NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3908 8.3049 120.3491 55.1038 33.8721 175.9634 2 L 4.2510 8.0740 120.8216 54.3123 39.5450 176.4415 3 T 3.9579 7.7761 115.8622 66.0815 70.4257 175.3728 4 D 4.3286 7.6612 118.0269 51.8719 44.0823 174.0428 5 P 4.5478 0.0000 0.0000 64.7493 31.4200 178.4592 6 I 3.7621 7.7629 117.3611 63.7347 37.8259 177.4773 7 A 4.0004 7.8546 121.5378 55.1992 18.1761 179.1738 8 D 4.2086 8.3634 117.7034 56.3482 39.5203 178.4847 9 M 4.0004 7.9251 119.4289 58.6214 32.3419 177.7970 10 L 3.8970 7.7107 119.2158 58.1968 41.7719 179.8709 11 T 3.8428 7.3673 108.7112 65.0627 69.2480 176.9423 12 R 3.9883 8.2882 122.2169 59.4199 30.1389 178.2649 13 I 3.8875 8.0353 120.1996 64.0014 37.0513 178.4397 14 R 4.0627 8.1912 118.2476 58.9867 28.1863 178.8300 15 N 4.3001 8.6437 117.5047 55.9013 38.5337 176.8602 16 A 4.1696 7.6734 120.5165 54.3832 18.5016 179.5263 17 T 4.2256 7.7116 114.1212 66.4056 68.3226 177.1908 18 R 3.7275 7.6113 119.1837 58.3704 30.1985 178.3898 19 V 3.5437 6.8112 109.9241 60.3941 32.3544 175.2991 20 Y 4.4378 7.5793 114.0306 59.1858 34.4385 170.3446 21 K 4.1816 8.0506 120.0944 56.5954 31.5824 176.8426 22 E 4.3428 9.0956 125.1331 59.1979 30.2946 177.7904 23 S 5.1350 7.7549 110.9544 57.2758 66.2386 173.2544 24 T 4.1683 7.8415 109.4789 61.3965 71.0142 172.0604 25 D 5.1133 8.8747 129.6064 54.4188 41.8508 176.0363 26 V 4.7090 9.1225 120.9848 59.4905 35.2346 172.3791 27 P 4.2179 0.0000 0.0000 62.8631 32.1437 176.1406 28 A 4.3623 8.0733 125.0020 51.1862 19.1338 176.8811 29 S 4.5491 8.2836 115.5775 56.2919 65.6838 174.9697 30 R 3.9208 8.8977 126.2773 59.5272 29.6209 179.0625 31 F 4.2535 8.1220 119.9483 61.0106 39.5249 177.2841 32 K 3.8026 7.9728 117.2388 59.0174 32.5198 178.5154 33 E 3.7341 8.1689 121.4908 59.1434 29.5849 178.1571 34 E 3.9169 7.5984 117.6473 58.3550 29.4292 179.2704 35 I 3.4194 6.9107 120.8668 64.1154 37.2858 178.1754 36 L 4.0215 7.3789 119.9898 57.9159 40.2555 179.1573 37 R 3.5148 7.5281 120.5187 59.2323 29.8645 177.6081 38 I 4.1029 7.2021 116.2078 61.9741 37.0896 177.5779 39 L 4.2382 7.6694 121.2757 57.6750 41.6113 178.9063 40 A 4.3371 7.9940 121.9276 54.2652 18.2134 179.4190 41 R 3.9827 8.0964 116.5213 58.3687 30.3621 176.8233 42 E 4.6961 7.7381 115.2151 56.2252 31.8281 175.1570 43 G 3.9252 8.1045 109.2498 43.4412 0.0000 178.5864 44 F 3.7569 8.0747 118.4990 57.3649 39.9885 174.2916 45 I 4.3791 7.7058 111.5702 59.8720 39.2391 177.3216 46 K 4.1481 8.7662 126.0743 59.0682 32.6730 177.7796 47 G 4.3412 7.6656 104.1036 45.8044 0.0000 172.2952 48 Y 5.2904 8.4175 121.6155 55.5154 41.4049 174.1404 49 E 4.6173 8.8833 116.8796 56.0858 33.5470 173.6837 50 R 4.8270 8.5801 118.1483 54.9447 32.9319 175.4005 51 V 4.4323 8.4867 124.1752 61.2682 34.4435 174.0419 52 D 5.1026 8.5888 125.4564 52.9496 42.3564 176.0650 53 V 4.1501 8.4336 123.5257 61.9255 32.6849 176.5161 54 D 4.6892 9.0570 127.6223 54.6169 40.0516 173.9013 55 G 3.5670 7.7072 112.1995 45.5365 0.0000 174.4202 56 K 4.0338 7.9238 122.3608 55.3431 32.3632 174.4662 57 P 4.7413 0.0000 0.0000 63.4837 32.1676 175.3635 58 Y 4.5794 8.7871 118.4171 56.3788 43.0867 173.9653 59 L 4.6865 9.0716 125.5368 53.8602 43.6649 174.9127 60 R 5.1558 8.5749 127.2877 54.6494 32.8532 174.9291 61 V 4.6735 8.5428 123.9113 61.2602 35.7015 173.4498 62 Y 5.5059 9.1776 122.5808 55.2514 40.9501 176.6383 63 L 4.4924 8.4019 123.3896 56.4264 42.7617 175.3285 64 K 3.9892 7.9351 116.3939 57.3768 35.6572 173.2800 65 Y 4.8415 8.3722 128.8925 56.2577 43.5679 175.8732 66 G 4.0248 10.1744 108.6592 44.9370 0.0000 172.2453 67 P 4.5576 0.0000 0.0000 61.5126 31.6345 175.1825 68 R 4.1801 8.3431 127.0982 56.6599 30.9159 175.3517 69 R 4.5820 8.0069 121.0936 55.7869 33.4570 173.5765 70 Q 3.5977 8.7703 120.2587 55.3550 27.3442 173.0102 71 G 3.6673 7.8378 107.1144 46.9109 0.0000 172.4969 72 P 4.0500 0.0000 0.0000 62.3545 30.7023 171.9889 73 D 4.4935 8.6845 131.6214 52.8527 41.5373 172.0157 74 P 4.9481 0.0000 0.0000 61.0086 30.2163 176.4935 75 R 3.4365 9.1543 119.0331 54.5212 30.0167 173.9182 76 P 4.7386 0.0000 0.0000 61.9022 