NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2532 8.3144 119.9986 56.1361 33.5577 175.1820 2 E 3.7415 8.7362 124.9073 54.6371 30.1036 174.9597 3 S 4.3914 8.9063 122.8513 57.9638 66.3262 174.6414 4 A 3.9841 8.5620 124.5988 55.4434 18.1964 180.0714 5 A 3.9878 8.0001 118.5926 55.1027 18.4516 179.5616 6 A 3.9567 8.1869 119.5207 55.2424 18.4990 179.7819 7 K 4.0948 8.3410 119.7738 59.0067 32.2609 178.8161 8 F 4.0465 8.3252 121.0094 61.3350 39.3481 176.9971 9 E 4.0848 8.3791 118.2208 59.2850 29.0187 179.3740 10 R 3.8036 7.9683 117.8759 59.7291 30.3357 178.4421 11 Q 3.9952 8.3337 116.5106 58.0640 28.7766 176.5514 12 H 4.6728 8.1881 113.5953 54.9430 30.6820 173.0298 13 M 4.5830 7.7629 119.9743 53.6928 33.6164 176.5445 14 D 4.7437 8.1822 122.8123 52.7412 41.8597 174.5587 15 S 4.1901 7.9915 117.3486 57.8588 63.9080 174.6969 16 G 4.2993 7.7936 110.7072 44.5969 0.0000 172.0162 17 N 4.6515 8.3488 115.9527 54.7657 40.3242 177.1311 18 S 4.5912 7.6095 114.2628 57.5808 61.8057 174.4479 19 A 3.7613 7.2774 123.2379 56.1364 19.0841 178.4438 20 S 4.5806 7.7524 107.9287 57.9169 63.8059 174.4910 21 S 4.2501 8.1073 117.1497 58.4584 62.7627 175.4309 22 S 4.5498 8.7362 122.1520 61.1799 62.4276 176.4520 23 S 4.3482 7.7555 117.0159 60.3330 63.0795 174.9384 24 N 4.7459 8.5404 119.8281 53.5060 38.7486 175.7063 25 Y 3.9852 7.8561 122.2917 61.4243 38.7646 177.4848 26 C 4.1878 8.6846 116.7671 60.1942 39.7311 176.0207 27 N 4.5047 8.2236 117.3881 56.5510 38.1313 177.3822 28 Q 3.9628 7.9991 119.3100 59.1268 28.8353 178.5956 29 M 3.7006 8.1449 120.0094 58.4938 31.7741 178.6479 30 M 4.0857 8.2948 119.2674 58.4354 31.9892 178.5488 31 C 4.1702 7.6950 119.0427 61.9483 31.6302 174.9910 32 C 3.9607 8.0191 119.6290 62.7354 31.1208 174.5940 33 R 4.3040 8.5540 115.4638 55.8468 29.2533 176.4403 34 K 3.9136 7.6757 115.8019 58.1698 30.1129 175.7470 35 M 4.5812 8.4019 116.0633 55.5262 31.8225 177.4778 36 T 5.2255 7.6512 105.7040 60.1745 70.1155 173.1882 37 Q 4.3421 8.0186 122.5556 56.8811 29.5733 176.8276 38 G 3.9380 9.6798 113.6796 45.8452 0.0000 173.0175 39 K 3.0958 7.2175 116.8094 56.3532 35.4031 172.7557 40 C 4.9329 8.6026 116.9150 55.0538 40.6150 174.0072 41 K 4.1153 8.7665 127.7103 55.8362 32.4467 174.3485 42 P 4.6995 0.0000 0.0000 65.6504 31.6187 175.9711 43 V 5.0714 7.5144 119.2663 60.5009 34.7193 173.4908 44 N 4.6785 8.7546 122.8873 52.7855 42.8018 173.0179 45 T 4.6983 7.7164 120.8097 61.5628 71.6545 173.1040 46 F 4.7053 8.7240 124.7595 55.7177 41.3271 174.7921 47 V 4.2977 8.4372 124.0318 62.2075 32.3726 175.0865 48 H 4.8876 8.7577 123.7682 55.8587 29.4113 175.1074 49 E 4.3512 7.9679 118.9457 55.0347 30.8517 176.5197 50 S 4.2557 8.3097 113.5592 58.1902 64.1054 174.1152 51 L 3.9347 8.6244 129.4745 58.4494 41.8480 179.2228 52 A 3.9906 7.9847 120.0028 55.3066 18.1141 179.2162 53 D 4.2850 7.8594 115.9298 57.5544 41.2977 178.7206 54 V 3.7673 8.2164 119.1905 65.8768 31.5446 178.2818 55 K 3.9912 8.5135 118.5067 59.2437 31.7996 179.0664 56 A 3.9910 7.9519 121.2011 55.0715 18.2061 179.5635 57 V 3.8000 7.5340 116.4422 66.6027 31.2320 177.4426 58 C 4.0402 8.0300 115.2918 58.5154 39.8933 174.5660 59 S 4.6581 7.8045 113.9988 57.9219 63.6308 174.8707 60 Q 4.5577 7.9660 122.3154 55.9053 28.0344 176.3705 61 K 4.1465 8.3123 126.7453 57.2279 33.1454 176.5994 62 K 3.9822 8.6296 129.8360 56.3745 32.8250 176.2113 63 V 4.5253 8.4857 119.5873 59.9179 36.7046 174.5554 64 T 4.2365 8.2570 119.0307 62.8968 69.4714 176.0699 65 C 4.6387 8.8031 123.7408 56.4432 40.9300 174.8397 66 K 3.7661 9.3101 123.7705 59.3678 31.7868 177.3867 67 D 4.6061 8.0873 115.8039 53.0247 39.5047 177.1870 