1HIS A 1 999.90 50.63-178.93 -61.31 -69.74 999.90 999.90 0.00 0.00 34.28 24.34 2.556 2.446 3 5 10.269 10.877 2MET A 2 65.18 149.76 176.65 -60.81-172.14 64.81 999.90 0.00 0.00 33.57 54.03 2.132 1.969 3 6 9.474 8.690 3PRO A 3 -62.28 113.62-178.58 20.84 999.90 999.90 999.90 0.00 0.00 38.17 43.25 2.268 1.970 4 7 10.784 7.800 4LYS A 4 -68.80 93.39 179.41 50.66 178.87 66.04 -73.30 0.00 0.00 33.25 14.11 3.046 2.023 5 7 13.681 8.698 5SER A 5 -92.07 106.22 179.95 -52.97 999.90 999.90 999.90 -1.31 0.00 34.91 44.14 3.245 2.384 4 10 12.929 9.240 6PRO A 6 -78.10 60.46-179.78 -4.64 999.90 999.90 999.90 0.00 0.00 38.19 3.44 2.696 0.667 4 16 10.496 3.392 7GLN A 7 -88.87 -10.71-179.24-174.43 175.93 29.18 999.90 -2.19 0.00 34.25 4.12 2.730 2.201 4 16 10.585 10.033 8LYS A 8 S -75.28 138.33 177.40 -74.19 70.21 62.50 172.56 0.00 0.00 34.10 61.00 2.200 2.370 6 21 10.330 11.848 9PRO A 9 e -66.76 128.55-175.94 24.45 999.90 999.90 999.90 0.00 0.00 38.31 1.11 3.522 1.718 8 26 14.398 10.764 10ILE A 10 E-124.72 157.14 175.83 58.49 87.39 999.90 999.90 0.00 0.00 33.51 12.32 3.233 1.634 10 33 12.644 6.963 11VAL A 11 E-125.77 135.37-178.25 179.97 999.90 999.90 999.90 -2.88 0.00 34.45 44.11 1.498 3.645 14 42 7.511 14.240 12ARG A 12 E -90.32 98.56-177.41 -53.49 177.64-166.65 127.24 -1.72 0.00 34.22 2.43 2.694 2.115 12 38 11.084 10.710 13VAL A 13 E -96.78 108.01 175.96-179.80 999.90 999.90 999.90 -2.27 0.00 34.12 42.53 3.192 2.447 12 50 13.461 9.334 14PHE A 14 E -76.53 104.09-177.40 -68.39 80.36 999.90 999.90 -3.16 0.00 33.87 23.40 3.638 2.315 12 40 14.115 9.859 15LEU A 15 t -71.39 157.87 178.27 -62.42 177.39 999.90 999.90 -0.94 0.00 34.70 74.35 1.013 3.834 12 41 4.469 14.943 16PRO A 16 T -54.10 160.09-175.19 14.21 999.90 999.90 999.90 0.00 0.00 37.78 52.21 2.253 2.344 10 39 10.073 10.626 17ASN A 17 T 68.57 31.34 173.50-165.47 29.26 999.90 999.90 0.00 0.00 32.85 3.31 2.913 2.202 5 26 11.447 9.880 18LYS A 18 T 65.60 23.03 178.21 -52.71 -55.47-178.70 -59.62 0.00 0.00 33.63 72.32 2.716 3.417 6 22 12.095 14.028 19GLN A 19 t -91.92-177.04 176.55 -65.30-156.18 -30.86 999.90 -1.30 0.00 34.18 13.05 2.555 1.434 7 25 11.319 8.338 20ARG A 20 -157.84 156.86 173.33 66.66 174.62-175.95 156.39 0.00 0.00 34.42 10.12 2.664 2.477 9 30 11.839 11.226 21THR A 21 E-156.27 160.51-178.91-172.20 999.90 999.90 999.90 -1.98 0.00 33.68 35.10 1.747 2.512 8 34 7.832 10.325 22VAL A 22 E-116.53 119.75-177.35-179.39 999.90 999.90 999.90 0.00 0.00 33.89 43.22 1.117 1.524 