS A 41 3.893 3.824 -12.775 1.00 0.34 C ATOM 611 O HIS A 41 4.880 3.860 -12.069 1.00 0.33 O ATOM 612 CB HIS A 41 1.775 2.861 -11.770 1.00 0.39 C ATOM 613 CG HIS A 41 2.702 2.000 -10.951 1.00 0.35 C ATOM 614 ND1 HIS A 41 3.254 2.439 -9.756 1.00 0.36 N ATOM 615 CD2 HIS A 41 3.197 0.736 -11.149 1.00 0.42 C ATOM 616 CE1 HIS A 41 4.044 1.456 -9.288 1.00 0.37 C ATOM 617 NE2 HIS A 41 4.046 0.395 -10.099 1.00 0.41 N ATOM 618 H HIS A 41 0.775 4.361 -13.464 1.00 0.48 H ATOM 619 HA HIS A 41 2.603 4.801 -11.343 1.00 0.37 H ATOM 620 HB2 HIS A 41 0.911 3.120 -11.178 1.00 0.44 H ATOM 621 HB3 HIS A 41 1.458 2.316 -12.649 1.00 0.45 H ATOM 622 HD1 HIS A 41 3.094 3.307 -9.330 1.00 0.43 H ATOM 623 HD2 HIS A 41 2.966 0.102 -11.992 1.00 0.54 H ATOM 624 HE1 HIS A 41 4.610 1.520 -8.369 1.00 0.43 H ATOM 625 N ARG A 42 3.977 3.515 -14.051 1.00 0.42 N ATOM 626 CA ARG A 42 5.311 3.205 -14.661 1.00 0.44 C ATOM 627 C ARG A 42 6.255 4.401 -14.480 1.00 0.36 C ATOM 628 O ARG A 42 7.320 4.276 -13.907 1.00 0.36 O ATOM 629 CB ARG A 42 5.033 2.947 -16.146 1.00 0.57 C ATOM 630 CG ARG A 42 4.703 1.467 -16.353 1.00 0.71 C ATOM 631 CD ARG A 42 3.468 1.337 -17.247 1.00 0.77 C ATOM 632 NE ARG A 42 3.061 -0.092 -17.131 1.00 0.84 N ATOM 633 CZ ARG A 42 1.883 -0.403 -16.660 1.00 1.02 C ATOM 634 NH1 ARG A 42 0.849 -0.431 -17.457 1.00 1.33 N ATOM 635 NH2 ARG A 42 1.742 -0.691 -15.393 1.00 1.27 N ATOM 636 H ARG A 42 3.169 3.494 -14.604 1.00 0.49 H ATOM 637 HA ARG A 42 5.734 2.323 -14.206 1.00 0.48 H ATOM 638 HB2 ARG A 42 4.199 3.554 -16.467 1.00 0.55 H ATOM 639 HB3 ARG A 42 5.908 3.202 -16.725 1.00 0.76 H ATOM 640 HG2 ARG A 42 5.542 0.974 -16.822 1.00 1.05 H ATOM 641 HG3 ARG A 42 4.503 1.006 -15.397 1.00 0.88 H ATOM 642 HD2 ARG A 42 2.678 1.987 -16.894 1.00 0.92 H ATOM 643 HD3 ARG A 42 3.718 1.568 -18.270 1.00 1.04 H ATOM 644 HE ARG A 42 3.678 -0.800 -17.411 1.00 1.02 H ATOM 645 HH11 ARG A 42 0.959 -0.215 -18.427 1.00 1.47 H ATOM 646 HH12 ARG A 42 -0.054 -0.671 -17.098 1.00 1.60 H ATOM 647 HH21 ARG A 42 2.535 -0.671 -14.784 1.00 1.38 H ATOM 648 HH22 ARG A 42 0.842 -0.931 -15.033 1.00 1.56 H ATOM 649 N THR A 43 5.857 5.563 -14.940 1.00 0.37 N ATOM 650 CA THR A 43 6.716 6.779 -14.769 1.00 0.35 C ATOM 651 C THR A 43 6.758 7.154 -13.280 1.00 0.31 C ATOM 652 O THR A 43 7.794 7.530 -12.751 1.00 0.33 O ATOM 653 CB THR A 43 6.034 7.871 -15.614 1.00 0.48 C ATOM 654 OG1 THR A 43 6.606 7.878 -16.913 1.00 1.27 O ATOM 655 CG2 THR A 43 6.218 9.253 -14.978 1.00 0.73 C ATOM 656 H THR A 43 4.982 5.642 -15.380 1.00 0.45 H ATOM 657 HA THR A 43 7.712 6.590 -15.140 1.00 0.36 H ATOM 658 HB THR A 43 4.979 7.656 -15.691 1.00 1.01 H ATOM 659 HG1 THR A 43 5.893 7.960 -17.550 1.00 1.65 H ATOM 660 HG21 THR A 43 5.274 9.592 -14.577 1.00 1.21 H ATOM 661 HG22 THR A 43 6.560 9.949 -15.729 1.00 1.27 H ATOM 662 HG23 THR A 43 6.946 9.195 -14.184 1.00 1.50 H ATOM 663 N TRP A 44 5.639 7.038 -12.601 1.00 0.28 N ATOM 664 CA TRP A 44 5.596 7.367 -11.146 1.00 0.27 C ATOM 665 C TRP A 44 6.630 6.526 -10.387 1.00 