NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1586 8.1727 122.0491 56.2754 34.1103 174.0807 2 V 4.5841 8.1537 127.0175 60.5531 32.4958 174.3723 3 F 4.4495 9.8904 128.8029 57.6743 40.1449 174.8513 4 E 4.2303 9.2179 121.3907 55.5135 31.0018 176.6238 5 R 3.3424 9.0598 120.3269 61.0938 29.9504 179.3108 6 C 4.3406 8.0452 115.5762 59.6335 36.9634 175.8682 7 E 3.8887 8.0883 120.8116 59.2355 29.3889 178.4545 8 L 3.4806 8.0427 120.1696 57.7488 41.9888 178.5564 9 A 3.9120 7.8533 120.7272 55.4571 18.2443 179.9291 10 R 3.8690 7.9625 116.4247 59.4889 30.2104 179.3752 11 T 3.8462 7.8368 115.5945 66.6955 68.5799 176.6268 12 L 3.8377 8.2107 121.1283 57.4721 41.5200 179.4288 13 K 3.8886 8.1522 119.6293 59.7455 31.9481 178.9925 14 R 3.9382 7.9882 117.1215 59.0697 29.9975 178.1275 15 L 4.3598 7.3942 115.5653 54.2891 41.6467 176.9618 16 G 3.8396 8.1062 107.0845 47.0709 0.0000 175.0567 17 M 4.0009 7.7444 120.3775 55.9685 32.5259 175.7994 18 D 4.4927 7.9829 117.6620 56.6280 40.5449 175.7374 19 G 3.9415 9.6171 116.2852 44.8892 0.0000 170.8763 20 Y 4.1985 8.1618 121.3572 58.8252 38.8829 176.4193 21 R 3.3331 8.9948 127.4063 57.3015 27.7319 177.3995 22 G 3.8107 8.2124 103.5196 45.6654 0.0000 174.0379 23 I 3.9694 7.4158 122.2010 59.3843 37.7163 176.0378 24 S 4.6499 8.2669 120.2136 57.6030 64.0387 174.9760 25 L 4.2385 8.6065 122.6275 58.4499 41.7578 179.0834 26 A 4.1612 8.1731 120.2186 55.2357 18.2421 179.3103 27 N 4.4558 8.0822 114.9362 56.3972 38.6363 177.6625 28 W 4.3177 8.0082 119.8458 60.0591 29.1282 178.3934 29 M 4.1235 8.4551 118.8159 58.5439 31.5576 177.9851 30 C 3.1745 8.0466 118.6384 59.0269 41.6745 175.3258 31 L 3.9809 8.2064 121.8496 58.2461 41.8094 178.6671 32 A 4.3784 8.3434 122.0776 54.3917 18.2502 179.5326 33 K 2.9591 8.1803 118.0050 59.3081 32.0350 179.0604 34 W 4.3264 7.5358 116.9139 59.0847 29.1508 178.4269 35 E 4.3783 8.5731 118.9867 58.8258 29.4480 178.0651 36 S 4.5114 7.9867 108.9387 57.1004 64.9715 174.4170 37 G 3.6131 8.4125 108.2193 46.9479 0.0000 173.5386 38 Y 3.6743 7.7170 113.7941 58.7132 34.5717 168.2581 39 N 5.3797 7.7989 118.9619 52.0703 40.1329 175.4606 40 T 4.2256 8.9954 117.6245 63.7089 69.9747 175.9234 41 R 4.5859 8.3123 117.1547 55.7464 30.4578 176.5993 42 A 4.3697 7.7763 122.5329 52.7653 19.3846 177.2525 43 T 5.5791 8.2102 110.6558 59.7482 72.4786 173.3747 44 N 4.8956 8.3816 120.2030 51.9603 42.5413 173.0401 45 Y 4.5894 8.7364 125.6827 57.4359 40.8571 174.0594 46 N 4.8623 8.1494 123.0238 50.9573 39.8931 175.0095 47 A 3.5821 8.2627 127.6523 54.6338 18.9912 178.8877 48 G 3.8861 8.1200 104.3693 48.3298 0.0000 173.7334 49 D 4.6620 7.3841 114.4242 52.0125 40.3300 176.1328 50 R 4.0934 8.2922 116.4489 56.9994 28.3027 176.1215 51 S 4.7778 7.5746 114.0982 57.8440 65.6309 173.0526 52 T 5.0419 8.6858 115.6461 61.9352 72.9516 172.9719 53 D 5.2940 9.0541 125.7613 53.6523 42.6835 174.9889 54 Y 5.0796 9.2170 121.8105 57.4908 41.1696 177.4209 55 G 4.3758 8.9843 111.7830 46.2766 0.0000 173.5284 56 I 4.2372 8.0705 116.3651 62.7910 38.0121 177.8328 57 F 4.9789 7.9600 115.8045 56.3980 40.0575 175.0712 58 Q 3.5846 7.9248 119.2555 57.0887 26.6352 174.3735 59 I 4.2922 8.2134 118.8339 61.2027 39.0278 176.7833 60 N 5.4026 9.2166 126.3779 53.2202 39.7809 175.7329 61 S 4.7415 9.1033 120.6865 60.2270 63.4180 175.4129 62 R 3.7556 9.0492 122.6855 58.9527 30.4398 177.6667 63 Y 4.2530 7.7795 114.6183 58.6309 40.3873 177.4833 64 W 4.7710 8.4319 119.3832 58.0376 30.0824 173.8837 65 C 5.6511 7.9827 110.6972 53.4241 45.2047 171.8262 66 N 5.0044 8.9187 119.9046 52.2172 39.6000 174.9231 67 D 4.8342 8.5166 122.8287 52.1427 40.4290 176.9930 68 G 3.9315 8.4878 107.4787 46.1851 0.0000 174.4699 69 K 4.3824 8.0473 116.9236 56.3008 33.1421 175.9930 70 V 4.1640 7.5820 120.1231 61.0530 32.3271 173.2068 71 P 4.3087 0.0000 