NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.3286 8.1749 110.9402 61.3572 70.9582 174.2610 4 R 3.9656 7.8448 120.4744 53.9086 30.7853 174.3736 5 T 4.4680 8.0212 111.9959 58.8885 70.6344 172.1048 6 P 4.3531 0.0000 0.0000 62.3388 32.0166 175.7030 7 K 4.3505 8.3468 121.1753 55.1539 32.7576 176.3274 8 L 4.5233 8.4030 126.4199 54.6468 43.5029 175.8507 9 V 4.4895 8.7154 122.0590 61.0034 34.0763 174.0690 10 K 4.7197 8.6322 129.7670 54.9016 34.3092 174.1263 11 H 5.4744 9.1497 127.7471 54.1779 32.0498 172.8056 12 T 5.0471 8.6818 123.2519 61.6503 71.2554 173.0033 13 L 5.3219 9.1406 128.8307 53.2812 44.8786 174.8029 14 L 5.4825 9.1276 126.7518 53.2763 44.4760 175.6588 15 T 5.3714 9.3307 112.5223 60.0228 72.8599 172.5228 16 R 4.8531 8.3312 121.7451 54.5933 33.3887 174.0864 17 F 4.9580 8.6763 123.8794 55.7879 40.8153 175.8190 18 K 3.8767 8.8748 122.3219 57.0845 32.4807 177.7775 19 D 4.4406 9.0419 123.7015 57.4821 40.8935 177.8031 20 E 4.2001 8.0281 114.6032 57.5605 30.2777 176.8802 21 I 3.9420 7.6288 122.1727 61.2968 37.8974 176.4553 22 T 4.3642 8.2176 115.4703 60.6350 71.4003 175.5946 23 R 3.8495 8.5469 121.8471 59.9389 29.9238 178.3814 24 E 3.9396 8.1395 117.4269 59.6852 29.4702 179.2805 25 Q 3.9387 7.9410 117.6587 58.9808 28.6958 178.9905 26 I 3.6143 7.7062 120.7913 64.4712 37.0789 178.2776 27 D 4.3473 8.3712 120.0408 57.3425 40.6340 178.6570 28 N 4.2645 8.1604 116.9897 56.6126 38.4364 177.1559 29 Y 4.3655 8.1213 118.2711 61.1806 37.8589 178.7103 30 I 3.7315 8.2052 121.0773 64.2422 37.0862 178.2285 31 N 4.3203 8.1825 117.5072 56.4863 38.1714 177.1973 32 D 4.3181 8.0021 119.1229 57.2295 41.0913 178.1271 33 Y 2.9966 7.7131 120.0851 60.6228 38.8506 177.6352 34 T 3.2604 7.6965 116.8811 66.7343 68.6380 175.7908 35 N 4.2539 8.1395 118.3877 56.5332 38.7863 176.7277 36 L 3.9674 7.6609 120.4054 57.3698 41.3344 179.0270 37 L 3.9182 7.2625 118.1130 58.1001 41.6769 178.8369 38 D 4.4365 7.6509 115.8525 57.1427 41.2897 177.7136 39 L 4.5174 7.7041 117.1042 55.1003 42.4984 176.6745 40 I 4.4796 7.6691 119.5776 58.4578 38.2476 174.1385 41 P 4.3514 0.0000 0.0000 65.2194 31.3955 178.4907 42 S 4.3424 8.0676 111.4139 60.3731 63.4974 174.1399 43 M 3.7534 7.9415 122.0417 55.3578 32.3495 175.5550 44 K 4.4632 8.5309 125.8059 57.9567 33.8445 176.6709 45 S 4.6633 7.3309 112.0156 57.2732 66.4591 173.3590 46 F 5.3034 8.5081 122.2703 56.9081 42.0737 173.2656 47 N 5.0916 8.5236 122.3947 51.3977 43.1270 173.2139 48 W 5.2713 7.8105 116.9005 55.8278 31.9146 173.5247 49 G 3.7351 8.4374 106.0724 46.0806 0.0000 172.1319 50 T 5.1628 8.1475 108.7540 59.1346 72.0337 173.2367 51 D 4.3565 8.5294 122.2274 55.3371 41.0274 177.0343 52 L 4.0694 8.8431 125.3855 55.4656 42.1086 177.6508 53 G 3.8971 8.7361 106.9696 46.7103 0.0000 174.3569 54 M 4.3137 8.0516 118.4896 55.1152 33.0052 176.0672 55 E 4.5322 7.7320 117.6343 54.0147 31.9768 175.4355 56 S 4.0752 8.4886 114.0157 58.7220 62.7251 175.1152 57 A 4.0781 8.7299 130.0201 55.2649 18.5258 179.1893 58 E 4.1666 8.1118 113.8298 59.0964 29.5980 179.0998 59 L 4.0998 7.6767 119.6356 57.3253 42.0035 178.2658 60 N 4.5855 8.2365 115.2948 53.0014 37.4917 175.1753 61 R 3.9107 9.0104 119.4371 57.4779 28.2539 177.6424 62 G 3.8937 8.4800 105.3354 45.7815 0.0000 174.3458 63 Y 4.3384 7.8069 118.2747 58.2255 38.6425 175.4362 64 T 4.6310 9.2907 114.1731 62.2575 71.6878 173.9140 65 H 5.5587 8.4678 117.8519 53.6639 32.8837 172.4962 66 A 5.1071 8.7128 123.2358 50.1049 22.3017 175.0321 67 F 5.0502 9.3726 120.3569 55.7853 42.8254 173.8467 68 E 4.9974 9.2453 124.4192 54.6931 31.7811 175.2234 69 S 5.2156 9.1081 121.3493 56.9818 65.9328 173.3308 70 T 4.8864 8.2718 121.2512 61.8564 70.9752 173.6748 71 F 5.0642 9.0096 123.0021 55.8637 43.4055 175.5410 72 E 4.3749 8.9534 118.4229 57.0119 30.1644 176.9321 73 S 4.7104 7.4100 112.3060 56.4112 66.2869 176.8280 