0.25 C ATOM 666 O TRP A 44 7.375 7.044 -9.580 1.00 0.31 O ATOM 667 CB TRP A 44 4.164 7.031 -10.697 1.00 0.30 C ATOM 668 CG TRP A 44 4.130 6.771 -9.220 1.00 0.30 C ATOM 669 CD1 TRP A 44 4.366 5.571 -8.644 1.00 0.36 C ATOM 670 CD2 TRP A 44 3.854 7.700 -8.131 1.00 0.30 C ATOM 671 NE1 TRP A 44 4.253 5.702 -7.272 1.00 0.38 N ATOM 672 CE2 TRP A 44 3.938 6.995 -6.907 1.00 0.34 C ATOM 673 CE3 TRP A 44 3.541 9.071 -8.086 1.00 0.34 C ATOM 674 CZ2 TRP A 44 3.720 7.626 -5.683 1.00 0.39 C ATOM 675 CZ3 TRP A 44 3.322 9.710 -6.853 1.00 0.41 C ATOM 676 CH2 TRP A 44 3.411 8.988 -5.655 1.00 0.42 C ATOM 677 H TRP A 44 4.827 6.724 -13.052 1.00 0.31 H ATOM 678 HA TRP A 44 5.788 8.417 -10.995 1.00 0.28 H ATOM 679 HB2 TRP A 44 3.514 7.861 -10.929 1.00 0.34 H ATOM 680 HB3 TRP A 44 3.823 6.153 -11.224 1.00 0.35 H ATOM 681 HD1 TRP A 44 4.606 4.661 -9.170 1.00 0.43 H ATOM 682 HE1 TRP A 44 4.377 4.978 -6.624 1.00 0.44 H ATOM 683 HE3 TRP A 44 3.470 9.636 -9.003 1.00 0.36 H ATOM 684 HZ2 TRP A 44 3.791 7.065 -4.762 1.00 0.44 H ATOM 685 HZ3 TRP A 44 3.082 10.763 -6.829 1.00 0.48 H ATOM 686 HH2 TRP A 44 3.242 9.485 -4.710 1.00 0.48 H ATOM 687 N PHE A 45 6.687 5.234 -10.638 1.00 0.24 N ATOM 688 CA PHE A 45 7.682 4.390 -9.912 1.00 0.24 C ATOM 689 C PHE A 45 9.107 4.709 -10.364 1.00 0.23 C ATOM 690 O PHE A 45 10.036 4.438 -9.653 1.00 0.25 O ATOM 691 CB PHE A 45 7.342 2.925 -10.210 1.00 0.27 C ATOM 692 CG PHE A 45 7.826 2.042 -9.064 1.00 0.26 C ATOM 693 CD1 PHE A 45 8.568 2.588 -7.998 1.00 0.26 C ATOM 694 CD2 PHE A 45 7.521 0.676 -9.061 1.00 0.31 C ATOM 695 CE1 PHE A 45 8.993 1.772 -6.945 1.00 0.29 C ATOM 696 CE2 PHE A 45 7.951 -0.139 -8.006 1.00 0.34 C ATOM 697 CZ PHE A 45 8.685 0.410 -6.948 1.00 0.32 C ATOM 698 H PHE A 45 6.080 4.831 -11.294 1.00 0.29 H ATOM 699 HA PHE A 45 7.592 4.567 -8.851 1.00 0.24 H ATOM 700 HB2 PHE A 45 6.272 2.820 -10.318 1.00 0.30 H ATOM 701 HB3 PHE A 45 7.828 2.623 -11.125 1.00 0.30 H ATOM 702 HD1 PHE A 45 8.816 3.639 -7.990 1.00 0.29 H ATOM 703 HD2 PHE A 45 6.963 0.248 -9.878 1.00 0.34 H ATOM 704 HE1 PHE A 45 9.560 2.196 -6.129 1.00 0.32 H ATOM 705 HE2 PHE A 45 7.714 -1.193 -8.007 1.00 0.40 H ATOM 706 HZ PHE A 45 9.011 -0.217 -6.130 1.00 0.37 H ATOM 707 N CYS A 46 9.302 5.293 -11.520 1.00 0.27 N ATOM 708 CA CYS A 46 10.702 5.626 -11.935 1.00 0.29 C ATOM 709 C CYS A 46 11.328 6.516 -10.850 1.00 0.27 C ATOM 710 O CYS A 46 12.355 6.190 -10.267 1.00 0.28 O ATOM 711 CB CYS A 46 10.571 6.380 -13.263 1.00 0.33 C ATOM 712 SG CYS A 46 12.172 6.400 -14.106 1.00 0.75 S ATOM 713 H CYS A 46 8.544 5.527 -12.096 1.00 0.30 H ATOM 714 HA CYS A 46 11.282 4.725 -12.070 1.00 0.30 H ATOM 715 HB2 CYS A 46 9.841 5.886 -13.887 1.00 0.52 H ATOM 716 HB3 CYS A 46 10.253 7.394 -13.071 1.00 0.60 H ATOM 717 HG CYS A 46 12.263 5.577 -14.592 1.00 1.15 H ATOM 718 N ALA A 47 10.680 7.618 -10.550 1.00 0.28 N ATOM 719 CA ALA A 47 11.192 8.530 -9.479 1.00 0.29 C ATOM 720 C ALA A 47 10.920 7.926 -8.089 1.00 0.25 C ATOM 721 O ALA A 47 11.598 8.243 -7.129 1.00 0.28 O ATOM 