1HIS A 1 999.90 109.19 179.25 -66.42 106.89 999.90 999.90 0.00 0.00 34.40 51.12 10.058 9.600 2 4 19.285 20.417 2MET A 2 -104.01 115.72 178.88 -58.16 -56.57 -59.66 999.90 0.00 0.00 34.47 33.41 8.554 7.381 3 5 19.047 15.932 3PRO A 3 -66.56 72.57-178.68 -15.61 999.90 999.90 999.90 0.00 0.00 37.99 22.22 4.621 10.228 4 6 9.363 20.899 4LYS A 4 -82.78 134.37-178.68 -60.71 174.76 -63.52-174.22 -2.64 0.00 34.39 52.12 5.978 9.027 4 7 15.301 20.264 5SER A 5 -151.02 87.24 176.68 170.21 999.90 999.90 999.90 0.00 0.00 34.51 25.14 6.584 7.222 4 10 16.449 11.441 6PRO A 6 -67.61 87.99-175.82 -14.29 999.90 999.90 999.90 0.00 0.00 37.91 43.01 8.898 7.438 4 14 19.387 14.796 7GLN A 7 -106.84 13.67 174.19 55.20-168.66 89.31 999.90 -1.55 0.00 33.91 10.33 11.742 6.081 4 15 23.498 12.866 8LYS A 8 S -66.43 157.49 174.01 -81.96 58.84 176.86 174.71 0.00 0.00 34.67 54.31 7.937 10.057 6 22 16.030 20.433 9PRO A 9 e -63.41 137.20-174.94 22.02 999.90 999.90 999.90 0.00 0.00 38.11 41.52 7.062 11.691 9 27 14.305 22.945 10ILE A 10 E-133.90 165.79 179.09 51.42 79.79 999.90 999.90 0.00 0.00 33.49 33.40 6.643 5.932 10 33 13.084 13.465 11VAL A 11 E-130.26 135.67 178.97-177.45 999.90 999.90 999.90 -2.50 0.00 34.85 20.01 11.640 9.870 14 43 22.201 18.731 12ARG A 12 E -89.70 100.01-179.36 -78.64 73.09 68.67 140.54 -1.65 0.00 33.89 12.55 4.135 9.342 12 36 8.033 20.011 13VAL A 13 E -95.85 109.92 176.13-177.08 999.90 999.90 999.90 -2.69 0.00 34.28 12.32 4.432 9.149 12 51 9.140 19.105 14PHE A 14 E -80.80 117.98 179.67 -67.01 -74.24 999.90 999.90 -2.74 0.00 34.17 22.44 11.110 6.864 12 37 24.031 15.986 15LEU A 15 E -93.72 157.68 179.63 -58.71 177.66 999.90 999.90 -1.35 0.00 34.63 22.25 7.312 5.328 11 39 16.569 11.762 16PRO A 16 T -63.57 168.67 177.90 21.20 999.90 999.90 999.90 0.00 0.00 38.16 35.41 7.371 8.318 10 33 16.854 15.191 17ASN A 17 T 61.38 33.59 175.48 -63.95 29.46 999.90 999.90 0.00 0.00 33.47 63.31 9.404 10.752 4 23 20.583 21.462 18LYS A 18 T 70.14 23.89 178.88 -50.44 -56.78 175.60 -58.53 0.00 0.00 33.53 71.41 3.502 7.758 6 16 7.160 18.021 19GLN A 19 E -99.62 163.56 178.31 -57.69 -60.15 -29.89 999.90 -1.00 0.00 34.33 61.31 12.686 8.731 7 27 25.376 19.329 20ARG A 20 E-160.42 159.47 178.27 57.41-172.43 57.90 178.77 0.00 0.00 33.99 51.14 9.086 5.594 9 33 19.395 12.288 21THR A 21 E-155.62 150.99 177.10 177.42 999.90 999.90 999.90 -2.35 0.00 34.37 25.31 7.110 8.614 9 39 16.380 18.457 22VAL A 22 E-117.80 119.41-175.55-174.74 999.90 999.90 999.90 0.00 0.00 34.08 53.40 