NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2226 8.2549 117.2585 56.2803 30.7049 174.1559 3 H 4.8004 8.4670 115.7897 53.4531 32.6752 171.4625 4 L 4.2428 9.6877 121.5953 55.3817 41.3427 175.7375 5 K 4.1261 8.1082 115.1595 57.0931 31.5816 175.8766 6 S 4.6937 9.4312 112.8542 55.5925 65.8794 172.6447 7 G 3.7007 9.0403 110.5066 46.4981 0.0000 174.6228 8 R 3.1762 8.5327 120.2123 55.9113 28.9825 176.1556 9 K 4.0694 7.6702 124.4767 55.5549 33.9606 175.5703 10 L 4.4169 7.5942 115.4104 54.6272 44.8265 173.5094 11 N 4.9404 8.8728 121.8589 52.5930 42.5306 176.0725 12 R 4.2799 10.6400 121.2559 56.1804 27.8342 179.1720 13 H 4.5720 8.8404 119.8086 53.5862 31.8112 175.4688 14 S 3.2087 8.4249 111.2823 57.3395 66.5791 175.6438 15 S 3.9471 9.2297 115.5082 62.2235 63.4576 174.8364 16 H 4.1114 8.4716 121.3796 59.3366 29.4838 176.7638 17 R 3.1065 8.5154 116.9597 59.2811 30.2785 177.8582 18 L 3.5288 8.2218 119.0129 58.4814 42.4306 179.7511 19 A 3.9759 8.7029 121.2427 54.8158 18.0822 179.1887 20 L 3.7579 8.0241 119.5366 58.5140 42.1902 178.2614 21 Y 4.1869 7.2212 115.8470 61.3946 37.7190 178.9471 22 R 3.9745 7.5834 118.1542 59.8352 30.1915 178.5168 23 N 4.3156 8.1884 115.6239 56.5527 38.5816 177.5091 24 Q 3.9579 8.3813 119.2149 58.8922 28.7413 178.3076 25 A 4.0655 8.4574 122.1528 55.5527 18.5423 179.4931 26 K 3.8382 8.3815 116.8996 60.1437 32.1581 179.5309 27 S 4.0681 7.8498 114.8431 61.4380 62.6898 176.3132 28 L 4.1241 8.3939 123.1092 57.5198 41.6112 178.2120 29 L 4.5776 7.3843 116.5908 56.5528 43.2347 178.3491 30 T 4.0318 7.6522 114.8828 65.9155 68.4564 175.4503 31 H 4.9314 8.5434 115.4605 54.3843 30.9431 174.8325 32 G 4.4028 7.9810 113.0533 45.3519 0.0000 173.5469 33 R 5.1792 7.5396 116.8286 54.3324 32.7802 175.7754 34 I 4.6011 8.5620 121.5442 60.5113 42.3967 173.7666 35 T 5.0596 8.5900 122.5342 62.3547 70.8061 173.1181 36 T 4.8455 8.3280 117.9311 60.3827 72.5453 173.5891 37 T 4.4579 7.8609 110.1267 61.3618 69.2415 174.0989 38 V 3.3852 7.4629 118.8371 66.2250 30.9427 176.4660 39 P 4.1265 0.0000 0.0000 65.9802 31.9464 177.7027 40 K 3.9207 8.1702 117.2922 59.7711 31.9665 178.7313 41 A 3.9610 8.1571 120.7877 54.9148 18.4020 179.5330 42 K 3.9174 8.1274 113.6048 57.9157 32.3272 176.8755 43 E 4.3496 8.6144 120.7302 57.1154 31.7735 177.5904 44 L 3.8837 7.5242 119.8790 57.1345 42.0928 178.7378 45 R 3.8821 8.7600 111.5971 59.3296 28.8046 178.8928 46 G 3.9724 8.6008 104.1673 47.1292 0.0000 174.2638 47 F 3.9072 7.4103 121.0366 60.9687 39.5503 176.8718 48 V 3.6411 8.0927 117.4321 66.9001 31.3268 176.9869 49 D 4.0115 7.9373 116.3715 58.0834 40.3146 178.6222 50 H 3.8380 8.3121 118.1086 59.4765 30.0032 177.5222 51 L 3.7931 7.8528 121.0503 57.5170 41.5651 179.0674 52 I 3.3320 7.1630 119.0998 64.6566 36.8879 177.8046 53 H 3.7766 7.6481 117.6369 58.0354 29.4538 176.7085 54 L 4.0165 7.0877 121.7159 58.0877 41.9966 178.2856 55 A 3.0276 7.8254 118.8064 54.2014 18.0905 178.6184 56 K 3.7855 7.5407 118.2845 58.5155 32.6022 176.8363 57 R 4.0218 7.4109 118.8941 56.7520 30.6994 177.2634 58 G 4.1541 8.5414 109.0997 45.2028 0.0000 174.1804 59 D 4.3516 8.0822 120.9904 53.7331 40.4622 176.6944 60 L 3.7056 8.6420 124.6882 59.2710 41.8723 178.0028 61 H 4.0308 8.4957 116.0164 59.9212 29.3064 176.0618 62 A 3.8342 8.1498 122.6164 55.7921 18.5948 178.7781 63 R 3.9557 8.4315 116.8554 60.1026 29.5889 178.5600 64 R 3.9837 8.9615 117.7428 59.3830 30.1007 178.6635 65 L 4.1179 8.4993 119.1145 57.0659 42.2313 178.1602 66 V 4.0474 8.1815 117.8217 65.3282 32.0326 177.2539 67 L 4.0348 7.4445 116.4079 58.0329 41.4483 179.5368 68 R 4.1082 7.9789 116.6667 59.5874 30.1583 178.3004 69 D 4.6236 7.8782 116.9188 59.0937 41.6169 178.1395 70 L 4.4839 7.8986 119.1658 55.3560 43.0771 175.1012 71 Q 4.7377 8.3466 116.4324 56.7124 35.4355 175.3903 72 D 4.5980 8.0471 118.2799 53.1161 42.1075 176.2682 73 V 3.5960 8.5850 126.9465 66.5786 31.6601 177.3496 74 K 4.0063 8.3444 118.4888 59.3555 32.0249 178.0221 75 L 3.9351 8.2599 120.4553 58.3179 41.6740 179.6409 76 V 3.7225 8.1994 119.5574 65.1741 31.5423 177.8830 77 R 4.2189 8.3321 118.5712 58.9561 29.8680 178.6227 78 K 3.9530 8.0124 118.3688 60.1874 32.3255 177.9322 79 L 4.0423 7.8210 120.7452 58.2871 41.8766 178.2067 80 F 3.7293 9.3640 118.7112 