NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 Q 4.2664 8.3293 119.6881 56.2285 29.4422 174.3405 6 T 4.5028 8.1509 113.5435 59.0693 71.4890 172.3018 7 M 4.2760 9.4318 124.0535 55.4332 33.1830 176.6206 8 K 4.2698 8.7666 125.7750 55.7814 33.6857 176.7941 9 G 3.8364 8.9046 112.5927 45.9483 0.0000 173.0634 10 L 3.9708 8.0528 121.1880 55.0270 42.6069 175.8858 11 D 4.8074 8.9816 126.1682 52.2997 41.1295 176.3713 12 I 3.9380 8.2805 128.0501 63.6898 38.3405 178.0438 13 Q 4.0608 7.9654 118.1832 58.5176 28.6048 177.7920 14 K 4.2830 7.8111 114.8861 57.5657 32.1238 177.7399 15 V 4.5855 7.4811 111.4679 60.8681 32.0146 176.0784 16 A 4.2320 7.5219 123.1461 52.3730 18.7572 177.2525 17 G 3.9686 8.1721 107.9118 43.2774 0.0000 172.8009 18 T 4.4866 7.8134 116.6944 63.4410 68.8972 174.6060 19 W 5.3166 8.4164 123.3765 55.4492 33.9013 173.9462 20 Y 4.8041 9.4912 118.8965 56.3155 41.3833 175.6184 21 S 4.8588 8.9667 119.3771 58.3748 62.6270 173.7645 22 L 4.4791 9.1931 128.7993 57.5751 43.1365 176.4451 23 A 5.1866 7.6709 118.3220 50.7695 22.9109 174.7682 24 M 5.3772 8.8701 115.6818 54.1938 35.2671 173.7116 25 A 5.2297 9.1903 120.4615 50.8235 23.3454 174.9733 26 A 5.2057 8.7505 120.6144 50.1342 22.6975 177.5221 27 S 4.9243 8.9264 114.2101 59.8650 64.1942 174.3182 28 D 4.8593 7.8710 119.8281 51.8984 43.7271 175.7019 29 I 3.7380 8.7283 127.5677 64.7094 36.5117 178.2099 30 S 4.2045 8.0025 113.6839 60.5724 63.1518 176.1590 31 L 4.3093 7.8623 120.9492 56.8468 41.4092 177.5843 32 L 4.6525 7.1632 112.0002 53.8592 43.6374 176.0619 33 D 4.2136 8.1970 119.1041 55.2257 41.3762 174.7768 34 A 4.0943 8.7519 129.6120 52.2624 18.2702 178.3216 35 Q 4.0843 8.7491 120.1586 59.0474 28.7990 178.4871 36 S 4.5402 8.0348 109.0675 58.2150 64.0384 174.0850 37 A 4.0390 8.3873 125.8384 52.0150 18.6062 175.1460 38 P 4.5050 0.0000 0.0000 64.0354 31.9601 176.7454 39 L 4.0545 8.8340 121.8081 54.4687 39.3511 175.1901 40 R 4.1661 7.2123 119.2191 54.8584 28.2924 174.5391 41 V 4.4657 7.3385 113.2232 58.9680 35.6397 174.1386 42 Y 4.6790 8.6253 122.5461 55.9475 39.9613 175.4970 43 V 4.0544 8.4345 125.1939 63.6358 32.0789 174.9283 44 E 4.4906 9.5444 127.2134 57.6842 31.4375 175.5238 45 E 5.1381 7.9104 118.4256 54.5764 33.9895 173.2597 46 L 4.9624 9.0830 124.8957 52.9655 44.7193 175.6405 47 K 4.8041 9.3037 124.0745 53.6008 34.4985 173.7394 48 P 4.9182 0.0000 0.0000 62.7788 32.3587 176.2578 49 T 4.5581 8.8233 113.3656 59.8049 70.4638 174.0021 50 P 4.2326 0.0000 0.0000 65.7827 31.1510 176.9383 51 E 4.2089 7.9966 115.9124 56.2925 29.7277 176.8150 52 G 4.0791 8.1300 107.0197 45.0759 0.0000 173.6479 53 D 5.0334 7.8204 119.6107 53.4397 43.3490 174.8858 54 L 4.9668 8.7123 120.7701 53.3731 45.5904 174.4060 55 E 4.8766 9.1398 127.5116 54.4740 31.8417 174.0334 56 I 4.7198 8.7065 127.9427 59.2186 40.5229 173.9807 57 L 5.0735 8.7904 130.4325 53.6426 43.4691 175.8206 58 L 5.2833 9.0303 122.4306 54.5020 44.7780 174.6403 59 Q 5.2989 9.4194 118.7263 54.1880 31.7085 174.9425 60 K 4.9466 9.3136 124.4905 54.4900 36.1011 174.7460 61 W 4.3275 9.3006 135.0000 58.0989 30.6344 173.6772 62 E 4.3722 8.6113 126.8077 55.4768 31.9435 175.3206 63 N 4.6455 8.1390 117.0303 52.8780 41.5994 177.5708 64 G 3.3419 7.6369 110.9353 47.8916 0.0000 175.9706 65 E 3.6012 7.6521 118.5850 56.0033 29.9423 175.2910 66 C 4.6432 8.1908 121.3909 55.3973 41.3768 172.9808 67 A 4.5141 8.9125 129.1345 51.3655 20.1537 175.3452 68 Q 5.1331 8.5231 120.2688 54.2876 31.1626 174.9165 69 K 4.7369 9.1576 125.4922 54.3582 35.9822 174.9404 70 K 4.8568 8.6475 124.2207 54.8390 34.4359 174.9068 71 I 4.4740 8.5800 128.8536 59.6620 39.5352 174.7563 72 I 4.6384 8.3851 127.6217 60.0987 38.4906 174.8075 73 A 4.9134 9.1600 129.4149 50.2043 21.3397 175.0083 74 E 4.8594 9.4395 123.5448 54.9583 31.2714 176.6727 75 K 4.1338 9.0851 123.7430 57.4063 33.6660 176.4050 76 T 4.6167 7.4011 109.7601 