1HIS A 1 999.90 -2.46-178.20 56.22-106.13 999.90 999.90 0.00 0.00 33.83 12.12 1.685 2.811 2 5 7.479 12.471 2MET A 2 65.49 111.40 174.47 -60.50-178.96 -61.98 999.90 0.00 0.00 33.78 33.24 2.296 2.176 3 5 9.572 7.913 3PRO A 3 -52.40 127.08-174.96 -26.32 999.90 999.90 999.90 0.00 0.00 38.44 63.14 3.667 4.554 4 6 12.712 15.621 4LYS A 4 -103.59 150.10 170.50 -59.34 -77.00 80.31 178.75 0.00 0.00 35.14 55.01 3.018 3.170 4 7 11.776 11.577 5SER A 5 -95.45 96.48-171.55 177.28 999.90 999.90 999.90 0.00 0.00 34.11 44.32 4.793 3.088 4 8 16.448 10.670 6PRO A 6 -72.94 107.64 173.31 -8.78 999.90 999.90 999.90 0.00 0.00 38.21 24.24 3.268 2.083 4 12 11.597 7.086 7GLN A 7 -87.81 88.92-171.19 55.55-171.80 91.36 999.90 -0.65 0.00 33.46 53.22 4.425 1.990 4 15 15.696 9.427 8LYS A 8 -89.69 154.29-179.26 -59.81 179.25 178.08-179.53 -1.24 0.00 34.27 73.14 2.218 4.512 6 20 8.451 15.887 9PRO A 9 e -59.22 136.46-176.18 19.10 999.90 999.90 999.90 0.00 0.00 38.05 4.32 1.961 1.872 9 25 7.846 8.342 10ILE A 10 E-123.93 162.71 173.27 62.25 169.74 999.90 999.90 0.00 0.00 34.69 52.12 3.127 2.630 10 31 12.977 10.527 11VAL A 11 E-130.88 130.47-174.31-176.91 999.90 999.90 999.90 -2.60 0.00 34.30 41.41 3.206 2.643 15 43 12.101 9.429 12ARG A 12 E -98.66 101.16-176.60 -46.46-179.21-167.84 -94.57 -1.23 0.00 34.45 11.01 3.513 2.580 12 37 13.170 11.012 13VAL A 13 E -96.30 117.54 176.22-175.82 999.90 999.90 999.90 -2.68 0.00 34.76 52.44 2.452 3.004 12 50 10.737 11.517 14PHE A 14 E -91.75 117.57-177.34 -68.22 88.82 999.90 999.90 -3.00 0.00 34.24 44.13 1.643 3.017 11 35 8.827 12.281 15LEU A 15 E -97.68 160.17 174.49 -59.66 175.86 999.90 999.90 -1.62 0.00 35.01 61.32 0.988 4.307 11 39 5.832 15.991 16PRO A 16 T -64.76 173.02-179.48 22.78 999.90 999.90 999.90 0.00 0.00 38.16 51.54 3.330 2.467 9 35 13.409 9.431 17ASN A 17 T 64.34 28.31 178.08 -64.39 -32.46 999.90 999.90 0.00 0.00 33.55 50.11 3.364 3.433 4 22 13.549 13.723 18LYS A 18 T 64.13 34.86-179.50 -58.43 -60.97-179.06 -62.04 0.00 0.00 33.58 52.24 2.808 3.713 5 16 10.227 13.838 19GLN A 19 E-110.33 160.76 179.52 -54.29 -60.56 -33.52 999.90 -0.92 0.00 34.28 74.33 2.205 3.382 7 27 9.714 14.177 20ARG A 20 E-156.62 153.73-179.17 63.35 178.71 63.62-169.47 0.00 0.00 34.35 52.30 2.360 4.122 9 30 10.455 15.594 21THR A 21 E-152.11 137.31 176.50 179.04 999.90 999.90 999.90 -2.92 0.00 34.21 3.35 3.099 3.111 9 37 12.580 12.741 22VAL A 22 E-104.77 120.78-176.97 178.28 999.90 999.90 999.90 0.00 0.00 33.91 33.44 3.325 