68 G 3.9222 8.0629 108.5197 45.6502 0.0000 174.2908 69 Q 4.2783 8.4208 119.4174 55.9583 29.5917 175.9356 70 T 4.8113 8.1231 107.9963 61.6126 69.0775 173.6450 71 N 5.1308 7.8845 114.1377 54.0387 39.0855 174.8351 72 C 5.4230 7.7354 115.7380 56.9267 40.7079 172.6480 73 Y 5.1584 9.1456 118.6260 56.3649 42.5701 173.9043 74 Q 5.2447 9.2636 123.7078 53.8958 31.9435 175.0484 75 S 4.6103 9.1008 121.4248 58.6979 63.1845 174.8172 76 K 4.1346 9.3279 122.8201 58.9861 32.1036 177.7712 77 S 4.8544 7.6695 112.6018 56.5138 65.2271 173.7599 78 T 4.1203 7.9684 112.1762 62.1147 69.7087 173.5367 79 M 4.9435 9.0572 121.5582 53.4586 37.0167 174.8545 80 R 4.6895 8.9864 121.1866 56.1629 31.3877 175.8905 81 I 5.0977 8.9363 116.9253 59.4857 41.9972 174.0529 82 T 5.0221 8.6307 119.8895 61.9156 71.2333 172.6556 83 D 5.0339 9.5900 127.7365 53.2631 43.3277 174.2656 84 C 5.5615 9.1511 123.0840 55.3181 41.7337 173.1561 85 R 5.3478 8.7333 122.1292 53.9524 33.6155 174.6901 86 E 4.1722 9.0540 125.5460 56.4957 30.2484 176.5523 87 T 4.2877 8.7829 117.7049 60.6212 70.2978 175.9625 88 G 3.8653 8.9026 111.9468 48.9904 0.0000 175.1451 89 S 4.2220 7.9419 114.8118 60.9038 63.2408 174.9597 90 S 4.2271 7.9532 115.4680 58.1732 62.6547 173.5001 91 K 4.2146 8.9269 125.6383 55.5296 35.2393 173.8270 92 Y 4.4335 8.8626 127.6906 57.8213 39.0608 173.8206 93 P 3.1311 0.0000 0.0000 62.5449 31.8222 176.8588 94 N 4.7586 7.8481 119.3299 52.2491 37.3724 172.9687 95 C 4.6709 7.9929 117.2030 56.5502 40.6528 173.2872 96 A 5.0100 8.8701 124.8505 50.5862 22.1836 174.6511 97 Y 5.2782 9.5147 118.9804 56.0775 42.5451 174.7211 98 K 4.5985 9.3671 123.1113 55.3626 34.2433 175.0970 99 T 5.0389 8.5854 124.1031 62.7886 70.1786 174.4467 100 T 4.5616 8.9553 122.3862 62.1368 72.4157 172.8778 101 Q 4.9199 8.6918 125.8545 55.1551 30.3953 175.5276 102 V 4.4568 8.4499 115.1395 60.7644 37.3123 172.2989 103 E 5.1296 8.6134 120.5971 54.8836 31.8831 175.8872 104 K 4.6833 8.7217 122.7480 55.2049 37.7837 175.1525 105 H 4.8267 9.7481 119.5068 55.7743 30.0759 174.9576 106 I 4.8533 9.1107 115.2289 59.2128 40.9166 174.3442 107 I 4.9348 8.6537 124.9934 59.7319 40.0650 175.0904 108 V 4.8150 8.9315 119.7077 59.3225 36.2726 174.6117 109 A 4.9772 8.9441 125.4572 51.5951 20.2081 175.7674 110 C 5.4320 9.1284 119.4319 55.5006 43.0480 173.6185 111 G 3.8833 9.1394 108.6310 46.5997 0.0000 172.9310 112 G 4.0201 9.3297 108.2489 44.6187 0.0000 172.2188 113 K 4.4011 8.1291 119.3086 53.8472 34.0131 174.2636 114 P 4.3025 0.0000 0.0000 62.6367 31.7408 175.9155 115 S 4.6842 8.2885 114.5957 57.9402 62.6923 173.3265 116 V 4.6008 8.4802 119.8778 58.3660 36.3013 173.4096 117 P 4.8443 0.0000 0.0000 63.4219 31.2684 176.9649 118 V 4.4867 8.7895 115.9266 60.8917 33.7171 175.1641 119 H 4.5519 7.7791 117.8498 55.2139 33.2683 172.1028 120 F 4.3815 8.8215 128.7513 57.9586 39.4099 174.1372 121 D 4.6136 8.5700 126.8556 55.7595 41.7477 175.7577 122 A 4.7209 6.7879 117.2033 51.4046 22.6456 174.2539 123 S 5.2033 8.4990 113.0095 57.0069 66.5405 174.6999 124 V 4.1063 9.0354 120.2750 62.5382 31.3581 172.9929 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 K 8.31 4.25 0.00 1.87 1.92 0.00 1.46 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.50 7.81 2 E 8.74 3.74 0.00 2.11 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 2.40 2.37 0.00 3 S 8.91 4.39 0.00 4.10 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 A 8.56 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 5 A 8.00 3.99 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 6 A 8.19 3.96 1.42 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 0.00 0.00 0.00 