NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1535 8.1727 122.0496 56.2964 34.0886 174.0326 2 V 4.5272 8.1954 127.3681 60.7713 32.1407 174.5335 3 F 4.4536 9.9277 128.8784 57.5681 40.1948 174.9520 4 E 4.3090 8.9841 121.0824 55.6130 31.0499 177.0542 5 R 3.3519 8.9413 121.6599 60.5856 29.9961 179.6040 6 C 4.3579 8.0355 115.2641 59.5293 36.4151 175.7014 7 E 3.9026 8.0842 120.8335 59.1921 29.2531 178.4490 8 L 3.5634 7.9780 120.0740 57.8486 42.0737 178.4850 9 A 3.9431 7.8062 120.7170 55.5481 18.3029 179.9258 10 R 3.8935 8.0227 116.2849 59.5852 30.0290 179.5083 11 T 3.8542 7.8556 115.5791 66.6499 68.5252 176.7939 12 L 3.8789 8.1083 121.2492 57.4276 41.5837 179.4687 13 K 3.8975 7.9963 119.7199 59.5686 31.9545 178.9115 14 R 3.9355 7.7440 117.7113 58.9925 30.0436 177.5238 15 L 4.3079 7.3969 116.0170 54.0918 41.8780 176.7530 16 G 3.8278 7.8814 106.9544 47.0525 0.0000 175.1007 17 M 3.8972 7.7404 120.8359 56.3115 32.4636 175.9423 18 D 4.4237 7.9818 118.1407 55.7113 41.3111 175.8547 19 G 3.9454 9.4037 115.5088 45.5373 0.0000 171.5822 20 Y 4.2875 8.2695 122.1350 58.7285 38.9186 176.3131 21 R 3.5737 9.0571 126.4702 57.2091 27.8342 177.1945 22 G 3.7920 8.2351 103.3492 45.5888 0.0000 174.0338 23 I 4.0821 7.6566 122.0429 58.9675 37.9636 175.8581 24 S 4.6092 8.3166 120.4126 57.7462 63.9080 174.9130 25 L 4.1915 9.0874 123.5625 58.6940 41.7367 179.3725 26 A 4.1351 8.2123 119.9568 55.3110 18.1550 179.2673 27 N 4.4440 8.1762 115.1647 56.2771 38.6045 177.6934 28 W 4.2263 8.0441 119.9203 59.9518 29.1491 178.3478 29 M 4.1671 8.5135 118.8726 58.5632 31.4413 177.8891 30 C 3.1587 8.0614 118.6171 59.1552 44.4295 175.3498 31 L 3.9581 8.2558 121.7895 58.2944 41.7347 178.8436 32 A 4.1829 8.3857 120.7958 54.8882 18.3477 179.5003 33 K 2.8274 8.1351 118.1607 59.3109 32.0674 179.1064 34 W 4.3436 7.6871 117.1110 58.9516 29.0759 178.2766 35 E 4.3650 8.1966 118.5745 58.4382 29.1284 177.5426 36 S 4.5277 7.8571 109.5156 56.5526 64.5749 174.4363 37 G 3.2283 8.0898 108.7462 46.9643 0.0000 173.3153 38 Y 3.6604 7.6756 113.4323 58.6592 35.0046 168.6454 39 N 5.3860 7.6433 117.9532 51.9710 40.1674 175.6212 40 T 4.0875 8.9616 117.1512 63.7467 69.2448 175.9398 41 R 4.5472 8.0809 117.1185 55.5914 29.9947 176.0665 42 A 4.3421 7.6732 121.4619 52.7270 19.2349 177.2278 43 T 5.0419 8.3968 111.3115 60.0561 72.6200 173.1310 44 N 4.8644 8.6977 121.6783 52.5385 42.4308 172.3540 45 Y 4.6730 8.7630 128.0199 57.0624 40.8044 173.8254 46 N 4.7359 8.5008 125.0373 51.3381 38.6739 175.4990 47 A 3.7482 8.3543 127.9054 54.8093 18.9167 179.0378 48 G 3.7671 8.0902 104.1824 48.0812 0.0000 173.7512 49 D 4.7152 7.4846 114.8567 52.0372 40.2626 175.8695 50 R 4.0166 8.1211 116.6946 57.2368 28.0923 175.8710 51 S 4.9221 7.6511 112.2412 57.1872 66.3897 172.6644 52 T 5.0698 8.6616 115.9906 61.9453 72.6277 172.8399 53 D 5.4134 9.0628 125.7041 53.3944 43.0575 175.0732 54 Y 4.9449 9.2424 120.9586 57.5054 41.6210 177.2428 55 G 4.1273 9.0181 111.7310 45.4974 0.0000 173.4026 56 I 3.8903 8.2046 116.8073 62.9614 37.9290 177.4348 57 F 4.6991 7.9546 115.5483 56.3883 39.8140 175.2545 58 Q 3.6244 7.8929 119.1885 57.1479 26.5857 174.2442 59 I 4.3840 8.1669 118.9768 61.2190 39.2491 176.9712 60 N 5.3605 9.2814 126.1165 53.4738 39.7575 175.7002 61 S 4.7133 9.0541 120.4189 60.1250 63.2628 175.4003 62 R 3.7406 8.7449 122.2426 58.6244 30.3314 177.7482 63 Y 4.1765 7.5327 114.1075 57.7006 40.8090 177.1434 64 W 4.7452 7.9882 118.9118 57.8512 29.8791 173.7014 65 C 5.6074 7.9060 110.5489 53.5091 45.8550 171.7918 66 N 5.1687 8.8638 119.5270 52.1406 39.8463 174.7944 67 D 4.8490 8.5251 122.9645 52.2395 40.5273 178.0181 68 G 4.0895 8.4706 109.6226 46.0226 0.0000 174.7791 69 K 4.3709 7.8969 115.8883 56.7575 33.2365 176.1687 70 T 4.3851 7.4786 116.5021 61.7267 69.1145 