NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 A 4.3090 8.2649 123.5810 51.4989 19.9523 176.6762 6 Q 3.8438 8.4700 120.4054 55.8889 29.3057 175.8425 7 C 4.4233 8.3564 118.9919 56.2342 42.1652 172.9767 8 D 4.6367 8.4430 121.8196 53.0050 40.9748 175.1015 9 F 5.5343 8.4582 123.7513 57.2942 39.2703 176.3460 10 G 4.0346 8.1941 110.7039 45.0101 0.0000 174.4904 11 G 3.4021 8.0649 115.3875 44.2985 0.0000 172.4574 12 P 4.4438 0.0000 0.0000 62.1209 32.0087 175.3245 13 F 4.8202 8.5383 116.3951 55.7416 41.1874 174.8173 14 Q 4.6736 9.3904 125.3027 54.1496 29.7583 176.2267 15 A 3.9506 8.6976 128.8557 55.5744 18.3850 178.8081 16 Y 4.0634 8.0432 115.4344 60.2891 37.9647 178.7233 17 K 3.3586 6.6465 119.6803 58.6585 31.7399 179.1089 18 S 4.0749 7.4824 112.5835 61.5165 62.4504 176.1986 19 V 3.4689 7.6725 119.8272 65.8767 31.5851 177.4415 20 N 4.4908 8.5392 116.7853 55.0712 38.6195 175.8871 21 G 4.0967 8.7095 108.9389 44.8584 0.0000 173.3394 22 P 4.2724 0.0000 0.0000 64.0664 31.5348 177.4901 23 G 3.9384 9.5750 107.4119 45.0723 0.0000 172.3970 24 N 4.5715 8.0808 114.1996 52.6266 40.5626 176.3587 25 G 3.6185 8.7492 106.7603 46.1683 0.0000 172.6648 26 G 4.4974 7.6159 109.0254 46.0914 0.0000 170.7310 27 Y 5.3293 8.8713 116.9155 56.4247 41.0180 175.2317 28 Y 4.7497 9.1584 122.0597 57.0875 40.1743 174.9685 29 L 3.1569 8.6304 125.8465 54.4775 41.7031 176.5742 30 R 4.1604 8.6830 128.5562 58.6897 31.1419 176.2680 31 K 4.9783 7.2759 116.2765 55.0854 36.8699 175.0467 32 T 5.2603 8.7340 116.2357 61.1848 71.0541 174.0558 33 T 4.7689 8.8619 115.6829 61.2850 69.7441 174.3127 34 K 4.3507 8.0664 125.0588 54.4917 33.1803 174.3665 35 P 4.0631 0.0000 0.0000 63.3381 32.3115 176.2541 36 G 3.9037 8.7443 107.4814 45.8769 0.0000 173.6738 37 T 4.2061 7.4945 108.9367 59.9154 69.7599 172.8270 38 P 4.3591 0.0000 0.0000 62.3978 32.0312 176.2313 39 E 4.1558 8.8217 120.3024 58.1008 29.9522 177.5751 40 C 4.3973 9.3023 117.0501 57.9584 37.9884 172.8433 41 A 4.8334 8.0248 121.1840 52.6665 19.2696 177.0472 42 Y 5.6010 8.8371 118.6482 56.1958 42.0377 174.0235 43 V 5.0595 9.2136 112.8788 59.7332 35.7516 174.7159 44 L 5.0934 8.9444 123.3555 53.0377 43.4655 177.1793 45 V 3.8612 8.2500 116.2046 60.8507 30.7145 174.8365 46 P 4.5004 0.0000 0.0000 62.6239 31.8679 177.4087 47 Q 4.2700 8.6982 121.4565 57.9989 29.3480 175.9492 48 N 5.1141 7.2620 112.6045 50.4562 40.0069 174.3448 49 T 3.9109 8.4730 117.0221 64.0565 68.9946 173.9698 50 L 4.4865 8.5940 127.0679 53.9446 42.4949 176.1148 51 S 4.1666 8.5582 116.1429 55.2867 65.9057 172.8565 52 E 3.6073 7.4552 120.9936 57.6497 29.4217 177.1073 53 G 4.2727 8.7401 113.6520 45.4072 0.0000 173.4903 54 Q 4.4227 7.4241 118.5870 55.3659 30.4981 175.0211 55 S 5.3007 8.2095 116.5230 57.6389 65.8250 173.1980 56 T 4.5281 8.4256 115.2703 61.4260 71.1602 172.6903 57 S 5.1995 8.6845 121.3381 58.4482 64.1523 173.6329 58 F 5.0702 8.8384 116.2946 55.9953 41.6584 173.2624 59 T 4.9588 8.6492 116.9432 62.8543 70.3870 173.3311 60 Y 4.7743 8.2628 122.5160 56.0656 42.3044 174.6179 61 G 4.4940 7.4722 104.4358 48.8655 0.0000 172.0796 62 K 5.1916 7.9530 117.6863 56.7038 35.3920 173.8267 63 L 4.7720 8.5343 123.8602 55.1213 42.9501 176.4002 64 Q 4.3715 9.4707 126.9026 56.2006 31.9092 173.9466 65 N 4.2384 9.9492 124.2355 54.4483 36.1025 175.5081 66 G 4.0498 8.6785 105.3458 45.2963 0.0000 173.7989 67 Q 4.7576 7.9195 118.3346 54.0489 32.8601 174.8922 68 M 4.9271 8.6730 122.3137 54.9134 32.5425 176.1699 69 I 4.2011 8.6639 118.6849 60.5593 39.6838 174.7973 70 Q 5.1009 8.5544 122.7061 54.2765 30.8858 174.8286 71 L 4.8062 8.6845 123.1333 52.8533 46.1431 175.4121 72 T 4.9886 8.1722 109.3544 60.2752 71.9316 172.6349 73 