NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2272 8.3149 119.9825 56.3632 34.6623 176.5335 3 K 3.8971 7.8814 117.6144 57.1243 32.6332 171.6808 4 V 3.8908 8.3065 113.2276 61.0075 31.9148 174.8763 5 Q 4.6975 8.1992 122.4402 54.4584 32.8951 173.7444 6 A 5.1963 8.3653 123.0518 50.8488 23.1715 174.7238 7 Y 4.7391 7.4532 113.3674 56.5669 40.1909 174.7805 8 V 4.2617 7.5651 121.0151 61.2996 34.3096 171.0090 9 K 4.1853 8.0306 119.9467 55.6947 34.6248 173.4087 10 L 4.9439 8.1769 126.7636 52.9852 45.2091 175.3273 11 Q 4.3372 8.5817 117.7648 56.3461 29.3746 176.7372 12 V 4.5597 7.8729 114.9332 59.3542 35.9291 175.2607 13 A 3.9756 8.8266 128.0369 51.8664 18.6522 176.0263 14 A 4.2447 8.7359 126.6483 55.7397 17.3121 175.2725 15 G 3.4904 8.2320 113.1058 46.2444 0.0000 172.3541 16 M 4.5863 8.0249 119.6652 54.1965 33.0523 173.6106 17 A 4.5160 7.4545 125.4688 53.1938 26.3000 177.1065 18 N 4.7124 7.9611 115.3350 51.3154 40.9306 174.9930 19 P 4.6217 0.0000 0.0000 62.3220 32.2261 175.6419 20 S 4.1439 8.7494 110.3262 61.3042 63.0628 172.1697 21 P 4.4800 0.0000 0.0000 60.9026 32.0202 174.2321 22 P 4.3412 0.0000 0.0000 65.5677 31.8940 178.0793 23 V 3.8705 7.5233 120.6116 62.1314 28.3844 174.5573 24 G 4.1117 7.6396 109.7353 44.2379 0.0000 170.1478 25 P 4.1955 0.0000 0.0000 64.4223 32.6655 177.1948 26 A 4.1198 7.8051 122.6047 52.8520 18.8591 177.0365 27 L 4.4680 8.0789 120.2865 54.5984 39.3383 175.5448 28 G 4.2658 7.4528 105.7004 43.9755 0.0000 174.5369 29 Q 4.4760 7.5322 116.4204 55.8324 29.4193 176.0618 30 Q 4.3397 8.9152 116.7609 55.7116 29.6127 175.7700 31 G 2.2824 7.4723 111.3417 44.6541 0.0000 174.5566 32 V 4.0484 7.1495 120.3449 59.9302 33.0245 174.8424 33 N 4.7628 8.2330 120.8343 52.6019 40.0442 174.6231 34 I 3.7499 7.8982 121.1750 61.8816 37.9007 175.9160 35 M 3.7840 7.4354 117.3480 60.0662 33.1616 179.5478 36 E 4.4895 7.8263 125.4312 56.4046 29.9303 179.3087 37 F 3.4771 9.2937 124.4186 60.7282 40.0176 177.2962 38 C 4.2596 9.2771 121.5612 62.4324 31.4516 175.2228 39 K 4.5849 8.3439 117.0301 57.6208 31.9663 176.7565 40 A 4.4308 7.3829 119.8743 52.6279 19.2326 176.5218 41 F 4.1022 8.1052 117.9271 59.8777 41.3736 176.8723 42 N 4.3205 7.7831 115.9070 52.7280 37.1337 175.8905 43 A 4.5094 7.3833 120.8596 52.0060 20.6837 177.7164 44 K 4.1607 7.8125 115.2015 56.9714 33.7413 176.8080 45 T 4.4051 7.2491 109.7629 60.9533 67.9474 175.7782 46 D 4.7065 7.1554 120.2063 51.0618 41.4321 174.0269 47 S 5.1183 7.4435 120.5488 57.5708 65.0462 178.3453 48 I 4.5730 7.4463 116.0482 60.0938 38.6063 174.1077 49 E 4.2922 8.5794 119.6325 55.5236 30.0471 177.4809 50 K 3.6240 8.9014 123.9065 59.1870 33.1683 177.8134 51 G 4.0033 7.2685 109.2724 44.0862 0.0000 174.6604 52 L 4.6057 7.1818 118.3055 52.4061 43.2163 173.8833 53 P 4.8911 0.0000 0.0000 62.5816 28.5421 173.5625 54 I 4.1611 7.8225 122.5355 59.3100 39.6956 173.1550 55 P 4.8976 0.0000 0.0000 62.1025 29.7487 175.2127 56 V 4.0074 8.0767 120.9076 62.0348 32.6501 175.5399 57 V 4.2166 8.3271 125.4471 60.9998 32.3575 175.1407 58 I 4.7668 8.1944 125.1332 58.6636 41.0767 174.3615 59 T 4.8291 8.6544 128.0241 61.7561 66.1213 174.1263 60 V 4.3933 7.8388 115.2527 62.0317 33.9814 175.5480 61 Y 4.8050 7.9686 117.5139 57.2358 40.5568 174.0107 62 A 4.2136 8.4016 117.9843 52.0227 21.5831 175.5999 63 D 4.8134 7.4664 113.1051 54.3927 44.3346 175.4711 64 R 4.8835 7.9864 117.9768 57.7186 37.7400 176.8291 65 S 4.7578 7.9545 110.8276 58.5198 63.5347 172.0139 66 F 5.4511 7.4454 115.8594 57.2926 40.7203 173.0153 67 T 4.6212 8.6402 113.9362 63.4696 72.8412 173.1401 68 F 4.8932 8.4552 120.3762 56.7596 43.1684 175.4915 69 V 4.4025 8.5772 123.0592 61.7481 33.2427 171.8521 70 T 4.2108 8.4266 119.6919 61.6226 67.5380 172.9725 71 K 4.6053 8.4838 135.0000 55.6776 33.6818 175.1207 72 T 4.5139 8.1617 106.3851 60.3382 71.4780 172.7838 73 P 3.9857 0.0000 0.0000 62.6514 27.9293 172.5286 74 P 4.1660 0.0000 0.0000 63.9933 31.6422 176.6236 75 A 3.8759 9.0263 121.6248 53.0943 18.1940 177.3969 76 A 4.1351 9.0046 129.1934 52.9149 17.6185 179.0401 