NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 M 4.2535 8.1585 120.3061 55.4594 34.3235 177.1694 12 A 4.0655 7.9298 121.5165 54.0749 18.0207 175.9543 13 E 3.8916 8.3736 116.9231 59.9079 29.9441 178.1879 14 V 3.6255 7.6639 117.3605 65.9944 31.2973 177.7242 15 E 3.9373 8.1342 118.5386 59.2799 28.7974 178.9057 16 E 3.9511 8.6033 119.8679 59.4740 29.6693 178.9082 17 T 3.8241 7.7990 115.6580 66.1256 68.6456 177.0803 18 L 4.0490 8.2721 121.4770 57.4137 41.6687 179.5487 19 K 3.8999 8.0353 118.5805 59.6479 31.8567 179.4041 20 R 3.9406 7.3053 117.0360 59.1542 30.3166 178.3506 21 L 4.1207 7.9276 118.9363 57.9670 41.5673 179.3032 22 Q 4.0709 8.4072 117.8110 58.5466 29.0187 177.4400 23 S 4.3057 7.7954 113.2279 59.1278 61.5702 173.7138 24 Q 4.5241 7.1895 119.4080 54.1309 30.2252 174.6849 25 K 4.2563 8.2753 121.1612 56.5654 33.2763 175.5472 26 G 3.8287 9.1019 117.3608 46.1112 0.0000 174.4805 27 V 4.1422 7.1266 118.7946 62.9568 31.8583 175.5710 28 Q 4.3403 9.2372 126.4756 55.5699 29.9617 176.3275 29 G 4.4497 6.7984 109.1383 46.0903 0.0000 171.6148 30 I 5.1489 7.7637 122.6793 59.3270 40.3703 174.6483 31 I 4.8958 8.6048 127.6537 59.4982 40.5672 174.9700 32 V 4.8180 9.0461 125.2072 61.3228 34.6280 174.1900 33 V 4.9795 8.5770 127.8335 61.2243 34.6537 175.4363 34 N 4.9758 8.6510 124.9030 51.7532 39.2824 175.7194 35 T 3.9912 8.3172 107.2077 64.5540 68.9825 175.4453 36 E 4.0319 8.1905 120.9733 57.6329 29.7332 177.5438 37 G 4.0536 8.0161 104.9288 45.0453 0.0000 173.5828 38 I 4.1316 8.2447 122.3663 59.5609 37.9210 174.0420 39 P 5.5545 0.0000 0.0000 61.6859 29.3581 175.3120 40 I 3.8886 8.0922 120.4968 64.7545 37.9855 176.4472 41 K 4.6601 7.6231 119.0018 55.3988 36.4695 174.9375 42 S 5.4326 8.4570 114.9924 58.8675 64.6175 174.8470 43 T 4.5352 8.5685 113.4982 62.0238 70.7230 174.1165 44 M 4.1953 7.3538 120.2394 54.7653 32.8452 175.6024 45 D 4.5236 8.1550 117.9235 54.1205 43.3038 176.4391 46 N 4.2564 8.5352 120.4836 56.4165 38.5395 175.2408 47 P 4.3411 0.0000 0.0000 65.8949 31.5886 178.2975 48 T 3.9680 7.7353 115.2459 66.2036 68.4293 176.9900 49 T 3.8372 8.1137 118.1472 66.9412 68.6057 176.9801 50 T 3.9389 7.8214 117.6376 66.7443 68.4501 176.4749 51 Q 3.9829 7.8759 120.2635 59.5755 29.2242 177.7039 52 Y 4.1251 8.2867 117.4626 60.7872 37.8362 178.3403 53 A 4.0649 8.5749 122.2754 55.5753 18.4990 179.9520 54 S 4.0980 7.6945 112.5904 61.4716 62.8542 176.2899 55 L 3.8633 8.1448 122.0055 58.6824 42.0072 178.6954 56 M 4.0712 8.2391 118.4357 58.7808 31.5712 178.1305 57 H 3.4956 7.9699 117.7518 59.4296 29.8973 176.9795 58 S 4.2648 8.6452 114.9315 60.5737 62.1020 175.7621 59 F 4.2823 8.0905 123.8467 61.6400 39.2557 177.2803 60 I 3.4066 7.3351 118.5666 63.7247 37.0152 178.1158 61 L 3.9680 7.2465 120.5118 57.5864 41.5698 178.8675 62 K 3.9437 8.4315 119.8141 59.5236 32.3440 178.6996 63 A 3.8436 7.8753 121.1576 54.9608 18.1183 179.3994 64 R 3.6966 7.6535 116.7612 59.8710 30.0024 178.6699 65 S 4.1265 7.4118 110.4043 61.5508 62.4532 176.1283 66 T 4.0731 7.4619 118.2065 66.3921 68.3427 176.9180 67 V 3.5898 8.2117 120.4825 66.2345 30.9161 178.1426 68 R 3.9065 7.8677 117.1171 59.0962 29.5844 178.2235 69 D 4.1295 8.1759 117.4473 56.8175 41.3220 178.0159 70 I 3.8568 7.7383 119.8104 63.3803 37.2391 175.4767 71 D 4.5026 6.5689 116.0666 52.9531 45.3357 174.4648 72 P 4.2944 0.0000 0.0000 65.6443 31.4496 177.1326 73 Q 4.4338 7.7781 121.0447 53.3810 28.2248 173.8769 74 N 5.1321 8.0372 119.4114 51.9759 42.7190 172.9619 75 D 4.7451 8.2112 118.8969 53.0082 44.9036 174.8835 76 L 4.6449 8.2427 122.1127 54.0207 43.0923 177.4031 77 T 4.5610 