NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 R 4.3288 8.1133 117.2814 56.3969 31.8410 176.2878 9 R 4.0315 7.8271 118.4315 56.1198 30.6933 177.1136 10 K 4.0040 8.6565 121.8038 58.8652 32.5816 178.1069 11 L 3.9359 7.4172 118.1059 58.2210 41.6644 180.1306 12 R 3.9317 7.9017 115.2360 59.2212 29.5622 178.5800 13 T 4.2079 7.7178 110.5948 64.1701 68.9015 177.2466 14 R 3.9746 8.3348 121.5317 59.2601 30.1214 178.9724 15 R 3.8534 8.0454 117.6484 59.2013 29.9166 178.9272 16 K 3.8684 8.1424 117.6327 59.6822 32.2308 179.1506 17 V 3.7392 7.7043 117.7903 65.1659 31.2728 177.7408 18 R 4.2336 7.7090 118.9338 57.9975 29.9612 176.0366 19 T 3.9594 7.7176 115.2814 63.7997 67.9428 174.2259 20 T 4.1467 8.2424 123.5235 63.6988 70.2526 173.4101 21 T 3.8201 8.8559 122.1765 65.4321 67.0942 177.2054 22 A 3.9762 9.2208 129.1639 55.5812 19.5863 179.9787 23 A 4.0485 8.1425 117.4725 55.4740 17.7522 178.1720 24 S 4.1228 7.2862 111.9605 57.1981 63.5923 173.6444 25 G 4.1741 8.2894 111.3307 46.1560 0.0000 173.8177 26 R 4.1607 7.5461 116.6100 56.3509 30.9082 175.7390 27 L 4.9726 7.9859 118.1578 53.1123 45.3136 176.1656 28 R 5.0395 8.4230 117.3255 54.4651 32.6532 174.4272 29 L 5.1475 9.0744 124.6250 53.7893 44.4470 175.7327 30 S 5.4992 9.1449 125.4797 59.4346 66.5481 172.9339 31 V 4.5739 7.2830 121.0741 62.7147 33.6935 170.8892 32 Y 5.3111 8.0293 127.0292 57.5169 39.3144 176.9006 33 R 3.8304 7.7454 115.6762 55.5373 29.4495 178.0425 34 S 3.8517 7.2129 113.7389 59.6673 63.3724 173.2081 35 S 4.6149 6.5715 112.8881 56.8526 64.1878 173.3389 36 K 4.5670 8.2265 117.3447 56.7881 32.6447 175.5259 37 H 4.8097 7.2680 114.1873 54.7630 30.1696 171.9487 38 I 3.8175 7.3970 118.4829 62.1033 37.9918 174.2346 39 Y 4.5990 8.8547 112.9371 60.2113 43.1200 176.5783 40 A 4.0201 7.3343 121.9099 53.0376 15.5098 175.5309 41 Q 4.5623 7.5216 126.7745 54.9280 31.7346 174.8797 42 I 5.0916 8.2336 123.6966 59.4013 41.3294 173.9668 43 I 5.0735 8.8636 129.4717 59.5410 41.4949 173.6633 44 D 4.7111 9.1475 124.9768 55.6217 41.9512 176.7231 45 D 3.5091 8.3464 119.1229 52.8628 43.4148 177.8526 46 S 4.0477 9.3089 110.9163 59.2518 62.8138 176.6733 47 R 3.7666 9.1692 114.0763 56.2893 31.2679 178.2793 48 G 3.9612 8.5258 113.6886 45.4601 0.0000 171.9122 49 Q 4.4804 7.6706 119.0179 54.5246 32.1570 175.1082 50 T 4.7451 8.3989 119.9143 62.2509 68.5823 174.0022 51 L 4.2370 7.8881 129.6033 56.7869 43.6935 180.3950 52 A 4.4451 7.4691 128.6719 50.6646 17.4653 181.2398 53 A 4.2015 10.3689 120.6614 54.5483 18.1766 179.8685 54 A 4.8541 8.0873 124.8163 51.0884 21.4990 178.1560 55 S 4.8623 7.9047 123.9334 57.0752 62.6462 176.3284 56 S 4.6150 8.2435 109.3057 58.2777 64.7221 177.1553 57 A 3.9554 8.7454 125.7538 55.3658 18.2441 180.5225 58 A 4.1602 7.6765 120.0172 52.9591 15.7324 177.9703 59 L 3.7674 8.2832 123.1534 54.1476 41.0240 174.1410 60 K 4.4266 8.3732 113.0611 56.7948 37.0871 176.4633 61 S 3.8970 9.1222 113.0112 59.5777 61.3139 171.3598 62 G 4.1122 8.5092 110.5864 46.7237 0.0000 174.8361 63 N 4.8399 7.8185 116.7459 52.1164 39.0307 175.0907 64 K 4.6122 8.9521 118.5585 55.2634 34.8527 176.9326 65 T 4.3908 7.8043 107.5370 62.2758 70.5450 175.3955 66 D 4.4215 8.1410 122.1943 57.4490 40.7219 178.1514 67 T 3.9396 8.3328 106.4961 63.6636 68.8366 176.2317 68 A 3.1473 8.0166 117.2829 53.5874 19.3159 178.5748 69 A 3.9858 8.7549 125.2992 53.1500 19.3072 179.6425 70 A 4.0117 7.9457 120.2922 55.5121 18.4820 180.2611 71 V 3.8415 7.6037 117.1960 64.7485 31.4903 178.8426 72 G 3.5961 7.9180 106.0033 47.4961 0.0000 175.4206 73 K 4.0016 8.9470 122.6862 58.7718 31.8183 178.6752 74 A 4.0689 8.4427 121.2564 54.0506 18.1787 178.8213 75 L 4.1076 7.8995 118.9915 57.3876 42.3212 178.0367 76 A 