722 CB ALA A 47 10.414 9.836 -9.658 1.00 0.34 C ATOM 723 H ALA A 47 9.839 7.831 -11.015 1.00 0.29 H ATOM 724 HA ALA A 47 12.247 8.709 -9.611 1.00 0.32 H ATOM 725 HB1 ALA A 47 10.374 10.363 -8.716 1.00 1.02 H ATOM 726 HB2 ALA A 47 9.410 9.616 -9.989 1.00 1.09 H ATOM 727 HB3 ALA A 47 10.909 10.452 -10.394 1.00 1.09 H ATOM 728 N ARG A 48 9.941 7.053 -7.978 1.00 0.24 N ATOM 729 CA ARG A 48 9.633 6.422 -6.654 1.00 0.22 C ATOM 730 C ARG A 48 10.472 5.148 -6.457 1.00 0.22 C ATOM 731 O ARG A 48 10.538 4.603 -5.372 1.00 0.27 O ATOM 732 CB ARG A 48 8.142 6.076 -6.706 1.00 0.23 C ATOM 733 CG ARG A 48 7.328 7.191 -6.040 1.00 0.29 C ATOM 734 CD ARG A 48 7.242 8.402 -6.974 1.00 0.34 C ATOM 735 NE ARG A 48 7.685 9.558 -6.148 1.00 0.50 N ATOM 736 CZ ARG A 48 6.805 10.278 -5.507 1.00 0.64 C ATOM 737 NH1 ARG A 48 6.363 9.883 -4.342 1.00 0.94 N ATOM 738 NH2 ARG A 48 6.367 11.392 -6.030 1.00 0.95 N ATOM 739 H ARG A 48 9.415 6.805 -8.766 1.00 0.26 H ATOM 740 HA ARG A 48 9.820 7.121 -5.855 1.00 0.25 H ATOM 741 HB2 ARG A 48 7.832 5.970 -7.734 1.00 0.25 H ATOM 742 HB3 ARG A 48 7.970 5.148 -6.182 1.00 0.26 H ATOM 743 HG2 ARG A 48 6.334 6.828 -5.827 1.00 0.37 H ATOM 744 HG3 ARG A 48 7.808 7.484 -5.119 1.00 0.35 H ATOM 745 HD2 ARG A 48 7.900 8.272 -7.821 1.00 0.38 H ATOM 746 HD3 ARG A 48 6.227 8.551 -7.305 1.00 0.41 H ATOM 747 HE ARG A 48 8.637 9.779 -6.085 1.00 0.81 H ATOM 748 HH11 ARG A 48 6.701 9.030 -3.942 1.00 1.09 H ATOM 749 HH12 ARG A 48 5.689 10.432 -3.851 1.00 1.22 H ATOM 750 HH21 ARG A 48 6.706 11.693 -6.922 1.00 1.09 H ATOM 751 HH22 ARG A 48 5.692 11.944 -5.540 1.00 1.24 H ATOM 752 N TYR A 49 11.120 4.682 -7.494 1.00 0.21 N ATOM 753 CA TYR A 49 11.970 3.461 -7.384 1.00 0.24 C ATOM 754 C TYR A 49 13.218 3.827 -6.607 1.00 0.25 C ATOM 755 O TYR A 49 13.548 3.231 -5.601 1.00 0.29 O ATOM 756 CB TYR A 49 12.361 3.113 -8.824 1.00 0.26 C ATOM 757 CG TYR A 49 11.657 1.857 -9.286 1.00 0.29 C ATOM 758 CD1 TYR A 49 11.729 0.688 -8.517 1.00 0.33 C ATOM 759 CD2 TYR A 49 10.946 1.856 -10.494 1.00 0.33 C ATOM 760 CE1 TYR A 49 11.092 -0.479 -8.955 1.00 0.38 C ATOM 761 CE2 TYR A 49 10.306 0.690 -10.929 1.00 0.37 C ATOM 762 CZ TYR A 49 10.380 -0.478 -10.160 1.00 0.38 C ATOM 763 OH TYR A 49 9.752 -1.628 -10.591 1.00 0.44 O ATOM 764 H TYR A 49 11.060 5.147 -8.354 1.00 0.23 H ATOM 765 HA TYR A 49 11.436 2.647 -6.921 1.00 0.25 H ATOM 766 HB2 TYR A 49 12.105 3.936 -9.473 1.00 0.26 H ATOM 767 HB3 TYR A 49 13.421 2.957 -8.864 1.00 0.28 H ATOM 768 HD1 TYR A 49 12.276 0.690 -7.586 1.00 0.37 H ATOM 769 HD2 TYR A 49 10.888 2.758 -11.086 1.00 0.36 H ATOM 770 HE1 TYR A 49 11.148 -1.379 -8.362 1.00 0.44 H ATOM 771 HE2 TYR A 49 9.757 0.691 -11.859 1.00 0.44 H ATOM 772 HH TYR A 49 8.842 -1.603 -10.285 1.00 0.87 H ATOM 773 N ALA A 50 13.898 4.832 -7.086 1.00 0.24 N ATOM 774 CA ALA A 50 15.135 5.308 -6.414 1.00 0.26 C ATOM 775 C ALA A 50 14.795 5.889 -5.044 1.00 0.26 C ATOM 776 O ALA A 50 15.439 5.593 -4.057 1.00 0.30 O ATOM 777 CB ALA A 50 15.639 6.399 -7.332 1.00 0.28 C