3.625 8 34 13.421 12.567 23VAL A 23 E-117.36 151.77-179.46 -68.43 999.90 999.90 999.90 -2.46 0.00 34.11 43.53 1.326 2.891 10 42 7.427 9.856 24PRO A 24 E -73.79 129.18 178.12 28.54 999.90 999.90 999.90 0.00 0.00 38.51 14.42 2.484 2.842 8 36 9.879 10.742 25ALA A 25 e -78.79 112.31 179.33 999.90 999.90 999.90 999.90 -2.46 0.00 33.95 0.00 1.685 3.624 13 36 5.870 10.941 26ARG A 26 -126.67 159.59 175.62 -57.75 177.08-177.25 175.83 -0.69 0.00 35.03 10.21 1.167 2.664 9 29 5.408 11.027 27CYS A 27 S -95.28 147.54-174.54-178.13 999.90 999.90 999.90 0.00 0.00 34.11 32.43 3.834 2.686 8 25 15.065 9.040 28GLY A 28 S 85.14 -25.30 176.80 999.90 999.90 999.90 999.90 0.00 0.00 999.90 0.00 3.740 0.000 5 20 13.516 0.000 29VAL A 29 -93.58 111.82-179.75-176.08 999.90 999.90 999.90 0.00 0.00 34.53 51.34 3.622 3.609 10 27 13.514 14.141 30THR A 30 h -75.91 157.71 176.25 60.12 999.90 999.90 999.90 -0.71 0.00 34.45 51.13 2.121 2.882 12 33 9.244 10.715 31VAL A 31 H -53.80 -40.90 178.04-178.09 999.90 999.90 999.90 -2.68 0.00 34.43 30.23 1.035 2.930 12 51 4.964 10.126 32ARG A 32 H -61.25 -37.81-177.59-166.21-176.61 56.29 177.53 -2.99 0.00 35.18 72.44 4.561 4.228 10 45 15.633 15.021 33ASP A 33 H -76.47 -53.85-178.31-172.63 68.66 999.90 999.90 0.00 0.00 34.28 71.33 2.117 3.354 7 33 10.265 12.810 34SER A 34 H -57.94 -41.14-177.36-178.77 999.90 999.90 999.90 -2.94 0.00 34.40 33.02 2.641 2.560 10 42 12.299 8.599 35LEU A 35 h -80.76 6.57 179.31 -65.81-177.30 999.90 999.90 -2.04 0.00 33.87 4.51 4.974 3.328 9 54 17.174 13.582 36LYS A 36 H -55.06 -36.64 177.11 68.74 174.28 77.17 -63.39 -1.70 0.00 33.59 74.14 3.795 3.840 8 34 14.531 14.699 37LYS A 37 H -67.35 -37.45 179.68 53.29 172.29 62.94 62.14 -0.81 0.00 34.20 43.34 2.707 2.639 7 25 10.634 9.122 38ALA A 38 H -70.62 -50.90 176.53 999.90 999.90 999.90 999.90 0.00 0.00 33.82 0.00 0.972 3.891 8 40 3.732 11.732 39LEU A 39 H -55.45 -42.91 178.97 -60.48 179.51 999.90 999.90 -3.00 0.00 34.73 34.24 4.598 2.455 10 39 16.506 9.361 40MET A 40 H -59.45 -57.16-176.42-179.50-179.96 -61.87 999.90 -2.04 0.00 34.37 3.23 3.267 3.544 8 25 12.116 13.969 41MET A 41 H -68.80 -23.13-179.29 66.29-178.85-176.98 999.90 -2.10 0.00 33.66 22.12 2.635 1.792 6 22 11.076 6.293 42ARG A 42 H-103.99 3.32 177.28 -67.41 -59.76 174.46-149.57 -1.98 0.00 33.56 45.54 3.701 3.340 6 31 14.119 12.045 43GLY A 43 h 59.04 48.50-178.76 999.90 999.90 999.90 999.90 -0.98 0.00 999.90 0.00 3.195 0.000 6 30 13.989 0.000 44LEU A 44 t-127.50 