NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 K 4.3783 8.1733 120.0853 55.6404 34.7299 174.5035 16 K 4.8704 7.9828 118.7626 54.1860 35.7493 173.8692 17 R 4.6235 9.0099 120.5566 54.8864 35.4496 173.4902 18 Y 5.3024 8.8769 119.7594 56.0881 41.3039 174.6820 19 I 4.8969 8.9465 117.1563 59.0175 40.5633 174.3185 20 A 5.0089 8.8400 129.1205 50.9470 20.5146 175.9922 21 F 5.3340 8.5359 115.3769 55.1466 42.1500 173.3740 22 K 4.9763 9.0511 120.6936 54.5405 35.8071 174.8977 23 V 4.9977 8.4276 125.0119 60.1036 33.7906 175.1433 24 I 4.4256 8.9624 126.3042 60.2958 38.2404 174.6055 25 S 4.7812 8.3387 120.4323 56.9916 65.2131 173.6922 26 E 4.0597 8.9681 123.7246 58.0082 29.5805 175.7476 27 N 4.9516 7.4644 113.3171 50.2795 40.3730 173.5555 28 Q 4.3194 8.0005 117.0876 55.7658 29.5262 175.7100 29 F 5.3333 8.5394 117.2635 56.0734 43.2808 174.1826 30 N 5.3441 8.5544 119.9429 51.2378 39.6308 176.0551 31 K 4.0428 8.8137 118.9579 60.1514 32.0928 178.7102 32 D 4.3298 8.1923 118.2610 57.5802 40.7488 178.8627 33 E 3.8629 8.2619 119.1186 59.4868 29.5666 179.5567 34 I 3.4323 7.3216 112.4552 63.3787 37.4262 177.9166 35 K 3.7202 7.8846 121.6917 59.2874 32.0048 178.2886 36 E 3.8958 8.0600 119.2280 59.1880 29.5098 178.2549 37 A 3.9148 7.8916 120.7657 55.6230 18.2860 179.5102 38 I 3.5023 7.9841 118.3145 64.3327 37.0186 178.4758 39 W 3.9074 7.9591 129.0117 60.5865 30.6344 177.6829 40 N 4.2320 8.5487 116.2629 56.3596 37.9644 177.1369 41 A 3.9156 8.2573 122.2845 55.6187 18.4745 179.6243 42 C 4.0588 7.6432 115.1226 62.5069 28.0774 176.4941 43 L 3.6996 7.6606 120.8571 57.7280 41.0147 179.6849 44 R 3.8749 7.8829 116.7610 59.6075 30.1134 179.0883 45 T 4.1110 7.6765 113.9973 66.2098 69.0913 176.4158 46 L 4.3706 8.2577 119.6357 53.1092 42.3473 177.5760 47 G 4.2846 7.6578 106.6066 45.0583 0.0000 174.5000 48 E 3.8132 8.5307 118.0828 59.1729 29.3009 179.5954 49 L 3.9434 7.8159 119.7770 58.1088 42.2612 178.8504 50 G 4.0041 7.8984 106.4348 47.6208 0.0000 175.3748 51 T 3.6739 8.1382 118.4266 66.1583 68.1577 176.4814 52 A 3.9683 7.5828 121.6404 55.1109 18.4292 179.6223 53 K 4.0184 7.7503 115.7839 59.5292 32.4626 179.2818 54 A 3.9845 8.1552 121.1620 52.6435 19.3260 176.9911 55 K 3.6433 8.1628 115.8736 57.1521 29.8924 172.4704 56 P 4.9206 0.0000 0.0000 62.0099 32.7165 177.1987 57 W 5.4805 9.4883 134.8327 55.7621 34.1727 174.1135 58 L 4.6560 7.7747 129.5952 53.7799 40.2550 175.7425 59 I 3.9117 8.1959 118.3529 63.2709 38.4480 176.6306 60 K 4.7108 7.8698 122.0547 54.8807 35.8265 174.7232 61 F 5.1673 8.6808 127.6324 56.4646 41.3630 174.1585 62 D 4.2317 8.8033 129.5997 53.2461 39.6187 176.2251 63 E 3.8041 8.3359 126.6041 59.3097 29.9429 179.1964 64 T 3.9228 7.7936 112.7980 64.9715 67.3868 175.1883 65 T 4.3361 7.8248 107.5664 60.4666 69.7761 174.4087 66 Q 3.1188 7.4241 120.3465 57.8755 26.9474 172.9380 67 T 4.6175 6.3653 112.6493 61.9971 73.8237 174.7171 68 G 4.2514 7.0645 109.0839 46.0414 0.0000 172.1138 69 I 5.3619 8.9053 120.2715 59.4510 41.0730 175.2301 70 I 5.0157 8.7910 125.1951 59.6314 41.2154 174.3631 71 R 5.0950 9.3536 126.0803 54.9681 33.0578 174.6908 72 S 5.2729 8.3420 117.5190 57.5008 67.0142 173.0548 73 D 4.5148 8.9986 121.4122 54.5886 41.3492 177.3380 74 R 3.7441 8.6084 125.7710 59.4055 30.1107 176.7806 75 N 4.7445 8.4651 112.7479 53.5022 38.7643 174.8382 76 H 5.0531 8.2716 114.5351 54.8778 30.8678 175.4130 77 V 3.4135 7.9859 121.0566 66.5295 31.1965 177.3671 78 Y 4.4370 7.5507 114.1990 59.8641 37.7477 177.3372 79 D 4.5352 8.0535 120.6597 56.6792 41.3314 178.7974 80 V 3.6342 7.6548 118.4123 65.7141 31.5540 178.0747 81 I 3.6512 7.8562 119.6880 64.4571 36.8496 177.8365 82 F 3.9400 8.0706 120.0948 61.8167 39.1556 177.2387 83 S 4.3237 8.2060 114.4951 61.5614 62.6858 176.6328 84 L 3.9969 7.9721 121.6792 57.9771 41.0562 179.6882 85 T 3.8495 7.7460 115.1248 66.3498 68.4464 175.9981 86 L 4.3161 7.0659 116.7730 54.6414 41.7307 177.2448 87 V 3.5820 