NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *10 C 4.5764 8.1876 117.6252 57.0203 28.7766 173.8004 11 P 4.2490 0.0000 0.0000 62.5122 32.3893 174.1470 12 L 5.0328 7.5018 122.6565 53.7203 45.2581 176.2081 13 M 4.9063 9.1913 125.4806 53.7009 36.2368 173.7201 14 V 4.8294 8.2909 124.0684 60.9093 34.8177 174.0642 15 K 4.9619 9.0668 128.4158 54.5695 35.5871 174.7711 16 V 4.8219 8.8279 126.4877 61.0812 34.7654 174.1080 17 L 5.0906 8.9105 127.0650 52.9233 45.7789 174.7780 18 D 5.2668 9.2218 121.6622 52.8546 42.5162 176.5190 19 A 4.3956 9.4514 128.4029 53.4131 18.9017 178.5530 20 V 3.8871 8.5652 114.7203 65.2628 32.0088 177.0912 21 R 4.2444 8.9554 116.5564 55.7049 31.0769 176.0729 22 G 3.8633 8.3128 105.7009 45.6126 0.0000 172.1149 23 S 4.7076 7.2333 111.8762 56.1826 67.2499 173.3625 24 P 4.5693 0.0000 0.0000 62.7592 31.7705 176.5038 25 A 4.3623 8.6343 125.4499 50.3869 19.3277 176.4209 26 I 4.2098 8.3806 122.5504 61.3126 38.9516 175.5369 27 N 4.1991 8.6526 122.6875 54.6113 37.8821 173.8591 28 V 4.0447 7.8024 116.7747 61.5363 32.8896 174.9660 29 A 4.5898 8.5777 129.8324 51.9159 20.0484 176.1336 30 V 4.7719 8.7713 121.2317 61.3969 35.1185 173.8432 31 H 5.1485 9.3076 124.8713 53.8885 31.8348 172.8989 32 V 4.8689 8.9609 123.5600 61.2090 34.0997 174.3926 33 F 5.5465 9.3907 124.8788 55.7645 43.5230 173.6402 34 R 4.7186 9.1342 121.5003 54.1713 32.8935 174.6289 35 K 4.0117 8.6087 128.0539 56.1553 32.7622 176.5182 36 A 4.4015 8.7559 129.5957 50.3498 20.6463 177.8592 37 A 3.7817 8.5871 121.8435 55.5131 18.3534 178.4636 38 D 4.5228 7.8413 112.0583 53.6142 39.4357 176.8877 39 D 4.4607 8.1099 118.9718 54.5341 39.5264 174.4903 40 T 4.1852 7.6422 110.0967 60.7524 70.8599 173.7540 41 W 4.9526 8.4503 122.8590 55.9868 30.2574 175.4925 42 E 4.9531 9.2241 124.6958 53.6620 31.7063 173.8780 43 P 4.3856 0.0000 0.0000 63.8467 31.5184 175.2511 44 F 4.8352 8.7198 123.9136 59.4724 41.7341 174.6619 45 A 4.4777 7.7387 116.7154 51.7782 22.1824 175.1971 46 S 4.5986 7.6931 112.9349 57.3880 65.8177 173.8606 47 G 3.8801 7.4398 106.8305 45.6408 0.0000 171.7457 48 K 5.1432 8.3178 117.6517 54.2748 35.6083 176.9078 49 T 4.2282 8.6985 114.8424 62.0141 70.2248 174.5651 50 S 4.9198 8.8238 119.0942 57.4719 65.1707 174.5075 51 E 3.9919 8.9218 118.5144 59.1061 29.1366 178.1443 52 S 4.3792 7.9824 111.7654 57.8798 63.6245 175.1160 53 G 3.8708 8.5711 110.4790 45.0829 0.0000 172.6654 54 E 5.0627 7.5720 117.5269 54.2320 33.0588 175.0703 55 L 4.8410 8.7018 124.0283 53.9645 44.6163 175.2061 56 H 4.8796 8.8625 123.0043 54.3932 31.6682 174.6246 57 G 3.8836 8.6865 105.5027 46.7168 0.0000 175.3208 58 L 3.9876 7.9571 121.8594 57.3961 41.7674 176.6629 59 T 4.4449 7.3141 110.1688 61.3009 70.6440 171.6342 60 T 4.6917 8.1970 114.8004 59.7913 71.5351 175.4722 61 E 4.1216 8.9688 118.2382 59.2547 29.8503 178.8428 62 E 4.2204 8.3507 119.0190 59.0735 29.7993 177.6726 63 E 4.3178 8.1211 116.5733 58.3716 30.2221 177.3148 64 F 4.9232 7.9797 122.7819 56.9913 37.6519 174.9483 65 V 4.0281 7.4257 117.2608 59.7736 33.0958 175.9972 66 E 4.1548 8.0249 120.3845 55.7178 30.0483 177.4369 67 G 3.7460 7.8033 108.3472 46.6894 0.0000 170.2668 68 I 4.8222 7.1640 119.9994 59.8344 39.1710 174.9761 69 Y 5.1753 8.6725 124.3647 55.8888 41.7390 174.4473 70 K 4.8046 8.9904 123.2220 54.5550 35.3069 174.7606 71 V 4.7357 9.2583 127.8631 61.4170 33.6122 173.8835 72 E 5.0149 9.5553 128.6422 54.7963 31.7864 175.0137 73 I 4.4250 8.7126 126.2053 59.5955 39.0992 175.9328 74 D 4.9456 8.8357 130.4711 53.3882 37.8225 177.2005 75 T 3.9081 7.7188 114.0781 64.2985 69.3703 176.6218 76 K 4.1213 7.7936 121.3870 59.7086 32.3125 179.0326 77 S 4.1704 8.1166 114.8649 61.4518 62.8923 175.7995 78 Y 3.9560 7.5498 121.1644 60.6775 38.4819 178.4376 79 W 4.4041 8.1549 119.6851 59.6637 29.1537 178.7240 80 K 4.0142 8.4849 118.4366 59.4692 31.2935 179.2044 81 A 4.0810 7.9433 119.7184 54.1524 18.3296 178.5567 82 L 4.4058 7.1122 114.5079 53.8589 42.0318 176.9588 83 G 3.9402 7.9877 106.8565 46.3676 0.0000 173.4994 84 I 4.4429 7.8438 119.7401 58.8409 39.4551 175.5530 85 S 4.3310 8.7228 120.1628 57.2892 62.3079 171.6068 86 P 4.7192 0.0000 0.0000 61.3524 33.3040 175.4235 