NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3129 8.2644 123.5845 52.2563 19.1955 175.9106 3 R 4.0239 8.5545 123.1934 58.5036 30.2723 175.6692 4 R 4.1522 8.2090 117.5629 56.8613 31.8146 175.3430 5 R 4.4311 7.3857 118.2058 54.1742 31.9775 176.3174 6 R 3.8198 8.7991 122.0667 56.8358 29.0455 175.1042 7 A 3.8496 7.4646 127.7772 49.7240 20.8028 176.0887 8 E 4.4814 8.3034 119.1182 54.2999 31.0837 176.5644 9 V 3.6780 8.3037 124.0112 62.2591 31.2044 175.5042 10 R 3.9195 8.3587 128.0346 56.3900 30.4689 176.3214 11 Q 4.2438 8.3182 125.0959 56.1265 30.4238 175.3151 12 L 4.1473 8.2181 116.5545 53.8625 43.2924 174.3300 13 Q 3.8216 8.7207 123.9862 55.7443 29.4421 176.4914 14 P 4.6620 0.0000 0.0000 62.6246 31.6534 175.0538 15 D 4.6651 8.5755 117.2282 54.8229 41.9579 177.0245 16 L 4.7499 8.3491 122.8525 54.6493 41.7834 177.2558 17 V 4.0926 7.5360 117.4621 63.9047 34.2923 175.3961 18 Y 4.3785 9.1804 115.6356 57.0472 38.4851 176.9843 19 G 4.4187 7.8791 105.7659 46.2756 0.0000 172.0907 20 D 4.7543 7.5599 118.8207 52.3778 44.1023 175.8975 21 V 3.4391 8.8502 127.0393 66.1964 31.3221 176.5539 22 L 4.0986 8.9456 122.2095 57.3668 42.3859 179.2729 23 V 3.2408 7.3403 115.8366 65.9292 32.0726 178.2051 24 T 3.6682 7.7326 114.7066 66.7079 67.9528 175.6996 25 A 3.9896 8.0941 122.4680 55.7145 18.1534 179.5769 26 F 4.3023 8.6920 117.7602 61.2037 39.5065 177.3633 27 I 3.8150 7.6679 119.2180 64.5771 36.9794 177.6944 28 N 4.1844 8.7343 118.0920 56.4700 38.1783 176.7415 29 K 4.2523 7.4153 116.1762 57.5505 32.4828 178.2381 30 I 4.2137 9.1186 119.1983 61.7902 37.9693 175.7493 31 M 4.1739 7.1244 117.7149 55.1707 30.8038 175.0972 32 R 4.2137 8.2133 125.5037 56.3521 31.3879 175.5694 33 D 4.4478 9.6702 121.0166 54.3394 38.7568 173.9348 34 G 3.9830 7.7126 106.9916 46.2766 0.0000 173.7818 35 K 4.5770 7.4451 122.8506 53.4264 33.9142 176.6482 36 K 3.8088 8.3384 123.7954 59.6577 32.3158 176.9383 37 N 4.3118 8.2782 115.1618 56.4476 38.8133 175.7859 38 L 4.2111 7.9229 121.2639 57.5688 42.3108 178.1995 39 A 4.0340 7.5239 118.8934 54.4621 18.3477 178.8947 40 A 3.7213 8.1952 119.7891 55.0662 18.2820 179.3503 41 R 3.7704 8.2841 112.7749 59.7744 30.0513 178.7325 42 I 4.0377 7.7495 118.5705 64.8208 37.2303 178.0153 43 F 4.0162 7.6818 121.0434 61.6466 39.2085 176.9717 44 Y 4.6807 8.6830 116.2148 60.6806 37.4707 177.7973 45 D 4.4415 9.5123 119.8840 57.3138 41.2124 178.1334 46 A 4.2144 7.8847 121.0782 54.8832 18.4033 179.3817 47 C 4.1034 7.7895 115.0894 62.7495 28.1109 176.1976 48 K 4.0609 7.9967 121.5667 59.3334 31.8697 178.4008 49 I 4.0465 7.8812 118.5568 62.5730 36.8383 178.0934 50 I 3.7626 7.1741 121.2846 64.2449 37.3287 177.4403 51 Q 4.3282 7.9869 118.4155 57.9334 29.0015 178.5839 52 E 3.9328 8.5958 117.1749 59.0626 28.9420 178.9632 53 K 4.1050 6.0383 118.0559 57.1744 32.7185 176.8843 54 T 4.1346 7.9318 114.9953 61.7954 70.6386 173.8056 55 G 3.8473 8.7164 115.3697 46.8588 0.0000 173.9944 56 Q 4.0337 8.0028 120.5555 56.0147 27.7385 176.0788 57 E 4.3489 9.0981 122.7262 55.7838 31.9740 174.1420 58 P 3.5159 0.0000 0.0000 63.7137 31.9778 177.4638 59 L 3.7596 9.3062 127.6612 59.0801 42.2389 176.7743 60 K 3.9604 7.5659 117.0770 58.8046 31.9519 178.6093 61 V 3.5899 8.2497 118.8379 65.5507 31.7526 177.1323 62 F 3.9287 8.0715 119.8129 61.9045 39.1046 176.1128 63 K 3.5133 8.8189 118.2531 60.0769 31.8044 177.7579 64 Q 3.8653 7.8960 118.2758 59.4333 28.8958 179.0507 65 A 3.9595 8.0258 120.3736 55.3509 18.5294 179.5140 66 V 3.3612 7.8292 