NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 H 4.6665 8.4293 120.3941 55.3298 30.4872 174.8557 6 E 4.5343 8.8920 109.7783 52.5796 32.3090 174.4883 7 T 4.2574 9.0759 111.5755 61.4139 71.9409 176.6004 8 D 4.4570 8.5284 120.8643 57.3167 40.7224 178.9648 9 E 4.0521 8.1440 118.9657 59.4806 29.6241 178.9907 10 E 3.9993 8.1547 118.2237 59.1522 29.3881 179.1897 11 F 4.1852 8.3455 120.7339 61.5057 39.5587 176.7611 12 D 4.4611 8.5503 118.3140 57.3896 40.6733 178.7195 13 A 4.0080 8.2645 121.1258 55.4404 18.5008 179.5980 14 R 3.7561 7.9112 116.3748 59.5448 30.1071 179.3081 15 W 3.9137 7.8060 118.0676 59.2660 29.2018 178.9715 16 V 3.8106 8.1180 118.4350 66.3284 30.7764 178.1775 17 T 3.8777 8.2383 114.7443 66.6955 68.2001 175.5481 18 Y 3.9330 7.6802 121.1636 60.8802 38.6093 178.3167 19 F 4.6357 8.0384 116.3088 59.7758 39.2091 176.7890 20 N 4.7701 7.8634 114.4015 52.9731 38.8923 174.9814 21 K 3.7737 7.2489 121.6312 56.1914 32.5604 174.8117 22 P 4.2525 0.0000 0.0000 65.8039 31.2446 177.8979 23 D 4.8135 7.7249 114.6711 53.1898 40.0672 176.2225 24 I 3.8400 7.3686 120.5379 62.0533 38.5900 175.8107 25 D 4.8136 8.4835 127.8607 51.9959 42.3753 177.3990 26 A 4.0576 8.4578 120.3979 55.0249 18.2950 179.3942 27 W 4.0679 8.3885 126.3175 60.9158 30.8866 177.9193 28 E 4.4542 9.5561 118.7999 59.1856 28.8077 179.2832 29 L 4.2768 8.0560 120.5622 58.3831 42.2823 179.1808 30 R 3.8847 8.2213 118.2421 59.0370 29.9559 178.8232 31 K 3.5948 8.1973 119.7930 59.3353 31.9766 178.8831 32 G 3.8832 8.3787 105.7287 48.3703 0.0000 175.6144 33 M 4.1663 8.3916 121.7896 58.1016 31.7941 178.7174 34 N 4.3316 8.3996 115.9310 56.3916 38.8930 177.4219 35 T 3.9583 8.0758 117.4066 66.4333 68.5587 176.7460 36 L 3.8145 8.0099 122.5823 57.8831 41.7383 178.5297 37 V 4.1120 7.3888 109.5044 61.8650 31.5628 177.5638 38 G 3.6415 7.5612 106.1250 45.2845 0.0000 174.1091 39 Y 4.5028 6.5794 118.4023 57.6441 39.0912 175.7380 40 D 4.6408 8.2771 122.7718 51.0809 39.7249 175.0255 41 L 4.2949 7.0184 119.1481 55.0896 42.8275 174.5415 42 V 4.2256 8.2346 119.8388 60.4547 32.6126 174.1115 43 P 4.4826 0.0000 0.0000 62.2096 32.0290 176.1410 44 E 4.1973 8.7367 120.8234 56.0444 30.2957 176.3895 45 P 4.2368 0.0000 0.0000 65.8176 31.1876 179.1250 46 K 4.1604 8.1018 116.9843 59.8907 32.4089 179.2167 47 I 3.9565 8.0880 121.3765 64.1968 37.1032 178.1824 48 I 3.5855 7.7422 120.2038 64.3797 36.9156 177.3182 49 D 4.2822 8.7095 118.8130 57.7083 41.0957 178.2649 50 A 4.0541 7.9886 120.4018 55.3436 18.5221 179.5205 51 A 3.5254 7.8898 119.1486 54.9459 18.2920 179.8974 52 L 3.8777 8.0759 117.8542 57.9857 41.5972 179.9478 53 R 3.9371 8.0622 117.8628 59.1892 30.1030 179.0007 54 A 4.0450 7.9261 120.4084 55.2459 18.3432 179.4972 55 C 4.1236 7.9042 115.1227 62.7589 28.1165 176.1573 56 R 3.8648 7.8956 120.2919 59.7349 29.5735 178.8635 57 R 4.1399 8.1664 116.4684 58.4651 30.0592 177.9908 58 L 4.5178 7.4919 116.0641 53.1310 42.4170 175.7933 59 N 4.2120 8.3172 115.7955 54.8253 36.6938 175.0968 60 D 4.8594 8.2048 117.5999 52.0536 41.2698 174.8967 61 F 4.2191 8.5927 126.0929 60.6816 40.3767 176.8403 62 A 3.9179 8.5151 122.0649 55.7111 17.9862 179.7480 63 S 4.0054 8.5309 112.8923 61.4282 62.6293 176.8862 64 A 3.8393 7.6568 123.8867 54.9180 18.0401 179.8845 65 V 3.3596 7.0828 116.3443 65.9404 31.7101 178.0435 66 R 4.6113 7.8892 119.8978 59.0793 29.9969 178.5599 67 I 3.6802 7.8504 119.6610 64.2799 37.1485 178.4433 68 L 4.1181 7.5805 120.0372 57.6429 41.4460 179.2380 69 E 3.8473 8.1801 118.9560 59.3407 29.3633 179.7973 70 V 3.5849 7.8541 119.1824 64.8115 31.1763 178.6343 71 V 3.6605 7.4880 117.6614 65.4397 31.7212 177.7121 72 K 3.9791 7.8229 119.1853 59.2368 31.8940 178.2067 73 D 4.2426 8.0716 118.3790 57.5306 40.9681 178.4241 74 K 3.8822 8.2238 117.3921 59.2835 32.4064 178.4534 75 A 4.2538 8.1919 119.8844 50.8451 18.6285 179.1786 