A 4.6310 8.0685 123.7154 51.5554 23.6377 174.5096 74 T 5.3309 8.8332 114.8801 62.1275 71.3794 174.8018 75 V 4.9138 9.0140 124.4261 60.2523 34.6654 174.4348 76 T 5.1644 8.9630 121.0140 61.7120 71.9915 173.1769 77 V 4.8687 8.4197 119.0610 59.6593 34.7519 174.9044 78 N 5.3544 8.8466 122.4380 52.8005 43.6111 174.2587 79 G 3.8198 9.1627 113.1022 47.3194 0.0000 173.9740 80 D 5.1329 8.6057 123.2081 52.1698 39.6914 174.9919 81 K 4.8229 8.4076 120.6731 55.3873 34.3757 175.3877 82 I 4.1929 9.0275 126.7030 59.7360 39.0246 174.2327 83 E 4.8197 9.0103 130.0810 54.5088 31.3506 174.5808 84 V 4.9743 8.5995 127.8325 61.3065 34.1732 174.3723 85 T 4.6807 8.9376 117.5965 60.6604 71.7211 174.6394 86 G 4.0054 9.2516 112.9385 46.1565 0.0000 173.2822 87 A 4.7595 7.5702 119.0776 50.1569 19.7072 179.7793 88 G 3.8468 7.8599 105.3541 47.2860 0.0000 175.5257 89 Q 4.4674 8.7325 125.0616 55.6621 28.4325 174.8994 90 D 4.7943 7.3363 114.5401 54.5115 42.1156 176.7332 91 L 4.1736 7.5205 124.2213 55.4917 42.9236 177.7578 92 S 4.3086 7.1100 115.3084 59.8015 63.6341 172.9924 93 G 3.7001 8.5707 108.9487 44.3887 0.0000 171.6998 94 T 4.7791 8.5093 116.1487 62.6780 70.1525 174.0808 95 T 4.7546 9.1268 124.2919 62.2302 70.9601 173.8571 96 T 4.9183 8.6191 122.6583 61.7077 71.3606 173.8368 97 V 4.0019 8.5281 127.1016 62.5358 31.1327 175.5829 98 L 4.3321 8.7485 129.6302 57.0568 42.6031 177.2513 99 F 2.5348 7.3451 117.9532 56.9634 42.5002 173.0360 100 S 4.4437 6.3424 116.7779 57.4082 64.7382 173.9416 101 D 4.2728 8.0370 123.7760 52.6912 39.7017 177.0650 102 Y 4.0380 8.1320 116.6745 59.1042 35.7459 170.2034 103 R 4.5780 7.9585 117.8722 56.9227 33.6055 176.0861 104 S 4.8352 9.1617 111.5413 59.1783 65.8259 170.7715 105 C 5.3657 8.3108 112.7020 54.3743 45.7182 172.7870 106 D 5.0985 9.2727 118.9404 52.6675 45.3697 174.5145 107 V 5.0696 8.9603 121.3398 61.5719 34.2274 174.4555 108 M 5.3249 9.3004 126.5124 53.5697 36.4998 174.3899 109 R 4.8281 8.8087 121.5149 54.6676 31.9960 176.5677 110 G 4.2926 8.9395 116.4054 44.2442 0.0000 172.2961 111 P 4.5641 0.0000 0.0000 64.9133 31.2849 177.7282 112 D 4.4278 7.9519 115.5063 55.0016 40.9834 177.0579 113 G 3.8478 8.0050 108.4572 44.5339 0.0000 173.5756 114 N 4.4233 7.6519 117.1395 52.9391 39.1964 173.5100 115 Y 5.3402 8.7397 117.5130 56.9278 40.6976 174.8700 116 E 5.2477 9.3912 120.6026 54.7787 34.6856 173.9828 117 L 4.9883 8.7002 125.7974 53.1061 44.5776 174.8550 118 W 5.1546 9.0439 126.3228 54.9310 32.0179 175.1473 119 V 4.9153 8.8017 123.6355 60.9301 34.3070 174.2853 120 H 3.8775 9.7466 129.1239 55.8834 30.5860 176.1433 121 S 4.2861 8.6661 120.1881 61.5096 62.7659 177.0100 122 S 4.1633 8.0381 113.9223 60.0840 63.1568 174.3919 123 A 4.6650 8.1724 122.3896 51.5718 19.7233 177.6760 124 I 3.3836 7.2333 116.1375 63.5899 37.9871 176.3580 125 N 4.8062 7.8383 114.9494 53.0716 38.6230 175.0824 126 L 4.2297 7.4452 118.7950 54.5942 42.1983 177.4089 127 Q 4.1077 8.3529 119.3450 58.0611 29.1320 176.8013 128 S 4.3058 7.2870 110.4240 57.2326 65.5302 173.1441 129 Y 4.7757 9.1558 120.2650 57.4068 39.0657 176.8478 130 G 3.9878 7.7578 112.4469 46.8515 0.0000 178.8357 131 C 4.4884 8.9798 122.0635 59.7334 39.8026 176.3618 132 C 4.2811 8.2651 117.3317 59.8084 40.6960 175.7477 133 D 4.4670 8.1982 120.1783 57.8082 40.6841 178.6472 134 T 3.9218 7.8016 115.8146 66.5496 68.4575 176.6366 135 K 3.4261 7.7643 121.4219 59.1110 32.0306 178.6928 136 F 3.9746 8.4735 121.1211 61.1244 39.2998 176.8529 137 A 3.8024 8.1619 120.3741 55.1436 17.9254 179.4743 138 Q 3.7805 7.4118 114.8840 59.4606 28.9507 179.5110 139 V 3.3272 7.2400 111.4573 63.8411 31.8341 178.3098 140 A 3.8221 7.7154 121.2335 52.7927 18.3158 178.4713 