NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2816 8.1733 120.1333 56.8803 34.8385 173.8819 2 D 5.1625 8.3928 121.0641 52.5391 41.9713 175.7480 3 F 4.5173 10.0911 124.6591 57.0102 40.6906 175.1451 4 E 4.2532 9.2412 121.3122 55.6479 30.9107 176.8647 5 R 3.4013 9.0971 121.2172 60.9121 29.9841 179.4445 6 C 4.3227 8.0507 115.2895 59.6683 40.1969 175.7160 7 E 3.9068 8.1280 120.7129 59.2464 29.3121 178.5308 8 L 3.6254 8.1224 120.2076 57.9256 42.0708 178.5569 9 A 3.9708 7.9297 120.7353 55.4094 18.2018 179.9173 10 R 3.8942 8.0715 116.3946 59.4892 30.1262 179.3085 11 T 3.8478 7.9070 115.5581 66.7323 68.4777 176.6274 12 L 3.8362 8.1983 121.1584 57.4861 41.5775 179.5174 13 K 3.9043 8.0161 119.5782 59.7004 31.9711 179.1290 14 R 3.9694 8.1112 117.3552 58.8972 30.0039 178.0928 15 L 4.3626 7.5408 116.2911 54.3178 41.7073 177.1527 16 G 3.8781 7.9158 106.9788 46.7512 0.0000 175.0406 17 M 3.9633 7.8567 121.0716 56.4347 32.3113 175.7066 18 D 4.5414 8.0346 117.7954 55.8348 40.9735 175.6319 19 G 3.9343 9.3030 115.4718 45.4988 0.0000 171.2190 20 Y 4.2365 8.3507 122.0235 58.6241 38.9131 176.3874 21 R 3.6285 8.9435 126.8406 57.3025 27.7777 177.2417 22 G 3.8006 8.1851 103.2136 45.7578 0.0000 174.0408 23 I 4.0704 7.4900 121.9572 59.0207 38.0598 175.8920 24 S 4.6494 8.3039 120.3420 57.7450 63.8523 174.9323 25 L 4.2463 8.7132 123.5019 58.5763 41.7607 179.2822 26 A 4.1370 8.1863 120.1501 55.3600 18.2079 179.2764 27 N 4.4489 8.1448 114.9067 56.2571 38.5637 177.6904 28 W 4.3060 8.0303 119.8838 59.9910 29.1185 178.2510 29 M 4.1172 8.5450 118.9154 58.6994 31.4705 177.9485 30 C 3.2273 8.0002 118.4496 59.1213 44.8236 175.3343 31 L 3.9664 8.2417 121.7611 58.2686 41.7757 178.8246 32 A 4.1531 8.3891 120.8642 54.9201 18.2935 179.3735 33 K 2.9272 8.2620 118.2488 59.4056 32.0348 179.0501 34 W 4.2182 7.7091 117.0084 58.9774 29.0858 178.2355 35 E 4.3977 8.2627 118.6141 58.5228 29.3504 177.6602 36 S 4.5023 7.9627 108.8683 56.8813 65.1180 174.3813 37 G 3.3653 8.2846 108.8063 47.0128 0.0000 173.4702 38 Y 3.6931 7.7438 113.4818 58.6430 35.2291 168.4131 39 N 5.4108 7.7132 118.9943 51.9706 40.6473 175.7832 40 T 3.9447 8.8239 116.1925 64.0843 69.2390 176.0395 41 R 4.3861 7.8809 118.6448 56.0605 30.9638 176.2282 42 A 4.3534 7.5027 121.7819 52.4362 19.4058 176.8829 43 T 5.1044 8.3199 110.6809 60.0296 72.4388 172.8025 44 N 4.9424 8.9548 122.0296 52.1466 42.1467 172.2059 45 Y 4.9025 8.7085 127.4847 56.8754 40.8817 173.7865 46 N 4.7760 8.4004 124.6410 51.2179 39.0762 175.5028 47 A 3.6281 8.2742 127.8825 54.6095 18.9331 179.1876 48 G 3.6735 8.0457 104.5559 48.5069 0.0000 174.2856 49 D 4.7389 7.8559 118.0863 51.6874 39.6702 176.3935 50 R 4.0988 7.7113 115.9088 56.8145 28.2581 175.8494 51 S 4.9952 7.2598 110.0584 56.9749 66.7088 172.6534 52 T 5.1574 8.9373 115.6984 61.9895 72.7298 172.9023 53 D 5.4827 9.0884 125.4119 53.2482 43.1555 175.1385 54 Y 5.0230 9.0797 120.6308 57.4109 41.9884 177.4355 55 G 4.4855 8.8948 111.5949 45.7640 0.0000 173.6077 56 I 4.0179 8.2521 116.8341 62.8725 37.8097 177.1144 57 F 4.7442 8.0245 115.5412 56.4269 39.9697 175.1722 58 Q 3.6764 7.9698 119.3040 57.1114 26.5850 174.1762 59 I 4.3765 8.1791 118.9403 61.1036 39.2519 176.8582 60 N 5.3361 9.2186 126.1938 53.3409 40.1661 175.8568 61 S 4.6003 9.3395 120.7838 60.5898 63.8841 176.3315 62 R 3.5024 8.7311 121.9912 58.6535 30.3272 177.8411 63 Y 4.2499 7.4002 113.2634 58.0884 40.4142 177.3730 64 W 4.7578 8.1862 118.9148 57.7174 30.5012 173.6154 65 C 5.4920 7.8368 110.7878 53.7080 45.2720 171.8741 66 N 4.7769 8.8356 119.7594 52.1979 39.4106 174.8773 67 D 4.7524 8.5952 123.3323 52.2191 40.3650 176.9856 68 G 3.9484 8.4587 107.5473 46.1887 0.0000 174.3562 69 K 4.5092 8.2070 116.1894 56.3877 33.3250 175.7866 