NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2505 8.2549 120.8598 55.4525 31.8901 176.0808 3 L 3.9515 7.6405 116.5574 55.8452 41.6558 172.0530 4 N 4.3442 7.6901 114.8776 53.9186 38.3636 176.6185 5 T 3.7219 7.7273 112.1719 64.6573 69.8523 174.3723 6 L 4.0973 7.5790 123.4174 55.4645 40.4098 176.3380 7 S 4.7808 8.2016 119.0557 55.4259 65.8455 171.9119 8 P 4.4612 0.0000 0.0000 62.0940 32.0575 176.9562 9 A 4.1675 8.1275 121.1642 52.0377 18.9098 176.5404 10 E 4.3336 8.8954 117.9975 58.3117 29.8714 176.5049 11 G 4.0500 8.9314 114.2215 45.6234 0.0000 172.9754 12 S 4.3291 7.8394 114.2082 59.1930 63.2087 174.6221 13 K 4.4021 7.5312 118.6195 54.6350 33.7869 176.7220 14 K 4.2526 8.5076 129.2448 58.2838 33.2767 180.3467 15 A 3.4130 8.5508 122.0513 52.2077 19.0052 178.7972 16 G 4.2498 9.1619 106.8348 43.3407 0.0000 173.2786 17 K 4.1753 8.0841 122.4143 57.1501 33.2801 176.2008 18 R 4.2993 8.0372 116.2380 57.6748 32.6405 173.5337 19 L 3.7061 8.3832 121.4028 54.8415 41.6314 174.2739 20 G 4.0435 8.7686 108.0485 47.4152 0.0000 174.0740 21 R 4.4925 8.1788 112.0920 54.8219 32.1233 175.2046 22 G 4.2560 8.2946 104.5949 43.3531 0.0000 175.3965 23 I 3.5734 8.6651 121.6918 64.2285 37.4533 178.6973 24 G 3.8159 8.3361 108.3067 48.7514 0.0000 174.5603 25 S 4.0494 7.2792 114.2665 59.2783 62.7705 175.7549 26 G 3.9873 8.6347 107.6338 45.3933 0.0000 173.2682 27 L 4.9006 7.6739 118.8813 53.7563 43.2951 177.4641 28 G 4.1016 8.0745 111.0597 44.7606 0.0000 173.1210 29 K 3.7578 8.6173 121.4442 58.2403 33.8555 176.4231 30 T 3.3040 8.5154 109.4816 62.2550 66.7835 170.8501 31 G 4.1584 7.8898 111.8321 47.1494 0.0000 171.7603 32 G 4.0863 8.2737 117.6305 47.0404 0.0000 171.3515 33 R 4.5395 7.6407 110.2105 54.9114 30.6973 177.1667 34 G 3.8831 8.1423 108.2554 46.4801 0.0000 172.1234 35 H 4.6660 8.6814 115.7657 54.8659 30.8220 175.5389 36 K 3.4772 9.8803 123.8209 56.5186 31.5996 174.6470 37 G 4.0008 8.4370 102.9746 45.5588 0.0000 174.4024 38 Q 4.0785 8.3068 119.4334 58.5896 29.2588 177.2932 39 K 3.9199 8.1651 116.5641 58.7189 32.2435 176.7462 40 S 4.5015 7.5319 112.4064 57.4180 65.0429 170.6765 41 R 4.2401 8.1584 123.4204 55.6233 30.2234 176.5103 42 S 4.2104 8.6896 116.2453 60.0408 63.0844 174.3098 43 G 3.8862 8.7444 109.2174 46.2220 0.0000 173.0658 44 G 4.1803 8.5888 108.5640 41.7271 0.0000 173.5533 45 G 4.2172 8.1903 115.1846 44.2040 0.0000 172.7594 46 V 3.7084 7.6811 116.4092 60.5400 32.4506 175.7626 47 R 4.4389 7.7555 118.1402 54.5726 31.6435 176.0514 48 R 4.0396 8.1837 116.6262 57.4367 30.5497 177.5071 49 G 4.3011 8.9671 110.8800 45.6825 0.0000 174.0910 50 F 4.1787 7.8567 121.3900 58.3697 40.4865 175.2544 51 E 4.5712 7.7285 124.6566 54.8268 28.6256 174.4371 52 G 4.2952 8.2162 116.3294 43.8295 0.0000 172.2111 53 G 3.8878 6.6694 114.6558 44.5403 0.0000 173.6447 54 Q 3.9257 7.8843 117.8688 55.5603 29.1608 175.2668 55 M 3.7234 8.5021 119.1631 55.3239 32.2591 174.4725 56 P 5.1510 0.0000 0.0000 61.7872 32.3929 177.1557 57 L 3.9225 8.8234 122.6555 58.5343 41.9873 177.8099 58 Y 4.4694 7.9153 114.4461 57.4213 37.9088 175.8159 59 R 4.3187 7.9310 118.6682 58.6312 32.9305 178.1404 60 R 4.0682 8.0150 112.8322 58.3654 29.5856 176.8433 61 L 4.4219 7.0304 119.0522 52.6013 42.5999 174.7559 62 P 4.4448 0.0000 0.0000 62.6208 31.7837 176.2586 63 K 4.3678 8.2917 118.0658 54.9491 32.6495 175.4635 64 F 4.6288 8.9521 120.9996 56.2603 37.9802 175.6555 65 G 3.9053 8.4008 120.9049 46.4987 0.0000 170.1902 66 F 4.1432 9.1668 129.1507 58.7744 37.8805 174.4148 67 T 4.3128 7.9786 117.9528 59.7410 70.4438 174.9574 68 S 3.7130 8.1811 121.0327 61.3452 63.1412 176.1386 69 R 4.1854 8.1283 117.5886 56.0109 28.6280 175.4089 70 K 4.6243 7.8061 115.5210 57.4683 38.1759 177.9738 71 A 4.2461 8.0679 121.2173 54.5419 18.4323 179.2829 72 A 4.0808 8.0430 118.2120 54.4108 18.8198 177.9745 73 I 4.5022 8.3890 109.2509 61.0061 39.0607 175.5941 74 T 5.2054 7.7801 118.8739 62.6019 70.8104 173.9300 75 A 4.3990 8.9763 130.1028 51.1826 21.2272 175.6907 76 E 4.4103 8.4129 118.1136 54.7211 30.7413 175.1571 77 I 4.2353 8.6948 126.9745 60.8527 38.2718 175.4181 78 R 5.2385 