NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 M 3.7223 8.3044 119.9858 55.5532 33.5173 175.8028 -1 D 4.0137 7.0396 118.0004 54.8245 39.4733 170.3642 0 Y 5.1006 7.5455 118.4247 56.7098 41.7737 175.3313 1 M 4.3302 8.6358 121.3706 57.0379 33.3387 176.6608 2 E 4.3918 7.9676 114.9639 55.7461 30.8916 175.7742 3 R 4.8729 8.1069 118.5971 53.3628 33.7640 173.8647 4 P 4.5142 0.0000 0.0000 63.0114 31.9217 176.6962 5 K 4.3078 8.6216 119.4235 57.6830 32.9292 176.8915 6 L 4.9946 7.8919 117.8536 52.7364 45.2877 175.8168 7 G 4.5806 8.7125 107.7460 44.3435 0.0000 171.4039 8 L 4.9653 9.1098 122.2686 52.9178 45.2267 175.4524 9 I 4.5711 8.4731 127.1731 61.0902 37.7356 175.3868 10 V 4.4634 8.6503 127.5839 60.9977 34.1511 175.6501 11 R 4.2931 8.5912 126.0092 55.6029 31.0501 176.0277 12 E 4.4529 8.3427 119.9673 55.6909 30.3547 176.0284 13 P 4.4050 0.0000 0.0000 63.9581 31.7686 177.7042 14 Y 4.2701 7.0852 117.2541 61.2493 37.7833 177.9323 15 A 4.0093 8.1072 121.5947 55.4996 18.5263 179.9469 16 S 4.0555 8.1653 113.2269 61.7201 62.8066 176.8688 17 L 4.0220 8.0161 121.6757 57.9224 41.2123 179.6115 18 I 3.9384 7.8726 119.7477 64.6064 37.0584 178.9588 19 V 3.5963 7.9096 112.8859 63.7086 31.1314 177.3529 20 D 4.8215 8.0294 117.0264 53.6518 40.8954 177.0054 21 G 3.9500 8.0418 107.8439 46.2128 0.0000 174.9297 22 R 4.2079 8.2021 119.0918 56.0582 30.7750 176.3507 23 K 4.4495 7.9011 117.8736 54.7663 33.6923 175.5210 24 V 4.2942 8.3367 119.5036 61.5093 33.1759 175.5683 25 W 5.3923 8.4805 121.8270 54.7958 32.1017 173.9929 26 E 4.6344 9.2022 126.5388 54.4036 31.1308 174.6802 27 I 4.5651 8.0642 128.2977 60.9886 38.0899 175.5199 28 R 4.7440 8.6897 124.5735 54.5691 34.4655 176.5099 29 R 4.1652 8.8298 118.9532 58.2046 30.5032 176.7486 30 R 4.6287 7.6051 114.9629 54.3378 34.2338 174.4222 31 K 4.3365 7.6889 119.2244 56.1505 33.3423 176.0954 32 T 4.4296 7.3895 112.4430 61.2973 69.7662 173.3103 33 R 4.2855 8.4734 125.1268 56.0033 30.8343 176.5331 34 H 4.1796 7.5864 118.7413 56.2657 30.3198 174.6249 35 R 4.6106 8.0450 123.9313 55.4626 34.0937 174.1624 36 G 3.7326 8.7860 106.2355 43.0693 0.0000 171.0443 37 P 5.0028 0.0000 0.0000 63.6266 32.0607 176.0469 38 L 4.6730 8.9374 123.6334 53.8160 45.5943 175.2757 39 G 4.0092 9.4175 114.9127 46.3931 0.0000 172.3289 40 I 4.8072 8.5867 124.3206 59.5859 39.0565 174.8084 41 V 4.7137 8.8011 129.0566 61.3619 33.2612 174.6090 42 S 4.7852 8.8363 122.7684 56.9196 65.8040 174.0565 43 G 3.7888 9.8148 115.1466 46.7747 0.0000 174.0642 44 G 3.9332 8.3992 104.5255 45.3903 0.0000 173.8759 45 R 4.6342 7.7700 117.9055 53.8470 33.6505 174.7050 46 L 4.6801 9.1701 125.0107 54.2248 41.5596 176.9654 47 I 4.1353 8.2012 120.4998 61.1162 39.0657 176.0971 48 G 2.3381 7.0009 107.9731 46.1480 0.0000 170.9003 49 Q 4.9498 6.7609 117.4109 55.9262 32.5805 173.0394 50 A 4.9493 8.6247 119.8166 51.0609 23.5146 174.7550 51 D 5.1772 9.1397 119.9002 52.9634 42.9701 175.8371 52 L 4.6570 9.0434 127.0006 54.6223 42.6244 176.9063 53 V 4.3126 8.4382 119.5374 60.6926 33.0633 175.7871 54 G 4.0275 7.2010 107.4693 46.0294 0.0000 172.2910 55 V 4.9849 8.2877 119.1092 61.0877 34.2367 174.3340 56 E 4.6098 10.2672 127.4733 55.1430 32.4584 175.5440 57 G 3.4519 8.2378 107.7532 42.3279 0.0000 171.4224 58 P 3.9138 0.0000 0.0000 62.5556 32.1527 175.8126 59 F 5.1595 9.2121 120.0411 55.8590 42.7465 174.6181 60 S 4.9539 8.9489 115.4166 56.7529 65.6826 175.4491 61 V 3.6084 8.4756 119.5497 66.2814 30.9485 177.7563 62 E 4.0024 8.1892 116.6947 59.7481 29.3065 178.8885 63 E 4.2529 8.2793 118.0607 59.3242 29.4985 179.4356 64 L 4.1457 7.8388 119.1599 57.5300 41.5125 179.1608 65 L 4.3314 7.8160 117.4039 56.9275 41.6054 178.3952 66 A 4.3185 7.4475 117.8291 52.8871 19.1030 176.7395 67 H 5.2410 8.6098 115.2263 52.9295 30.2929 175.5697 68 Q 3.6734 8.4364 122.1888 59.4794 28.9592 177.0915 69 E 3.9081 7.9408 117.4718 58.8906 29.5912 178.9661 70 K 3.8177 7.8176 120.1432 58.3016 31.1940 177.9823 71 H 5.0013 7.6215 114.7364 53.4331 29.8805 174.6264 72 L 3.7830 7.8125 119.8357 55.4509 39.7624 173.7074 73 A 4.8682 7.4500 120.8026 50.3825 20.6368 178.5336 74 E 4.0152 8.6509 122.5909 55.9998 31.1321 177.7241 75 E 3.8983 8.8768 123.8764 59.5013 29.7997 178.8589 76 A 4.0433 7.9616 120.0317 55.5803 18.4393 179.5585 77 F 4.5786 8.0927 115.5924 60.4806 39.0462 177.8091 78 L 4.0763 