NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0373 8.3549 109.7679 44.9824 0.0000 173.1189 2 D 4.5323 8.1442 118.6699 52.7462 41.9591 174.1465 3 K 4.7827 8.8630 119.0576 56.1103 35.9737 174.4185 4 L 4.6294 8.7183 121.9845 53.5395 43.6364 175.5573 5 I 4.7720 8.2921 123.7227 59.4573 39.7805 175.0981 6 L 4.5823 8.8822 126.5629 52.9665 44.1448 174.9694 7 K 4.7084 8.5714 125.3443 54.6337 34.1900 176.0442 8 G 3.8522 9.7572 116.7818 46.4621 0.0000 173.9023 9 L 3.9490 7.9361 119.6991 54.1802 42.8897 176.8230 10 K 4.7151 8.1880 125.3237 54.7064 33.7654 175.1580 11 F 5.3394 8.8297 125.5675 55.9687 43.4451 173.2038 12 Y 4.7794 9.0225 123.3081 56.8782 40.1588 174.5448 13 G 4.2089 8.9584 112.4696 44.9551 0.0000 172.4512 14 F 5.2181 8.3311 115.6240 57.4091 40.2788 175.2309 15 H 4.7342 8.2892 116.9013 55.1339 29.4270 174.9099 16 G 4.4139 8.0128 111.1071 44.5726 0.0000 173.3678 17 A 4.6155 8.0326 122.0449 52.3828 20.1950 177.4559 18 I 4.2289 7.4982 116.7127 59.9003 38.5864 176.7460 19 A 4.0704 8.7739 127.0700 55.5718 18.0599 179.6103 20 E 4.0506 8.1839 116.3632 59.3962 29.4662 179.2137 21 E 4.0285 8.2533 119.0313 59.3957 29.3055 179.3685 22 R 4.6580 7.8108 117.8507 58.3378 30.3055 178.7795 23 T 4.1888 7.5850 114.9920 66.5290 68.7859 176.7538 24 L 4.3109 8.2058 120.0553 57.0146 42.1068 178.4755 25 G 3.3953 9.3127 105.3035 45.1072 0.0000 171.2121 26 Q 3.8755 6.9626 115.4494 55.6642 32.0706 172.8322 27 M 4.6430 8.0718 118.8657 54.6781 33.2294 176.1584 28 F 4.9527 9.5460 120.5437 55.6375 43.2733 174.0062 29 L 5.3348 8.9290 121.6959 53.0347 44.9267 176.0090 30 V 5.6006 8.3543 121.1107 59.8180 35.3426 173.5045 31 D 5.4364 8.7753 122.7542 52.5868 44.4118 174.7407 32 I 5.1516 9.0203 123.5220 59.5900 41.3607 174.1558 33 D 5.2338 9.3007 125.7504 52.5986 43.8068 174.7752 34 A 5.1473 8.7228 126.9747 50.0668 21.0718 175.8715 35 W 4.7015 9.7339 124.7332 56.8606 30.0701 176.2164 36 V 4.7116 8.1766 123.2815 60.4221 34.0757 173.7227 37 S 4.2167 8.8791 119.0086 58.6217 62.8638 174.1223 38 L 4.6627 9.0689 126.2218 54.1916 42.0611 178.3903 39 K 3.8843 7.5741 121.4899 59.3519 32.1518 178.5224 40 K 3.8762 8.0440 119.0889 59.7028 32.2006 178.5066 41 A 4.1421 8.0348 120.5312 54.9332 18.1350 179.5956 42 G 3.7410 8.2472 103.6213 47.2954 0.0000 174.9543 43 E 4.3789 7.6802 119.7742 57.8064 30.2371 177.8662 44 S 4.3692 8.0372 113.1967 58.1113 63.7009 173.9474 45 D 4.3609 8.3378 120.0650 54.9076 40.1320 172.0800 46 N 4.8575 7.9131 115.9115 50.7441 40.3378 174.9557 47 L 3.8904 8.6085 127.9157 58.0020 42.2533 178.5622 48 E 4.0472 9.3469 118.0912 58.8123 29.4892 177.2185 49 D 4.6762 8.1073 117.2357 54.7436 40.9769 175.5308 50 T 4.5188 7.4043 113.3947 60.8503 70.3195 171.8094 51 I 4.3070 7.9198 121.3796 59.0512 39.5097 175.4764 52 S 3.8376 8.4854 120.6352 58.2613 62.6015 174.3974 53 Y 4.2604 7.7747 126.6864 59.5893 37.6388 178.4545 54 V 3.7810 7.5804 120.5247 66.1636 31.6376 177.5947 55 D 4.5998 7.8991 119.6131 56.9387 40.6123 178.8636 56 I 3.8335 7.6777 119.8357 64.2501 37.1257 177.8289 57 F 4.1800 8.6139 122.0061 61.6474 38.7097 177.4747 58 S 4.1610 8.6689 113.5025 60.9975 62.7898 176.2073 59 L 3.9493 7.9805 124.2117 57.8564 41.8792 178.6219 60 A 3.8618 8.1619 120.9845 54.9159 18.3047 179.3609 61 K 2.0000 7.5948 118.3639 59.1081 31.8795 178.6990 62 E 3.8277 7.4581 117.0670 59.3980 29.5771 179.3232 63 I 3.7502 7.5071 119.6677 64.4832 37.0512 178.7070 64 V 3.4517 7.3880 117.7123 65.6204 31.4183 176.9794 65 E 4.6215 7.8975 115.6323 58.3334 30.0859 177.5336 66 G 3.9257 7.9863 111.6597 