NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2381 8.1727 120.1334 56.7952 34.7644 173.8792 2 V 4.5489 8.1192 122.2066 61.0486 32.3920 174.6600 3 F 4.5100 9.9447 128.8967 57.2335 40.4528 175.0015 4 E 4.3440 9.1197 121.0989 55.8028 30.8518 177.5898 5 R 3.2768 8.8725 122.8910 60.1369 30.0573 179.7308 6 C 4.3125 8.0497 115.4121 59.6324 35.0946 175.4103 7 E 3.8931 8.1414 120.6335 59.2033 29.2082 178.5432 8 L 3.4844 7.9084 119.9752 57.9066 42.1024 178.5221 9 A 3.9320 7.6717 120.6190 55.5270 18.3132 179.9059 10 R 3.8912 7.9845 116.3263 59.5254 29.9395 179.5011 11 T 3.8247 7.7035 115.3310 66.6887 68.5073 176.7278 12 L 3.8496 8.1496 121.2847 57.5112 41.5562 179.5257 13 K 3.9242 8.0106 119.6908 59.5424 31.9394 178.9244 14 R 3.9578 7.7658 117.8148 58.8223 30.0333 177.4493 15 L 4.3941 7.4303 116.4875 53.7822 41.9189 176.5679 16 G 3.8397 7.7957 106.8486 47.1010 0.0000 175.2439 17 M 3.9221 7.8847 121.0577 56.4530 32.4396 175.8179 18 D 4.3983 8.0370 117.7862 55.9745 41.3328 175.8672 19 G 3.9372 9.3412 115.4728 45.4611 0.0000 171.4375 20 Y 4.1595 8.2884 121.9606 58.8562 38.9153 176.4708 21 R 3.6332 9.0005 126.8881 57.2776 27.8691 177.1573 22 G 3.7911 7.9799 102.3388 45.8326 0.0000 174.0163 23 I 4.0518 7.7763 122.2676 59.2323 37.9681 175.9017 24 S 4.6760 8.3001 121.0131 57.8941 64.9719 174.7579 25 L 4.2373 8.6959 124.3197 58.5091 41.8545 179.2554 26 A 4.1445 8.1676 120.2051 55.4230 18.3234 179.2362 27 N 4.5187 8.1491 114.6054 56.3526 38.6472 177.7480 28 W 4.2832 8.1108 120.1593 59.9379 29.0997 178.5824 29 M 4.2039 8.5842 119.1404 58.4637 31.4515 177.9274 30 C 3.1492 8.1327 118.6902 59.0481 44.8316 175.3932 31 L 3.9727 8.0631 121.6878 58.3120 41.7999 178.8568 32 A 4.1252 8.2401 120.6962 54.8237 18.2828 179.5078 33 K 2.8318 7.9232 118.1054 59.2865 32.0680 179.0376 34 W 4.5015 7.5408 116.8443 58.6885 29.1396 178.4725 35 E 4.3327 8.1340 118.7200 58.6213 29.2155 177.6951 36 S 4.5175 7.7485 109.3607 56.7212 64.4666 174.3570 37 G 3.3183 8.3283 108.3387 46.9754 0.0000 173.4216 38 Y 3.5670 7.6448 113.5556 58.7660 35.1121 168.6666 39 N 5.2996 7.6567 119.2686 51.8207 39.7919 175.4379 40 T 3.9501 8.7561 117.5072 64.2197 69.0658 176.2978 41 R 4.0014 7.9964 120.8588 57.7430 30.6385 176.2550 42 A 4.1237 7.5961 120.1598 53.3266 19.2963 176.7960 43 T 4.9456 8.3879 117.5047 61.8435 72.8789 172.8837 44 N 4.9169 8.9940 124.3990 51.9220 41.9420 172.2227 45 Y 4.8323 8.7569 127.8866 56.9611 40.3332 174.5001 46 N 4.5247 8.6548 124.8915 51.4137 38.9894 175.5246 47 A 3.5511 8.4024 127.9160 54.8646 18.8706 178.8302 48 G 3.8148 8.1163 103.7659 48.0945 0.0000 173.7097 49 D 4.7529 7.6319 115.0694 51.8671 40.1136 175.6429 50 R 3.8036 7.7323 117.5246 57.7604 28.2814 175.8306 51 S 4.9831 7.3292 109.4027 56.9206 66.7136 172.8191 52 T 5.0783 8.8216 116.2985 61.9526 72.5362 172.7409 53 D 5.4868 9.1184 125.4559 53.3276 43.0522 175.0476 54 Y 4.8478 9.7934 121.5918 57.4857 41.4949 177.1436 55 G 4.2716 9.2096 111.7383 46.2378 0.0000 173.3509 56 I 3.8999 8.1757 116.7392 62.8999 37.7788 177.0769 57 F 4.6707 7.9514 115.4695 56.4796 40.0377 175.1638 58 Q 3.6036 7.8422 119.2290 57.0794 26.2850 173.5591 59 I 4.5252 8.2310 119.5403 61.0031 39.4393 176.4781 60 N 5.5070 9.1218 125.1951 52.7972 40.3077 175.5224 61 S 5.1717 8.9879 119.4381 59.6769 63.4591 175.1421 62 R 3.9057 8.3188 121.8064 58.4862 30.3000 177.4333 63 Y 3.9767 7.2767 113.0986 58.4220 38.8712 176.2170 64 W 4.8878 8.1180 118.0089 57.0906 31.4908 173.5309 65 C 5.2460 7.9894 110.8431 53.2870 45.5714 171.9380 66 N 5.0924 9.0463 120.5937 52.4843 39.4299 175.0280 67 D 4.8153 8.5649 122.6629 52.2767 40.8772 175.6719 68 G 4.3790 8.6413 111.7964 45.9321 0.0000 175.0729 69 K 4.1455 7.7940 116.1127 58.0350 33.2878 176.7852 