NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1922 8.1727 122.0542 56.3044 34.1345 174.0657 2 V 4.5580 8.1946 127.0245 60.7225 32.2743 174.5322 3 F 4.4232 10.0026 128.8965 57.5410 40.2305 174.8748 4 E 4.2988 9.2506 121.2282 55.7038 30.8899 177.2206 5 R 3.1771 8.8972 123.1026 60.3902 30.0281 179.6070 6 C 4.3641 8.0475 115.1677 59.4967 35.0391 175.6625 7 E 3.9034 8.0747 120.9285 59.1225 29.3248 178.4700 8 L 3.6447 7.9056 120.1209 57.9878 42.1553 178.4835 9 A 3.9900 7.8555 120.7189 55.4267 18.2374 179.8525 10 R 3.8774 8.0180 116.2557 59.6106 30.1499 179.3853 11 T 3.8476 7.7549 115.1143 66.7839 68.5513 176.6748 12 L 3.8816 8.2159 121.1747 57.4907 41.5658 179.5799 13 K 3.8830 8.0690 119.5078 59.6146 31.9917 178.6970 14 R 3.9351 7.8058 117.4498 59.2724 29.9361 177.3598 15 L 4.4480 7.5944 116.2754 53.6592 41.9498 176.7144 16 G 3.9696 7.7620 106.3656 47.0599 0.0000 175.3721 17 M 3.8754 7.8910 120.0287 56.3338 32.5092 176.0969 18 D 4.4169 7.9371 118.2176 56.1266 41.0840 175.9657 19 G 3.9644 9.4723 116.4263 45.1468 0.0000 171.5468 20 Y 4.0026 8.0803 122.2072 58.6777 38.8741 175.9468 21 R 3.7054 9.0146 126.2689 57.2715 28.5941 176.5455 22 G 3.8724 8.3726 102.1618 45.1130 0.0000 173.9239 23 I 4.0280 7.8101 122.3006 59.5652 38.1937 175.9552 24 S 4.5813 8.3357 120.7371 58.0703 64.9086 174.9307 25 L 4.2420 8.7800 124.8212 58.4672 41.7575 179.3188 26 A 4.1445 8.1469 120.2655 55.3105 18.3316 179.2103 27 N 4.3968 8.0811 114.5603 56.3524 38.5808 177.6273 28 W 4.2495 7.8631 119.8653 60.1084 29.0671 178.5651 29 M 4.2074 8.6259 118.9409 58.4443 31.4557 177.8344 30 C 3.0941 8.3452 118.8228 59.2303 43.2295 175.2499 31 L 4.0781 8.1379 121.5305 58.3992 41.6791 178.8850 32 A 4.0012 8.3302 120.6654 54.8757 18.3240 179.4284 33 K 2.7580 8.1223 118.2038 59.3054 32.0022 179.0992 34 W 4.2903 7.8778 117.4128 59.2552 29.0700 178.4215 35 E 4.3674 8.5379 118.8403 58.7531 29.1620 177.8536 36 S 4.5470 7.6055 108.1828 56.6187 64.5074 173.7445 37 G 3.4590 8.1531 108.7387 47.2683 0.0000 173.2045 38 Y 3.6308 7.4973 112.4772 58.6794 35.5971 169.4485 39 N 5.3746 7.7342 118.7180 51.9493 40.3744 175.4258 40 T 4.0511 8.9657 116.9228 63.8871 69.1682 175.9825 41 R 4.3849 8.4365 119.9417 56.1340 30.8584 176.4377 42 A 4.2954 7.6167 121.8189 52.7314 19.2558 176.8278 43 T 5.0114 8.3356 111.0011 60.0523 72.4502 172.9877 44 N 4.8782 8.6681 121.4865 52.2376 42.2374 172.2944 45 Y 4.7148 8.6820 127.8907 57.0995 40.8388 174.0084 46 N 4.6974 8.4866 124.8521 50.9984 38.2021 175.2254 47 A 3.3494 7.9391 126.9125 54.1659 19.3386 178.9124 48 G 3.9648 8.1990 106.5317 42.6272 0.0000 173.8172 49 D 5.5356 8.5205 130.0802 53.4394 38.3202 177.9254 50 R 4.4265 7.9061 119.8164 56.7033 29.1495 175.0851 51 S 5.0608 8.1282 109.8733 56.5520 66.4014 172.7163 52 T 5.1449 8.7563 115.8833 62.0879 73.0561 172.7321 53 D 5.4499 8.8813 125.5718 53.1889 43.1679 175.1188 54 Y 4.9382 9.3488 121.1873 57.3459 41.8541 177.5554 55 G 4.4141 9.0789 111.8372 44.8721 0.0000 173.4868 56 I 3.5970 8.4152 117.4734 63.6237 37.6987 177.1130 57 F 4.8542 8.0387 115.2098 56.5023 39.9740 175.1572 58 Q 3.6079 8.0018 119.3035 57.1171 26.6990 174.3298 59 I 4.1513 7.9906 118.5944 61.2417 39.1782 176.8260 60 N 5.4104 9.1655 126.2720 53.2628 39.6174 175.8896 61 S 4.3300 9.4459 121.7237 61.1950 63.3577 175.5057 62 R 3.7512 8.9233 122.2413 58.7731 30.3370 177.8714 63 Y 4.0456 7.8217 114.6501 57.5417 40.3805 176.7756 64 W 5.0414 8.0171 118.3135 57.1375 31.5250 173.6447 65 C 5.4954 8.1231 112.0404 53.8250 45.1353 172.7442 66 N 4.9835 9.3549 119.2365 52.1621 39.8507 174.8273 67 D 4.7570 8.8092 124.0739 52.2287 40.3306 177.2126 68 G 3.9665 8.8256 107.7350 46.2849 0.0000 174.4218 69 K 4.5330 8.3158 116.4861 56.3725 33.5091 175.8481 70 T 4.7088 7.6529 116.3827 60.6504 69.3415 172.2523 71 P 4.2193 0.0000 0.0000 63.5981 31.7724 