9.3723 120.3560 53.1067 32.4415 176.4336 79 L 4.1924 8.0835 118.2220 57.6126 41.5008 179.1285 80 S 4.2913 8.1975 112.4314 60.4999 63.6807 174.3652 81 D 4.6977 7.8724 123.5164 54.7742 42.3540 175.2509 82 L 4.0247 8.9305 123.7198 56.9900 40.0661 176.5058 83 A 4.2597 7.8460 115.1465 52.9075 17.9787 177.9526 84 K 4.6474 7.6348 113.6831 57.8618 34.1551 176.8869 85 V 4.0467 8.1523 118.7518 62.6170 31.4358 175.9226 86 E 3.5599 8.9911 119.8743 57.8289 27.9442 175.9410 87 G 3.8593 8.1567 109.9552 44.5401 0.0000 169.7180 88 G 3.7459 8.4577 112.4578 46.0828 0.0000 174.6454 89 V 3.2696 8.3215 114.5786 63.0418 29.9878 173.9157 90 V 4.0045 8.0861 130.7597 61.1410 29.4101 174.4635 91 D 4.8070 8.1000 122.8124 54.1860 41.7337 176.1898 92 L 4.3204 7.9641 122.8068 57.6046 40.7058 177.8330 93 N 4.8434 8.1806 114.3328 50.7554 35.6246 175.2110 94 T 3.5207 8.4592 113.3619 64.3793 67.5313 173.3239 95 L 3.7086 7.7281 119.5197 58.2434 41.7038 179.8976 96 K 3.9453 8.0374 117.3080 59.6133 31.9338 179.0594 97 A 4.1005 7.9117 118.8629 54.8992 18.3623 178.4952 98 A 4.1467 8.4123 117.2265 51.5219 19.7381 177.0810 99 N 4.1721 8.2556 115.0263 53.3056 36.0945 174.5580 100 I 4.2503 7.6443 111.2103 59.5829 39.5637 174.5301 101 I 4.5325 7.6270 119.0906 60.1160 45.0020 173.0678 102 G 3.5043 8.4192 103.3709 43.8358 0.0000 174.3904 103 I 3.7154 8.4242 127.3668 64.2114 37.3787 177.0788 104 Q 4.1976 7.9473 117.7443 57.5937 29.2866 176.3728 105 I 3.9301 7.1586 117.3609 62.1134 37.6554 175.2538 106 E 4.4132 8.9519 119.7779 55.6572 31.8547 175.6322 107 F 5.0984 7.5881 116.4865 56.1829 43.8574 173.1786 108 A 5.2058 8.2112 119.0783 52.2785 22.3378 175.5482 109 K 4.6581 8.2720 118.6644 54.2696 35.6322 177.4262 110 V 3.6915 8.4151 120.2106 64.6499 31.4313 175.5321 111 I 3.3462 7.7016 123.8966 60.3285 36.4965 172.2520 112 L 4.5730 8.3175 122.8638 53.9405 42.1604 175.5897 113 A 4.4025 8.4395 129.3483 53.2812 20.3339 176.8485 114 G 4.1980 8.1690 104.1518 45.5180 0.0000 172.8560 115 E 4.7020 7.5312 117.7704 54.4818 33.5322 175.5115 116 V 4.5226 8.6304 128.0727 62.6400 30.7898 173.7648 117 T 3.2840 7.6997 116.2298 63.9064 68.3398 172.5668 118 T 3.7987 8.0162 116.5015 61.7789 68.5469 171.7150 119 P 4.8430 0.0000 0.0000 62.7581 31.7139 175.6986 120 V 4.6099 8.4291 124.3645 60.9834 35.6936 174.4167 121 T 5.1780 8.1354 115.0878 58.7277 70.6158 173.4218 122 V 4.1052 8.4007 120.6965 61.4333 32.9295 175.5910 123 R 4.5455 8.9737 123.7483 54.5709 33.6523 175.9868 124 G 3.9118 8.6944 109.9683 46.1535 0.0000 171.4914 125 L 4.7527 8.0095 116.5426 53.7347 47.0726 176.1882 126 R 4.9937 8.0410 118.7008 54.9708 33.4862 175.8089 127 V 4.5190 7.8066 116.3312 61.0931 33.6244 173.1030 128 T 4.1025 8.3595 113.6371 61.4793 69.2437 174.9256 129 K 4.1966 8.5329 120.2994 58.1565 33.0788 177.8377 130 G 3.8153 7.9675 107.3678 46.4752 0.0000 174.9790 131 A 4.4942 7.7601 121.4325 53.3985 19.2612 178.5753 132 R 4.0677 7.9112 112.1550 57.4926 29.5251 176.8925 133 A 4.5131 8.0712 118.7450 53.2755 20.9854 178.6567 134 A 3.9515 7.9425 117.1642 54.9861 18.7131 179.7169 135 I 3.5990 7.6636 116.3203 64.5680 38.2227 177.9147 136 E 4.3628 8.3201 119.8710 58.4121 29.2401 178.7717 137 A 4.1832 9.5232 119.8075 54.0819 18.6584 178.3844 138 A 4.6719 7.6304 118.7770 51.5405 19.5312 177.1108 139 G 3.8228 8.6918 107.3108 47.9819 0.0000 174.6140 140 G 4.3154 7.6236 106.8299 44.4910 0.0000 173.1312 141 K 4.8100 8.2493 118.8831 54.8489 36.0709 174.5029 142 I 4.4062 8.2181 125.0490 59.7309 38.9356 174.8224 143 E 4.0160 8.7473 124.4291 54.1840 29.2716 176.5145 144 E 4.0812 7.8433 125.5914 55.7592 31.2736 174.5417 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 R 8.25 4.25 0.00 1.79 2.00 0.00 3.21 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 3 L 7.64 3.95 0.00 1.75 1.64 0.92 0.76 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 4 N 7.69 4.34 0.00 2.94 2.77 0.00 0.00 6.59 7.05 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 5 T 7.73 3.72 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 6 L 7.58 4.10 0.00 1.72 1.75 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.20 