NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4115 8.3049 120.3482 55.0197 33.4226 174.9928 2 L 4.0780 8.2992 126.0905 52.9284 42.4393 175.9066 3 T 4.0833 8.6501 113.5672 64.2542 70.3405 174.1787 4 D 4.6139 7.6127 121.1782 50.3991 42.0489 172.8224 5 P 4.1832 0.0000 0.0000 65.0798 31.3569 177.8717 6 I 3.5767 7.6849 118.4560 64.1936 37.1082 177.9911 7 A 3.9358 8.1160 121.2492 55.0657 18.0295 179.0426 8 D 4.1993 8.1807 116.5641 57.8377 41.2355 178.0928 9 M 3.9113 7.8451 118.0469 58.6030 32.2447 177.8624 10 L 3.7596 8.1649 119.3513 58.4181 41.7599 180.0936 11 T 3.7994 8.1090 115.4145 66.5861 68.4919 176.9005 12 R 3.8660 8.1727 120.3982 59.5684 30.1294 179.1430 13 I 3.6203 7.8530 119.2973 64.1999 36.8625 178.2993 14 R 3.7487 7.6544 118.2609 59.6426 30.3312 177.7905 15 N 4.3246 8.8853 116.5500 56.3170 38.6089 176.8328 16 A 4.0044 8.4823 122.3832 55.7981 18.3955 179.7457 17 T 4.5224 7.8680 109.1793 64.6950 68.4826 176.7144 18 R 3.7386 7.7223 119.1343 57.7308 29.9699 177.8016 19 V 4.3043 7.2949 110.0254 60.4296 32.0228 174.7569 20 Y 3.2497 7.5567 115.7834 58.3256 35.8571 171.2669 21 K 4.1202 7.8153 117.5667 56.8133 32.7193 176.8592 22 E 4.3556 8.6308 120.5365 58.1786 30.2737 176.6721 23 S 5.2243 7.1444 113.6828 58.0870 66.4099 171.8523 24 T 4.0947 7.1311 109.9197 62.4202 71.1643 173.2753 25 D 5.3870 8.7742 128.4425 53.6383 43.4156 176.1618 26 V 4.5328 8.1478 118.4051 59.9748 35.0527 171.5678 27 P 3.5090 0.0000 0.0000 62.9835 31.5195 175.8797 28 A 4.4259 8.1877 126.8194 51.7531 19.5720 176.9186 29 S 4.5867 8.2710 113.2626 55.8170 66.3040 175.2751 30 R 3.9024 8.9460 122.8097 59.6318 29.9616 178.7025 31 F 4.3754 8.3395 119.6094 61.6281 39.3326 176.6717 32 K 3.4546 8.0661 118.8799 59.4742 31.7399 178.1590 33 E 3.5116 8.3933 119.6739 59.2723 29.3346 178.1478 34 E 3.9164 8.6605 119.6388 59.5654 29.4712 179.1353 35 I 3.7239 7.5452 119.2931 64.3081 37.1434 178.0679 36 L 3.7936 7.4216 119.6761 57.8522 41.2937 179.3306 37 R 4.0336 8.0063 118.7332 59.8522 29.8516 178.4994 38 I 3.7378 7.3506 117.6679 64.4000 37.1649 178.0687 39 L 4.1722 8.0734 119.7412 58.1260 41.4562 179.5479 40 A 4.0000 8.8447 120.6979 55.1622 18.1997 179.2278 41 R 3.8562 8.1162 116.2195 59.9804 30.2681 178.2760 42 E 4.0077 8.7673 115.7266 56.3712 30.6750 176.4160 43 G 3.7137 8.0689 107.3724 46.6520 0.0000 173.5005 44 F 4.9043 8.4686 115.7756 57.3446 41.8552 176.4037 45 I 4.7699 7.4750 111.4089 58.4453 40.5435 175.5458 46 K 4.0798 9.2646 121.6224 57.5735 32.1652 178.0505 47 G 4.2750 7.1098 105.4169 44.9215 0.0000 169.0804 48 Y 5.7631 7.7694 116.8569 55.8548 41.4100 174.1636 49 E 4.6818 8.4568 113.6002 56.0102 31.7057 176.5083 50 R 4.7319 8.8109 120.8859 57.1197 31.4907 175.5527 51 V 4.3317 8.0076 112.5941 61.3536 37.0769 172.5618 52 D 5.8500 8.4658 120.9287 51.3375 41.6426 174.1700 53 V 3.5533 8.2305 120.7755 62.8846 31.7709 175.5681 54 D 4.5095 9.1705 129.1351 55.8498 39.0526 173.5705 55 G 4.0919 8.3899 101.2468 46.0030 0.0000 173.2115 56 K 4.6124 7.6351 118.4519 53.0785 34.9512 173.7251 57 P 4.9201 0.0000 0.0000 63.5283 32.2141 174.8916 58 Y 5.0926 8.9908 122.0135 55.9310 41.5667 174.2949 59 L 5.1049 8.6560 118.6897 53.2728 45.3642 176.6741 60 R 4.2141 8.8348 124.7673 56.0950 31.3656 176.1857 61 V 4.4432 8.7394 125.2212 61.3480 33.4046 174.2147 62 Y 4.7384 9.0008 128.0397 57.4612 38.6678 175.4713 63 L 4.5720 8.9259 125.4376 54.1291 42.9312 176.5694 64 K 4.7616 8.1185 120.0189 55.3299 35.2825 174.6548 65 Y 4.7984 8.2082 118.2009 57.0312 43.0500 175.2228 66 G 4.2494 8.9635 110.2331 44.7556 0.0000 171.4635 67 P 4.7893 0.0000 0.0000 61.2823 33.5991 175.4966 68 R 4.0261 8.5646 121.0052 57.3476 30.7238 175.1656 69 R 4.7582 8.2358 122.0199 53.6920 34.0318 177.7423 70 Q 4.2973 9.0691 117.3491 57.2443 28.6601 182.4279 71 G 4.2323 8.8822 113.8898 45.0241 0.0000 173.2491 72 P 4.2603 0.0000 0.0000 63.4057 31.8284 174.6698 73 D 4.2551 8.4748 121.8854 54.5914 38.4825 170.8127 74 P 4.6440 0.0000 0.0000 62.2582 31.9264 176.7828 75 R 4.0352 7.5862 119.1264 55.7596 30.2479 175.0290 76 P 4.7427 0.0000 0.0000 