74 K 3.7930 8.3531 122.6529 59.6583 31.7774 179.6511 75 S 4.1862 8.1316 114.1701 61.4571 63.0040 176.7184 76 G 3.6122 8.2463 109.5011 47.3607 0.0000 175.5095 77 L 2.4829 7.5784 122.7620 57.3925 42.0027 178.8698 78 Q 3.8502 8.0478 119.7703 58.8744 28.7395 177.5499 79 E 3.8884 7.9982 119.5785 59.5192 29.9509 177.8200 80 Y 4.2885 7.7409 118.8994 60.9816 38.6386 178.2821 81 L 3.8986 8.0061 118.6165 57.3423 41.7794 178.2926 82 D 4.6293 7.8672 116.2667 53.4405 41.8027 176.8884 83 S 4.3329 7.2354 115.5550 57.4998 64.2712 175.2360 84 A 3.9415 8.6359 124.0894 55.3201 18.0364 180.0347 85 A 3.8945 7.8671 118.7791 55.2650 18.4472 179.4817 86 L 3.8053 7.8282 118.6464 58.1393 42.1985 179.0223 87 A 3.9163 7.8892 120.1758 55.0284 18.0497 179.4443 88 A 3.9582 8.0108 118.6996 55.1070 18.7035 179.4833 89 F 4.2910 8.0737 118.7325 61.5003 39.5947 177.4403 90 A 3.6716 8.2235 120.6531 54.7827 17.8036 178.9794 91 E 3.8775 7.7946 117.2742 59.4374 29.7175 178.7846 92 G 4.0166 7.6974 104.4718 45.8435 0.0000 175.3361 93 F 3.3521 7.4554 122.8294 60.7883 39.3689 177.3837 94 L 3.6388 7.5186 118.5701 57.1829 41.2053 177.5359 95 P 4.3420 0.0000 0.0000 64.4678 31.5206 177.7625 96 T 4.1137 7.6379 108.4788 61.8501 69.1398 174.0020 97 L 4.5777 6.8762 122.6944 53.6325 42.7757 176.6532 98 S 4.4744 8.5292 117.9742 59.9006 64.3971 174.4496 99 Q 4.5939 7.6426 118.3587 54.2192 33.2389 174.1202 100 R 5.1708 8.5579 122.2908 55.1048 33.3161 173.6807 101 L 4.8512 9.2452 128.1530 53.2212 45.3619 175.0039 102 V 5.0088 8.5364 125.2946 61.1503 34.4382 174.3595 103 I 4.7570 8.8031 126.8557 59.5918 41.5791 173.1939 104 D 5.6352 8.7331 128.4385 52.9862 43.9634 174.6346 105 Y 4.8789 7.9785 118.2577 55.6153 41.5541 174.0773 106 F 4.4725 8.5139 120.4242 58.1082 39.8058 175.8336 107 L 4.5279 8.5138 123.4357 53.8093 40.3653 176.6840 108 Y 4.5502 8.0666 119.5776 58.1549 37.9577 175.7709 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 3 T 8.17 4.33 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 4 R 7.84 3.97 0.00 1.92 1.91 0.00 3.17 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 5 T 8.02 4.47 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 1.22 0.00 0.00 6 P 0.00 4.35 0.00 2.25 2.14 0.00 3.77 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 7 K 8.35 4.35 0.00 1.64 1.64 0.00 1.92 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.04 1.49 7.81 8 L 8.40 4.52 0.00 1.67 1.56 0.91 0.85 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 9 V 8.72 4.49 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 0.75 0.00 0.00 0.50 0.00 0.00 10 K 8.63 4.72 0.00 1.54 0.74 0.00 1.45 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.08 0.92 7.81 11 H 9.15 5.47 0.00 3.24 3.42 0.00 5.63 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 T 8.68 5.05 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 1.28 0.00 0.00 13 L 9.14 5.32 0.00 1.98 1.95 1.16 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 14 L 9.13 5.48 0.00 1.04 1.28 0.54 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 15 T 9.33 5.37 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 1.47 0.00 0.00 16 R 8.33 4.85 0.00 1.77 1.57 0.00 3.18 0.00 0.00 3.06 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 17 F 8.68 4.96 0.00 3.02 2.97 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 18 K 8.87 3.88 0.00 1.72 1.97 0.00 1.76 0.00 0.00 1.78 0.00 0.00 2.76 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.44 1.48 7.81 19 D 9.04 4.44 0.00 2.67 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 20 E 8.03 4.20 0.00 2.08 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 0.00 2.29 2.28 0.00 21 I 7.63 3.94 2.