NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 P 4.3543 0.0000 0.0000 63.0947 32.6295 173.4715 5 T 4.5322 7.9433 107.7388 59.8488 71.8218 173.2726 6 I 3.8053 9.0943 122.1409 65.0394 38.0704 179.2118 7 N 4.3624 8.1782 116.7635 56.5252 38.3318 177.1146 8 Q 4.0289 8.1885 119.3124 59.0893 28.5703 179.1957 9 L 3.9910 7.2491 117.7622 57.7021 41.7945 179.0465 10 V 3.7246 7.8896 117.5775 66.7095 31.4239 176.9798 11 R 4.1792 8.3997 117.1242 57.5860 30.0138 178.2414 12 K 3.6309 8.2578 124.0535 55.3406 32.9231 177.9928 13 G 4.0741 8.3418 105.7859 44.6213 0.0000 173.4492 14 R 3.9415 8.2108 119.6029 55.7825 30.5466 176.3672 15 E 4.0917 8.6375 124.2404 55.2482 30.2345 176.1941 16 K 4.0407 8.5176 127.7890 56.1674 32.3613 175.8621 17 V 3.2649 7.7753 118.6156 59.8268 31.8453 171.9971 18 R 3.8503 8.1709 132.6831 55.7080 30.8432 175.8705 19 K 4.6311 8.3473 123.4389 54.8042 35.2665 176.1945 20 K 4.2964 8.3699 121.0761 55.5910 33.1448 176.6993 21 S 4.3282 8.2233 115.2132 58.2549 62.8920 174.3048 22 K 4.1681 8.3804 123.5593 56.9128 32.2468 177.4044 23 V 3.9955 7.5117 119.5914 61.0646 33.3571 173.6573 24 P 4.5640 0.0000 0.0000 61.7698 29.5930 176.9132 25 A 4.6062 7.4880 125.5540 51.5019 20.9181 178.1483 26 L 3.4725 7.1063 128.9355 56.5470 40.8341 177.9103 27 K 4.3027 8.7225 124.5361 57.5855 31.0339 177.3530 28 G 3.9487 8.6034 104.7733 45.9138 0.0000 174.1872 29 A 3.8639 7.3530 120.8216 51.7947 18.8294 176.4794 30 P 3.9352 0.0000 0.0000 64.8413 31.4537 176.4577 31 F 5.4771 7.4463 113.0996 55.3041 43.2277 173.5623 32 R 4.7181 8.7682 121.5865 54.7224 33.0576 174.5057 33 R 5.0619 8.4186 124.8588 55.4757 32.5830 174.9517 34 G 4.4193 8.5853 110.6967 45.8126 0.0000 171.6761 35 V 4.8169 7.9245 120.0842 60.8491 33.4776 174.5837 36 C 4.2905 9.3683 127.5919 60.8742 27.8727 173.3318 37 T 4.1148 8.9108 120.2611 63.8014 67.4049 174.3612 38 V 4.3157 7.5922 120.6311 61.1836 34.1780 174.0843 39 V 4.4702 8.4326 126.9317 60.7787 32.1523 173.8832 40 R 4.7678 8.7004 125.9687 54.2747 34.5851 172.9397 41 T 5.0105 8.4881 116.8773 60.6253 68.7363 173.8455 42 V 4.6247 8.4589 122.4821 59.6866 34.4918 175.4896 43 T 4.4047 8.3607 113.8808 60.9174 69.8340 174.0551 44 P 4.7098 0.0000 0.0000 62.8305 33.2241 176.3427 45 K 4.5739 7.7751 120.1537 56.9915 30.1358 178.3165 46 K 4.0691 8.5838 128.8932 59.4863 32.1618 175.4169 47 P 4.5222 0.0000 0.0000 63.1733 31.9665 175.3069 48 N 5.0413 7.5087 114.5119 51.5193 42.0168 174.4367 49 S 4.3028 8.2396 111.5950 58.8318 63.5150 175.9734 50 A 4.2775 8.6657 132.6722 55.6466 19.1288 179.2193 51 L 3.5921 7.4801 114.8453 55.8589 38.5239 174.2641 52 R 4.4678 8.8250 126.9668 54.9873 31.7959 175.9056 53 K 4.4323 9.0744 123.7979 56.8022 32.6685 176.1614 54 V 5.0618 8.5994 124.8422 61.1895 35.5494 174.3465 55 A 5.2387 8.8134 124.6932 51.0479 22.7422 176.0961 56 K 4.5396 8.8463 122.9371 56.5536 33.7888 176.5324 57 V 4.5666 9.3303 124.6165 61.0085 34.5472 174.7427 58 R 4.4984 8.5267 130.3655 55.7010 29.8788 175.8231 59 L 4.4025 8.1089 126.5496 55.0661 41.9086 177.9996 60 T 4.1260 8.6332 109.9675 63.6209 68.9634 176.0250 61 S 4.5405 8.0999 117.2354 58.4502 63.0658 175.7818 62 G 3.7480 7.8601 107.6892 46.2328 0.0000 173.6989 63 Y 4.2915 7.2966 117.6074 57.6854 40.8583 174.3031 64 E 4.8949 8.4664 118.9017 56.3927 31.0323 174.3835 65 V 4.7307 8.4008 126.7601 61.0772 35.8810 173.4458 66 T 5.1374 8.4745 111.9375 59.9121 70.9613 173.4189 67 A 5.7177 8.9248 126.2368 49.3281 22.6380 173.8254 68 Y 4.9520 8.5686 121.0795 56.2166 40.9834 174.4746 69 I 3.9601 7.8553 128.2970 59.5604 37.5855 174.8614 70 P 4.0164 0.0000 0.0000 62.6171 32.2400 176.5820 