NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 L 4.3925 8.1693 122.4908 54.7790 43.3440 177.0782 4 S 4.2735 8.6821 121.4060 56.6602 65.1660 173.6948 5 Q 3.9466 8.4644 122.6535 59.6004 29.0845 179.6939 6 E 3.9615 8.1210 117.8132 59.2523 29.7945 178.8236 7 E 3.9215 7.9281 119.5097 59.4803 29.6208 179.2500 8 S 4.1624 8.2230 115.2543 62.0808 62.7814 177.0567 9 T 3.9044 8.1805 118.4554 66.4778 68.0675 176.7070 10 L 3.9776 7.9648 120.9705 57.8102 41.6151 179.4966 11 I 3.6892 7.6195 119.2507 64.5320 36.9815 178.3197 12 E 3.9618 8.2119 119.1782 59.5020 29.2962 179.7228 13 R 3.8804 8.3760 118.2295 59.1898 30.1590 179.0208 14 A 4.0226 8.2680 120.8104 55.3641 18.3381 179.8884 15 T 3.8084 8.1565 114.1105 66.7617 68.3454 176.7839 16 A 4.0044 8.0397 121.6456 55.3650 18.7613 179.5532 17 T 3.9411 7.9025 114.1727 66.9932 68.1076 176.7980 18 I 3.7718 7.8745 120.3718 64.0373 37.8291 177.3029 19 N 4.5789 8.2956 116.0552 54.8468 38.5075 176.3163 20 S 4.5588 7.6960 114.3289 57.5669 64.0228 173.7413 21 I 4.5290 6.4624 114.8161 58.0636 39.7667 173.7667 22 P 4.3691 0.0000 0.0000 62.4896 31.7474 176.6299 23 I 3.8369 8.1825 122.6011 61.7446 37.5047 175.6523 24 S 4.6491 8.2216 118.2932 56.9367 65.2738 173.5986 25 E 4.1593 8.6164 124.8691 57.9554 30.0633 177.4417 26 D 4.3870 7.9913 118.9256 55.5620 41.3225 175.0226 27 Y 5.5713 7.4545 115.7128 55.9946 38.7873 174.5398 28 S 4.8184 10.0207 117.1842 57.3027 65.5530 173.8699 29 V 4.8995 8.0656 120.2871 61.2658 35.0220 173.7731 30 A 5.3287 8.9144 128.4216 50.3797 22.4983 175.1249 31 S 5.1558 9.1337 113.1178 56.6057 66.7356 172.7106 32 A 5.3282 8.8674 124.8520 50.2810 22.6134 174.9796 33 A 5.2053 9.1376 122.0473 50.1140 23.2727 174.5939 34 L 5.0539 8.7705 122.8807 53.6039 44.2349 175.7421 35 S 5.3394 8.9199 121.2741 56.8262 64.9816 175.6017 36 S 4.2182 8.9182 116.7486 60.8667 62.8887 174.7267 37 D 4.6530 8.1944 119.2369 53.0393 39.5604 176.2746 38 G 3.8034 8.6783 106.5834 46.4102 0.0000 173.4591 39 R 4.6465 7.9149 115.3253 54.2180 35.4657 175.2397 40 I 4.8095 7.6564 120.2817 59.5151 40.4099 175.0000 41 F 4.9893 9.1336 125.3042 55.8089 42.1432 174.5507 42 T 5.5550 7.6294 111.7043 59.0670 72.1358 172.4745 43 G 4.0967 7.7624 106.5098 46.1711 0.0000 172.5463 44 V 5.2559 8.3203 112.8927 58.8646 35.3116 175.4912 45 N 4.8283 8.7341 120.0966 53.0788 38.6774 175.1672 46 V 4.5355 8.8975 119.7519 61.0725 33.9832 173.7013 47 Y 4.3312 8.7517 130.3294 57.7285 39.2999 174.5930 48 H 4.7358 7.8020 124.1287 54.6703 32.8682 174.2189 49 F 4.1166 8.5722 121.2669 59.8422 37.7497 176.0703 50 T 3.8870 6.9556 109.0557 61.8811 68.9153 174.5815 51 G 3.8154 8.0617 110.6479 45.1555 0.0000 174.4240 52 G 4.4226 7.8927 104.9043 44.8980 0.0000 172.5962 53 P 4.5501 0.0000 0.0000 62.5931 32.7108 175.7804 54 C 4.5858 8.7221 119.4322 59.6563 29.1889 174.4388 55 A 3.9674 8.8838 122.3787 55.7559 17.3113 179.9686 56 E 3.9251 8.1857 116.3408 59.6284 29.5456 179.4700 57 L 4.0772 7.7529 118.5605 57.4511 41.8180 179.3568 58 V 3.5657 7.8219 118.4315 65.9320 31.4156 178.0874 59 V 3.6341 8.0631 118.1794 66.1907 31.3523 177.8978 60 L 4.0860 8.1134 118.6740 57.9113 41.4914 179.8485 61 G 3.6057 8.1653 105.4587 47.6473 0.0000 176.1548 62 T 3.8640 7.9262 117.9392 66.4060 68.4836 176.7073 63 A 2.5800 8.0831 122.8542 54.5999 18.3406 179.5154 64 A 3.7994 7.9257 118.9988 55.2185 18.2174 179.7186 65 A 3.9794 7.8892 117.8695 54.1875 18.4282 178.6109 66 A 4.4367 7.0011 115.5704 50.6087 19.7191 176.3405 67 A 3.6069 8.0314 120.2691 53.5142 16.6280 179.9190 68 A 3.9200 8.0778 124.3236 54.0607 19.7977 180.9529 69 G 3.6739 7.0778 104.2048 46.6113 0.0000 175.3802 70 N 4.5471 8.6843 122.4439 52.9937 38.9207 173.6535 71 L 4.9276 8.2913 123.5341 53.7312 43.3565 176.2719 72 T 4.5463 8.8161 112.7100 62.4501 71.3968 173.6719 73 C 5.2312 7.7398 120.8541 58.1871 35.2398 172.3963 74 I 5.2947 8.7275 124.0949 59.6450 41.7654 173.9785 75 V 4.9199 8.7422 125.0964 60.2200 35.3416 173.4444 76 A 5.2862 8.5675 122.3585 50.2990 22.7172 174.9450 77 I 4.9062 9.0580 121.7386 59.4020 40.7182 175.5938 78 G 4.2436 8.8799 114.8643 45.5422 0.0000 173.0149 79 N 4.6810 8.9727 120.0783 51.9064 39.2581 174.1512 80 E 3.8695 9.3656 115.0591 57.7955 26.9536 174.7055 81 N 4.3010 8.3193 109.2901 54.5679 36.1559 176.3304 82 R 4.0277 7.8439 118.8396 56.9424 31.2047 179.1350 83 G 3.8172 7.9991 