70 T 4.5986 7.7331 117.2048 61.3194 69.3221 172.2814 71 P 4.2242 0.0000 0.0000 63.9888 31.6597 176.3517 72 G 3.8585 8.8777 109.9526 46.3074 0.0000 173.1779 73 A 4.2875 7.4833 120.5566 51.6081 19.4029 177.4411 74 V 4.3429 8.2917 112.3698 59.3418 35.6264 176.3138 75 N 4.9448 8.0114 117.0608 52.0896 37.6838 174.5559 76 A 3.9696 8.9477 125.0231 54.7362 19.1215 178.4743 77 C 4.5385 8.5279 111.4323 57.3085 41.2543 173.0823 78 H 4.0663 7.7906 116.5001 56.4347 26.2966 174.0751 79 L 4.7847 8.2484 118.1338 52.9190 46.6175 176.5878 80 S 4.6401 8.3956 115.6597 58.0277 63.2525 176.0206 81 C 4.0857 8.6219 124.2296 59.7192 40.7699 176.3606 82 S 3.8945 7.7472 114.7577 61.3078 61.6508 175.9541 83 A 4.0740 7.8303 122.3158 54.2780 18.1959 177.9026 84 L 4.4675 7.8444 116.5080 55.0048 41.8925 177.5549 85 L 5.0923 7.8915 117.5679 54.5547 42.2735 176.6557 86 Q 4.3967 7.8102 117.5791 55.3080 29.6267 175.9815 87 D 4.3991 8.5507 120.1725 57.0996 41.1462 176.6231 88 N 4.5825 8.0372 118.2067 53.1450 39.0304 174.5155 89 I 4.2497 8.4463 119.1764 60.9785 37.9343 176.9209 90 A 3.9368 8.3162 124.6081 56.0830 18.1718 180.1421 91 D 4.2710 8.1022 116.3004 57.4967 40.8686 178.7655 92 A 4.1018 7.9912 120.7971 55.1823 18.3633 179.7393 93 V 3.3844 8.1852 116.8903 65.9067 31.5903 178.1259 94 A 3.8115 8.1026 120.7422 55.2445 18.1071 178.8543 95 C 4.2120 8.3760 116.8133 59.6857 41.6602 175.6384 96 A 3.8911 8.1885 122.7438 54.9392 17.5774 179.7692 97 K 3.7279 7.6524 116.4514 59.4740 32.3097 179.1296 98 R 4.0639 7.7581 118.9519 59.3376 29.9874 178.6089 99 V 2.3737 7.6571 118.2674 65.7625 31.2891 178.0964 100 V 3.8819 7.8187 110.3920 62.9766 31.3160 178.2196 101 R 4.2108 7.6219 117.1348 57.4919 30.5211 176.5992 102 D 4.7024 7.3824 118.9313 52.7505 41.7394 175.2666 103 P 4.2455 0.0000 0.0000 66.3136 31.1911 177.8877 104 Q 4.0081 8.1519 117.4805 56.5169 29.9612 177.2437 105 G 3.7928 7.8131 106.5761 46.9237 0.0000 176.4197 106 I 3.5360 7.7869 120.8278 63.4748 37.9212 177.8352 107 R 4.2023 7.1803 118.0215 57.8074 30.0225 177.3784 108 A 4.1445 7.6283 120.6201 53.6096 18.7145 177.7505 109 W 4.7748 8.2429 116.7230 55.4297 29.9038 177.4648 110 V 3.7451 8.8074 123.6593 66.0632 30.9657 177.5509 111 A 4.0324 8.3407 120.1111 54.8972 18.1115 179.2602 112 W 3.9573 8.3825 126.4643 60.7532 30.6166 178.4146 113 R 3.7345 8.2817 116.2388 59.2466 29.5954 178.4583 114 N 4.3564 8.1199 115.4481 55.7792 38.7996 176.9384 115 R 4.0417 7.9156 115.7850 55.9935 31.1019 176.1527 116 C 4.5565 7.6897 114.7491 57.5151 42.8566 174.8307 117 Q 3.1645 6.5964 119.5010 56.8593 29.2963 175.2813 118 N 4.1617 8.5145 121.2225 53.7789 36.1886 173.8298 119 R 4.5529 7.1793 113.0732 54.5517 34.6598 174.9694 120 D 4.4852 8.5913 120.1926 54.5429 41.5235 176.9283 121 V 4.6899 8.3253 118.5623 61.3471 32.7387 177.6329 122 R 4.0840 7.9794 119.0317 59.1765 29.6398 178.6220 123 Q 4.0292 8.0597 116.2189 59.3261 28.4269 177.9456 124 Y 4.3517 8.0192 117.8152 59.8294 38.3627 176.6125 125 V 4.3887 7.7048 110.8897 60.6829 33.0418 175.5451 126 Q 4.1835 8.0123 120.1523 57.3683 28.7964 176.9235 127 G 3.9633 8.9364 110.3612 45.9842 0.0000 174.5259 128 C 4.4348 8.0368 115.8594 56.7409 40.7700 173.6513 129 G 3.7701 8.1226 107.0350 47.0886 0.0000 174.0582 130 V 4.0240 7.8081 117.4156 61.1508 32.2983 176.0030 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 4.28 0.00 1.64 2.01 0.00 1.11 0.00 0.00 1.34 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.40 1.21 7.81 2 D 8.39 5.16 0.00 2.65 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 3 F 10.09 4.52 0.00 2.96 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 4 E 9.24 4.25 0.00 1.95 1.88 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 2.32 2.25 0.00 5 R 9.10 