116.7460 66.1217 31.5287 177.9431 67 E 3.8496 8.1826 118.8910 58.8819 29.2621 177.5646 68 N 4.6320 8.0615 114.8540 54.4878 39.1712 174.9409 69 V 4.2789 7.6039 117.3998 63.0469 33.1457 175.3189 70 K 3.9170 7.6095 119.2763 55.6877 31.4677 174.9087 71 P 4.3449 0.0000 0.0000 62.8525 30.8672 175.8232 72 R 4.0479 8.8244 124.7350 59.3310 29.9169 175.8675 73 M 5.1466 7.6713 113.3231 53.9899 36.7751 173.5246 74 E 4.8152 9.5353 117.7272 55.7416 33.9381 173.7502 75 V 4.9778 8.3766 112.1199 59.7845 33.8965 176.1171 76 R 4.5568 9.0391 123.4060 54.3075 33.8780 174.7676 77 S 4.3506 8.7227 119.3162 58.2140 63.4231 173.0350 78 R 4.2132 7.8837 125.7213 54.0684 32.2174 174.9857 79 R 3.9265 8.4290 127.1210 56.2899 29.9883 175.4693 80 V 3.4920 7.8859 126.6107 63.3387 32.1704 174.2134 81 G 3.3200 8.4168 113.9795 48.2400 0.0000 172.0293 82 G 4.1341 9.2436 116.9708 45.9521 0.0000 172.0702 83 A 4.3624 7.0706 119.6716 51.9737 21.4250 174.4920 84 N 4.4478 8.0390 110.1484 51.7746 39.9991 173.1272 85 Y 4.1871 7.1914 119.9369 57.8281 39.6597 174.8730 86 Q 4.4198 8.3629 122.6881 54.4954 29.4898 175.3544 87 V 4.0423 8.0308 125.1408 61.6997 32.4952 173.9913 88 P 5.0757 0.0000 0.0000 63.3799 32.5161 174.9135 89 M 4.4170 8.9452 117.4826 54.7703 34.8312 173.8593 90 E 4.3683 9.0124 118.8645 56.3981 30.6195 177.2660 91 V 4.1364 8.1579 122.5157 60.8787 32.4029 175.2314 92 S 4.1417 8.5966 122.4190 57.7296 62.7344 173.2162 93 P 4.4335 0.0000 0.0000 64.0422 31.0501 177.6655 94 R 4.0191 8.2043 120.1822 56.7815 29.5576 178.2060 95 R 3.7417 8.0031 119.7581 60.1295 30.8684 177.5953 96 Q 3.7740 7.9641 119.0883 59.6668 28.7825 178.7896 97 Q 3.9371 8.4699 120.4207 59.0571 28.9299 178.1018 98 S 4.0781 7.7904 116.0113 61.1943 63.0930 175.9155 99 L 3.4221 8.3278 121.5353 58.7306 41.4865 179.0908 100 A 3.5049 7.5617 117.3929 56.2000 18.0020 179.2864 101 L 4.1240 8.0599 114.8248 57.6488 42.1714 179.8856 102 R 3.9151 8.6916 119.1334 59.5041 29.3649 178.5269 103 W 4.5921 8.6615 118.8242 59.6585 28.8391 178.0119 104 L 4.1335 7.8209 118.2588 58.0659 41.3064 179.1696 105 V 3.8068 8.0660 117.7611 66.2409 31.2912 178.1777 106 Q 4.0312 7.7967 116.4425 59.1435 28.8230 178.6588 107 A 4.1790 9.2587 119.9093 54.5727 18.7595 178.5944 108 A 4.1674 8.4749 121.1123 53.9912 18.2987 178.7619 109 N 4.3913 8.0468 116.7096 55.0561 39.5676 175.5071 110 Q 4.5129 7.6213 118.4036 55.5817 28.6904 175.7763 111 R 4.7506 7.3712 114.9484 53.8325 34.4131 174.4431 112 P 4.4422 0.0000 0.0000 64.3851 32.0560 176.7617 113 E 4.0932 7.9361 116.9212 56.5023 30.0566 177.1534 114 R 3.9954 8.5139 120.0307 58.8002 30.8312 177.1320 115 R 4.2392 7.9770 118.3141 55.2985 30.0776 177.0381 116 A 3.8858 8.6471 127.2159 55.2634 19.0769 179.0117 117 A 4.1807 8.2475 117.2560 55.7718 18.4081 180.2340 118 V 3.6805 7.9683 110.2679 64.3995 31.6895 179.0674 119 R 3.9747 7.7874 118.0569 58.7573 29.7550 178.7023 120 I 4.0041 7.6370 118.9623 63.3909 37.2655 177.5797 121 A 3.9698 7.8025 121.0990 55.8104 18.5589 179.1926 122 H 4.1392 8.5015 114.4966 58.9224 28.8909 177.3509 123 E 3.9407 8.1604 120.5346 59.8409 29.5217 179.1413 124 L 4.1071 8.3310 118.6969 57.4026 41.6107 178.4350 125 M 4.3298 7.8221 116.2100 56.6082 32.3340 177.1326 126 D 4.6464 7.7298 118.7830 56.1915 41.9545 177.7432 127 A 4.0364 8.0049 121.6240 54.1951 18.2942 179.2418 128 A 3.8894 7.7556 119.6274 54.7593 18.5606 178.5453 129 E 4.3463 8.5974 116.7345 56.6478 30.4335 177.5568 130 G 4.9625 7.2319 120.8651 46.3460 0.0000 172.8290 