ATOM 778 H ALA A 50 13.578 5.290 -7.904 1.00 0.25 H ATOM 779 HA ALA A 50 15.863 4.517 -6.333 1.00 0.29 H ATOM 780 HB1 ALA A 50 14.870 7.152 -7.437 1.00 0.33 H ATOM 781 HB2 ALA A 50 15.862 5.973 -8.297 1.00 0.37 H ATOM 782 HB3 ALA A 50 16.523 6.840 -6.909 1.00 0.36 H ATOM 783 N TRP A 51 13.776 6.711 -4.987 1.00 0.24 N ATOM 784 CA TRP A 51 13.366 7.314 -3.688 1.00 0.24 C ATOM 785 C TRP A 51 13.121 6.199 -2.673 1.00 0.24 C ATOM 786 O TRP A 51 13.726 6.173 -1.624 1.00 0.28 O ATOM 787 CB TRP A 51 12.076 8.083 -4.005 1.00 0.25 C ATOM 788 CG TRP A 51 11.178 8.128 -2.798 1.00 0.24 C ATOM 789 CD1 TRP A 51 11.410 8.837 -1.668 1.00 0.29 C ATOM 790 CD2 TRP A 51 9.915 7.432 -2.590 1.00 0.22 C ATOM 791 NE1 TRP A 51 10.367 8.618 -0.781 1.00 0.28 N ATOM 792 CE2 TRP A 51 9.418 7.760 -1.308 1.00 0.23 C ATOM 793 CE3 TRP A 51 9.162 6.558 -3.386 1.00 0.24 C ATOM 794 CZ2 TRP A 51 8.210 7.234 -0.838 1.00 0.23 C ATOM 795 CZ3 TRP A 51 7.951 6.029 -2.919 1.00 0.26 C ATOM 796 CH2 TRP A 51 7.476 6.367 -1.649 1.00 0.24 C ATOM 797 H TRP A 51 13.274 6.924 -5.803 1.00 0.25 H ATOM 798 HA TRP A 51 14.125 7.992 -3.331 1.00 0.27 H ATOM 799 HB2 TRP A 51 12.332 9.085 -4.310 1.00 0.30 H ATOM 800 HB3 TRP A 51 11.559 7.588 -4.814 1.00 0.26 H ATOM 801 HD1 TRP A 51 12.268 9.467 -1.485 1.00 0.34 H ATOM 802 HE1 TRP A 51 10.291 9.015 0.111 1.00 0.32 H ATOM 803 HE3 TRP A 51 9.517 6.289 -4.367 1.00 0.27 H ATOM 804 HZ2 TRP A 51 7.842 7.492 0.144 1.00 0.25 H ATOM 805 HZ3 TRP A 51 7.383 5.360 -3.545 1.00 0.32 H ATOM 806 HH2 TRP A 51 6.542 5.957 -1.295 1.00 0.26 H ATOM 807 N TYR A 52 12.253 5.272 -2.991 1.00 0.23 N ATOM 808 CA TYR A 52 11.979 4.145 -2.052 1.00 0.24 C ATOM 809 C TYR A 52 13.262 3.350 -1.789 1.00 0.27 C ATOM 810 O TYR A 52 13.491 2.877 -0.696 1.00 0.33 O ATOM 811 CB TYR A 52 10.944 3.267 -2.759 1.00 0.27 C ATOM 812 CG TYR A 52 10.680 2.039 -1.918 1.00 0.27 C ATOM 813 CD1 TYR A 52 9.779 2.106 -0.849 1.00 0.30 C ATOM 814 CD2 TYR A 52 11.351 0.841 -2.196 1.00 0.44 C ATOM 815 CE1 TYR A 52 9.543 0.976 -0.060 1.00 0.34 C ATOM 816 CE2 TYR A 52 11.113 -0.291 -1.408 1.00 0.47 C ATOM 817 CZ TYR A 52 10.210 -0.225 -0.340 1.00 0.36 C ATOM 818 OH TYR A 52 9.980 -1.343 0.438 1.00 0.44 O ATOM 819 H TYR A 52 11.789 5.312 -3.855 1.00 0.25 H ATOM 820 HA TYR A 52 11.572 4.519 -1.129 1.00 0.25 H ATOM 821 HB2 TYR A 52 10.026 3.822 -2.887 1.00 0.29 H ATOM 822 HB3 TYR A 52 11.323 2.967 -3.723 1.00 0.32 H ATOM 823 HD1 TYR A 52 9.265 3.031 -0.637 1.00 0.41 H ATOM 824 HD2 TYR A 52 12.048 0.790 -3.019 1.00 0.60 H ATOM 825 HE1 TYR A 52 8.851 1.029 0.768 1.00 0.47 H ATOM 826 HE2 TYR A 52 11.631 -1.214 -1.618 1.00 0.63 H ATOM 827 HH TYR A 52 9.052 -1.348 0.688 1.00 0.95 H ATOM 828 N CYS A 53 14.092 3.192 -2.788 1.00 0.28 N ATOM 829 CA CYS A 53 15.356 2.417 -2.607 1.00 0.32 C ATOM 830 C CYS A 53 16.244 3.045 -1.521 1.00 0.32 C ATOM 831 O CYS A 53 16.741 2.353 -0.655 1.00 0.37 O ATOM 832 CB CYS A 53 16.041 2.462 -3.976 1.00 0.35 C ATOM 833 SG CYS A 53 17.679 1.698 -3.866 1.00 0.47 S ATOM 834 