NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2167 8.3144 121.7897 55.6320 33.0641 175.1898 2 E 3.7842 8.6735 126.6339 54.8004 30.1734 174.9451 3 S 4.3145 8.9155 122.9381 57.9736 66.2548 174.5812 4 A 4.0341 8.6272 124.9285 55.3876 18.1390 180.0842 5 A 3.9421 7.9912 118.4353 55.3860 18.5095 179.5872 6 A 4.0022 8.2247 119.4164 55.0789 18.3357 179.7269 7 K 4.0836 8.4989 120.0032 59.0831 32.2016 178.7718 8 F 4.0778 8.5530 121.0749 61.3674 39.3749 176.9507 9 E 3.9858 8.4856 118.2346 59.3534 29.0364 179.3551 10 R 3.8102 8.0173 117.9481 59.6041 30.2824 178.2801 11 Q 4.0321 8.0515 116.6780 57.8714 28.8970 176.3942 12 H 4.6564 7.8953 113.2328 54.8488 30.7404 172.9698 13 M 4.5760 7.6359 119.7215 53.6794 33.7005 176.2641 14 D 4.7612 8.0990 121.9739 52.8553 41.4407 175.6435 15 S 3.9958 8.1453 117.8423 60.8159 63.5831 175.8887 16 G 3.8862 7.9240 106.4287 45.9634 0.0000 172.2116 17 N 5.0697 7.5271 115.9860 52.0750 43.1336 173.0236 18 S 4.7049 8.5081 112.3612 56.2532 66.1180 173.3550 19 P 4.2867 0.0000 0.0000 65.6235 31.0219 177.7459 20 S 4.4249 7.5314 108.9543 59.1030 63.7089 175.4937 21 S 4.5227 8.1465 120.6217 57.4562 61.1272 174.8236 22 S 4.3608 8.0279 119.9025 61.5193 63.2391 177.0306 23 S 4.3165 8.0376 114.6524 60.5535 62.9268 174.2448 24 N 4.6154 8.5573 118.9078 54.1334 39.3543 175.6808 25 Y 4.0718 8.1132 119.1400 62.1500 38.6590 177.6140 26 C 4.1187 8.4117 116.9876 59.8426 37.8913 175.6800 27 N 4.4087 8.2502 117.6634 56.6256 38.2005 177.2283 28 L 3.9535 7.6722 119.7561 57.7748 41.6929 179.1865 29 M 3.7095 7.8178 118.5162 58.5916 31.9467 178.1798 30 M 4.0431 8.1112 119.3419 58.2847 32.0147 178.3855 31 C 4.1387 7.6603 119.7783 62.1361 31.6247 174.9872 32 C 3.9384 8.2006 119.5550 62.4523 31.1299 174.3981 33 R 4.4157 8.1458 115.9797 55.5667 29.5781 176.2559 34 K 3.8925 7.7102 115.6764 58.4733 30.0284 176.1405 35 M 4.6708 8.3485 115.3518 55.3878 32.0588 177.2234 36 T 4.8762 7.8504 107.7615 61.4119 69.5008 172.6023 37 Q 4.8013 8.3534 120.6518 56.1396 30.4558 174.8143 38 G 4.2877 10.8183 114.6729 45.4491 0.0000 173.3802 39 K 3.6821 6.9415 114.5781 55.3755 34.8467 175.4825 40 C 4.6205 8.6117 118.0768 55.8218 40.3611 173.8381 41 K 4.1204 8.5244 127.3445 55.9872 32.2201 174.8685 42 P 4.5671 0.0000 0.0000 65.3618 32.6597 176.5243 43 V 5.0187 7.6129 118.5869 61.1362 34.6468 174.1646 44 N 4.7446 9.2516 125.2222 52.6618 42.8007 172.8015 45 T 4.7723 7.8069 121.9415 61.6765 70.8584 173.5233 46 F 4.7696 8.8728 124.7353 55.6741 41.7942 174.6432 47 V 4.5466 8.4119 122.4163 61.7574 32.8631 174.9384 48 H 4.9441 8.9980 123.7269 55.7321 29.6796 174.8888 49 E 4.2608 8.1644 118.3213 55.4113 30.3684 177.1219 50 S 4.3142 8.3454 115.1296 58.3699 64.8667 174.8682 51 L 3.9288 8.5931 124.4899 58.4643 41.7867 179.2392 52 A 3.9954 7.9757 120.0271 55.3959 18.1613 179.1689 53 D 4.3194 7.9927 116.1522 57.4652 41.1763 178.9872 54 V 3.7606 7.8506 118.7768 65.8907 31.7001 178.0708 55 K 3.8713 8.4997 118.5104 59.6299 31.9380 179.0365 56 A 4.0522 8.1972 120.4636 54.6292 18.1724 179.6890 57 V 3.7646 7.6473 117.0970 66.1882 31.3014 177.1916 58 C 3.8469 7.9151 114.9799 58.2437 39.9320 174.3064 59 S 4.5670 7.4646 113.7689 57.9004 63.7045 174.7300 60 Q 4.6951 7.5113 121.1248 55.9796 30.9654 176.2616 61 K 4.1944 8.5322 128.3664 56.9424 33.2771 176.6887 62 K 4.2281 8.7490 129.8797 56.6205 32.6178 176.1550 63 V 4.6646 8.0495 119.8897 59.2811 36.2095 175.4082 64 T 3.9132 8.3031 112.5372 61.7466 69.3773 175.2065 65 C 4.6093 8.2958 123.0470 56.3547 40.9631 174.9977 66 K 3.7089 9.4025 123.5207 59.3704 31.7334 177.7423 67 N 4.5982 8.1419 113.5698 52.4607 37.4464 176.0056 68 G 3.9131 8.1600 