NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3220 8.2644 123.5844 52.3117 20.0211 176.0221 2 D 4.5662 7.5189 124.1716 52.4258 43.7748 174.2049 3 L 4.1239 8.7015 115.8382 58.5155 41.9927 178.5166 4 E 3.9311 8.2665 116.7768 59.4236 29.2201 178.7286 5 D 4.2567 8.7380 119.4708 57.0862 41.4003 177.3166 6 N 4.3063 8.0128 117.7000 56.9014 38.8273 176.6918 7 W 3.9450 8.0399 119.7604 59.5453 29.1177 178.0131 8 E 3.9849 8.7054 119.6781 59.6526 28.6618 178.7393 9 T 3.8577 8.0327 115.1752 67.0302 68.4401 176.3726 10 L 4.0244 7.8366 120.1434 57.8961 41.4644 178.4321 11 N 4.3560 8.6070 118.1110 56.3909 38.9154 176.2839 12 D 4.4890 8.4636 120.7773 57.4161 41.0864 178.9119 13 N 4.3013 7.6878 116.2543 56.2399 38.6231 177.0871 14 L 3.9635 7.7536 120.3108 57.7135 41.4985 179.6911 15 K 3.8715 7.7637 118.7702 59.5353 32.4803 178.7844 16 V 3.6885 7.7556 118.2090 66.1264 31.4374 177.6967 17 I 3.6790 7.4941 119.0480 64.8203 36.7898 178.2037 18 E 4.0819 8.1868 117.7768 58.2423 29.2840 177.7083 19 K 4.6294 8.4575 118.6340 55.8189 33.1487 178.1162 20 A 3.7118 7.8339 123.7735 53.3312 18.6434 181.0084 21 D 4.5111 8.0501 117.5761 55.5875 41.1273 173.9606 22 N 4.9372 9.0426 114.4608 50.4574 42.8470 175.2553 23 A 4.0758 8.7831 122.3585 54.7626 17.8723 180.0932 24 A 3.9714 7.8182 119.3000 55.4239 18.6381 179.7743 25 Q 4.0609 7.9705 115.1297 57.9251 28.7982 179.0863 26 V 3.5120 7.5125 119.7783 66.0305 31.8233 177.7037 27 K 3.9087 7.7173 118.3406 59.7326 31.9560 178.4243 28 D 4.2584 7.8939 117.5518 57.1116 41.1539 177.8033 29 A 3.9847 8.0663 120.9262 55.5687 18.4983 179.6127 30 L 3.9275 7.9655 117.0247 58.3563 41.3671 180.0085 31 T 3.9315 7.9565 115.5800 66.3167 68.1922 176.9576 32 K 4.0674 7.8554 120.2815 59.6042 31.8985 179.0685 33 M 3.8783 8.2051 119.0014 58.4709 31.7049 178.7700 34 R 3.9334 8.0647 117.8393 59.3601 30.4278 178.8898 35 A 3.9690 7.5426 118.4372 55.2960 18.3108 179.6934 36 A 4.0157 8.4777 117.8656 55.4284 18.6408 178.5857 37 A 4.0447 9.5931 120.7593 54.8018 18.2414 179.4583 38 L 3.8673 8.1210 116.9841 56.9725 42.0258 179.4307 39 D 4.2502 7.9688 117.9534 57.2552 41.0538 178.1103 40 A 4.3931 7.8478 122.4384 54.2330 18.0266 178.9899 41 Q 3.1841 7.3746 118.1735 58.4400 28.9307 178.0523 42 K 4.5429 7.3024 116.4387 55.6607 33.3106 177.0820 43 A 4.6568 8.2572 117.9234 52.1252 20.4610 176.1045 44 T 5.1082 7.1686 117.0417 58.8338 71.2640 173.1385 45 P 4.7639 0.0000 0.0000 64.9704 31.7358 175.3391 46 P 4.6281 0.0000 0.0000 61.8515 31.8197 175.5604 47 K 3.6294 10.3208 116.6100 56.2062 30.1620 177.6676 48 L 2.7982 7.3738 117.2573 56.4240 43.6351 174.2445 49 E 3.9602 8.0932 127.1661 57.1680 29.2660 176.6873 50 D 4.6463 8.3728 123.4184 54.3939 40.9328 176.5596 51 K 4.3949 6.5194 120.8784 55.7847 40.3500 175.3625 52 S 4.7728 7.4793 112.7022 56.3654 65.1023 174.3227 53 P 4.2279 0.0000 0.0000 65.5779 32.1461 177.0582 54 D 4.5939 8.0010 116.6447 56.5540 44.3131 175.7193 55 S 4.8746 8.4640 113.4487 58.7975 60.1883 170.1520 56 P 4.3833 0.0000 0.0000 64.8790 31.3362 177.5506 57 E 4.4313 8.1258 117.7349 57.2408 29.3143 178.0351 58 M 4.0331 8.1030 118.2435 59.5372 32.4255 177.6379 59 K 3.9587 8.2010 119.2323 59.8930 32.0501 178.0238 60 D 4.4512 7.8163 118.6865 57.4248 40.7228 178.4151 61 F 4.3970 8.7466 121.5410 61.4846 39.0431 176.9710 62 R 3.8260 8.4807 118.7791 59.6619 29.5187 177.6230 63 H 4.2822 8.6924 117.7043 59.3938 29.9230 177.1225 64 G 3.6931 8.1250 107.1063 48.0293 0.0000 175.8507 65 F 3.7703 7.9160 120.3954 59.8196 38.6882 176.9634 66 D 4.2109 9.7722 116.9135 57.9144 41.1091 177.9861 67 I 3.7806 7.5720 120.5693 63.7310 36.8485 177.9969 68 L 3.8418 7.6865 119.7058 59.2895 39.7752 179.5798 69 V 3.8282 8.5787 119.5482 64.6352 31.2961 178.3250 70 G 3.7148 8.1919 106.5606 47.8589 0.0000 175.8487 71 Q 4.1091 7.9240 118.4542 58.4284 29.0405 177.8745 72 I 3.7532 7.3532 121.3312 64.4071 37.0385 177.7736 73 D 4.4471 7.8846 