87 F 3.9307 8.2693 121.5995 60.7124 39.5680 176.1783 88 H 4.4245 7.8213 115.6721 54.9526 30.0025 175.4724 89 E 4.0455 8.6338 122.1520 59.6488 29.5365 176.2901 90 H 4.9793 7.6835 110.1564 55.8647 31.4230 172.6838 91 A 4.4586 8.5472 120.5542 50.1873 21.0537 175.8390 92 E 5.1185 8.7507 119.9535 54.4540 33.1994 175.4977 93 V 4.5014 8.9796 123.8409 61.0973 34.4545 174.1855 94 V 5.0964 8.6208 127.6584 61.1265 33.8428 174.3183 95 F 5.1271 9.0157 121.4290 56.2321 41.7102 172.9325 96 T 4.9291 8.6914 116.5747 62.3653 69.6134 174.1659 97 A 4.5441 8.9451 129.0113 51.2512 20.1255 175.8196 98 N 5.1367 9.1436 120.0010 51.0383 41.6164 175.7122 99 D 4.5299 9.7353 128.7546 53.7717 39.7042 177.5756 *100 S 4.3119 7.6853 116.2258 57.7128 64.7156 177.5917 101 G 3.9414 8.3383 111.0670 43.8967 0.0000 171.6318 102 P 4.5411 0.0000 0.0000 62.6002 31.6905 176.7603 103 R 4.8465 8.5340 122.5967 54.6602 34.4560 174.2384 104 R 4.8420 9.4570 124.4157 54.7751 33.0926 173.9546 105 Y 4.9458 9.2799 123.6504 56.5999 40.5721 174.6228 106 T 4.8616 8.9670 122.0742 61.8947 71.1400 173.5030 107 I 4.6846 8.6994 128.3967 59.8224 38.9306 174.7363 108 A 5.3436 8.8202 129.0154 50.1197 22.1358 174.9445 109 A 5.1684 8.8579 121.0808 50.1316 23.3477 174.8950 110 L 4.9780 9.2717 124.0892 53.3951 44.5623 174.9657 111 L 5.3548 9.1571 127.2359 53.4933 43.9715 176.0051 112 S 5.1659 9.3933 118.5121 56.0255 67.1312 173.4831 113 P 3.1358 0.0000 0.0000 65.1113 31.0935 177.8533 114 Y 4.7066 7.7972 112.2738 57.2116 38.5819 175.0868 115 S 4.7921 7.9332 114.2190 57.6358 66.0030 172.7673 116 Y 5.4545 7.8351 118.5297 56.0487 40.9736 173.9879 117 S 4.9851 9.0852 116.4840 57.2971 66.3020 173.1216 118 T 5.1970 8.3519 115.7883 61.1113 70.6250 172.4475 119 T 4.8313 8.9565 120.3614 60.6544 71.7765 171.7989 120 A 5.1083 8.5188 125.9358 49.9685 21.6827 175.8614 121 V 4.1734 8.8095 122.7069 61.1167 33.8467 174.5454 122 V 4.7589 8.3544 128.5742 61.3080 33.1958 174.4609 123 T 4.7055 8.6616 117.3205 59.8664 72.9604 173.8342 124 N 4.5912 8.5372 119.0260 53.7403 39.1936 174.0631 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 *10 C 8.19 4.58 0.00 2.77 2.94 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 11 P 0.00 4.25 0.00 2.37 2.50 0.00 3.73 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 1.90 2.27 0.00 12 L 7.50 5.03 0.00 0.57 1.10 0.85 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 13 M 9.19 4.91 0.00 1.95 1.73 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 2.18 2.49 0.00 14 V 8.29 4.83 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 0.91 0.00 0.00 0.88 0.00 0.00 15 K 9.07 4.96 0.00 1.75 1.53 0.00 1.59 0.00 0.00 1.55 0.00 0.00 3.00 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.27 1.30 7.81 16 V 8.83 4.82 1.87 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 0.73 0.00 0.00 0.80 0.00 0.00 17 L 8.91 5.09 0.00 1.59 1.51 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 18 D 9.22 5.27 0.00 2.67 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 19 A 9.45 4.40 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 20 V 8.57 3.89 2.62 0.00 0.00 0.00 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 0.96 0.00 0.00 21 R 8.96 4.24 0.00 2.16 2.03 0.00 3.46 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.43 0.00 22 G 8.31 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 0.00 0.00 0.00 23 S 7.23 4.71 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 P 0.00 4.57 0.00 1.94 2.16 0.00 3.68 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 2.15 2.09 0.00 25 A 8.63 4.36 0.58 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 26 I 8.38 4.21 1.91 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.80 0.94 0.00 0.00 27 N 8.65 4.20 0.00 2.84 2.92 0.00 0.00 7.11 7.23 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 28 V 7.80 4.04 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 0.77 0.00 0.00 0.51 0.00 0.00 29 A 8.58 4.59 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 30 V 8.77 4.77 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 0.96 0.00 0.00 0.91 0.00 0.00 31 H 9.31 5.15 0.00 3.05 2.68 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 