NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5789 8.2233 120.1872 54.2009 43.2156 177.4420 3 S 3.9370 8.1376 114.4189 58.7174 62.7358 173.6210 4 N 4.7224 8.1266 118.8367 54.2023 38.7696 175.8367 5 D 4.3309 7.7622 120.0863 57.4889 41.0300 178.2158 6 L 3.6844 7.4510 119.9153 57.8976 41.8131 178.8368 7 E 4.0424 9.2181 120.1250 59.4977 29.5637 177.9178 8 A 3.9284 7.9936 120.0975 55.6278 18.2069 179.0880 9 S 3.9411 8.1579 110.6298 62.0240 62.1173 175.6471 10 F 4.8564 7.6508 120.8154 58.5023 38.8108 177.2845 11 T 4.0898 8.8122 109.8876 65.8192 68.5313 175.5672 12 S 4.0881 8.1582 115.2227 61.2106 62.4045 175.8242 13 R 4.1049 7.7658 118.5599 56.5928 30.1810 175.9760 14 L 4.8790 7.2769 116.9131 53.3149 43.5977 174.9402 15 P 4.1195 0.0000 0.0000 61.2743 30.4078 174.9620 16 P 4.3127 0.0000 0.0000 65.3608 31.1413 178.5093 17 E 3.9670 8.0889 116.1046 59.5104 29.7698 178.6513 18 I 3.6520 7.8905 121.2884 63.9193 37.2308 178.0932 19 V 3.5523 7.9258 118.5432 66.2762 31.0968 178.0159 20 A 3.9548 7.6382 117.3156 55.6328 18.5471 178.8695 21 A 3.8002 8.3488 118.3677 55.7580 18.1525 179.3630 22 L 3.8536 8.1708 117.0215 57.9872 42.1925 179.8534 23 K 4.1716 7.8305 117.4359 57.5167 32.5979 177.4065 24 R 4.1894 7.9183 118.4827 54.8416 30.0751 174.4182 25 K 4.0116 7.8378 125.1813 54.9182 33.1689 175.6453 26 S 4.6642 8.7224 119.8441 58.5117 62.6996 173.8483 27 S 4.7524 7.8052 119.0827 56.1242 64.4093 173.7285 28 R 3.9830 8.4136 119.2992 58.8511 30.1192 176.8568 29 D 4.3381 8.3186 118.6641 53.7838 41.0624 174.9884 30 P 4.4272 0.0000 0.0000 63.8854 31.2487 176.4067 31 N 4.9644 8.9443 113.5129 52.9552 40.2443 174.7220 32 S 4.6999 7.7802 113.1532 57.6518 63.0220 173.1235 33 R 4.8448 7.6196 115.8219 55.2013 32.3692 175.2972 34 F 3.6473 9.5319 117.2966 61.2413 39.3441 177.0734 35 P 4.5633 0.0000 0.0000 65.2455 32.0800 178.3883 36 R 3.8586 8.0635 116.6677 59.2915 30.0541 178.6033 37 K 3.7443 8.2523 119.6023 59.9911 31.8651 177.9256 38 L 3.7253 8.0729 121.0275 57.5965 41.8164 178.1062 39 H 3.8534 8.4948 119.2287 60.1956 29.5378 175.6702 40 M 4.0493 8.7811 120.4782 56.4715 31.7039 178.1460 41 L 3.9411 7.2502 117.9476 57.9846 42.3013 179.2587 42 L 3.8512 7.9405 119.2950 57.8595 42.0275 178.5946 43 T 4.5072 9.1967 109.7571 64.8153 68.8296 175.6507 44 Y 4.2107 8.3252 121.6802 60.6416 38.3959 178.0683 45 L 4.0848 7.9721 120.4205 58.0033 42.0608 179.2781 46 A 4.9764 8.6693 121.6125 54.3498 18.2014 179.7137 47 S 4.3862 9.5235 112.3422 60.8472 65.2429 175.8526 48 N 4.7397 8.2307 124.4212 50.3820 35.8410 173.0830 49 P 4.2891 0.0000 0.0000 65.4684 32.1044 176.9762 50 Q 4.0941 8.5724 118.9358 58.9290 29.1240 177.7704 51 L 3.9583 8.0735 119.2289 57.9579 41.6341 178.9312 52 E 3.8713 7.9698 118.7661 59.0327 27.7930 178.4608 53 E 4.3039 8.6459 119.0926 58.9921 29.9464 177.4559 54 E 3.9486 8.1970 116.7692 59.3239 29.6819 178.1544 55 I 3.0762 7.3207 119.4853 64.2618 37.4453 174.3569 56 G 3.5911 8.0735 115.8073 45.0853 0.0000 171.5068 57 L 4.8808 7.7137 123.0183 55.1157 44.3772 173.2048 58 S 4.3717 7.9169 120.6068 57.6553 65.8096 176.4464 59 W 5.0424 8.6023 120.7060 56.7901 29.4672 176.4991 60 I 4.6358 8.6521 119.0829 61.3351 37.5389 175.5010 61 S 4.7627 7.8619 113.0124 56.9095 65.9258 174.3527 62 D 4.3729 8.6738 119.3996 56.6556 40.8788 178.9425 63 T 4.2790 7.4803 108.3572 62.9852 69.6895 174.3073 64 E 5.5737 9.0855 119.2832 54.4661 33.6777 174.7139 65 F 5.5327 9.8314 114.8975 55.3107 42.0688 173.2326 66 K 5.3090 9.2762 118.6852 55.5787 35.6434 174.9070 67 M 5.2103 9.2374 118.4714 54.4749 35.3948 174.1223 68 K 4.3372 8.1087 119.9082 53.8283 30.9644 177.8443 69 K 4.1010 7.9783 124.0400 59.2368 32.8687 178.6696 70 K 3.8418 8.1890 116.7210 59.8306 32.0927 178.4398 71 N 4.4369 8.2221 116.2538 56.5188 38.5459 177.2922 72 V 3.3664 7.7048 118.7216 66.0753 31.3363 177.4681 73 A 3.9668 8.2248 120.6594 55.6121 18.1852 178.9589 74 L 4.0223 7.8784 118.5597 58.2519 42.2694 179.2309 75 V 3.8031 7.5871 111.4572 64.6670 31.5273 178.1958 76 M 3.8843 7.6313 116.6486 56.3201 32.7075 177.6563 77 G 4.2757 10.5246 112.7928 46.1239 0.0000 174.9360 78 I 4.1102 7.3599 111.3368 59.7533 38.9829 