77 V 4.2220 7.2164 107.5237 61.3410 32.8787 177.7894 78 L 4.1621 8.4474 120.6343 55.9279 40.6469 176.3592 79 L 4.2418 8.1772 117.8590 56.9271 41.9029 178.2843 80 K 4.1849 7.4895 117.4137 57.9956 32.3414 177.1588 81 K 4.4582 7.8408 118.2506 56.3990 32.2302 176.3061 82 A 4.6097 7.8624 118.4694 51.6312 21.0432 177.6978 83 A 4.3949 7.9269 117.1255 50.9827 19.6483 175.4727 84 G 3.7598 7.8789 115.5299 45.1138 0.0000 172.1883 85 I 4.0326 8.1928 126.1897 62.7649 38.7563 177.5300 86 K 3.9822 8.1246 118.8143 58.9851 32.0663 177.4523 87 S 4.5305 7.9316 117.8960 56.8463 62.8973 173.2935 88 G 4.1577 8.1942 113.4208 43.0950 0.0000 171.0589 89 S 4.3228 8.5235 114.9170 57.1584 62.8294 174.0378 90 G 3.8904 9.0225 117.8566 47.9621 0.0000 173.4582 91 K 4.4751 7.5806 121.2039 53.2514 32.0673 172.9431 92 P 4.4287 0.0000 0.0000 64.5965 32.1997 175.8155 93 N 4.5662 8.9992 118.3173 53.7553 34.6417 175.9058 94 K 4.0608 7.6787 119.0593 58.4547 32.4123 175.4231 95 D 4.9558 7.7120 115.0358 51.3519 42.3025 173.2178 96 K 4.7070 8.3346 117.4164 55.3994 35.2858 175.3546 97 V 4.3623 8.1254 113.8013 63.5426 34.6265 174.0865 98 G 4.1615 7.5986 106.3226 44.9860 0.0000 171.3142 99 K 4.7369 8.1697 116.4647 55.6443 35.4201 175.3697 100 I 4.5531 7.5173 117.1036 59.9260 41.2325 175.4237 101 S 4.5600 8.4100 119.0565 56.8358 63.7396 174.9692 102 R 3.8582 8.4452 118.1409 58.9833 29.7994 178.9508 103 A 3.9573 8.1279 121.3410 55.3809 18.4624 178.8743 104 Q 4.2974 7.4722 112.0708 56.3857 28.6043 176.7295 105 L 4.5447 7.6682 121.9092 55.6781 43.6216 177.7093 106 Q 4.3912 7.5523 115.9440 56.9182 28.9502 176.9645 107 E 3.9895 8.1528 120.3080 59.2260 29.8391 178.2963 108 I 3.8032 7.6791 113.0676 62.6169 37.9768 175.9925 109 A 4.2556 7.0724 123.2766 52.4572 19.1413 178.4351 110 Q 3.8551 8.6550 120.1915 57.3941 27.8317 174.9781 111 T 4.2949 8.2608 113.5782 63.3588 68.8444 175.6158 112 K 4.3540 7.8010 116.1111 57.4997 34.9783 176.4364 113 A 4.0114 7.7540 123.2368 55.0936 18.3273 179.3681 114 A 4.4615 7.9147 115.8177 53.1576 18.0874 177.5246 115 D 4.6803 8.1825 114.2432 54.1011 44.0023 175.4207 116 M 4.5071 7.6168 119.0213 53.7716 32.1740 175.7274 117 T 4.3101 8.1619 115.8099 59.7874 67.8108 173.0184 118 G 4.0225 7.8888 115.5556 43.8957 0.0000 170.0931 119 A 4.0099 8.5992 127.6107 53.2442 18.8964 174.5262 120 D 4.5765 8.5434 124.5692 53.7299 40.8357 175.2974 121 I 3.6791 8.0382 114.9529 63.5683 37.8612 178.1350 122 E 3.9385 8.2041 118.7116 58.9089 29.2203 178.4752 123 A 4.1597 7.3690 120.4939 54.4143 17.6576 178.7644 124 M 4.1588 7.8132 117.0366 58.6641 32.1499 178.3221 125 T 4.0943 8.2194 110.6403 63.8957 70.1276 174.8645 126 R 4.4869 7.3732 119.9979 53.5586 26.7584 174.0674 127 S 4.6797 7.4468 118.7971 59.0612 70.0800 175.5743 128 I 4.1680 7.2672 115.4561 61.5950 37.6125 176.3729 129 E 4.3924 7.7842 117.6732 58.3702 29.6105 177.8476 130 G 3.8408 7.7305 105.3154 47.1682 0.0000 175.3321 131 T 4.0387 7.8655 114.9230 64.0517 68.7235 176.1492 132 A 4.3563 6.8459 123.8580 53.2047 18.7554 177.4716 133 R 4.6517 7.1913 113.5812 55.3845 34.3297 176.3104 134 S 4.5530 8.4168 114.0055 59.2465 64.5503 175.1966 135 M 4.5801 7.9357 116.5527 54.8256 33.2120 173.6434 136 G 3.6827 7.6940 106.5988 45.4502 0.0000 170.8013 137 L 3.4270 8.1561 117.2719 56.0522 41.7127 175.1132 138 V 4.3570 7.4891 122.8658 59.7068 33.2966 176.0832 139 V 3.6328 8.0986 120.5600 66.1886 31.7163 175.8725 140 E 4.1784 7.9921 122.6147 56.5940 29.4570 176.7508 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 K 8.31 4.23 0.00 1.84 1.98 0.00 1.50 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.27 1.43 7.81 3 K 7.88 3.90 0.00 1.81 1.87 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.45 7.81 4 V 8.31 3.89 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 0.68 0.00 0.00 0.64 0.00 0.00 5 Q 8.20 4.70 0.00 1.86 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.26 0.00 6 A 8.37 5.20 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 7 Y 7.45 4.74 0.00 2.99 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 