118.8356 56.7300 39.0654 178.1275 74 D 4.3426 7.9545 118.3901 56.7347 41.0828 178.0518 75 A 3.9900 8.5014 122.0246 54.8219 18.1910 179.1919 76 L 3.8746 8.0263 119.2602 58.0957 41.8769 179.2007 77 K 4.4908 7.6765 119.4566 58.9868 32.3128 178.3854 78 L 4.0682 8.0077 118.9594 57.9238 41.6170 179.0590 79 A 3.9511 8.5729 120.8933 55.8068 18.3188 179.4773 80 N 4.4583 8.0697 114.4055 55.8638 38.3344 176.1686 81 E 4.3796 8.9742 119.6024 55.7562 30.0813 176.0238 82 G 3.7691 8.5146 105.3365 47.1903 0.0000 175.2230 83 K 4.3691 7.6507 117.5642 54.8753 31.3719 177.5283 84 V 3.5681 7.5020 123.5417 65.8440 32.1589 177.1650 85 K 3.9481 7.8593 117.8582 60.0546 32.7073 178.6736 86 E 3.9017 8.1513 119.5403 58.9833 29.2444 179.1128 87 A 3.9760 7.9976 119.7267 55.2261 18.6142 179.3953 88 Q 4.0438 8.0930 116.2857 58.9643 28.6356 178.7506 89 A 3.9352 8.5332 122.0164 55.1677 18.5920 179.5362 90 A 3.9508 8.2788 118.7921 54.6762 18.2899 179.8192 91 A 3.8671 8.0330 120.0618 55.4420 18.6575 179.5773 92 E 4.0633 7.9171 116.6165 58.5511 29.3185 179.4870 93 Q 3.9482 7.7723 118.3955 59.0196 28.3154 178.1083 94 L 3.7473 7.7538 122.3578 57.7800 41.7019 178.6495 95 K 3.8086 7.9143 117.9067 60.1306 31.7162 179.2888 96 T 3.9815 8.0267 115.5350 66.4863 68.2616 176.7044 97 T 3.6049 7.8567 118.5115 66.8080 68.2047 176.0725 98 I 3.3770 7.0162 120.0699 64.3638 37.2335 178.4056 99 R 4.0197 7.6018 117.6990 59.6505 29.7519 178.3880 100 A 4.2053 8.8905 119.8162 55.3659 18.4911 178.6204 101 Y 4.1856 8.1398 113.1058 58.6643 39.2647 175.0629 102 N 4.3525 8.2426 117.7544 55.4499 37.6910 174.0449 103 Q 3.3876 8.6295 120.3907 56.7640 28.0152 175.7849 104 K 3.7291 10.4561 118.6864 57.2714 32.4883 175.5364 105 Y 5.1947 8.7989 108.4467 58.2456 41.0232 175.2975 106 G 3.8488 8.2670 115.1059 45.9509 0.0000 174.2110 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 4.32 1.35 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 0.00 0.00 0.00 2 D 7.52 4.57 0.00 2.86 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.70 4.12 0.00 1.72 1.81 1.02 0.83 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 4 E 8.27 3.93 0.00 2.16 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 0.00 2.38 2.39 0.00 5 D 8.74 4.26 0.00 2.80 2.87 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 6 N 8.01 4.31 0.00 2.90 3.09 0.00 0.00 7.74 7.88 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 7 W 8.04 3.94 0.00 3.43 3.37 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 8 E 8.71 3.98 0.00 2.07 2.26 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 2.34 2.41 0.00 9 T 8.03 3.86 4.37 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 1.20 0.00 0.00 10 L 7.84 4.02 0.00 1.77 1.46 0.77 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.61 4.36 0.00 2.95 2.90 0.00 0.00 7.09 8.49 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 12 D 8.46 4.49 0.00 2.83 2.73 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 0.00 0.00 0.00 0.00 13 N 7.69 4.30 0.00 2.83 2.79 0.00 0.00 7.18 6.60 0.00 0.00 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 L 7.75 3.96 0.00 1.56 1.71 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 15 K 7.76 3.87 0.00 1.77 1.97 0.00 1.81 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.46 7.81 16 V 7.76 3.69 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 0.87 0.00 0.00 0.96 0.00 0.00 17 I 7.49 3.68 1.85 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 1.50 1.40 0.89 0.00 0.00 18 E 8.19 4.08 0.00 2.19 2.01 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 2.34 2.53 0.00 19 K 8.46 4.63 0.00 1.80 1.74 0.00 1.67 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.33 1.33 7.81 20 A 7.83 3.71 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 21 D 8.05 4.51 0.00 2.96 2.83 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 22 N 9.04 4.94 0.00 2.54 2.64 0.00 0.00 6.79 8.01 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 