NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4795 8.3049 120.3305 55.5335 32.9973 174.3856 2 M 4.4954 8.5525 123.6787 52.8976 34.4572 170.2642 3 V 4.4207 8.2997 121.7441 60.7721 34.5023 174.0448 4 W 4.6483 8.9367 135.0000 57.4695 31.2094 175.2384 5 T 4.2579 8.1446 123.8547 61.2836 67.0384 172.7673 6 P 4.4993 0.0000 0.0000 63.4946 32.2592 175.7855 7 V 4.0139 7.3827 119.7143 62.7803 33.0725 175.3900 8 N 4.2779 8.6526 125.1230 54.8716 36.0303 173.6629 9 N 5.0255 7.5560 108.2855 53.0349 40.1924 174.1861 10 K 4.1733 8.2876 115.7652 56.4183 32.7585 176.3795 11 M 5.0586 8.3403 120.2048 53.8950 35.6827 175.2451 12 F 4.6076 8.3102 116.4780 57.2093 41.0091 176.3287 13 E 3.4897 8.2804 122.6793 57.1511 27.8429 175.7601 14 T 3.8347 8.3712 122.6896 66.4883 68.8021 174.2628 15 F 4.5372 9.0187 124.4239 57.6031 36.7922 176.3382 16 S 4.4882 8.2123 114.5518 60.2075 62.9581 174.3872 17 Y 4.4442 8.2743 117.6218 58.0520 38.1209 174.9717 18 L 4.7344 7.6357 120.4039 52.0129 43.8596 174.4372 19 P 4.4430 0.0000 0.0000 61.9694 31.7503 175.0184 20 P 4.3006 0.0000 0.0000 62.7242 31.7709 176.4977 21 L 3.9684 8.3294 122.7912 54.8205 42.1495 177.9805 22 T 4.2258 8.1949 113.9892 61.1836 71.1094 175.2650 23 D 4.3304 8.5568 121.0388 57.6316 40.7569 178.8134 24 E 3.9346 8.0724 119.3047 59.2796 29.7528 178.7530 25 Q 3.9280 8.0276 118.2833 58.6728 28.6520 178.6462 26 I 3.6579 8.0129 120.8706 64.4319 37.1741 178.0892 27 A 4.0228 8.1961 121.4293 55.3891 18.1709 179.5773 28 A 3.9523 8.0735 119.0384 55.3973 18.4551 179.9021 29 Q 4.0850 8.0711 116.5589 59.1327 28.8199 179.1575 30 V 3.7422 8.3801 119.6906 66.2185 31.5683 177.7501 31 D 4.4401 8.4748 118.7952 57.5829 40.4788 178.2635 32 Y 4.1962 8.0930 119.9535 60.5544 38.9081 177.9262 33 I 3.9360 7.9754 120.8257 64.5396 37.3033 178.6274 34 V 3.5338 7.9097 118.7095 65.9593 31.1799 177.9129 35 A 3.9411 8.1636 119.6684 54.4917 18.2398 178.3204 36 N 4.0959 7.0552 112.6154 52.1158 38.7689 175.7471 37 G 3.7663 7.3144 108.3047 46.0114 0.0000 174.0425 38 W 4.9422 7.4400 118.6945 56.1500 30.6157 176.1883 39 I 4.3956 8.9903 123.1015 59.4724 37.9376 174.0228 40 P 4.8974 0.0000 0.0000 62.8848 32.7116 175.2023 41 C 5.0043 8.9572 121.9665 58.3013 35.6410 172.4265 42 L 5.2772 8.7553 124.0171 53.2378 44.3423 175.1893 43 E 5.6109 9.1259 121.1088 54.9026 34.0772 174.6132 44 F 5.6313 9.0401 116.0125 55.9551 42.1757 173.0158 45 A 4.4888 8.2175 119.7807 50.3247 22.6541 176.3372 46 E 4.2835 8.6284 119.1453 55.7115 30.5310 177.6980 47 A 4.2924 8.7875 122.7253 55.8068 18.4456 179.8331 48 D 4.5080 8.1566 113.5393 56.4367 41.0598 177.2147 49 K 4.6204 7.9062 117.0021 56.0430 32.5622 176.8271 50 A 3.9182 7.6378 124.2662 53.8193 18.9224 178.2864 51 Y 4.6767 7.4492 111.4812 55.5604 40.1996 175.7240 52 V 3.8164 8.3530 122.4439 63.9284 31.9576 175.2256 53 S 4.7362 8.7372 119.1401 57.6907 66.2243 173.7345 54 N 5.1966 8.5945 114.4264 52.5576 39.2923 176.2194 55 E 3.9234 8.3603 118.8168 59.9173 29.2682 179.1356 56 S 4.1080 8.6832 114.9777 60.4520 62.9179 176.0128 57 A 2.5800 7.6653 123.4938 53.6087 17.7292 179.0319 58 I 3.5648 6.8515 115.6789 63.8690 38.0044 177.1550 59 R 4.2577 7.4360 116.2460 55.8157 30.5562 176.2798 60 F 5.0694 7.1956 118.1453 55.9352 41.3022 177.7012 61 G 4.0651 8.2531 117.4673 46.2556 0.0000 175.7714 62 S 4.6349 8.4473 114.5665 58.6329 62.2532 174.4956 63 V 4.4575 7.3172 107.3869 61.1608 33.1878 177.6130 64 S 4.5129 8.2194 114.9231 59.5319 63.4882 173.3027 65 C 3.9835 8.1011 119.1519 61.4811 27.8864 173.0869 66 L 3.5701 8.4173 123.2304 55.5840 38.9645 173.2564 67 Y 4.3467 7.6274 119.5725 56.0947 39.7756 174.5918 68 Y 4.8926 7.1781 123.3755 56.3415 42.4545 174.7414 69 D 4.4890 8.8972 123.5816 55.3299 41.7208 176.8365 70 N 4.5514 8.8873 116.4066 54.2683 35.9457 176.1052 71 R 3.9413 7.9872 118.7117 59.3625 30.3513 177.1913 72 Y 4.3479 7.6298 114.5364 57.9738 38.3500 175.3169 73 W 5.0685 8.6632 124.2017 55.4599 32.6452 174.5196 74 T 4.3194 8.1430 117.2473 62.5152 69.4699 174.6654 75 M 4.4479 8.5520 126.7293 55.3855 33.1677 175.2115 76 W 4.8199 9.5689 135.0000 56.0700 31.1955 176.8098 77 K 