8 V 7.57 4.26 1.89 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 0.51 0.00 0.00 0.86 0.00 0.00 9 K 8.03 4.19 0.00 1.69 1.69 0.00 1.69 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.53 1.39 7.81 10 L 8.18 4.94 0.00 1.63 1.53 0.92 0.75 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 11 Q 8.58 4.34 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.46 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 12 V 7.87 4.56 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 0.58 0.00 0.00 0.58 0.00 0.00 13 A 8.83 3.98 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 14 A 8.74 4.24 1.22 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 0.00 0.00 15 G 8.23 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 16 M 8.02 4.59 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.51 0.00 17 A 7.45 4.52 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 18 N 7.96 4.71 0.00 2.72 2.76 0.00 0.00 6.96 7.69 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 19 P 0.00 4.62 0.00 2.21 2.04 0.00 3.84 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 20 S 8.75 4.14 0.00 3.99 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 P 0.00 4.48 0.00 2.19 2.09 0.00 3.74 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 22 P 0.00 4.34 0.00 2.18 2.19 0.00 3.76 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 1.96 1.94 0.00 23 V 7.52 3.87 2.21 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 0.68 0.00 0.00 0.89 0.00 0.00 24 G 7.64 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 0.00 0.00 0.00 25 P 0.00 4.20 0.00 2.18 2.28 0.00 3.81 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 2.02 1.92 0.00 26 A 7.81 4.12 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 27 L 8.08 4.47 0.00 1.53 1.45 0.83 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 28 G 7.45 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 29 Q 7.53 4.48 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.70 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 30 Q 8.92 4.34 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.92 0.00 0.00 0.00 0.00 0.00 2.34 2.26 0.00 31 G 7.47 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 0.00 0.00 0.00 32 V 7.15 4.05 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 0.49 0.00 0.00 0.66 0.00 0.00 33 N 8.23 4.76 0.00 2.65 2.71 0.00 0.00 6.99 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 34 I 7.90 3.75 1.74 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 1.09 1.27 0.93 0.00 0.00 35 M 7.44 3.78 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.56 0.00 36 E 7.83 4.49 0.00 2.26 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 2.50 2.41 0.00 37 F 9.29 3.48 0.00 2.16 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 38 C 9.28 4.26 0.00 3.02 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 39 K 8.34 4.58 0.00 1.78 1.88 0.00 1.51 0.00 0.00 2.46 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.47 7.81 40 A 7.38 4.43 1.69 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 41 F 8.11 4.10 0.00 2.60 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 42 N 7.78 4.32 0.00 2.79 2.74 0.00 0.00 5.77 7.96 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 43 A 7.38 4.51 1.24 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 44 K 7.81 4.16 0.00 1.52 1.60 0.00 1.58 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.27 1.39 7.81 45 T 7.25 4.41 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 1.13 0.00 0.00 46 D 7.16 4.71 0.00 2.47 2.48 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 0.00 0.00 0.00 0.00 47 S 7.44 5.12 0.00 3.97 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 48 I 7.45 4.57 1.86 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.95 0.89 0.00 0.00 49 E 8.58 4.29 0.00 2.02 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 2.37 2.23 0.00 50 K 8.90 3.62 0.00 1.82 1.94 0.00 1.43 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.50 7.81 51 G 7.27 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 