NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.0966 8.1749 117.3782 64.6038 69.7913 173.5348 6 Y 3.9449 8.6029 121.2973 58.1663 35.8762 166.1505 7 E 4.2730 8.9217 125.0744 56.6419 31.1985 176.3559 8 I 4.4957 7.9222 120.4591 58.3143 41.2551 175.8095 9 S 4.5998 9.5668 123.2603 57.7032 65.1808 175.5986 10 S 4.4348 8.6381 117.2620 61.6937 62.8203 176.5692 11 A 4.4288 7.9857 122.9602 55.4499 18.3251 179.3536 12 E 3.8398 8.1643 117.0638 59.3537 29.3979 179.7191 13 W 4.1699 8.2049 119.0950 59.6752 28.9752 178.1316 14 E 4.2154 8.3752 119.3546 58.9431 29.0368 179.1691 15 V 3.5507 7.6709 118.0172 66.0720 31.7284 177.6632 16 M 3.4321 7.7881 118.3213 58.4264 31.2447 178.4199 17 N 4.8549 8.6643 116.7946 56.7430 38.6984 177.5466 18 I 3.6757 7.3296 120.6974 64.3532 37.2394 178.5210 19 I 3.8061 7.6096 120.7653 63.9073 36.7316 177.8622 20 W 4.6489 8.2002 117.6305 58.2939 28.9055 177.1962 21 M 4.3780 7.3680 118.0457 57.5620 32.3846 177.1212 22 K 4.2948 8.0596 116.0068 55.7075 32.5928 177.6242 23 K 4.2275 8.1974 124.5672 57.1226 31.1938 175.4593 24 Y 5.1511 7.8260 113.0922 56.1080 41.0248 174.7552 25 A 4.9432 9.2535 125.4857 50.2829 23.1581 175.8615 26 S 5.4604 9.2254 116.7090 57.1428 64.8657 175.2644 27 A 3.8942 9.1494 122.0139 55.8072 17.9185 179.8319 28 N 4.3882 8.2215 114.0861 56.1800 38.5612 177.3589 29 N 4.3376 7.8671 118.1535 56.5094 38.7434 177.2511 30 I 3.7260 7.6955 121.0792 64.6034 37.0745 178.6540 31 I 3.7595 7.7873 120.4450 64.1474 36.7543 177.9406 32 E 3.9021 8.2425 119.3191 59.4788 29.7996 178.3333 33 E 4.0624 8.5120 118.7628 59.6669 29.5855 179.3119 34 I 3.6004 7.8355 119.3947 64.6181 37.0922 178.1580 35 Q 4.6204 7.9280 117.4980 57.3214 28.4949 177.9993 36 M 4.1649 7.7737 120.2792 57.3874 32.0442 177.0214 37 Q 4.2612 7.6670 116.4434 57.0381 30.4265 175.9970 38 K 4.1737 7.1160 116.4642 54.8488 34.0377 176.1461 39 D 4.7065 8.0626 123.3405 52.6789 39.3914 175.7780 40 W 5.1192 7.4603 120.2921 54.8003 32.4528 177.0096 41 S 4.6097 8.3376 115.4892 57.3828 65.0388 173.6046 42 P 4.3047 0.0000 0.0000 65.3177 31.0545 178.6818 43 K 3.9592 8.0981 118.1904 59.9553 31.9373 178.2578 44 T 3.7735 7.6489 115.2606 67.1241 68.5489 176.5360 45 I 3.7858 7.7321 120.9077 64.4371 37.0751 178.7595 46 R 3.8816 8.7610 119.8156 59.3193 29.7201 179.2045 47 T 3.7745 7.8391 115.5611 66.6526 68.5485 176.3482 48 L 3.8343 7.4405 120.7999 57.9326 41.6478 179.7503 49 I 3.4329 7.4533 119.1703 64.6292 37.0333 178.4906 50 T 3.8672 7.8660 116.5221 66.8359 68.4337 176.5800 51 R 3.9475 8.1833 120.6483 59.3803 29.9952 178.4518 52 L 3.8135 7.7818 118.6187 57.2816 41.5628 178.5743 53 Y 4.3772 7.7674 121.2040 60.2046 38.6493 177.7417 54 K 3.7520 8.5473 118.9728 59.2855 32.3618 178.3246 55 K 3.9670 7.7084 118.0162 57.1249 32.2756 177.4261 56 G 3.8819 8.3511 106.5999 46.4181 0.0000 174.3984 57 F 4.3557 9.0069 121.8245 58.8542 40.2297 175.6208 58 I 5.0375 7.6738 110.1732 59.3446 41.8730 173.3333 59 D 5.0699 8.2868 121.4530 52.7851 45.3223 173.5836 60 R 5.0310 8.2510 115.0610 54.6004 31.9828 175.6814 61 K 4.8490 8.9778 121.8615 55.3157 35.3535 177.2144 62 K 5.0066 8.1155 117.2069 55.8895 32.4058 176.9346 63 D 4.2318 8.1130 118.2215 55.8050 42.4204 176.0056 64 N 4.0167 8.5429 124.5427 54.3333 36.4062 175.7791 65 K 3.9912 8.6066 122.3616 59.8740 32.7498 177.9869 66 I 3.7835 7.4558 119.6011 61.1300 37.9829 174.5226 67 F 5.2465 8.6684 123.2369 56.8619 40.4097 174.5305 68 Q 4.9785 8.4229 123.7433 54.6003 30.5943 174.7538 69 Y 4.8564 9.3022 123.2234 57.5473 39.8428 174.3055 70 Y 5.2672 8.8258 120.5765 55.4217 42.4227 173.5966 