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.08 0.90 0.00 0.00 22 T 8.22 4.36 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 1.22 0.00 0.00 23 R 8.55 3.85 0.00 1.91 2.00 0.00 3.33 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 24 E 8.14 3.94 0.00 2.08 1.96 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 2.39 2.46 0.00 25 Q 7.94 3.94 0.00 2.31 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 26 I 7.71 3.61 1.80 0.00 0.00 0.45 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 0.22 0.56 0.00 0.00 27 D 8.37 4.35 0.00 2.80 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 28 N 8.16 4.26 0.00 2.69 2.63 0.00 0.00 7.03 7.08 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 29 Y 8.12 4.37 0.00 3.43 3.20 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 0.00 0.00 0.00 0.00 30 I 8.21 3.73 1.70 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.91 0.11 0.00 0.00 31 N 8.18 4.32 0.00 2.91 2.85 0.00 0.00 6.98 8.19 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 32 D 8.00 4.32 0.00 3.06 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 33 Y 7.71 3.00 0.00 2.54 2.51 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 34 T 7.70 3.26 4.35 0.00 0.00 0.00 0.00 0.00 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 35 N 8.14 4.25 0.00 2.89 2.92 0.00 0.00 7.25 6.26 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 36 L 7.66 3.97 0.00 1.66 1.72 0.70 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.26 3.92 0.00 1.78 1.71 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 38 D 7.65 4.44 0.00 2.66 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 39 L 7.70 4.52 0.00 1.64 1.69 0.89 0.73 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 40 I 7.67 4.48 2.15 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.94 1.20 0.00 0.00 41 P 0.00 4.35 0.00 2.07 2.14 0.00 3.72 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 42 S 8.07 4.34 0.00 4.15 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 43 M 7.94 3.75 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.30 0.00 44 K 8.53 4.46 0.00 1.56 1.76 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.48 7.81 45 S 7.33 4.66 0.00 3.80 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 46 F 8.51 5.30 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 47 N 8.52 5.09 0.00 2.44 2.41 0.00 0.00 6.11 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 48 W 7.81 5.27 0.00 3.21 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 49 G 8.44 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 0.00 0.00 0.00 50 T 8.15 5.16 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 1.27 0.00 0.00 51 D 8.53 4.36 0.00 2.76 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 52 L 8.84 4.07 0.00 1.66 1.68 0.88 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 53 G 8.74 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 54 M 8.05 4.31 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.53 0.00 55 E 7.73 4.53 0.00 1.95 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 2.24 2.22 0.00 56 S 8.49 4.08 0.00 3.85 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 57 A 8.73 4.08 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 58 E 8.11 4.17 0.00 2.19 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 0.00 2.37 2.35 0.00 59 L 7.68 4.10 0.00 1.78 1.79 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.24 4.59 0.00 3.14 3.12 0.00 0.00 6.33 7.66 0.00 0.00 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 R 9.01 3.91 0.00 2.30 2.18 0.00 3.43 0.00 0.00 3.41 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.81 0.00 62 G 8.48 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 63 Y 7.81 4.34 0.00 3.16 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 64 T 9.29 4.63 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 1.36 0.00 0.00 65 H 8.47 5.56 0.00 3.27 2.96 0.00 5.56 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.71 5.11 1.15 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 