0.00 0.00 0.00 0.00 52 L 7.18 4.61 0.00 1.66 1.62 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.89 0.00 2.01 2.05 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 54 I 7.82 4.16 1.92 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.79 1.02 0.00 0.00 55 P 0.00 4.90 0.00 2.15 2.10 0.00 3.86 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 56 V 8.08 4.01 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 0.90 0.00 0.00 1.07 0.00 0.00 57 V 8.33 4.22 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 0.85 0.00 0.00 0.99 0.00 0.00 58 I 8.19 4.77 1.91 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.68 0.93 0.00 0.00 59 T 8.65 4.83 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 60 V 7.84 4.39 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 1.29 0.00 0.00 1.10 0.00 0.00 61 Y 7.97 4.80 0.00 3.18 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 62 A 8.40 4.21 1.16 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 0.00 0.00 0.00 63 D 7.47 4.81 0.00 2.68 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 64 R 7.99 4.88 0.00 1.84 1.96 0.00 3.26 0.00 0.00 3.32 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 65 S 7.95 4.76 0.00 3.76 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 66 F 7.45 5.45 0.00 3.06 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.64 4.62 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 1.24 0.00 0.00 68 F 8.46 4.89 0.00 2.97 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 69 V 8.58 4.40 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 0.94 0.00 0.00 0.99 0.00 0.00 70 T 8.43 4.21 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 1.23 0.00 0.00 71 K 8.48 4.61 0.00 1.77 1.71 0.00 1.68 0.00 0.00 1.79 0.00 0.00 3.13 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.50 7.81 72 T 8.16 4.51 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 1.23 0.00 0.00 73 P 0.00 3.99 0.00 2.16 2.23 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 74 P 0.00 4.17 0.00 2.18 2.08 0.00 3.74 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 2.00 1.99 0.00 75 A 9.03 3.88 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 76 A 9.00 4.14 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 77 V 7.22 4.22 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 1.01 0.00 0.00 78 L 8.45 4.16 0.00 1.81 1.85 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.18 4.24 0.00 1.78 1.72 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 80 K 7.49 4.18 0.00 1.87 1.87 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.68 1.52 7.81 81 K 7.84 4.46 0.00 1.69 1.78 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.48 7.81 82 A 7.86 4.61 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 83 A 7.93 4.39 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 84 G 7.88 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 0.00 0.00 0.00 85 I 8.19 4.03 1.94 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 1.42 1.16 0.91 0.00 0.00 86 K 8.12 3.98 0.00 1.79 1.85 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.43 7.81 87 S 7.93 4.53 0.00 3.97 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 88 G 8.19 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 0.00 0.00 0.00 0.00 89 S 8.52 4.32 0.00 3.95 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 90 G 9.02 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 91 K 7.58 4.48 0.00 1.87 1.94 0.00 1.53 0.00 0.00 1.87 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.32 7.81 92 P 0.00 4.43 0.00 2.17 2.08 0.00 3.78 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.04 0.00 93 N 9.00 4.57 0.00 2.90 3.35 0.00 0.00 6.05 7.13 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 94 K 7.68 4.06 0.00 1.84 1.87 0.00 1.63 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.42 7.81 95 D 7.71 4.96 0.00 2.76 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 96 K 8.33 4.71 0.00 1.84 1.83 0.00 1.55 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.29 1.32 7.81 97 