76 G 3.8377 8.6099 106.2472 46.2295 0.0000 175.4897 77 P 4.3699 0.0000 0.0000 64.7884 31.8473 176.8302 78 H 4.6055 7.8318 117.9496 54.5377 26.4538 175.8716 79 K 4.0879 8.1783 121.9099 58.4458 32.2057 177.6776 80 E 4.4272 8.0875 115.6028 56.8381 30.7028 178.2746 81 I 3.7267 8.0317 122.1285 64.6501 37.3421 177.1271 82 Y 4.2695 8.1011 119.7983 60.5601 38.6625 176.0796 83 P 4.1026 0.0000 0.0000 65.9979 31.3665 177.9362 84 Y 4.0438 7.6590 117.7705 60.5277 38.7104 178.0436 85 V 3.3261 7.9275 119.2605 65.9655 31.4507 178.0477 86 I 3.4409 7.6034 118.7460 64.0944 36.9842 177.7461 87 Q 3.9798 7.7256 120.3199 59.4774 28.6951 178.6400 88 E 3.8895 7.7220 117.5122 58.2361 29.7050 178.2436 89 L 4.4436 7.3279 117.5864 54.1835 42.1288 177.8516 90 R 3.8204 7.5254 120.6881 59.1813 29.8888 176.4240 91 P 4.2230 0.0000 0.0000 66.0228 31.3925 178.7671 92 T 3.9100 7.7971 113.9413 66.5792 68.4162 176.6227 93 L 4.0048 8.4548 121.2990 57.7415 41.1197 179.4551 94 N 4.3087 8.2973 116.4005 56.2689 38.3594 176.8543 95 E 3.9541 8.2512 119.6601 59.3929 29.8110 178.3977 96 L 4.4067 8.0596 116.0732 54.3427 42.1601 177.0677 97 G 3.7583 7.7004 105.5344 46.4944 0.0000 173.8768 98 I 4.4605 7.8229 121.7240 60.0392 36.9972 176.2834 99 S 4.6745 8.9258 122.4969 57.9648 64.0219 175.2954 100 T 4.2463 8.9171 115.2799 60.8064 70.7521 173.8945 101 P 4.2740 0.0000 0.0000 66.0362 31.2020 178.7601 102 E 4.1523 8.1848 116.5038 59.7153 29.3601 179.1252 103 E 3.9926 7.7076 115.5535 58.7761 29.5586 178.4542 104 L 4.5649 7.6012 116.1529 53.7409 42.3371 177.2177 105 G 3.9486 8.2075 107.9558 46.1374 0.0000 175.6187 106 L 4.1222 8.0182 119.8324 56.1618 41.7779 177.5045 107 D 4.6019 8.0026 116.8226 53.1702 40.0872 176.0390 108 K 4.4779 7.2421 119.6859 55.4101 34.2032 176.9875 109 V 3.8001 8.2725 114.4854 61.7456 31.5386 176.0058 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 5 H 8.43 4.67 0.00 3.12 2.90 0.00 5.73 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.89 4.53 0.00 2.38 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 2.30 2.50 0.00 7 T 9.08 4.26 4.45 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 1.23 0.00 0.00 8 D 8.53 4.46 0.00 2.74 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 9 E 8.14 4.05 0.00 2.09 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 2.43 2.50 0.00 10 E 8.15 4.00 0.00 2.24 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 2.35 2.35 0.00 11 F 8.35 4.19 0.00 3.20 3.21 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 0.00 0.00 0.00 0.00 12 D 8.55 4.46 0.00 3.04 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 13 A 8.26 4.01 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 14 R 7.91 3.76 0.00 1.81 1.57 0.00 2.93 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.80 0.00 15 W 7.81 3.91 0.00 3.14 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 16 V 8.12 3.81 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 1.10 0.00 0.00 1.14 0.00 0.00 17 T 8.24 3.88 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 1.17 0.00 0.00 18 Y 7.68 3.93 0.00 2.74 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 19 F 8.04 4.64 0.00 3.30 3.21 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 0.00 0.00 0.00 0.00 20 N 7.86 4.77 0.00 3.04 2.89 0.00 0.00 6.89 6.92 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 21 K 7.25 3.77 0.00 1.67 1.58 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.38 1.34 7.81 22 P 0.00 4.25 0.00 2.07 2.13 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 23 D 7.72 4.81 0.00 2.77 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 24 I 7.37 3.84 1.89 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.86 1.01 0.00 0.00 25 D 8.48 4.81 0.00 3.05 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 26 A 8.46 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 27 W 8.39 4.07 