141 G 3.6353 8.0344 105.4038 47.3048 0.0000 174.7029 142 G 3.9685 8.6253 114.1114 44.9956 0.0000 173.4796 143 R 4.1147 7.5151 118.8049 54.9481 30.3334 175.0591 144 P 4.3665 0.0000 0.0000 62.9416 32.0054 175.1505 145 I 4.8890 8.1648 122.4087 59.9394 39.5710 174.4988 146 H 4.8522 9.5714 123.9666 54.4374 31.2653 173.3897 147 H 5.0399 8.9500 121.0488 55.1972 28.3086 174.8191 148 T 4.2302 8.6982 121.8991 64.6686 69.8516 175.1592 149 W 4.7466 8.1024 130.2242 55.8329 32.2481 175.0421 150 Q 3.6945 6.5443 122.1507 53.4117 31.9438 176.1584 151 T 3.2727 7.4252 114.8586 64.6906 67.2910 174.4512 152 Y 4.2942 7.0432 116.9312 57.8799 38.6764 176.4468 153 C 4.1526 6.9988 119.8114 56.3654 40.6387 172.0167 154 P 4.5661 0.0000 0.0000 61.7203 31.6354 174.3542 155 P 4.7563 0.0000 0.0000 61.5925 31.9353 176.6530 156 L 3.7298 8.1485 120.4517 53.6229 42.1701 175.7773 157 P 4.3638 0.0000 0.0000 63.2385 31.0001 176.0702 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 A 8.26 4.31 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 6 Q 8.47 3.84 0.00 2.08 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.92 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 7 C 8.36 4.42 0.00 1.89 2.48 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 0.00 8 D 8.44 4.64 0.00 2.61 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 9 F 8.46 5.53 0.00 3.10 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 10 G 8.19 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 0.00 0.00 0.00 11 G 8.06 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 12 P 0.00 4.44 0.00 2.19 2.08 0.00 3.64 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 13 F 8.54 4.82 0.00 3.10 2.96 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 14 Q 9.39 4.67 0.00 1.67 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 15 A 8.70 3.95 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 16 Y 8.04 4.06 0.00 3.07 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 17 K 6.65 3.36 0.00 0.79 0.74 0.00 0.85 0.00 0.00 0.86 0.00 0.00 2.63 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.77 0.21 7.81 18 S 7.48 4.07 0.00 3.90 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 19 V 7.67 3.47 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 0.70 0.00 0.00 0.76 0.00 0.00 20 N 8.54 4.49 0.00 2.75 2.84 0.00 0.00 6.86 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 21 G 8.71 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 4.27 0.00 2.09 2.16 0.00 3.86 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.22 0.00 23 G 9.58 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 24 N 8.08 4.57 0.00 2.79 2.78 0.00 0.00 6.19 7.00 0.00 0.00 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 G 8.75 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.62 4.50 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 0.00 27 Y 8.87 5.33 0.00 2.88 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 28 Y 9.16 4.75 0.00 2.79 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.63 3.16 0.00 0.27 1.18 -0.06 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.68 4.16 0.00 1.62 1.69 0.00 3.34 0.00 0.00 3.01 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.53 0.00 31 K 7.28 4.98 0.00 0.79 1.25 0.00 1.38 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.28 1.19 7.81 32 T 8.73 5.26 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 1.23 0.00 0.00 33 T 8.86 4.77 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 1.34 0.00 0.00 34 K 8.07 4.35 0.00 1.73 1.74 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.34 7.81 35 P 0.00 4.06 0.00 2.16 1.90 0.00 3.81 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 