8.3184 119.0798 58.0109 41.5013 179.7371 79 R 3.9359 8.2689 117.6392 59.3972 29.8547 179.1428 80 A 4.1152 7.8906 118.8067 54.8965 18.3340 178.7769 81 Y 4.2177 7.9265 117.5634 60.7038 39.4711 177.0161 82 A 3.8653 8.8704 121.9228 52.8720 18.8284 177.5228 83 K 3.6823 8.6091 114.9379 57.9242 30.0183 174.8114 84 D 4.4533 8.2886 110.6006 55.1633 39.9059 172.2788 85 E 4.7968 7.6372 114.4361 52.7947 33.0149 174.0892 86 P 4.5906 0.0000 0.0000 63.1764 32.1037 175.7356 87 L 4.9649 8.6357 121.4288 53.2445 46.1743 175.0431 88 Y 5.3960 9.1955 117.5180 56.2494 42.6115 174.5948 89 A 4.9982 9.1446 123.0554 49.9177 21.7021 175.5498 90 W 4.7818 9.3628 124.2249 56.6043 30.5935 176.0993 91 V 4.5705 9.1619 126.6589 62.5074 31.9989 174.8533 92 L 6.0751 9.6167 128.0614 52.5682 44.8396 175.2860 93 E 4.6571 8.7090 117.6966 55.3367 33.4067 173.9614 94 N 4.4475 8.8304 113.6249 54.2553 36.2683 174.5055 95 A 4.8289 8.1341 118.4992 51.9191 19.7464 177.7476 96 F 5.1197 8.5387 114.8527 55.8174 41.9122 172.9243 97 R 4.5962 8.4445 120.5207 54.7831 31.1587 175.7649 98 Y 4.6881 8.1704 125.0959 57.7435 38.6653 175.8104 99 E 4.1932 9.2684 121.8763 58.8805 29.5122 177.8442 100 K 4.6507 7.8065 117.0881 53.0174 35.4728 174.0825 101 P 4.7008 0.0000 0.0000 63.1187 32.0124 175.7240 102 L 4.6868 8.9824 122.9686 53.6814 43.9582 175.3244 103 H 4.7580 8.7483 121.9777 55.9815 30.8207 174.3437 104 V 4.4594 7.5188 124.9436 59.8498 33.5714 173.4660 105 P 4.0994 0.0000 0.0000 63.5008 31.3640 176.3483 106 R 4.2144 8.3967 120.9730 55.4007 30.9796 176.1706 107 R 4.3199 8.2030 118.4722 55.9410 30.5266 175.2804 108 P 4.6479 0.0000 0.0000 62.7648 32.0284 177.0461 109 G 3.5979 7.9522 108.5270 48.2521 0.0000 174.1983 110 R 3.6851 7.6043 119.9845 56.7503 30.1882 175.7780 111 V 3.7633 8.1673 125.2489 62.4018 32.2612 174.8384 112 M 4.6324 8.1467 125.8357 53.3503 35.1036 174.8161 113 F 5.2074 8.3407 120.0856 55.5842 42.0749 175.2156 114 V 3.9100 8.3723 123.7287 62.0997 32.1480 175.1235 115 D 4.5276 8.7240 126.9203 54.2826 41.2322 175.4022 116 L 4.5936 8.4361 125.9179 54.4255 42.1839 178.5578 117 S 4.2741 8.4372 115.2105 60.6833 62.8150 174.9325 118 E 4.4115 7.8584 117.9550 55.6193 30.0038 176.1418 119 V 3.2353 7.2317 119.8917 62.9456 31.6914 176.4398 120 R 4.0896 7.9195 126.1444 55.2304 28.7660 176.5844 121 W 4.4044 8.2817 121.5079 56.8043 29.1465 176.6966 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ -2 M 8.30 3.72 0.00 1.73 1.56 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.45 0.00 -1 D 7.04 4.01 0.00 2.75 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 Y 7.55 5.10 0.00 3.11 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 8.64 4.33 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 2 E 7.97 4.39 0.00 2.13 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 3 R 8.11 4.87 0.00 1.80 1.87 0.00 3.30 0.00 0.00 3.39 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.49 0.00 4 P 0.00 4.51 0.00 2.44 2.16 0.00 3.89 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 5 K 8.62 4.31 0.00 1.83 1.97 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.49 7.81 6 L 7.89 4.99 0.00 1.57 1.56 0.96 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.71 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 L 9.11 4.97 0.00 1.83 1.56 1.03 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 9 I 8.47 4.57 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.66 0.91 0.00 0.00 10 V 8.65 4.46 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.98 0.00 0.00 11 R 8.59 4.29 0.00 1.99 1.84 0.00 3.34 0.00 0.00 3.34 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.60 0.00 12 E 8.34 4.45 0.00 1.89 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.21 0.00 13 P 0.00 4.40 0.00 2.09 2.12 0.00 2.84 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.76 0.00 14 Y 7.09 4.27 0.00 3.22 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.11 4.01 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.17 4.06 0.00 4.08 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 8.02 4.02 0.00 1.93 1.77 0.97 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 18 I 7.87 3.94 2.06 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.99 0.94 0.00 0.00 19 V 7.91 3.60 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.97 0.00 0.00 20 D 8.03 4.82 0.00 