131 K 4.4823 7.6190 118.4070 56.1659 33.2537 176.4300 132 G 3.9003 8.0820 108.7094 46.2105 0.0000 175.2452 133 G 3.5916 8.8696 110.2090 48.1626 0.0000 175.8220 134 A 3.8316 8.2788 121.5806 54.6232 18.2947 179.8229 135 V 3.6031 7.6432 117.0857 66.3409 31.6416 178.2244 136 K 3.9920 7.5644 117.7657 59.5469 31.5906 179.1208 137 K 3.6885 7.4722 118.5986 58.6904 32.0560 178.6795 138 K 4.6122 7.8906 119.6327 59.8617 32.2338 178.6522 139 E 4.0223 8.7722 119.0892 59.1341 28.8720 178.2885 140 D 4.4370 8.4921 117.3683 55.6316 41.3901 177.1829 141 V 3.8377 7.4541 117.4144 63.9426 32.0308 176.9514 142 E 4.0103 7.9563 118.1075 59.4588 29.7238 178.4328 143 R 4.0519 7.7661 118.2509 59.5017 30.3192 178.4609 144 M 4.0356 7.5036 117.8896 57.6632 32.0191 177.1200 145 A 4.3574 7.0610 119.5960 53.4062 19.2623 176.2738 146 E 4.1087 8.9079 121.8532 57.1941 27.7974 177.1553 147 A 3.4827 7.6107 120.6452 54.7485 18.4862 178.0327 148 N 5.1372 8.0900 111.6382 53.2092 39.1355 176.4610 149 R 3.9832 8.8447 120.8550 58.0941 30.4294 177.4074 150 A 3.8393 8.0161 120.1982 55.7936 18.5792 178.3367 151 Y 3.9634 7.1539 112.2059 56.8883 37.1008 176.1813 152 A 4.5377 7.5565 122.9414 53.3207 20.4779 178.0193 153 H 4.8841 8.0959 110.6900 56.3244 28.9096 175.4160 154 Y 5.0439 8.2596 114.1965 58.8087 39.8098 177.4590 155 R 3.9853 8.7587 119.7006 57.0572 30.7526 176.4058 156 W 4.0996 8.8776 120.9114 56.8998 30.1709 174.1971 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 2 A 8.26 4.31 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 3 R 8.55 4.02 0.00 1.87 1.96 0.00 3.24 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 4 R 8.21 4.15 0.00 1.84 1.87 0.00 3.24 0.00 0.00 3.22 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 5 R 7.39 4.43 0.00 1.77 1.84 0.00 3.27 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 6 R 8.80 3.82 0.00 1.75 1.89 0.00 3.25 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 7 A 7.46 3.85 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 8 E 8.30 4.48 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 2.22 2.26 0.00 9 V 8.30 3.68 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 0.76 0.00 0.00 0.93 0.00 0.00 10 R 8.36 3.92 0.00 1.81 1.82 0.00 3.29 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 11 Q 8.32 4.24 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 12 L 8.22 4.15 0.00 1.63 1.57 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.72 3.82 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.88 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 14 P 0.00 4.66 0.00 2.10 2.05 0.00 3.73 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 15 D 8.58 4.67 0.00 2.74 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.35 4.75 0.00 1.66 1.62 0.92 0.81 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 17 V 7.54 4.09 2.47 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 0.29 0.00 0.00 0.16 0.00 0.00 18 Y 9.18 4.38 0.00 2.98 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 19 G 7.88 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.56 4.75 0.00 2.88 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.85 3.44 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 0.91 0.00 0.00 0.96 0.00 0.00 22 L 8.95 4.10 0.00 1.80 1.81 1.02 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.34 3.24 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 0.19 0.00 0.00 0.75 0.00 0.00 24 T 7.73 3.67 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 