70 T 4.4093 7.5845 117.9980 61.8817 68.7200 173.0357 71 P 4.2675 0.0000 0.0000 63.2596 32.5259 176.2413 72 G 3.8334 8.4036 106.1365 46.8967 0.0000 170.5437 73 A 4.8414 7.0961 118.2859 49.6140 23.2886 177.4191 74 V 3.7808 7.9136 112.0691 61.6959 32.3372 177.0535 75 N 4.8342 8.5294 120.6357 51.8821 39.7447 175.1691 76 A 4.2056 8.6641 119.7780 53.6408 18.4545 178.2629 77 A 4.1716 7.8323 118.3199 54.0397 19.1027 177.5338 78 H 4.7421 7.5450 112.5976 54.1864 30.5453 175.0697 79 L 3.9054 8.6329 121.1422 55.7987 43.1474 176.4852 80 S 4.7282 8.6928 121.5560 58.5008 63.6418 176.2176 81 C 4.1142 9.0106 122.2194 59.7216 40.8290 176.5685 82 S 3.8833 7.9559 115.5187 61.4346 62.1750 176.2742 83 A 4.0369 7.7526 123.0728 54.3238 17.8474 178.4967 84 L 4.4801 7.9557 116.3981 54.9482 41.6393 177.5971 85 L 4.9976 7.6012 117.9120 54.5040 42.2826 176.7701 86 Q 4.3266 7.7463 117.8059 55.5538 29.4548 176.0189 87 D 4.3934 8.5321 119.9717 57.1141 41.1498 176.7173 88 N 4.5563 8.0536 118.2222 53.2251 39.0673 174.5782 89 I 4.2384 8.4361 119.0675 60.9875 38.1290 176.9026 90 A 3.9366 8.4933 125.0837 55.9893 18.1695 180.0476 91 D 4.2866 8.0943 116.3644 57.4415 40.9814 178.6281 92 A 4.0998 8.0218 120.7920 55.2407 18.3140 179.7419 93 V 3.3711 8.0640 116.5574 66.0706 31.3448 178.1576 94 A 3.8105 7.8090 120.2234 55.0342 18.1273 179.2587 95 C 4.0073 8.0678 117.0627 62.5257 31.6436 175.4296 96 A 4.0583 8.3271 122.7373 55.2378 17.5237 179.7654 97 K 3.7028 7.7405 116.2817 59.4242 32.3381 179.2088 98 R 4.0046 7.5456 118.7025 59.3042 29.4843 178.4671 99 V 2.2647 7.1947 117.9549 65.7488 31.1419 177.6997 100 V 3.9972 7.1736 108.1428 61.9719 31.6483 177.1793 101 R 4.2051 7.7442 117.9106 57.5437 30.5644 176.7750 102 D 4.6893 7.6211 118.1883 52.7803 41.6350 175.3550 103 P 4.1736 0.0000 0.0000 66.1559 31.1487 177.6061 104 Q 3.9413 8.2148 119.3268 56.6185 30.0282 176.8209 105 G 3.7879 8.1800 107.5469 45.8618 0.0000 174.3147 106 I 3.7281 7.7857 117.9174 63.4190 37.9985 178.4796 107 R 4.3317 7.3357 117.8636 57.9375 29.9787 177.4776 108 A 3.9102 7.7851 121.3412 54.1597 18.7615 177.6610 109 W 4.7600 8.1713 116.9493 55.3138 29.8733 177.6328 110 V 3.7756 8.7356 124.8298 64.9168 30.7341 178.0576 111 A 4.0820 8.3167 120.8682 54.5844 18.1530 179.2380 112 W 4.0853 8.3910 126.7308 60.7764 30.6218 178.3489 113 R 3.7938 8.2207 116.0870 59.3546 29.6351 178.4340 114 N 4.3805 7.8963 114.7018 55.8828 38.7408 176.9514 115 R 4.2027 7.6818 115.8272 56.0349 31.2354 176.0989 116 C 4.5620 7.7744 114.4446 57.9709 42.5823 174.8094 117 Q 3.1960 6.4995 118.6192 57.1986 28.8404 175.4341 118 N 4.2119 8.5831 120.4322 54.6116 36.1336 174.1280 119 R 4.5644 7.5407 113.7215 54.0806 34.1080 175.6692 120 D 4.5219 8.5541 119.6914 54.5257 40.0603 175.6536 121 V 4.5706 8.1396 119.4623 61.2253 32.2785 178.8159 122 R 4.0234 8.1821 123.0466 59.1998 30.1535 179.0034 123 Q 3.9583 8.1961 115.7419 59.4510 28.3375 178.4501 124 Y 4.4166 7.4592 115.0440 59.9351 38.1708 176.8984 125 V 4.4534 7.9711 111.1894 60.2856 33.4676 175.4868 126 Q 4.1263 7.6251 118.1811 57.4841 28.6280 176.8902 127 G 3.9108 8.8709 109.1003 46.3154 0.0000 174.6464 128 C 4.4250 8.0530 116.1487 56.7639 40.6622 174.4127 129 G 3.8565 8.3021 107.1249 46.4155 0.0000 173.9728 130 V 4.0055 7.8096 118.0398 61.0880 32.0658 175.7764 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 1 K 8.17 4.24 0.00 1.70 2.20 0.00 1.13 0.00 0.00 1.41 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.20 1.02 7.81 2 V 8.12 4.55 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.94 0.00 0.00 3 F 9.94 4.51 0.00 2.99 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 4 E 9.12 4.34 0.00 1.95 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 2.31 2.24 0.00 