4.78 0.00 3.84 3.78 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 8 P 0.00 4.46 0.00 2.04 2.01 0.00 3.68 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 2.02 2.08 0.00 9 A 8.13 4.17 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 10 E 8.90 4.33 0.00 1.88 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 0.00 2.18 2.32 0.00 11 G 8.93 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 0.00 0.00 0.00 12 S 7.84 4.33 0.00 3.87 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 13 K 7.53 4.40 0.00 1.67 1.70 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.37 7.81 14 K 8.51 4.25 0.00 1.74 1.80 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.37 7.81 15 A 8.55 3.41 1.18 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 0.00 0.00 16 G 9.16 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 0.00 0.00 0.00 0.00 17 K 8.08 4.18 0.00 1.87 1.84 0.00 1.52 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.47 7.81 18 R 8.04 4.30 0.00 1.76 1.93 0.00 3.36 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 19 L 8.38 3.71 0.00 1.77 1.65 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.77 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 21 R 8.18 4.49 0.00 1.75 1.89 0.00 3.36 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.52 0.00 22 G 8.29 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 0.00 0.00 0.00 23 I 8.67 3.57 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 1.35 0.67 0.91 0.00 0.00 24 G 8.34 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 25 S 7.28 4.05 0.00 3.81 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 26 G 8.63 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 0.00 0.00 0.00 27 L 7.67 4.90 0.00 1.65 1.58 0.95 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.07 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 29 K 8.62 3.76 0.00 1.86 1.86 0.00 1.73 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.47 7.81 30 T 8.52 3.30 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 1.09 0.00 0.00 31 G 7.89 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 32 G 8.27 4.09 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 0.00 33 R 7.64 4.54 0.00 1.89 1.94 0.00 3.21 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.52 0.00 34 G 8.14 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 35 H 8.68 4.67 0.00 3.09 3.23 0.00 6.05 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 9.88 3.48 0.00 1.88 1.83 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.45 7.81 37 G 8.44 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 38 Q 8.31 4.08 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.99 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 39 K 8.17 3.92 0.00 1.79 1.88 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.41 7.81 40 S 7.53 4.50 0.00 4.07 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 0.00 41 R 8.16 4.24 0.00 2.07 2.05 0.00 3.14 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 42 S 8.69 4.21 0.00 3.96 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 43 G 8.74 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 44 G 8.59 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 0.00 0.00 0.00 0.00 45 G 8.19 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 0.00 0.00 0.00 0.00 46 V 7.68 3.71 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 0.69 0.00 0.00 0.99 0.00 0.00 47 R 7.76 4.44 0.00 1.91 1.92 0.00 3.11 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.75 0.00 48 R 8.18 4.04 0.00 1.86 1.85 0.00 3.14 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 49 G 8.97 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 50 F 7.86 4.18 0.00 3.09 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 51 E 7.73 4.57 0.00 2.05 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 0.00 2.36 2.12 0.00 52 G 8.22 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 53 G 6.67 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 54 Q 7.88 3.93 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.88 0.00 0.00 0.00 0.00 0.00 