NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2010 8.2649 123.5815 51.4797 20.3012 176.7037 2 R 4.1958 7.6599 117.0017 53.8714 29.4627 170.8201 3 V 3.5508 8.6408 124.1665 62.6879 33.6464 176.3922 4 K 3.8385 7.9763 117.2091 56.4653 29.9854 176.7737 5 R 4.0674 8.0857 118.1575 58.9436 30.3629 178.3415 6 G 3.9092 7.8509 105.3534 48.8507 0.0000 175.0445 7 V 3.7512 7.9467 114.5558 63.8997 31.3690 178.1334 8 I 3.7889 7.6482 112.8945 64.1313 37.7578 177.7076 9 A 3.8813 8.6072 122.9037 55.4597 18.1256 179.2690 10 R 3.7284 7.9463 115.5542 59.5564 30.0853 178.7409 11 A 3.9265 7.5307 118.8783 55.0282 18.3632 179.3902 12 R 3.8497 8.2106 117.5280 60.0002 30.0852 178.2544 13 H 4.0955 8.0120 115.2121 58.9399 28.5415 177.6209 14 K 3.8499 7.7961 119.7724 59.8963 32.2910 177.7246 15 K 3.8376 8.2734 119.7782 60.1005 31.7245 178.5725 16 I 3.7089 7.6429 113.1182 63.8821 37.8800 177.7679 17 L 4.0495 8.0945 121.0785 56.6970 42.7191 177.6978 18 K 4.3927 7.5936 120.3805 55.8305 31.6109 178.6386 19 Q 4.1764 7.4221 120.2344 54.4336 27.4172 177.1866 20 A 3.6911 7.2999 120.8400 54.4168 20.4252 179.7621 21 K 4.1692 7.8444 114.1479 57.5658 32.6524 179.3262 22 G 4.3579 8.4706 105.6555 44.6897 0.0000 175.5133 23 Y 3.7394 7.2841 113.9823 57.5362 39.0779 170.3220 24 Y 4.8080 8.4390 115.9459 58.8648 43.0025 173.6473 25 G 3.3439 7.7268 115.4510 45.9737 0.0000 175.3982 26 A 3.9208 8.5025 122.7161 55.2386 18.2989 179.4529 27 R 4.2096 7.7668 111.7375 57.8919 30.0251 176.8035 28 S 4.5099 8.3253 113.9598 60.1981 67.2522 176.3857 29 R 3.8587 7.5440 118.3335 59.2494 30.1386 177.6145 30 V 3.9871 7.5150 117.3862 62.0744 32.0838 176.2697 31 Y 4.3385 8.7565 127.4710 60.0415 37.6884 177.8111 32 R 3.5939 8.3127 116.6616 59.1201 28.3546 177.6818 33 V 3.2886 7.5391 115.2117 63.5414 33.2665 181.2508 34 A 3.3790 7.7097 113.3694 49.2439 21.1140 180.2140 35 F 3.9998 9.3418 122.3273 61.0845 38.9944 175.7299 36 Q 4.2126 7.2467 116.0203 57.7292 29.2935 176.4643 37 A 4.4833 8.8892 120.6374 53.9371 20.3718 179.1094 38 V 3.6724 7.8010 116.9791 65.2383 31.0717 178.4881 39 I 3.6348 7.9221 120.4576 64.0116 36.8629 178.3440 40 K 3.6318 7.8199 118.6471 59.2369 31.8503 178.7474 41 A 4.1112 8.2621 121.4667 55.4425 18.3026 180.0200 42 G 3.6195 7.8746 103.7422 47.9107 0.0000 175.9321 43 Q 4.0294 8.0866 120.3050 59.1952 28.3929 178.1639 44 Y 4.5903 8.8976 118.3309 60.9196 37.7281 179.0613 45 A 4.0574 8.0802 121.9822 55.2713 18.5451 178.6569 46 Y 4.0080 7.8383 116.7260 60.7815 39.0065 178.1898 47 R 4.0088 7.6986 117.7788 59.0964 30.5130 177.7568 48 D 4.3270 7.5875 117.7317 58.2211 40.5885 178.3570 49 R 3.8545 7.6059 117.6736 59.5511 29.9374 178.0496 50 R 3.9639 7.5909 118.5035 58.7216 30.3855 178.5640 51 Q 3.8807 8.0492 119.7263 59.1194 29.1757 177.5504 52 R 3.7152 8.0351 119.8011 59.0776 29.4743 178.2213 53 K 3.9809 7.5288 118.5279 59.4490 31.8845 178.6915 54 R 4.0469 8.0191 115.6416 58.4912 30.0765 178.3299 55 Q 3.5227 7.8086 119.7094 59.1028 28.6237 178.3621 56 F 4.2590 7.7628 118.3122 59.8662 38.9562 177.9524 57 R 4.7017 7.4640 118.2895 59.7321 29.4905 178.3488 58 Q 4.0030 9.0403 120.4917 58.7861 28.8017 178.2620 59 L 3.9287 7.3736 120.0895 57.9077 42.1884 178.2292 60 W 4.5949 8.9516 120.0944 60.4448 29.0444 178.6133 61 I 3.5099 8.3509 112.2543 63.9149 36.6934 178.0165 62 A 3.9110 7.6666 122.2454 54.7414 18.2888 179.4394 63 R 4.1637 8.3168 114.3417 58.7940 30.1368 178.9713 64 I 3.7743 8.6004 121.3498 64.1987 36.9527 177.9141 65 N 4.6298 8.6946 118.2578 56.6065 38.6681 176.6879 66 A 4.1317 7.6076 118.8450 53.7422 18.5713 178.6128 67 A 4.3442 7.7472 118.8415 54.3863 19.6096 179.3236 68 A 3.8956 8.2190 117.9698 55.1212 18.2315 179.6735 69 R 4.5019 7.8920 116.1248 58.5313 29.5039 178.5238 70 Q 4.0825 7.7522 119.8546 57.7661 30.0868 175.8850 71 N 4.9034 7.3578 115.3793 51.4127 37.1528 172.6778 72 G 3.9049 8.1221 109.5406 46.7848 0.0000 168.4938 73 I 3.1011 8.1292 130.2495 60.7061 37.3149 174.1915 74 S 4.9654 8.2191 120.2257 57.1931 65.9246 174.0142 75 Y 4.3128 8.7291 121.3218 61.3304 37.9516 178.2785 76 S 4.1796 8.2045 114.6989 61.5365 63.4789 176.2043 77 K 4.2030 7.9556 120.5497 59.4041 31.9878 177.7751 78 F 4.4052 9.1308 119.8391 61.7372 38.9453 176.5269 79 I 3.1890 6.9814 120.0243 64.4158 37.1912 177.7878 80 N 