H CYS A 53 13.879 3.580 -3.665 1.00 0.29 H ATOM 835 HA CYS A 53 15.128 1.394 -2.352 1.00 0.34 H ATOM 836 HB2 CYS A 53 15.438 1.921 -4.690 1.00 0.38 H ATOM 837 HB3 CYS A 53 16.142 3.490 -4.299 1.00 0.34 H ATOM 838 HG CYS A 53 17.558 0.759 -3.707 1.00 1.01 H ATOM 839 N GLN A 54 16.459 4.338 -1.562 1.00 0.31 N ATOM 840 CA GLN A 54 17.338 4.980 -0.525 1.00 0.33 C ATOM 841 C GLN A 54 16.602 5.190 0.816 1.00 0.31 C ATOM 842 O GLN A 54 17.195 5.044 1.872 1.00 0.35 O ATOM 843 CB GLN A 54 17.779 6.317 -1.139 1.00 0.34 C ATOM 844 CG GLN A 54 16.603 7.300 -1.207 1.00 0.31 C ATOM 845 CD GLN A 54 16.580 8.177 0.052 1.00 0.36 C ATOM 846 OE1 GLN A 54 15.530 8.428 0.609 1.00 0.41 O ATOM 847 NE2 GLN A 54 17.697 8.663 0.525 1.00 0.44 N ATOM 848 H GLN A 54 16.059 4.883 -2.278 1.00 0.31 H ATOM 849 HA GLN A 54 18.208 4.368 -0.361 1.00 0.36 H ATOM 850 HB2 GLN A 54 18.568 6.739 -0.536 1.00 0.39 H ATOM 851 HB3 GLN A 54 18.154 6.140 -2.137 1.00 0.38 H ATOM 852 HG2 GLN A 54 16.706 7.926 -2.078 1.00 0.34 H ATOM 853 HG3 GLN A 54 15.681 6.750 -1.273 1.00 0.30 H ATOM 854 HE21 GLN A 54 18.546 8.473 0.076 1.00 0.49 H ATOM 855 HE22 GLN A 54 17.685 9.209 1.335 1.00 0.51 H ATOM 856 N GLN A 55 15.334 5.533 0.797 1.00 0.29 N ATOM 857 CA GLN A 55 14.605 5.756 2.093 1.00 0.29 C ATOM 858 C GLN A 55 14.344 4.426 2.818 1.00 0.29 C ATOM 859 O GLN A 55 14.403 4.367 4.031 1.00 0.33 O ATOM 860 CB GLN A 55 13.286 6.471 1.745 1.00 0.29 C ATOM 861 CG GLN A 55 12.511 5.695 0.679 1.00 0.27 C ATOM 862 CD GLN A 55 11.327 4.967 1.314 1.00 0.28 C ATOM 863 OE1 GLN A 55 11.451 4.379 2.369 1.00 0.46 O ATOM 864 NE2 GLN A 55 10.172 4.979 0.708 1.00 0.31 N ATOM 865 H GLN A 55 14.870 5.652 -0.056 1.00 0.29 H ATOM 866 HA GLN A 55 15.198 6.397 2.729 1.00 0.31 H ATOM 867 HB2 GLN A 55 12.680 6.552 2.636 1.00 0.32 H ATOM 868 HB3 GLN A 55 13.506 7.460 1.376 1.00 0.32 H ATOM 869 HG2 GLN A 55 12.144 6.387 -0.066 1.00 0.29 H ATOM 870 HG3 GLN A 55 13.164 4.978 0.208 1.00 0.28 H ATOM 871 HE21 GLN A 55 10.071 5.449 -0.146 1.00 0.45 H ATOM 872 HE22 GLN A 55 9.407 4.520 1.105 1.00 0.35 H ATOM 873 N MET A 56 14.073 3.358 2.100 1.00 0.29 N ATOM 874 CA MET A 56 13.831 2.048 2.786 1.00 0.30 C ATOM 875 C MET A 56 15.157 1.476 3.297 1.00 0.29 C ATOM 876 O MET A 56 15.191 0.775 4.287 1.00 0.31 O ATOM 877 CB MET A 56 13.212 1.123 1.750 1.00 0.34 C ATOM 878 CG MET A 56 11.924 0.530 2.324 1.00 0.41 C ATOM 879 SD MET A 56 12.301 -1.006 3.202 1.00 0.62 S ATOM 880 CE MET A 56 10.850 -1.009 4.283 1.00 0.88 C ATOM 881 H MET A 56 14.039 3.415 1.122 1.00 0.32 H ATOM 882 HA MET A 56 13.142 2.180 3.604 1.00 0.33 H ATOM 883 HB2 MET A 56 12.991 1.681 0.858 1.00 0.37 H ATOM 884 HB3 MET A 56 13.901 0.325 1.519 1.00 0.38 H ATOM 885 HG2 MET A 56 11.476 1.237 3.013 1.00 0.45 H ATOM 886 HG3 MET A 56 11.234 0.327 1.525 1.00 0.51 H ATOM 887 HE1 MET A 56 11.075 -1.560 5.185 1.00 1.39 H ATOM 888 HE2 MET A 56 10.022 -1.477 3.777 1.00 1.40 H ATOM 889 HE3 MET A 56 10.587 0.010 4.534 1.00 1.36 H ATOM 890 N MET A 57 16.254 1.790 2.644 