59.9031 39.8101 175.6808 81 D 4.8729 8.2225 122.5045 52.1764 39.7124 175.3988 82 E 4.7728 7.7295 123.5955 57.9795 36.1003 176.2274 83 I 4.0552 8.1007 119.6856 63.6413 38.2243 177.8824 84 A 4.1890 8.5553 123.6383 55.0126 18.4599 177.5811 85 P 4.2170 0.0000 0.0000 66.0554 31.2875 178.1365 86 R 3.8178 6.9051 114.4883 58.3702 31.8400 176.7553 87 Y 4.2411 8.2928 111.8376 57.1911 38.1098 176.2623 88 R 4.2532 9.8607 133.6923 58.5534 30.1982 175.9507 89 D 4.8144 8.0083 113.4764 54.2018 40.8084 175.9243 90 R 4.5831 7.4779 118.5905 54.5234 32.1851 175.7493 91 Q 4.3223 8.2431 123.7374 54.2226 29.1613 175.7739 92 G 3.7676 8.1412 111.5374 45.1987 0.0000 170.2055 93 G 3.8847 8.2820 103.3988 46.9136 0.0000 173.1638 94 Y 4.1305 7.6995 111.7225 57.6597 38.2282 175.9207 95 T 5.4625 7.1693 111.6778 62.3671 70.2724 172.6404 96 R 4.8016 8.8516 126.6775 54.4799 33.9733 175.1081 97 V 4.8499 8.1650 119.6127 61.4074 34.4364 174.2870 98 L 4.7814 8.9714 128.4137 52.4440 44.1472 176.3669 99 K 4.2722 8.8791 123.5479 56.9924 32.6423 176.2896 100 L 4.8599 8.3414 122.8396 52.9282 44.5045 175.8323 101 A 4.3500 8.4397 123.8594 52.0560 20.0443 174.1653 102 E 3.9901 8.8664 127.7487 56.2869 29.2602 174.5548 103 R 4.5612 8.1526 121.6657 53.9856 33.0317 175.7417 104 R 3.8089 8.3095 120.0517 57.7281 31.0461 175.7776 105 R 4.5256 8.9028 125.2151 57.6648 29.9821 175.6275 106 G 3.5883 8.8911 117.5112 44.8746 0.0000 170.7673 107 D 4.2744 9.6188 120.6665 52.0317 37.9909 177.0702 108 G 4.3303 7.7231 109.0819 45.7572 0.0000 172.8618 109 A 4.6162 8.2182 120.6325 49.7133 21.1201 176.5813 110 P 4.5286 0.0000 0.0000 63.6203 32.4303 176.0528 111 L 5.1465 8.5505 123.0753 53.4629 45.0623 174.7045 112 A 5.0222 9.4777 121.2933 50.8863 23.2670 174.8054 113 L 5.0091 8.8881 121.3920 53.2850 45.2307 175.6133 114 V 4.8976 9.1409 125.0940 61.3591 34.0321 173.6930 115 E 4.8561 8.6743 129.2954 55.7308 32.2978 175.6868 116 L 4.4235 9.0249 125.7470 54.6101 41.8401 178.3635 117 V 4.8583 8.4145 126.1451 62.2465 33.1957 171.4299 118 E 4.5153 8.2473 121.5649 57.2280 29.4731 175.6425 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 4.22 0.00 1.88 1.97 0.00 2.94 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.69 0.00 3 H 8.47 4.80 0.00 3.20 3.19 0.00 5.67 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 4 L 9.69 4.24 0.00 1.72 2.06 0.93 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.11 4.13 0.00 1.78 1.84 0.00 1.64 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.51 7.81 6 S 9.43 4.69 0.00 3.93 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 7 G 9.04 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.53 3.18 0.00 1.91 2.22 0.00 3.42 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 9 K 7.67 4.07 0.00 1.88 1.86 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.13 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.55 7.81 10 L 7.59 4.42 0.00 1.63 1.59 0.95 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.87 4.94 0.00 2.65 2.68 0.00 0.00 7.41 7.65 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 12 R 10.64 4.28 0.00 1.87 1.32 0.00 3.00 0.00 0.00 2.78 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.45 0.00 13 H 8.84 4.57 0.00 3.31 3.35 0.00 5.67 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.42 3.21 0.00 4.11 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 15 S 9.23 3.95 0.00 4.08 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 H 8.47 4.11 0.00 2.81 3.10 0.00 5.90 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 8.52 3.11 0.00 1.83 1.79 0.00 3.16 0.00 0.00 3.07 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.09 0.00 18 L 8.22 3.53 0.00 1.60 1.73 0.89 1.20 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 19 A 8.70 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 20 L 8.02 3.76 0.00 1.49 1.49 0.