3.3802 8.5133 128.9924 57.7121 30.4476 177.4986 78 L 4.9272 8.1968 125.7525 52.6715 44.9694 174.0738 79 P 4.2706 0.0000 0.0000 63.3663 32.2640 177.6345 80 M 4.2996 8.6146 123.5573 53.7485 30.4281 175.5660 81 F 4.4859 7.4306 119.0108 58.6561 40.0396 176.5649 82 G 3.9938 9.1002 112.1813 45.6436 0.0000 173.1741 83 C 4.2853 7.8870 120.6362 59.6500 31.7685 173.1675 84 R 4.5598 8.6429 124.0523 55.5103 31.2477 174.4432 85 D 4.7970 7.8497 118.0945 51.3634 42.8995 174.4865 86 P 4.3572 0.0000 0.0000 65.8828 31.2149 178.5563 87 M 4.1260 8.2308 117.3746 58.2234 31.8747 178.4810 88 Q 3.9725 7.9745 119.5940 59.0871 29.2477 178.5395 89 V 3.6180 7.7438 118.7457 66.0731 31.6986 177.8219 90 L 4.0347 8.0437 118.7053 57.9384 41.3705 179.7426 91 R 3.9763 8.3982 118.3360 59.3058 29.9744 179.0109 92 E 4.0977 8.1823 118.2934 59.1420 29.3951 179.1689 93 I 3.4855 7.7712 120.0042 64.3648 37.2353 178.3412 94 V 3.4581 7.6457 118.4972 66.0769 31.3639 177.8365 95 A 3.9437 8.0710 120.4318 55.1808 18.2506 179.1643 96 C 2.0000 7.8310 117.5350 62.1173 31.3634 175.9669 97 T 3.7216 7.6216 111.4038 64.4327 67.9224 176.3251 98 K 3.8081 7.6960 121.6036 59.3441 32.3440 178.4829 99 A 3.9685 7.5111 119.6802 53.3935 19.9059 177.6037 100 F 4.7340 7.6799 115.6932 55.1174 39.0300 174.0649 101 P 4.5086 0.0000 0.0000 64.2035 31.8863 177.8725 102 D 4.6891 8.0796 116.8923 53.8623 41.2155 175.3379 103 A 4.7477 7.3560 120.6716 50.2570 21.6199 176.9475 104 Y 4.2265 8.5008 117.6496 57.8294 39.4348 175.2345 105 V 5.2342 8.8181 123.2701 61.0960 35.0281 174.3129 106 R 5.0020 9.4956 124.0451 54.2648 32.9698 173.9143 107 L 4.8065 8.0451 123.4327 53.9331 43.8500 175.6760 108 V 4.7942 8.5547 118.0343 59.5181 36.4958 174.1700 109 A 4.9049 8.0979 121.6792 50.4204 22.8997 175.1426 110 F 5.2511 9.0532 119.5469 55.7263 42.6090 174.1144 111 D 5.4185 8.7815 122.6131 52.7433 42.3848 176.5991 112 N 4.7369 9.1499 123.0063 54.2148 38.4123 176.3853 113 Q 4.1762 8.5974 118.6194 58.9249 28.9698 177.5482 114 K 4.0425 8.2659 114.6025 56.8399 33.0338 176.4812 115 Q 3.4224 7.9632 118.5145 55.9520 27.0702 172.6813 116 V 4.5181 7.8122 117.3841 59.9938 35.0477 174.2678 117 Q 4.4086 8.7343 123.3321 56.5272 29.3196 175.5288 118 I 4.2889 8.2756 124.3343 60.9642 39.9773 174.5415 119 M 4.6640 6.8440 117.3444 54.6521 34.4404 173.7876 120 G 4.7289 8.3003 104.5329 46.9599 0.0000 172.5181 121 F 4.9908 7.1692 116.2791 55.3646 40.9865 172.8494 122 L 4.5937 8.8757 123.0925 55.5993 42.0965 176.8053 123 V 4.5311 8.9152 118.0725 61.3835 33.9694 175.5651 124 Q 4.6212 7.7667 121.2095 54.5505 32.3714 173.0695 125 R 4.4612 8.0848 121.6545 52.9101 32.7368 173.5797 126 P 4.1775 0.0000 0.0000 62.8477 31.6792 177.6468 127 K 4.0893 8.4773 119.9103 59.0913 32.1636 178.0097 128 S 4.4548 7.9326 111.0338 58.1109 63.5008 173.9845 129 A 4.2955 7.8720 125.5217 52.8559 18.3714 177.7180 130 R 4.6105 8.8643 120.3897 56.0226 31.5319 175.5719 131 D 4.9682 8.4409 117.3225 52.5223 39.7568 175.5910 132 W 5.6113 7.5747 114.1803 54.3528 31.2826 173.9696 133 Q 4.3281 8.4263 118.2239 52.9501 30.7962 174.1573 134 P 4.5017 0.0000 0.0000 62.4348 31.9283 176.9111 135 A 3.9723 8.9915 123.5334 55.6980 18.1564 179.2902 136 N 4.5957 8.0763 109.4734 54.0847 37.8071 175.5397 137 K 4.4551 7.8375 117.7485 56.3489 32.9023 177.3081 138 R 3.6308 7.5324 120.9242 57.6678 30.1893 176.6740 139 S 5.0831 7.4800 110.2951 56.3066 66.0290 174.2418 140 V 3.9857 8.4976 114.6276 61.7351 32.1207 175.6145 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 4.48 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.59 0.00 2 M 8.55 4.50 0.00 2.03 2.06 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 2.57 2.63 0.00 3 V 8.30 4.42 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 1.10 0.00 0.00 0.97 0.00 0.00 4 W 8.94 4.65 0.00 3.46 3.03 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 5 T 8.14 4.26 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 1.00 0.00 0.00 6 P 0.00 4.50 0.00 2.23 2.19 0.00 3.78 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 7 V 7.38 4.01 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 0.76 