NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4229 8.3193 115.2907 57.7463 64.3925 173.9398 3 S 4.1548 8.0044 114.9077 57.9765 63.5872 171.8890 4 L 4.7711 8.9969 123.8294 52.9858 45.1421 176.9871 5 I 4.1995 8.0798 122.2628 60.6011 38.8367 174.6086 6 R 4.7850 8.6743 127.6367 54.7127 31.4899 174.8519 7 R 4.6643 8.8896 124.3438 54.3420 32.0149 175.3336 8 V 4.3299 8.3490 123.3907 62.3048 32.3926 175.0833 9 I 4.2325 8.5103 129.9402 60.8072 37.9945 175.5644 10 S 4.7597 8.5200 121.0151 56.9963 65.4056 172.9650 11 T 4.5357 9.8578 121.2702 60.0392 69.9562 174.3040 12 A 4.1762 8.6996 131.1456 54.2747 18.5586 178.0218 13 K 4.1826 8.0545 113.9095 56.9632 32.5397 176.6343 14 A 4.8438 7.4623 121.3276 48.9748 21.6974 174.3723 15 P 4.2970 0.0000 0.0000 62.4147 31.8857 177.2615 16 G 3.7289 8.5308 111.1906 45.0414 0.0000 173.0086 17 A 3.7637 8.2014 123.3595 52.3085 18.6148 177.7277 18 I 4.2538 8.5891 114.8548 60.4942 38.0705 175.3237 19 G 4.1456 6.8736 108.8585 44.8114 0.0000 172.1435 20 P 4.5578 0.0000 0.0000 61.4032 29.7198 174.4836 21 Y 4.9413 6.8464 119.6317 56.1633 41.7297 175.4259 22 S 4.8187 8.4477 116.2331 56.8213 65.1524 174.3843 23 Q 4.4270 8.7198 122.3277 59.5199 29.5220 176.5477 24 A 5.0105 7.6194 116.9302 51.1318 22.8789 175.3697 25 V 4.7592 8.7000 119.0166 61.0410 35.0465 173.9437 26 L 5.1609 9.0327 130.1885 53.3748 44.5284 175.1645 27 V 4.6949 8.6802 125.6007 60.5830 34.8149 174.7675 28 D 4.5474 9.7671 128.7544 55.4907 39.6588 174.2339 29 R 4.1166 7.9156 116.1715 56.4574 29.1402 176.1637 30 T 4.7550 7.8003 115.5880 62.0728 70.4676 173.7033 31 I 4.7081 8.6096 127.7875 59.8363 39.7631 174.2823 32 Y 4.6537 8.9636 126.2600 56.8102 39.0178 174.7063 33 I 4.8237 8.4898 126.1996 59.3592 39.3811 176.1752 34 S 4.1991 8.8879 123.3618 58.1360 63.7270 174.5346 35 G 3.8179 8.4131 109.1670 46.4479 0.0000 172.7506 36 Q 4.9274 9.5696 125.2798 54.1911 31.1740 174.8945 37 I 4.8654 8.2156 115.7103 57.8974 41.1781 175.7607 38 G 3.9856 8.0667 109.0112 46.3444 0.0000 173.4393 39 M 4.9499 7.7317 118.1806 54.5173 33.3150 177.2639 40 D 4.6437 9.2209 124.0760 53.1871 41.8775 175.5924 41 P 4.7876 0.0000 0.0000 65.4905 31.9371 177.5981 42 S 4.2528 8.3849 113.2084 60.4053 62.3706 174.4126 43 S 4.5507 7.7733 109.7855 56.7645 64.0293 175.0293 44 G 3.9719 9.6542 109.7461 45.4023 0.0000 173.6736 45 Q 4.4770 7.2888 117.8658 54.6617 30.7943 175.2905 46 L 4.6066 8.3113 121.1756 54.8049 42.1074 177.9193 47 V 3.9595 8.3749 117.5799 61.3840 32.2502 176.4514 48 S 4.3548 8.4444 117.7634 58.4654 63.9879 174.2582 49 G 3.9299 9.2230 108.4523 44.8493 0.0000 175.1516 50 G 3.8688 8.1189 109.5652 44.5443 0.0000 174.2359 51 V 3.6031 8.4134 117.0432 65.1132 30.7828 178.1487 52 A 3.9654 7.8855 120.5494 55.1476 18.3905 179.3484 53 E 4.0054 8.0945 116.6523 59.3960 29.5705 179.2047 54 E 3.9642 8.2980 118.5959 59.3525 29.5324 179.2655 55 A 3.9749 8.2136 120.9384 54.8864 18.3294 179.6439 56 K 3.8596 7.9397 117.7948 59.7181 32.2566 178.9427 57 Q 3.9106 8.2821 119.6949 58.9968 28.8600 177.9574 58 A 4.0810 8.3452 122.3641 55.1093 18.3063 179.6669 59 L 3.7860 7.7158 117.5145 57.5251 41.5404 179.6283 60 K 3.9457 7.9903 118.7197 59.6592 32.1665 179.0368 61 N 4.2884 8.2919 116.5781 56.5654 38.4219 176.9724 62 M 4.1080 8.3521 119.9462 58.7617 32.1575 178.4794 63 G 3.1518 8.4133 105.9680 47.7429 0.0000 175.5663 64 E 3.9373 8.1353 120.9823 59.0777 28.8878 179.5979 65 I 3.7304 7.6230 119.5756 64.2151 37.0909 178.3827 66 L 3.9113 8.0663 120.2422 57.6066 41.4191 179.4231 67 K 4.1085 8.4327 120.8696 58.9383 31.9343 178.6151 68 A 4.2912 7.9390 119.1623 53.9397 18.2451 178.3016 69 A 4.5862 7.2042 116.9702 51.1626 19.4062 176.8962 70 G 3.7721 8.3666 106.4456 47.5077 0.0000 173.4544 71 C 4.9215 8.1937 116.8889 57.4824 32.2523 172.1158 72 D 4.5664 7.8164 117.4825 52.2956 41.8272 175.6378 73 F 4.2722 8.5161 116.2018 60.9717 38.9412 177.6212 