2.77 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 8.04 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 R 8.20 4.21 0.00 1.95 1.99 0.00 3.10 0.00 0.00 3.14 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 23 K 7.90 4.45 0.00 1.71 1.84 0.00 2.00 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.43 1.65 7.81 24 V 8.34 4.29 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.84 0.00 0.00 25 W 8.48 5.39 0.00 3.27 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 9.20 4.63 0.00 2.11 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.89 0.00 27 I 8.06 4.57 1.58 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.74 0.93 0.00 0.00 28 R 8.69 4.74 0.00 1.14 1.45 0.00 2.69 0.00 0.00 2.85 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.50 0.00 29 R 8.83 4.17 0.00 1.81 1.98 0.00 3.05 0.00 0.00 3.06 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.44 0.00 30 R 7.61 4.63 0.00 1.84 1.76 0.00 3.21 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 31 K 7.69 4.34 0.00 1.48 1.55 0.00 1.59 0.00 0.00 1.55 0.00 0.00 2.54 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.92 0.21 7.81 32 T 7.39 4.43 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 33 R 8.47 4.29 0.00 1.74 1.88 0.00 3.42 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 34 H 7.59 4.18 0.00 3.06 3.01 0.00 5.70 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 R 8.05 4.61 0.00 1.67 1.67 0.00 3.34 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.47 0.00 36 G 8.79 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 5.00 0.00 2.19 2.19 0.00 3.77 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.02 0.00 38 L 8.94 4.67 0.00 1.86 1.70 0.96 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 39 G 9.42 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 I 8.59 4.81 1.77 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.38 0.89 0.00 0.00 41 V 8.80 4.71 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.95 0.00 0.00 42 S 8.84 4.79 0.00 3.87 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 9.81 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.40 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.77 4.63 0.00 1.94 1.81 0.00 3.33 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 46 L 9.17 4.68 0.00 1.74 1.78 1.08 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.20 4.14 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.96 0.96 0.00 0.00 48 G 7.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 6.76 4.95 0.00 2.20 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.56 0.00 0.00 0.00 0.00 0.00 1.29 2.03 0.00 50 A 8.62 4.95 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 D 9.14 5.18 0.00 2.83 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 9.04 4.66 0.00 1.83 1.59 1.07 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.44 4.31 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.00 0.00 0.00 54 G 7.20 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.29 4.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.63 0.00 0.00 56 E 10.27 4.61 0.00 1.62 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.44 0.00 57 G 8.24 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 3.91 0.00 1.77 1.59 0.00 3.62 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.94 0.00 59 F 9.21 5.16 0.00 2.88 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.95 4.95 0.00 3.99 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.48 3.61 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.96 0.00 0.00 62 E 8.19 4.00 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 63 E 8.28 4.25 0.00 2.51 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 64 L 7.84 4.15 0.00 1.80 1.61 0.79 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.82 4.33 0.00 1.81 1.75 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 66 A 7.45 4.32 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 H 8.61 5.24 0.00 3.09 2.55 0.00 5.66 0.00 0.00 0.00 0.00 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 Q 8.44 3.67 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 69 E 7.94 3.91 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.23 0.00 70 K 7.82 3.82 0.00 1.14 0.87 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.67 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.84 