0.00 0.00 0.91 0.00 0.00 8 N 8.65 4.28 0.00 2.98 2.88 0.00 0.00 6.52 6.92 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 9 N 7.56 5.03 0.00 2.65 2.71 0.00 0.00 7.31 6.68 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 10 K 8.29 4.17 0.00 1.95 1.48 0.00 0.63 0.00 0.00 1.07 0.00 0.00 2.61 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.35 1.47 7.81 11 M 8.34 5.06 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.68 0.00 12 F 8.31 4.61 0.00 3.11 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 13 E 8.28 3.49 0.00 2.15 1.73 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 2.21 2.14 0.00 14 T 8.37 3.83 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 0.21 0.00 0.00 15 F 9.02 4.54 0.00 3.29 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 16 S 8.21 4.49 0.00 4.14 4.20 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 17 Y 8.27 4.44 0.00 3.03 3.19 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 0.00 0.00 0.00 0.00 18 L 7.64 4.73 0.00 1.86 1.62 0.91 1.11 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 P 0.00 4.44 0.00 2.04 2.02 0.00 3.71 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 2.04 2.15 0.00 20 P 0.00 4.30 0.00 2.05 2.00 0.00 3.73 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 21 L 8.33 3.97 0.00 1.58 1.49 0.34 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.19 4.23 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 1.18 0.00 0.00 23 D 8.56 4.33 0.00 2.70 2.77 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 24 E 8.07 3.93 0.00 2.01 1.91 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 2.35 2.38 0.00 25 Q 8.03 3.93 0.00 2.29 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 26 I 8.01 3.66 2.05 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 1.60 0.86 1.07 0.00 0.00 27 A 8.20 4.02 1.40 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 28 A 8.07 3.95 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 29 Q 8.07 4.09 0.00 2.47 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.34 1.86 0.00 30 V 8.38 3.74 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 1.14 0.00 0.00 1.08 0.00 0.00 31 D 8.47 4.44 0.00 2.98 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.09 4.20 0.00 3.25 3.33 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 33 I 7.98 3.94 2.17 0.00 0.00 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 1.71 1.41 1.06 0.00 0.00 34 V 7.91 3.53 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 0.96 0.00 0.00 35 A 8.16 3.94 1.20 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 0.00 0.00 36 N 7.06 4.10 0.00 1.44 1.42 0.00 0.00 7.02 7.54 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 37 G 7.31 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 38 W 7.44 4.94 0.00 3.37 3.09 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 39 I 8.99 4.40 2.12 0.00 0.00 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 1.46 0.93 0.74 0.00 0.00 40 P 0.00 4.90 0.00 2.09 1.99 0.00 3.80 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 41 C 8.96 5.00 0.00 3.08 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 42 L 8.76 5.28 0.00 1.85 1.62 0.89 0.82 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 43 E 9.13 5.61 0.00 2.05 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 2.35 2.32 0.00 44 F 9.04 5.63 0.00 3.05 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 45 A 8.22 4.49 -0.20 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 0.00 0.00 46 E 8.63 4.28 0.00 2.18 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 2.30 2.29 0.00 47 A 8.79 4.29 1.48 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 0.00 0.00 0.00 48 D 8.16 4.51 0.00 2.71 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 49 K 7.91 4.62 0.00 1.52 1.70 0.00 1.70 0.00 0.00 1.88 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.42 7.81 50 A 7.64 3.92 0.66 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 0.00 0.00 51 Y 7.45 4.68 0.00 2.93 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 52 V 8.35 3.82 1.96 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 