5 R 8.87 3.28 0.00 1.91 1.94 0.00 3.41 0.00 0.00 3.46 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 6 C 8.05 4.31 0.00 2.99 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 7 E 8.14 3.89 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.42 0.00 8 L 7.91 3.48 0.00 1.33 1.35 -0.08 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.67 3.93 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 10 R 7.98 3.89 0.00 1.96 1.98 0.00 3.13 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 11 T 7.70 3.82 4.20 0.00 0.00 0.00 0.00 0.00 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 12 L 8.15 3.85 0.00 1.70 1.57 0.93 0.46 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 13 K 8.01 3.92 0.00 1.84 1.90 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.77 3.96 0.00 2.02 2.08 0.00 3.29 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 15 L 7.43 4.39 0.00 1.46 1.55 0.84 1.07 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 16 G 7.80 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.88 3.92 0.00 1.08 1.88 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.21 0.00 18 D 8.04 4.40 0.00 2.67 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.34 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.29 4.16 0.00 3.36 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 21 R 9.00 3.63 0.00 1.90 1.85 0.00 3.33 0.00 0.00 3.11 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.30 0.00 22 G 7.98 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 23 I 7.78 4.05 1.70 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.81 -0.37 0.00 0.00 24 S 8.30 4.68 0.00 4.12 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 25 L 8.70 4.24 0.00 2.14 1.81 0.99 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.17 4.14 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 0.00 0.00 0.00 0.00 0.00 27 N 8.15 4.52 0.00 2.86 2.77 0.00 0.00 7.02 7.03 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 28 W 8.11 4.28 0.00 3.61 3.14 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 0.00 0.00 0.00 0.00 29 M 8.58 4.20 0.00 2.15 2.36 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.95 0.00 30 C 8.13 3.15 0.00 2.83 3.25 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 0.00 0.00 0.00 0.00 31 L 8.06 3.97 0.00 1.82 1.88 0.62 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.24 4.13 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 7.92 2.83 0.00 1.54 1.52 0.00 0.61 0.00 0.00 0.87 0.00 0.00 2.73 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.99 0.21 7.81 34 W 7.54 4.50 0.00 3.34 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.13 4.33 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.38 0.00 36 S 7.75 4.52 0.00 4.06 4.13 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.33 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 7.64 3.57 0.00 3.21 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 39 N 7.66 5.30 0.00 2.79 2.91 0.00 0.00 7.01 6.95 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 40 T 8.76 3.95 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 41 R 8.00 4.00 0.00 1.85 2.10 0.00 3.30 0.00 0.00 3.24 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 42 A 7.60 4.12 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.39 4.95 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 44 N 8.99 4.92 0.00 2.82 2.80 0.00 0.00 6.46 7.10 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 45 Y 8.76 4.83 0.00 2.92 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 N 8.65 4.52 0.00 2.43 2.63 0.00 0.00 6.53 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.40 3.55 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.12 3.81 