0.00 0.00 67 F 9.37 5.05 0.00 3.28 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 68 E 9.25 5.00 0.00 1.82 1.75 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 2.22 2.20 0.00 69 S 9.11 5.22 0.00 3.78 3.42 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 70 T 8.27 4.89 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 1.11 0.00 0.00 71 F 9.01 5.06 0.00 2.89 2.86 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 72 E 8.95 4.37 0.00 2.01 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 2.30 2.30 0.00 73 S 7.41 4.71 0.00 4.05 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 74 K 8.35 3.79 0.00 1.83 1.85 0.00 1.71 0.00 0.00 1.97 0.00 0.00 3.11 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.28 1.41 7.81 75 S 8.13 4.19 0.00 4.05 4.13 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 76 G 8.25 3.61 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 0.00 0.00 0.00 77 L 7.58 2.48 0.00 1.14 1.50 0.39 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 8.05 3.85 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.54 0.00 0.00 0.00 0.00 0.00 2.33 2.54 0.00 79 E 8.00 3.89 0.00 2.25 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 0.00 2.36 2.34 0.00 80 Y 7.74 4.29 0.00 3.17 2.79 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 0.00 0.00 0.00 0.00 81 L 8.01 3.90 0.00 1.74 1.68 0.89 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.87 4.63 0.00 2.62 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 7.24 4.33 0.00 3.99 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 84 A 8.64 3.94 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 85 A 7.87 3.89 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 L 7.83 3.81 0.00 1.25 1.37 0.81 0.80 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 87 A 7.89 3.92 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 88 A 8.01 3.96 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 89 F 8.07 4.29 0.00 2.89 3.08 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 0.00 0.00 0.00 0.00 90 A 8.22 3.67 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 91 E 7.79 3.88 0.00 2.11 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 2.31 2.31 0.00 92 G 7.70 4.02 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 0.00 0.00 0.00 93 F 7.46 3.35 0.00 1.59 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 0.00 0.00 0.00 0.00 94 L 7.52 3.64 0.00 1.67 1.54 0.85 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.34 0.00 1.93 2.03 0.00 3.48 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 96 T 7.64 4.11 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 1.16 0.00 0.00 97 L 6.88 4.58 0.00 1.44 1.53 0.58 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 98 S 8.53 4.47 0.00 3.79 3.93 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 99 Q 7.64 4.59 0.00 1.66 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.87 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 100 R 8.56 5.17 0.00 1.73 1.76 0.00 3.23 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 101 L 9.25 4.85 0.00 1.62 1.06 0.72 0.41 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 0.00 102 V 8.54 5.01 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 0.90 0.00 0.00 1.02 0.00 0.00 103 I 8.80 4.76 1.92 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.38 1.02 0.00 0.00 104 D 8.73 5.64 0.00 2.59 2.42 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 0.00 105 Y 7.98 4.88 0.00 3.02 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 0.00 106 F 8.51 4.47 0.00 1.93 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 0.00 0.00 0.00 0.00 107 L 8.51 4.53 0.00 1.57 1.69 0.91 0.91 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 0.00 108 Y 8.07 4.55 0.00 3.06 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