7.8280 115.0755 61.8128 68.5564 172.4266 78 F 4.2663 7.8475 118.0386 57.2187 42.4748 173.3257 79 L 4.4982 8.2522 128.3930 54.5550 44.1800 174.2351 80 R 5.1103 8.7403 124.9545 54.6188 33.1455 176.8683 81 I 4.4759 8.1128 114.8668 59.2303 38.7083 172.9583 82 R 3.9063 8.5430 128.8203 57.6616 30.4882 175.5211 83 S 4.7601 7.8198 124.7005 57.2204 65.2597 173.9885 84 K 4.2431 8.4422 118.6611 58.7254 32.5529 178.6607 85 K 4.1915 8.0661 117.5836 57.8632 32.3499 176.0556 86 N 4.7166 7.4916 113.3733 52.1210 40.4737 172.3951 87 E 4.6323 8.6727 118.4202 55.3349 31.6714 175.1763 88 I 4.5432 8.2629 124.6236 59.6079 39.0346 174.8677 89 M 4.3673 9.1319 128.7182 55.0847 33.2971 176.1643 90 V 5.2643 8.7885 122.1235 61.2600 35.2673 173.3156 91 A 4.9682 8.3724 127.5643 49.7398 22.8952 173.1809 92 P 4.6585 0.0000 0.0000 63.1913 32.0730 175.5233 93 D 4.7780 7.7006 124.5153 51.9875 43.7001 174.9252 94 K 3.9231 8.0416 117.5211 59.7289 31.8654 178.6231 95 D 4.7127 7.2429 112.7820 53.8781 41.1063 173.4729 96 Y 4.8613 7.0333 116.7694 56.2345 42.4640 173.3444 97 F 5.0658 9.4705 118.1880 55.5735 41.6663 174.9722 98 L 4.5421 8.3402 127.0435 54.8868 43.6938 175.8661 99 I 4.7724 8.7058 125.6976 59.8143 40.9336 174.5101 100 V 4.5422 8.9417 128.9026 61.2707 33.5301 174.2475 101 I 5.1079 8.0798 129.6732 59.8141 39.7127 175.0851 102 Q 4.9112 8.6788 123.1184 55.2505 32.2651 172.9236 103 N 4.8281 8.7019 117.8367 52.7138 39.2708 173.7832 104 P 4.4884 0.0000 0.0000 63.1589 32.1965 176.1195 105 T 4.3548 8.2574 109.3758 62.7632 70.6207 173.9603 106 E 4.0808 8.2876 126.0586 56.4302 29.5193 176.1434 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 11 M 8.16 4.25 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.36 0.00 12 A 7.93 4.07 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 13 E 8.37 3.89 0.00 2.02 2.05 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 2.42 2.41 0.00 14 V 7.66 3.63 2.09 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 1.10 0.00 0.00 0.76 0.00 0.00 15 E 8.13 3.94 0.00 2.24 1.97 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 2.30 2.41 0.00 16 E 8.60 3.95 0.00 2.15 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 2.31 2.50 0.00 17 T 7.80 3.82 4.26 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 0.00 0.00 0.00 1.24 0.00 0.00 18 L 8.27 4.05 0.00 1.89 1.71 0.96 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.04 3.90 0.00 1.93 1.86 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.64 7.81 20 R 7.31 3.94 0.00 1.70 1.97 0.00 3.32 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 21 L 7.93 4.12 0.00 2.07 1.70 1.01 0.76 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 22 Q 8.41 4.07 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.99 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 23 S 7.80 4.31 0.00 4.08 4.01 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 24 Q 7.19 4.52 0.00 2.31 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.81 0.00 0.00 0.00 0.00 0.00 2.51 2.32 0.00 25 K 8.28 4.26 0.00 1.74 1.75 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.42 1.43 7.81 26 G 9.10 3.83 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 0.00 0.00 0.00 27 V 7.13 4.14 2.17 0.00 0.00 0.00 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 0.93 0.00 0.00 28 Q 9.24 4.34 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.94 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 29 G 6.80 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 0.00 0.00 0.00 0.00 30 I 7.76 5.15 1.88 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 1.24 0.93 