0.0000 65.0377 31.2305 176.7375 72 G 3.9040 7.8213 106.7427 43.7731 0.0000 171.0424 73 A 4.6604 8.1604 125.6477 50.6718 22.6785 174.5000 74 V 4.3672 8.6848 112.1272 59.4400 35.7449 176.2185 75 N 4.9431 8.0755 118.1272 51.6723 37.6859 174.3071 76 A 3.9716 9.1635 125.2953 55.0117 19.0683 178.4772 77 C 4.6217 8.7291 111.0112 57.2128 41.0179 173.0536 78 H 4.0287 7.9185 116.5700 56.7283 26.4653 174.3846 79 L 4.8501 8.2609 117.2587 52.8003 46.2910 176.7832 80 S 4.6152 8.3717 115.7489 58.0159 63.2916 175.9956 81 C 4.0584 8.7515 124.3800 59.5500 38.9305 176.3555 82 S 3.9209 7.8010 114.7120 61.3298 61.6746 175.9000 83 A 4.0237 7.8362 122.4115 54.5583 18.0564 177.9582 84 L 4.4745 7.7740 116.1440 54.9437 41.7503 177.5805 85 L 5.1064 7.9738 117.3291 54.4612 42.5985 176.8199 86 Q 4.3270 7.8353 117.7551 55.4163 29.4596 176.0385 87 D 4.3901 8.5386 120.2174 57.0391 41.1454 176.6197 88 N 4.5818 8.0215 118.2328 53.0914 39.2454 174.7525 89 I 4.1860 8.4262 118.7616 61.0201 38.0466 176.9883 90 A 3.9340 8.1133 124.6202 55.9714 18.2067 179.9013 91 D 4.2750 8.0729 116.4372 57.4177 40.8793 178.7233 92 A 4.1111 7.9528 120.9143 55.0685 18.3691 179.7408 93 V 3.4210 8.2820 117.1110 65.9929 31.7286 178.0611 94 A 3.8223 7.9988 120.6537 55.3138 18.1192 178.8584 95 C 4.2368 8.3644 116.7290 59.6517 37.9213 175.5429 96 A 4.0084 8.2674 122.7987 55.1055 17.5877 179.8366 97 K 3.8449 7.7231 116.2794 59.3633 32.3390 179.1662 98 R 4.0861 7.6856 118.6264 59.4336 30.1402 178.4800 99 V 2.6673 7.7269 118.2539 65.9951 31.1646 178.2274 100 V 4.0296 7.7498 110.1230 63.2945 31.2283 178.2540 101 R 4.1188 7.7687 117.3521 57.4173 30.3600 176.5089 102 D 4.7337 7.5310 119.1442 52.4887 41.9765 175.3604 103 P 4.1827 0.0000 0.0000 66.4089 30.6454 177.6623 104 Q 4.0238 8.2407 118.3442 56.3344 29.9665 178.0324 105 G 3.9708 7.8395 106.4048 47.1391 0.0000 176.6254 106 I 3.5628 7.7444 122.7113 62.9169 37.8242 177.3806 107 R 4.4200 7.4514 117.5368 57.8070 30.0454 177.3784 108 A 4.2278 7.5911 120.4596 53.8424 18.5264 178.0033 109 W 4.5739 8.0986 115.7093 55.7256 29.9568 177.6566 110 V 3.7408 8.7651 123.4099 65.9988 30.9281 177.7118 111 A 4.0670 8.2987 120.2271 54.7405 18.1456 179.2592 112 W 3.9273 8.2264 126.8556 60.6396 30.6106 178.3388 113 R 3.7439 8.2689 116.1932 59.5352 29.6779 178.3433 114 N 4.4321 8.0890 114.6573 55.1083 38.7517 176.7708 115 R 4.2388 7.8280 116.2236 55.9898 31.1463 175.8653 116 C 4.5794 7.2184 113.5145 57.6112 43.3401 174.7368 117 Q 3.1119 6.8397 120.2351 57.2956 28.8869 175.7797 118 N 4.1681 8.5907 121.7609 54.7185 36.2784 173.6303 119 R 4.5595 7.5246 113.3106 54.1391 34.1845 175.6486 120 D 4.5670 8.4889 119.0883 53.9798 40.2254 175.9395 121 V 4.4953 8.1449 118.6568 61.2397 32.4937 178.3052 122 R 4.0117 8.0238 121.8850 59.4847 29.4732 178.4366 123 Q 3.9008 8.1352 116.7793 59.9385 27.8694 178.7759 124 Y 4.2221 7.7397 117.0655 59.8634 38.2714 176.9049 125 V 4.4461 7.9926 110.6310 60.5448 33.5826 175.4559 126 Q 4.2283 7.4983 120.5065 57.1815 28.7637 176.8717 127 G 3.9823 9.0190 111.1660 45.6658 0.0000 174.4621 128 C 4.4279 7.9691 115.7958 56.8016 40.6412 173.8547 129 G 3.8402 8.1043 107.1964 46.8881 0.0000 174.1429 130 V 4.0051 7.9045 117.9690 61.0768 32.0405 175.9245 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 8.17 4.16 0.00 2.06 1.63 0.00 1.23 0.00 0.00 0.94 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.89 1.12 7.81 2 V 8.15 4.58 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 0.91 0.00 0.00 0.95 0.00 0.00 3 F 9.89 4.45 0.00 2.86 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 4 E 9.22 4.23 0.00 1.96 1.88 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 2.32 2.25 0.00 5 R 9.06 3.34 0.00 1.99 1.92 0.00 3.42 0.00 0.00 3.49 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.84 0.00 6 C 8.05 