8 36 5.539 6.666 23VAL A 23 E-117.23 152.67 178.32 -61.63 999.90 999.90 999.90 -2.16 0.00 34.40 61.13 3.936 2.525 9 43 15.253 10.861 24PRO A 24 E -75.59 147.66-179.33 29.20 999.90 999.90 999.90 0.00 0.00 38.42 51.32 2.787 2.523 9 38 11.271 9.981 25ALA A 25 e-103.67 126.73-179.67 999.90 999.90 999.90 999.90 -2.94 0.00 34.13 0.00 2.246 3.912 14 35 10.234 15.113 26ARG A 26 t-128.74 146.18 177.59 -60.19 179.63 178.65 152.30 0.00 0.00 34.52 44.13 1.173 2.500 8 29 5.306 10.742 27CYS A 27 T -75.69 132.21-176.64 178.05 999.90 999.90 999.90 0.00 0.00 34.43 41.13 3.262 2.109 7 24 13.006 8.170 28GLY A 28 T 94.06 -23.70 177.93 999.90 999.90 999.90 999.90 0.00 0.00 999.90 0.00 1.751 0.000 6 20 7.327 0.000 29VAL A 29 t -85.26 125.26-179.59 177.87 999.90 999.90 999.90 -0.77 0.00 34.20 52.21 2.106 2.989 12 27 10.627 12.924 30THR A 30 h -82.74 165.92 172.83 70.31 999.90 999.90 999.90 0.00 0.00 34.93 62.33 2.612 3.536 12 35 10.598 14.270 31VAL A 31 H -56.96 -32.38-179.97-179.95 999.90 999.90 999.90 -2.54 0.00 34.39 24.24 2.735 0.712 12 53 12.168 3.522 32ARG A 32 H -68.04 -45.77 177.34-159.25 -83.00 179.91 179.55 -1.98 0.00 34.11 42.21 1.268 1.564 11 45 6.227 7.043 33ASP A 33 H -67.83 -33.42-178.15 -68.76 -75.11 999.90 999.90 0.00 0.00 34.23 4.51 1.390 2.140 8 36 7.074 11.193 34SER A 34 H -74.31 -44.01-173.64-179.75 999.90 999.90 999.90 -2.24 0.00 34.39 22.04 3.136 1.146 13 48 12.537 4.349 35LEU A 35 H -95.79 -4.78-177.67 -59.82-175.85 999.90 999.90 -2.57 0.00 34.16 53.33 1.613 2.231 9 55 8.352 10.420 36LYS A 36 H -58.24 -43.51 178.65 60.40 169.15 -61.36-175.69 -1.18 0.00 33.27 23.13 2.033 1.458 10 40 8.955 6.167 37LYS A 37 H -80.92 -27.85 177.23 -55.28-175.30 66.31 174.73 0.00 0.00 33.91 44.34 2.738 2.571 8 29 12.416 12.082 38ALA A 38 H -64.24 -38.77 176.01 999.90 999.90 999.90 999.90 0.00 0.00 33.84 0.00 2.300 4.263 8 43 11.178 15.838 39LEU A 39 H -79.27 -29.70 179.13 -63.31 177.96 999.90 999.90 -2.49 0.00 34.14 73.43 2.279 2.735 12 40 11.924 11.905 40MET A 40 H -54.63 -48.08 178.61-170.98 -67.10 178.39 999.90 -1.13 0.00 34.08 24.32 2.381 1.218 9 27 11.076 5.138 41MET A 41 h -64.99 -19.12 175.62 59.48 178.59 178.51 999.90 -1.68 0.00 33.69 53.42 1.980 2.103 7 21 9.422 10.171 42ARG A 42 T -87.37 -5.97-176.22 -71.48 -71.72 -55.41 -89.73 -0.87 0.00 34.81 74.05 2.233 1.980 6 29 11.243 10.258 43GLY A 43 T 83.15 16.22-176.19 999.90 999.90 999.90 999.90 -1.85 0.00 999.90 0.00 2.106 0.000 6 24 8.998 0.000 44LEU A 44 t-117.30 