7 K 8.34 4.09 0.00 1.96 2.04 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.31 7.81 8 F 8.33 4.05 0.00 3.20 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 9 E 8.38 4.08 0.00 2.30 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 2.49 2.68 0.00 10 R 7.97 3.80 0.00 1.78 2.07 0.00 3.24 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 1.59 1.64 0.00 11 Q 8.33 4.00 0.00 1.71 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.47 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 12 H 8.19 4.67 0.00 1.91 2.80 0.00 5.62 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.76 4.58 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.69 0.00 14 D 8.18 4.74 0.00 2.53 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 15 S 7.99 4.19 0.00 3.91 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 16 G 7.79 4.30 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 0.00 17 N 8.35 4.65 0.00 2.72 2.87 0.00 0.00 6.77 7.57 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 18 S 7.61 4.59 0.00 3.88 3.82 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 19 A 7.28 3.76 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 20 S 7.75 4.58 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 21 S 8.11 4.25 0.00 3.89 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 22 S 8.74 4.55 0.00 4.07 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 0.00 23 S 7.76 4.35 0.00 4.03 4.07 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 0.00 0.00 0.00 0.00 24 N 8.54 4.75 0.00 3.04 2.90 0.00 0.00 6.43 7.44 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 25 Y 7.86 3.99 0.00 3.14 3.04 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 26 C 8.68 4.19 0.00 3.17 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 27 N 8.22 4.50 0.00 2.92 2.94 0.00 0.00 7.14 7.63 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 28 Q 8.00 3.96 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 29 M 8.14 3.70 0.00 0.77 1.12 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.65 0.00 30 M 8.29 4.09 0.00 1.75 2.04 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 2.44 0.00 31 C 7.69 4.17 0.00 3.10 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 32 C 8.02 3.96 0.00 2.90 3.05 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 33 R 8.55 4.30 0.00 2.02 2.03 0.00 3.58 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.01 0.00 34 K 7.68 3.91 0.00 1.94 1.91 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.39 1.51 7.81 35 M 8.40 4.58 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.41 0.00 36 T 7.65 5.23 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 37 Q 8.02 4.34 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.76 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 38 G 9.68 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 39 K 7.22 3.10 0.00 1.61 1.53 0.00 1.17 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.11 1.31 7.81 40 C 8.60 4.93 0.00 3.08 3.11 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 0.00 41 K 8.77 4.12 0.00 1.79 1.75 0.00 1.76 0.00 0.00 1.64 0.00 0.00 3.33 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.58 1.38 7.81 42 P 0.00 4.70 0.00 2.19 2.33 0.00 3.71 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 2.10 2.00 0.00 43 V 7.51 5.07 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 0.79 0.00 0.00 0.97 0.00 0.00 44 N 8.75 4.68 0.00 2.61 2.21 0.00 0.00 6.97 6.72 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 45 T 7.72 4.70 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 0.84 0.00 0.00 46 F 8.72 4.71 0.00 3.00 