4.34 0.00 3.01 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 7 E 8.09 3.89 0.00 2.07 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 2.67 2.43 0.00 8 L 8.04 3.48 0.00 1.29 1.37 -0.08 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.85 3.91 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 10 R 7.96 3.87 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 11 T 7.84 3.85 4.23 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 1.23 0.00 0.00 12 L 8.21 3.84 0.00 1.69 1.56 0.89 0.44 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 13 K 8.15 3.89 0.00 1.92 1.91 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.51 7.81 14 R 7.99 3.94 0.00 2.03 1.97 0.00 3.21 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 15 L 7.39 4.36 0.00 1.65 1.56 0.88 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.11 3.84 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 0.00 0.00 0.00 17 M 7.74 4.00 0.00 1.33 1.97 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.20 0.00 18 D 7.98 4.49 0.00 2.68 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 19 G 9.62 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 20 Y 8.16 4.20 0.00 3.38 3.27 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 21 R 8.99 3.33 0.00 1.83 1.81 0.00 3.33 0.00 0.00 2.96 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.29 0.00 22 G 8.21 3.81 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 0.00 23 I 7.42 3.97 1.72 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.67 -0.37 0.00 0.00 24 S 8.27 4.65 0.00 4.05 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 25 L 8.61 4.24 0.00 2.06 1.80 1.03 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.17 4.16 1.52 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 0.00 0.00 27 N 8.08 4.46 0.00 2.69 2.72 0.00 0.00 6.94 8.95 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 28 W 8.01 4.32 0.00 3.48 3.06 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 29 M 8.46 4.12 0.00 2.11 2.33 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.91 0.00 30 C 8.05 3.17 0.00 2.70 3.18 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 0.00 31 L 8.21 3.98 0.00 1.83 1.81 0.72 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.34 4.38 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 33 K 8.18 2.96 0.00 1.64 1.62 0.00 0.61 0.00 0.00 0.78 0.00 0.00 2.55 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.03 0.21 7.81 34 W 7.54 4.33 0.00 3.37 3.26 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 35 E 8.57 4.38 0.00 2.06 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 2.57 2.60 0.00 36 S 7.99 4.51 0.00 4.06 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 37 G 8.41 3.61 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 0.00 0.00 0.00 38 Y 7.72 3.67 0.00 3.23 3.03 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 0.00 0.00 0.00 39 N 7.80 5.38 0.00 2.85 2.82 0.00 0.00 7.01 6.71 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 40 T 9.00 4.23 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 1.45 0.00 0.00 41 R 8.31 4.59 0.00 1.87 2.09 0.00 3.08 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 1.82 1.59 0.00 42 A 7.78 4.37 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 43 T 8.21 5.58 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 1.31 0.00 0.00 44 N 8.38 4.90 0.00 2.74 2.74 0.00 0.00 6.70 7.48 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 45 Y 8.74 4.59 0.00 3.01 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 46 N 8.15 4.86 0.00 2.59 2.54 0.00 0.00 6.88 7.53 0.00 0.00 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 A 8.26 3.58 1.28 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 48 G 8.12 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 0.00 0.00 0.00 49 