6.251 10.744 8 39 12.823 20.968 23VAL A 23 E-116.00 150.36-178.97 -63.18 999.90 999.90 999.90 -1.86 0.00 34.22 45.12 7.879 7.784 10 44 18.001 16.116 24PRO A 24 E -71.21 124.98 177.57 26.67 999.90 999.90 999.90 0.00 0.00 38.18 1.40 8.815 3.788 9 37 17.482 6.899 25ALA A 25 e -78.76 103.78-174.34 999.90 999.90 999.90 999.90 -2.18 0.00 33.84 0.00 7.375 6.755 13 37 17.402 6.205 26ARG A 26 -115.93 160.61-178.89 -58.86 160.66 -66.46-157.26 -0.94 0.00 35.26 1.13 6.987 5.372 9 30 17.752 15.610 27CYS A 27 S -87.02 137.87-179.87-178.25 999.90 999.90 999.90 0.00 0.00 34.13 72.32 11.582 13.506 7 24 22.539 23.437 28GLY A 28 S 77.62 -11.74 179.86 999.90 999.90 999.90 999.90 0.00 0.00 999.90 0.00 8.543 0.000 6 21 16.703 0.000 29VAL A 29 -93.60 123.66-178.38-177.27 999.90 999.90 999.90 0.00 0.00 34.17 11.54 8.978 8.006 10 28 20.621 16.311 30THR A 30 h -74.73 168.54 172.63 70.63 999.90 999.90 999.90 -0.54 0.00 34.98 53.11 4.556 12.089 12 33 8.684 23.158 31VAL A 31 H -61.64 -33.78 179.90-179.82 999.90 999.90 999.90 -2.30 0.00 34.23 2.55 10.757 4.867 12 52 23.156 10.463 32ARG A 32 H -66.18 -51.32-179.81-164.00-125.27 -55.67 115.75 -1.75 0.00 34.60 23.24 5.657 8.780 9 43 10.685 18.762 33ASP A 33 H -66.94 -21.14 178.86 -65.94 -69.47 999.90 999.90 0.00 0.00 33.97 60.43 9.302 6.437 7 35 20.678 14.420 34SER A 34 H -86.02 -48.88-176.74 -64.06 999.90 999.90 999.90 -1.20 0.00 34.04 21.32 4.572 10.813 12 46 10.302 20.962 35LEU A 35 H -82.83 -2.27 178.75 -66.23-179.36 999.90 999.90 -2.84 0.00 33.72 53.32 4.396 13.051 9 55 10.699 24.872 36LYS A 36 H -55.46 -25.81 175.80 65.49-178.42 -59.02-178.12 -1.07 0.00 33.99 50.21 12.173 8.060 10 38 23.882 15.879 37LYS A 37 H -81.32 -48.85-178.52 -59.04 -63.11-177.09 178.27 -0.82 0.00 34.72 3.41 5.226 7.036 7 28 11.298 14.874 38ALA A 38 H -59.85 -44.52 177.99 999.90 999.90 999.90 999.90 0.00 0.00 34.14 0.00 6.239 7.942 9 44 15.211 12.566 39LEU A 39 H -62.76 -46.57-177.78 -60.28 176.23 999.90 999.90 -3.07 0.00 34.40 35.23 3.743 5.128 11 42 6.276 13.059 40MET A 40 H -59.12 -46.86 179.42-172.57 67.87 -86.11 999.90 -0.86 0.00 34.04 15.55 9.308 4.380 9 28 18.266 9.957 41MET A 41 h -67.75 -8.61 174.94 60.65 178.18 -66.43 999.90 -2.33 0.00 33.47 62.42 7.421 8.990 7 22 14.444 17.898 42ARG A 42 T-112.11 2.52 179.26 -55.55 -51.47 -55.29-176.13 -1.29 0.00 34.20 44.43 8.637 9.813 6 30 17.616 21.275 43GLY A 43 T 74.50 11.76-176.53 999.90 999.90 999.90 999.90 -1.66 0.00 999.90 0.00 10.280 0.000 7 28 18.822 0.000 44LEU A 44 