7.1628 119.6441 62.8390 30.5221 175.8310 88 S 4.1892 8.5865 122.8981 60.4432 62.6687 173.4575 89 D 4.8702 7.5991 116.5139 51.4114 42.3843 174.9577 90 I 4.1105 7.9293 118.9264 60.3537 39.2936 173.8029 91 N 4.1672 8.9364 128.8298 54.7241 36.3847 175.9388 92 G 4.0745 8.5062 107.1608 45.2741 0.0000 174.0064 93 N 4.7433 7.8035 117.7102 51.3291 39.2392 174.5905 94 K 4.1265 8.7182 124.7237 57.1100 32.7371 175.3356 95 A 4.8614 7.7619 124.2605 51.3451 22.7618 175.3344 96 I 4.6972 8.4977 112.8704 59.0066 41.4886 174.1211 97 I 5.1193 8.3695 123.3867 59.1180 40.4187 174.4043 98 K 4.7704 8.8860 128.4110 54.9071 35.4859 176.2910 99 V 4.3008 8.4648 116.2113 61.5787 32.2356 176.1532 100 L 4.4011 9.5337 123.7257 53.8736 42.7700 177.2577 101 G 3.5705 6.6532 110.9940 44.8443 0.0000 171.6886 102 V 4.5811 7.1753 113.9299 59.8960 34.1253 175.1162 103 S 4.6060 8.5476 113.8772 57.5422 65.1906 175.8511 104 G 3.6658 8.6676 113.5413 47.7680 0.0000 174.8449 105 T 4.6521 7.4727 109.6712 59.3407 72.4855 175.7108 106 I 3.4982 7.6597 121.6640 64.0909 37.0672 178.4760 107 K 3.9060 7.9147 120.0491 59.6283 31.6703 178.6138 108 R 3.9254 7.8469 118.5333 59.1372 28.5117 178.3276 109 L 4.2113 7.7831 119.7725 58.0345 42.2175 178.7147 110 K 4.0023 8.9330 120.2812 59.2480 32.0331 177.2403 111 R 4.1771 8.0544 119.9004 57.7316 29.4778 177.0845 112 K 3.6843 7.0031 122.4627 58.3273 33.2088 177.3741 113 F 4.8488 8.0701 115.1033 59.1405 42.9165 176.0902 114 L 4.3772 7.7759 118.2624 57.4118 41.7170 179.4608 115 S 5.1551 8.4228 112.4425 60.9410 62.7210 174.6691 116 Q 4.5277 7.9864 117.3598 56.0024 29.0753 175.0242 117 F 4.7029 8.5595 118.4938 57.6131 42.6789 174.4389 118 G 4.0038 9.0046 107.3876 46.7698 0.0000 173.4352 119 W 4.8289 7.8524 118.0360 54.8358 32.7854 176.6378 120 R 4.2646 8.4828 115.7642 57.0633 28.2564 174.6643 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 15 K 8.17 4.38 0.00 1.72 1.90 0.00 1.57 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.42 1.49 7.81 16 K 7.98 4.87 0.00 1.57 1.33 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.29 1.46 7.81 17 R 9.01 4.62 0.00 1.55 1.63 0.00 3.22 0.00 0.00 3.14 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.66 0.00 18 Y 8.88 5.30 0.00 2.92 2.85 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 19 I 8.95 4.90 1.81 0.00 0.00 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 1.33 0.89 0.80 0.00 0.00 20 A 8.84 5.01 0.97 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 21 F 8.54 5.33 0.00 3.12 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 22 K 9.05 4.98 0.00 1.63 1.65 0.00 1.82 0.00 0.00 1.85 0.00 0.00 3.10 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.38 1.28 7.81 23 V 8.43 5.00 2.36 0.00 0.00 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 1.27 0.00 0.00 24 I 8.96 4.43 1.94 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 1.19 1.14 0.97 0.00 0.00 25 S 8.34 4.78 0.00 4.10 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.97 4.06 0.00 1.96 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 2.29 2.34 0.00 27 N 7.46 4.95 0.00 2.61 2.63 0.00 0.00 6.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 Q 8.00 4.32 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 29 F 8.54 5.33 0.00 3.26 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.55 5.34 0.00 3.05 3.01 0.00 0.00 7.14 7.06 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 31 K 8.81 4.04 0.00 1.92 1.93 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.70 1.74 7.81 32 D 8.19 4.33 0.00 2.75 2.71 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 33 E 8.26 3.86 0.00 2.23 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 0.00 2.34 2.51 0.00 34 I 7.32 3.43 1.51 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 -0.26 0.59 0.47 0.00 0.00 35 K 7.88 3.72 0.00 1.78 1.93 0.00 1.44 0.00 0.00 1.44 0.00 0.00 2.73 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.31 