176.6029 72 G 3.7944 8.8259 109.8660 46.2732 0.0000 173.3104 73 A 4.2377 7.4098 120.8932 51.5365 19.4066 177.4738 74 V 4.3293 8.1434 112.3480 59.3210 35.7981 176.3371 75 N 5.0126 7.9813 117.1018 52.4588 37.7808 174.6803 76 A 4.0545 8.8296 124.1791 54.5336 19.1910 178.4262 77 C 4.5404 8.3016 111.7599 57.1985 41.0174 173.0919 78 H 4.0693 7.7517 115.5224 56.8170 26.2682 174.5080 79 L 4.8563 8.1695 117.2365 52.6926 46.1181 176.7927 80 S 4.5962 8.3600 115.6549 58.1215 63.2133 176.0009 81 C 4.0849 8.7415 124.6516 59.7865 37.9314 176.5372 82 S 3.8971 7.9990 115.3905 61.4773 62.0943 176.1555 83 A 4.1744 7.8326 122.7493 53.8459 18.2405 178.3406 84 L 4.5831 8.0041 117.0845 54.5086 41.6821 177.2717 85 L 5.4375 7.6399 117.9478 53.8477 42.2430 176.3257 86 Q 4.6611 7.8190 116.8070 54.3829 30.5981 175.8105 87 D 4.4470 8.5670 120.0903 57.1868 41.1553 176.9073 88 N 4.5807 8.0821 118.1110 53.3306 39.3934 174.6439 89 I 4.3569 8.4219 118.4884 60.9787 38.0849 177.0465 90 A 3.9525 8.0978 124.9198 55.9629 18.1647 180.2293 91 D 4.2777 8.0907 116.4967 57.4511 40.9154 178.6742 92 A 4.1274 8.0169 120.8432 55.1261 18.4554 179.7312 93 V 3.1979 8.1930 116.8190 66.0321 31.7267 178.1361 94 A 3.8276 8.0133 120.5602 55.1962 18.1075 178.8588 95 C 4.1526 8.2550 116.8358 59.6476 44.8766 175.5530 96 A 3.9260 8.0544 122.7566 55.1142 17.5641 179.7749 97 K 3.5182 7.4477 116.1035 59.2156 32.2633 179.3437 98 R 4.0087 7.5608 118.5493 59.2919 30.0552 178.4427 99 V 2.1680 7.4871 118.4071 65.8690 31.4866 178.3656 100 V 3.9301 8.0875 111.0445 63.4993 31.1762 177.6968 101 R 4.4536 7.6891 116.3801 55.9018 30.8340 176.1494 102 D 4.7540 7.6259 119.9064 52.9766 41.8670 175.4448 103 P 4.2404 0.0000 0.0000 66.0311 31.3927 178.0848 104 Q 4.0091 8.2686 118.4668 56.9806 30.1680 177.0358 105 G 4.0387 7.9118 106.8128 47.1588 0.0000 175.8073 106 I 3.8949 7.9915 120.9271 63.0104 38.0202 177.8142 107 R 4.2783 7.5674 117.8726 58.4631 29.9846 177.6359 108 A 3.8683 7.6581 120.4774 54.0447 18.5974 177.9120 109 W 4.6989 8.1374 116.5241 55.3007 29.8010 177.1759 110 V 3.6838 8.5349 124.5213 66.0980 31.0892 177.5898 111 A 4.0763 8.4531 120.3042 54.7045 18.1084 179.3648 112 W 3.9849 8.4061 126.4641 60.8513 30.6816 178.1088 113 R 3.7075 8.0516 116.4412 59.4311 29.5813 178.4653 114 N 4.3881 7.9782 115.0032 55.2012 38.8310 176.7956 115 R 4.0367 7.8905 116.3513 55.7797 31.4533 175.8602 116 C 4.5279 7.4982 115.7304 57.3437 42.5136 174.3066 117 Q 3.3515 6.5789 119.1202 57.0359 28.8684 175.0531 118 N 4.2321 8.6539 119.2808 54.3115 36.2469 174.0820 119 R 4.6432 7.2503 113.4179 54.0453 33.9078 174.6832 120 D 4.5656 8.5828 119.4768 54.2386 41.7762 176.3736 121 V 4.5895 8.3882 118.6421 61.0513 32.2607 177.5798 122 R 4.0741 8.3827 120.0962 59.1083 29.2536 178.8834 123 Q 3.9293 8.0937 116.4217 59.1363 28.5845 177.5933 124 Y 4.4254 7.8263 114.6235 59.4858 38.0885 176.3732 125 V 4.4392 7.6657 112.2845 60.4873 33.1847 175.4860 126 Q 3.9916 7.6761 118.2137 57.2270 28.8202 176.4729 127 G 3.9128 8.7731 108.5106 46.7091 0.0000 174.7528 128 C 4.5072 7.9984 117.8183 55.9275 41.0395 174.9258 129 G 3.8006 8.0471 106.7536 46.5434 0.0000 174.0531 130 V 3.9301 7.1793 115.2988 61.1216 31.6713 176.1434 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 4.19 0.00 1.89 1.68 0.00 1.35 0.00 0.00 1.46 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.94 1.19 7.81 2 V 8.19 4.56 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 0.93 0.00 0.00 0.96 0.00 0.00 3 F 10.00 4.42 0.00 2.82 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 4 E 9.25 4.30 0.00 1.92 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 2.30 2.24 0.00 5 R 8.90 3.18 0.00 1.85 1.92 0.00 3.44 0.00 0.00 3.49 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 6 C 8.05 4.36 0.00 2.99 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 7 E 