44.6063 0.0000 173.2260 67 S 4.0153 8.7772 116.3842 57.9215 62.6018 173.4772 68 P 4.3364 0.0000 0.0000 62.9649 31.7773 175.5827 69 R 4.7698 8.4468 119.1186 54.1596 33.7827 176.6804 70 N 4.7215 8.7636 115.4884 55.4789 38.8548 176.4409 71 L 4.8752 7.4585 116.8198 52.5416 45.8555 177.4912 72 L 4.0134 8.3913 121.3426 57.9279 41.6577 179.5029 73 E 3.9707 8.2705 118.1554 59.9649 29.4081 179.5557 74 T 3.8773 7.6750 114.9704 66.6083 68.6450 176.9549 75 V 3.4849 7.5679 119.8051 65.8035 31.5198 177.9333 76 A 3.9907 8.6100 120.9708 55.0698 18.1040 179.2454 77 E 3.8908 8.2909 117.8737 59.3042 29.6195 179.0656 78 L 3.9438 8.0100 119.0468 57.7473 41.6866 179.3859 79 I 3.6496 7.8350 119.4780 64.3498 37.0318 178.2492 80 A 3.9737 7.9725 121.2532 55.3223 18.2314 179.6588 81 S 4.0379 8.2245 113.7120 61.9468 63.0128 177.2300 82 K 3.9469 8.3025 121.1423 59.6482 31.6651 179.6485 83 T 4.0234 7.9842 115.9805 66.7475 68.2412 176.6705 84 L 4.0281 7.8811 119.4895 57.8397 41.7273 178.8994 85 E 4.0246 8.5944 118.4341 59.0711 29.6660 178.3186 86 K 4.1071 8.3147 118.3504 56.7697 33.3900 176.4607 87 F 4.7371 8.0339 118.3948 54.7477 39.5010 174.7742 88 H 4.1595 8.5944 120.4209 58.7138 28.3383 177.2368 89 Q 4.1311 8.2861 117.5869 58.4717 28.6629 177.9875 90 I 4.0603 7.5746 118.4907 61.6931 37.4493 175.7207 91 N 4.7468 9.4963 123.4521 55.8055 39.3759 174.9784 92 A 4.6665 7.8863 118.0164 51.1472 23.0422 175.5778 93 V 5.1504 8.1829 118.2390 60.5257 35.3497 173.5598 94 R 5.1905 9.5185 125.1240 54.6923 32.4874 174.5907 95 V 4.9250 8.9004 126.1759 61.0457 34.6677 174.0365 96 K 5.0734 9.4503 127.7544 54.6581 34.6465 174.7461 97 L 5.2406 8.5283 127.1161 53.4394 44.3679 175.4184 98 S 5.1656 9.2604 120.8240 57.3025 68.5148 172.8968 99 K 4.5905 9.0397 121.0272 54.2843 33.3976 176.1130 100 P 4.4898 0.0000 0.0000 63.8405 31.6106 176.0072 101 N 4.7076 7.7949 114.8385 51.3172 39.1776 173.4771 102 V 4.0182 8.0496 123.1075 60.6749 32.7024 175.7402 103 A 4.0126 8.2692 130.1702 53.6194 18.8158 178.0056 104 L 3.9615 8.6633 120.6241 55.0296 40.5536 175.2536 105 I 3.8533 7.1623 119.7074 61.2097 37.0621 176.3603 106 K 4.1202 8.6779 125.4792 57.9692 32.4394 177.3084 107 S 4.6585 7.6497 112.5730 56.8057 64.8732 173.4158 108 T 4.2726 8.0987 117.8148 62.9908 68.9761 174.3361 109 I 4.6116 7.7682 117.4754 59.9681 40.8203 174.5750 110 D 4.5590 8.4121 119.0009 55.2662 41.2324 176.1078 111 Y 4.7224 6.4023 113.0016 56.6030 40.1670 172.2659 112 L 4.7752 7.9312 119.8053 53.5058 45.2534 176.5446 113 G 4.0906 8.0823 107.5300 47.0191 0.0000 172.3002 114 V 4.7596 8.6998 112.7701 59.6868 35.8777 175.1602 115 D 5.0050 8.6276 121.5364 53.2330 43.2947 174.1302 116 I 4.7903 8.7824 119.6641 58.9677 41.3277 174.2617 117 F 5.2677 8.6992 124.4712 56.6881 41.8700 174.0432 118 R 4.6197 8.4586 124.3531 54.5625 34.2839 174.3011 119 Q 4.7207 8.1608 119.2700 54.1023 33.6610 175.1707 120 R 4.0797 8.5043 119.3839 55.9209 29.3664 176.2982 121 N 4.8232 8.1650 121.0704 51.4841 40.9736 175.7675 122 T 4.0669 8.2369 114.6099 64.3012 68.5370 174.7838 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 G 8.35 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 0.00 0.00 0.00 2 D 8.14 4.53 0.00 2.93 2.56 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 3 K 8.86 4.78 0.00 1.34 0.96 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.62 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.94 1.11 7.81 4 L 8.72 4.63 0.00 1.58 1.65 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 5 I 8.29 4.77 1.80 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.37 