4.3437 7.5037 116.0476 56.4693 39.0875 176.9567 81 G 3.6832 8.2810 107.3149 47.9833 0.0000 175.6117 82 L 3.9218 7.8337 120.1964 57.2108 41.5442 178.9363 83 K 4.0332 7.9697 119.2074 58.2375 32.1231 177.0472 84 K 4.1116 7.6741 118.8347 55.8457 32.1772 176.3656 85 A 4.5002 7.7532 128.2371 52.1476 21.1352 176.2819 86 S 4.3399 8.6639 116.7511 60.9987 63.2480 175.9081 87 V 4.2608 7.4416 114.9926 62.4703 33.4448 174.3783 88 E 3.9672 8.3176 118.2792 57.7262 28.8579 175.8710 89 I 4.0807 7.7159 124.2376 60.0714 39.6876 173.2486 90 D 4.2209 8.5235 119.0778 53.9745 41.0959 176.2677 91 R 4.2002 8.3334 126.4221 55.9594 31.6780 178.4332 92 K 4.4021 7.9037 123.0756 54.6505 31.2335 179.9571 93 I 2.0000 7.0242 113.9574 61.5321 38.7290 174.7159 94 L 4.1069 7.4150 123.7082 58.0416 41.0473 178.4269 95 A 4.1179 8.3438 123.1671 54.4987 18.5962 178.4367 96 D 4.6745 8.3088 113.2372 54.9178 41.1965 177.6430 97 I 2.0000 7.7558 121.2168 64.1120 37.2042 177.6892 98 A 3.6338 7.1989 121.5911 54.7625 18.1251 179.1649 99 V 3.9055 7.6516 108.9023 62.8346 32.0266 177.1316 100 F 4.7351 6.8971 111.3938 57.9638 40.6295 176.8562 101 D 4.7830 7.0714 120.3838 51.3862 37.9724 176.6104 102 K 3.8371 7.7332 125.4165 60.7518 32.7894 178.8116 103 V 3.6096 7.9562 113.2821 63.7628 31.2425 178.2313 104 A 3.9899 7.8524 118.4683 55.1325 18.6401 178.8621 105 F 4.2360 8.5149 119.4593 61.9286 39.2323 177.3425 106 T 3.8309 8.6775 112.3434 64.4025 66.8887 174.9837 107 A 5.0382 7.7771 121.9169 52.1530 18.9512 177.7495 108 L 4.3911 8.0725 118.5757 55.5556 42.8417 178.2057 109 V 3.2067 6.9010 110.5389 63.8292 31.5740 178.0344 110 E 3.7177 7.9161 118.3105 58.7614 29.3027 178.2937 111 K 4.1575 7.4580 117.4750 57.8162 32.4155 176.3893 112 A 4.5574 7.5229 119.2163 54.3048 21.1512 177.9657 113 K 3.7674 8.7435 116.0342 59.6214 32.1549 177.9362 114 A 4.1545 7.7818 119.1017 53.9724 18.8380 178.5592 115 A 4.0413 7.8697 118.4438 54.8643 18.6984 177.7488 116 L 3.8400 8.3403 116.3314 54.9939 41.8586 177.3593 117 A 4.1606 8.8124 125.6346 52.7717 18.1499 176.8440 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 A 8.26 4.20 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 2 R 7.66 4.20 0.00 1.86 1.89 0.00 3.21 0.00 0.00 3.18 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 3 V 8.64 3.55 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 0.79 0.00 0.00 0.92 0.00 0.00 4 K 7.98 3.84 0.00 1.97 1.77 0.00 1.62 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.49 7.81 5 R 8.09 4.07 0.00 1.86 1.99 0.00 3.20 0.00 0.00 3.32 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 6 G 7.85 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 7 V 7.95 3.75 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 1.00 0.00 0.00 1.00 0.00 0.00 8 I 7.65 3.79 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.02 0.91 0.00 0.00 9 A 8.61 3.88 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 10 R 7.95 3.73 0.00 1.91 2.07 0.00 3.09 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 11 A 7.53 3.93 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 12 R 8.21 3.85 0.00 2.09 2.00 0.00 3.20 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 1.71 1.82 0.00 13 H 8.01 4.10 0.00 3.14 3.25 0.00 5.88 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 14 K 7.80 3.85 0.00 1.86 2.03 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.46 7.81 15 K 8.27 3.84 0.00 2.00 2.04 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.47 7.81 16 I 7.64 3.71 1.81 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.88 0.83 0.00 0.00 17 L 8.09 4.05 0.00 1.93 1.77 1.05 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.59 4.39 0.00 2.05 1.85 0.00 1.83 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.45 7.81 19 Q 7.42 4.18 0.00 1.71 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.36 0.00 0.00 0.00 0.00 0.00 2.39 2.00 0.00 20 A 7.30 3.69 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 21 K 7.84 4.17 0.00 1.90 2.16 0.00 1.89 0.00 0.00 1.90 0.00 0.00 3.06 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.63 1.64 7.81 22 G 8.47 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 0.00 0.00 0.00 0.00 23 Y 7.28 3.74 0.00 3.13 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 24 Y 8.44 4.81 0.00 3.00 