NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 F 4.8492 8.3201 119.3621 57.2052 40.2856 174.6664 3 A 4.0006 8.9484 129.3746 54.1361 18.7956 175.7292 4 K 4.7624 9.1296 114.5415 53.1192 37.5752 174.0617 5 P 4.2239 0.0000 0.0000 65.7099 31.1155 178.6579 6 E 3.9057 8.1038 117.7227 59.1638 29.5355 178.4051 7 D 4.3164 8.2085 118.9881 57.0690 40.7387 178.4780 8 A 2.5800 7.3358 120.9819 54.2872 18.2406 179.8017 9 V 3.3125 7.2922 116.2264 66.1908 31.7063 178.3389 10 K 3.9449 7.9153 118.1349 59.3301 31.7396 178.7458 11 Y 3.8973 7.8619 120.0647 60.7397 38.7090 178.4800 12 R 3.8119 8.0845 117.1993 59.2199 29.4534 178.6767 13 Q 3.9590 8.0096 118.7320 58.9328 28.7318 179.0755 14 S 4.0364 7.9354 115.8297 61.3685 62.7596 176.5623 15 A 3.7822 7.9142 123.7653 55.1215 18.0659 179.7155 16 L 3.8738 7.9916 117.5776 58.1200 41.6607 179.8258 17 T 3.8727 7.9636 115.6617 66.8073 68.4723 176.7127 18 L 4.1258 8.1383 120.4243 57.1654 41.6619 178.8645 19 M 3.9433 8.2508 118.9178 58.9059 32.0931 178.1498 20 A 4.0810 8.2191 120.3563 55.3426 18.6512 179.2207 21 S 4.1074 8.0976 111.6806 62.3122 62.1321 176.3199 22 H 4.3001 8.2455 117.3527 58.3234 28.6706 177.4453 23 F 4.5681 8.3691 122.7835 61.3769 39.4352 177.7335 24 G 3.7735 8.9811 105.9060 47.4853 0.0000 175.4204 25 R 4.0752 7.9279 117.0940 58.6252 29.7470 177.9118 26 M 4.1884 8.0250 118.8231 56.4263 32.2225 177.9727 27 T 3.5069 7.6715 117.1660 66.3628 68.6764 174.4723 28 P 4.2227 0.0000 0.0000 65.1959 31.3112 178.9742 29 V 3.7538 7.4624 118.1877 65.5090 31.3812 178.0049 30 V 3.3226 7.1973 116.5812 65.7913 31.3299 177.5253 31 K 4.1632 7.8462 115.7937 56.7487 32.1879 178.1227 32 G 3.9441 7.7308 107.4546 45.5096 0.0000 174.6310 33 Q 4.0743 7.9072 118.3953 57.2941 29.1446 176.0168 34 A 4.8236 7.5357 120.0166 48.9848 22.1086 173.5818 35 P 4.4247 0.0000 0.0000 62.7788 32.4098 175.5493 36 Y 4.4651 8.4433 121.2986 56.6194 39.1087 174.0267 37 D 4.5357 8.1184 127.2096 52.0074 42.9016 175.7404 38 A 3.4934 7.7813 129.7286 55.1041 18.4445 178.7997 39 A 3.8766 7.8166 118.6613 55.0982 18.5298 179.3759 40 Q 3.8876 8.2839 118.0572 59.5858 29.0838 178.8212 41 I 3.8076 7.7707 120.7429 64.0464 37.1228 178.2482 42 K 3.9095 8.4142 120.6626 59.5696 32.0494 178.6725 43 A 4.3730 8.0227 122.2311 54.7417 18.2227 179.1513 44 N 4.3346 8.3161 115.6204 56.8739 39.0590 177.3593 45 V 3.6848 8.3154 120.0407 65.7837 31.4377 177.8390 46 E 4.0166 8.2769 118.7389 59.2843 29.2635 179.4633 47 V 3.5727 7.6693 117.7517 65.9521 31.5541 177.7564 48 L 4.0096 8.2334 120.3719 57.9312 41.6439 178.6282 49 K 3.8716 8.3343 119.0920 59.9714 32.2850 178.4825 50 T 4.0557 7.7160 115.1456 66.8317 68.4587 176.7148 51 L 4.0399 8.1398 121.0832 57.7070 41.4140 179.6038 52 S 4.5747 8.4367 113.0808 60.6459 63.0836 175.5025 53 A 4.6047 7.7306 123.1701 53.4590 18.6127 178.5565 54 L 4.3122 7.8692 117.8037 56.6875 42.0585 177.3665 55 P 4.0288 0.0000 0.0000 64.9189 31.0974 178.6988 56 W 4.9242 7.0177 117.7827 59.7806 29.0351 178.3358 57 A 4.2138 8.3470 120.1841 54.9742 17.6598 178.4754 58 A 4.4002 7.8573 115.9933 53.0130 18.6452 178.2918 59 F 5.1272 7.5180 116.9545 57.7999 40.2905 176.9274 60 G 4.1559 8.2876 107.8340 42.2429 0.0000 171.0724 61 P 4.4933 0.0000 0.0000 64.5248 31.6429 176.8964 62 G 3.9084 9.0686 110.3346 45.7548 0.0000 173.5490 63 T 4.3427 7.6760 108.7615 60.9877 69.2869 174.3176 64 E 2.0000 7.2466 121.7139 56.5168 29.8527 177.4433 65 G 3.5766 8.7273 108.5191 44.9019 0.0000 172.9705 66 G 3.8969 8.0860 109.2207 45.5648 0.0000 172.7095 67 D 4.6085 8.6955 116.7575 55.1466 41.7532 176.9176 