1.94 1.94 0.00 36 G 8.74 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 0.00 0.00 0.00 37 T 7.49 4.21 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 1.26 0.00 0.00 38 P 0.00 4.36 0.00 2.14 2.10 0.00 3.74 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 2.10 2.13 0.00 39 E 8.82 4.16 0.00 2.27 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 0.00 2.45 2.46 0.00 40 C 9.30 4.40 0.00 3.43 3.46 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 0.00 41 A 8.02 4.83 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 42 Y 8.84 5.60 0.00 3.02 2.96 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 43 V 9.21 5.06 2.18 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 0.75 0.00 0.00 0.78 0.00 0.00 44 L 8.94 5.09 0.00 1.66 1.70 1.02 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 45 V 8.25 3.86 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 1.05 0.00 0.00 46 P 0.00 4.50 0.00 2.38 2.18 0.00 3.61 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 2.10 2.09 0.00 47 Q 8.70 4.27 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 48 N 7.26 5.11 0.00 2.82 2.74 0.00 0.00 6.99 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 8.47 3.91 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 1.24 0.00 0.00 50 L 8.59 4.49 0.00 1.88 1.63 0.88 0.87 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 51 S 8.56 4.17 0.00 3.63 3.76 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 52 E 7.46 3.61 0.00 1.56 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 2.24 2.30 0.00 53 G 8.74 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 7.42 4.42 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.67 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 55 S 8.21 5.30 0.00 3.72 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 T 8.43 4.53 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 1.26 0.00 0.00 57 S 8.68 5.20 0.00 3.83 3.78 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 58 F 8.84 5.07 0.00 3.08 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 59 T 8.65 4.96 4.33 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 1.22 0.00 0.00 60 Y 8.26 4.77 0.00 2.99 2.95 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 0.00 0.00 0.00 0.00 61 G 7.47 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.95 5.19 0.00 2.06 1.99 0.00 1.74 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.22 7.81 63 L 8.53 4.77 0.00 1.75 1.74 1.09 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 64 Q 9.47 4.37 0.00 2.11 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.07 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 65 N 9.95 4.24 0.00 2.91 2.88 0.00 0.00 7.28 7.65 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 66 G 8.68 4.05 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 0.00 0.00 0.00 67 Q 7.92 4.76 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 68 M 8.67 4.93 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.50 0.00 69 I 8.66 4.20 1.85 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 1.46 0.78 0.93 0.00 0.00 70 Q 8.55 5.10 0.00 1.89 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.84 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 71 L 8.68 4.81 0.00 0.27 1.01 0.72 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 72 T 8.17 4.99 4.14 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 1.12 0.00 0.00 73 A 8.07 4.63 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 0.00 0.00 0.00 0.00 0.00 0.00 74 T 8.83 5.33 4.29 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 1.31 0.00 0.00 75 V 9.01 4.91 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.61 