71 G 4.0950 8.5839 111.9394 46.1608 0.0000 173.9327 72 E 4.1895 8.5331 118.5705 55.0039 27.9878 177.1026 73 G 3.9436 9.7848 110.8863 45.4699 0.0000 168.5485 74 H 4.6099 7.9545 110.9788 56.1877 31.0771 173.2902 75 N 4.8096 8.5286 112.2181 52.3300 36.9515 174.3978 76 L 4.7654 7.6105 117.2005 54.0389 44.7930 176.7492 77 Q 4.7548 8.5743 125.6341 55.4809 29.6527 175.7518 78 E 4.3649 8.7368 121.7162 58.8317 30.0352 177.1977 79 H 5.0329 7.8138 112.1970 56.2368 31.4721 173.6479 80 S 4.5990 8.1729 114.9958 58.4481 64.1888 173.6790 81 V 4.8806 8.1703 115.6981 60.2760 34.5788 174.9525 82 V 4.6280 8.1175 121.0762 61.7125 35.1799 171.2114 83 L 5.3161 8.3102 119.9881 53.2132 45.0611 175.6212 84 I 4.7791 8.3956 122.3680 59.9626 38.5191 176.7826 85 R 4.1648 9.0512 129.2120 58.1079 30.7345 174.2800 86 G 3.6789 8.9127 111.3417 46.1658 0.0000 172.3081 87 G 4.6448 7.7035 116.7951 45.2751 0.0000 170.8409 88 R 4.5062 8.5024 123.3821 55.7063 31.2228 176.2155 89 V 4.2203 8.1734 118.8808 60.8087 33.4691 176.1887 90 K 4.1851 8.8979 126.7345 57.8605 31.8467 177.1089 91 D 4.6842 7.7558 117.2455 53.7696 42.0931 175.5895 92 L 4.5786 7.9749 118.7878 52.6733 44.3763 174.0074 93 P 4.2621 0.0000 0.0000 64.6545 31.4493 174.9427 94 G 4.0607 9.0163 112.2772 45.8969 0.0000 173.1298 95 V 3.8127 7.4337 117.8563 62.9510 30.7981 175.5358 96 R 4.4145 8.4600 126.7722 55.4628 31.8309 175.3163 97 Y 4.8041 7.7829 116.7006 57.1999 42.3418 174.7395 98 H 4.9680 8.7707 122.4229 55.5764 30.7921 173.9644 99 I 4.8739 7.7338 118.7785 59.0183 39.8112 175.4948 100 V 3.7219 8.5840 129.7857 63.1528 32.1376 175.4989 101 R 4.4206 8.3894 124.3810 55.5736 32.0763 177.7893 102 G 3.9024 7.9857 106.6115 45.8400 0.0000 173.7835 103 V 3.9471 7.1687 120.4853 62.0810 33.6945 175.0569 104 Y 3.6321 8.0228 123.7971 59.1815 36.3252 171.6700 105 D 4.3393 8.5211 121.5130 57.5954 40.8121 175.8330 106 A 4.2130 7.8878 122.6899 51.0452 17.7528 177.1120 107 A 4.2232 8.5731 125.6693 52.4420 19.8726 177.5636 108 G 4.6160 8.1034 109.2027 45.8354 0.0000 172.9238 109 V 4.5710 7.8064 122.5229 60.9931 33.6592 176.6248 110 K 4.3134 8.5632 128.2450 56.9107 33.3494 176.9415 111 D 4.8379 9.0274 125.0762 54.5037 39.6720 175.1852 112 R 3.8942 7.3262 118.3189 56.4964 29.9015 174.4485 113 K 4.3987 7.7191 120.4292 57.8326 35.2178 176.6757 114 K 4.0904 7.5100 117.6514 57.5287 33.2340 177.2346 115 S 4.0575 8.7067 114.7722 59.4308 60.2703 174.8019 116 R 3.9668 7.4143 122.0141 59.4856 29.8547 178.4064 117 S 4.0754 7.9726 111.0958 62.0027 62.6286 176.2443 118 K 3.9245 8.0939 119.1518 59.4583 32.0714 177.7204 119 Y 4.2914 8.4313 113.5780 56.6709 38.1732 175.8370 120 G 3.8750 8.0466 108.1174 46.4835 0.0000 171.3341 121 T 4.6260 8.2115 116.2125 61.8300 71.2438 174.0413 122 K 3.8126 8.6444 128.0204 56.0595 32.5971 176.3766 123 K 3.7691 8.7223 126.9344 56.5979 32.4950 174.6367 124 P 4.6698 0.0000 0.0000 61.5005 33.6680 174.2691 125 K 4.5008 8.1850 118.1464 55.2442 34.6516 176.1649 126 E 3.9309 9.1516 125.9815 59.0677 30.0001 176.5302 127 A 4.0515 7.9321 124.0632 52.6730 18.7120 176.9064 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 4 P 0.00 4.35 0.00 2.19 2.19 0.00 3.69 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 1.88 1.96 0.00 5 T 7.94 4.53 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 6 I 9.09 3.81 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.57 0.91 0.00 0.00 7 N 8.18 4.36 0.00 2.73 2.88 0.00 0.00 7.04 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 8 Q 8.19 4.03 0.00 2.