173.0786 71 P 4.2523 0.0000 0.0000 63.8216 32.1282 176.3967 72 G 3.9087 8.4469 109.5122 46.6007 0.0000 172.4846 73 A 4.7527 7.6508 117.8834 50.2244 21.7406 177.3978 74 V 4.3372 8.2838 112.4060 59.4497 35.5986 176.1528 75 N 4.9635 8.2102 118.2222 51.8535 38.0045 174.1211 76 A 4.0782 9.1353 124.5654 54.5036 19.1204 178.2918 77 C 4.4023 8.7559 111.0901 56.5550 40.8768 173.7225 78 H 4.1117 7.7640 115.5088 56.6802 26.3494 174.1289 79 L 4.8431 8.4651 117.7855 52.8671 46.5541 176.7365 80 S 4.6327 8.3387 115.0884 58.0344 63.2882 176.0439 81 C 4.1491 8.6641 123.7177 59.5993 40.8191 176.3255 82 S 3.9078 7.7501 114.5946 61.3872 61.6540 175.9996 83 A 4.0612 7.6937 121.9385 54.5802 17.9905 177.9763 84 L 4.4330 7.8476 116.1997 55.1403 41.7612 177.6484 85 L 5.2791 7.7244 116.7439 53.7203 42.2909 176.7357 86 Q 4.3583 7.7732 117.7798 55.4490 29.5204 175.9733 87 D 4.4341 8.5208 119.7408 57.0516 41.1801 176.8932 88 N 4.6034 8.0675 118.1201 53.2294 39.4484 174.6249 89 I 4.3217 8.4179 118.6292 61.0025 38.1251 177.1539 90 A 3.9380 8.6020 125.4903 56.0506 18.1736 180.3198 91 D 4.3114 8.0724 116.5641 57.3638 40.9079 178.6952 92 A 4.0914 8.0217 120.7155 55.0314 18.4612 179.4208 93 A 3.7780 8.4399 119.5153 55.2198 18.3212 179.7511 94 A 3.7963 7.9802 119.3372 55.3400 18.3813 179.0956 95 C 4.2282 8.4337 116.9097 59.5926 37.8932 175.5840 96 A 3.9183 8.1696 122.6814 55.0835 17.6215 179.7605 97 K 3.8734 7.5587 116.1749 59.3757 32.2752 179.2882 98 R 4.0596 7.6091 119.1334 59.2905 29.9124 178.5191 99 V 2.1735 7.3853 118.0414 65.7431 31.2998 177.8555 100 V 3.9159 7.5825 109.1111 62.3215 31.3039 177.6967 101 R 4.1902 7.7115 118.6369 57.3574 30.5252 176.0560 102 D 4.7028 7.2858 119.0537 53.0292 41.7844 175.1823 103 P 4.2221 0.0000 0.0000 66.3532 31.0855 177.8548 104 Q 4.0086 8.1462 117.3634 56.5013 30.0283 177.1410 105 G 3.7136 7.8753 106.9737 46.8990 0.0000 176.4070 106 I 3.5553 7.7972 120.7239 63.5148 37.9334 177.9523 107 R 4.2174 7.2834 117.9385 58.0728 29.9544 177.5339 108 A 4.0222 7.6301 120.7237 54.0067 18.5869 177.3698 109 W 4.7575 8.0443 116.5701 55.1887 29.9704 177.3900 110 V 3.7494 8.6971 123.8530 65.9571 30.9315 177.6025 111 A 4.0613 8.2991 120.2390 54.7945 18.1484 179.2113 112 W 3.9677 8.4132 127.0904 60.5782 30.5490 178.5056 113 R 3.6605 8.0040 116.6637 59.2739 29.6974 178.3611 114 N 4.3424 7.8963 115.0480 55.6628 38.6829 176.8705 115 R 4.0542 7.6080 116.2129 55.9642 31.6643 176.1882 116 C 4.5732 7.1336 114.6339 57.6713 42.7889 174.2363 117 Q 3.3335 6.5767 119.9503 57.2692 28.6589 175.5829 118 N 4.1959 8.6874 120.6977 54.3190 36.1778 173.8136 119 R 4.5073 7.3887 115.0498 54.0968 33.0939 175.7596 120 D 4.5732 8.4251 118.9790 53.9789 40.3614 175.8123 121 V 4.5580 8.1817 118.8643 61.1791 32.3483 178.4535 122 R 4.0560 8.1011 122.4351 59.2743 30.2943 178.8459 123 Q 3.9905 8.2074 115.4796 59.3724 28.4202 178.5337 124 Y 4.1613 7.7463 115.0653 60.1159 38.0440 177.0152 125 V 4.3818 7.8810 110.8660 60.7436 32.7937 175.4893 126 Q 4.0958 7.5394 120.2168 57.2009 28.7623 177.0221 127 G 3.9632 8.9199 110.3814 45.9627 0.0000 174.5910 128 C 4.4030 7.9489 116.0805 57.0004 40.5839 174.0498 129 G 3.8423 8.1511 107.1814 46.7284 0.0000 174.0920 130 V 4.0004 7.8834 118.0642 61.0711 32.0094 175.8789 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 4.15 0.00 1.96 1.65 0.00 1.26 0.00 0.00 0.89 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.84 1.10 7.81 2 V 8.20 4.53 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 0.95 0.00 0.00 3 F 9.93 4.45 0.00 2.85 2.82 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 4 E 8.98 4.31 0.00 1.96 1.86 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 2.30 2.35 0.00 5 R 8.94 3.35 0.00 1.92 1.92 0.00 3.44 0.00 0.00 3.46 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 