62.1404 32.3523 175.4813 77 E 4.3950 8.7674 120.8776 56.2097 31.0456 175.5775 78 Q 4.7812 8.4990 122.9452 55.1302 30.1961 176.5573 79 V 3.8046 8.3765 121.8399 65.8841 31.8679 177.1062 80 I 4.2166 7.2390 122.2220 60.3326 35.6811 175.3268 81 H 4.2572 8.7195 121.1443 58.4123 29.3557 175.1889 82 H 4.3786 7.5365 119.3962 54.3166 32.3269 172.8803 83 I 4.0884 7.2736 121.5163 60.3121 39.4198 171.9557 84 R 4.4834 7.7201 128.6229 53.5599 32.6973 174.6181 85 R 3.8104 8.5808 126.9370 57.2208 30.2733 174.2302 86 I 4.1891 8.5189 125.9624 62.6281 38.2892 175.7270 87 S 4.2232 7.9427 120.5230 58.6748 63.5116 173.9005 88 K 4.7146 8.6818 124.6565 53.6233 36.0577 174.1172 89 P 4.4320 0.0000 0.0000 64.0647 31.6597 177.3847 90 G 3.8970 9.0827 109.9445 44.8924 0.0000 173.5027 91 R 5.0531 7.2991 123.4812 56.4724 32.6976 173.6226 92 R 4.0902 7.6437 118.8602 55.8583 31.3834 176.6288 93 V 4.1715 8.1226 121.3772 61.3222 33.8188 173.7897 94 Y 5.4844 8.4623 125.0596 56.4429 40.7688 175.6382 95 V 4.6893 9.1890 115.6219 59.5914 36.3544 175.8113 96 G 4.1633 9.9807 113.9593 44.4809 0.0000 175.0216 97 V 3.5989 8.5225 119.6365 64.8082 31.0490 178.2707 98 K 4.2827 8.0328 116.4090 57.4557 31.9692 176.9731 99 E 4.6337 8.4301 117.7683 55.7708 30.2244 175.9875 100 I 3.8830 7.5288 121.5165 60.3969 37.4366 174.5491 101 P 4.4761 0.0000 0.0000 62.8394 31.8988 176.7482 102 R 4.3119 8.0174 119.3246 53.8801 29.5935 174.4263 103 V 3.5050 8.0913 120.7045 63.6883 32.0027 175.2821 104 R 3.8624 8.6104 127.5863 59.9038 26.7575 176.8977 105 R 3.7252 8.6343 111.8528 56.9712 28.3630 177.2160 106 G 4.1203 8.3652 109.4511 45.8553 0.0000 175.7882 107 L 4.0888 8.4931 119.4507 56.5147 41.7883 176.2103 108 G 4.8065 7.7796 105.5973 44.6182 0.0000 171.4463 109 I 5.1825 8.9831 111.8206 59.4059 41.9714 173.6606 110 A 5.0685 8.6799 122.2712 50.3898 22.9196 174.9950 111 I 4.8646 8.9942 123.8260 59.6744 39.1171 174.8207 112 L 5.1884 8.8518 127.9276 53.9490 43.8526 175.1913 113 S 5.1428 8.9990 116.2682 57.0922 64.2450 173.0761 114 T 5.0719 8.2729 116.4205 59.4193 71.9233 175.2094 115 S 4.2619 8.8184 115.8366 60.5478 63.1460 174.9749 116 K 4.2906 7.8310 119.8928 56.0025 32.1144 177.3100 117 G 3.9464 8.5145 105.7712 44.5520 0.0000 173.3240 118 V 4.1816 8.0384 118.7888 63.3106 31.8508 175.0216 119 L 5.2461 9.2193 127.4198 53.2189 46.7629 175.8693 120 T 4.8125 8.5916 110.4626 61.0360 70.5762 175.5294 121 D 4.4331 9.0593 123.8830 56.9280 39.0538 179.3115 122 R 4.0081 8.0092 117.2432 59.0856 29.4223 177.8668 123 E 3.9153 8.0826 119.2514 58.9136 29.4440 178.9837 124 A 3.9811 8.5032 120.6236 55.5003 18.3934 179.5382 125 R 3.8054 8.2699 117.0455 59.5553 29.9668 178.4404 126 K 3.9189 8.4035 118.1181 59.5558 32.2454 177.8977 127 L 4.4104 8.3031 115.9845 53.6842 41.8132 176.9024 128 G 4.0948 8.1631 106.9418 46.5174 0.0000 173.8948 129 V 4.5211 8.0576 109.5066 59.3277 36.0284 175.8408 130 G 4.3788 8.9137 110.6907 45.4768 0.0000 172.2154 131 G 3.8600 7.4698 104.7240 46.1288 0.0000 170.2884 132 E 4.8430 8.0683 122.8006 55.7548 30.9821 177.4631 133 L 4.4389 8.9940 130.7337 54.5737 41.2320 177.0141 134 I 3.8551 8.7545 126.2187 62.9267 38.0631 175.4048 135 C 5.2071 7.4769 113.9472 57.8187 31.9012 171.8993 136 E 5.1291 8.1303 117.8706 55.0773 32.8268 174.8401 137 V 4.3807 8.3269 118.2526 61.6257 35.7765 173.4519 138 W 4.8501 8.5300 124.2713 57.2906 28.2220 174.1047 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 M 8.30 4.41 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.56 0.00 2 L 8.30 4.08 0.00 1.74 1.56 0.97 0.69 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 3 T 8.65 4.08 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 4 D 7.61 4.61 0.00 2.70 2.50 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 5 P 0.00 4.18 0.00 2.16 2.07 0.00 3.64 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 2.12 2.19 0.00 6 I 7.68 3.58 1.93 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.77 0.72 0.00 0.00 7 A 8.12 3.94 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 8 D 8.18 4.20 0.00 2.76 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 9 M 7.85 3.91 0.00 2.15 1.93 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 10 L 8.16 3.76 0.00 1.73 1.61 0.81 0.48 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 11 T 8.11 3.80 4.45 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 1.16 0.00 0.00 12 R 8.17 3.87 0.00 1.94 1.96 0.00 3.30 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 13 I 7.85 3.62 1.93 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.84 0.80 0.00 0.00 14 R 7.65 3.75 0.00 1.81 1.99 0.00 3.19 0.00 0.00 3.