23 A 8.78 4.08 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 24 A 7.82 3.97 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 25 Q 7.97 4.06 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.84 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 26 V 7.51 3.51 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 1.01 0.00 0.00 0.98 0.00 0.00 27 K 7.72 3.91 0.00 1.89 1.85 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.67 7.81 28 D 7.89 4.26 0.00 2.70 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 29 A 8.07 3.98 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 30 L 7.97 3.93 0.00 1.70 1.71 0.93 0.53 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 31 T 7.96 3.93 4.42 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 1.20 0.00 0.00 32 K 7.86 4.07 0.00 2.04 1.84 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.71 1.61 7.81 33 M 8.21 3.88 0.00 2.02 2.27 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 2.71 2.53 0.00 34 R 8.06 3.93 0.00 2.10 1.99 0.00 3.16 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 35 A 7.54 3.97 1.35 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 0.00 0.00 0.00 36 A 8.48 4.02 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 37 A 9.59 4.04 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 38 L 8.12 3.87 0.00 1.62 1.68 0.91 0.95 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 39 D 7.97 4.25 0.00 2.83 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 40 A 7.85 4.39 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 41 Q 7.37 3.18 0.00 1.74 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.37 0.00 0.00 0.00 0.00 0.00 2.23 2.52 0.00 42 K 7.30 4.54 0.00 1.75 1.76 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.33 7.81 43 A 8.26 4.66 1.26 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 0.00 0.00 0.00 44 T 7.17 5.11 4.68 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 1.61 0.00 0.00 45 P 0.00 4.76 0.00 2.28 2.25 0.00 4.01 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.64 0.00 46 P 0.00 4.63 0.00 2.35 2.55 0.00 3.85 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 47 K 10.32 3.63 0.00 1.84 1.89 0.00 1.77 0.00 0.00 1.82 0.00 0.00 3.07 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.43 1.61 7.81 48 L 7.37 2.80 0.00 1.15 1.30 0.75 -0.41 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 49 E 8.09 3.96 0.00 1.95 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 2.30 2.36 0.00 50 D 8.37 4.65 0.00 2.64 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 K 6.52 4.39 0.00 1.79 1.71 0.00 1.61 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.25 1.39 7.81 52 S 7.48 4.77 0.00 3.81 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 53 P 0.00 4.23 0.00 2.01 2.02 0.00 3.59 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 1.98 2.09 0.00 54 D 8.00 4.59 0.00 2.59 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 0.00 0.00 0.00 0.00 55 S 8.46 4.87 0.00 4.04 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 0.00 56 P 0.00 4.38 0.00 2.21 2.13 0.00 3.61 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 57 E 8.13 4.43 0.00 2.04 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 2.43 2.26 0.00 58 M 8.10 4.03 0.00 2.31 2.14 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.60 0.00 59 K 8.20 3.96 0.00 1.93 1.84 0.00 1.69 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.53 1.64 7.81 60 D 7.82 4.45 0.00 3.17 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 61 F 8.75 4.40 0.00 3.10 3.36 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 62 R 8.48 3.83 0.00 1.92 2.01 0.00 3.18 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 63 H 8.69 4.28 0.00 3.14 3.45 0.00 6.01 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.13 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.92 3.77 0.00 2.96 