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 25 G 7.73 3.34 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 26 A 8.50 3.92 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 27 R 7.77 4.21 0.00 2.25 2.25 0.00 3.31 0.00 0.00 3.47 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.74 0.00 28 S 8.33 4.51 0.00 3.79 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 29 R 7.54 3.86 0.00 1.80 1.99 0.00 3.31 0.00 0.00 3.14 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 30 V 7.51 3.99 2.22 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 1.02 0.00 0.00 0.93 0.00 0.00 31 Y 8.76 4.34 0.00 3.07 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 32 R 8.31 3.59 0.00 2.04 2.21 0.00 3.07 0.00 0.00 3.37 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 33 V 7.54 3.29 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 0.76 0.00 0.00 1.01 0.00 0.00 34 A 7.71 3.38 0.81 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 0.00 0.00 35 F 9.34 4.00 0.00 2.89 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 36 Q 7.25 4.21 0.00 2.40 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 37 A 8.89 4.48 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 38 V 7.80 3.67 2.02 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 0.64 0.00 0.00 0.90 0.00 0.00 39 I 7.92 3.63 1.86 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.55 0.90 0.00 0.00 40 K 7.82 3.63 0.00 1.72 1.42 0.00 0.61 0.00 0.00 1.14 0.00 0.00 2.70 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.29 1.15 7.81 41 A 8.26 4.11 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 42 G 7.87 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 8.09 4.03 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.58 0.00 44 Y 8.90 4.59 0.00 2.98 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 45 A 8.08 4.06 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 46 Y 7.84 4.01 0.00 3.11 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 47 R 7.70 4.01 0.00 2.15 1.92 0.00 3.24 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 48 D 7.59 4.33 0.00 2.91 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 49 R 7.61 3.85 0.00 1.71 1.77 0.00 3.32 0.00 0.00 3.16 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 50 R 7.59 3.96 0.00 1.74 1.74 0.00 3.13 0.00 0.00 3.17 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 51 Q 8.05 3.88 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.53 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 52 R 8.04 3.72 0.00 2.08 1.86 0.00 2.93 0.00 0.00 2.91 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.98 0.00 53 K 7.53 3.98 0.00 1.86 1.97 0.00 1.69 0.00 0.00 1.90 0.00 0.00 3.13 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.61 7.81 54 R 8.02 4.05 0.00 2.06 2.18 0.00 2.77 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.57 0.00 55 Q 7.81 3.52 0.00 1.93 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.08 2.28 0.00 56 F 7.76 4.26 0.00 2.63 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 0.00 0.00 0.00 0.00 57 R 7.46 4.70 0.00 2.19 2.22 0.00 3.31 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.00 0.00 58 Q 9.04 4.00 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.62 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 59 L 7.37 3.93 0.00 1.79 1.63 0.90 0.96 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 60 W 8.95 4.59 0.00 3.61 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 61 I 8.35 3.51 0.93 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.91 1.18 0.00 0.00 62 A 7.67 3.91 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 R 8.32 4.16 0.00 2.03 2.20 0.00 2.93 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.88 0.00 64 I 8.60 3.77 2.22 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.24 1.45 0.00 0.00 65 N 8.69 4.63 0.00 2.90 3.04 0.00 0.00 7.06 7.22 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 66 A 7.61 4.13 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 67 A 7.75 4.34 1.10 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 0.00 0.00 68 A 8.22 3.90 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 69 R 7.89 4.50 0.00 2.02 2.28 0.00 3.09 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.51 0.00 70 Q 7.75 4.08 0.00 2.04 