1.00 0.31 N ATOM 891 CA MET A 57 17.579 1.287 3.123 1.00 0.32 C ATOM 892 C MET A 57 17.856 1.873 4.511 1.00 0.31 C ATOM 893 O MET A 57 18.476 1.247 5.350 1.00 0.35 O ATOM 894 CB MET A 57 18.609 1.801 2.111 1.00 0.36 C ATOM 895 CG MET A 57 18.639 0.877 0.891 1.00 0.37 C ATOM 896 SD MET A 57 19.792 -0.489 1.193 1.00 0.61 S ATOM 897 CE MET A 57 20.994 -0.076 -0.097 1.00 1.59 C ATOM 898 H MET A 57 16.208 2.373 1.858 1.00 0.34 H ATOM 899 HA MET A 57 17.589 0.208 3.157 1.00 0.35 H ATOM 900 HB2 MET A 57 18.339 2.800 1.800 1.00 0.38 H ATOM 901 HB3 MET A 57 19.586 1.819 2.571 1.00 0.44 H ATOM 902 HG2 MET A 57 17.651 0.480 0.717 1.00 0.47 H ATOM 903 HG3 MET A 57 18.960 1.439 0.025 1.00 0.42 H ATOM 904 HE1 MET A 57 21.342 0.939 0.046 1.00 2.17 H ATOM 905 HE2 MET A 57 20.528 -0.161 -1.064 1.00 2.08 H ATOM 906 HE3 MET A 57 21.830 -0.759 -0.041 1.00 1.99 H ATOM 907 N GLN A 58 17.377 3.073 4.756 1.00 0.30 N ATOM 908 CA GLN A 58 17.580 3.715 6.092 1.00 0.32 C ATOM 909 C GLN A 58 16.355 3.476 6.994 1.00 0.32 C ATOM 910 O GLN A 58 16.413 3.682 8.192 1.00 0.40 O ATOM 911 CB GLN A 58 17.750 5.207 5.800 1.00 0.36 C ATOM 912 CG GLN A 58 19.152 5.656 6.221 1.00 0.82 C ATOM 913 CD GLN A 58 19.340 7.130 5.863 1.00 1.30 C ATOM 914 OE1 GLN A 58 19.190 7.993 6.704 1.00 1.83 O ATOM 915 NE2 GLN A 58 19.664 7.455 4.638 1.00 1.97 N ATOM 916 H GLN A 58 16.866 3.546 4.057 1.00 0.30 H ATOM 917 HA GLN A 58 18.471 3.328 6.562 1.00 0.34 H ATOM 918 HB2 GLN A 58 17.618 5.386 4.742 1.00 0.77 H ATOM 919 HB3 GLN A 58 17.014 5.768 6.355 1.00 0.73 H ATOM 920 HG2 GLN A 58 19.268 5.526 7.287 1.00 1.16 H ATOM 921 HG3 GLN A 58 19.891 5.065 5.702 1.00 1.28 H ATOM 922 HE21 GLN A 58 19.783 6.756 3.962 1.00 2.43 H ATOM 923 HE22 GLN A 58 19.786 8.397 4.397 1.00 2.34 H ATOM 924 N ALA A 59 15.254 3.028 6.431 1.00 0.29 N ATOM 925 CA ALA A 59 14.034 2.757 7.248 1.00 0.32 C ATOM 926 C ALA A 59 14.032 1.285 7.661 1.00 0.31 C ATOM 927 O ALA A 59 13.846 0.963 8.819 1.00 0.36 O ATOM 928 CB ALA A 59 12.848 3.059 6.325 1.00 0.36 C ATOM 929 H ALA A 59 15.235 2.854 5.470 1.00 0.29 H ATOM 930 HA ALA A 59 14.005 3.397 8.116 1.00 0.35 H ATOM 931 HB1 ALA A 59 11.926 2.827 6.837 1.00 0.59 H ATOM 932 HB2 ALA A 59 12.925 2.457 5.432 1.00 0.54 H ATOM 933 HB3 ALA A 59 12.858 4.106 6.057 1.00 0.59 H ATOM 934 N ARG A 60 14.254 0.398 6.708 1.00 0.34 N ATOM 935 CA ARG A 60 14.299 -1.077 6.983 1.00 0.41 C ATOM 936 C ARG A 60 12.890 -1.641 7.252 1.00 0.46 C ATOM 937 O ARG A 60 12.520 -2.664 6.706 1.00 0.58 O ATOM 938 CB ARG A 60 15.256 -1.234 8.180 1.00 0.42 C ATOM 939 CG ARG A 60 14.560 -1.909 9.363 1.00 0.51 C ATOM 940 CD ARG A 60 15.578 -2.133 10.481 1.00 0.69 C ATOM 941 NE ARG A 60 15.500 -3.588 10.777 1.00 1.51 N ATOM 942 CZ ARG A 60 14.750 -4.008 11.756 1.00 2.28 C ATOM 943 NH1 ARG A 60 13.479 -4.229 11.553 1.00 2.94 N ATOM 944 NH2 ARG A 60 15.274 -4.192 12.939 1.00 2.66 N ATOM 945 H ARG A 60 14.407 0.713 5.792 1.00 0.38 H ATOM 946 HA ARG A 60 14.722 -1.583 6.128 1.00 0.48 H ATOM 947 HB2 ARG A 60 