159.84 177.51 -60.58 174.94 999.90 999.90 -2.43 0.00 34.74 23.22 1.402 1.270 8 38 7.307 5.426 45ILE A 45 t-138.74 154.79-176.68 51.63-178.37 999.90 999.90 0.00 0.00 33.58 73.22 4.881 4.119 7 34 17.276 15.798 46PRO A 46 T -50.12 -31.86 179.47 -27.75 999.90 999.90 999.90 0.00 0.00 38.55 30.33 3.478 2.897 8 38 12.936 9.849 47GLU A 47 T -84.65 -15.30 179.68 59.42-169.19 74.15 999.90 0.00 0.00 34.02 21.02 1.558 3.781 7 29 7.880 13.682 48CYS A 48 e -97.18 -8.74-177.50 176.50 999.90 999.90 999.90 -2.03 0.00 34.77 74.13 3.614 3.906 11 31 14.168 14.752 49CYS A 49 E-142.55 149.33 178.23 -63.74 999.90 999.90 999.90 -1.06 0.00 34.31 74.14 4.122 3.765 12 39 15.143 14.659 50ALA A 50 E-119.79 134.53 178.85 999.90 999.90 999.90 999.90 -2.54 0.00 34.17 0.00 2.120 4.583 12 37 8.602 14.396 51VAL A 51 E-108.40 125.05 177.13-174.16 999.90 999.90 999.90 -0.51 0.00 34.84 14.32 1.480 1.869 12 51 6.602 8.665 52TYR A 52 E-139.90 152.00 178.46 62.19 -85.59 999.90 999.90 -2.37 0.00 33.95 21.54 4.099 1.971 11 42 15.195 9.220 53ARG A 53 E-122.92 154.97-174.54 77.22-167.72-152.98-125.83 -1.67 0.00 33.64 50.45 3.939 4.301 13 34 15.567 15.089 54ILE A 54 E-110.85 131.40 179.90 -54.26 178.87 999.90 999.90 0.00 0.00 33.90 5.41 2.597 2.135 10 26 11.058 8.249 55GLN A 55 E-137.70 119.62-178.51 179.65-175.98 -90.80 999.90 -1.89 0.00 34.81 32.54 5.184 1.932 7 19 17.907 6.790 56ASP A 56 T 57.46 16.28-179.46 -68.33 79.19 999.90 999.90 0.00 0.00 34.06 63.03 2.589 4.450 4 10 10.558 16.109 57GLY A 57 T 107.59 -10.02-179.32 999.90 999.90 999.90 999.90 0.00 0.00 999.90 0.00 3.000 0.000 5 13 11.271 0.000 58GLU A 58 E -88.02 134.66 173.51 70.08-167.96 45.20 999.90 -2.42 0.00 34.06 41.35 2.933 3.663 7 15 10.202 13.354 59LYS A 59 E -97.74 103.81-178.69 -65.22-179.25 177.81 179.69 0.00 0.00 34.60 72.25 4.471 2.269 8 20 15.768 10.618 60LYS A 60 E-100.49 113.70 176.13 -66.67 -58.13-179.11-175.87 -2.48 0.00 33.94 43.14 3.981 2.256 8 23 14.736 10.442 61PRO A 61 E -64.04 113.07-177.42 -17.43 999.90 999.90 999.90 0.00 0.00 38.22 3.13 2.149 2.320 8 33 8.482 9.408 62ILE A 62 E -86.71 129.25 175.49 -52.58 173.28 999.90 999.90 -2.73 0.00 34.98 52.01 1.595 3.310 9 39 5.528 13.187 63GLY A 63 t -68.55 126.13-179.46 999.90 999.90 999.90 999.90 0.00 0.00 999.90 0.00 3.585 0.000 7 32 13.815 0.000 64TRP A 64 T -52.05 -28.69-177.89 -69.81 80.58 999.90 999.90 0.00 0.00 34.49 20.21 3.379 3.127 9 41 13.183 12.829 65ASP A 65 T -82.74 14.94 179.16 -59.59 89.32 999.90 999.90 0.00 