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 15 N 8.89 4.32 0.00 2.83 2.82 0.00 0.00 6.97 6.32 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 16 A 8.48 4.00 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 17 T 7.87 4.52 4.55 0.00 0.00 0.00 0.00 0.00 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 18 R 7.72 3.74 0.00 1.89 1.95 0.00 3.03 0.00 0.00 3.30 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 19 V 7.29 4.30 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 0.73 0.00 0.00 0.96 0.00 0.00 20 Y 7.56 3.25 0.00 2.92 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.82 4.12 0.00 1.83 1.94 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.55 7.81 22 E 8.63 4.36 0.00 2.10 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 2.55 2.43 0.00 23 S 7.14 5.22 0.00 3.24 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 24 T 7.13 4.09 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 1.18 0.00 0.00 25 D 8.77 5.39 0.00 2.50 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 26 V 8.15 4.53 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 0.65 0.00 0.00 0.87 0.00 0.00 27 P 0.00 3.51 0.00 1.79 1.73 0.00 3.64 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 2.01 2.15 0.00 28 A 8.19 4.43 1.19 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 0.00 0.00 29 S 8.27 4.59 0.00 3.98 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.95 3.90 0.00 1.92 2.09 0.00 3.17 0.00 0.00 3.29 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.73 0.00 31 F 8.34 4.38 0.00 3.00 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 32 K 8.07 3.45 0.00 1.78 1.72 0.00 1.71 0.00 0.00 1.45 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.26 1.23 7.81 33 E 8.39 3.51 0.00 2.13 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 0.00 2.33 2.11 0.00 34 E 8.66 3.92 0.00 2.35 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 2.41 2.49 0.00 35 I 7.55 3.72 1.77 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.31 0.79 0.00 0.00 36 L 7.42 3.79 0.00 0.99 1.17 0.48 0.66 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 37 R 8.01 4.03 0.00 2.02 2.01 0.00 3.39 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.88 0.00 38 I 7.35 3.74 2.06 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.82 0.99 0.00 0.00 39 L 8.07 4.17 0.00 1.89 1.84 0.96 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.84 4.00 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 41 R 8.12 3.86 0.00 1.93 2.21 0.00 3.30 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 42 E 8.77 4.01 0.00 1.98 1.61 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 2.52 2.58 0.00 43 G 8.07 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 F 8.47 4.90 0.00 3.21 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 45 I 7.47 4.77 2.12 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.85 0.95 0.00 0.00 46 K 9.26 4.08 0.00 1.96 1.95 0.00 1.89 0.00 0.00 1.73 0.00 0.00 3.20 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.52 1.61 7.81 47 G 7.11 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 48 Y 7.77 5.76 0.00 3.09 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 49 E 8.46 4.68 0.00 2.01 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 2.46 2.30 0.00 50 R 8.81 4.73 0.00 1.75 1.97 0.00 3.43 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.84 0.00 51 V 8.01 4.33 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 0.78 0.00 0.00 1.06 0.00 0.00 52 D 8.47 5.85 0.00 2.52 