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 47 V 8.44 4.30 2.15 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 0.87 0.00 0.00 1.10 0.00 0.00 48 H 8.76 4.89 0.00 3.19 3.28 0.00 5.70 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 49 E 7.97 4.35 0.00 1.99 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 2.34 2.26 0.00 50 S 8.31 4.26 0.00 3.90 3.89 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 0.00 0.00 0.00 51 L 8.62 3.93 0.00 1.81 1.67 0.94 1.20 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 52 A 7.98 3.99 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.86 4.29 0.00 2.86 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.22 3.77 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 1.08 0.00 0.00 1.00 0.00 0.00 55 K 8.51 3.99 0.00 1.95 1.82 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.67 7.81 56 A 7.95 3.99 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 57 V 7.53 3.80 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 0.88 0.00 0.00 1.09 0.00 0.00 58 C 8.03 4.04 0.00 2.96 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 59 S 7.80 4.66 0.00 3.86 3.82 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 60 Q 7.97 4.56 0.00 2.25 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.90 0.00 0.00 0.00 0.00 0.00 2.34 2.28 0.00 61 K 8.31 4.15 0.00 1.99 1.86 0.00 1.61 0.00 0.00 1.54 0.00 0.00 2.73 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.37 7.81 62 K 8.63 3.98 0.00 1.64 1.57 0.00 0.61 0.00 0.00 1.37 0.00 0.00 2.75 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.23 1.21 7.81 63 V 8.49 4.53 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 0.67 0.00 0.00 0.86 0.00 0.00 64 T 8.26 4.24 4.19 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 1.20 0.00 0.00 65 C 8.80 4.64 0.00 3.20 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 66 K 9.31 3.77 0.00 1.86 1.85 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.38 7.81 67 D 8.09 4.61 0.00 2.81 2.74 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 68 G 8.06 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 0.00 0.00 0.00 69 Q 8.42 4.28 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.90 0.00 0.00 0.00 0.00 0.00 2.36 2.27 0.00 70 T 8.12 4.81 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 1.17 0.00 0.00 71 N 7.88 5.13 0.00 2.96 3.02 0.00 0.00 6.03 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 72 C 7.74 5.42 0.00 3.14 2.95 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 73 Y 9.15 5.16 0.00 2.84 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 74 Q 9.26 5.24 0.00 2.02 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.97 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 75 S 9.10 4.61 0.00 3.96 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 76 K 9.33 4.13 0.00 1.79 1.94 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.67 1.57 7.81 77 S 7.67 4.85 0.00 3.84 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 7.97 4.12 4.16 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 0.99 0.00 0.00 79 M 9.06 4.94 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 80 R 8.99 4.69 0.00 1.97 1.89 0.00 3.11 0.00 0.00 3.51 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 81 I 8.94 5.10 1.85 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 1.40 0.88 1.04 0.00 0.00 82 T 8.63 5.02 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 1.23 0.00 0.00 83 D 9.59 5.03 0.00 2.74 2.61 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 0.00 0.00 0.00 0.00 84 C 9.15 5.56 0.00 2.90 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 85 R 