0.85 0.00 0.00 6 L 8.88 4.58 0.00 1.65 1.64 1.01 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.57 4.71 0.00 1.68 1.62 0.00 1.96 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.29 1.43 7.81 8 G 9.76 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 0.00 0.00 0.00 9 L 7.94 3.95 0.00 1.65 0.83 0.96 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.19 4.72 0.00 1.63 1.59 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.40 7.81 11 F 8.83 5.34 0.00 3.06 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 9.02 4.78 0.00 3.08 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 13 G 8.96 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 0.00 0.00 0.00 0.00 14 F 8.33 5.22 0.00 3.07 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 15 H 8.29 4.73 0.00 3.21 3.35 0.00 5.78 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.01 4.41 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 0.00 17 A 8.03 4.62 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 I 7.50 4.23 1.97 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 1.47 1.21 0.95 0.00 0.00 19 A 8.77 4.07 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 20 E 8.18 4.05 0.00 2.10 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 2.42 2.49 0.00 21 E 8.25 4.03 0.00 2.33 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 0.00 2.33 2.37 0.00 22 R 7.81 4.66 0.00 1.97 2.06 0.00 3.46 0.00 0.00 2.99 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.58 0.00 23 T 7.59 4.19 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 1.27 0.00 0.00 24 L 8.21 4.31 0.00 1.74 1.81 0.96 1.12 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 25 G 9.31 3.40 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 0.00 26 Q 6.96 3.88 0.00 1.60 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.87 0.00 0.00 0.00 0.00 0.00 1.47 1.16 0.00 27 M 8.07 4.64 0.00 1.85 1.88 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 28 F 9.55 4.95 0.00 2.99 2.93 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 29 L 8.93 5.33 0.00 1.36 1.32 0.80 0.75 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 30 V 8.35 5.60 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 1.02 0.00 0.00 0.99 0.00 0.00 31 D 8.78 5.44 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 32 I 9.02 5.15 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 1.29 0.83 0.99 0.00 0.00 33 D 9.30 5.23 0.00 2.94 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.72 5.15 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 35 W 9.73 4.70 0.00 3.61 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 36 V 8.18 4.71 2.13 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 0.56 0.00 0.00 0.95 0.00 0.00 37 S 8.88 4.22 0.00 3.89 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 38 L 9.07 4.66 0.00 1.67 1.61 0.94 1.03 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 39 K 7.57 3.88 0.00 2.01 1.81 0.00 1.53 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.50 7.81 40 K 8.04 3.88 0.00 1.87 1.79 0.00 1.78 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.69 1.52 7.81 41 A 8.03 4.14 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 42 G 8.25 3.74 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 0.00 0.00 0.00 43 E 7.68 4.38 0.00 2.04 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 2.28 2.40 0.00 44 S 8.04 4.37 0.00 4.03 4.02 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 45 D 8.34 4.36 0.00 2.75 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 