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 66 D 9.77 4.21 0.00 2.83 2.87 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 67 I 7.57 3.78 1.95 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 1.47 0.78 0.91 0.00 0.00 68 L 7.69 3.84 0.00 1.60 1.70 0.66 -0.42 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 69 V 8.58 3.83 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 1.10 0.00 0.00 1.12 0.00 0.00 70 G 8.19 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 0.00 0.00 0.00 71 Q 7.92 4.11 0.00 2.18 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.98 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 72 I 7.35 3.75 1.99 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 1.50 0.77 0.87 0.00 0.00 73 D 7.88 4.45 0.00 2.97 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 74 D 7.95 4.34 0.00 2.87 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 75 A 8.50 3.99 1.35 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 0.00 0.00 0.00 76 L 8.03 3.87 0.00 1.68 1.80 0.89 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.68 4.49 0.00 1.78 2.09 0.00 1.65 0.00 0.00 2.45 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.38 7.81 78 L 8.01 4.07 0.00 2.01 1.68 0.97 0.70 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 79 A 8.57 3.95 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 80 N 8.07 4.46 0.00 2.82 2.88 0.00 0.00 6.60 8.48 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 81 E 8.97 4.38 0.00 1.80 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 2.29 2.31 0.00 82 G 8.51 3.77 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 0.00 0.00 0.00 83 K 7.65 4.37 0.00 1.79 1.75 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.58 1.33 7.81 84 V 7.50 3.57 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 1.11 0.00 0.00 0.95 0.00 0.00 85 K 7.86 3.95 0.00 2.01 2.04 0.00 1.56 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.52 7.81 86 E 8.15 3.90 0.00 1.99 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 2.39 2.32 0.00 87 A 8.00 3.98 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 88 Q 8.09 4.04 0.00 2.38 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 89 A 8.53 3.94 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 90 A 8.28 3.95 1.35 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 0.00 0.00 0.00 91 A 8.03 3.87 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 92 E 7.92 4.06 0.00 2.07 1.99 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 2.31 2.30 0.00 93 Q 7.77 3.95 0.00 2.31 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.68 0.00 0.00 0.00 0.00 0.00 2.24 2.42 0.00 94 L 7.75 3.75 0.00 1.68 1.70 0.72 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 95 K 7.91 3.81 0.00 1.94 1.78 0.00 1.68 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.46 7.81 96 T 8.03 3.98 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 1.21 0.00 0.00 97 T 7.86 3.60 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 98 I 7.02 3.38 1.84 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.37 1.05 0.00 0.00 99 R 7.60 4.02 0.00 1.93 1.96 0.00 3.30 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.86 0.00 100 A 8.89 4.21 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 0.00 101 Y 8.14 4.19 0.00 2.93 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 0.00 102 N 8.24 4.35 0.00 2.81 3.21 0.00 0.00 7.48 7.18 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 0.00 103 Q 8.63 3.39 0.00 2.30 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.19 6.25 0.00 0.00 0.00 0.00 0.00 2.44 2.30 0.00 104 K 10.46 3.73 0.00 1.76 1.72 0.00 0.61 0.00 0.00 1.11 0.00 0.00 2.48 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.39 1.49 7.81 105 Y 8.80 5.19 0.00 3.17 2.87 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 0.00 106 G 8.27 3.85 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 0.00 0.00 0.00