0.00 0.00 76 T 8.96 5.16 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 1.23 0.00 0.00 77 V 8.42 4.87 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 0.67 0.00 0.00 1.00 0.00 0.00 78 N 8.85 5.35 0.00 2.70 2.65 0.00 0.00 6.58 7.74 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 79 G 9.16 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 80 D 8.61 5.13 0.00 3.05 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 81 K 8.41 4.82 0.00 1.74 1.74 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.54 7.81 82 I 9.03 4.19 1.79 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.74 0.63 0.00 0.00 83 E 9.01 4.82 0.00 2.03 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 0.00 2.20 2.26 0.00 84 V 8.60 4.97 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 1.08 0.00 0.00 0.81 0.00 0.00 85 T 8.94 4.68 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 86 G 9.25 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 0.00 0.00 0.00 87 A 7.57 4.76 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.86 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 89 Q 8.73 4.47 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 90 D 7.34 4.79 0.00 2.75 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 91 L 7.52 4.17 0.00 1.44 1.47 1.01 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 92 S 7.11 4.31 0.00 4.19 3.76 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 93 G 8.57 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 0.00 0.00 0.00 94 T 8.51 4.78 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 1.19 0.00 0.00 95 T 9.13 4.75 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 1.17 0.00 0.00 96 T 8.62 4.92 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 1.24 0.00 0.00 97 V 8.53 4.00 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 0.62 0.00 0.00 0.86 0.00 0.00 98 L 8.75 4.33 0.00 1.60 1.64 1.07 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 99 F 7.35 2.53 0.00 2.57 2.43 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 S 6.34 4.44 0.00 3.59 3.42 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 0.00 101 D 8.04 4.27 0.00 2.79 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 8.13 4.04 0.00 3.18 2.97 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 0.00 103 R 7.96 4.58 0.00 2.03 1.88 0.00 3.13 0.00 0.00 3.30 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 104 S 9.16 4.84 0.00 3.90 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 0.00 105 C 8.31 5.37 0.00 3.12 3.23 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 0.00 106 D 9.27 5.10 0.00 2.57 2.43 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 0.00 107 V 8.96 5.07 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 1.18 0.00 0.00 1.08 0.00 0.00 108 M 9.30 5.32 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.73 0.00 109 R 8.81 4.83 0.00 1.98 1.81 0.00 3.08 0.00 0.00 3.09 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.22 0.00 110 G 8.94 4.29 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 0.00 111 P 0.00 4.56 0.00 2.04 2.18 0.00 3.74 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.05 0.00 112 D 7.95 4.43 0.00 2.82 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 0.00 113 G 8.01 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 0.00 114 N 7.65 4.42 0.00 2.76 2.90 0.00 0.00 6.14 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 0.00 115 Y 8.74 5.34 0.00 2.92 2.95 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 0.00 0.00 0.00 0.00 116 E 9.39 5.25 0.00 2.15 1.77 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 2.26 2.36 0.00 117 L 8.70 4.99 0.00 0.91 0.77 0.94 