74 T 4.1215 8.0634 109.9600 63.9860 68.7401 175.0153 75 N 4.5207 8.1228 119.0596 54.3223 39.0069 174.9586 76 V 4.1702 7.7956 119.6650 62.9511 32.0953 175.7263 77 V 4.3956 8.6239 119.7090 61.5026 34.2183 175.5313 78 K 5.1779 7.7282 121.5043 55.4147 35.7550 174.4846 79 T 5.2505 9.0685 116.7505 60.2161 73.0319 172.6540 80 T 4.9855 8.6321 118.3409 61.8383 72.2357 173.2438 81 V 4.1428 8.7711 127.4859 61.3257 33.4288 174.4499 82 L 4.5349 8.6701 129.9052 53.2424 43.1523 175.8592 83 L 5.0949 8.5644 124.4821 53.1111 43.5913 177.8522 84 A 4.1092 8.5231 123.9233 54.0918 19.5167 177.5330 85 D 4.5318 7.8615 114.8294 52.4483 43.9193 175.5172 86 I 3.7718 8.6094 127.5610 64.2382 38.0915 176.7112 87 N 4.7194 8.6330 115.2786 54.4079 38.3692 175.6919 88 D 4.6794 8.2732 118.6453 54.2533 41.1776 177.6332 89 F 3.7502 7.9955 122.5316 61.6146 39.3744 176.7183 90 N 4.3908 8.3357 115.0925 56.7152 38.2711 177.3089 91 T 3.8564 7.8644 116.4623 66.7178 68.5390 176.6817 92 V 3.5553 7.9415 120.2766 66.0553 31.5184 177.7808 93 N 4.1439 8.3283 116.6504 56.1571 38.0746 177.2142 94 E 3.9998 7.7750 118.6976 59.5535 29.8744 179.2290 95 I 3.9384 7.6055 119.8092 64.4518 37.1887 177.5852 96 Y 4.2586 8.4165 120.7975 60.9867 38.3807 178.3063 97 K 4.5708 8.1982 116.7719 58.3871 32.2391 178.4558 98 Q 4.0443 8.3277 118.1163 57.2565 28.8268 175.9210 99 Y 3.6899 7.6089 116.3227 57.7437 39.9655 175.7209 100 F 4.7226 7.8211 118.1041 55.8696 39.9925 175.1640 101 K 4.4459 8.3442 125.3589 57.2932 33.4387 176.2639 102 S 3.3245 7.5116 110.1120 57.6409 65.2072 174.5900 103 N 4.0725 8.4277 115.6607 54.2297 35.6766 175.1930 104 F 4.3809 7.6065 114.7766 56.7873 40.1799 174.3216 105 P 4.6273 0.0000 0.0000 62.6084 31.9652 176.1986 106 A 4.3055 8.6222 124.1668 52.5811 19.6330 176.5548 107 R 5.5451 8.5890 117.9781 54.7003 33.5599 173.9635 108 A 5.0462 8.6967 125.2917 50.1884 22.4884 174.8462 109 A 5.1753 8.4838 121.9092 50.7138 22.4234 174.8147 110 Y 4.7054 8.1659 118.0649 56.5281 41.9769 172.6136 111 Q 4.9273 8.8859 121.4335 55.1474 30.3600 175.1010 112 V 4.5198 8.5012 119.3514 59.4708 33.9990 176.0321 113 A 4.0944 8.7268 124.0132 55.1637 18.5499 177.8525 114 A 4.4710 7.2685 113.9398 51.5897 22.0483 175.2108 115 L 4.8732 7.8685 119.6148 51.7053 45.4516 174.5813 116 P 4.3932 0.0000 0.0000 64.3219 31.6688 176.9951 117 K 3.6654 9.5061 119.5302 57.1471 29.5361 175.7880 118 G 3.9232 8.0920 104.5211 46.5472 0.0000 175.0722 119 S 4.3713 7.7585 114.6966 58.5881 63.4507 174.7735 120 R 4.4266 9.5451 121.0257 57.0737 31.0467 175.9773 121 I 4.8810 7.3275 117.6514 59.7854 41.1244 173.0805 122 E 4.9138 9.1520 128.6902 54.4878 33.2298 174.0930 123 I 4.9159 8.9229 127.4030 59.5769 40.4757 174.6796 124 E 5.0152 8.8385 125.0162 55.0830 32.7110 174.5444 125 A 5.1569 8.2959 120.0296 51.0242 23.4789 175.2431 126 V 4.7597 8.7829 118.5073 61.0952 34.8143 174.4619 127 A 5.1733 8.9327 127.8739 50.2579 23.1858 174.5280 128 I 4.8425 8.2532 120.0268 59.1195 39.6010 175.8011 129 Q 4.0056 9.1577 129.8853 55.9555 29.5228 176.5193 130 G 3.8947 7.9754 116.1055 44.1526 0.0000 171.0673 131 P 4.5150 0.0000 0.0000 62.2472 32.1053 175.6969 132 L 4.8035 8.2165 119.3055 53.1170 44.7784 175.8338 133 T 4.5692 8.4222 116.1750 60.3118 69.7529 173.1274 134 T 4.6256 8.4185 117.9049 59.8643 71.2640 174.1644 135 A 4.2514 8.2451 124.5539 52.5405 19.3738 176.0085 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 S 8.32 4.42 0.00 3.85 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 3 S 8.00 4.15 0.00 4.10 3.85 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 4 L 9.00 4.77 0.00 1.64 1.61 0.94 0.87 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 5 I 8.08 4.20 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 1.05 0.92 0.00 0.00 6 R 8.67 4.78 0.00 1.81 1.84 0.00 3.22 0.00 0.00 3.29 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 7 R 8.89 4.66 0.00 