1.24 0.00 0.00 25 A 8.09 3.99 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 26 F 8.69 4.30 0.00 3.55 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 27 I 7.67 3.82 1.86 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.72 0.81 0.00 0.00 28 N 8.73 4.18 0.00 2.83 2.89 0.00 0.00 7.13 5.56 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 29 K 7.42 4.25 0.00 1.67 1.71 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.58 7.81 30 I 9.12 4.21 1.82 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.72 0.88 0.00 0.00 31 M 7.12 4.17 0.00 2.13 1.98 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.45 0.00 32 R 8.21 4.21 0.00 1.87 1.75 0.00 3.37 0.00 0.00 3.33 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 33 D 9.67 4.45 0.00 2.79 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 34 G 7.71 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 0.00 0.00 0.00 35 K 7.45 4.58 0.00 1.76 1.68 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.69 7.81 36 K 8.34 3.81 0.00 1.81 1.81 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.49 7.81 37 N 8.28 4.31 0.00 2.74 2.88 0.00 0.00 6.87 7.78 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 38 L 7.92 4.21 0.00 1.96 1.65 0.94 0.71 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 39 A 7.52 4.03 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 40 A 8.20 3.72 1.49 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 41 R 8.28 3.77 0.00 2.10 2.13 0.00 3.21 0.00 0.00 3.38 8.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.84 0.00 42 I 7.75 4.04 1.92 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 0.90 0.96 0.00 0.00 43 F 7.68 4.02 0.00 3.01 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 44 Y 8.68 4.68 0.00 3.19 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 45 D 9.51 4.44 0.00 2.89 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 46 A 7.88 4.21 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 C 7.79 4.10 0.00 3.43 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 48 K 8.00 4.06 0.00 1.84 1.94 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.52 7.81 49 I 7.88 4.05 2.03 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.86 0.93 0.00 0.00 50 I 7.17 3.76 2.00 0.00 0.00 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 1.72 0.71 0.98 0.00 0.00 51 Q 7.99 4.33 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.07 0.00 0.00 0.00 0.00 0.00 2.42 2.31 0.00 52 E 8.60 3.93 0.00 2.08 1.79 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 2.41 2.56 0.00 53 K 6.04 4.11 0.00 1.95 1.82 0.00 1.80 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.39 7.81 54 T 7.93 4.13 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 1.32 0.00 0.00 55 G 8.72 3.85 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 0.00 0.00 0.00 56 Q 8.00 4.03 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 57 E 9.10 4.35 0.00 2.07 1.92 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 2.42 2.35 0.00 58 P 0.00 3.52 0.00 2.37 1.89 0.00 3.74 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 59 L 9.31 3.76 0.00 1.18 1.57 0.94 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.57 3.96 0.00 1.91 1.92 0.00 1.58 0.00 0.00 1.59 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.50 7.81 61 V 8.25 3.59 2.40 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 0.81 0.00 0.00 0.92 0.00 0.00 62 F 8.07 3.93 0.00 2.90 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 