46 N 7.91 4.86 0.00 2.74 2.63 0.00 0.00 6.86 6.41 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 47 L 8.61 3.89 0.00 1.70 1.63 0.76 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 48 E 9.35 4.05 0.00 2.04 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 2.34 2.37 0.00 49 D 8.11 4.68 0.00 2.79 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 T 7.40 4.52 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 1.20 0.00 0.00 51 I 7.92 4.31 1.66 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.74 0.09 0.00 0.00 52 S 8.49 3.84 0.00 3.74 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 53 Y 7.77 4.26 0.00 3.12 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 54 V 7.58 3.78 2.13 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 1.11 0.00 0.00 1.05 0.00 0.00 55 D 7.90 4.60 0.00 3.01 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 7.68 3.83 2.04 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.17 0.97 0.00 0.00 57 F 8.61 4.18 0.00 3.33 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 8.67 4.16 0.00 4.19 4.34 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 59 L 7.98 3.95 0.00 1.92 1.98 0.90 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 60 A 8.16 3.86 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 61 K 7.59 2.00 0.00 0.87 1.49 0.00 1.84 0.00 0.00 1.69 0.00 0.00 3.29 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.14 1.10 7.81 62 E 7.46 3.83 0.00 2.09 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 2.28 2.67 0.00 63 I 7.51 3.75 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.79 0.83 0.00 0.00 64 V 7.39 3.45 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.91 0.00 0.00 65 E 7.90 4.62 0.00 1.98 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 2.63 2.21 0.00 66 G 7.99 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 67 S 8.78 4.02 0.00 3.82 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 68 P 0.00 4.34 0.00 2.26 2.16 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 69 R 8.45 4.77 0.00 1.81 1.84 0.00 3.29 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.53 0.00 70 N 8.76 4.72 0.00 2.73 2.90 0.00 0.00 7.12 7.85 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 71 L 7.46 4.88 0.00 1.66 1.77 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.39 4.01 0.00 1.73 1.76 1.06 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 73 E 8.27 3.97 0.00 2.06 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 2.42 2.50 0.00 74 T 7.68 3.88 4.34 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 1.19 0.00 0.00 75 V 7.57 3.48 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.49 0.00 0.00 76 A 8.61 3.99 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 77 E 8.29 3.89 0.00 2.30 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 78 L 8.01 3.94 0.00 1.85 1.66 0.88 0.59 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 79 I 7.83 3.65 2.04 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 1.42 0.68 0.94 0.00 0.00 80 A 7.97 3.97 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 81 S 8.22 4.04 0.00 4.04 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 82 K 8.30 3.95 0.00 1.79 1.83 0.00 1.64 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.59 1.60 7.81 83 T 7.98 4.02 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 84 L 7.88 4.03 0.00 1.76 1.74 0.83 0.87 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 85 E 8.59 4.02 0.00 1.94 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 0.00 2.26 2.28 0.00 86 K 