0.00 3.45 3.41 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 28 E 9.56 4.45 0.00 2.25 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 2.79 3.01 0.00 29 L 8.06 4.28 0.00 1.91 1.96 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.22 3.88 0.00 1.81 1.84 0.00 3.16 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 31 K 8.20 3.59 0.00 0.79 1.64 0.00 1.15 0.00 0.00 1.20 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.26 1.39 7.81 32 G 8.38 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 33 M 8.39 4.17 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.73 0.00 34 N 8.40 4.33 0.00 2.64 2.81 0.00 0.00 7.12 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 35 T 8.08 3.96 4.57 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 1.36 0.00 0.00 36 L 8.01 3.81 0.00 1.01 1.58 0.05 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 37 V 7.39 4.11 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 0.72 0.00 0.00 0.95 0.00 0.00 38 G 7.56 3.64 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 39 Y 6.58 4.50 0.00 2.92 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 40 D 8.28 4.64 0.00 2.64 2.57 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 41 L 7.02 4.29 0.00 1.67 1.48 0.98 0.17 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 42 V 8.23 4.23 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 0.90 0.00 0.00 0.96 0.00 0.00 43 P 0.00 4.48 0.00 2.09 1.98 0.00 3.76 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 2.00 2.10 0.00 44 E 8.74 4.20 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 2.49 2.75 0.00 45 P 0.00 4.24 0.00 2.13 2.03 0.00 3.68 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.21 0.00 46 K 8.10 4.16 0.00 2.03 2.11 0.00 1.57 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.56 1.61 7.81 47 I 8.09 3.96 2.06 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 1.72 0.63 1.17 0.00 0.00 48 I 7.74 3.59 1.98 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.96 0.86 0.00 0.00 49 D 8.71 4.28 0.00 2.79 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 50 A 7.99 4.05 1.55 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 51 A 7.89 3.53 0.53 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 0.00 0.00 52 L 8.08 3.88 0.00 1.83 1.68 0.87 1.12 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 53 R 8.06 3.94 0.00 2.07 2.00 0.00 3.15 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 54 A 7.93 4.05 1.55 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 55 C 7.90 4.12 0.00 3.24 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 56 R 7.90 3.86 0.00 1.96 2.13 0.00 3.19 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 57 R 8.17 4.14 0.00 1.96 2.01 0.00 3.21 0.00 0.00 3.24 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 58 L 7.49 4.52 0.00 1.87 1.72 0.98 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.32 4.21 0.00 2.82 2.90 0.00 0.00 6.64 7.73 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 60 D 8.20 4.86 0.00 2.58 2.57 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 61 F 8.59 4.22 0.00 3.16 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 62 A 8.52 3.92 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 63 S 8.53 4.01 0.00 3.97 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 64 A 7.66 3.84 1.16 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 65 V 7.08 3.36 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 0.97 0.00 0.00 0.44 0.00 0.00 66 R 7.89 4.61 0.00 1.89 1.98 0.00 3.30 0.00 0.00 3.24 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.52 0.00 67 I 7.85 3.68 1.92 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.91 0.81 0.00 0.00 68 L 7.58 4.12 0.00 1.82 1.90 0.93 0.90 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 69 E 8.18 3.85 0.00 2.15 1.91 