68 A 4.3702 7.9717 121.3110 51.5213 19.2339 177.3010 69 R 4.2586 8.7950 119.8425 55.5323 30.8363 176.6658 70 P 4.9594 0.0000 0.0000 65.1158 31.4993 178.2087 71 E 4.7484 8.2079 119.6824 58.1763 29.2553 178.4309 72 I 2.6494 7.1461 120.7165 63.5038 36.6377 177.5404 73 W 4.4132 7.5911 117.1650 58.1874 30.3437 178.2786 74 S 4.4355 8.4038 114.0465 59.9422 63.7111 173.9157 75 D 5.0162 8.1768 121.6702 52.7317 41.3174 176.8527 76 A 4.2707 8.1701 124.2536 54.5900 18.8468 179.1896 77 A 3.9605 7.9540 118.9249 55.5635 18.4254 179.8281 78 S 4.4870 7.9694 114.0982 60.4962 63.0209 176.4461 79 F 3.5304 7.8976 123.5476 60.8543 38.9506 177.0053 80 K 3.7858 8.1432 119.3139 59.5120 32.1011 178.6485 81 Q 4.1211 8.0586 118.3185 58.9518 28.5386 179.1490 82 K 3.9262 7.6626 119.3898 58.9199 31.8399 179.0343 83 Q 3.1643 7.4361 120.0927 59.0181 28.8789 178.0427 84 Q 3.8705 8.1115 119.1348 59.0187 28.7961 179.1118 85 A 3.8985 7.8367 121.3606 55.1074 18.3940 179.4642 86 F 4.1367 7.8500 120.3272 61.1483 39.6231 177.4320 87 Q 3.5981 8.2955 117.9957 58.8222 28.2790 178.5408 88 D 4.3106 8.1612 120.1453 57.3231 40.8403 178.4986 89 N 4.3016 8.1165 117.0476 56.2460 38.3959 177.4393 90 I 3.5708 7.5139 121.3503 64.3026 37.1331 178.5323 91 V 3.5387 7.5455 118.5909 65.8615 31.3210 178.0257 92 K 3.9525 7.8448 119.2947 59.3288 31.9538 178.5742 93 L 4.0296 8.0603 120.6830 58.2352 41.9471 179.0591 94 S 4.1253 8.4663 115.2584 61.5805 62.7688 176.5488 95 A 3.9727 8.1398 123.1436 55.0791 17.9905 179.5520 96 A 3.9342 8.1871 119.0288 55.3296 18.2694 179.7705 97 A 4.0610 8.0943 118.3273 55.4902 18.5359 179.3797 98 D 4.4505 8.2904 116.4686 57.2257 40.9419 178.4990 99 A 4.2224 8.0448 120.7360 52.6794 18.4040 177.9090 100 G 4.2255 7.9178 104.6580 46.8277 0.0000 173.4169 101 D 5.0051 7.9012 119.2057 51.6900 43.6868 176.3606 102 L 3.3122 8.3359 126.2939 57.7090 42.2036 178.5221 103 D 4.2859 7.9464 118.7229 56.6740 39.2045 178.8014 104 K 3.9908 7.9208 119.7340 58.5699 32.0406 178.8964 105 L 3.9368 7.9012 120.6940 58.2505 41.9983 179.1408 106 R 3.8588 8.1456 117.9857 59.2753 30.0128 178.9500 107 A 3.9752 7.9574 119.9424 55.2651 18.3853 179.6398 108 A 4.1821 8.2673 119.4395 55.1014 18.3217 179.5878 109 F 4.3314 8.8953 119.9819 61.4982 39.4836 177.5763 110 G 3.7272 8.3901 105.3866 47.8760 0.0000 175.3102 111 D 4.3695 8.1748 121.3505 57.1126 40.8110 179.0526 112 V 3.6397 8.0535 118.8187 66.0441 31.5721 178.1608 113 G 3.4646 8.2882 105.4303 47.8170 0.0000 175.4094 114 A 4.0419 8.1144 123.2944 54.8769 17.8430 179.8890 115 S 4.1008 7.8170 112.9365 61.3880 63.2720 176.3905 116 C 3.7885 8.1590 120.7062 62.6118 27.8161 176.0162 117 K 3.8835 7.9874 120.6954 59.4421 31.5380 178.5566 118 A 3.9062 7.7407 120.0387 55.4114 18.5477 178.8759 119 C 4.1520 7.7731 117.2458 63.5742 31.7064 174.6807 120 H 4.2513 8.3759 120.2606 58.4944 29.2349 176.2536 121 D 4.4607 8.5306 124.9238 56.3666 41.2285 178.0924 122 A 3.9149 7.6915 120.3425 53.5004 18.9696 177.3366 123 Y 4.5904 8.0150 113.1413 57.6965 40.4975 175.4901 124 A 4.8607 7.5174 121.8577 50.2524 20.5882 176.9151 125 K 4.2842 8.4097 120.2582 55.9086 33.1160 177.6145 126 K 4.1911 8.4738 120.1601 57.0222 32.6992 176.0300 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 2 F 8.32 4.85 0.00 3.03 3.10 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 3 A 8.95 4.00 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 4 K 9.13 4.76 0.00 1.78 1.62 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.39 7.81 5 P 0.00 4.22 0.00 2.05 2.13 0.00 3.56 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 