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 53 V 8.23 3.55 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 0.68 0.00 0.00 54 D 9.17 4.51 0.00 2.82 2.73 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 55 G 8.39 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 56 K 7.64 4.61 0.00 2.23 1.83 0.00 1.60 0.00 0.00 2.20 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.40 7.81 57 P 0.00 4.92 0.00 2.08 2.21 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 1.95 1.96 0.00 58 Y 8.99 5.09 0.00 2.97 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 59 L 8.66 5.10 0.00 1.60 1.66 0.83 1.20 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 60 R 8.83 4.21 0.00 1.68 1.14 0.00 3.13 0.00 0.00 2.91 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.55 0.00 61 V 8.74 4.44 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 0.95 0.00 0.00 0.98 0.00 0.00 62 Y 9.00 4.74 0.00 3.10 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 63 L 8.93 4.57 0.00 1.48 1.19 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.12 4.76 0.00 1.70 1.69 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.48 7.81 65 Y 8.21 4.80 0.00 3.03 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 66 G 8.96 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 0.00 0.00 0.00 0.00 67 P 0.00 4.79 0.00 2.14 2.20 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 2.05 1.98 0.00 68 R 8.56 4.03 0.00 1.80 1.87 0.00 3.12 0.00 0.00 3.19 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 69 R 8.24 4.76 0.00 1.68 1.82 0.00 3.28 0.00 0.00 3.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 70 Q 9.07 4.30 0.00 2.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.94 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 71 G 8.88 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 0.00 0.00 0.00 0.00 72 P 0.00 4.26 0.00 2.19 2.06 0.00 3.91 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 73 D 8.47 4.26 0.00 2.83 2.73 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 74 P 0.00 4.64 0.00 2.20 2.21 0.00 3.71 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 1.98 1.93 0.00 75 R 7.59 4.04 0.00 1.79 1.72 0.00 3.48 0.00 0.00 3.32 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.59 0.00 76 P 0.00 4.74 0.00 2.32 2.06 0.00 2.45 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 1.83 1.50 0.00 77 E 8.77 4.40 0.00 2.17 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 0.00 2.47 2.46 0.00 78 Q 8.50 4.78 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.86 0.00 0.00 0.00 0.00 0.00 2.38 2.24 0.00 79 V 8.38 3.80 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 0.93 0.00 0.00 0.99 0.00 0.00 80 I 7.24 4.22 1.72 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.79 0.63 0.00 0.00 81 H 8.72 4.26 0.00 3.18 3.48 0.00 5.84 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 82 H 7.54 4.38 0.00 1.40 1.31 0.00 5.81 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.27 4.09 1.51 0.00 0.00 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 1.01 0.42 0.67 0.00 0.00 84 R 7.72 4.48 0.00 1.66 1.45 0.00 3.21 0.00 0.00 3.46 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.48 0.00 85 R 8.58 3.81 0.00 1.78 1.76 0.00 3.38 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 86 I 8.52 4.19 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.89 0.89 0.00 0.00 87 S 7.94 4.22 0.00 3.95 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 88 K 8.68 4.71 0.00 1.77 1.59 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.57 7.81 89 P 0.00 4.43 0.00 2.03 1.98 0.00 3.68 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 90 G 9.08 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 91 R 7.30 5.05 0.00 1.80 1.77 0.00 3.21 0.00 0.00 3.12 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.49 0.00 92 R 7.64 4.09 0.00 1.28 1.30 0.00 3.59 0.00 0.00 3.14 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 93 V 8.12 4.17 1.97 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 1.03 0.00 0.00 0.90 0.00 0.00 94 Y 8.46 5.48 0.00 2.91 