175.9186 79 K 4.2457 7.9241 120.2286 55.4389 33.9145 177.7763 80 L 3.8580 8.5188 124.8329 59.4356 41.8900 178.2968 81 N 4.0217 8.5911 114.8482 57.1916 38.5090 176.2979 82 T 3.7704 7.6602 109.5563 65.0730 69.1227 175.2111 83 L 3.7500 7.8724 123.0165 58.0940 42.1124 178.5388 84 N 4.2692 8.2571 116.0795 56.5342 38.4262 178.0059 85 V 3.5783 7.8030 113.6513 64.4540 31.7159 178.0621 86 N 3.9625 8.4439 116.5550 56.5292 38.2646 177.4151 87 L 4.5333 7.5948 119.8694 57.2855 41.4314 179.5235 88 R 3.9697 7.7322 118.2236 59.5568 30.2272 177.8862 89 D 4.5665 8.8160 119.6968 57.1899 40.6193 178.1921 90 L 4.3054 8.2477 117.1245 54.6597 42.6515 176.9581 91 A 3.7680 7.4602 118.7503 53.0371 16.6839 178.7577 92 F 4.5454 8.0168 116.8535 58.9222 39.6325 175.4831 93 E 4.5974 10.5477 124.5196 54.1462 30.7181 174.1887 94 Q 2.9696 8.6896 127.9756 56.2518 29.2202 175.7055 95 L 4.4553 7.3246 124.4969 54.4089 42.4482 176.8771 96 Q 4.2929 6.9697 114.5393 55.0933 32.4183 173.4375 97 H 4.3247 8.6461 122.3503 55.2607 30.7230 173.9476 98 D 4.3241 8.0339 121.4661 54.5487 41.1391 175.7858 99 K 4.3162 9.0994 128.0681 55.1929 32.3703 176.5089 100 G 4.2709 9.5681 115.2126 46.4193 0.0000 172.0058 101 G 4.0514 8.9525 109.7581 44.7905 0.0000 174.8544 102 W 4.8158 7.7912 118.2819 56.8948 30.6196 175.8683 103 T 4.8318 8.6424 110.9303 61.0534 71.9407 172.8171 104 Q 4.9983 7.8237 121.8076 54.5616 32.2310 173.9928 105 W 4.6570 8.5690 117.1758 57.2382 33.7390 173.9197 106 K 5.2981 8.5128 119.7505 56.7790 35.5542 174.1615 107 R 4.4201 9.0540 119.8450 55.4942 32.4972 174.7218 108 S 3.8775 9.1460 118.7948 62.1916 63.1129 176.1182 109 G 3.4898 7.8842 113.1250 45.3366 0.0000 173.6245 110 F 3.6628 7.1858 130.7382 57.4028 38.3569 175.0011 111 T 5.1732 8.4564 121.0846 65.9292 74.9209 174.4951 112 R 4.0297 8.1632 123.0737 56.1323 29.8644 174.7308 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 2 D 8.22 4.58 0.00 2.67 2.71 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 3 S 8.14 3.94 0.00 3.95 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 4 N 8.13 4.72 0.00 2.97 3.04 0.00 0.00 5.89 8.07 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 5 D 7.76 4.33 0.00 2.66 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 6 L 7.45 3.68 0.00 1.80 1.60 0.56 0.86 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 7 E 9.22 4.04 0.00 1.96 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 0.00 2.35 2.40 0.00 8 A 7.99 3.93 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 9 S 8.16 3.94 0.00 3.76 3.54 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 10 F 7.65 4.86 0.00 3.19 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 11 T 8.81 4.09 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 1.27 0.00 0.00 12 S 8.16 4.09 0.00 3.88 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 13 R 7.77 4.10 0.00 1.96 2.08 0.00 3.29 0.00 0.00 3.29 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 14 L 7.28 4.88 0.00 1.77 1.75 0.86 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 15 P 0.00 4.12 0.00 2.35 2.02 0.00 4.07 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 16 P 0.00 4.31 0.00 2.16 2.14 0.00 3.61 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 17 E 8.09 3.97 0.00 2.19 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 0.00 2.36 2.39 0.00 18 I 7.89 3.65 2.17 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.59 0.98 0.00 0.00 19 V 7.93 3.55 2.30 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 1.03 0.00 0.00 1.02 0.00 0.00 20 A 7.64 3.95 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 21 A 8.35 3.80 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 22 L 8.17 3.85 0.00 1.81 1.78 0.92 0.79 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 23 K 7.83 4.17 0.00 2.02 1.91 0.00 1.82 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.62 7.81 24 R 7.92 4.19 0.00 1.86 1.97 0.00 3.41 0.00 0.00 3.16 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 25 K 7.84 4.01 0.00 1.76 1.71 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.14 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.44 1.57 7.81 26 S 8.72 4.66 