6 C 8.04 4.36 0.00 3.00 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 8.08 3.90 0.00 2.06 2.24 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 2.56 2.41 0.00 8 L 7.98 3.56 0.00 1.39 1.41 -0.05 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.81 3.94 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 10 R 8.02 3.89 0.00 1.88 1.99 0.00 3.13 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.86 3.85 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 1.20 0.00 0.00 12 L 8.11 3.88 0.00 1.73 1.57 0.96 0.58 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 13 K 8.00 3.90 0.00 1.95 1.93 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.74 3.94 0.00 2.03 1.92 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.40 4.31 0.00 1.62 1.54 0.85 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.88 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 17 M 7.74 3.90 0.00 1.11 1.81 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.36 0.00 18 D 7.98 4.42 0.00 2.67 2.67 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 19 G 9.40 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 0.00 0.00 0.00 20 Y 8.27 4.29 0.00 3.33 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 21 R 9.06 3.57 0.00 1.82 1.80 0.00 3.21 0.00 0.00 2.97 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.27 0.00 22 G 8.24 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 23 I 7.66 4.08 1.76 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.62 -0.26 0.00 0.00 24 S 8.32 4.61 0.00 4.06 4.03 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 0.00 0.00 0.00 25 L 9.09 4.19 0.00 2.07 1.82 0.99 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.21 4.14 1.52 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 0.00 0.00 27 N 8.18 4.44 0.00 2.83 2.74 0.00 0.00 6.92 7.70 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 28 W 8.04 4.23 0.00 3.54 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 29 M 8.51 4.17 0.00 2.17 2.36 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 2.71 2.91 0.00 30 C 8.06 3.16 0.00 2.56 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 31 L 8.26 3.96 0.00 1.86 1.86 0.49 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.39 4.18 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.14 2.83 0.00 1.47 1.73 0.00 0.69 0.00 0.00 0.97 0.00 0.00 2.55 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.12 0.21 7.81 34 W 7.69 4.34 0.00 3.34 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 35 E 8.20 4.37 0.00 2.03 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 0.00 2.57 2.37 0.00 36 S 7.86 4.53 0.00 4.08 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 0.00 37 G 8.09 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 0.00 0.00 0.00 38 Y 7.68 3.66 0.00 3.25 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 7.64 5.39 0.00 2.85 2.82 0.00 0.00 7.01 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 8.96 4.09 4.46 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 1.50 0.00 0.00 41 R 8.08 4.55 0.00 2.00 2.09 0.00 3.09 0.00 0.00 3.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 42 A 7.67 4.34 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 43 T 8.40 5.04 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 1.35 0.00 0.00 44 N 8.70 4.86 0.00 3.03 2.66 0.00 0.00 6.92 7.51 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 45 Y 8.76 4.67 0.00 2.99 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 8.50 4.74 0.00 2.61 2.60 0.00 0.00 6.52 7.45 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 47 A 8.35 3.75 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 48 G 8.09 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 49 D 7.48 4.72 0.00 2.70 