0.00 34.73 14.44 1.537 3.543 7 29 7.647 13.301 66THR A 66 t -93.28 140.74 176.59 -55.62 999.90 999.90 999.90 -2.10 0.00 34.56 22.02 4.766 2.558 10 31 16.658 8.893 67ASP A 67 B -59.85 122.12-174.38 -64.71 79.07 999.90 999.90 0.00 0.00 34.34 31.51 2.748 3.012 11 32 9.262 10.979 68ILE A 68 G -63.00 -19.51 178.71-172.43 176.65 999.90 999.90 -2.36 0.00 33.73 34.55 2.710 2.378 14 41 9.399 9.445 69SER A 69 G -61.11 -19.68 178.68-176.62 999.90 999.90 999.90 -1.26 0.00 34.32 41.33 4.423 4.401 9 35 15.292 15.544 70TRP A 70 G -78.23 -8.04-176.19 -67.90 58.27 999.90 999.90 -2.03 0.00 34.59 65.32 2.054 3.093 7 37 8.741 12.666 71LEU A 71 G-110.67 18.97-174.91 -50.05 178.56 999.90 999.90 -2.21 0.00 35.09 20.14 3.334 2.510 9 46 13.454 8.966 72THR A 72 g -61.56 123.17 171.37 -58.59 999.90 999.90 999.90 -0.86 0.00 34.65 3.50 2.817 0.733 10 35 11.502 3.298 73GLY A 73 T 100.35 -37.33-174.35 999.90 999.90 999.90 999.90 -2.66 0.00 999.90 0.00 3.379 0.000 8 27 11.978 0.000 74GLU A 74 e -96.78 172.62-173.01 60.99-173.00 -63.50 999.90 -0.60 0.00 33.02 3.01 3.046 2.605 8 35 12.548 11.606 75GLU A 75 E -93.75 139.55 173.44 -62.66 65.63 51.56 999.90 0.00 0.00 35.12 3.44 3.573 1.864 11 41 14.388 7.390 76LEU A 76 E-103.57 140.63 179.32 -57.97-173.97 999.90 999.90 -2.96 0.00 34.52 33.41 3.347 2.042 12 50 11.822 8.678 77HIS A 77 E-115.51 117.37-178.31 -56.56-100.14 999.90 999.90 -2.90 0.00 34.40 23.32 2.351 2.354 10 46 9.317 10.755 78VAL A 78 E-112.60 129.42 177.56-175.01 999.90 999.90 999.90 -2.43 0.00 34.64 32.03 3.276 1.780 12 48 13.882 7.211 79GLU A 79 E-135.21 155.02-174.20 52.43-177.13 67.71 999.90 -1.80 0.00 33.45 51.11 3.652 2.014 9 40 13.284 8.131 80VAL A 80 E -78.93 130.94 175.59-178.25 999.90 999.90 999.90 0.00 0.00 34.21 64.32 2.879 4.436 9 30 10.824 15.459 81LEU A 81 e -88.17 -62.72 178.77 -59.53 177.74 999.90 999.90 -2.71 0.00 34.52 40.23 2.937 3.058 8 24 12.526 11.705 82GLU A 82 S-108.34 113.51-177.95 -67.58 -61.83 -79.60 999.90 0.00 0.00 34.12 25.02 3.388 4.118 7 18 12.640 15.277 83ASN A 83 -78.57 72.77-178.32 -48.85 -86.89 999.90 999.90 -0.61 0.00 34.24 52.31 2.385 3.514 6 19 10.584 13.193 84VAL A 84 -111.72 96.44 175.30-175.61 999.90 999.90 999.90 -2.24 0.00 34.39 62.34 5.072 2.325 5 17 17.524 10.415 85PRO A 85 -87.82 161.51-179.46 33.05 999.90 999.90 999.90 0.00 0.00 39.04 14.52 2.972 3.255 3 18 12.231 12.731 86LEU A 86 -108.98 999.90 999.90 34.03 76.14 999.90 999.90 0.00 0.00 32.35 11.05 1.828 1.931 2 11 7.231 7.221