107.4440 45.7488 0.0000 174.2943 69 Q 4.2576 8.3766 119.4340 56.1775 29.2555 176.1842 70 T 4.4421 8.1982 108.1535 61.7553 69.2895 173.8600 71 N 5.0559 8.0035 117.2774 53.9512 38.6881 173.9797 72 C 5.3591 7.9537 115.7222 56.8927 44.4220 172.4702 73 Y 5.2774 8.7670 118.3725 56.5649 42.2645 173.7625 74 Q 5.1315 9.4077 125.5446 54.1020 31.3115 174.9923 75 S 4.6241 8.9018 121.9875 58.3374 63.1143 174.9426 76 K 4.1716 9.8107 122.3295 59.3026 32.7094 176.7290 77 S 4.9473 7.6096 113.5368 56.1815 67.0533 173.9368 78 T 4.0841 8.2721 111.1257 62.4106 69.4364 173.4256 79 M 5.0271 8.9078 121.8477 53.4637 36.7716 175.0426 80 R 4.5997 9.4598 122.0135 56.1824 31.2315 175.8387 81 I 5.0883 8.9109 117.1173 59.4582 42.1194 174.1645 82 T 5.0717 9.0358 118.8234 61.9664 71.9188 172.9393 83 D 4.9195 9.0997 126.8193 53.3991 42.9540 174.7844 84 C 5.4720 9.2802 121.3760 55.3930 39.9923 173.1057 85 R 5.2449 8.8281 123.1927 53.8598 33.2043 174.9185 86 E 4.0433 9.2578 126.4732 56.4719 30.2332 176.9987 87 T 4.2515 8.5063 117.1588 60.7891 69.9186 175.9545 88 G 3.6292 8.4782 111.0639 48.5280 0.0000 175.0710 89 S 4.3237 7.3241 114.9206 59.6564 63.3268 174.7232 90 S 4.1466 7.3529 115.5488 58.0081 62.7723 173.4343 91 K 4.4611 8.3468 126.5897 54.8515 34.9866 174.6368 92 Y 4.3499 8.7562 127.8118 57.6810 39.0795 173.8639 93 P 3.1299 0.0000 0.0000 62.6597 31.8725 176.7669 94 N 4.5397 7.6504 119.6223 52.2480 36.9081 171.7808 95 C 4.3885 8.2136 116.2105 56.5535 41.1349 172.9087 96 A 5.1865 8.4735 127.3091 50.3287 21.1525 174.8520 97 Y 5.1955 9.1071 118.7647 55.9746 42.0744 175.0927 98 K 4.4177 9.3075 124.5226 56.1381 34.0030 175.4284 99 T 4.9905 8.5740 123.7685 62.5080 70.0985 174.0263 100 T 4.5983 8.7940 123.6940 61.6528 71.4721 173.4305 101 Q 4.4951 8.7455 126.3584 55.7197 29.5437 176.0105 102 V 4.5711 8.9078 116.5523 59.6824 36.6434 174.7995 103 E 5.5528 8.7276 121.3448 53.6826 31.5502 175.0952 104 K 4.7959 8.2648 122.6000 54.3605 37.4587 175.5634 105 H 4.6827 8.6352 118.4456 56.1523 29.7990 174.9152 106 I 4.8209 8.6395 115.6855 59.3206 40.7771 174.3419 107 I 4.9142 8.2912 124.2382 59.6802 39.9564 175.1177 108 V 4.7544 8.6135 119.5928 59.2754 35.6802 174.6225 109 A 4.9395 8.7947 125.3406 51.5425 20.1855 175.8179 110 C 5.4633 9.1906 119.5703 55.5518 44.5992 173.4412 111 G 4.0086 9.2514 108.2052 46.4986 0.0000 173.3309 112 G 4.3376 9.0917 106.5310 44.9802 0.0000 172.7728 113 K 4.6044 8.0620 116.7618 53.5152 34.2120 175.0613 114 P 4.3666 0.0000 0.0000 62.1721 31.9945 176.0555 115 S 4.6753 8.3097 114.8582 58.1047 62.6705 173.5023 116 V 4.6317 8.6663 119.8599 58.5005 36.1620 173.3729 117 P 4.7836 0.0000 0.0000 63.2971 31.0808 176.8099 118 V 4.4817 9.1526 116.3552 61.5044 34.3659 175.4075 119 H 4.9454 8.0435 119.0673 54.4219 33.6970 171.6086 120 F 4.5567 8.5270 126.9280 57.3123 39.6566 174.4655 121 D 4.6484 8.3810 126.7678 55.9148 41.9598 175.8770 122 A 4.6236 6.6015 117.2311 51.5775 22.2828 174.8021 123 S 5.3166 8.9603 113.7545 56.6163 65.6425 174.6555 124 V 4.1348 8.6502 120.3233 62.0989 31.5470 175.0749 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 K 8.31 4.22 0.00 1.74 1.79 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.39 7.81 2 E 8.67 3.78 0.00 2.12 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 0.00 2.40 2.37 0.00 3 S 8.92 4.31 0.00 4.10 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 4 A 8.63 4.03 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 5 A 7.99 3.94 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 6 A 8.22 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 7 K 8.50 4.08 0.00 1.99 2.06 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.31 