2.37 2.24 0.00 55 M 8.50 3.72 0.00 1.89 2.01 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.58 0.00 56 P 0.00 5.15 0.00 1.30 2.07 0.00 3.65 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 1.89 1.88 0.00 57 L 8.82 3.92 0.00 1.76 1.78 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 58 Y 7.92 4.47 0.00 3.13 3.02 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 59 R 7.93 4.32 0.00 1.76 1.71 0.00 3.08 0.00 0.00 2.87 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.12 0.00 60 R 8.01 4.07 0.00 1.89 2.03 0.00 3.03 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 61 L 7.03 4.42 0.00 1.98 1.71 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.44 0.00 2.13 2.08 0.00 3.66 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 63 K 8.29 4.37 0.00 1.80 1.82 0.00 1.59 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.41 7.81 64 F 8.95 4.63 0.00 3.24 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 65 G 8.40 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 66 F 9.17 4.14 0.00 3.03 3.36 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 67 T 7.98 4.31 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 1.15 0.00 0.00 68 S 8.18 3.71 0.00 3.91 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 69 R 8.13 4.19 0.00 2.15 2.05 0.00 3.42 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 70 K 7.81 4.62 0.00 1.84 1.67 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.54 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.32 1.45 7.81 71 A 8.07 4.25 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 72 A 8.04 4.08 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 73 I 8.39 4.50 1.88 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.41 0.94 0.00 0.00 74 T 7.78 5.21 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 1.32 0.00 0.00 75 A 8.98 4.40 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 76 E 8.41 4.41 0.00 1.93 1.82 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 2.18 2.33 0.00 77 I 8.69 4.24 2.13 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 1.29 0.66 0.98 0.00 0.00 78 R 9.37 5.24 0.00 1.78 1.98 0.00 3.05 0.00 0.00 3.26 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.87 0.00 79 L 8.08 4.19 0.00 1.83 2.06 1.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.20 4.29 0.00 3.97 4.28 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 81 D 7.87 4.70 0.00 2.75 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 82 L 8.93 4.02 0.00 1.93 1.82 1.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.85 4.26 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 84 K 7.63 4.65 0.00 1.88 1.95 0.00 1.50 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.38 1.42 7.81 85 V 8.15 4.05 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 0.79 0.00 0.00 0.93 0.00 0.00 86 E 8.99 3.56 0.00 2.05 1.95 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 2.23 2.27 0.00 87 G 8.16 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 88 G 8.46 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 0.00 0.00 0.00 89 V 8.32 3.27 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 0.69 0.00 0.00 0.96 0.00 0.00 90 V 8.09 4.00 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 0.90 0.00 0.00 0.93 0.00 0.00 91 D 8.10 4.81 0.00 2.72 2.57 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 0.00 0.00 0.00 0.00 92 L 7.96 4.32 0.00 1.69 2.07 0.89 0.96 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 93 N 8.18 4.84 0.00 2.82 1.99 0.00 0.00 6.07 7.71 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 94 T 8.46 3.52 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 1.22 0.00 0.00 95 L 7.73 3.71 0.00 1.67 1.76 1.