V 8.13 4.36 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 0.95 0.00 0.00 0.93 0.00 0.00 98 G 7.60 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 0.00 0.00 0.00 0.00 99 K 8.17 4.74 0.00 1.80 1.73 0.00 1.44 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.30 1.52 7.81 100 I 7.52 4.55 1.87 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 1.18 0.57 0.94 0.00 0.00 101 S 8.41 4.56 0.00 3.85 3.74 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 0.00 102 R 8.45 3.86 0.00 2.03 2.18 0.00 3.02 0.00 0.00 3.34 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 103 A 8.13 3.96 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 0.00 104 Q 7.47 4.30 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.72 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 105 L 7.67 4.54 0.00 1.80 1.83 0.92 0.77 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 0.00 106 Q 7.55 4.39 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.49 0.00 107 E 8.15 3.99 0.00 2.09 1.94 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 2.29 2.32 0.00 108 I 7.68 3.80 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 1.58 0.98 0.91 0.00 0.00 109 A 7.07 4.26 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 0.00 110 Q 8.66 3.86 0.00 2.27 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 7.13 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 111 T 8.26 4.29 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 0.00 112 K 7.80 4.35 0.00 1.85 1.96 0.00 1.81 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.33 7.81 113 A 7.75 4.01 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 0.00 114 A 7.91 4.46 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 0.00 115 D 8.18 4.68 0.00 2.75 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 0.00 116 M 7.62 4.51 0.00 1.92 2.02 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.58 0.00 117 T 8.16 4.31 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 0.00 118 G 7.89 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 0.00 119 A 8.60 4.01 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 0.00 120 D 8.54 4.58 0.00 2.89 2.68 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 0.00 121 I 8.04 3.68 1.87 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 1.70 0.85 0.91 0.00 0.00 122 E 8.20 3.94 0.00 2.26 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 2.36 2.44 0.00 123 A 7.37 4.16 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 0.00 124 M 7.81 4.16 0.00 2.14 2.11 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 2.67 2.65 0.00 125 T 8.22 4.09 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 0.00 126 R 7.37 4.49 0.00 1.94 2.01 0.00 3.11 0.00 0.00 3.15 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.73 0.00 127 S 7.45 4.68 0.00 3.83 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 0.00 128 I 7.27 4.17 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 1.53 1.22 0.91 0.00 0.00 129 E 7.78 4.39 0.00 2.09 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 2.46 2.43 0.00 130 G 7.73 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 0.00 131 T 7.87 4.04 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 1.22 0.00 0.00 132 A 6.85 4.36 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 0.00 133 R 7.19 4.65 0.00 1.76 1.92 0.00 3.40 0.00 0.00 3.45 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 134 S 8.42 4.55 0.00 3.93 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 0.00 135 M 7.94 4.58 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 136 G 7.69 3.68 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 0.00 0.00 0.00 0.00 137 L 8.16 3.43 0.00 1.67 1.57 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 138 V 7.49 4.36 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 0.81 0.00 0.00 0.93 0.00 0.00 139 V 8.10 3.63 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 0.82 0.00 0.00 0.93 0.00 0.00 140 E 7.99 4.18 0.00 2.07 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 2.40 2.30 0.00