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 118 W 9.04 5.15 0.00 3.25 3.17 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 0.00 119 V 8.80 4.92 1.67 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 0.85 0.00 0.00 0.09 0.00 0.00 120 H 9.75 3.88 0.00 2.48 2.93 0.00 5.66 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 S 8.67 4.29 0.00 3.94 3.98 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 0.00 122 S 8.04 4.16 0.00 4.02 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 0.00 123 A 8.17 4.67 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 0.00 124 I 7.23 3.38 1.54 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.67 0.00 0.00 125 N 7.84 4.81 0.00 2.76 2.91 0.00 0.00 6.94 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 0.00 126 L 7.45 4.23 0.00 1.54 1.49 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 8.35 4.11 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.68 0.00 0.00 0.00 0.00 0.00 2.32 2.26 0.00 128 S 7.29 4.31 0.00 3.85 3.68 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 0.00 129 Y 9.16 4.78 0.00 3.06 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 0.00 130 G 7.76 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 0.00 131 C 8.98 4.49 0.00 3.26 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 0.00 132 C 8.27 4.28 0.00 3.26 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 D 8.20 4.47 0.00 2.98 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.80 3.92 4.56 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 1.33 0.00 0.00 135 K 7.76 3.43 0.00 0.79 1.27 0.00 0.72 0.00 0.00 0.61 0.00 0.00 2.87 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.93 1.10 7.81 136 F 8.47 3.97 0.00 3.20 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 0.00 137 A 8.16 3.80 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 0.00 138 Q 7.41 3.78 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 139 V 7.24 3.33 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 0.00 0.00 0.40 0.00 0.00 0.47 0.00 0.00 140 A 7.72 3.82 0.63 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 0.00 0.00 141 G 8.03 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.63 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 0.00 143 R 7.52 4.11 0.00 1.97 1.91 0.00 3.39 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 144 P 0.00 4.37 0.00 2.22 1.96 0.00 3.59 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 2.14 2.12 0.00 145 I 8.16 4.89 1.94 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.01 0.97 0.00 0.00 146 H 9.57 4.85 0.00 3.09 3.24 0.00 5.80 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 H 8.95 5.04 0.00 3.06 3.34 0.00 5.69 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 T 8.70 4.23 4.37 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 1.29 0.00 0.00 149 W 8.10 4.75 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 6.54 3.69 0.00 0.93 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.62 0.00 0.00 0.00 0.00 0.00 2.14 2.32 0.00 151 T 7.43 3.27 3.95 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 0.00 0.00 0.00 1.07 0.00 0.00 152 Y 7.04 4.29 0.00 3.04 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 0.00 153 C 7.00 4.15 0.00 2.66 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 0.00 154 P 0.00 4.57 0.00 2.09 2.04 0.00 3.78 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 155 P 0.00 4.76 0.00 2.06 2.03 0.00 3.76 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 156 L 8.15 3.73 0.00 1.44 1.27 0.56 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 157 P 0.00 4.36 0.00 2.18 2.03 0.00 3.05 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.98 0.00