71 S 4.7310 8.6385 114.3882 57.2407 63.4934 173.4023 72 L 4.7577 8.5824 125.7532 54.3587 42.2363 176.3374 73 V 4.3163 7.9013 118.4628 60.4247 34.1855 175.8251 74 E 4.1680 8.5965 126.0577 55.9775 29.7051 176.5845 75 E 2.9747 8.7240 127.1970 59.5122 28.9703 178.4886 76 S 4.0715 7.6873 113.6975 61.2838 62.8846 176.3862 77 D 4.3819 7.3945 122.6151 57.3542 40.6892 178.4292 78 I 3.8145 8.1330 119.4701 64.1211 38.0537 177.9875 79 K 4.1391 8.2691 119.4672 59.5873 31.7851 178.6107 80 Y 4.0278 7.7941 119.1033 60.7366 38.8076 177.9702 81 K 3.6049 8.4395 120.5963 59.8346 32.2163 178.8509 82 T 4.0963 8.3620 116.4974 66.5555 68.3254 176.9049 83 S 4.3596 8.1111 117.1687 61.0224 62.8624 176.7881 84 K 3.8291 7.9129 121.5403 59.5675 31.7980 179.1005 85 N 4.5003 7.9643 116.3170 56.0754 38.4123 177.1460 86 F 4.3336 8.2671 122.0738 61.5002 39.3906 177.0552 87 I 3.5086 8.1703 119.5499 64.6823 36.7758 177.8665 88 N 4.2299 7.9325 115.5932 56.8706 38.4258 176.8713 89 K 4.0187 7.6245 119.5424 59.2840 32.4227 178.9426 90 V 3.6101 7.3513 118.7990 64.9354 32.6285 177.1302 91 Y 4.3773 7.1849 123.3512 55.8600 36.5456 176.1686 92 K 3.9029 8.5092 124.5242 59.7012 32.7579 178.7191 93 G 3.9375 7.6114 105.2909 44.6642 0.0000 174.2287 94 G 3.9338 7.9841 110.2174 44.3983 0.0000 174.5309 95 F 4.2397 8.9172 119.0833 61.9966 38.9710 177.0867 96 N 4.0390 8.1618 115.1020 56.0385 38.1824 177.3722 97 S 4.0044 8.0628 117.0301 61.3114 62.9126 176.2875 98 L 2.4517 7.1361 122.2436 57.7418 41.7330 179.0718 99 V 3.3747 7.0088 117.8354 65.8616 31.3129 177.6467 100 L 3.8569 8.0781 120.4796 58.1254 41.7557 178.5421 101 N 4.3221 8.2383 117.1776 56.5597 38.9110 176.8068 102 F 3.8092 8.6469 122.5722 60.9125 39.1975 177.4495 103 V 3.6485 7.8902 117.7825 65.9639 31.5068 177.6777 104 E 4.0697 7.7512 116.2151 58.8080 29.5397 178.2805 105 K 4.0941 7.5512 119.1928 56.9077 32.8731 176.3921 106 E 3.9456 7.6306 120.3760 54.8963 30.1594 175.4252 107 E 4.2031 8.5412 127.4517 55.2440 28.9276 175.1399 108 L 4.7573 8.1304 126.6559 53.5269 43.1726 177.9976 109 S 4.3910 8.6505 118.2268 57.8648 65.1997 175.1027 110 Q 3.9237 8.7038 124.0397 59.8467 28.6233 178.8883 111 D 4.3614 8.0722 118.9837 57.4834 40.7008 178.5076 112 E 3.9916 8.1465 118.0393 59.4037 29.8909 179.2643 113 I 3.8756 8.4557 120.1395 64.4629 37.1436 178.3183 114 E 3.9596 8.7196 119.6915 59.4993 29.0955 178.8654 115 E 3.9018 8.3432 118.4698 59.5224 29.4718 178.6239 116 L 4.2033 7.8072 118.0296 57.0496 41.6247 179.4829 117 R 3.8972 8.1833 119.2181 59.1369 30.0865 178.3043 118 N 4.5384 7.9889 114.9126 54.7382 37.1669 176.6501 119 I 3.8184 7.1384 122.2252 64.1978 37.3249 177.5403 120 L 4.2398 7.9290 119.1044 57.0176 41.6767 178.4695 121 N 4.5923 7.9447 115.1862 54.7709 40.1308 176.2026 122 K 4.2255 7.5011 121.0961 55.6610 30.3565 177.1775 123 K 4.2023 7.7737 121.2589 56.8785 31.8643 176.3416 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 5 T 8.17 4.10 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 0.78 0.00 0.00 6 Y 8.60 3.94 0.00 3.25 3.43 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 7 E 8.92 4.27 0.00 2.03 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 0.00 2.41 2.49 0.00 8 I 7.92 4.50 1.44 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 0.59 0.49 0.69 0.00 0.00 9 S 9.57 4.60 0.00 4.04 3.96 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.64 4.43 0.00 4.01 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 0.00 11 A 7.99 4.43 1.18 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 0.00 0.00 0.00 0.00 0.00 12 E 8.16 3.84 0.00 1.93 