3.40 0.00 2.04 1.96 0.00 3.43 0.00 0.00 3.48 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.91 0.00 6 C 8.05 4.32 0.00 3.01 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 7 E 8.13 3.91 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 2.59 2.42 0.00 8 L 8.12 3.63 0.00 1.36 1.34 -0.10 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.93 3.97 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 8.07 3.89 0.00 1.89 1.99 0.00 3.14 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 1.65 1.79 0.00 11 T 7.91 3.85 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 12 L 8.20 3.84 0.00 1.69 1.57 0.90 0.45 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 13 K 8.02 3.90 0.00 1.95 1.94 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 8.11 3.97 0.00 1.93 1.97 0.00 3.21 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 1.66 1.91 0.00 15 L 7.54 4.36 0.00 1.63 1.57 0.84 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.92 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 17 M 7.86 3.96 0.00 1.30 1.97 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.22 0.00 18 D 8.03 4.54 0.00 2.68 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 19 G 9.30 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.35 4.24 0.00 3.38 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 21 R 8.94 3.63 0.00 1.91 1.86 0.00 3.36 0.00 0.00 3.01 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 1.43 0.00 22 G 8.19 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 23 I 7.49 4.07 1.68 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 0.87 0.89 -0.30 0.00 0.00 24 S 8.30 4.65 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 8.71 4.25 0.00 1.99 1.82 0.98 1.47 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 8.19 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 8.14 4.45 0.00 2.82 2.76 0.00 0.00 6.97 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 28 W 8.03 4.31 0.00 3.53 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 8.54 4.12 0.00 2.15 2.37 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.93 0.00 30 C 8.00 3.23 0.00 2.44 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 31 L 8.24 3.97 0.00 1.87 1.91 0.60 -0.27 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 32 A 8.39 4.15 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 33 K 8.26 2.93 0.00 1.68 1.63 0.00 0.61 0.00 0.00 0.84 0.00 0.00 2.76 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.19 0.36 7.81 34 W 7.71 4.22 0.00 3.46 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 35 E 8.26 4.40 0.00 2.05 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 0.00 2.58 2.58 0.00 36 S 7.96 4.50 0.00 4.05 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 37 G 8.28 3.37 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 0.00 38 Y 7.74 3.69 0.00 3.24 2.98 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 39 N 7.71 5.41 0.00 2.85 2.79 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 8.82 3.94 4.48 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 1.49 0.00 0.00 41 R 7.88 4.39 0.00 1.85 2.04 0.00 3.23 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 42 A 7.50 4.35 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 43 T 8.32 5.10 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 1.24 0.00 0.00 44 N 8.95 4.94 0.00 2.89 2.73 0.00 0.00 6.74 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 45 Y 8.71 4.90 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 8.40 4.78 0.00 2.61 2.60 0.00 0.00 6.60 6.77 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 47 A 8.27 3.63 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 48 G 8.05 3.67 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 