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 0.00 0.00 0.00 49 D 7.63 4.75 0.00 2.68 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 7.73 3.80 0.00 2.02 2.16 0.00 3.18 0.00 0.00 3.34 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.55 0.00 51 S 7.33 4.98 0.00 3.91 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 52 T 8.82 5.08 4.11 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 0.00 0.00 0.00 0.70 0.00 0.00 53 D 9.12 5.49 0.00 2.69 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 9.79 4.85 0.00 2.99 2.90 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 55 G 9.21 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.18 3.90 1.69 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 1.80 0.16 0.00 0.00 57 F 7.95 4.67 0.00 3.17 2.91 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.84 3.60 0.00 2.53 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.77 0.00 59 I 8.23 4.53 2.16 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.39 1.17 0.00 0.00 60 N 9.12 5.51 0.00 3.11 2.98 0.00 0.00 6.97 7.63 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 61 S 8.99 5.17 0.00 4.18 4.35 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 0.00 0.00 0.00 62 R 8.32 3.91 0.00 1.53 1.29 0.00 2.58 0.00 0.00 2.87 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.20 0.00 63 Y 7.28 3.98 0.00 2.23 1.70 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 64 W 8.12 4.89 0.00 3.50 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 C 7.99 5.25 0.00 3.20 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 N 9.05 5.09 0.00 2.97 2.72 0.00 0.00 6.92 8.19 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 67 D 8.56 4.82 0.00 2.80 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.64 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 7.79 4.15 0.00 1.92 1.97 0.00 1.60 0.00 0.00 1.74 0.00 0.00 3.12 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.55 7.81 70 T 7.58 4.41 4.23 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 71 P 0.00 4.27 0.00 2.16 2.05 0.00 4.07 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 72 G 8.40 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 A 7.10 4.84 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.91 3.78 1.82 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 0.50 0.00 0.00 0.85 0.00 0.00 75 N 8.53 4.83 0.00 2.81 2.99 0.00 0.00 5.97 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.66 4.21 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.83 4.17 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.54 4.74 0.00 3.20 3.31 0.00 5.70 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.63 3.91 0.00 1.76 1.66 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.69 4.73 0.00 3.79 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.01 4.11 0.00 2.25 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.96 3.88 0.00 4.02 4.10 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 83 A 7.75 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.96 4.48 0.00 1.90 1.82 1.05 0.68 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 85 L 7.60 5.00 0.00 1.79 1.73 1.12 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.75 4.33 0.00 2.20 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.64 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 87 D 8.53 4.39 0.00 2.63 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 N 8.05 4.56 0.00 2.69 2.75 0.00 0.00 6.95 7.94 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 89 I 8.44 4.24 1.78 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.38 0.98 0.00 0.00 90 A 8.49 3.94 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 91 D 8.09 4.29 0.00 2.72 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.02 