32.8685 177.3416 77 E 4.7823 8.0429 128.2760 55.7085 27.9889 178.5576 78 Q 4.7458 8.4859 115.8431 54.7640 32.5402 174.0308 79 V 3.8260 8.4024 123.8548 66.1313 32.0511 177.8720 80 I 4.2971 7.6072 121.2975 61.5784 34.8053 175.2594 81 H 4.1215 8.5067 123.0296 58.4759 30.4227 175.0979 82 H 4.4335 7.1334 122.5334 54.3348 32.3870 170.8872 83 I 4.6346 7.8649 126.3541 59.1464 39.5450 174.5372 84 R 4.5856 8.1131 127.9753 55.1487 33.7966 174.4205 85 R 4.2928 8.6358 125.2146 56.4698 30.8917 175.9214 86 I 4.3544 8.1665 122.1992 61.6469 39.1018 176.7654 87 S 5.2347 7.4930 115.4610 55.1962 62.3210 172.7384 88 K 4.0330 7.9289 122.0805 55.7720 32.8694 173.7538 89 P 4.5839 0.0000 0.0000 60.3782 30.7266 176.3627 90 G 4.7897 7.4203 119.9024 46.5259 0.0000 171.1271 91 R 4.2830 7.5667 128.6552 53.9587 29.4590 174.2242 92 R 4.4976 8.2568 123.3919 54.7391 30.5924 176.7176 93 V 4.1080 8.8032 125.4266 62.3223 32.5493 174.5019 94 Y 5.0874 8.8188 126.7972 56.6620 39.1329 175.5655 95 V 4.6828 9.0798 117.6125 58.5406 36.9648 176.5914 96 G 4.1419 9.6479 114.1055 45.1861 0.0000 177.8765 97 V 2.8111 7.9932 121.0418 60.8974 34.3909 175.4897 98 K 4.4991 8.9278 118.1833 56.5099 33.1959 177.6090 99 E 4.3901 7.9435 116.0035 57.2783 28.7287 176.7513 100 I 4.0116 7.6457 121.3445 60.5964 37.4958 174.5806 101 P 4.4122 0.0000 0.0000 62.7032 32.0223 175.8857 102 R 3.7310 7.8819 117.6031 56.6217 26.7663 174.9454 103 V 3.6322 7.6042 119.5503 63.9512 32.6533 176.0656 104 R 3.5660 8.6190 124.1103 59.7052 28.1757 176.3183 105 R 3.6795 8.5751 111.9278 56.7971 28.2658 174.5781 106 G 3.9622 7.6407 109.6184 45.5622 0.0000 173.5387 107 L 4.7186 7.8893 116.9908 54.8014 41.6544 176.2405 108 G 4.5685 8.4172 107.6180 44.7514 0.0000 173.2892 109 I 4.7713 8.9602 116.3474 59.1846 40.4893 174.2586 110 A 4.9075 8.8235 125.3258 50.2826 22.2005 174.9965 111 I 4.7308 8.7292 122.8853 59.4137 40.0933 174.6731 112 L 4.8167 8.7966 127.8184 53.5182 46.0599 175.1593 113 S 5.3793 8.9730 121.1712 56.7646 62.6363 173.2248 114 T 5.0929 7.8130 117.6514 59.2467 71.1489 174.7710 115 S 4.3358 8.5965 114.5639 60.0673 62.4577 174.9691 116 K 4.6358 8.0443 119.1335 56.9225 33.5349 178.0833 117 G 3.9735 7.8198 112.3840 46.6017 0.0000 176.0617 118 V 4.5376 8.1466 123.6206 61.2763 32.3480 174.1626 119 L 5.0241 9.2256 128.0229 53.1028 45.3310 175.7160 120 T 5.0557 7.9541 111.3867 60.0943 72.2224 176.3859 121 D 3.7485 8.0525 116.1467 55.1237 43.2202 178.6672 122 R 4.0129 7.8987 114.9983 59.1352 30.6067 178.7658 123 E 4.1676 8.2188 114.0732 57.4716 30.0790 176.9373 124 A 4.4487 7.7186 122.7812 53.6962 20.3210 179.3686 125 R 3.9494 7.6494 115.8496 59.2291 30.1644 178.3193 126 K 4.1833 8.4091 117.9523 59.3159 33.0376 178.6670 127 L 4.2334 7.8364 120.4816 55.9885 43.3025 174.4541 128 G 3.6318 8.9749 110.0231 44.7356 0.0000 172.3768 129 V 4.2555 7.4470 122.3175 61.7961 34.0453 172.8293 130 G 4.0887 7.2050 107.5260 46.2717 0.0000 172.1863 131 G 4.3527 7.7600 105.9027 45.7813 0.0000 171.6968 132 E 3.9169 7.3557 123.1229 55.7884 30.9238 177.1781 133 L 3.8694 8.8922 127.7382 55.9452 41.3837 177.0723 134 I 3.8111 8.8083 128.2176 62.4803 37.3219 177.0100 135 C 5.2109 8.6372 126.2988 58.3692 36.8389 172.1363 136 E 5.1069 8.4988 117.1808 55.0900 32.7285 174.4311 137 V 5.3918 8.7033 120.9431 60.0830 36.2823 175.4558 138 W 5.0379 7.9478 119.6883 56.9839 27.9668 174.5813 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 M 8.30 4.39 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 2 L 8.07 4.25 0.00 1.75 1.63 0.91 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 3 T 7.78 3.96 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 4 D 7.66 4.33 0.00 2.66 2.56 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 5 P 0.00 4.55 0.00 2.20 2.07 0.00 3.93 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 2.10 1.99 0.00 6 I 7.76 3.76 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 1.56 1.70 1.04 0.00 0.00 7 A 7.85 4.00 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 8 D 8.36 4.21 0.00 2.96 2.94 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 0.00 0.00 0.00 0.00 9 M 7.93 4.00 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.53 0.00 10 L 7.71 3.90 0.00 1.80 1.67 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.37 3.84 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 1.23 0.00 0.00 12 R 8.29 3.99 0.00 2.03 2.06 0.00 3.26 0.00 0.00 3.38 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 13 I 8.04 3.89 2.