60.2199 71.5932 173.1731 77 K 3.9527 8.7052 119.1966 59.5990 32.3944 177.4079 78 I 4.1167 7.3071 120.3854 59.3740 37.4401 174.7274 79 P 4.0045 0.0000 0.0000 65.4484 31.4572 177.2151 80 A 4.4020 7.8564 118.5484 52.6338 19.2007 176.2026 81 V 4.9991 7.3125 115.9032 60.9116 33.9127 174.8170 82 F 5.0284 9.3099 124.8020 55.6753 43.7639 173.6367 83 K 5.2192 9.1616 120.5873 54.9155 34.3473 175.7511 84 I 4.8700 8.3585 116.4963 58.9669 41.5994 174.1472 85 D 5.1731 8.2803 119.8727 51.5586 40.9659 174.1919 86 A 4.5788 8.3826 122.2892 51.8130 22.8771 176.6938 87 L 3.7515 9.1822 119.4725 56.0353 39.1459 175.1276 88 N 4.2585 8.4681 111.6082 53.9751 36.0373 173.9658 89 E 4.7556 8.1436 118.7368 55.0125 31.9666 175.8725 90 N 6.0193 8.9508 114.7276 51.4193 39.9115 173.8571 91 K 5.1189 7.9763 118.6188 55.0638 37.1039 174.9333 92 V 4.9384 9.1130 124.2525 61.1162 34.3995 174.0437 93 L 5.1596 9.2118 128.2082 52.9473 44.4415 175.7265 94 V 4.3655 9.0823 125.7661 62.6444 31.9577 176.5568 95 L 4.1726 9.1212 129.3976 57.2755 42.4286 176.9157 96 D 4.4664 7.7085 114.3623 54.4436 44.3672 174.8532 97 T 3.9319 8.3311 114.5933 62.1560 70.0410 172.5557 98 D 4.6026 7.2906 125.5320 52.5711 39.9488 178.2607 99 Y 4.1091 7.3511 121.2914 59.6266 37.7185 171.1125 100 K 4.3699 8.7284 117.7975 57.5135 33.1335 177.4654 101 K 4.6952 9.1220 115.7574 57.6741 35.6176 176.0559 102 Y 6.2730 8.2001 116.6747 54.0402 42.1538 174.2032 103 L 4.6480 8.4237 120.6847 53.7777 45.9352 173.8915 104 L 5.4870 9.2373 126.4913 53.0218 44.7300 175.5500 105 F 5.5022 8.7156 117.0951 55.9530 42.1387 172.4361 106 C 5.3189 9.3984 115.4555 55.6172 39.4526 173.2881 107 M 5.5358 8.6933 120.7832 54.0943 35.4357 174.4421 108 E 5.1842 8.7471 117.1311 55.9759 33.9054 173.6481 109 N 5.2894 8.3747 119.9941 51.8276 39.8413 175.2687 110 S 4.0780 9.3798 122.9048 61.5002 63.0201 176.1012 111 A 4.1225 8.2027 123.0148 55.0111 18.2648 177.6122 112 E 4.8479 8.2233 114.7377 54.9362 31.6915 173.6012 113 P 4.3137 0.0000 0.0000 64.9982 32.1460 178.8651 114 E 3.9353 8.2419 116.7772 58.8317 29.4772 177.5577 115 Q 4.6226 7.6946 114.8989 55.6689 29.0089 176.0965 116 S 4.6140 7.3444 110.7484 58.7238 66.1996 174.4529 117 L 4.4324 8.3331 123.5847 54.9834 42.8811 176.4816 118 V 4.9090 8.6430 125.5556 60.3125 34.6678 173.8731 119 C 5.3346 9.3928 121.8531 55.1965 39.1036 172.9770 120 Q 4.7986 8.5813 119.1232 54.3110 33.4363 173.5659 121 C 4.6798 8.2967 122.6063 57.6522 33.6391 172.3966 122 L 5.4367 9.0383 126.8646 53.2962 44.0693 176.0661 123 V 5.3833 8.9001 115.3034 59.8698 35.1047 177.1115 124 R 3.6502 9.0673 123.1950 58.6842 30.2651 177.3501 125 T 4.7403 7.7826 106.7882 58.9718 71.7265 172.7165 126 P 4.0215 0.0000 0.0000 62.4055 30.0513 175.3452 127 E 4.6973 7.3655 116.3751 54.9479 33.8663 176.1464 128 V 3.9503 8.2349 120.6321 60.8611 32.7900 175.5655 129 D 4.7508 8.4629 123.9931 52.6688 42.4267 176.3998 130 D 4.4557 8.5658 128.1021 56.9127 40.8707 178.6622 131 E 3.8705 8.0932 119.5627 59.2890 29.5129 178.8645 132 A 3.5005 8.0666 120.2571 55.1834 18.3911 179.5578 133 L 4.0334 7.8611 117.1666 57.6824 41.6851 179.2759 134 E 3.8881 8.2044 119.2916 59.4022 29.6804 178.9149 135 K 3.8759 8.0617 118.4916 59.4461 32.1319 179.1376 136 F 4.2356 8.1401 120.7334 61.5652 39.1914 176.9229 137 D 4.1970 8.3153 117.4868 57.2928 40.9300 178.8311 138 K 4.0623 8.0238 118.6959 59.4106 31.8789 179.3631 139 A 4.0337 7.7528 119.6467 54.3494 18.5791 178.6999 140 L 4.1866 7.4702 115.6946 55.1108 41.8724 178.8005 141 K 3.8534 7.6006 118.2116 58.7833 32.1120 177.6917 142 A 4.3442 7.7322 119.2732 52.5605 19.5953 177.1122 143 L 4.3676 7.3128 115.9020 53.2624 43.4567 175.5879 144 P 4.5134 0.0000 0.0000 62.0090 30.3247 175.7674 145 M 4.6997 7.3962 118.1113 56.0470 33.2411 176.5054 146 H 4.9000 8.9284 118.9243 55.4975 30.7591 173.8065 147 I 4.6155 7.3966 118.9343 59.6325 41.4441 173.2554 148 R 