0.00 4.05 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 27 S 7.81 4.75 0.00 3.90 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 28 R 8.41 3.98 0.00 1.85 1.99 0.00 3.27 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 29 D 8.32 4.34 0.00 2.76 2.58 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 30 P 0.00 4.43 0.00 2.08 2.09 0.00 3.67 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 2.04 2.13 0.00 31 N 8.94 4.96 0.00 2.77 2.78 0.00 0.00 6.61 7.51 0.00 0.00 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 S 7.78 4.70 0.00 4.01 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 33 R 7.62 4.84 0.00 2.21 2.08 0.00 3.16 0.00 0.00 3.36 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 34 F 9.53 3.65 0.00 3.15 3.12 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 35 P 0.00 4.56 0.00 2.39 2.30 0.00 3.78 0.00 0.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.47 0.00 36 R 8.06 3.86 0.00 2.04 1.97 0.00 3.23 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.70 0.00 37 K 8.25 3.74 0.00 1.91 1.70 0.00 1.65 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.46 7.81 38 L 8.07 3.73 0.00 1.39 1.60 0.49 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 39 H 8.49 3.85 0.00 2.93 3.29 0.00 5.81 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 M 8.78 4.05 0.00 2.33 1.87 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 2.64 2.63 0.00 41 L 7.25 3.94 0.00 1.87 1.61 0.79 0.49 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 42 L 7.94 3.85 0.00 1.46 1.72 0.11 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 43 T 9.20 4.51 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 1.42 0.00 0.00 44 Y 8.33 4.21 0.00 3.06 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 45 L 7.97 4.08 0.00 1.72 1.67 0.78 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 46 A 8.67 4.98 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.52 4.39 0.00 4.12 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 0.00 48 N 8.23 4.74 0.00 3.10 2.77 0.00 0.00 7.27 6.99 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 49 P 0.00 4.29 0.00 2.09 2.18 0.00 3.78 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.23 0.00 50 Q 8.57 4.09 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 51 L 8.07 3.96 0.00 1.55 1.56 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 52 E 7.97 3.87 0.00 2.25 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 0.00 2.37 2.47 0.00 53 E 8.65 4.30 0.00 2.18 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 2.36 2.45 0.00 54 E 8.20 3.95 0.00 2.34 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 0.00 2.47 2.53 0.00 55 I 7.32 3.08 1.72 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.22 0.62 0.00 0.00 56 G 8.07 3.59 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 0.00 0.00 0.00 57 L 7.71 4.88 0.00 1.49 1.48 0.79 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.92 4.37 0.00 4.07 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 59 W 8.60 5.04 0.00 3.37 3.52 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 60 I 8.65 4.64 1.98 0.00 0.00 0.98 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 0.54 0.95 0.00 0.00 61 S 7.86 4.76 0.00 4.03 4.04 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 0.00 0.00 0.00 62 D 8.67 4.37 0.00 2.71 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 T 7.48 4.28 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 1.30 0.00 0.00 64 E 9.09 5.57 0.00 2.18 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 0.00 2.35 2.39 0.00 65 F 9.83 5.53 0.00 2.75 2.28 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 0.00 66 K 9.28 5.31 0.00 1.93 1.94 0.00 1.01 0.00 0.00 1.57 0.00 0.00 2.72 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.59 1.63 7.81 67 M 9.24 5.21 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 68 K 8.11 4.34 0.00 1.37 1.29 0.00 0.92 0.00 0.00 0.61 0.00 0.00 2.50 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.30 0.21 7.81 69 K 7.98 4.10 0.00 1.78 1.79 0.00 1.76 0.00 0.00 1.86 0.00 0.00 3.38 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.50 1.57 7.81 70 