0.61 0.00 0.00 0.78 0.00 0.00 53 S 8.74 4.74 0.00 4.08 3.99 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 54 N 8.59 5.20 0.00 2.76 2.84 0.00 0.00 6.56 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 55 E 8.36 3.92 0.00 2.15 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 2.39 2.39 0.00 56 S 8.68 4.11 0.00 4.06 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 7.67 2.58 1.11 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 58 I 6.85 3.56 1.78 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.81 0.84 0.00 0.00 59 R 7.44 4.26 0.00 1.96 2.02 0.00 3.20 0.00 0.00 3.23 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 60 F 7.20 5.07 0.00 3.01 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 61 G 8.25 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 0.00 0.00 0.00 62 S 8.45 4.63 0.00 3.86 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 63 V 7.32 4.46 1.87 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 0.67 0.00 0.00 0.49 0.00 0.00 64 S 8.22 4.51 0.00 4.10 4.27 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 65 C 8.10 3.98 0.00 2.97 2.96 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 66 L 8.42 3.57 0.00 1.78 1.76 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 7.63 4.35 0.00 2.97 3.06 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 68 Y 7.18 4.89 0.00 2.82 2.70 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 69 D 8.90 4.49 0.00 2.79 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 70 N 8.89 4.55 0.00 3.06 3.25 0.00 0.00 6.98 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 71 R 7.99 3.94 0.00 1.51 1.66 0.00 3.09 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 72 Y 7.63 4.35 0.00 3.06 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 73 W 8.66 5.07 0.00 3.10 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 74 T 8.14 4.32 2.91 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 0.90 0.00 0.00 75 M 8.55 4.45 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.78 0.00 76 W 9.57 4.82 0.00 3.68 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 77 K 8.51 3.38 0.00 1.72 0.94 0.00 1.73 0.00 0.00 1.53 0.00 0.00 2.75 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.74 0.21 7.81 78 L 8.20 4.93 0.00 1.61 1.59 1.01 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.27 0.00 0.76 1.87 0.00 3.67 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.14 0.00 80 M 8.61 4.30 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 81 F 7.43 4.49 0.00 3.10 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 82 G 9.10 3.99 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 0.00 83 C 7.89 4.29 0.00 3.06 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 84 R 8.64 4.56 0.00 1.80 1.86 0.00 3.21 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.81 0.00 85 D 7.85 4.80 0.00 2.72 2.52 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 86 P 0.00 4.36 0.00 2.22 2.12 0.00 3.67 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 87 M 8.23 4.13 0.00 2.08 2.25 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.70 0.00 88 Q 7.97 3.97 0.00 2.29 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 89 V 7.74 3.62 2.25 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 1.05 0.00 0.00 0.97 0.00 0.00 90 L 8.04 4.03 0.00 1.90 1.72 0.94 0.76 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 91 R 8.40 3.98 0.00 2.01 2.02 0.00 3.14 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 92 E 8.18 4.10 0.00 2.25 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 0.00 2.61 2.65 0.00 93 I 7.77 3.49 2.00 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 1.35 0.78 0.85 0.00 0.00 94 V 7.65 3.46 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 0.97 0.00 0.00 0.96 0.00 0.00 95 A 8.07 3.94 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 96 C 7.83 2.00 0.00 1.23 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 0.00 0.00 0.00 0.00 97 T 7.62 3.72 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 1.12 0.00 0.00 98 K 7.70 3.81 0.00 1.80 1.93 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.38 