5.1892 8.5080 128.2417 54.7510 33.3552 173.8719 149 L 4.9346 9.0890 124.8985 52.9502 46.1453 175.5919 150 S 4.8323 8.1259 115.2606 56.7263 65.9571 173.1639 151 F 5.0558 8.9275 121.5406 55.9615 41.4633 174.9825 152 N 4.8981 8.5486 117.9419 50.7569 39.0330 174.2191 153 P 4.1700 0.0000 0.0000 65.8504 30.9149 179.1546 154 T 3.8504 7.8039 113.4678 66.8971 68.6756 176.2538 155 Q 4.0585 8.9124 120.2645 58.7422 28.4867 178.5322 156 L 4.0061 8.0137 119.8172 56.9870 41.6848 178.3170 157 E 4.4146 7.5039 113.8886 55.2388 30.4504 175.1495 158 E 4.5887 7.0878 120.5372 54.0630 31.5797 175.4691 159 Q 3.9840 8.5783 123.7120 57.6267 29.2772 177.6208 160 C 3.9090 9.8056 120.4465 57.3758 41.8647 172.9836 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 Q 8.33 4.27 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 6 T 8.15 4.50 4.26 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 1.23 0.00 0.00 7 M 9.43 4.28 0.00 2.14 2.01 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 2.63 2.54 0.00 8 K 8.77 4.27 0.00 1.70 1.74 0.00 1.88 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.39 7.81 9 G 8.90 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 10 L 8.05 3.97 0.00 1.66 1.68 0.97 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.98 4.81 0.00 2.72 2.44 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 0.00 0.00 0.00 0.00 12 I 8.28 3.94 2.08 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 1.50 1.09 1.01 0.00 0.00 13 Q 7.97 4.06 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.29 6.71 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 14 K 7.81 4.28 0.00 1.58 1.59 0.00 0.61 0.00 0.00 0.91 0.00 0.00 2.70 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.24 1.11 7.81 15 V 7.48 4.59 2.20 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 0.84 0.00 0.00 1.03 0.00 0.00 16 A 7.52 4.23 1.35 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 0.00 0.00 17 G 8.17 3.97 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 0.00 0.00 0.00 18 T 7.81 4.49 4.07 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 0.00 0.00 0.80 0.00 0.00 19 W 8.42 5.32 0.00 3.03 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 20 Y 9.49 4.80 0.00 2.97 2.87 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 0.00 0.00 0.00 21 S 8.97 4.86 0.00 4.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.19 4.48 0.00 1.84 1.72 0.97 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.67 5.19 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 M 8.87 5.38 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.67 0.00 25 A 9.19 5.23 1.23 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 0.00 0.00 0.00 26 A 8.75 5.21 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 27 S 8.93 4.92 0.00 4.00 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 28 D 7.87 4.86 0.00 2.73 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.73 3.74 1.87 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 1.62 0.45 0.91 0.00 0.00 30 S 8.00 4.20 0.00 4.01 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 31 L 7.86 4.31 0.00 1.75 1.78 0.93 0.95 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 32 L 7.16 4.65 0.00 1.57 1.66 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.20 4.21 0.00 2.87 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 34 A 8.75 4.09 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 35 Q 8.75 4.08 0.00 1.91 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.93 0.00 0.00 0.00 0.00 0.00 2.24 1.87 0.00 36 S 8.03 4.54 0.00 4.08 4.15 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 37 A 8.39 4.04 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.50 0.00 2.20 2.09 0.00 3.95 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 39 L 8.83 4.05 0.00 1.96 2.15 1.