K 8.19 3.84 0.00 1.61 1.87 0.00 1.57 0.00 0.00 1.63 0.00 0.00 3.16 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.60 7.81 71 N 8.22 4.44 0.00 2.74 2.65 0.00 0.00 6.73 8.47 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 72 V 7.70 3.37 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 0.98 0.00 0.00 0.79 0.00 0.00 73 A 8.22 3.97 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 74 L 7.88 4.02 0.00 1.84 1.72 1.06 1.20 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 75 V 7.59 3.80 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 0.60 0.00 0.00 0.87 0.00 0.00 76 M 7.63 3.88 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.54 0.00 77 G 10.52 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 0.00 0.00 0.00 0.00 78 I 7.36 4.11 1.87 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.65 0.94 0.00 0.00 79 K 7.92 4.25 0.00 1.67 1.75 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.58 7.81 80 L 8.52 3.86 0.00 1.68 1.68 0.90 0.47 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 81 N 8.59 4.02 0.00 2.78 2.71 0.00 0.00 6.80 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 82 T 7.66 3.77 4.18 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 0.00 0.00 1.19 0.00 0.00 83 L 7.87 3.75 0.00 1.69 1.74 0.88 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 84 N 8.26 4.27 0.00 2.94 2.92 0.00 0.00 7.17 7.40 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 85 V 7.80 3.58 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 0.90 0.00 0.00 0.92 0.00 0.00 86 N 8.44 3.96 0.00 1.91 1.61 0.00 0.00 7.11 7.36 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 87 L 7.59 4.53 0.00 1.60 1.70 0.62 -0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 88 R 7.73 3.97 0.00 1.95 2.17 0.00 3.39 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 89 D 8.82 4.57 0.00 2.88 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 90 L 8.25 4.31 0.00 1.64 1.60 1.07 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 91 A 7.46 3.77 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 92 F 8.02 4.55 0.00 3.29 3.12 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 93 E 10.55 4.60 0.00 2.17 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 2.23 2.28 0.00 94 Q 8.69 2.97 0.00 1.12 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 6.81 0.00 0.00 0.00 0.00 0.00 1.87 1.26 0.00 95 L 7.32 4.46 0.00 1.45 1.59 1.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 96 Q 6.97 4.29 0.00 1.82 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.03 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 97 H 8.65 4.32 0.00 2.99 3.18 0.00 5.93 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 D 8.03 4.32 0.00 2.58 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 0.00 0.00 0.00 0.00 99 K 9.10 4.32 0.00 1.78 1.76 0.00 1.86 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.48 7.81 100 G 9.57 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 0.00 0.00 0.00 0.00 101 G 8.95 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 0.00 102 W 7.79 4.82 0.00 3.49 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 0.00 103 T 8.64 4.83 4.17 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 0.00 0.00 0.00 1.36 0.00 0.00 104 Q 7.82 5.00 0.00 1.81 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.90 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 105 W 8.57 4.66 0.00 1.94 2.80 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 0.00 106 K 8.51 5.30 0.00 2.23 2.07 0.00 1.61 0.00 0.00 1.84 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.58 1.61 7.81 107 R 9.05 4.42 0.00 1.90 2.03 0.00 2.79 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 108 S 9.15 3.88 0.00 4.08 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 0.00 109 G 7.88 3.49 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 0.00 110 F 7.19 3.66 0.00 3.31 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 0.00 111 T 8.46 5.17 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 1.11 0.00 0.00 112 R 8.16 4.03 0.00 1.44 1.77 0.00 2.21 0.00 0.00 2.45 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00