0.00 49 D 7.86 4.74 0.00 2.76 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 50 R 7.71 4.10 0.00 1.95 2.16 0.00 3.11 0.00 0.00 3.17 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.54 0.00 51 S 7.26 5.00 0.00 3.91 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 52 T 8.94 5.16 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 0.64 0.00 0.00 53 D 9.09 5.48 0.00 2.70 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 54 Y 9.08 5.02 0.00 2.92 2.89 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 55 G 8.89 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 0.00 0.00 0.00 0.00 56 I 8.25 4.02 1.68 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.85 0.13 0.00 0.00 57 F 8.02 4.74 0.00 3.23 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 58 Q 7.97 3.68 0.00 2.54 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.86 6.84 0.00 0.00 0.00 0.00 0.00 2.54 2.73 0.00 59 I 8.18 4.38 2.14 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.14 1.11 0.00 0.00 60 N 9.22 5.34 0.00 3.11 3.06 0.00 0.00 6.97 7.63 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 61 S 9.34 4.60 0.00 4.08 4.50 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 62 R 8.73 3.50 0.00 1.57 1.41 0.00 2.63 0.00 0.00 2.83 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.97 0.00 63 Y 7.40 4.25 0.00 1.67 1.63 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 64 W 8.19 4.76 0.00 3.61 3.28 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 65 C 7.84 5.49 0.00 3.16 3.18 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 66 N 8.84 4.78 0.00 2.80 2.70 0.00 0.00 7.06 8.05 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 67 D 8.60 4.75 0.00 2.85 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 68 G 8.46 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 69 K 8.21 4.51 0.00 1.86 1.87 0.00 1.59 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.44 7.81 70 T 7.73 4.60 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 1.16 0.00 0.00 71 P 0.00 4.22 0.00 2.02 2.00 0.00 3.83 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 72 G 8.88 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 73 A 7.48 4.29 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 8.29 4.34 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 0.62 0.00 0.00 0.86 0.00 0.00 75 N 8.01 4.94 0.00 2.74 2.57 0.00 0.00 6.77 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 76 A 8.95 3.97 1.24 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 0.00 0.00 77 C 8.53 4.54 0.00 3.30 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 7.79 4.07 0.00 3.30 3.34 0.00 5.81 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.25 4.78 0.00 1.69 1.49 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.40 4.64 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 8.62 4.09 0.00 2.33 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 82 S 7.75 3.89 0.00 3.82 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 7.83 4.07 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 7.84 4.47 0.00 1.91 1.82 1.04 0.40 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 85 L 7.89 5.09 0.00 1.79 1.71 1.14 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.81 4.40 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.40 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 87 D 8.55 4.40 0.00 2.63 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 8.04 4.58 0.00 2.70 2.76 0.00 0.00 6.95 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 8.45 4.25 1.77 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.58 1.00 0.00 0.00 90 A 8.32 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 91 D 8.10 4.27 0.00 2.75 