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 9 L 7.25 3.99 0.00 1.86 1.72 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.89 3.72 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.98 0.00 0.00 11 R 8.40 4.18 0.00 1.78 1.80 0.00 3.23 0.00 0.00 3.15 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.80 0.00 12 K 8.26 3.63 0.00 1.73 1.77 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.40 7.81 13 G 8.34 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 8.21 3.94 0.00 1.81 1.89 0.00 3.37 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 15 E 8.64 4.09 0.00 1.92 1.86 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 2.29 2.29 0.00 16 K 8.52 4.04 0.00 1.75 1.70 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.41 7.81 17 V 7.78 3.26 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 0.72 0.00 0.00 0.93 0.00 0.00 18 R 8.17 3.85 0.00 1.94 1.96 0.00 3.17 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 19 K 8.35 4.63 0.00 1.84 1.71 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.35 7.81 20 K 8.37 4.30 0.00 1.77 1.77 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.42 7.81 21 S 8.22 4.33 0.00 3.81 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 22 K 8.38 4.17 0.00 1.70 1.75 0.00 1.75 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.38 1.38 7.81 23 V 7.51 4.00 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 0.79 0.00 0.00 0.59 0.00 0.00 24 P 0.00 4.56 0.00 2.14 2.08 0.00 3.82 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 2.14 2.13 0.00 25 A 7.49 4.61 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 26 L 7.11 3.47 0.00 1.79 0.94 1.01 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.72 4.30 0.00 1.81 1.80 0.00 1.82 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.44 7.81 28 G 8.60 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 29 A 7.35 3.86 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 30 P 0.00 3.94 0.00 1.68 1.57 0.00 3.58 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.00 0.00 31 F 7.45 5.48 0.00 2.89 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 R 8.77 4.72 0.00 1.90 1.73 0.00 3.16 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 33 R 8.42 5.06 0.00 2.01 1.76 0.00 2.69 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.47 0.00 34 G 8.59 4.42 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 0.00 35 V 7.92 4.82 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 1.04 0.00 0.00 0.91 0.00 0.00 36 C 9.37 4.29 0.00 2.85 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 37 T 8.91 4.11 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 1.28 0.00 0.00 38 V 7.59 4.32 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 0.92 0.00 0.00 0.93 0.00 0.00 39 V 8.43 4.47 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 0.99 0.00 0.00 1.02 0.00 0.00 40 R 8.70 4.77 0.00 1.82 1.71 0.00 3.30 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 41 T 8.49 5.01 4.28 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 1.24 0.00 0.00 42 V 8.46 4.62 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 0.69 0.00 0.00 0.95 0.00 0.00 43 T 8.36 4.40 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 1.22 0.00 0.00 44 P 0.00 4.71 0.00 2.14 2.36 0.00 3.66 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 2.01 2.09 0.00 45 K 7.78 4.57 0.00 2.00 0.86 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.47 7.81 46 K 8.58 4.07 0.00 1.70 1.76 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.45 7.81 47 P 0.00 4.52 0.00 2.07 2.07 0.00 3.65 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 1.99 2.08 0.00 48 N 7.51 5.04 0.00 2.77 2.68 0.00 0.00 6.78 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 