16.104 -1.831 7.879 1.00 0.48 H ATOM 948 HB3 ARG A 60 15.607 -0.258 8.484 1.00 0.42 H ATOM 949 HG2 ARG A 60 13.761 -1.277 9.722 1.00 0.60 H ATOM 950 HG3 ARG A 60 14.157 -2.860 9.048 1.00 0.65 H ATOM 951 HD2 ARG A 60 16.571 -1.866 10.147 1.00 1.03 H ATOM 952 HD3 ARG A 60 15.307 -1.563 11.356 1.00 1.15 H ATOM 953 HE ARG A 60 16.009 -4.228 10.237 1.00 1.97 H ATOM 954 HH11 ARG A 60 13.083 -4.074 10.647 1.00 2.81 H ATOM 955 HH12 ARG A 60 12.902 -4.551 12.303 1.00 3.70 H ATOM 956 HH21 ARG A 60 16.246 -4.008 13.089 1.00 2.36 H ATOM 957 HH22 ARG A 60 14.703 -4.515 13.693 1.00 3.41 H ATOM 958 N GLU A 61 12.099 -0.986 8.068 1.00 0.46 N ATOM 959 CA GLU A 61 10.719 -1.484 8.343 1.00 0.58 C ATOM 960 C GLU A 61 9.814 -0.312 8.744 1.00 0.45 C ATOM 961 O GLU A 61 9.086 0.209 7.923 1.00 0.41 O ATOM 962 CB GLU A 61 10.866 -2.494 9.489 1.00 0.76 C ATOM 963 CG GLU A 61 10.153 -3.798 9.118 1.00 1.04 C ATOM 964 CD GLU A 61 8.638 -3.574 9.117 1.00 1.24 C ATOM 965 OE1 GLU A 61 8.045 -3.664 10.179 1.00 1.41 O ATOM 966 OE2 GLU A 61 8.097 -3.313 8.055 1.00 1.47 O ATOM 967 H GLU A 61 12.408 -0.161 8.493 1.00 0.45 H ATOM 968 HA GLU A 61 10.322 -1.977 7.470 1.00 0.71 H ATOM 969 HB2 GLU A 61 11.913 -2.692 9.662 1.00 1.05 H ATOM 970 HB3 GLU A 61 10.423 -2.091 10.386 1.00 0.74 H ATOM 971 HG2 GLU A 61 10.472 -4.115 8.135 1.00 1.24 H ATOM 972 HG3 GLU A 61 10.401 -4.562 9.839 1.00 1.22 H ATOM 973 N LEU A 62 9.872 0.113 9.993 1.00 0.46 N ATOM 974 CA LEU A 62 9.033 1.261 10.475 1.00 0.42 C ATOM 975 C LEU A 62 7.528 0.964 10.319 1.00 0.43 C ATOM 976 O LEU A 62 6.847 0.692 11.290 1.00 0.53 O ATOM 977 CB LEU A 62 9.461 2.459 9.617 1.00 0.36 C ATOM 978 CG LEU A 62 9.240 3.762 10.393 1.00 0.50 C ATOM 979 CD1 LEU A 62 10.366 4.746 10.065 1.00 0.63 C ATOM 980 CD2 LEU A 62 7.895 4.377 9.992 1.00 0.64 C ATOM 981 H LEU A 62 10.484 -0.323 10.622 1.00 0.54 H ATOM 982 HA LEU A 62 9.258 1.465 11.510 1.00 0.50 H ATOM 983 HB2 LEU A 62 10.506 2.365 9.366 1.00 0.38 H ATOM 984 HB3 LEU A 62 8.876 2.479 8.712 1.00 0.39 H ATOM 985 HG LEU A 62 9.242 3.555 11.454 1.00 0.64 H ATOM 986 HD11 LEU A 62 10.377 4.939 9.002 1.00 1.17 H ATOM 987 HD12 LEU A 62 11.313 4.321 10.363 1.00 1.23 H ATOM 988 HD13 LEU A 62 10.203 5.670 10.597 1.00 1.11 H ATOM 989 HD21 LEU A 62 7.773 5.328 10.487 1.00 1.22 H ATOM 990 HD22 LEU A 62 7.095 3.712 10.283 1.00 1.09 H ATOM 991 HD23 LEU A 62 7.871 4.522 8.922 1.00 1.20 H ATOM 992 N GLU A 63 7.005 1.018 9.114 1.00 0.38 N ATOM 993 CA GLU A 63 5.548 0.745 8.903 1.00 0.40 C ATOM 994 C GLU A 63 5.328 -0.066 7.615 1.00 0.38 C ATOM 995 O GLU A 63 6.107 0.009 6.682 1.00 0.48 O ATOM 996 CB GLU A 63 4.896 2.130 8.785 1.00 0.44 C ATOM 997 CG GLU A 63 5.498 2.891 7.595 1.00 0.54 C ATOM 998 CD GLU A 63 4.781 4.232 7.422 1.00 0.56 C ATOM 999 OE1 GLU A 63 3.661 4.225 6.936 1.00 0.81 O ATOM 1000 OE2 GLU A 63 5.366 5.243 7.774 1.00 0.86 O ATOM 1001 H GLU A 63 7.571 1.240 8.346 1.00 0.38 H ATOM 1002 HA GLU A 63 5.137 0.218 9.751 1.00 0.44 H ATOM 1003 HB2 GLU A 63 3.833 2.013 