171.76 177.10 -56.77 173.48 999.90 999.90 -2.80 0.00 35.08 62.32 1.774 3.171 10 32 8.201 13.903 45ILE A 45 g-133.44 143.90-179.07 54.96 178.74 999.90 999.90 0.00 0.00 34.02 21.00 2.543 1.125 9 32 11.193 5.744 46PRO A 46 G -56.81 -29.69-178.64 17.41 999.90 999.90 999.90 0.00 0.00 38.19 34.55 2.718 3.637 11 44 10.517 14.686 47GLU A 47 G -58.34 -32.38-174.82 -46.04 -57.45 -85.36 999.90 0.00 0.00 34.88 2.44 1.950 1.492 4 35 10.069 7.095 48CYS A 48 e-106.28 9.96-178.24-176.39 999.90 999.90 999.90 -1.57 0.00 34.71 51.43 3.169 1.770 9 34 12.357 8.946 49CYS A 49 E-118.27 166.87 179.63 -59.85 999.90 999.90 999.90 -1.36 0.00 34.26 4.11 2.888 1.061 11 44 13.309 4.489 50ALA A 50 E-132.08 138.90 179.82 999.90 999.90 999.90 999.90 -2.94 0.00 34.32 0.00 3.010 2.164 12 41 12.292 7.794 51VAL A 51 E-111.17 132.11 173.40-179.93 999.90 999.90 999.90 -0.61 0.00 34.78 52.44 3.490 3.038 12 53 13.820 11.803 52TYR A 52 E-139.06 146.89 175.31 62.46 -88.88 999.90 999.90 -2.26 0.00 33.51 61.51 2.565 2.338 11 43 11.356 11.025 53ARG A 53 E-116.62 169.15 174.94 68.04 153.55 -62.38 170.45 -2.25 0.00 34.85 61.11 2.264 1.692 12 37 11.034 8.366 54ILE A 54 E-104.04 115.69-177.06 -56.42-179.80 999.90 999.90 -0.58 0.00 33.44 0.43 2.328 3.164 10 26 9.930 13.994 55GLN A 55 E-131.27 119.69-179.47-175.44 -84.77 147.57 999.90 -3.00 0.00 34.38 54.55 3.725 2.119 7 19 15.179 9.353 56ASP A 56 T 59.31 27.01 179.59-163.80 55.26 999.90 999.90 0.00 0.00 33.55 4.11 1.925 1.840 4 12 9.921 8.909 57GLY A 57 T 89.96 2.51-179.46 999.90 999.90 999.90 999.90 0.00 0.00 999.90 0.00 2.748 0.000 5 13 11.702 0.000 58GLU A 58 E-116.02 133.03 175.37 -56.33 176.20 -78.06 999.90 -1.81 0.00 35.03 14.32 2.265 2.382 7 14 10.230 10.118 59LYS A 59 E -78.13 99.00-178.36 -61.96-177.46-177.63 66.18 0.00 0.00 33.71 14.21 1.949 2.592 8 21 9.051 11.281 60LYS A 60 E -93.67 112.09 176.37 -71.07 -64.23-166.15 -63.98 -2.32 0.00 34.61 74.12 2.893 3.707 8 23 12.952 14.724 61PRO A 61 E -66.19 110.23-176.48 -16.42 999.90 999.90 999.90 0.00 0.00 38.12 23.23 2.859 1.067 8 34 12.839 4.211 62ILE A 62 E -89.13 138.59 177.13 -58.73 179.41 999.90 999.90 -1.56 0.00 34.72 41.12 2.073 1.714 9 40 9.669 7.037 63GLY A 63 t -67.06 138.59 178.09 999.90 999.90 999.90 999.90 0.00 0.00 999.90 0.00 1.640 0.000 7 35 7.781 0.000 64TRP A 64 T -59.45 -22.99 179.86 -71.01 91.97 999.90 999.90 0.00 0.00 34.48 35.12 3.037 2.399 10 39 12.173 10.557 65ASP A 65 T -72.09 -11.84-175.07 58.38 -81.25 999.90 999.90 0.00 