1.38 7.81 99 A 7.51 3.97 1.15 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 0.00 100 F 7.68 4.73 0.00 2.80 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 0.00 101 P 0.00 4.51 0.00 2.12 2.11 0.00 3.24 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 1.93 1.87 0.00 102 D 8.08 4.69 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 0.00 103 A 7.36 4.75 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 0.00 104 Y 8.50 4.23 0.00 2.51 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 0.00 105 V 8.82 5.23 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 0.98 0.00 0.00 0.88 0.00 0.00 106 R 9.50 5.00 0.00 1.82 1.92 0.00 2.32 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.33 0.00 107 L 8.05 4.81 0.00 1.52 0.73 0.91 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.55 4.79 1.62 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 0.46 0.00 0.00 0.50 0.00 0.00 109 A 8.10 4.90 1.20 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 0.00 0.00 110 F 9.05 5.25 0.00 2.99 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 0.00 111 D 8.78 5.42 0.00 2.41 2.44 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 0.00 112 N 9.15 4.74 0.00 2.93 3.05 0.00 0.00 6.33 7.39 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 0.00 113 Q 8.60 4.18 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.02 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 114 K 8.27 4.04 0.00 1.75 1.86 0.00 2.04 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.45 7.81 115 Q 7.96 3.42 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.70 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 116 V 7.81 4.52 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 0.57 0.00 0.00 0.91 0.00 0.00 117 Q 8.73 4.41 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.85 0.00 0.00 0.00 0.00 0.00 2.18 1.87 0.00 118 I 8.28 4.29 1.26 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.38 -0.60 0.00 0.00 119 M 6.84 4.66 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.59 0.00 120 G 8.30 4.73 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 0.00 121 F 7.17 4.99 0.00 3.19 3.27 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 0.00 122 L 8.88 4.59 0.00 1.64 1.62 0.65 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.92 4.53 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 0.75 0.00 0.00 0.94 0.00 0.00 124 Q 7.77 4.62 0.00 1.99 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.27 2.22 0.00 125 R 8.08 4.46 0.00 1.17 1.48 0.00 2.21 0.00 0.00 2.65 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.23 0.00 126 P 0.00 4.18 0.00 2.10 2.16 0.00 2.20 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.52 0.00 127 K 8.48 4.09 0.00 1.76 1.93 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.40 1.34 7.81 128 S 7.93 4.45 0.00 4.00 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 0.00 129 A 7.87 4.30 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 0.00 130 R 8.86 4.61 0.00 2.07 1.90 0.00 3.31 0.00 0.00 3.28 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.14 0.00 131 D 8.44 4.97 0.00 2.94 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 0.00 132 W 7.57 5.61 0.00 3.65 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 0.00 133 Q 8.43 4.33 0.00 1.88 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.03 0.00 0.00 0.00 0.00 0.00 2.31 2.03 0.00 134 P 0.00 4.50 0.00 2.31 2.10 0.00 3.39 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.76 0.00 135 A 8.99 3.97 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 0.00 136 N 8.08 4.60 0.00 2.83 2.95 0.00 0.00 5.83 7.13 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 0.00 137 K 7.84 4.46 0.00 1.83 1.67 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.23 7.81 138 R 7.53 3.63 0.00 1.49 0.66 0.00 3.02 0.00 0.00 3.02 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.66 0.00 139 S 7.48 5.08 0.00 4.08 3.94 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 0.00 140 V 8.50 3.99 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 0.60 0.00 0.00 0.91 0.00 0.00