1.23 7.81 36 E 8.06 3.90 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 37 A 7.89 3.91 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 I 7.98 3.50 1.98 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.67 0.87 0.00 0.00 39 W 7.96 3.91 0.00 3.56 3.31 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 40 N 8.55 4.23 0.00 2.77 2.87 0.00 0.00 7.01 7.40 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 41 A 8.26 3.92 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 42 C 7.64 4.06 0.00 2.66 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 43 L 7.66 3.70 0.00 1.66 1.58 0.63 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 44 R 7.88 3.87 0.00 1.72 1.97 0.00 3.14 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 45 T 7.68 4.11 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 46 L 8.26 4.37 0.00 1.70 1.59 0.84 0.73 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 47 G 7.66 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 0.00 0.00 0.00 0.00 48 E 8.53 3.81 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.32 0.00 49 L 7.82 3.94 0.00 1.67 1.60 0.89 0.99 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 50 G 7.90 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 0.00 0.00 0.00 51 T 8.14 3.67 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 0.71 0.00 0.00 52 A 7.58 3.97 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.75 4.02 0.00 1.62 1.78 0.00 1.66 0.00 0.00 1.62 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.59 7.81 54 A 8.16 3.98 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 55 K 8.16 3.64 0.00 1.93 1.80 0.00 1.65 0.00 0.00 1.62 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.54 7.81 56 P 0.00 4.92 0.00 2.09 2.03 0.00 3.76 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 1.93 2.05 0.00 57 W 9.49 5.48 0.00 3.29 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 58 L 7.77 4.66 0.00 1.45 1.14 0.78 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.20 3.91 2.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.83 1.20 0.00 0.00 60 K 7.87 4.71 0.00 1.96 1.96 0.00 1.66 0.00 0.00 1.47 0.00 0.00 2.77 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.47 7.81 61 F 8.68 5.17 0.00 3.04 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 62 D 8.80 4.23 0.00 2.33 2.46 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 63 E 8.34 3.80 0.00 1.95 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 2.62 2.41 0.00 64 T 7.79 3.92 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 1.18 0.00 0.00 65 T 7.82 4.34 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 1.30 0.00 0.00 66 Q 7.42 3.12 0.00 2.19 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.72 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 67 T 6.37 4.62 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 0.48 0.00 0.00 68 G 7.06 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 69 I 8.91 5.36 1.95 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 0.90 0.87 1.02 0.00 0.00 70 I 8.79 5.02 1.93 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.98 1.00 0.00 0.00 71 R 9.35 5.09 0.00 1.99 1.94 0.00 3.10 0.00 0.00 3.32 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.06 0.00 72 S 8.34 5.27 0.00 4.01 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 73 D 9.00 4.51 0.00 2.81 2.65 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 74 R 8.61 3.74 0.00 1.82 1.93 0.00 3.29 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 75 N 8.47 4.74 0.00 2.64 2.67 0.00 0.00 6.79 8.13 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 76 H 8.27 5.05 0.00 3.09 3.17 0.00 5.63 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 V 7.99 3.41 1.60 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 0.56 0.00 0.00 0.79 0.00 0.00 78 Y 7.55 4.44 0.00 3.10 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 79 D 8.05 4.54 0.00 2.90 