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 40 R 7.21 4.17 0.00 1.73 2.00 0.00 3.29 0.00 0.00 3.47 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.46 0.00 41 V 7.34 4.47 2.06 0.00 0.00 0.00 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 0.97 0.00 0.00 42 Y 8.63 4.68 0.00 3.03 2.88 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 43 V 8.43 4.05 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 0.75 0.00 0.00 1.05 0.00 0.00 44 E 9.54 4.49 0.00 2.05 1.92 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 2.25 2.26 0.00 45 E 7.91 5.14 0.00 1.98 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 0.00 2.40 2.31 0.00 46 L 9.08 4.96 0.00 1.89 1.65 0.66 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 47 K 9.30 4.80 0.00 1.58 1.70 0.00 1.65 0.00 0.00 2.01 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.32 7.81 48 P 0.00 4.92 0.00 2.09 2.21 0.00 3.76 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 2.00 2.08 0.00 49 T 8.82 4.56 4.25 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 1.21 0.00 0.00 50 P 0.00 4.23 0.00 2.20 2.25 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 51 E 8.00 4.21 0.00 1.99 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 2.29 2.25 0.00 52 G 8.13 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 7.82 5.03 0.00 2.68 2.87 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 0.00 0.00 0.00 54 L 8.71 4.97 0.00 1.20 0.81 0.80 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 55 E 9.14 4.88 0.00 1.98 1.84 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 2.18 2.19 0.00 56 I 8.71 4.72 1.63 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 1.08 1.33 0.76 0.00 0.00 57 L 8.79 5.07 0.00 1.62 1.55 0.97 0.57 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 58 L 9.03 5.28 0.00 1.77 1.83 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 59 Q 9.42 5.30 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.17 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 60 K 9.31 4.95 0.00 1.80 1.65 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.44 7.81 61 W 9.30 4.33 0.00 3.53 3.08 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 0.00 0.00 0.00 0.00 62 E 8.61 4.37 0.00 1.90 1.72 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 2.26 2.34 0.00 63 N 8.14 4.65 0.00 2.70 2.51 0.00 0.00 6.85 7.82 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 64 G 7.64 3.34 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 65 E 7.65 3.60 0.00 1.75 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 2.19 2.04 0.00 66 C 8.19 4.64 0.00 3.29 3.11 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 67 A 8.91 4.51 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 68 Q 8.52 5.13 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.68 0.00 0.00 0.00 0.00 0.00 2.24 2.47 0.00 69 K 9.16 4.74 0.00 1.67 1.65 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.50 7.81 70 K 8.65 4.86 0.00 1.71 1.66 0.00 1.73 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.28 1.40 7.81 71 I 8.58 4.47 1.82 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 1.22 0.55 0.88 0.00 0.00 72 I 8.39 4.64 1.87 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 1.27 0.37 0.92 0.00 0.00 73 A 9.16 4.91 1.07 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 0.00 0.00 0.00 0.00 0.00 74 E 9.44 4.86 0.00 1.91 1.91 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 2.33 2.43 0.00 75 K 9.09 4.13 0.00 1.63 2.13 0.00 1.54 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.34 7.81 76 T 7.40 4.62 4.16 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 1.17 0.00 0.00 77 K 8.71 3.95 0.00 1.72 1.88 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.43 7.81 78 I 7.31 4.12 1.78 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 1.25 1.00 0.87 0.00 0.00 79 P 0.00 4.00 0.00 2.03 2.26 0.00 3.63 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 2.03 2.07 0.00 80 A 7.86 