8.07 3.90 0.00 2.06 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 2.59 2.40 0.00 8 L 7.91 3.64 0.00 1.36 1.41 0.09 0.88 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 9 A 7.86 3.99 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 10 R 8.02 3.88 0.00 2.09 1.99 0.00 3.14 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 11 T 7.75 3.85 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 1.21 0.00 0.00 12 L 8.22 3.88 0.00 1.58 1.58 0.95 0.66 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 13 K 8.07 3.88 0.00 1.95 1.92 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.81 3.94 0.00 1.92 2.15 0.00 3.30 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 15 L 7.59 4.45 0.00 1.56 1.55 0.88 0.86 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 16 G 7.76 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 17 M 7.89 3.88 0.00 1.16 1.94 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.22 0.00 18 D 7.94 4.42 0.00 2.67 2.66 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 0.00 0.00 0.00 0.00 19 G 9.47 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 0.00 0.00 0.00 20 Y 8.08 4.00 0.00 3.22 3.08 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 0.00 0.00 0.00 0.00 21 R 9.01 3.71 0.00 2.11 2.02 0.00 3.49 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.65 0.00 22 G 8.37 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 23 I 7.81 4.03 1.69 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.69 -0.31 0.00 0.00 24 S 8.34 4.58 0.00 4.10 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 8.78 4.24 0.00 2.06 1.81 0.98 1.23 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 26 A 8.15 4.14 1.48 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 0.00 0.00 27 N 8.08 4.40 0.00 2.69 2.62 0.00 0.00 7.03 8.98 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 28 W 7.86 4.25 0.00 3.61 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 29 M 8.63 4.21 0.00 2.22 2.41 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.99 0.00 30 C 8.35 3.09 0.00 2.74 3.21 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 31 L 8.14 4.08 0.00 1.94 1.95 -0.12 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.33 4.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.12 2.76 0.00 1.55 1.40 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.44 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.44 1.33 7.81 34 W 7.88 4.29 0.00 3.31 3.21 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 35 E 8.54 4.37 0.00 2.10 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 2.69 2.79 0.00 36 S 7.61 4.55 0.00 4.08 4.06 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 37 G 8.15 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.50 3.63 0.00 3.20 2.97 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 39 N 7.73 5.37 0.00 2.70 2.85 0.00 0.00 7.02 7.10 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 40 T 8.97 4.05 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 1.54 0.00 0.00 41 R 8.44 4.38 0.00 1.98 2.04 0.00 3.38 0.00 0.00 3.45 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 42 A 7.62 4.30 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 43 T 8.34 5.01 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 1.22 0.00 0.00 44 N 8.67 4.88 0.00 2.86 2.86 0.00 0.00 6.83 7.33 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 45 Y 8.68 4.71 0.00 3.06 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 46 N 8.49 4.70 0.00 2.70 2.57 0.00 0.00 6.59 7.03 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 47 A 7.94 3.35 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 48 G 8.20 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 0.00 0.00 0.00 49 D 8.52 5.54 0.00 2.89 2.85 0.00 0.00 0.00 0.00 0.00 0.00 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 