1.00 0.00 0.00 31 I 8.60 4.90 1.97 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.88 0.98 0.00 0.00 32 V 9.05 4.82 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 0.99 0.00 0.00 0.98 0.00 0.00 33 V 8.58 4.98 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 1.01 0.00 0.00 1.06 0.00 0.00 34 N 8.65 4.98 0.00 3.04 2.99 0.00 0.00 6.63 7.33 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 35 T 8.32 3.99 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 1.18 0.00 0.00 36 E 8.19 4.03 0.00 2.15 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 2.31 0.00 37 G 8.02 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 0.00 0.00 0.00 38 I 8.24 4.13 1.89 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 1.36 0.60 0.92 0.00 0.00 39 P 0.00 5.55 0.00 2.20 2.14 0.00 3.42 0.00 0.00 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.93 0.00 40 I 8.09 3.89 1.82 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 1.33 0.66 0.89 0.00 0.00 41 K 7.62 4.66 0.00 1.65 1.66 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.40 7.81 42 S 8.46 5.43 0.00 3.83 3.66 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 43 T 8.57 4.54 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 1.26 0.00 0.00 44 M 7.35 4.20 0.00 1.85 1.94 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 45 D 8.16 4.52 0.00 2.62 2.47 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 46 N 8.54 4.26 0.00 2.81 2.78 0.00 0.00 6.62 7.70 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 47 P 0.00 4.34 0.00 2.30 2.28 0.00 3.77 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 48 T 7.74 3.97 4.11 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 0.00 0.00 0.00 0.57 0.00 0.00 49 T 8.11 3.84 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 1.22 0.00 0.00 50 T 7.82 3.94 4.26 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 0.00 0.00 0.00 1.23 0.00 0.00 51 Q 7.88 3.98 0.00 2.23 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.60 0.00 52 Y 8.29 4.13 0.00 3.26 3.02 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 53 A 8.57 4.06 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 54 S 7.69 4.10 0.00 4.04 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 55 L 8.14 3.86 0.00 1.70 1.54 0.64 0.94 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 56 M 8.24 4.07 0.00 1.96 2.19 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.58 0.00 57 H 7.97 3.50 0.00 3.46 3.55 0.00 5.77 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 58 S 8.65 4.26 0.00 3.93 4.14 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 59 F 8.09 4.28 0.00 3.07 3.02 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 60 I 7.34 3.41 1.17 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 1.34 0.50 0.93 0.00 0.00 61 L 7.25 3.97 0.00 1.95 1.64 1.02 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.43 3.94 0.00 2.08 1.72 0.00 1.58 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.48 7.81 63 A 7.88 3.84 0.99 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 0.00 0.00 0.00 0.00 0.00 0.00 64 R 7.65 3.70 0.00 1.99 2.10 0.00 3.11 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 65 S 7.41 4.13 0.00 3.98 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 66 T 7.46 4.07 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 1.18 0.00 0.00 67 V 8.21 3.59 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.90 0.00 0.00 68 R 7.87 3.91 0.00 1.99 1.97 0.00 3.32 0.00 0.00 3.08 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.78 0.00 69 D 8.18 4.13 0.00 2.79 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 