t -90.00 176.21 178.29 -55.52 175.40 999.90 999.90 -2.70 0.00 34.67 3.24 6.700 1.978 10 36 15.747 3.301 45ILE A 45 g-140.10 143.24-176.63 50.05 177.67 999.90 999.90 0.00 0.00 33.92 24.23 7.830 8.372 10 33 17.585 20.514 46PRO A 46 G -55.74 -49.68-174.62 -22.79 999.90 999.90 999.90 0.00 0.00 38.50 61.13 8.907 9.718 10 41 20.167 22.002 47GLU A 47 G -73.57 5.54 175.57 52.60 -79.40 -73.48 999.90 0.00 0.00 32.87 65.35 12.549 9.059 4 32 24.610 18.920 48CYS A 48 e-128.29 15.35 178.39-175.42 999.90 999.90 999.90 -1.48 0.00 34.15 23.15 9.865 6.403 10 32 20.238 10.635 49CYS A 49 E-129.49 137.10-178.63 -60.76 999.90 999.90 999.90 -1.95 0.00 34.27 23.25 7.903 6.657 12 44 20.099 11.000 50ALA A 50 E-109.75 120.94 175.68 999.90 999.90 999.90 999.90 -3.02 0.00 34.27 0.00 7.397 7.316 11 37 15.737 0.000 51VAL A 51 E -98.88 139.13 175.43-175.91 999.90 999.90 999.90 -0.61 0.00 34.72 52.33 7.743 8.524 12 53 18.465 19.488 52TYR A 52 E-146.89 153.35 177.96 61.63 87.11 999.90 999.90 -2.08 0.00 33.42 43.24 4.935 9.806 11 41 12.132 22.141 53ARG A 53 E-114.29 159.56 178.42 65.93-169.61 -51.81-130.08 -2.55 0.00 34.58 50.33 2.068 9.428 11 35 3.601 19.447 54ILE A 54 E-101.91 95.57-175.74 -58.03-179.18 999.90 999.90 0.00 0.00 33.32 23.33 2.333 5.870 9 26 4.164 11.755 55GLN A 55 E-108.74 128.12-179.76-135.56 -62.44 -31.61 999.90 -1.78 0.00 34.57 55.21 9.035 5.740 7 19 20.206 13.870 56ASP A 56 T 64.71 20.17 179.46-161.25 83.32 999.90 999.90 0.00 0.00 33.75 53.30 9.467 11.085 4 11 21.197 21.009 57GLY A 57 T 97.16 -20.09-177.89 999.90 999.90 999.90 999.90 0.00 0.00 999.90 0.00 7.971 0.000 5 13 15.044 0.000 58GLU A 58 E-108.36 162.20-177.78 61.85-173.89 -77.95 999.90 -1.55 0.00 34.09 25.53 7.104 11.210 6 14 13.249 22.819 59LYS A 59 E -82.20 143.27-179.80 -65.06-179.95 172.75-177.39 0.00 0.00 33.89 51.02 5.125 5.625 8 20 12.259 12.135 60LYS A 60 E-139.89 120.58-177.97 -75.36 -73.71 167.48 -71.05 -2.44 0.00 34.47 3.34 9.799 8.609 8 23 18.924 19.243 61PRO A 61 E -65.76 144.20-178.48 23.65 999.90 999.90 999.90 0.00 0.00 38.09 34.11 6.978 10.585 8 34 15.251 20.351 62ILE A 62 E-118.83 124.17 175.44 -56.80 176.33 999.90 999.90 -3.30 0.00 34.89 2.25 10.666 7.625 9 40 23.804 19.985 63GLY A 63 t -70.12 141.52 178.41 999.90 999.90 999.90 999.90 0.00 0.00 999.90 0.00 12.091 0.000 7 33 22.818 0.000 64TRP A 64 T -65.64 -16.08 174.83 -67.60 87.71 999.90 999.90 0.00 0.00 33.72 3.12 4.706 7.289 10 40 10.718 18.346 65ASP A 65 T -72.99 -16.37-177.96 54.33 -85.06 999.90 999.90 