0.90 7.81 71 H 7.62 5.00 0.00 3.39 3.70 0.00 5.97 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 7.81 3.78 0.00 1.85 1.80 0.99 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 73 A 7.45 4.87 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.65 4.02 0.00 1.53 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.89 0.00 75 E 8.88 3.90 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 76 A 7.96 4.04 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 F 8.09 4.58 0.00 3.21 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.32 4.08 0.00 1.92 1.76 0.89 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 79 R 8.27 3.94 0.00 1.91 2.02 0.00 3.16 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 80 A 7.89 4.12 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 Y 7.93 4.22 0.00 3.01 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 A 8.87 3.87 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 K 8.61 3.68 0.00 1.95 1.83 0.00 1.85 0.00 0.00 1.64 0.00 0.00 3.15 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.43 7.81 84 D 8.29 4.45 0.00 2.77 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 7.64 4.80 0.00 2.05 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.44 0.00 86 P 0.00 4.59 0.00 1.82 1.80 0.00 3.59 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 87 L 8.64 4.96 0.00 1.58 1.54 1.01 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 88 Y 9.20 5.40 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 A 9.14 5.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 W 9.36 4.78 0.00 3.35 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 V 9.16 4.57 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.02 0.00 0.00 92 L 9.62 6.08 0.00 1.61 1.64 1.04 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 93 E 8.71 4.66 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 94 N 8.83 4.45 0.00 3.17 3.18 0.00 0.00 6.88 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.13 4.83 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 F 8.54 5.12 0.00 3.02 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 R 8.44 4.60 0.00 1.78 1.87 0.00 3.25 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 98 Y 8.17 4.69 0.00 3.02 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 9.27 4.19 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 100 K 7.81 4.65 0.00 1.74 1.74 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.42 7.81 101 P 0.00 4.70 0.00 2.12 2.10 0.00 3.79 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 102 L 8.98 4.69 0.00 1.60 1.62 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 103 H 8.75 4.76 0.00 3.13 3.22 0.00 5.87 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.52 4.46 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.92 0.00 0.00 105 P 0.00 4.10 0.00 2.18 2.08 0.00 3.76 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.99 0.00 106 R 8.40 4.21 0.00 1.88 1.90 0.00 3.29 0.00 0.00 3.41 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.65 0.00 107 R 8.20 4.32 0.00 1.79 1.85 0.00 3.19 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 108 P 0.00 4.65 0.00 2.16 2.14 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.94 0.00 109 G 7.95 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 R 7.60 3.69 0.00 2.10 1.86 0.00 3.22 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 111 V 8.17 3.76 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.84 0.00 0.00 112 M 8.15 4.63 0.00 1.95 1.84 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 113 F 8.34 5.21 0.00 3.06 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.37 3.91 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.99 0.00 0.00 115 D 8.72 4.53 0.00 2.74 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.44 4.59 0.00 1.89 1.76 1.05 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.44 4.27 0.00 3.97 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 E 7.86 4.41 0.00 1.89 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.25 0.00 119 V 7.23 3.24 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.59 0.00 0.00 0.62 0.00 0.00 120 R 7.92 4.09 0.00 1.71 1.83 0.00 3.37 0.00 0.00 3.18 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 121 W 8.28 4.40 0.00 3.28 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00