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 95 V 9.19 4.69 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 0.74 0.00 0.00 1.04 0.00 0.00 96 G 9.98 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 0.00 0.00 0.00 0.00 97 V 8.52 3.60 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 0.80 0.00 0.00 1.00 0.00 0.00 98 K 8.03 4.28 0.00 1.78 1.91 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.47 7.81 99 E 8.43 4.63 0.00 1.98 1.94 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 2.24 2.25 0.00 100 I 7.53 3.88 1.90 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 1.38 0.71 0.94 0.00 0.00 101 P 0.00 4.48 0.00 2.21 2.08 0.00 3.76 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 102 R 8.02 4.31 0.00 1.81 1.92 0.00 3.22 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 103 V 8.09 3.50 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 1.28 0.00 0.00 1.11 0.00 0.00 104 R 8.61 3.86 0.00 1.90 1.59 0.00 2.84 0.00 0.00 2.35 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.50 0.00 105 R 8.63 3.73 0.00 1.81 2.06 0.00 3.30 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.52 0.00 106 G 8.37 4.12 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 0.00 0.00 0.00 107 L 8.49 4.09 0.00 1.54 1.72 0.85 0.77 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 0.00 108 G 7.78 4.81 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 0.00 0.00 0.00 109 I 8.98 5.18 2.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.12 1.12 0.00 0.00 110 A 8.68 5.07 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 0.00 111 I 8.99 4.86 1.88 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 1.33 1.22 0.96 0.00 0.00 112 L 8.85 5.19 0.00 1.74 1.93 0.96 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 113 S 9.00 5.14 0.00 3.96 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 0.00 114 T 8.27 5.07 4.32 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 1.28 0.00 0.00 115 S 8.82 4.26 0.00 3.97 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 K 7.83 4.29 0.00 1.73 1.85 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.36 7.81 117 G 8.51 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 0.00 0.00 0.00 0.00 118 V 8.04 4.18 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 0.93 0.00 0.00 1.09 0.00 0.00 119 L 9.22 5.25 0.00 1.58 1.68 0.94 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.59 4.81 4.30 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 1.32 0.00 0.00 121 D 9.06 4.43 0.00 2.92 3.04 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 0.00 122 R 8.01 4.01 0.00 2.04 2.25 0.00 3.19 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 123 E 8.08 3.92 0.00 2.29 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 2.36 2.38 0.00 124 A 8.50 3.98 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.27 3.81 0.00 2.22 1.99 0.00 3.12 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 126 K 8.40 3.92 0.00 1.81 2.08 0.00 1.86 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.50 7.81 127 L 8.30 4.41 0.00 1.78 1.68 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.16 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 0.00 129 V 8.06 4.52 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 0.79 0.00 0.00 0.94 0.00 0.00 130 G 8.91 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 G 7.47 3.86 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 0.00 0.00 0.00 132 E 8.07 4.84 0.00 2.46 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.15 0.00 133 L 8.99 4.44 0.00 1.79 1.56 0.94 1.21 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 0.00 134 I 8.75 3.86 2.22 0.00 0.00 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 1.50 0.79 0.90 0.00 0.00 135 C 7.48 5.21 0.00 3.00 2.90 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 0.00 136 E 8.13 5.13 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.11 0.00 137 V 8.33 4.38 1.80 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 -0.25 0.00 0.00 0.69 0.00 0.00 138 W 8.53 4.85 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