1.89 2.02 0.00 2.82 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 8 V 8.35 4.33 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 0.81 0.00 0.00 0.95 0.00 0.00 9 I 8.51 4.23 1.89 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 1.13 0.94 0.95 0.00 0.00 10 S 8.52 4.76 0.00 3.81 3.67 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 11 T 9.86 4.54 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 1.26 0.00 0.00 12 A 8.70 4.18 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 13 K 8.05 4.18 0.00 1.76 1.86 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.38 7.81 14 A 7.46 4.84 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 15 P 0.00 4.30 0.00 2.09 2.03 0.00 3.71 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 16 G 8.53 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 17 A 8.20 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.59 4.25 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.91 0.96 0.00 0.00 19 G 6.87 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 0.00 0.00 0.00 20 P 0.00 4.56 0.00 2.22 2.10 0.00 3.83 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.98 0.00 21 Y 6.85 4.94 0.00 3.01 2.89 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 22 S 8.45 4.82 0.00 3.94 3.85 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 23 Q 8.72 4.43 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.76 0.00 0.00 0.00 0.00 0.00 2.53 2.42 0.00 24 A 7.62 5.01 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 25 V 8.70 4.76 2.19 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 1.07 0.00 0.00 0.98 0.00 0.00 26 L 9.03 5.16 0.00 1.78 1.64 1.01 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 27 V 8.68 4.69 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 1.06 0.00 0.00 0.99 0.00 0.00 28 D 9.77 4.55 0.00 2.77 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 29 R 7.92 4.12 0.00 2.10 2.11 0.00 3.16 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 30 T 7.80 4.75 4.22 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 0.57 0.00 0.00 31 I 8.61 4.71 1.80 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 1.21 0.71 0.90 0.00 0.00 32 Y 8.96 4.65 0.00 2.93 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 33 I 8.49 4.82 1.99 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 1.24 1.00 0.94 0.00 0.00 34 S 8.89 4.20 0.00 3.93 3.66 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 35 G 8.41 3.82 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 0.00 0.00 0.00 36 Q 9.57 4.93 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.56 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 37 I 8.22 4.87 1.87 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 1.29 0.68 0.97 0.00 0.00 38 G 8.07 3.99 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 0.00 0.00 0.00 39 M 7.73 4.95 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.55 0.00 40 D 9.22 4.64 0.00 2.72 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 41 P 0.00 4.79 0.00 2.22 2.14 0.00 3.83 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 1.99 2.04 0.00 42 S 8.38 4.25 0.00 3.85 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 43 S 7.77 4.55 0.00 4.01 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 44 G 9.65 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 45 Q 7.29 4.48 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.95 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 46 L 8.31 4.61 0.00 1.54 1.62 0.99 0.93 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 47 V 8.37 3.96 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 0.66 0.00 0.00 0.94 0.00 0.00 48 S 8.44 4.35 0.00 3.98 3.87 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 49 G 9.22 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 50 G 8.12 3.87 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 0.00 