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.04 3.95 0.00 1.78 1.84 0.00 1.64 0.00 0.00 1.83 0.00 0.00 3.18 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.49 7.81 97 A 7.91 4.10 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 98 A 8.41 4.15 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 99 N 8.26 4.17 0.00 2.81 2.84 0.00 0.00 6.67 7.74 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 0.00 100 I 7.64 4.25 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 1.30 0.50 0.99 0.00 0.00 101 I 7.63 4.53 1.86 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 1.34 0.81 0.89 0.00 0.00 102 G 8.42 3.50 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 0.00 0.00 0.00 103 I 8.42 3.72 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.43 0.89 0.00 0.00 104 Q 7.95 4.20 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.85 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 105 I 7.16 3.93 1.96 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 1.29 0.82 0.96 0.00 0.00 106 E 8.95 4.41 0.00 1.16 1.12 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 2.00 2.22 0.00 107 F 7.59 5.10 0.00 2.93 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 0.00 108 A 8.21 5.21 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 0.00 109 K 8.27 4.66 0.00 1.68 1.73 0.00 1.96 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.20 7.81 110 V 8.42 3.69 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 0.99 0.00 0.00 1.01 0.00 0.00 111 I 7.70 3.35 1.98 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 1.45 0.85 0.91 0.00 0.00 112 L 8.32 4.57 0.00 1.60 1.59 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 113 A 8.44 4.40 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 0.00 114 G 8.17 4.20 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 0.00 115 E 7.53 4.70 0.00 2.10 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 2.21 2.36 0.00 116 V 8.63 4.52 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 0.70 0.00 0.00 0.98 0.00 0.00 117 T 7.70 3.28 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 1.21 0.00 0.00 118 T 8.02 3.80 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 0.00 119 P 0.00 4.84 0.00 1.97 2.14 0.00 3.72 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00 120 V 8.43 4.61 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 1.04 0.00 0.00 0.98 0.00 0.00 121 T 8.14 5.18 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 1.21 0.00 0.00 122 V 8.40 4.11 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 0.89 0.00 0.00 1.12 0.00 0.00 123 R 8.97 4.55 0.00 1.64 1.77 0.00 3.44 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 124 G 8.69 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 0.00 125 L 8.01 4.75 0.00 1.86 1.56 1.01 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.04 4.99 0.00 1.89 1.84 0.00 3.16 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 127 V 7.81 4.52 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 0.64 0.00 0.00 0.95 0.00 0.00 128 T 8.36 4.10 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 1.21 0.00 0.00 129 K 8.53 4.20 0.00 1.89 1.97 0.00 1.56 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.40 1.43 7.81 130 G 7.97 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 0.00 131 A 7.76 4.49 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 0.00 132 R 7.91 4.07 0.00 1.99 2.16 0.00 3.02 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 133 A 8.07 4.51 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 0.00 134 A 7.94 3.95 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 0.00 135 I 7.66 3.60 1.96 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 1.64 1.33 0.97 0.00 0.00 136 E 8.32 4.36 0.00 2.17 1.98 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 2.60 2.23 0.00 137 A 9.52 4.18 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 0.00 138 A 7.63 4.67 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 0.00 139 G 8.69 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 0.00 140 G 7.62 4.32 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 0.00 141 K 8.25 4.81 0.00 1.79 1.59 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.46 7.81 142 I 8.22 4.41 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 1.41 0.64 0.92 0.00 0.00 143 E 8.75 4.02 0.00 2.02 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 0.00 2.32 2.48 0.00 144 E 7.84 4.08 0.00 2.14 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 2.23 2.29 0.00