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.22 4.19 0.00 2.42 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 22 R 7.58 3.97 0.00 2.01 2.07 0.00 3.15 0.00 0.00 3.30 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.84 0.00 23 N 8.19 4.32 0.00 3.00 2.88 0.00 0.00 7.14 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Q 8.38 3.96 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.44 2.65 0.00 25 A 8.46 4.07 1.67 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 26 K 8.38 3.84 0.00 2.02 1.92 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.76 7.81 27 S 7.85 4.07 0.00 4.01 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 28 L 8.39 4.12 0.00 1.66 1.73 0.94 0.73 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 29 L 7.38 4.58 0.00 1.68 1.68 0.96 0.83 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 30 T 7.65 4.03 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 31 H 8.54 4.93 0.00 3.17 3.28 0.00 5.72 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 7.98 4.40 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 0.00 33 R 7.54 5.18 0.00 1.70 1.85 0.00 3.24 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 34 I 8.56 4.60 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.91 0.93 0.00 0.00 35 T 8.59 5.06 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 1.27 0.00 0.00 36 T 8.33 4.85 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 1.26 0.00 0.00 37 T 7.86 4.46 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 38 V 7.46 3.39 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 1.02 0.00 0.00 0.98 0.00 0.00 39 P 0.00 4.13 0.00 2.06 2.12 0.00 3.77 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 2.04 2.19 0.00 40 K 8.17 3.92 0.00 1.86 1.85 0.00 1.64 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.52 7.81 41 A 8.16 3.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 K 8.13 3.92 0.00 1.67 1.87 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.46 7.81 43 E 8.61 4.35 0.00 2.01 1.75 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 2.06 1.81 0.00 44 L 7.52 3.88 0.00 1.80 1.74 0.95 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.76 3.88 0.00 2.06 1.95 0.00 3.18 0.00 0.00 3.32 8.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.69 0.00 46 G 8.60 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 47 F 7.41 3.91 0.00 2.85 3.16 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 48 V 8.09 3.64 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 0.98 0.00 0.00 0.99 0.00 0.00 49 D 7.94 4.01 0.00 3.00 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 50 H 8.31 3.84 0.00 3.13 3.19 0.00 5.77 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.85 3.79 0.00 1.72 1.48 0.46 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.16 3.33 1.26 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.61 0.21 0.00 0.00 53 H 7.65 3.78 0.00 2.58 3.02 0.00 5.74 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.09 4.02 0.00 1.85 1.51 0.78 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.83 3.03 0.56 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 56 K 7.54 3.79 0.00 1.61 1.74 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.46 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.33 1.49 7.81 57 R 7.41 4.02 0.00 2.04 1.93 0.00 3.21 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.56 0.00 58 G 8.54 4.15 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 0.00 0.00 0.00 59 D 8.08 4.35 0.00 2.94 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 60 L 8.64 3.71 0.00 1.65 1.70 0.88 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.50 4.03 0.00 3.21 3.46 0.00 5.77 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.15 3.83 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 63 R 8.43 3.96 0.00 1.45 1.86 0.00 2.68 0.00 0.00 2.94 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.70 0.00 64 R 8.96 3.98 0.00 2.04 2.01 0.00 3.20 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 65 L 8.50 4.12 0.00 1.69 1.81 0.91 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.18 4.05 2.32 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 0.97 0.00 0.00 1.08 0.00 0.00 67 L 7.44 4.03 0.00 1.87 1.79 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.98 4.11 0.00 1.81 2.04 0.00 3.23 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.94 0.00 69 D 7.88 4.62 0.00 2.73 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 70 L 7.90 4.48 0.00 1.68 1.69 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.35 4.74 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.92 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 