3.9612 8.1414 120.5388 55.4149 18.0885 179.0762 77 A 3.9773 7.4882 117.2545 56.3224 18.6596 178.8844 78 A 3.7136 8.0128 116.5916 55.3654 18.2076 180.0588 79 A 3.8637 8.9076 116.4727 55.1909 18.8565 180.2746 80 A 3.8759 7.3522 117.9300 54.9837 19.3290 178.4421 81 E 4.3595 8.5907 116.9858 55.8626 29.3157 176.5663 82 K 4.1004 8.1527 121.0433 55.1553 37.3375 173.5430 83 G 3.7752 8.2680 111.5282 45.1954 0.0000 172.0777 84 I 4.4845 7.9259 124.8477 59.1352 40.2540 175.5074 85 K 4.1781 8.8992 126.3490 58.0128 31.5034 176.2136 86 Q 4.6774 7.8166 117.7031 54.1242 31.1125 175.0114 87 V 4.7526 8.1234 122.4195 61.4311 35.9139 174.3563 88 V 3.3909 8.9711 122.6174 60.5216 34.6705 174.3836 89 F 4.8423 6.1459 124.9228 57.0475 34.5928 175.3744 90 D 4.9050 8.4948 132.0451 53.1512 37.9776 177.2524 91 R 4.6476 7.8671 115.2964 56.8978 31.1967 177.2403 92 G 3.8940 7.8955 108.7783 45.3911 0.0000 175.2537 93 S 3.9711 8.1187 118.9224 61.1629 62.7585 172.8899 94 Y 4.3740 6.8296 117.2647 58.5781 37.8162 177.6359 95 K 4.1488 8.8331 128.8268 59.4142 31.2088 178.4657 96 Y 3.7315 7.1330 121.6473 58.9895 38.7799 170.6708 97 H 4.4677 8.1602 126.9096 56.6398 28.6383 175.1311 98 G 3.7118 8.4174 104.4032 44.4201 0.0000 174.3382 99 R 3.8033 7.8740 120.1974 58.6524 30.1958 178.7775 100 V 3.7757 7.5572 118.9757 64.1107 31.9992 178.0285 101 K 3.4438 7.7705 119.4660 58.5780 31.7442 177.3734 102 A 3.9782 8.6899 120.5450 53.8874 17.8110 179.3401 103 L 3.8191 8.1084 118.9707 56.8209 45.4818 179.8636 104 A 4.3995 8.9232 119.7294 53.5704 17.2548 179.4507 105 D 4.4923 6.0500 118.5752 56.9853 41.6721 177.3374 106 A 4.0218 8.4185 121.1626 56.0475 18.2009 179.6181 107 A 4.0974 8.5655 118.1945 54.6937 18.3323 180.0509 108 R 4.3393 8.6373 116.7459 56.2583 30.4937 175.6794 109 E 4.8215 9.1393 120.2225 56.6417 35.5992 177.8695 110 G 3.7672 8.5628 108.5898 47.4245 0.0000 173.4927 111 G 3.7379 7.5263 112.0355 45.6648 0.0000 173.5114 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 8 R 8.11 4.33 0.00 2.02 2.09 0.00 2.94 0.00 0.00 3.34 7.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 9 R 7.83 4.03 0.00 1.96 2.00 0.00 3.14 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 10 K 8.66 4.00 0.00 1.79 1.85 0.00 1.97 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.39 7.81 11 L 7.42 3.94 0.00 1.92 1.70 0.91 0.83 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 12 R 7.90 3.93 0.00 1.95 2.10 0.00 2.93 0.00 0.00 3.36 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.65 0.00 13 T 7.72 4.21 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 1.20 0.00 0.00 14 R 8.33 3.97 0.00 1.92 2.00 0.00 3.12 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.07 0.00 15 R 8.05 3.85 0.00 1.95 1.98 0.00 3.32 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 16 K 8.14 3.87 0.00 1.85 1.90 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.56 7.81 17 V 7.70 3.74 2.16 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 0.78 0.00 0.00 0.93 0.00 0.00 18 R 7.71 4.23 0.00 2.00 2.17 0.00 3.26 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 19 T 7.72 3.96 4.49 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 1.24 0.00 0.00 20 T 8.24 4.15 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 1.24 0.00 0.00 21 T 8.86 3.82 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 1.20 0.00 0.00 22 A 9.22 3.98 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 23 A 8.14 4.05 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 24 S 7.29 4.12 0.00 4.21 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 25 G 8.29 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 0.00 0.00 0.00 26 R 7.55 4.16 0.00 1.66 1.86 0.00 3.10 