D 7.38 4.66 0.00 2.66 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 8.29 4.09 0.00 2.04 2.24 0.00 3.14 0.00 0.00 3.19 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 51 S 7.57 4.78 0.00 3.91 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 52 T 8.69 5.04 3.95 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 0.69 0.00 0.00 53 D 9.05 5.29 0.00 2.66 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 54 Y 9.22 5.08 0.00 2.95 2.89 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 55 G 8.98 4.38 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 0.00 56 I 8.07 4.24 1.69 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.89 0.09 0.00 0.00 57 F 7.96 4.98 0.00 3.23 3.03 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 0.00 0.00 0.00 58 Q 7.92 3.58 0.00 2.60 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.84 0.00 0.00 0.00 0.00 0.00 2.54 2.82 0.00 59 I 8.21 4.29 2.14 0.00 0.00 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 1.35 1.18 1.11 0.00 0.00 60 N 9.22 5.40 0.00 3.09 3.00 0.00 0.00 6.97 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 61 S 9.10 4.74 0.00 4.14 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 0.00 62 R 9.05 3.76 0.00 1.58 1.85 0.00 2.68 0.00 0.00 2.82 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.50 0.00 63 Y 7.78 4.25 0.00 1.92 1.72 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 0.00 0.00 0.00 0.00 64 W 8.43 4.77 0.00 3.62 3.30 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 65 C 7.98 5.65 0.00 3.18 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 66 N 8.92 5.00 0.00 2.80 2.70 0.00 0.00 7.00 9.11 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 67 D 8.52 4.83 0.00 2.84 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 68 G 8.49 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 0.00 0.00 0.00 69 K 8.05 4.38 0.00 1.89 1.93 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.54 7.81 70 V 7.58 4.16 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 0.78 0.00 0.00 1.08 0.00 0.00 71 P 0.00 4.31 0.00 2.06 2.13 0.00 3.67 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 72 G 7.82 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 A 8.16 4.66 1.14 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 0.00 0.00 74 V 8.68 4.37 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 0.63 0.00 0.00 0.92 0.00 0.00 75 N 8.08 4.94 0.00 2.76 2.58 0.00 0.00 6.75 8.20 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 76 A 9.16 3.97 1.20 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 0.00 0.00 0.00 77 C 8.73 4.62 0.00 3.28 3.25 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.92 4.03 0.00 3.29 3.36 0.00 5.79 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.26 4.85 0.00 1.69 1.50 1.00 0.67 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 80 S 8.37 4.62 0.00 3.83 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 81 C 8.75 4.06 0.00 2.22 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 82 S 7.80 3.92 0.00 3.88 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 83 A 7.84 4.02 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 84 L 7.77 4.47 0.00 1.91 1.81 1.06 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.97 5.11 0.00 1.75 1.70 1.10 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.84 4.33 0.00 2.24 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 87 D 8.54 4.39 0.00 2.61 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 88 N 8.02 4.58 0.00 2.69 2.74 0.00 0.00 6.96 7.94 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 89 I 8.43 4.19 1.73 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.99 0.97 0.00 0.00 90 A 8.11 3.93 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 91 D 8.07 4.27 0.00 2.71 