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 V 7.65 3.63 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 1.02 0.00 0.00 0.99 0.00 0.00 81 I 7.86 3.65 2.01 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 1.39 0.48 1.00 0.00 0.00 82 F 8.07 3.94 0.00 3.24 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 S 8.21 4.32 0.00 4.08 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 84 L 7.97 4.00 0.00 1.72 1.56 0.72 0.25 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 85 T 7.75 3.85 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 1.10 0.00 0.00 86 L 7.07 4.32 0.00 1.69 1.62 0.67 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 87 V 7.16 3.58 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 0.89 0.00 0.00 88 S 8.59 4.19 0.00 3.87 3.80 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 89 D 7.60 4.87 0.00 2.80 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 90 I 7.93 4.11 1.62 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.74 0.32 0.00 0.00 91 N 8.94 4.17 0.00 2.91 3.01 0.00 0.00 7.12 8.02 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 92 G 8.51 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 93 N 7.80 4.74 0.00 3.19 3.03 0.00 0.00 6.46 8.13 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 94 K 8.72 4.13 0.00 1.75 1.78 0.00 1.83 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.48 7.81 95 A 7.76 4.86 1.48 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 0.00 0.00 96 I 8.50 4.70 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.15 0.93 0.00 0.00 97 I 8.37 5.12 1.93 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.00 0.88 0.00 0.00 98 K 8.89 4.77 0.00 1.87 1.89 0.00 1.41 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.43 7.81 99 V 8.46 4.30 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 0.72 0.00 0.00 0.95 0.00 0.00 100 L 9.53 4.40 0.00 1.39 1.80 0.87 0.66 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 0.00 101 G 6.65 3.57 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 0.00 0.00 0.00 102 V 7.18 4.58 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 0.56 0.00 0.00 0.91 0.00 0.00 103 S 8.55 4.61 0.00 3.98 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 0.00 104 G 8.67 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 0.00 0.00 0.00 105 T 7.47 4.65 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 1.27 0.00 0.00 106 I 7.66 3.50 1.63 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 -0.36 0.81 0.00 0.00 107 K 7.91 3.91 0.00 1.78 1.81 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.53 1.46 7.81 108 R 7.85 3.93 0.00 1.91 2.08 0.00 3.37 0.00 0.00 3.12 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 109 L 7.78 4.21 0.00 2.01 1.90 0.84 0.42 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 0.00 110 K 8.93 4.00 0.00 1.91 1.98 0.00 2.26 0.00 0.00 1.91 0.00 0.00 3.11 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.63 1.61 7.81 111 R 8.05 4.18 0.00 2.14 1.88 0.00 3.21 0.00 0.00 3.15 8.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 112 K 7.00 3.68 0.00 0.90 0.89 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.28 1.29 7.81 113 F 8.07 4.85 0.00 2.95 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 0.00 114 L 7.78 4.38 0.00 1.58 0.90 -0.87 0.22 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 0.00 115 S 8.42 5.16 0.00 4.01 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 0.00 116 Q 7.99 4.53 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.75 0.00 0.00 0.00 0.00 0.00 2.21 2.64 0.00 117 F 8.56 4.70 0.00 3.33 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 G 9.00 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 0.00 0.00 0.00 119 W 7.85 4.83 0.00 3.52 3.13 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 0.00 0.00 0.00 0.00 120 R 8.48 4.26 0.00 1.90 1.88 0.00 3.23 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.53 0.00