0.00 0.00 35.24 50.24 6.196 6.569 7 27 17.276 14.574 66THR A 66 t -69.47 136.96 176.80 -49.34 999.90 999.90 999.90 -1.99 0.00 34.66 13.31 7.934 2.500 9 32 19.256 3.971 67ASP A 67 B -69.45 128.08-179.21 -56.08 78.40 999.90 999.90 0.00 0.00 34.53 24.12 5.026 9.552 13 34 11.798 18.631 68ILE A 68 G -59.07 -20.73 177.44-173.50 62.02 999.90 999.90 -2.43 0.00 33.93 43.34 9.864 5.787 13 43 19.370 11.674 69SER A 69 G -59.84 -26.71 177.21 57.01 999.90 999.90 999.90 -0.75 0.00 34.80 53.51 9.803 13.016 11 35 18.907 23.388 70TRP A 70 G -69.48 -21.56-173.72 -72.97 64.36 999.90 999.90 -2.22 0.00 34.81 12.41 5.274 6.640 6 37 10.847 15.869 71LEU A 71 G-110.49 21.02-176.18 -52.85 173.25 999.90 999.90 -1.65 0.00 35.08 14.42 7.474 6.268 10 44 17.695 14.627 72THR A 72 g -58.80 121.32 170.78 -58.65 999.90 999.90 999.90 -0.98 0.00 34.39 3.52 9.282 8.790 10 36 19.905 18.555 73GLY A 73 T 83.01 4.23 179.68 999.90 999.90 999.90 999.90 -1.63 0.00 999.90 0.00 12.467 0.000 9 29 24.225 0.000 74GLU A 74 e-111.82 172.70-178.67 68.47-175.30 86.85 999.90 -1.62 0.00 33.39 43.40 5.726 10.780 7 36 11.885 21.008 75GLU A 75 E-102.98 127.20 178.91 -66.06 71.29 73.20 999.90 0.00 0.00 33.87 2.32 7.724 5.291 10 40 15.935 12.878 76LEU A 76 E-103.67 159.62 176.32 -55.34 177.36 999.90 999.90 -2.64 0.00 35.06 22.30 6.308 3.521 12 49 11.915 6.904 77HIS A 77 E-128.75 127.12-178.50 -58.57 -89.57 999.90 999.90 -2.20 0.00 34.13 74.44 9.952 8.758 11 44 20.259 21.188 78VAL A 78 E-117.84 146.78 174.35-176.74 999.90 999.90 999.90 -2.74 0.00 34.61 11.23 5.397 7.280 12 47 12.039 17.789 79GLU A 79 E-141.88 140.93-177.12 57.73-175.59 -79.09 999.90 -1.93 0.00 33.62 54.50 10.424 11.242 9 40 22.713 22.382 80VAL A 80 E -82.90 132.45-178.79-179.93 999.90 999.90 999.90 0.00 0.00 34.08 41.32 8.220 8.498 9 35 18.709 15.829 81LEU A 81 e -77.92 -52.93 179.89 -54.25-177.40 999.90 999.90 -2.65 0.00 34.50 34.42 3.665 7.217 7 23 7.183 16.772 82GLU A 82 -126.10 151.55-179.57 -68.15-176.78 60.53 999.90 -0.70 0.00 34.43 53.12 6.111 7.787 6 20 16.430 15.017 83ASN A 83 S -88.42 28.44-174.96 57.22 -33.56 999.90 999.90 0.00 0.00 34.79 31.32 11.408 8.546 5 19 22.057 17.183 84VAL A 84 -115.16 108.00 169.03 53.69 999.90 999.90 999.90 0.00 0.00 33.79 21.25 6.573 2.300 5 17 15.542 5.132 85PRO A 85 -90.29-176.81 177.86 33.68 999.90 999.90 999.90 0.00 0.00 39.20 53.34 7.349 8.169 6 18 15.887 16.458 86LEU A 86 -151.24 999.90 999.90 56.39 168.91 999.90 999.90 0.00 0.00 32.34 62.45 5.880 9.404 2 14 14.955 18.528