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 2.25 2.42 0.00 70 V 7.85 3.58 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 0.96 0.00 0.00 0.88 0.00 0.00 71 V 7.49 3.66 2.31 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 0.94 0.00 0.00 1.01 0.00 0.00 72 K 7.82 3.98 0.00 0.83 1.53 0.00 0.61 0.00 0.00 1.09 0.00 0.00 2.75 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.18 1.09 7.81 73 D 8.07 4.24 0.00 2.76 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 74 K 8.22 3.88 0.00 1.87 1.88 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.60 1.60 7.81 75 A 8.19 4.25 1.49 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 0.00 0.00 76 G 8.61 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 0.00 0.00 0.00 77 P 0.00 4.37 0.00 2.08 2.12 0.00 3.93 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 1.62 1.84 0.00 78 H 7.83 4.61 0.00 3.35 3.28 0.00 5.63 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.18 4.09 0.00 1.77 1.92 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.65 1.39 7.81 80 E 8.09 4.43 0.00 2.13 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 0.00 2.33 2.25 0.00 81 I 8.03 3.73 1.95 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 1.39 1.04 0.99 0.00 0.00 82 Y 8.10 4.27 0.00 2.92 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 83 P 0.00 4.10 0.00 2.25 2.13 0.00 3.84 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 84 Y 7.66 4.04 0.00 3.05 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 85 V 7.93 3.33 2.19 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 0.96 0.00 0.00 1.20 0.00 0.00 86 I 7.60 3.44 1.46 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.09 0.16 0.72 0.00 0.00 87 Q 7.73 3.98 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.13 2.30 0.00 88 E 7.72 3.89 0.00 1.79 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 1.52 1.57 0.00 89 L 7.33 4.44 0.00 1.60 1.60 0.86 0.74 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 90 R 7.53 3.82 0.00 2.03 1.89 0.00 3.23 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 91 P 0.00 4.22 0.00 2.17 2.06 0.00 3.65 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 2.07 2.15 0.00 92 T 7.80 3.91 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 1.20 0.00 0.00 93 L 8.45 4.00 0.00 1.75 1.87 0.86 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 94 N 8.30 4.31 0.00 2.95 2.85 0.00 0.00 6.63 7.28 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 95 E 8.25 3.95 0.00 2.00 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 0.00 2.34 2.37 0.00 96 L 8.06 4.41 0.00 1.69 1.74 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 97 G 7.70 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 0.00 0.00 0.00 98 I 7.82 4.46 1.90 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.68 0.86 0.00 0.00 99 S 8.93 4.67 0.00 4.08 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 0.00 100 T 8.92 4.25 4.48 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 1.22 0.00 0.00 101 P 0.00 4.27 0.00 2.18 2.14 0.00 3.76 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 2.13 2.20 0.00 102 E 8.18 4.15 0.00 2.12 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 2.50 2.75 0.00 103 E 7.71 3.99 0.00 2.25 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 0.00 2.38 2.40 0.00 104 L 7.60 4.56 0.00 1.70 1.77 1.20 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.21 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 0.00 106 L 8.02 4.12 0.00 1.84 1.73 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 107 D 8.00 4.60 0.00 2.75 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 0.00 108 K 7.24 4.48 0.00 2.01 1.84 0.00 1.60 0.00 0.00 1.71 0.00 0.00 3.20 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.39 7.81 109 V 8.27 3.80 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 0.66 0.00 0.00 0.92 0.00 0.00