106.2587 45.2580 0.0000 172.1643 84 I 4.3451 8.3737 122.4757 61.4919 37.7550 175.6876 85 L 4.8116 8.5002 127.2386 52.6685 43.7975 176.8744 86 S 4.4531 8.7576 120.1582 57.5234 63.6041 172.6225 87 P 4.5506 0.0000 0.0000 62.1841 31.7235 176.5244 88 C 4.5617 8.4995 116.4535 57.7252 31.8744 174.8813 89 G 3.6261 8.5591 107.0542 47.9582 0.0000 175.7810 90 R 3.9022 7.9202 120.4314 59.4196 30.2251 178.2088 91 C 4.1319 8.0413 116.0336 62.8990 28.0903 176.0064 92 R 3.9512 8.2831 119.9190 59.3164 29.6688 178.9215 93 Q 3.9159 8.0886 119.1641 59.2287 29.0988 178.4234 94 V 3.5983 7.9261 119.3125 65.8865 31.5307 177.9225 95 L 3.9980 8.4064 119.1345 57.7780 41.2865 179.1961 96 L 3.9790 7.9603 119.1764 58.4278 42.0830 178.4972 97 D 4.4840 8.0808 117.6751 56.5078 40.8849 177.7937 98 L 4.5112 7.9715 117.5476 54.9095 44.3251 176.6967 99 H 4.9597 8.4997 115.9989 53.3470 29.3682 172.3654 100 P 4.2770 0.0000 0.0000 65.2115 31.6944 178.3286 101 G 3.8557 7.9474 105.8681 45.8040 0.0000 173.4734 102 I 4.2019 7.9501 121.5381 60.8133 39.5021 174.7303 103 K 5.1115 8.8883 126.0723 54.6833 35.1280 174.9709 104 A 5.2816 8.7449 124.5471 50.1970 21.9806 175.6057 105 I 4.5038 8.5481 123.5048 61.0901 38.0951 175.8634 106 V 4.6224 8.8864 119.6157 59.4047 36.6470 174.4335 107 K 4.8213 8.5107 121.0837 55.9541 33.2264 177.6905 108 D 4.7378 8.9863 124.8040 52.2437 41.4124 176.9352 109 S 4.1614 8.5702 112.5556 61.4122 62.9116 174.6125 110 D 4.4922 8.3026 118.4600 54.2552 41.0155 177.0639 111 G 3.9163 8.2657 107.6809 45.4370 0.0000 173.2413 112 Q 4.6333 8.2606 118.6832 53.3878 31.0168 173.5878 113 P 4.8494 0.0000 0.0000 63.2460 32.2328 175.8057 114 T 4.6886 9.2067 117.9580 60.4898 71.3025 172.0910 115 A 5.0049 8.6489 130.1907 50.9463 20.1140 176.7059 116 V 4.4437 8.6956 116.4303 58.9899 35.4853 176.0718 117 G 3.9309 8.7035 113.0964 45.6629 0.0000 174.2040 118 I 3.6783 8.4003 123.0635 64.2187 37.9722 178.6537 119 R 3.9819 7.9931 118.3626 59.1848 29.6983 178.5839 120 E 4.0710 8.0842 117.4867 58.6843 29.4904 178.4006 121 L 4.4468 7.6411 117.0959 54.6613 43.4714 176.7405 122 L 4.7958 7.3298 117.9405 52.2696 41.7797 174.2687 123 P 4.5216 0.0000 0.0000 61.9641 32.8060 177.5999 124 S 4.2863 8.4319 112.6794 58.7302 63.0730 174.0558 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 3 L 8.17 4.39 0.00 1.60 1.64 1.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.68 4.27 0.00 4.09 3.99 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 5 Q 8.46 3.95 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.94 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 6 E 8.12 3.96 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 2.34 0.00 7 E 7.93 3.92 0.00 2.17 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 2.33 2.35 0.00 8 S 8.22 4.16 0.00 4.00 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 9 T 8.18 3.90 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 1.19 0.00 0.00 10 L 7.96 3.98 0.00 1.88 1.72 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.62 3.69 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.71 0.91 0.00 0.00 12 E 8.21 3.96 0.00 2.14 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 2.45 2.49 0.00 13 R 8.38 3.88 0.00 1.78 1.95 0.00 3.26 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.75 0.00 14 A 8.27 4.02 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 15 T 8.16 3.81 4.39 0.00 0.00 0.00 0.00 0.00 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 16 A 8.04 4.00 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 17 T 7.90 3.94 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 18 I 7.87 3.77 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.25 0.98 0.00 0.00 19 N 8.30 4.58 0.00 2.83 2.87 0.00 0.00 6.99 7.14 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 20 S 7.70 4.56 0.00 4.05 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 21 I 6.46 4.53 1.88 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.75 0.96 0.00 0.00 22 P 0.00 4.37 0.00 2.11 2.06 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 23 I 8.18 3.84 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 1.31 0.48 0.92 0.00 0.00 24 S 8.22 4.65 0.00 3.87 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 25 E 8.62 4.16 0.00 1.87 1.80 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 2.22 2.26 0.00 26 D 7.99 4.39 0.00 