4.40 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 81 V 7.31 5.00 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 0.87 0.00 0.00 0.92 0.00 0.00 82 F 9.31 5.03 0.00 3.02 2.98 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 0.00 0.00 0.00 83 K 9.16 5.22 0.00 1.68 1.73 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.13 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.51 7.81 84 I 8.36 4.87 1.88 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 1.15 0.88 0.97 0.00 0.00 85 D 8.28 5.17 0.00 2.59 2.57 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 0.00 0.00 0.00 0.00 86 A 8.38 4.58 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 87 L 9.18 3.75 0.00 1.83 1.78 0.94 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 88 N 8.47 4.26 0.00 2.87 2.94 0.00 0.00 7.05 7.67 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 89 E 8.14 4.76 0.00 2.09 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 0.00 2.41 2.39 0.00 90 N 8.95 6.02 0.00 2.71 2.97 0.00 0.00 6.66 7.13 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 91 K 7.98 5.12 0.00 1.71 1.72 0.00 1.63 0.00 0.00 1.76 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.45 7.81 92 V 9.11 4.94 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 1.03 0.00 0.00 0.95 0.00 0.00 93 L 9.21 5.16 0.00 1.61 1.61 0.96 0.82 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 94 V 9.08 4.37 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 0.98 0.00 0.00 0.99 0.00 0.00 95 L 9.12 4.17 0.00 1.76 1.76 1.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 96 D 7.71 4.47 0.00 2.82 2.60 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 97 T 8.33 3.93 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 0.53 0.00 0.00 98 D 7.29 4.60 0.00 2.90 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 99 Y 7.35 4.11 0.00 3.23 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 0.00 100 K 8.73 4.37 0.00 1.77 1.90 0.00 1.71 0.00 0.00 1.85 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.47 7.81 101 K 9.12 4.70 0.00 1.90 2.06 0.00 1.34 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.94 1.69 7.81 102 Y 8.20 6.27 0.00 3.21 3.18 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 0.00 103 L 8.42 4.65 0.00 0.79 0.66 0.29 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 104 L 9.24 5.49 0.00 1.71 1.72 1.12 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 105 F 8.72 5.50 0.00 3.20 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 0.00 106 C 9.40 5.32 0.00 2.89 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 0.00 107 M 8.69 5.54 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.59 0.00 108 E 8.75 5.18 0.00 2.02 2.02 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 2.19 2.24 0.00 109 N 8.37 5.29 0.00 2.89 2.74 0.00 0.00 7.33 7.83 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 0.00 110 S 9.38 4.08 0.00 4.00 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 0.00 111 A 8.20 4.12 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 0.00 112 E 8.22 4.85 0.00 1.99 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.30 0.00 113 P 0.00 4.31 0.00 2.22 2.26 0.00 3.66 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.21 0.00 114 E 8.24 3.94 0.00 2.13 2.02 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 2.32 2.34 0.00 115 Q 7.69 4.62 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 116 S 7.34 4.61 0.00 4.02 3.92 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 0.00 117 L 8.33 4.43 0.00 1.97 1.55 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.64 4.91 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 0.77 0.00 0.00 0.93 0.00 0.00 119 C 9.39 5.33 0.00 2.89 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 0.00 120 Q 8.58 4.80 0.00 1.15 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.71 0.00 0.00 0.00 0.00 0.00 2.12 1.93 0.00 121 C 8.30 4.68 0.00 1.45 2.02 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 0.00 122 L 9.04 5.44 0.00 1.59 1.76 0.63 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.90 5.38 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 0.88 0.00 0.00 1.24 0.00 0.00 124 R 9.07 3.65 0.00 1.54 1.72 0.00 2.66 0.00 0.00 2.