8.31 4.11 0.00 1.43 1.15 0.00 1.54 0.00 0.00 1.30 0.00 0.00 2.83 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 0.97 7.81 87 F 8.03 4.74 0.00 3.18 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 88 H 8.59 4.16 0.00 3.31 3.48 0.00 5.56 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Q 8.29 4.13 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.95 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 90 I 7.57 4.06 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 1.32 0.54 1.10 0.00 0.00 91 N 9.50 4.75 0.00 2.69 2.92 0.00 0.00 6.81 7.31 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 92 A 7.89 4.67 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 5.15 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 0.67 0.00 0.00 1.03 0.00 0.00 94 R 9.52 5.19 0.00 2.58 2.31 0.00 3.31 0.00 0.00 3.39 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.02 0.00 95 V 8.90 4.92 2.13 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 0.97 0.00 0.00 0.99 0.00 0.00 96 K 9.45 5.07 0.00 1.67 1.72 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.42 7.81 97 L 8.53 5.24 0.00 1.74 1.53 0.89 0.91 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 98 S 9.26 5.17 0.00 3.48 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 99 K 9.04 4.59 0.00 1.63 1.57 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.06 1.43 7.81 100 P 0.00 4.49 0.00 1.99 2.11 0.00 3.61 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.01 0.00 101 N 7.79 4.71 0.00 2.55 2.69 0.00 0.00 6.78 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 0.00 102 V 8.05 4.02 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 0.78 0.00 0.00 0.93 0.00 0.00 103 A 8.27 4.01 1.25 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 0.00 0.00 104 L 8.66 3.96 0.00 1.84 1.91 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 105 I 7.16 3.85 1.99 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 1.29 0.46 0.96 0.00 0.00 106 K 8.68 4.12 0.00 1.72 1.86 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.48 7.81 107 S 7.65 4.66 0.00 3.95 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 0.00 108 T 8.10 4.27 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 0.00 109 I 7.77 4.61 1.81 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 1.49 0.78 0.88 0.00 0.00 110 D 8.41 4.56 0.00 2.51 2.84 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 0.00 111 Y 6.40 4.72 0.00 2.99 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 0.00 112 L 7.93 4.78 0.00 1.60 1.59 0.92 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 113 G 8.08 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.70 4.76 2.12 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 0.84 0.00 0.00 0.97 0.00 0.00 115 D 8.63 5.01 0.00 2.70 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 0.00 116 I 8.78 4.79 1.91 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 1.27 0.68 0.95 0.00 0.00 117 F 8.70 5.27 0.00 2.92 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 0.00 118 R 8.46 4.62 0.00 1.55 1.62 0.00 3.23 0.00 0.00 3.11 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.67 0.00 119 Q 8.16 4.72 0.00 1.75 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 7.11 0.00 0.00 0.00 0.00 0.00 1.88 1.86 0.00 120 R 8.50 4.08 0.00 1.79 1.89 0.00 3.20 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 121 N 8.16 4.82 0.00 2.68 2.76 0.00 0.00 7.20 7.54 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 0.00 122 T 8.24 4.07 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