1.68 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 2.08 2.18 0.00 13 W 8.20 4.17 0.00 3.72 3.30 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 14 E 8.38 4.22 0.00 2.25 2.17 0.00 0.00 0.00 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 2.36 0.00 15 V 7.67 3.55 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 0.86 0.00 0.00 0.92 0.00 0.00 16 M 7.79 3.43 0.00 0.51 1.71 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.49 0.00 17 N 8.66 4.85 0.00 2.94 3.08 0.00 0.00 7.11 7.19 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 18 I 7.33 3.68 2.05 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 1.55 1.09 0.93 0.00 0.00 19 I 7.61 3.81 1.54 0.00 0.00 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 1.49 0.98 0.92 0.00 0.00 20 W 8.20 4.65 0.00 3.63 3.20 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 0.00 21 M 7.37 4.38 0.00 2.01 2.34 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.67 0.00 22 K 8.06 4.29 0.00 2.08 1.90 0.00 1.95 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.73 1.68 7.81 23 K 8.20 4.23 0.00 2.00 1.82 0.00 1.60 0.00 0.00 1.77 0.00 0.00 3.15 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.43 7.81 24 Y 7.83 5.15 0.00 2.87 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.25 4.94 1.27 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 26 S 9.23 5.46 0.00 3.99 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 27 A 9.15 3.89 1.38 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 28 N 8.22 4.39 0.00 2.78 2.91 0.00 0.00 7.09 6.92 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 29 N 7.87 4.34 0.00 2.97 2.91 0.00 0.00 6.90 7.25 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 30 I 7.70 3.73 2.03 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.08 0.86 0.00 0.00 31 I 7.79 3.76 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.92 0.98 0.00 0.00 32 E 8.24 3.90 0.00 2.01 2.22 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 2.33 2.36 0.00 33 E 8.51 4.06 0.00 2.11 1.98 0.00 0.00 0.00 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 2.52 0.00 34 I 7.84 3.60 1.98 0.00 0.00 0.98 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 0.74 0.71 0.00 0.00 35 Q 7.93 4.62 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.01 0.00 0.00 0.00 0.00 0.00 2.47 2.38 0.00 36 M 7.77 4.16 0.00 1.96 2.21 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.55 0.00 37 Q 7.67 4.26 0.00 1.88 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.67 0.00 0.00 0.00 0.00 0.00 2.24 2.27 0.00 38 K 7.12 4.17 0.00 0.79 0.74 0.00 1.48 0.00 0.00 1.55 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.84 0.21 7.81 39 D 8.06 4.71 0.00 2.71 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 40 W 7.46 5.12 0.00 3.35 2.94 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 41 S 8.34 4.61 0.00 4.08 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 42 P 0.00 4.30 0.00 2.19 2.16 0.00 3.64 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 43 K 8.10 3.96 0.00 1.81 1.80 0.00 1.73 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.53 7.81 44 T 7.65 3.77 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 0.86 0.00 0.00 45 I 7.73 3.79 2.06 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.34 0.95 0.00 0.00 46 R 8.76 3.88 0.00 2.01 1.94 0.00 3.13 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 47 T 7.84 3.77 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 1.12 0.00 0.00 48 L 7.44 3.83 0.00 1.71 1.62 0.84 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.45 3.43 1.75 