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 50 R 8.12 4.02 0.00 2.05 2.21 0.00 3.13 0.00 0.00 3.19 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.54 0.00 51 S 7.65 4.92 0.00 3.85 3.98 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 52 T 8.66 5.07 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 0.65 0.00 0.00 53 D 9.06 5.41 0.00 2.70 2.83 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 0.00 0.00 0.00 54 Y 9.24 4.94 0.00 2.92 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 55 G 9.02 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 0.00 0.00 0.00 56 I 8.20 3.89 1.67 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.80 0.06 0.00 0.00 57 F 7.95 4.70 0.00 3.19 2.95 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 58 Q 7.89 3.62 0.00 2.54 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.83 0.00 0.00 0.00 0.00 0.00 2.41 2.77 0.00 59 I 8.17 4.38 2.16 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.09 1.19 0.00 0.00 60 N 9.28 5.36 0.00 3.02 3.06 0.00 0.00 6.98 7.21 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 61 S 9.05 4.71 0.00 4.07 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 62 R 8.74 3.74 0.00 1.53 1.26 0.00 2.64 0.00 0.00 2.89 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.08 0.00 63 Y 7.53 4.18 0.00 1.43 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 0.00 0.00 0.00 64 W 7.99 4.75 0.00 3.70 3.31 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 65 C 7.91 5.61 0.00 3.18 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 66 N 8.86 5.17 0.00 2.81 2.71 0.00 0.00 7.08 8.30 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 67 D 8.53 4.85 0.00 2.97 2.78 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 68 G 8.47 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 69 K 7.90 4.37 0.00 1.94 1.94 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.57 1.47 7.81 70 T 7.48 4.39 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 1.15 0.00 0.00 71 P 0.00 4.25 0.00 2.02 1.97 0.00 3.81 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 2.03 2.09 0.00 72 G 8.45 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 73 A 7.65 4.75 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 74 V 8.28 4.34 2.02 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 0.64 0.00 0.00 0.87 0.00 0.00 75 N 8.21 4.96 0.00 2.79 2.65 0.00 0.00 6.76 8.22 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 76 A 9.14 4.08 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 77 C 8.76 4.40 0.00 3.21 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 78 H 7.76 4.11 0.00 3.34 3.36 0.00 5.62 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.47 4.84 0.00 1.66 1.50 0.97 1.06 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 S 8.34 4.63 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 8.66 4.15 0.00 2.23 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 82 S 7.75 3.91 0.00 3.85 3.83 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 0.00 0.00 0.00 83 A 7.69 4.06 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 84 L 7.85 4.43 0.00 1.93 1.81 1.07 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.72 5.28 0.00 1.77 1.71 1.10 1.00 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 86 Q 7.77 4.36 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.55 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 87 D 8.52 4.43 0.00 2.63 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 88 N 8.07 4.60 0.00 2.70 2.74 0.00 0.00 6.92 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 4.32 1.78 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.92 0.98 0.00 0.00 90 A 8.60 3.94 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 91 D 8.07 4.31 0.00 2.75 2.74 