0.00 0.00 51 V 8.41 3.60 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 0.92 0.00 0.00 52 A 7.89 3.97 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 53 E 8.09 4.01 0.00 2.07 2.01 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 2.41 2.46 0.00 54 E 8.30 3.96 0.00 2.02 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 2.33 2.46 0.00 55 A 8.21 3.97 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 56 K 7.94 3.86 0.00 1.92 1.99 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.65 7.81 57 Q 8.28 3.91 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 58 A 8.35 4.08 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 59 L 7.72 3.79 0.00 1.00 0.38 0.74 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.99 3.95 0.00 1.97 1.89 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.58 1.71 7.81 61 N 8.29 4.29 0.00 2.89 2.87 0.00 0.00 6.70 7.60 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 62 M 8.35 4.11 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.59 0.00 63 G 8.41 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 0.00 0.00 0.00 64 E 8.14 3.94 0.00 2.14 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 2.49 2.66 0.00 65 I 7.62 3.73 1.99 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 1.53 1.14 0.91 0.00 0.00 66 L 8.07 3.91 0.00 1.53 1.64 0.57 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 67 K 8.43 4.11 0.00 1.83 1.93 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.28 7.81 68 A 7.94 4.29 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.20 4.59 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 70 G 8.37 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.19 4.92 0.00 3.03 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.82 4.57 0.00 2.71 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 73 F 8.52 4.27 0.00 2.97 2.78 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 0.00 0.00 0.00 74 T 8.06 4.12 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 1.27 0.00 0.00 75 N 8.12 4.52 0.00 2.92 3.05 0.00 0.00 6.47 7.28 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 76 V 7.80 4.17 2.54 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 0.83 0.00 0.00 1.19 0.00 0.00 77 V 8.62 4.40 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 0.68 0.00 0.00 0.94 0.00 0.00 78 K 7.73 5.18 0.00 1.85 1.60 0.00 1.70 0.00 0.00 1.90 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.53 7.81 79 T 9.07 5.25 4.39 0.00 0.00 0.00 0.00 0.00 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 80 T 8.63 4.99 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 1.17 0.00 0.00 81 V 8.77 4.14 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 0.81 0.00 0.00 0.83 0.00 0.00 82 L 8.67 4.53 0.00 1.58 1.43 0.86 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.56 5.09 0.00 1.61 1.68 1.07 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 84 A 8.52 4.11 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 85 D 7.86 4.53 0.00 2.63 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 86 I 8.61 3.77 1.91 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 1.40 1.07 0.92 0.00 0.00 87 N 8.63 4.72 0.00 2.88 2.87 0.00 0.00 6.99 8.71 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 88 D 8.27 4.68 0.00 2.84 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 89 F 8.00 3.75 0.00 3.36 3.07 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 90 N 8.34 4.39 0.00 2.82 2.89 0.00 0.00 7.06 7.05 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 91 T 7.86 3.86 4.39 0.00 0.00 0.00 0.00 0.00 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 92 V 7.94 3.56 1.90 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 0.96 0.00 0.00 0.87 0.00 0.00 93 N 8.33 4.14 0.00 2.72 2.79 0.00 0.00 7.03 7.30 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 94 E 7.78 4.00 0.00 2.16 