7.91 4.43 0.00 2.11 2.08 0.00 3.19 0.00 0.00 3.41 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 51 S 8.13 5.06 0.00 3.97 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 0.00 52 T 8.76 5.14 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 0.51 0.00 0.00 53 D 8.88 5.45 0.00 2.72 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 54 Y 9.35 4.94 0.00 2.97 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 55 G 9.08 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 0.00 0.00 0.00 0.00 56 I 8.42 3.60 1.67 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.67 -0.03 0.00 0.00 57 F 8.04 4.85 0.00 3.28 3.33 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 58 Q 8.00 3.61 0.00 2.54 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.83 0.00 0.00 0.00 0.00 0.00 2.56 2.73 0.00 59 I 7.99 4.15 2.10 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 1.44 0.99 1.09 0.00 0.00 60 N 9.17 5.41 0.00 3.03 2.98 0.00 0.00 6.97 7.27 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 61 S 9.45 4.33 0.00 4.00 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 62 R 8.92 3.75 0.00 1.79 1.72 0.00 3.09 0.00 0.00 3.04 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 1.14 0.00 63 Y 7.82 4.05 0.00 1.89 1.48 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 64 W 8.02 5.04 0.00 3.50 3.20 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 65 C 8.12 5.50 0.00 3.08 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 66 N 9.35 4.98 0.00 2.80 2.70 0.00 0.00 7.13 8.42 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 67 D 8.81 4.76 0.00 2.82 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 8.83 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 69 K 8.32 4.53 0.00 1.85 1.84 0.00 1.54 0.00 0.00 2.09 0.00 0.00 3.07 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.66 7.81 70 T 7.65 4.71 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 1.18 0.00 0.00 71 P 0.00 4.22 0.00 2.02 1.98 0.00 3.82 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 2.04 2.09 0.00 72 G 8.83 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 0.00 0.00 0.00 73 A 7.41 4.24 1.23 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 0.00 0.00 0.00 74 V 8.14 4.33 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 0.60 0.00 0.00 0.83 0.00 0.00 75 N 7.98 5.01 0.00 2.75 2.60 0.00 0.00 6.77 8.75 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 76 A 8.83 4.05 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 77 C 8.30 4.54 0.00 3.46 3.21 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 78 H 7.75 4.07 0.00 3.42 3.41 0.00 5.60 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.17 4.86 0.00 1.68 1.49 0.99 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.36 4.60 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 8.74 4.08 0.00 2.22 1.23 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 0.00 82 S 8.00 3.90 0.00 4.04 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 83 A 7.83 4.17 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 84 L 8.00 4.58 0.00 1.91 1.83 1.04 0.69 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 85 L 7.64 5.44 0.00 1.80 1.72 1.14 1.18 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 86 Q 7.82 4.66 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.98 7.09 0.00 0.00 0.00 0.00 0.00 2.46 2.32 0.00 87 D 8.57 4.45 0.00 2.64 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 88 N 8.08 4.58 0.00 2.71 2.75 0.00 0.00 6.91 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 8.42 4.36 1.85 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.76 0.99 0.00 0.00 90 A 8.10 3.95 1.41 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 0.00 0.00 0.00 91 D 8.09 4.28 0.00 2.73 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 92 A 8.02 4.13 