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.71 -0.01 0.00 0.00 50 T 7.87 3.87 4.36 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 1.24 0.00 0.00 51 R 8.18 3.95 0.00 1.85 1.88 0.00 2.97 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.56 0.00 52 L 7.78 3.81 0.00 1.77 1.59 0.71 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 53 Y 7.77 4.38 0.00 3.13 3.16 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 0.00 0.00 0.00 0.00 54 K 8.55 3.75 0.00 1.68 1.82 0.00 1.74 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.76 1.55 7.81 55 K 7.71 3.97 0.00 1.85 1.79 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.10 1.36 7.81 56 G 8.35 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 57 F 9.01 4.36 0.00 2.99 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.67 5.04 2.01 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 1.21 1.13 0.84 0.00 0.00 59 D 8.29 5.07 0.00 2.43 1.56 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.25 5.03 0.00 1.00 0.66 0.00 2.51 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.22 0.00 61 K 8.98 4.85 0.00 1.75 1.73 0.00 1.45 0.00 0.00 1.36 0.00 0.00 2.57 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.28 1.39 7.81 62 K 8.12 5.01 0.00 1.89 1.71 0.00 0.96 0.00 0.00 0.61 0.00 0.00 2.58 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.28 1.05 7.81 63 D 8.11 4.23 0.00 2.61 2.58 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 64 N 8.54 4.02 0.00 2.87 2.65 0.00 0.00 7.13 7.61 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 65 K 8.61 3.99 0.00 1.65 1.76 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.30 1.34 7.81 66 I 7.46 3.78 1.98 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.42 0.97 0.00 0.00 67 F 8.67 5.25 0.00 3.00 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 68 Q 8.42 4.98 0.00 1.94 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.93 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 69 Y 9.30 4.86 0.00 3.12 2.85 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 0.00 0.00 0.00 70 Y 8.83 5.27 0.00 2.65 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 71 S 8.64 4.73 0.00 3.77 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 72 L 8.58 4.76 0.00 1.49 1.63 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 73 V 7.90 4.32 2.24 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 0.84 0.00 0.00 0.69 0.00 0.00 74 E 8.60 4.17 0.00 2.06 1.86 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 2.38 2.30 0.00 75 E 8.72 2.97 0.00 1.16 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 1.73 1.47 0.00 76 S 7.69 4.07 0.00 3.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.39 4.38 0.00 3.06 2.79 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 78 I 8.13 3.81 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.82 1.32 0.00 0.00 79 K 8.27 4.14 0.00 1.85 1.77 0.00 1.58 0.00 0.00 1.39 0.00 0.00 2.95 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.71 1.51 7.81 80 Y 7.79 4.03 0.00 3.17 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 81 K 8.44 3.60 0.00 1.96 2.02 0.00 1.51 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.57 7.81 82 T 8.36 4.10 4.63 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 1.27 0.00 0.00 83 S 8.11 4.36 0.00 3.92 3.96 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.91 3.83 0.00 1.68 1.70 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.85 1.29 7.81 85 N 7.96 4.50 0.00 2.99 2.93 0.00 0.00 6.71 9.22 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 86 F 8.27 4.33 0.00 3.18 3.29 