1.70 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 0.00 0.00 0.00 27 Y 7.45 5.57 0.00 2.97 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 28 S 10.02 4.82 0.00 3.81 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 0.00 29 V 8.07 4.90 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 1.08 0.00 0.00 0.98 0.00 0.00 30 A 8.91 5.33 1.27 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 31 S 9.13 5.16 0.00 3.86 3.67 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 32 A 8.87 5.33 1.25 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 0.00 0.00 33 A 9.14 5.21 1.25 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 0.00 0.00 34 L 8.77 5.05 0.00 1.77 1.54 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.92 5.34 0.00 4.20 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 0.00 36 S 8.92 4.22 0.00 4.01 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 37 D 8.19 4.65 0.00 2.83 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 38 G 8.68 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 0.00 0.00 0.00 39 R 7.91 4.65 0.00 1.67 1.19 0.00 3.16 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.60 0.00 40 I 7.66 4.81 1.70 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 1.27 0.49 0.83 0.00 0.00 41 F 9.13 4.99 0.00 3.05 2.94 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 42 T 7.63 5.56 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 1.21 0.00 0.00 43 G 7.76 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 8.32 5.26 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 0.80 0.00 0.00 0.90 0.00 0.00 45 N 8.73 4.83 0.00 2.95 2.95 0.00 0.00 6.63 7.83 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 46 V 8.90 4.54 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 1.07 0.00 0.00 1.06 0.00 0.00 47 Y 8.75 4.33 0.00 3.06 2.82 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 48 H 7.80 4.74 0.00 3.08 2.97 0.00 5.73 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 F 8.57 4.12 0.00 3.15 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 50 T 6.96 3.89 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 0.48 0.00 0.00 51 G 8.06 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 0.00 0.00 0.00 52 G 7.89 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 0.00 0.00 0.00 0.00 53 P 0.00 4.55 0.00 2.13 2.18 0.00 3.70 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 54 C 8.72 4.59 0.00 2.91 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 55 A 8.88 3.97 1.45 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 56 E 8.19 3.93 0.00 2.08 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 2.42 2.49 0.00 57 L 7.75 4.08 0.00 1.80 1.70 0.91 0.86 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 58 V 7.82 3.57 2.25 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 1.00 0.00 0.00 1.02 0.00 0.00 59 V 8.06 3.63 2.29 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 1.15 0.00 0.00 1.05 0.00 0.00 60 L 8.11 4.09 0.00 1.92 1.71 0.96 0.77 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 61 G 8.17 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 62 T 7.93 3.86 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 63 A 8.08 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 7.93 3.80 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 65 A 7.89 3.98 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 66 A 7.00 4.44 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 67 A 8.03 3.61 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 68 A 8.08 3.92 1.07 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 0.00 0.00 69 G 7.08 3.67 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 0.00 0.00 0.00 70 N 8.68 4.55 0.00 2.83 2.80 0.00 0.00 6.79 6.74 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 71 L 8.29 4.93 0.00 1.33 1.51 0.82 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 72 T 8.82 4.55 4.25 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 1.22 0.00 0.00 73 C 7.74 5.23 0.00 2.98 2.75 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 74 I 8.73 5.29 1.88 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 1.30 1.75 0.95 0.00 0.00 75 V 8.74 4.92 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 0.65 0.00 0.00 0.94 0.00 0.00 76 A 8.57 5.29 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 