7.81 8 F 8.55 4.08 0.00 3.18 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 9 E 8.49 3.99 0.00 2.28 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 2.47 2.64 0.00 10 R 8.02 3.81 0.00 1.76 2.06 0.00 3.22 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 1.58 1.62 0.00 11 Q 8.05 4.03 0.00 1.71 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.47 0.00 0.00 0.00 0.00 0.00 2.27 2.46 0.00 12 H 7.90 4.66 0.00 1.77 2.74 0.00 5.62 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.64 4.58 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.62 0.00 14 D 8.10 4.76 0.00 2.65 2.45 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 15 S 8.15 4.00 0.00 3.91 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 16 G 7.92 3.89 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 0.00 0.00 0.00 17 N 7.53 5.07 0.00 3.06 2.70 0.00 0.00 6.70 7.45 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 18 S 8.51 4.70 0.00 3.97 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 P 0.00 4.29 0.00 2.06 2.17 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 20 S 7.53 4.42 0.00 4.03 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 21 S 8.15 4.52 0.00 3.95 3.87 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 0.00 0.00 0.00 0.00 22 S 8.03 4.36 0.00 3.88 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 23 S 8.04 4.32 0.00 3.89 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 24 N 8.56 4.62 0.00 2.81 2.89 0.00 0.00 6.64 7.49 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 25 Y 8.11 4.07 0.00 3.18 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 26 C 8.41 4.12 0.00 3.15 3.06 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 27 N 8.25 4.41 0.00 3.10 2.93 0.00 0.00 7.16 6.74 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 28 L 7.67 3.95 0.00 1.54 1.57 0.87 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 29 M 7.82 3.71 0.00 1.09 0.80 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.05 0.00 30 M 8.11 4.04 0.00 1.78 1.82 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.37 0.00 31 C 7.66 4.14 0.00 3.04 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 32 C 8.20 3.94 0.00 2.85 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 33 R 8.15 4.42 0.00 2.03 2.02 0.00 3.57 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.91 0.00 34 K 7.71 3.89 0.00 1.95 1.93 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.53 7.81 35 M 8.35 4.67 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.43 0.00 36 T 7.85 4.88 4.40 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 1.43 0.00 0.00 37 Q 8.35 4.80 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.80 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 38 G 10.82 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 39 K 6.94 3.68 0.00 1.63 1.47 0.00 1.51 0.00 0.00 1.78 0.00 0.00 2.80 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.26 1.31 7.81 40 C 8.61 4.62 0.00 3.24 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 41 K 8.52 4.12 0.00 1.80 1.80 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.22 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.40 7.81 42 P 0.00 4.57 0.00 2.19 2.31 0.00 3.73 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 2.10 1.98 0.00 43 V 7.61 5.02 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 0.80 0.00 0.00 0.97 0.00 0.00 44 N 9.25 4.74 0.00 2.65 2.27 0.00 0.00 6.72 8.05 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 45 T 7.81 4.77 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 0.81 0.00 0.00 46 F 8.87 4.77 0.00 3.01 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 