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.10 0.86 0.00 0.00 14 R 8.19 4.06 0.00 1.97 2.12 0.00 3.29 0.00 0.00 3.23 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 15 N 8.64 4.30 0.00 2.88 2.88 0.00 0.00 6.83 7.16 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 16 A 7.67 4.17 1.43 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 0.00 0.00 0.00 17 T 7.71 4.23 4.38 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 1.60 0.00 0.00 18 R 7.61 3.73 0.00 1.63 1.80 0.00 3.15 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 19 V 6.81 3.54 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 0.63 0.00 0.00 0.95 0.00 0.00 20 Y 7.58 4.44 0.00 3.24 3.21 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 21 K 8.05 4.18 0.00 1.81 2.03 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.56 7.81 22 E 9.10 4.34 0.00 1.99 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 0.00 2.50 2.43 0.00 23 S 7.75 5.13 0.00 3.90 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 24 T 7.84 4.17 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 1.28 0.00 0.00 25 D 8.87 5.11 0.00 2.37 2.23 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 26 V 9.12 4.71 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 0.70 0.00 0.00 0.94 0.00 0.00 27 P 0.00 4.22 0.00 1.89 1.90 0.00 3.66 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 28 A 8.07 4.36 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 29 S 8.28 4.55 0.00 3.79 3.65 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 0.00 0.00 0.00 0.00 30 R 8.90 3.92 0.00 1.93 2.01 0.00 3.18 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 1.74 1.71 0.00 31 F 8.12 4.25 0.00 3.08 3.04 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 32 K 7.97 3.80 0.00 1.93 2.05 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.58 1.41 7.81 33 E 8.17 3.73 0.00 2.10 2.05 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 2.11 2.45 0.00 34 E 7.60 3.92 0.00 1.99 1.80 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 2.23 2.29 0.00 35 I 6.91 3.42 1.76 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.43 0.72 0.00 0.00 36 L 7.38 4.02 0.00 1.76 1.80 0.54 0.75 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 37 R 7.53 3.51 0.00 1.75 1.82 0.00 3.16 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 38 I 7.20 4.10 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 1.58 0.86 0.90 0.00 0.00 39 L 7.67 4.24 0.00 1.73 1.73 0.70 0.76 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 40 A 7.99 4.34 1.59 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 41 R 8.10 3.98 0.00 1.88 2.15 0.00 3.39 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 42 E 7.74 4.70 0.00 1.96 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 2.39 2.43 0.00 43 G 8.10 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 44 F 8.07 3.76 0.00 3.41 2.88 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 45 I 7.71 4.38 2.09 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.98 0.95 0.00 0.00 46 K 8.77 4.15 0.00 1.78 1.93 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.37 7.81 47 G 7.67 4.34 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 0.00 48 Y 8.42 5.29 0.00 2.88 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.88 4.62 0.00 1.98 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 0.00 2.19 2.08 0.00 50 R 8.58 4.83 0.00 1.68 1.90 0.00 3.36 0.00 0.00 3.