6 E 8.10 3.91 0.00 2.02 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 2.34 2.42 0.00 7 D 8.21 4.32 0.00 2.94 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 8 A 7.34 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 V 7.29 3.31 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 1.02 0.00 0.00 0.88 0.00 0.00 10 K 7.92 3.94 0.00 1.78 1.81 0.00 1.71 0.00 0.00 1.54 0.00 0.00 3.11 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.59 1.56 7.81 11 Y 7.86 3.90 0.00 3.00 2.64 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 12 R 8.08 3.81 0.00 1.63 1.81 0.00 2.21 0.00 0.00 2.76 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.14 0.00 13 Q 8.01 3.96 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.84 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 14 S 7.94 4.04 0.00 3.83 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 15 A 7.91 3.78 1.01 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 16 L 7.99 3.87 0.00 1.84 1.75 1.17 0.72 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 17 T 7.96 3.87 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 1.21 0.00 0.00 18 L 8.14 4.13 0.00 1.82 1.76 0.86 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 19 M 8.25 3.94 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.74 0.00 20 A 8.22 4.08 1.46 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 0.00 0.00 21 S 8.10 4.11 0.00 3.93 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 22 H 8.25 4.30 0.00 3.43 3.46 0.00 5.71 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 F 8.37 4.57 0.00 3.25 3.27 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 24 G 8.98 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 0.00 0.00 0.00 25 R 7.93 4.08 0.00 1.98 2.15 0.00 3.27 0.00 0.00 3.21 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.68 0.00 26 M 8.02 4.19 0.00 1.90 2.17 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.58 0.00 27 T 7.67 3.51 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 1.21 0.00 0.00 28 P 0.00 4.22 0.00 2.11 2.06 0.00 3.64 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 2.08 2.11 0.00 29 V 7.46 3.75 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 1.24 0.00 0.00 0.97 0.00 0.00 30 V 7.20 3.32 1.50 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 0.61 0.00 0.00 -0.01 0.00 0.00 31 K 7.85 4.16 0.00 1.71 1.80 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.49 7.81 32 G 7.73 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 33 Q 7.91 4.07 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.61 0.00 0.00 0.00 0.00 0.00 2.37 2.28 0.00 34 A 7.54 4.82 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 35 P 0.00 4.42 0.00 2.19 2.07 0.00 3.75 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 1.98 1.94 0.00 36 Y 8.44 4.47 0.00 2.98 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 D 8.12 4.54 0.00 2.60 2.39 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 38 A 7.78 3.49 1.14 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 0.00 0.00 39 A 7.82 3.88 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 40 Q 8.28 3.89 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 41 I 7.77 3.81 2.04 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 1.64 1.15 1.05 0.00 0.00 42 K 8.41 3.91 0.00 1.91 1.96 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.46 1.67 7.81 43 A 8.02 4.37 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 44 N 8.32 4.33 0.00 2.92 2.89 0.00 0.00 6.88 6.99 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 45 V 8.32 