49 S 8.24 4.30 0.00 3.93 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 50 A 8.67 4.28 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 51 L 7.48 3.59 0.00 1.74 2.06 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 52 R 8.82 4.47 0.00 1.89 1.94 0.00 3.36 0.00 0.00 3.12 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.62 0.00 53 K 9.07 4.43 0.00 1.72 1.69 0.00 1.67 0.00 0.00 1.80 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.53 7.81 54 V 8.60 5.06 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 1.13 0.00 0.00 1.14 0.00 0.00 55 A 8.81 5.24 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 56 K 8.85 4.54 0.00 1.74 1.89 0.00 1.62 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.55 1.46 7.81 57 V 9.33 4.57 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 1.00 0.00 0.00 0.97 0.00 0.00 58 R 8.53 4.50 0.00 1.89 1.83 0.00 3.16 0.00 0.00 3.16 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.61 0.00 59 L 8.11 4.40 0.00 1.72 1.72 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 60 T 8.63 4.13 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 1.18 0.00 0.00 61 S 8.10 4.54 0.00 4.14 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 62 G 7.86 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 0.00 0.00 0.00 63 Y 7.30 4.29 0.00 2.78 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 64 E 8.47 4.89 0.00 1.93 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.21 0.00 65 V 8.40 4.73 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.80 0.00 0.00 66 T 8.47 5.14 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 1.25 0.00 0.00 67 A 8.92 5.72 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 68 Y 8.57 4.95 0.00 3.05 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 69 I 7.86 3.96 1.71 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.43 0.72 0.00 0.00 70 P 0.00 4.02 0.00 1.61 1.69 0.00 3.58 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.82 0.00 71 G 8.58 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 72 E 8.53 4.19 0.00 1.99 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 2.30 2.32 0.00 73 G 9.78 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 74 H 7.95 4.61 0.00 3.20 3.23 0.00 5.54 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 N 8.53 4.81 0.00 2.77 2.80 0.00 0.00 5.73 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.61 4.77 0.00 1.77 1.67 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 77 Q 8.57 4.75 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.94 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 78 E 8.74 4.36 0.00 1.89 1.89 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 2.16 2.36 0.00 79 H 7.81 5.03 0.00 3.02 3.19 0.00 5.76 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.17 4.60 0.00 3.80 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 81 V 8.17 4.88 1.87 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 0.77 0.00 0.00 0.94 0.00 0.00 82 V 8.12 4.63 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 0.65 0.00 0.00 0.96 0.00 0.00 83 L 8.31 5.32 0.00 1.51 1.57 0.68 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 84 I 8.40 4.78 1.93 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 0.97 1.17 1.17 0.00 0.00 85 R 9.05 4.16 0.00 1.91 2.10 0.00 3.35 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.86 0.00 86 G 8.91 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 0.00 0.00 0.00 87 G 7.70 4.64 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 88 R 8.50 4.51 0.00 1.87 1.82 0.00 2.90 0.00 0.00 3.09 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 