70 I 7.74 3.86 1.97 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 1.51 0.86 0.90 0.00 0.00 71 D 6.57 4.50 0.00 2.44 2.50 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 72 P 0.00 4.29 0.00 2.17 2.17 0.00 3.72 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 73 Q 7.78 4.43 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.85 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 74 N 8.04 5.13 0.00 2.60 2.62 0.00 0.00 7.04 8.46 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 75 D 8.21 4.75 0.00 2.65 2.50 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 76 L 8.24 4.64 0.00 1.62 1.58 0.88 0.75 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 77 T 7.83 4.56 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 1.32 0.00 0.00 78 F 7.85 4.27 0.00 3.07 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 79 L 8.25 4.50 0.00 1.72 1.67 0.79 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 80 R 8.74 5.11 0.00 1.83 1.92 0.00 3.39 0.00 0.00 3.60 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.97 0.00 81 I 8.11 4.48 1.81 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.42 1.03 0.00 0.00 82 R 8.54 3.91 0.00 1.87 1.94 0.00 3.23 0.00 0.00 3.24 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 83 S 7.82 4.76 0.00 3.71 3.79 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 84 K 8.44 4.24 0.00 1.74 1.86 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.45 7.81 85 K 8.07 4.19 0.00 1.76 1.87 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.37 7.81 86 N 7.49 4.72 0.00 2.92 2.88 0.00 0.00 5.90 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 87 E 8.67 4.63 0.00 2.16 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 2.34 2.64 0.00 88 I 8.26 4.54 1.82 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 1.52 0.62 0.98 0.00 0.00 89 M 9.13 4.37 0.00 1.88 2.01 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.60 0.00 90 V 8.79 5.26 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 1.18 0.00 0.00 1.02 0.00 0.00 91 A 8.37 4.97 0.97 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 0.00 0.00 92 P 0.00 4.66 0.00 2.09 2.27 0.00 3.74 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 93 D 7.70 4.78 0.00 2.14 1.54 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 94 K 8.04 3.92 0.00 1.67 1.86 0.00 1.86 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.42 7.81 95 D 7.24 4.71 0.00 2.62 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 96 Y 7.03 4.86 0.00 3.12 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 97 F 9.47 5.07 0.00 3.02 2.93 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 98 L 8.34 4.54 0.00 1.72 1.57 1.07 0.80 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 99 I 8.71 4.77 2.11 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.86 1.04 0.00 0.00 100 V 8.94 4.54 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 1.02 0.00 0.00 0.96 0.00 0.00 101 I 8.08 5.11 2.04 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 1.48 0.61 0.96 0.00 0.00 102 Q 8.68 4.91 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.86 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 103 N 8.70 4.83 0.00 2.66 2.83 0.00 0.00 7.20 7.61 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 0.00 104 P 0.00 4.49 0.00 2.19 2.06 0.00 3.74 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 105 T 8.26 4.35 4.26 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 0.00 0.00 0.00 1.24 0.00 0.00 106 E 8.29 4.08 0.00 1.94 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 2.31 2.39 0.00