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 27 L 7.99 4.97 0.00 1.59 1.61 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.42 5.04 0.00 1.96 1.98 0.00 3.25 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 29 L 9.07 5.15 0.00 1.73 1.55 1.01 1.00 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 30 S 9.14 5.50 0.00 3.98 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 31 V 7.28 4.57 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 0.79 0.00 0.00 1.12 0.00 0.00 32 Y 8.03 5.31 0.00 3.17 3.10 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 33 R 7.75 3.83 0.00 1.44 1.56 0.00 3.19 0.00 0.00 3.12 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 34 S 7.21 3.85 0.00 4.06 3.52 0.00 0.00 0.00 0.00 0.00 0.00 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 S 6.57 4.61 0.00 3.71 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 36 K 8.23 4.57 0.00 1.69 1.75 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.28 1.26 7.81 37 H 7.27 4.81 0.00 2.78 3.15 0.00 5.99 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 I 7.40 3.82 1.81 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.83 0.84 0.00 0.00 39 Y 8.85 4.60 0.00 3.08 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 40 A 7.33 4.02 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.52 4.56 0.00 2.20 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 42 I 8.23 5.09 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.59 0.95 0.00 0.00 43 I 8.86 5.07 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 1.09 0.98 0.95 0.00 0.00 44 D 9.15 4.71 0.00 2.68 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 45 D 8.35 3.51 0.00 2.85 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 46 S 9.31 4.05 0.00 3.99 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 47 R 9.17 3.77 0.00 1.81 1.96 0.00 3.20 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 48 G 8.53 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 Q 7.67 4.48 0.00 2.06 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.90 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 50 T 8.40 4.75 4.21 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 1.30 0.00 0.00 51 L 7.89 4.24 0.00 1.61 1.57 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.47 4.45 0.99 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 53 A 10.37 4.20 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 A 8.09 4.85 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 55 S 7.90 4.86 0.00 3.94 3.22 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 56 S 8.24 4.62 0.00 3.76 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 57 A 8.75 3.96 1.26 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 58 A 7.68 4.16 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 59 L 8.28 3.77 0.00 1.81 1.74 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.37 4.43 0.00 2.09 1.95 0.00 1.62 0.00 0.00 1.85 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.36 7.81 61 S 9.12 3.90 0.00 4.15 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.51 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 63 N 7.82 4.84 0.00 2.78 2.74 0.00 0.00 6.71 8.83 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 64 K 8.95 4.61 0.00 1.90 1.80 0.00 1.20 0.00 0.00 1.41 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.24 1.26 7.81 65 T 7.80 4.39 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 1.16 0.00 0.00 66 D 8.14 4.42 0.00 2.70 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 67 T 8.33 3.94 4.21 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 1.28 0.00 0.00 68 A 8.02 3.15 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 69 A 8.75 3.99 