89 V 8.17 4.22 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.74 0.00 0.00 90 K 8.90 4.19 0.00 1.75 1.81 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.34 7.81 91 D 7.76 4.68 0.00 2.52 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 92 L 7.97 4.58 0.00 1.59 1.46 0.68 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 4.26 0.00 2.03 2.00 0.00 3.62 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 94 G 9.02 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 0.00 0.00 0.00 95 V 7.43 3.81 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 1.21 0.00 0.00 0.95 0.00 0.00 96 R 8.46 4.41 0.00 1.37 1.46 0.00 3.15 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.67 0.00 97 Y 7.78 4.80 0.00 2.92 2.82 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 98 H 8.77 4.97 0.00 3.38 3.25 0.00 5.57 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 7.73 4.87 1.89 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 1.10 1.04 0.91 0.00 0.00 100 V 8.58 3.72 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 0.50 0.00 0.00 0.69 0.00 0.00 101 R 8.39 4.42 0.00 1.79 1.81 0.00 3.36 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.42 0.00 102 G 7.99 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 0.00 103 V 7.17 3.95 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 0.71 0.00 0.00 104 Y 8.02 3.63 0.00 3.27 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 0.00 105 D 8.52 4.34 0.00 3.24 2.75 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 0.00 106 A 7.89 4.21 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 0.00 107 A 8.57 4.22 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 0.00 108 G 8.10 4.62 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 0.00 109 V 7.81 4.57 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 0.79 0.00 0.00 1.15 0.00 0.00 110 K 8.56 4.31 0.00 1.88 1.64 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.46 7.81 111 D 9.03 4.84 0.00 2.88 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 R 7.33 3.89 0.00 1.62 1.78 0.00 3.02 0.00 0.00 2.92 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.44 0.00 113 K 7.72 4.40 0.00 1.70 1.67 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.33 7.81 114 K 7.51 4.09 0.00 1.74 1.67 0.00 1.79 0.00 0.00 1.79 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.42 7.81 115 S 8.71 4.06 0.00 3.93 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 0.00 116 R 7.41 3.97 0.00 1.85 2.20 0.00 3.37 0.00 0.00 3.07 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 117 S 7.97 4.08 0.00 3.87 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 0.00 118 K 8.09 3.92 0.00 2.04 1.75 0.00 1.79 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.52 7.81 119 Y 8.43 4.29 0.00 2.85 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 0.00 120 G 8.05 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 0.00 0.00 0.00 121 T 8.21 4.63 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 1.23 0.00 0.00 122 K 8.64 3.81 0.00 1.70 1.73 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.73 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.43 7.81 123 K 8.72 3.77 0.00 1.74 1.72 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.45 7.81 124 P 0.00 4.67 0.00 2.20 2.07 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 125 K 8.19 4.50 0.00 1.64 1.67 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.30 1.48 7.81 126 E 9.15 3.93 0.00 1.99 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 0.00 2.30 2.24 0.00 127 A 7.93 4.05 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