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 87 I 8.17 3.51 2.03 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.48 1.02 0.00 0.00 88 N 7.93 4.23 0.00 2.80 2.90 0.00 0.00 7.09 7.19 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 89 K 7.62 4.02 0.00 1.74 1.90 0.00 1.83 0.00 0.00 1.68 0.00 0.00 3.17 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.39 1.42 7.81 90 V 7.35 3.61 1.15 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 0.14 0.00 0.00 0.67 0.00 0.00 91 Y 7.18 4.38 0.00 2.97 2.85 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 0.00 0.00 0.00 92 K 8.51 3.90 0.00 1.86 1.95 0.00 1.57 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.47 7.81 93 G 7.61 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 94 G 7.98 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 95 F 8.92 4.24 0.00 3.02 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 96 N 8.16 4.04 0.00 2.79 2.75 0.00 0.00 7.12 7.57 0.00 0.00 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 S 8.06 4.00 0.00 4.06 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 L 7.14 2.45 0.00 1.10 1.54 1.12 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 99 V 7.01 3.37 1.71 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 0.82 0.00 0.00 -0.01 0.00 0.00 100 L 8.08 3.86 0.00 1.68 1.80 0.89 0.50 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 0.00 101 N 8.24 4.32 0.00 2.88 2.92 0.00 0.00 6.81 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 F 8.65 3.81 0.00 3.22 3.01 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 0.00 103 V 7.89 3.65 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 0.91 0.00 0.00 1.02 0.00 0.00 104 E 7.75 4.07 0.00 2.09 2.05 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 2.54 2.28 0.00 105 K 7.55 4.09 0.00 1.87 1.66 0.00 1.64 0.00 0.00 1.61 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.40 7.81 106 E 7.63 3.95 0.00 1.16 1.75 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 2.44 2.27 0.00 107 E 8.54 4.20 0.00 1.94 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 108 L 8.13 4.76 0.00 1.70 1.61 1.01 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.65 4.39 0.00 4.09 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.70 3.92 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.94 0.00 0.00 0.00 0.00 0.00 2.44 2.54 0.00 111 D 8.07 4.36 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 0.00 112 E 8.15 3.99 0.00 2.16 2.05 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 2.37 2.37 0.00 113 I 8.46 3.88 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.26 0.92 0.00 0.00 114 E 8.72 3.96 0.00 1.92 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.47 0.00 115 E 8.34 3.90 0.00 2.24 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 2.33 2.52 0.00 116 L 7.81 4.20 0.00 1.98 1.69 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.18 3.90 0.00 2.03 1.97 0.00 3.28 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 118 N 7.99 4.54 0.00 2.91 3.07 0.00 0.00 6.12 7.68 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 0.00 119 I 7.14 3.82 2.07 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.83 0.91 0.00 0.00 120 L 7.93 4.24 0.00 1.86 1.73 0.98 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 121 N 7.94 4.59 0.00 2.69 2.87 0.00 0.00 6.96 7.61 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 0.00 122 K 7.50 4.23 0.00 1.68 1.77 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.65 1.54 7.81 123 K 7.77 4.20 0.00 1.90 1.80 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.35 7.81