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 V 8.19 3.20 2.12 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 0.68 0.00 0.00 0.95 0.00 0.00 94 A 8.01 3.83 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 95 C 8.26 4.15 0.00 3.10 3.23 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 0.00 96 A 8.05 3.93 0.58 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 0.00 0.00 97 K 7.45 3.52 0.00 1.56 1.33 0.00 1.30 0.00 0.00 1.13 0.00 0.00 2.34 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.30 0.72 7.81 98 R 7.56 4.01 0.00 1.95 1.99 0.00 3.26 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.83 0.00 99 V 7.49 2.17 1.74 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 -0.28 0.00 0.00 -0.77 0.00 0.00 100 V 8.09 3.93 2.43 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 1.12 0.00 0.00 1.39 0.00 0.00 101 R 7.69 4.45 0.00 2.05 2.04 0.00 3.25 0.00 0.00 3.36 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.95 0.00 102 D 7.63 4.75 0.00 3.18 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 0.00 103 P 0.00 4.24 0.00 2.03 2.13 0.00 3.71 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 0.00 104 Q 8.27 4.01 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.89 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 105 G 7.91 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 0.00 0.00 0.00 106 I 7.99 3.89 1.25 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.13 0.71 -0.39 0.00 0.00 107 R 7.57 4.28 0.00 1.98 2.06 0.00 3.31 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.63 0.00 108 A 7.66 3.87 0.82 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 0.00 109 W 8.14 4.70 0.00 3.72 3.33 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 0.00 110 V 8.53 3.68 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 1.10 0.00 0.00 0.99 0.00 0.00 111 A 8.45 4.08 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.41 3.98 0.00 3.47 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 R 8.05 3.71 0.00 2.05 2.03 0.00 3.34 0.00 0.00 3.52 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 114 N 7.98 4.39 0.00 2.59 2.70 0.00 0.00 6.90 7.08 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 0.00 115 R 7.89 4.04 0.00 0.86 0.66 0.00 2.26 0.00 0.00 2.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.85 0.00 116 C 7.50 4.53 0.00 1.67 2.72 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 0.00 117 Q 6.58 3.35 0.00 0.93 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.89 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 118 N 8.65 4.23 0.00 2.78 2.81 0.00 0.00 6.76 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 7.25 4.64 0.00 1.88 1.76 0.00 3.08 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 120 D 8.58 4.57 0.00 2.65 2.59 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 0.00 121 V 8.39 4.59 2.35 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 0.92 0.00 0.00 1.05 0.00 0.00 122 R 8.38 4.07 0.00 2.04 2.26 0.00 2.79 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.60 0.00 123 Q 8.09 3.93 0.00 1.99 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.99 0.00 0.00 0.00 0.00 0.00 2.19 1.37 0.00 124 Y 7.83 4.43 0.00 3.16 3.21 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 0.00 125 V 7.67 4.44 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 0.90 0.00 0.00 1.03 0.00 0.00 126 Q 7.68 3.99 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.42 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 127 G 8.77 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 0.00 0.00 0.00 128 C 8.00 4.51 0.00 3.08 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 0.00 129 G 8.05 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 0.00 130 V 7.18 3.93 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 0.65 0.00 0.00 0.96 0.00 0.00