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 51 V 8.49 4.43 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 0.97 0.00 0.00 1.01 0.00 0.00 52 D 8.59 5.10 0.00 2.62 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 53 V 8.43 4.15 2.20 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 0.94 0.00 0.00 0.79 0.00 0.00 54 D 9.06 4.69 0.00 2.90 2.85 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 0.00 0.00 0.00 0.00 55 G 7.71 3.57 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 0.00 0.00 0.00 56 K 7.92 4.03 0.00 1.99 1.77 0.00 1.62 0.00 0.00 1.97 0.00 0.00 3.32 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.55 1.52 7.81 57 P 0.00 4.74 0.00 2.06 2.06 0.00 3.70 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.99 0.00 58 Y 8.79 4.58 0.00 3.09 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 59 L 9.07 4.69 0.00 1.86 1.62 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 60 R 8.57 5.16 0.00 1.91 2.06 0.00 3.09 0.00 0.00 3.32 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.55 0.00 61 V 8.54 4.67 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 0.96 0.00 0.00 0.92 0.00 0.00 62 Y 9.18 5.51 0.00 2.87 2.80 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 63 L 8.40 4.49 0.00 1.43 1.75 1.12 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.94 3.99 0.00 1.77 1.85 0.00 1.72 0.00 0.00 1.99 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.31 7.81 65 Y 8.37 4.84 0.00 3.16 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 66 G 10.17 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 0.00 0.00 0.00 67 P 0.00 4.56 0.00 2.13 2.25 0.00 3.75 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 68 R 8.34 4.18 0.00 1.81 1.85 0.00 3.34 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 69 R 8.01 4.58 0.00 1.86 1.98 0.00 3.14 0.00 0.00 3.34 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.64 0.00 70 Q 8.77 3.60 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 71 G 7.84 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 72 P 0.00 4.05 0.00 2.19 2.13 0.00 3.87 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 2.17 1.95 0.00 73 D 8.68 4.49 0.00 2.84 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 74 P 0.00 4.95 0.00 2.18 1.30 0.00 3.58 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 75 R 9.15 3.44 0.00 1.95 1.88 0.00 3.50 0.00 0.00 3.31 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 76 P 0.00 4.74 0.00 1.60 2.11 0.00 3.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.92 0.00 77 E 8.04 4.78 0.00 1.96 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 2.35 2.37 0.00 78 Q 8.49 4.75 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.86 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 79 V 8.40 3.83 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 0.64 0.00 0.00 1.00 0.00 0.00 80 I 7.61 4.30 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.80 0.75 0.00 0.00 81 H 8.51 4.12 0.00 3.27 3.08 0.00 5.89 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 82 H 7.13 4.43 0.00 2.67 1.72 0.00 5.88 0.00 0.00 0.00 0.00 6.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.86 4.63 1.63 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.88 0.77 0.00 0.00 84 R 8.11 4.59 0.00 1.76 1.52 0.00 3.52 0.00 0.00 3.29 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.76 0.00 85 R 8.64 4.29 0.00 1.78 1.81 0.00 3.35 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.87 0.00 86 I 8.17 4.35 2.09 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 1.33 0.72 0.93 0.00 0.00 87 S 7.49 5.23 0.00 3.94 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 88 K 7.93 4.03 0.00 1.83 1.76 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.48 7.81 89 P 0.00 4.58 0.00 2.04 2.07 0.00 3.83 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.27 0.00 90 G 7.42 4.79 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 91 R 7.57 4.28 0.00 1.84 1.85 0.00 3.11 0.00 0.00 3.19 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 92 R 8.26 4.50 0.00 1.93 2.30 0.00 3.36 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.87 0.00 93 V 8.80 4.11 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 0.79 0.00 0.00 1.02 0.00 0.00 94 Y 8.82 5.09 0.00 2.76 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 V 9.08 4.68 