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.38 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 71 N 7.36 4.90 0.00 2.75 2.74 0.00 0.00 6.97 6.66 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 72 G 8.12 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 73 I 8.13 3.10 1.79 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 1.46 0.73 0.88 0.00 0.00 74 S 8.22 4.97 0.00 4.14 4.06 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 75 Y 8.73 4.31 0.00 3.14 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 76 S 8.20 4.18 0.00 3.96 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 77 K 7.96 4.20 0.00 1.93 1.87 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.52 7.81 78 F 9.13 4.41 0.00 3.06 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 79 I 6.98 3.19 1.59 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 -0.36 0.70 0.00 0.00 80 N 7.50 4.34 0.00 2.95 2.98 0.00 0.00 7.17 7.86 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 81 G 8.28 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 L 7.83 3.92 0.00 1.51 1.55 -0.28 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 83 K 7.97 4.03 0.00 1.85 1.80 0.00 1.74 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.43 7.81 84 K 7.67 4.11 0.00 1.90 1.73 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.41 7.81 85 A 7.75 4.50 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 86 S 8.66 4.34 0.00 3.86 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 87 V 7.44 4.26 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 0.82 0.00 0.00 0.92 0.00 0.00 88 E 8.32 3.97 0.00 1.96 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 0.00 2.30 2.28 0.00 89 I 7.72 4.08 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.42 0.94 0.00 0.00 90 D 8.52 4.22 0.00 2.63 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 91 R 8.33 4.20 0.00 1.73 1.80 0.00 3.36 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.52 0.00 92 K 7.90 4.40 0.00 1.85 1.21 0.00 1.48 0.00 0.00 1.33 0.00 0.00 2.44 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.94 1.33 7.81 93 I 7.02 2.00 0.56 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 1.23 0.97 0.54 0.00 0.00 94 L 7.41 4.11 0.00 1.87 1.79 0.88 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.34 4.12 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 96 D 8.31 4.67 0.00 3.07 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 97 I 7.76 2.00 1.92 0.00 0.00 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 1.41 1.16 0.89 0.00 0.00 98 A 7.20 3.63 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.65 3.91 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 0.86 0.00 0.00 1.25 0.00 0.00 100 F 6.90 4.74 0.00 3.19 3.14 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 0.00 101 D 7.07 4.78 0.00 3.04 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 0.00 102 K 7.73 3.84 0.00 2.00 2.07 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.53 7.81 103 V 7.96 3.61 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 0.96 0.00 0.00 104 A 7.85 3.99 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 F 8.51 4.24 0.00 3.01 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 0.00 106 T 8.68 3.83 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 1.28 0.00 0.00 107 A 7.78 5.04 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 0.00 108 L 8.07 4.39 0.00 1.86 1.59 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 109 V 6.90 3.21 1.62 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 0.04 0.00 0.00 0.77 0.00 0.00 110 E 7.92 3.72 0.00 1.96 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 2.35 2.28 0.00 111 K 7.46 4.16 0.00 1.79 2.01 0.00 1.90 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.45 7.81 112 A 7.52 4.56 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 0.00 113 K 8.74 3.77 0.00 1.69 1.84 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.38 7.81 114 A 7.78 4.15 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 0.00 115 A 7.87 4.04 1.31 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 0.00 0.00 116 L 8.34 3.84 0.00 1.75 1.67 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 117 A 8.81 4.16 1.24 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 0.00 0.00