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 92 A 8.02 4.09 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 93 A 8.44 3.78 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 94 A 7.98 3.80 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 95 C 8.43 4.23 0.00 3.12 3.14 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 0.00 96 A 8.17 3.92 0.88 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 97 K 7.56 3.87 0.00 1.64 1.37 0.00 1.28 0.00 0.00 0.75 0.00 0.00 2.31 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.30 1.01 7.81 98 R 7.61 4.06 0.00 1.90 2.13 0.00 3.27 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 1.81 1.92 0.00 99 V 7.39 2.17 1.85 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 -0.18 0.00 0.00 -0.53 0.00 0.00 100 V 7.58 3.92 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 1.13 0.00 0.00 1.41 0.00 0.00 101 R 7.71 4.19 0.00 2.20 2.01 0.00 3.34 0.00 0.00 3.30 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 102 D 7.29 4.70 0.00 3.01 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 0.00 103 P 0.00 4.22 0.00 2.14 2.20 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 104 Q 8.15 4.01 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.80 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.88 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 0.00 106 I 7.80 3.56 1.02 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.29 -0.56 0.00 0.00 107 R 7.28 4.22 0.00 2.00 2.04 0.00 3.23 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.58 0.00 108 A 7.63 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.04 4.76 0.00 3.52 3.25 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 0.00 110 V 8.70 3.75 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 1.09 0.00 0.00 1.00 0.00 0.00 111 A 8.30 4.06 1.52 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 0.00 0.00 112 W 8.41 3.97 0.00 3.50 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 0.00 113 R 8.00 3.66 0.00 2.06 1.97 0.00 3.58 0.00 0.00 3.56 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.05 0.00 114 N 7.90 4.34 0.00 2.54 2.70 0.00 0.00 6.97 7.75 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 0.00 115 R 7.61 4.05 0.00 0.94 0.69 0.00 2.82 0.00 0.00 2.85 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.97 0.00 116 C 7.13 4.57 0.00 1.73 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 3.33 0.00 0.93 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.79 0.00 0.00 0.00 0.00 0.00 2.18 2.19 0.00 118 N 8.69 4.20 0.00 2.80 2.82 0.00 0.00 6.89 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 7.39 4.51 0.00 1.83 1.81 0.00 3.09 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.35 0.00 120 D 8.43 4.57 0.00 2.62 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 0.00 121 V 8.18 4.56 2.38 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 1.00 0.00 0.00 1.06 0.00 0.00 122 R 8.10 4.06 0.00 1.96 2.02 0.00 3.31 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 123 Q 8.21 3.99 0.00 2.04 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.90 0.00 0.00 0.00 0.00 0.00 2.14 1.54 0.00 124 Y 7.75 4.16 0.00 3.27 3.17 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 0.00 125 V 7.88 4.38 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 1.13 0.00 0.00 1.06 0.00 0.00 126 Q 7.54 4.10 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.71 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 127 G 8.92 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 0.00 128 C 7.95 4.40 0.00 3.02 3.14 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 0.00 129 G 8.15 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 0.00 130 V 7.88 4.00 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 0.76 0.00 0.00 0.96 0.00 0.00