47 V 8.41 4.55 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 0.86 0.00 0.00 1.04 0.00 0.00 48 H 9.00 4.94 0.00 3.13 3.27 0.00 5.71 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.16 4.26 0.00 1.99 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 0.00 2.34 2.26 0.00 50 S 8.35 4.31 0.00 4.05 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 51 L 8.59 3.93 0.00 1.79 1.73 0.94 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.98 4.00 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 53 D 7.99 4.32 0.00 2.82 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 54 V 7.85 3.76 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 1.08 0.00 0.00 1.03 0.00 0.00 55 K 8.50 3.87 0.00 2.02 1.84 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.60 7.81 56 A 8.20 4.05 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.65 3.76 2.21 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 1.11 0.00 0.00 1.00 0.00 0.00 58 C 7.92 3.85 0.00 2.92 2.77 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 59 S 7.46 4.57 0.00 3.89 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 60 Q 7.51 4.70 0.00 2.13 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.90 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 61 K 8.53 4.19 0.00 1.85 1.72 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.76 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.39 7.81 62 K 8.75 4.23 0.00 1.82 1.62 0.00 1.58 0.00 0.00 1.39 0.00 0.00 2.57 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.23 1.36 7.81 63 V 8.05 4.66 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 0.77 0.00 0.00 0.83 0.00 0.00 64 T 8.30 3.91 4.19 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 1.16 0.00 0.00 65 C 8.30 4.61 0.00 3.16 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 66 K 9.40 3.71 0.00 1.70 1.89 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.55 7.81 67 N 8.14 4.60 0.00 2.80 2.89 0.00 0.00 6.12 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 68 G 8.16 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 0.00 0.00 0.00 69 Q 8.38 4.26 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 70 T 8.20 4.44 4.18 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 0.00 0.00 0.00 1.17 0.00 0.00 71 N 8.00 5.06 0.00 2.97 3.03 0.00 0.00 6.04 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 72 C 7.95 5.36 0.00 2.89 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 73 Y 8.77 5.28 0.00 2.90 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 74 Q 9.41 5.13 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.98 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 75 S 8.90 4.62 0.00 3.91 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 76 K 9.81 4.17 0.00 1.87 2.01 0.00 1.56 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.64 1.43 7.81 77 S 7.61 4.95 0.00 3.70 3.73 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 78 T 8.27 4.08 4.19 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 1.09 0.00 0.00 79 M 8.91 5.03 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 80 R 9.46 4.60 0.00 1.82 1.91 0.00 3.06 0.00 0.00 3.22 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.67 0.00 81 I 8.91 5.09 1.94 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.83 1.04 0.00 0.00 82 T 9.04 5.07 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 1.35 0.00 0.00 83 D 9.10 4.92 0.00 2.62 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 84 C 9.28 5.47 0.00 2.87 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 85 R 8.83 5.24 0.00 1.81 1.85 0.00 3.18 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 