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 92 A 7.95 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 93 V 8.28 3.42 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 0.77 0.00 0.00 0.86 0.00 0.00 94 A 8.00 3.82 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 95 C 8.36 4.24 0.00 3.07 3.29 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 96 A 8.27 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.72 3.84 0.00 1.57 1.33 0.00 1.24 0.00 0.00 0.61 0.00 0.00 2.38 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 0.87 7.81 98 R 7.69 4.09 0.00 2.01 2.15 0.00 3.28 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.92 0.00 99 V 7.73 2.67 1.87 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 -0.16 0.00 0.00 -0.66 0.00 0.00 100 V 7.75 4.03 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 1.11 0.00 0.00 1.41 0.00 0.00 101 R 7.77 4.12 0.00 2.11 2.07 0.00 3.25 0.00 0.00 3.32 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.80 0.00 102 D 7.53 4.73 0.00 3.07 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 0.00 103 P 0.00 4.18 0.00 2.15 2.21 0.00 3.80 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 104 Q 8.24 4.02 0.00 2.10 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.77 0.00 0.00 0.00 0.00 0.00 2.45 2.36 0.00 105 G 7.84 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 0.00 0.00 0.00 106 I 7.74 3.56 0.94 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.64 0.00 0.00 107 R 7.45 4.42 0.00 2.12 2.05 0.00 3.25 0.00 0.00 3.30 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.71 0.00 108 A 7.59 4.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.10 4.57 0.00 3.66 3.17 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 0.00 110 V 8.77 3.74 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 1.10 0.00 0.00 1.00 0.00 0.00 111 A 8.30 4.07 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.23 3.93 0.00 3.44 3.53 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.27 3.74 0.00 2.07 2.04 0.00 3.65 0.00 0.00 3.50 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.22 0.00 114 N 8.09 4.43 0.00 2.60 2.75 0.00 0.00 6.95 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 0.00 115 R 7.83 4.24 0.00 1.26 1.02 0.00 2.85 0.00 0.00 2.84 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.56 0.00 116 C 7.22 4.58 0.00 1.70 2.70 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 0.00 0.00 0.00 0.00 117 Q 6.84 3.11 0.00 0.93 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.72 0.00 0.00 0.00 0.00 0.00 2.20 2.20 0.00 118 N 8.59 4.17 0.00 2.76 2.80 0.00 0.00 6.84 7.66 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 0.00 119 R 7.52 4.56 0.00 1.81 1.78 0.00 3.13 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.38 0.00 120 D 8.49 4.57 0.00 2.63 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 0.00 121 V 8.14 4.50 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 1.01 0.00 0.00 1.07 0.00 0.00 122 R 8.02 4.01 0.00 1.92 2.01 0.00 3.31 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 123 Q 8.14 3.90 0.00 2.02 2.22 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 1.94 1.30 0.00 124 Y 7.74 4.22 0.00 3.22 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 0.00 125 V 7.99 4.45 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 1.01 0.00 0.00 1.06 0.00 0.00 126 Q 7.50 4.23 0.00 1.91 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.51 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 127 G 9.02 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 0.00 0.00 0.00 128 C 7.97 4.43 0.00 3.10 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 0.00 129 G 8.10 3.84 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 0.00 0.00 0.00 130 V 7.90 4.01 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 0.96 0.00 0.00