3.68 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 1.00 0.00 0.00 1.06 0.00 0.00 46 E 8.28 4.02 0.00 2.27 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 47 V 7.67 3.57 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 0.74 0.00 0.00 0.98 0.00 0.00 48 L 8.23 4.01 0.00 1.93 1.93 1.16 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 49 K 8.33 3.87 0.00 1.84 2.08 0.00 1.88 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.51 7.81 50 T 7.72 4.06 4.41 0.00 0.00 0.00 0.00 0.00 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 51 L 8.14 4.04 0.00 1.87 1.74 0.91 0.67 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 52 S 8.44 4.57 0.00 4.33 4.31 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 53 A 7.73 4.60 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.87 4.31 0.00 1.75 1.83 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 55 P 0.00 4.03 0.00 0.49 1.66 0.00 2.49 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 1.26 1.76 0.00 56 W 7.02 4.92 0.00 3.39 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.35 4.21 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.86 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 F 7.52 5.13 0.00 3.24 2.49 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 60 G 8.29 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 61 P 0.00 4.49 0.00 2.11 2.09 0.00 3.83 0.00 0.00 3.77 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 62 G 9.07 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 63 T 7.68 4.34 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 1.36 0.00 0.00 64 E 7.25 2.00 0.00 1.57 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 1.98 1.47 0.00 65 G 8.73 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.09 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 67 D 8.70 4.61 0.00 2.75 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 68 A 7.97 4.37 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.79 4.26 0.00 2.05 2.12 0.00 3.26 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.54 0.00 70 P 0.00 4.96 0.00 2.42 2.47 0.00 3.79 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.14 0.00 71 E 8.21 4.75 0.00 2.35 2.39 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 2.57 2.40 0.00 72 I 7.15 2.65 0.56 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.44 -1.10 0.00 0.00 73 W 7.59 4.41 0.00 3.42 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 74 S 8.40 4.44 0.00 4.13 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 0.00 75 D 8.18 5.02 0.00 2.93 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 0.00 76 A 8.17 4.27 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 77 A 7.95 3.96 1.33 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 0.00 0.00 0.00 78 S 7.97 4.49 0.00 4.13 4.04 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 79 F 7.90 3.53 0.00 2.35 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 80 K 8.14 3.79 0.00 1.89 1.91 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.46 7.81 81 Q 8.06 4.12 0.00 2.