0.00 35.21 62.51 1.925 1.690 7 28 8.302 8.512 66THR A 66 t -75.75 135.11 176.17 -49.77 999.90 999.90 999.90 -2.10 0.00 34.72 24.11 2.120 2.303 10 32 8.973 10.920 67ASP A 67 B -62.03 127.21 178.57 -63.60 67.80 999.90 999.90 0.00 0.00 34.74 25.51 0.683 1.165 12 34 3.037 5.988 68ILE A 68 G -61.31 -22.75 177.42-174.65 178.54 999.90 999.90 -2.38 0.00 33.81 10.10 1.906 2.200 13 43 9.653 10.512 69SER A 69 G -54.89 -29.12 178.31 179.34 999.90 999.90 999.90 -0.65 0.00 34.40 2.25 1.314 1.755 11 35 7.133 8.881 70TRP A 70 G -68.79 -26.74-172.01 -65.62 36.07 999.90 999.90 -1.83 0.00 35.21 63.22 2.841 2.609 6 38 12.770 11.607 71LEU A 71 G-105.47 10.88-179.66 -53.27 174.13 999.90 999.90 -1.69 0.00 35.07 53.33 2.988 3.409 10 45 12.306 13.175 72THR A 72 g -50.38 119.22 176.65 -56.74 999.90 999.90 999.90 -0.80 0.00 34.76 31.02 2.526 1.787 10 34 10.892 6.896 73GLY A 73 T 96.73 -21.44-176.81 999.90 999.90 999.90 999.90 -1.35 0.00 999.90 0.00 3.501 0.000 8 30 14.871 0.000 74GLU A 74 e -86.42 172.47-179.51 -63.03 -63.35 83.77 999.90 -2.13 0.00 33.87 32.42 2.337 1.583 7 36 11.380 6.662 75GLU A 75 E-111.18 119.96 179.93 -50.73-176.04 -44.36 999.90 0.00 0.00 34.72 42.42 1.287 2.931 11 41 5.768 13.021 76LEU A 76 E -97.39 155.23 175.34 -56.71 179.77 999.90 999.90 -1.93 0.00 34.77 25.23 2.199 1.852 12 54 9.838 9.902 77HIS A 77 E-127.52 120.53-175.90 -61.41-101.59 999.90 999.90 -2.59 0.00 33.98 53.50 1.788 2.558 11 46 7.740 10.459 78VAL A 78 E-115.95 140.60 174.79-177.76 999.90 999.90 999.90 -3.11 0.00 34.73 60.12 2.226 2.527 12 51 9.390 10.743 79GLU A 79 E-144.26 160.72-178.41 60.40 177.59 -80.45 999.90 -2.08 0.00 33.58 4.41 1.653 1.068 10 44 8.140 5.216 80VAL A 80 E -81.78 139.01-178.69-175.15 999.90 999.90 999.90 0.00 0.00 34.05 24.15 0.996 1.886 9 39 4.766 8.276 81LEU A 81 e -60.57 -42.44 172.93 -67.51 171.36 999.90 999.90 -2.38 0.00 33.74 52.54 2.221 4.005 7 26 9.973 15.439 82GLU A 82 S-146.03 143.13-174.03 58.71 178.61 66.09 999.90 -0.53 0.00 33.24 13.33 3.226 1.466 5 18 13.484 7.553 83ASN A 83 S -78.10 37.62-177.06 -54.50 32.01 999.90 999.90 0.00 0.00 34.76 42.12 1.706 2.209 5 21 9.262 10.498 84VAL A 84 -121.20 90.39 176.01-175.62 999.90 999.90 999.90 -1.23 0.00 34.28 14.41 2.305 1.111 4 16 9.574 4.233 85PRO A 85 -79.05 151.25-179.14 30.21 999.90 999.90 999.90 0.00 0.00 38.60 40.21 1.911 3.094 4 18 9.142 12.027 86LEU A 86 -67.03 999.90 999.90 -61.15 178.93 999.90 999.90 0.00 0.00 34.26 51.44 2.620 2.851 2 15 10.427 11.422