72 D 8.05 4.60 0.00 2.80 2.55 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 73 V 8.58 3.60 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 0.90 0.00 0.00 0.94 0.00 0.00 74 K 8.34 4.01 0.00 1.99 1.93 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.57 7.81 75 L 8.26 3.94 0.00 1.73 1.86 0.94 0.87 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 76 V 8.20 3.72 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 0.98 0.00 0.00 1.15 0.00 0.00 77 R 8.33 4.22 0.00 2.00 2.14 0.00 3.19 0.00 0.00 3.11 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.91 0.00 78 K 8.01 3.95 0.00 1.84 2.02 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.78 7.81 79 L 7.82 4.04 0.00 1.83 1.70 0.68 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 80 F 9.36 3.73 0.00 3.14 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 81 D 8.22 4.87 0.00 2.86 2.79 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 82 E 7.73 4.77 0.00 1.91 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.24 0.00 83 I 8.10 4.06 2.01 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.01 1.07 0.00 0.00 84 A 8.56 4.19 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 85 P 0.00 4.22 0.00 2.02 2.16 0.00 3.76 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 86 R 6.91 3.82 0.00 1.19 1.39 0.00 3.03 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 87 Y 8.29 4.24 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 88 R 9.86 4.25 0.00 2.07 2.05 0.00 3.19 0.00 0.00 3.36 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 89 D 8.01 4.81 0.00 2.72 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 90 R 7.48 4.58 0.00 1.82 1.66 0.00 2.79 0.00 0.00 2.90 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.40 0.00 91 Q 8.24 4.32 0.00 2.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.32 0.00 0.00 0.00 0.00 0.00 2.21 2.34 0.00 92 G 8.14 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.28 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 94 Y 7.70 4.13 0.00 2.69 2.32 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 95 T 7.17 5.46 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 1.32 0.00 0.00 96 R 8.85 4.80 0.00 1.78 1.78 0.00 3.13 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 97 V 8.16 4.85 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 98 L 8.97 4.78 0.00 1.57 1.53 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.88 4.27 0.00 1.64 1.75 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.43 7.81 100 L 8.34 4.86 0.00 1.67 1.56 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.44 4.35 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 0.00 102 E 8.87 3.99 0.00 2.16 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 0.00 2.18 2.31 0.00 103 R 8.15 4.56 0.00 1.68 2.08 0.00 3.30 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 104 R 8.31 3.81 0.00 2.09 2.10 0.00 3.13 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 1.64 1.69 0.00 105 R 8.90 4.53 0.00 1.73 1.89 0.00 3.24 0.00 0.00 3.23 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 106 G 8.89 3.59 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 0.00 0.00 0.00 107 D 9.62 4.27 0.00 2.89 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 0.00 108 G 7.72 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 0.00 0.00 0.00 0.00 109 A 8.22 4.62 1.30 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 0.00 110 P 0.00 4.53 0.00 2.12 2.21 0.00 3.67 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 2.07 2.01 0.00 111 L 8.55 5.15 0.00 1.61 1.72 0.92 0.94 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 0.00 112 A 9.48 5.02 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.89 5.01 0.00 1.75 1.50 0.97 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 114 V 9.14 4.90 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 0.90 0.00 0.00 0.93 0.00 0.00 115 E 8.67 4.86 0.00 2.11 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 116 L 9.02 4.42 0.00 1.78 1.62 1.04 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.41 4.86 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.98 0.00 0.00 118 E 8.25 4.52 0.00 1.88 1.79 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 2.04 2.20 0.00