8.96 4.87 2.34 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 1.23 0.00 0.00 0.95 0.00 0.00 33 F 9.39 5.55 0.00 2.93 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 34 R 9.13 4.72 0.00 1.41 1.68 0.00 2.83 0.00 0.00 2.98 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.50 0.00 35 K 8.61 4.01 0.00 0.85 1.24 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.92 0.26 7.81 36 A 8.76 4.40 1.21 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 0.00 0.00 37 A 8.59 3.78 1.23 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 38 D 7.84 4.52 0.00 2.74 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.11 4.46 0.00 2.71 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 40 T 7.64 4.19 4.21 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 1.23 0.00 0.00 41 W 8.45 4.95 0.00 3.00 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 42 E 9.22 4.95 0.00 2.03 1.95 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 2.29 2.28 0.00 43 P 0.00 4.39 0.00 2.00 2.02 0.00 3.78 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.39 0.00 44 F 8.72 4.84 0.00 3.07 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 45 A 7.74 4.48 1.09 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 0.00 0.00 0.00 46 S 7.69 4.60 0.00 3.73 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 G 7.44 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 48 K 8.32 5.14 0.00 1.56 1.64 0.00 1.74 0.00 0.00 1.98 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.28 1.36 7.81 49 T 8.70 4.23 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 1.15 0.00 0.00 50 S 8.82 4.92 0.00 3.89 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 51 E 8.92 3.99 0.00 2.23 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 2.32 1.88 0.00 52 S 7.98 4.38 0.00 3.99 3.96 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 53 G 8.57 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 0.00 0.00 0.00 54 E 7.57 5.06 0.00 1.99 1.70 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 2.18 2.37 0.00 55 L 8.70 4.84 0.00 1.63 1.41 0.93 1.24 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 56 H 8.86 4.88 0.00 3.03 3.17 0.00 5.85 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 8.69 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 58 L 7.96 3.99 0.00 1.56 1.69 0.86 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 59 T 7.31 4.44 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 1.04 0.00 0.00 60 T 8.20 4.69 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 1.21 0.00 0.00 61 E 8.97 4.12 0.00 2.01 1.93 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 2.24 1.89 0.00 62 E 8.35 4.22 0.00 1.96 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 2.35 2.39 0.00 63 E 8.12 4.32 0.00 2.44 2.16 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 2.33 2.11 0.00 64 F 7.98 4.92 0.00 3.14 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 65 V 7.43 4.03 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 0.82 0.00 0.00 0.95 0.00 0.00 66 E 8.02 4.15 0.00 1.81 1.85 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 2.42 2.35 0.00 67 G 7.80 3.75 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 0.00 0.00 0.00 68 I 7.16 4.82 1.69 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.65 1.10 0.00 0.00 69 Y 8.67 5.18 0.00 1.77 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.99 4.80 0.00 0.79 0.74 0.00 0.63 0.00 0.00 1.22 0.00 0.00 2.18 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.08 0.95 7.81 71 V 9.26 4.74 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 1.02 0.00 0.00 1.15 0.00 0.00 72 E 9.56 5.01 0.00 2.16 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 2.10 2.25 0.00 73 I 8.71 4.42 1.72 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.63 0.76 0.00 0.00 74 D 8.84 4.95 0.00 2.76 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 75 T 7.72 3.91 4.44 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 1.13 0.00 0.00 76 K 7.79 4.12 0.00 2.29 1.90 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.54 7.81 77 S 8.12 4.17 0.00 3.94 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 78 Y 7.55 3.96 