77 I 9.06 4.91 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 1.17 1.04 0.97 0.00 0.00 78 G 8.88 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 0.00 0.00 0.00 0.00 79 N 8.97 4.68 0.00 2.80 3.10 0.00 0.00 7.26 7.76 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 80 E 9.37 3.87 0.00 2.11 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 2.23 2.31 0.00 81 N 8.32 4.30 0.00 2.86 2.92 0.00 0.00 7.22 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 82 R 7.84 4.03 0.00 1.82 2.00 0.00 3.26 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 83 G 8.00 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 0.00 0.00 0.00 84 I 8.37 4.35 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 1.35 0.58 0.95 0.00 0.00 85 L 8.50 4.81 0.00 1.50 1.57 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.76 4.45 0.00 3.76 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 87 P 0.00 4.55 0.00 2.18 2.07 0.00 3.38 0.00 0.00 3.48 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 88 C 8.50 4.56 0.00 3.18 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 89 G 8.56 3.63 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 0.00 0.00 0.00 90 R 7.92 3.90 0.00 1.88 1.93 0.00 3.17 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 91 C 8.04 4.13 0.00 3.15 2.98 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 92 R 8.28 3.95 0.00 2.00 1.99 0.00 3.13 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 93 Q 8.09 3.92 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 94 V 7.93 3.60 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.00 0.00 0.00 95 L 8.41 4.00 0.00 1.89 1.72 0.96 0.54 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 96 L 7.96 3.98 0.00 1.68 1.90 0.92 1.41 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 97 D 8.08 4.48 0.00 2.74 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 98 L 7.97 4.51 0.00 1.63 1.53 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 99 H 8.50 4.96 0.00 3.09 3.15 0.00 5.62 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 0.00 100 P 0.00 4.28 0.00 2.18 2.30 0.00 3.75 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 101 G 7.95 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 0.00 0.00 0.00 102 I 7.95 4.20 2.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.31 0.96 0.00 0.00 103 K 8.89 5.11 0.00 1.74 1.73 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.37 7.81 104 A 8.74 5.28 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.55 4.50 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.59 0.92 0.00 0.00 106 V 8.89 4.62 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 0.73 0.00 0.00 0.94 0.00 0.00 107 K 8.51 4.82 0.00 1.64 1.74 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.44 7.81 108 D 8.99 4.74 0.00 2.86 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 0.00 109 S 8.57 4.16 0.00 4.00 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 0.00 110 D 8.30 4.49 0.00 2.81 2.75 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 0.00 111 G 8.27 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 0.00 112 Q 8.26 4.63 0.00 2.30 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.47 6.93 0.00 0.00 0.00 0.00 0.00 2.31 2.47 0.00 113 P 0.00 4.85 0.00 1.93 1.99 0.00 3.64 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 114 T 9.21 4.69 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 1.29 0.00 0.00 115 A 8.65 5.00 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 0.00 116 V 8.70 4.44 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 0.75 0.00 0.00 0.95 0.00 0.00 117 G 8.70 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 0.00 118 I 8.40 3.68 1.99 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 1.53 1.21 0.99 0.00 0.00 119 R 7.99 3.98 0.00 1.90 1.97 0.00 3.19 0.00 0.00 3.34 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 120 E 8.08 4.07 0.00 2.16 2.02 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 2.35 2.40 0.00 121 L 7.64 4.45 0.00 1.80 1.71 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 122 L 7.33 4.80 0.00 1.62 1.57 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 123 P 0.00 4.52 0.00 2.18 2.05 0.00 3.77 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 1.99 1.95 0.00 124 S 8.43 4.29 0.00 4.00 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