8.73 5.35 0.00 1.83 1.84 0.00 3.16 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 86 E 9.05 4.17 0.00 1.98 1.84 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 2.21 2.07 0.00 87 T 8.78 4.29 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 1.22 0.00 0.00 88 G 8.90 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 89 S 7.94 4.22 0.00 3.85 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 90 S 7.95 4.23 0.00 3.67 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.93 4.21 0.00 1.78 1.58 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.34 1.36 7.81 92 Y 8.86 4.43 0.00 2.91 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 93 P 0.00 3.13 0.00 1.71 1.05 0.00 3.61 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 94 N 7.85 4.76 0.00 2.90 2.73 0.00 0.00 7.05 7.81 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 95 C 7.99 4.67 0.00 3.08 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 96 A 8.87 5.01 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 97 Y 9.51 5.28 0.00 2.84 2.88 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 98 K 9.37 4.60 0.00 1.81 1.73 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.58 7.81 99 T 8.59 5.04 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 1.32 0.00 0.00 100 T 8.96 4.56 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 1.23 0.00 0.00 101 Q 8.69 4.92 0.00 1.89 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.72 0.00 0.00 0.00 0.00 0.00 2.17 2.28 0.00 102 V 8.45 4.46 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 0.61 0.00 0.00 0.95 0.00 0.00 103 E 8.61 5.13 0.00 1.80 1.83 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 2.19 2.29 0.00 104 K 8.72 4.68 0.00 1.74 1.81 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.45 7.81 105 H 9.75 4.83 0.00 3.19 3.21 0.00 5.57 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.11 4.85 1.68 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 1.25 0.79 1.11 0.00 0.00 107 I 8.65 4.93 1.86 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 1.16 0.70 0.82 0.00 0.00 108 V 8.93 4.81 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 0.51 0.00 0.00 0.93 0.00 0.00 109 A 8.94 4.98 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 0.00 110 C 9.13 5.43 0.00 2.80 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 0.00 111 G 9.14 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 0.00 112 G 9.33 4.02 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 0.00 0.00 0.00 113 K 8.13 4.40 0.00 1.66 1.66 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.41 7.81 114 P 0.00 4.30 0.00 2.19 2.03 0.00 3.81 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 115 S 8.29 4.68 0.00 3.87 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 0.00 116 V 8.48 4.60 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 0.75 0.00 0.00 0.98 0.00 0.00 117 P 0.00 4.84 0.00 1.96 2.02 0.00 3.61 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 118 V 8.79 4.49 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 0.74 0.00 0.00 1.01 0.00 0.00 119 H 7.78 4.55 0.00 3.22 3.11 0.00 5.85 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.82 4.38 0.00 3.04 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 0.00 121 D 8.57 4.61 0.00 2.63 2.61 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 0.00 0.00 0.00 0.00 122 A 6.79 4.72 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 0.00 123 S 8.50 5.20 0.00 4.04 4.13 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 0.00 124 V 9.04 4.11 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 0.62 0.00 0.00 0.94 0.00 0.00