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 70 A 7.95 4.01 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 71 V 7.60 3.84 2.50 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 0.94 0.00 0.00 1.02 0.00 0.00 72 G 7.92 3.60 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 0.00 0.00 0.00 73 K 8.95 4.00 0.00 1.85 2.03 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.46 7.81 74 A 8.44 4.07 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 75 L 7.90 4.11 0.00 1.95 1.86 1.03 0.77 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 76 A 8.14 3.96 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.49 3.98 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 78 A 8.01 3.71 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.91 3.86 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 80 A 7.35 3.88 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.59 4.36 0.00 2.07 1.97 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 2.34 2.28 0.00 82 K 8.15 4.10 0.00 1.82 1.78 0.00 1.90 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.27 1.25 7.81 83 G 8.27 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 0.00 0.00 0.00 84 I 7.93 4.48 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 1.29 0.58 0.89 0.00 0.00 85 K 8.90 4.18 0.00 1.70 1.80 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.44 7.81 86 Q 7.82 4.68 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.45 0.00 0.00 0.00 0.00 0.00 2.33 2.24 0.00 87 V 8.12 4.75 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 0.72 0.00 0.00 0.89 0.00 0.00 88 V 8.97 3.39 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 0.44 0.00 0.00 0.79 0.00 0.00 89 F 6.15 4.84 0.00 3.15 3.22 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 90 D 8.49 4.91 0.00 2.83 2.92 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 91 R 7.87 4.65 0.00 2.15 2.24 0.00 3.20 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 1.66 1.86 0.00 92 G 7.90 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 93 S 8.12 3.97 0.00 3.76 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 94 Y 6.83 4.37 0.00 3.05 2.92 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 95 K 8.83 4.15 0.00 1.81 1.85 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.48 1.65 7.81 96 Y 7.13 3.73 0.00 2.96 3.24 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 97 H 8.16 4.47 0.00 3.10 2.68 0.00 5.94 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 G 8.42 3.71 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 0.00 0.00 0.00 99 R 7.87 3.80 0.00 1.88 2.04 0.00 2.87 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 100 V 7.56 3.78 2.04 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 0.78 0.00 0.00 1.02 0.00 0.00 101 K 7.77 3.44 0.00 1.46 1.73 0.00 1.50 0.00 0.00 1.66 0.00 0.00 3.10 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.61 1.06 7.81 102 A 8.69 3.98 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 0.00 103 L 8.11 3.82 0.00 1.70 1.80 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 104 A 8.92 4.40 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 0.00 105 D 6.05 4.49 0.00 2.67 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 0.00 106 A 8.42 4.02 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 A 8.57 4.10 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.64 4.34 0.00 1.85 2.10 0.00 3.43 0.00 0.00 3.43 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 109 E 9.14 4.82 0.00 2.06 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 0.00 2.45 2.19 0.00 110 G 8.56 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 0.00 111 G 7.53 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 0.00 0.00 0.00