0.00 2.86 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 79 W 8.15 4.40 0.00 3.52 3.38 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 80 K 8.48 4.01 0.00 1.98 1.89 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.74 7.81 81 A 7.94 4.08 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 82 L 7.11 4.41 0.00 1.88 1.72 0.32 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 83 G 7.99 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 84 I 7.84 4.44 2.15 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.00 0.77 0.00 0.00 85 S 8.72 4.33 0.00 3.88 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 86 P 0.00 4.72 0.00 2.31 2.18 0.00 3.84 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.12 0.00 87 F 8.27 3.93 0.00 1.51 2.55 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 88 H 7.82 4.42 0.00 3.28 3.44 0.00 5.95 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 E 8.63 4.05 0.00 1.77 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 2.14 0.00 90 H 7.68 4.98 0.00 3.23 3.24 0.00 5.11 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 A 8.55 4.46 0.27 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 92 E 8.75 5.12 0.00 1.85 1.79 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 2.32 2.36 0.00 93 V 8.98 4.50 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 1.08 0.00 0.00 0.99 0.00 0.00 94 V 8.62 5.10 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 1.12 0.00 0.00 0.89 0.00 0.00 95 F 9.02 5.13 0.00 3.17 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 96 T 8.69 4.93 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 1.29 0.00 0.00 97 A 8.95 4.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 N 9.14 5.14 0.00 2.97 2.76 0.00 0.00 7.07 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 99 D 9.74 4.53 0.00 2.77 2.67 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 *100 S 7.69 4.31 0.00 3.61 3.71 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 0.00 101 G 8.34 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 0.00 102 P 0.00 4.54 0.00 1.96 2.03 0.00 3.66 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 2.03 2.13 0.00 103 R 8.53 4.85 0.00 1.86 1.45 0.00 3.28 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.19 0.00 104 R 9.46 4.84 0.00 1.89 1.70 0.00 3.16 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.44 0.00 105 Y 9.28 4.95 0.00 2.93 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 0.00 106 T 8.97 4.86 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 1.16 0.00 0.00 107 I 8.70 4.68 1.82 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.97 0.89 0.00 0.00 108 A 8.82 5.34 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 0.00 109 A 8.86 5.17 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 0.00 110 L 9.27 4.98 0.00 1.75 1.59 0.98 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 111 L 9.16 5.35 0.00 1.78 2.01 0.51 0.61 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 0.00 112 S 9.39 5.17 0.00 3.90 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.14 0.00 2.08 1.75 0.00 3.32 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.67 0.00 114 Y 7.80 4.71 0.00 2.76 2.81 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 0.00 115 S 7.93 4.79 0.00 3.92 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 0.00 116 Y 7.84 5.45 0.00 3.08 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 0.00 117 S 9.09 4.99 0.00 3.84 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 0.00 118 T 8.35 5.20 4.44 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 1.35 0.00 0.00 119 T 8.96 4.83 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 1.21 0.00 0.00 120 A 8.52 5.11 1.13 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 0.00 0.00 121 V 8.81 4.17 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 0.93 0.00 0.00 0.90 0.00 0.00 122 V 8.35 4.76 1.89 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 0.34 0.00 0.00 0.72 0.00 0.00 123 T 8.66 4.71 4.20 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 1.16 0.00 0.00 124 N 8.54 4.59 0.00 3.04 2.66 0.00 0.00 6.84 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.