8.637 1.00 0.47 H ATOM 1004 HB3 GLU A 63 5.073 2.688 9.693 1.00 0.50 H ATOM 1005 HG2 GLU A 63 6.548 3.066 7.775 1.00 0.70 H ATOM 1006 HG3 GLU A 63 5.380 2.305 6.696 1.00 0.68 H ATOM 1007 N LEU A 64 4.265 -0.832 7.561 1.00 0.35 N ATOM 1008 CA LEU A 64 3.971 -1.645 6.340 1.00 0.35 C ATOM 1009 C LEU A 64 2.561 -1.323 5.828 1.00 0.32 C ATOM 1010 O LEU A 64 1.618 -1.249 6.596 1.00 0.43 O ATOM 1011 CB LEU A 64 4.060 -3.105 6.799 1.00 0.44 C ATOM 1012 CG LEU A 64 4.074 -4.032 5.579 1.00 0.54 C ATOM 1013 CD1 LEU A 64 4.878 -5.293 5.903 1.00 0.67 C ATOM 1014 CD2 LEU A 64 2.636 -4.424 5.215 1.00 0.64 C ATOM 1015 H LEU A 64 3.653 -0.867 8.326 1.00 0.41 H ATOM 1016 HA LEU A 64 4.705 -1.454 5.573 1.00 0.38 H ATOM 1017 HB2 LEU A 64 4.967 -3.246 7.369 1.00 0.55 H ATOM 1018 HB3 LEU A 64 3.208 -3.340 7.419 1.00 0.48 H ATOM 1019 HG LEU A 64 4.531 -3.520 4.744 1.00 0.66 H ATOM 1020 HD11 LEU A 64 4.515 -6.115 5.304 1.00 1.19 H ATOM 1021 HD12 LEU A 64 4.766 -5.534 6.949 1.00 1.30 H ATOM 1022 HD13 LEU A 64 5.921 -5.121 5.682 1.00 1.13 H ATOM 1023 HD21 LEU A 64 2.494 -5.480 5.394 1.00 1.17 H ATOM 1024 HD22 LEU A 64 2.459 -4.210 4.172 1.00 1.23 H ATOM 1025 HD23 LEU A 64 1.944 -3.859 5.821 1.00 1.13 H ATOM 1026 N GLU A 65 2.410 -1.123 4.541 1.00 0.32 N ATOM 1027 CA GLU A 65 1.060 -0.796 3.982 1.00 0.38 C ATOM 1028 C GLU A 65 0.718 -1.735 2.816 1.00 0.36 C ATOM 1029 O GLU A 65 0.951 -1.418 1.666 1.00 0.39 O ATOM 1030 CB GLU A 65 1.171 0.653 3.492 1.00 0.49 C ATOM 1031 CG GLU A 65 1.414 1.590 4.681 1.00 0.63 C ATOM 1032 CD GLU A 65 2.800 2.231 4.555 1.00 0.75 C ATOM 1033 OE1 GLU A 65 3.755 1.629 5.019 1.00 1.00 O ATOM 1034 OE2 GLU A 65 2.883 3.314 3.999 1.00 0.84 O ATOM 1035 H GLU A 65 3.184 -1.183 3.942 1.00 0.37 H ATOM 1036 HA GLU A 65 0.308 -0.866 4.752 1.00 0.45 H ATOM 1037 HB2 GLU A 65 1.993 0.733 2.796 1.00 0.54 H ATOM 1038 HB3 GLU A 65 0.254 0.935 2.997 1.00 0.60 H ATOM 1039 HG2 GLU A 65 0.658 2.362 4.689 1.00 0.71 H ATOM 1040 HG3 GLU A 65 1.362 1.028 5.602 1.00 0.72 H ATOM 1041 N HIS A 66 0.161 -2.888 3.112 1.00 0.39 N ATOM 1042 CA HIS A 66 -0.209 -3.865 2.034 1.00 0.41 C ATOM 1043 C HIS A 66 1.026 -4.220 1.179 1.00 0.43 C ATOM 1044 O HIS A 66 1.991 -4.702 1.750 1.00 0.53 O ATOM 1045 CB HIS A 66 -1.290 -3.151 1.204 1.00 0.46 C ATOM 1046 CG HIS A 66 -2.084 -4.166 0.425 1.00 0.46 C ATOM 1047 ND1 HIS A 66 -2.865 -5.129 1.046 1.00 0.75 N ATOM 1048 CD2 HIS A 66 -2.227 -4.380 -0.924 1.00 0.65 C ATOM 1049 CE1 HIS A 66 -3.436 -5.871 0.080 1.00 0.76 C ATOM 1050 NE2 HIS A 66 -3.082 -5.458 -1.139 1.00 0.61 N ATOM 1051 OXT HIS A 66 0.990 -4.009 -0.024 1.00 0.57 O ATOM 1052 H HIS A 66 -0.018 -3.115 4.050 1.00 0.46 H ATOM 1053 HA HIS A 66 -0.622 -4.759 2.474 1.00 0.47 H ATOM 1054 HB2 HIS A 66 -1.950 -2.609 1.864 1.00 0.54 H ATOM 1055 HB3 HIS A 66 -0.821 -2.460 0.518 1.00 0.55 H ATOM 1056 HD1 HIS A 66 -2.982 -5.247 2.011 1.00 1.07 H ATOM 1057 HD2 HIS A 66 -1.749 -3.801 -1.699 1.00 1.01 H ATOM 1058 HE1 HIS A 66 -4.101 -6.701 0.268 1.00 1.07 H TER 1059 HIS A 66