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 2.59 2.51 0.00 95 I 7.61 3.94 2.05 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 1.46 0.60 1.05 0.00 0.00 96 Y 8.42 4.26 0.00 3.18 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 97 K 8.20 4.57 0.00 2.09 1.93 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.62 1.72 7.81 98 Q 8.33 4.04 0.00 1.81 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.75 0.00 0.00 0.00 0.00 0.00 2.28 2.53 0.00 99 Y 7.61 3.69 0.00 1.92 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 0.00 100 F 7.82 4.72 0.00 3.02 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 0.00 101 K 8.34 4.45 0.00 1.68 1.82 0.00 1.80 0.00 0.00 1.88 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.29 7.81 102 S 7.51 3.32 0.00 3.70 3.61 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 0.00 103 N 8.43 4.07 0.00 2.75 2.84 0.00 0.00 6.93 7.45 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 0.00 104 F 7.61 4.38 0.00 3.10 3.03 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 0.00 105 P 0.00 4.63 0.00 1.83 1.93 0.00 3.70 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 2.15 0.00 106 A 8.62 4.31 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 0.00 107 R 8.59 5.55 0.00 1.74 1.71 0.00 2.60 0.00 0.00 3.51 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.56 0.00 108 A 8.70 5.05 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.48 5.18 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 0.00 110 Y 8.17 4.71 0.00 3.00 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 0.00 111 Q 8.89 4.93 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.57 0.00 112 V 8.50 4.52 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 0.82 0.00 0.00 1.03 0.00 0.00 113 A 8.73 4.09 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 0.00 114 A 7.27 4.47 1.20 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 0.00 0.00 115 L 7.87 4.87 0.00 1.85 1.52 0.99 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 116 P 0.00 4.39 0.00 2.18 2.00 0.00 3.73 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 117 K 9.51 3.67 0.00 1.91 1.90 0.00 1.88 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.44 7.81 118 G 8.09 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 0.00 0.00 0.00 119 S 7.76 4.37 0.00 3.91 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 0.00 120 R 9.55 4.43 0.00 1.69 1.95 0.00 3.32 0.00 0.00 3.10 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 121 I 7.33 4.88 1.84 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 1.21 0.63 0.90 0.00 0.00 122 E 9.15 4.91 0.00 2.01 1.66 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 2.15 2.22 0.00 123 I 8.92 4.92 1.91 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.90 1.08 0.00 0.00 124 E 8.84 5.02 0.00 2.21 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 2.21 2.27 0.00 125 A 8.30 5.16 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 0.00 126 V 8.78 4.76 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 0.79 0.00 0.00 0.96 0.00 0.00 127 A 8.93 5.17 1.17 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 0.00 0.00 0.00 0.00 0.00 128 I 8.25 4.84 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.97 0.89 0.00 0.00 129 Q 9.16 4.01 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.90 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 130 G 7.98 3.89 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 0.00 131 P 0.00 4.51 0.00 2.19 2.05 0.00 3.70 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 1.98 1.98 0.00 132 L 8.22 4.80 0.00 1.60 1.57 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 133 T 8.42 4.57 4.24 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 1.21 0.00 0.00 134 T 8.42 4.63 4.24 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 1.21 0.00 0.00 135 A 8.25 4.25 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