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 93 V 8.06 3.37 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 0.77 0.00 0.00 0.93 0.00 0.00 94 A 7.81 3.81 1.34 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 95 C 8.07 4.01 0.00 3.17 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.33 4.06 0.73 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 97 K 7.74 3.70 0.00 1.57 1.36 0.00 1.27 0.00 0.00 0.62 0.00 0.00 2.35 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.30 1.00 7.81 98 R 7.55 4.00 0.00 1.91 2.00 0.00 3.24 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 1.79 1.63 0.00 99 V 7.19 2.26 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 -0.10 0.00 0.00 -0.47 0.00 0.00 100 V 7.17 4.00 2.31 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 1.05 0.00 0.00 1.34 0.00 0.00 101 R 7.74 4.21 0.00 2.03 2.02 0.00 3.22 0.00 0.00 3.37 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.99 0.00 102 D 7.62 4.69 0.00 3.03 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 0.00 103 P 0.00 4.17 0.00 2.15 2.20 0.00 3.78 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 104 Q 8.21 3.94 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.95 0.00 0.00 0.00 0.00 0.00 2.44 2.33 0.00 105 G 8.18 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 0.00 106 I 7.79 3.73 1.08 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.86 -0.80 0.00 0.00 107 R 7.34 4.33 0.00 2.02 2.05 0.00 3.28 0.00 0.00 3.32 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.66 0.00 108 A 7.79 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.17 4.76 0.00 3.50 3.24 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.74 3.78 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.98 0.00 0.00 111 A 8.32 4.08 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.39 4.09 0.00 3.52 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 R 8.22 3.79 0.00 2.06 2.00 0.00 3.34 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.97 0.00 114 N 7.90 4.38 0.00 2.63 2.76 0.00 0.00 6.98 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.68 4.20 0.00 1.63 1.26 0.00 2.21 0.00 0.00 2.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.47 0.00 116 C 7.77 4.56 0.00 1.48 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 0.00 117 Q 6.50 3.20 0.00 0.93 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.92 0.00 0.00 0.00 0.00 0.00 2.19 2.32 0.00 118 N 8.58 4.21 0.00 2.81 2.83 0.00 0.00 6.79 7.66 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 0.00 119 R 7.54 4.56 0.00 1.81 1.76 0.00 3.32 0.00 0.00 3.08 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.35 0.00 120 D 8.55 4.52 0.00 2.62 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 0.00 121 V 8.14 4.57 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.07 0.00 0.00 122 R 8.18 4.02 0.00 1.96 2.00 0.00 3.17 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 123 Q 8.20 3.96 0.00 2.03 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.91 0.00 0.00 0.00 0.00 0.00 2.09 1.46 0.00 124 Y 7.46 4.42 0.00 3.08 3.15 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 0.00 0.00 0.00 0.00 125 V 7.97 4.45 2.16 0.00 0.00 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 1.05 0.00 0.00 126 Q 7.63 4.13 0.00 2.21 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.10 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 127 G 8.87 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.05 4.42 0.00 3.07 3.14 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 0.00 0.00 0.00 0.00 129 G 8.30 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.81 4.01 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 0.79 0.00 0.00 0.96 0.00 0.00