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.56 0.00 0.00 0.00 0.00 0.00 2.34 2.55 0.00 82 K 7.66 3.93 0.00 1.47 1.61 0.00 1.92 0.00 0.00 1.54 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.60 7.81 83 Q 7.44 3.16 0.00 1.25 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.74 0.00 0.00 0.00 0.00 0.00 2.02 1.16 0.00 84 Q 8.11 3.87 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 85 A 7.84 3.90 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 86 F 7.85 4.14 0.00 2.93 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 87 Q 8.30 3.60 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.44 2.57 0.00 88 D 8.16 4.31 0.00 2.82 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 89 N 8.12 4.30 0.00 2.77 2.79 0.00 0.00 7.01 6.76 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 90 I 7.51 3.57 1.70 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 0.58 0.15 0.83 0.00 0.00 91 V 7.55 3.54 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 0.98 0.00 0.00 0.92 0.00 0.00 92 K 7.84 3.95 0.00 1.80 1.93 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.45 7.81 93 L 8.06 4.03 0.00 1.87 1.86 1.11 1.00 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 94 S 8.47 4.13 0.00 4.06 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 95 A 8.14 3.97 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 96 A 8.19 3.93 1.42 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 97 A 8.09 4.06 1.42 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 98 D 8.29 4.45 0.00 2.68 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 99 A 8.04 4.22 1.40 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 0.00 100 G 7.92 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 0.00 101 D 7.90 5.01 0.00 2.66 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 0.00 102 L 8.34 3.31 0.00 1.04 1.42 0.36 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 103 D 7.95 4.29 0.00 2.87 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 0.00 104 K 7.92 3.99 0.00 1.81 1.90 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.48 7.81 105 L 7.90 3.94 0.00 1.74 1.60 0.98 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.15 3.86 0.00 1.98 1.95 0.00 3.06 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 107 A 7.96 3.98 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 0.00 108 A 8.27 4.18 1.43 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 0.00 0.00 109 F 8.90 4.33 0.00 3.20 3.22 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 0.00 110 G 8.39 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 0.00 0.00 0.00 111 D 8.17 4.37 0.00 2.93 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 0.00 112 V 8.05 3.64 2.23 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 0.80 0.00 0.00 0.95 0.00 0.00 113 G 8.29 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 0.00 0.00 0.00 114 A 8.11 4.04 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 0.00 115 S 7.82 4.10 0.00 4.02 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 0.00 116 C 8.16 3.79 0.00 2.94 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 0.00 117 K 7.99 3.88 0.00 1.80 1.92 0.00 1.63 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.44 7.81 118 A 7.74 3.91 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 0.00 119 C 7.77 4.15 0.00 2.71 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 0.00 120 H 8.38 4.25 0.00 3.39 3.26 0.00 5.85 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 0.00 121 D 8.53 4.46 0.00 2.74 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 0.00 122 A 7.69 3.91 0.55 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 0.00 0.00 0.00 123 Y 8.01 4.59 0.00 3.10 2.84 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 0.00 124 A 7.52 4.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 K 8.41 4.28 0.00 1.90 1.78 0.00 1.87 0.00 0.00 1.79 0.00 0.00 3.14 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.48 1.51 7.81 126 K 8.47 4.19 0.00 1.81 1.75 0.00 1.49 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.46 7.81