2.28 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 0.77 0.00 0.00 0.94 0.00 0.00 96 G 9.65 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 0.00 0.00 0.00 97 V 7.99 2.81 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 0.84 0.00 0.00 0.94 0.00 0.00 98 K 8.93 4.50 0.00 1.91 2.04 0.00 1.52 0.00 0.00 1.82 0.00 0.00 3.13 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.40 1.37 7.81 99 E 7.94 4.39 0.00 2.13 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 0.00 2.36 2.29 0.00 100 I 7.65 4.01 1.88 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 1.36 0.35 0.98 0.00 0.00 101 P 0.00 4.41 0.00 2.16 2.17 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.11 0.00 102 R 7.88 3.73 0.00 1.96 1.99 0.00 3.21 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 103 V 7.60 3.63 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 1.16 0.00 0.00 1.04 0.00 0.00 104 R 8.62 3.57 0.00 2.07 1.88 0.00 3.08 0.00 0.00 2.80 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.20 0.00 105 R 8.58 3.68 0.00 1.77 1.97 0.00 3.24 0.00 0.00 3.20 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 106 G 7.64 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 0.00 107 L 7.89 4.72 0.00 1.72 1.75 0.98 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.42 4.57 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 0.00 0.00 0.00 109 I 8.96 4.77 2.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.25 1.12 0.00 0.00 110 A 8.82 4.91 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 0.00 111 I 8.73 4.73 1.92 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.99 0.86 0.00 0.00 112 L 8.80 4.82 0.00 1.74 1.51 0.92 0.57 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 0.00 113 S 8.97 5.38 0.00 4.16 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 0.00 114 T 7.81 5.09 4.41 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 1.23 0.00 0.00 115 S 8.60 4.34 0.00 3.86 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 0.00 116 K 8.04 4.64 0.00 1.75 1.78 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.40 7.81 117 G 7.82 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 0.00 118 V 8.15 4.54 2.03 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 0.72 0.00 0.00 0.87 0.00 0.00 119 L 9.23 5.02 0.00 1.52 1.50 0.97 0.49 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 0.00 120 T 7.95 5.06 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 1.23 0.00 0.00 121 D 8.05 3.75 0.00 2.89 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 0.00 122 R 7.90 4.01 0.00 2.05 2.19 0.00 3.03 0.00 0.00 3.40 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 123 E 8.22 4.17 0.00 2.11 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 0.00 2.37 2.26 0.00 124 A 7.72 4.45 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 0.00 125 R 7.65 3.95 0.00 1.92 2.14 0.00 3.27 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 126 K 8.41 4.18 0.00 1.88 1.92 0.00 1.55 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.67 7.81 127 L 7.84 4.23 0.00 1.83 1.73 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.97 3.63 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 0.00 0.00 0.00 129 V 7.45 4.26 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 0.66 0.00 0.00 0.94 0.00 0.00 130 G 7.21 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 0.00 131 G 7.76 4.35 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 0.00 132 E 7.36 3.92 0.00 1.16 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 2.24 2.16 0.00 133 L 8.89 3.87 0.00 1.51 1.65 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 134 I 8.81 3.81 1.87 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.74 0.96 0.00 0.00 135 C 8.64 5.21 0.00 2.90 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 0.00 136 E 8.50 5.11 0.00 2.18 2.01 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 2.38 2.54 0.00 137 V 8.70 5.39 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 0.69 0.00 0.00 0.53 0.00 0.00 138 W 7.95 5.04 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