86 E 9.26 4.04 0.00 1.67 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 0.00 2.19 2.08 0.00 87 T 8.51 4.25 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 1.20 0.00 0.00 88 G 8.48 3.63 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 0.00 89 S 7.32 4.32 0.00 4.05 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 90 S 7.35 4.15 0.00 3.80 3.83 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 91 K 8.35 4.46 0.00 1.78 1.58 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.53 7.81 92 Y 8.76 4.35 0.00 2.94 2.87 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 0.00 0.00 0.00 0.00 93 P 0.00 3.13 0.00 1.74 1.07 0.00 3.65 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 94 N 7.65 4.54 0.00 2.92 2.76 0.00 0.00 7.01 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 95 C 8.21 4.39 0.00 3.15 3.16 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 96 A 8.47 5.19 1.17 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 0.00 0.00 97 Y 9.11 5.20 0.00 2.86 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 98 K 9.31 4.42 0.00 1.84 1.73 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.47 7.81 99 T 8.57 4.99 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 1.31 0.00 0.00 100 T 8.79 4.60 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 1.23 0.00 0.00 101 Q 8.75 4.50 0.00 1.92 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.79 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 102 V 8.91 4.57 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 0.82 0.00 0.00 0.97 0.00 0.00 103 E 8.73 5.55 0.00 1.80 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 2.20 2.14 0.00 104 K 8.26 4.80 0.00 1.70 1.86 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.48 7.81 105 H 8.64 4.68 0.00 3.24 3.22 0.00 5.58 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 0.00 106 I 8.64 4.82 1.69 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 1.26 1.25 1.14 0.00 0.00 107 I 8.29 4.91 1.69 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 1.16 0.76 0.86 0.00 0.00 108 V 8.61 4.75 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 0.60 0.00 0.00 0.95 0.00 0.00 109 A 8.79 4.94 1.28 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 0.00 110 C 9.19 5.46 0.00 2.90 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 0.00 111 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 0.00 112 G 9.09 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 0.00 0.00 0.00 113 K 8.06 4.60 0.00 1.69 1.71 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.34 7.81 114 P 0.00 4.37 0.00 2.15 2.04 0.00 3.76 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 1.98 1.94 0.00 115 S 8.31 4.68 0.00 3.87 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 0.00 116 V 8.67 4.63 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 0.70 0.00 0.00 1.00 0.00 0.00 117 P 0.00 4.78 0.00 1.97 2.02 0.00 3.62 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 2.04 2.12 0.00 118 V 9.15 4.48 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 0.67 0.00 0.00 1.03 0.00 0.00 119 H 8.04 4.95 0.00 3.21 3.10 0.00 5.85 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 0.00 120 F 8.53 4.56 0.00 3.03 2.80 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 0.00 121 D 8.38 4.65 0.00 2.63 2.59 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 0.00 0.00 0.00 0.00 122 A 6.60 4.62 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 123 S 8.96 5.32 0.00 3.96 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 0.00 124 V 8.65 4.13 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 0.78 0.00 0.00 0.93 0.00 0.00