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 1.41 0.00 125 T 7.78 4.74 4.21 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 1.20 0.00 0.00 126 P 0.00 4.02 0.00 1.82 1.04 0.00 3.56 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.69 0.00 127 E 7.37 4.70 0.00 1.91 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 0.00 2.15 2.19 0.00 128 V 8.23 3.95 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 0.70 0.00 0.00 0.94 0.00 0.00 129 D 8.46 4.75 0.00 2.77 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 0.00 130 D 8.57 4.46 0.00 2.72 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 0.00 131 E 8.09 3.87 0.00 1.97 1.92 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 2.43 2.47 0.00 132 A 8.07 3.50 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 0.00 133 L 7.86 4.03 0.00 1.91 1.77 0.93 0.74 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 0.00 134 E 8.20 3.89 0.00 2.28 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 0.00 2.29 2.34 0.00 135 K 8.06 3.88 0.00 1.88 1.78 0.00 1.48 0.00 0.00 1.20 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.47 7.81 136 F 8.14 4.24 0.00 3.19 3.26 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 0.00 137 D 8.32 4.20 0.00 2.76 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 0.00 138 K 8.02 4.06 0.00 1.95 1.82 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 139 A 7.75 4.03 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 0.00 140 L 7.47 4.19 0.00 1.47 1.43 0.41 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 141 K 7.60 3.85 0.00 1.88 1.83 0.00 1.64 0.00 0.00 1.78 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.63 7.81 142 A 7.73 4.34 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 0.00 143 L 7.31 4.37 0.00 1.69 1.54 0.85 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 144 P 0.00 4.51 0.00 2.21 2.20 0.00 3.65 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 2.04 1.97 0.00 145 M 7.40 4.70 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.38 0.00 146 H 8.93 4.90 0.00 2.96 3.29 0.00 5.85 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 I 7.40 4.62 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 1.23 1.26 0.97 0.00 0.00 148 R 8.51 5.19 0.00 1.77 1.69 0.00 3.19 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.71 0.00 149 L 9.09 4.93 0.00 1.26 1.05 0.97 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 150 S 8.13 4.83 0.00 3.73 3.70 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 0.00 151 F 8.93 5.06 0.00 2.99 2.99 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 0.00 0.00 0.00 152 N 8.55 4.90 0.00 2.95 2.97 0.00 0.00 5.99 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 P 0.00 4.17 0.00 2.15 2.23 0.00 3.60 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 154 T 7.80 3.85 4.43 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 1.19 0.00 0.00 155 Q 8.91 4.06 0.00 2.26 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.19 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 156 L 8.01 4.01 0.00 1.69 1.54 0.86 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 157 E 7.50 4.41 0.00 2.10 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 2.49 2.25 0.00 158 E 7.09 4.59 0.00 1.80 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 2.19 2.27 0.00 159 Q 8.58 3.98 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 5.95 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 160 C 9.81 3.91 0.00 3.23 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