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 7.99 4.10 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 93 V 8.19 3.38 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 0.77 0.00 0.00 0.90 0.00 0.00 94 A 8.10 3.81 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 95 C 8.38 4.21 0.00 3.15 3.28 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 96 A 8.19 3.89 0.73 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 0.00 0.00 97 K 7.65 3.73 0.00 1.61 1.35 0.00 1.29 0.00 0.00 0.78 0.00 0.00 2.32 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 0.93 7.81 98 R 7.76 4.06 0.00 1.98 2.13 0.00 3.27 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.92 0.00 99 V 7.66 2.37 1.78 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 -0.36 0.00 0.00 -0.58 0.00 0.00 100 V 7.82 3.88 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 1.20 0.00 0.00 1.44 0.00 0.00 101 R 7.62 4.21 0.00 2.02 2.05 0.00 3.24 0.00 0.00 3.38 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.11 0.00 102 D 7.38 4.70 0.00 3.03 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 4.25 0.00 2.15 2.19 0.00 3.78 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 1.98 2.00 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 2.42 2.32 0.00 105 G 7.81 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 0.00 106 I 7.79 3.54 1.02 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.26 -0.64 0.00 0.00 107 R 7.18 4.20 0.00 1.95 2.03 0.00 3.21 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.43 0.00 108 A 7.63 4.14 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 8.24 4.77 0.00 3.47 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 0.00 110 V 8.81 3.75 2.19 0.00 0.00 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 1.01 0.00 0.00 111 A 8.34 4.03 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.38 3.96 0.00 3.48 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 0.00 113 R 8.28 3.73 0.00 2.06 2.01 0.00 3.35 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.05 0.00 114 N 8.12 4.36 0.00 2.69 2.71 0.00 0.00 6.94 8.19 0.00 0.00 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 7.92 4.04 0.00 1.05 0.66 0.00 2.21 0.00 0.00 2.45 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.96 0.00 116 C 7.69 4.56 0.00 1.61 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 0.00 117 Q 6.60 3.16 0.00 0.93 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.79 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 118 N 8.51 4.16 0.00 2.75 2.77 0.00 0.00 6.81 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 7.18 4.55 0.00 1.78 1.72 0.00 3.13 0.00 0.00 3.01 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.69 0.00 120 D 8.59 4.49 0.00 2.62 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 8.33 4.69 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 1.04 0.00 0.00 1.05 0.00 0.00 122 R 7.98 4.08 0.00 2.05 2.02 0.00 3.16 0.00 0.00 3.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 123 Q 8.06 4.03 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.12 0.00 0.00 0.00 0.00 0.00 2.00 1.59 0.00 124 Y 8.02 4.35 0.00 3.21 3.18 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 0.00 125 V 7.70 4.39 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 1.00 0.00 0.00 1.07 0.00 0.00 126 Q 8.01 4.18 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.84 0.00 0.00 0.00 0.00 0.00 2.52 2.31 0.00 127 G 8.94 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 8.04 4.43 0.00 3.10 3.15 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 0.00 129 G 8.12 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 0.00 130 V 7.81 4.02 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 0.80 0.00 0.00 0.96 0.00 0.00