63 K 8.82 3.51 0.00 1.86 1.78 0.00 1.54 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.48 7.81 64 Q 7.90 3.87 0.00 1.99 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.45 2.40 0.00 65 A 8.03 3.96 1.18 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 0.00 0.00 66 V 7.83 3.36 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 0.90 0.00 0.00 0.03 0.00 0.00 67 E 8.18 3.85 0.00 2.06 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 0.00 2.27 2.33 0.00 68 N 8.06 4.63 0.00 2.98 2.79 0.00 0.00 6.91 7.25 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 69 V 7.60 4.28 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 1.01 0.00 0.00 0.98 0.00 0.00 70 K 7.61 3.92 0.00 1.71 1.88 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.52 1.47 7.81 71 P 0.00 4.34 0.00 2.31 2.40 0.00 3.76 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.63 0.00 72 R 8.82 4.05 0.00 1.79 2.07 0.00 3.24 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 73 M 7.67 5.15 0.00 1.92 1.92 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 2.52 2.80 0.00 74 E 9.54 4.82 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 75 V 8.38 4.98 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 0.79 0.00 0.00 0.96 0.00 0.00 76 R 9.04 4.56 0.00 1.77 1.74 0.00 3.23 0.00 0.00 3.29 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 77 S 8.72 4.35 0.00 3.78 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.88 4.21 0.00 1.48 1.63 0.00 3.23 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.42 0.00 79 R 8.43 3.93 0.00 1.69 1.73 0.00 3.35 0.00 0.00 3.01 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.47 0.00 80 V 7.89 3.49 1.67 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 0.72 0.00 0.00 0.42 0.00 0.00 81 G 8.42 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.24 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 83 A 7.07 4.36 1.18 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 0.00 0.00 84 N 8.04 4.45 0.00 2.54 2.57 0.00 0.00 6.80 7.46 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 85 Y 7.19 4.19 0.00 2.74 1.84 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 86 Q 8.36 4.42 0.00 1.91 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.95 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 87 V 8.03 4.04 2.29 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 1.27 0.00 0.00 1.05 0.00 0.00 88 P 0.00 5.08 0.00 2.17 2.10 0.00 4.17 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.20 0.00 89 M 8.95 4.42 0.00 2.14 2.27 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.65 0.00 90 E 9.01 4.37 0.00 1.90 1.94 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 2.34 2.34 0.00 91 V 8.16 4.14 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 0.87 0.00 0.00 1.06 0.00 0.00 92 S 8.60 4.14 0.00 3.89 3.76 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 93 P 0.00 4.43 0.00 2.20 2.14 0.00 3.80 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 1.98 1.98 0.00 94 R 8.20 4.02 0.00 1.81 1.80 0.00 3.16 0.00 0.00 3.09 8.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 95 R 8.00 3.74 0.00 1.86 1.93 0.00 3.22 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 96 Q 7.96 3.77 0.00 2.40 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.58 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 97 Q 8.47 3.94 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.60 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 98 S 7.79 4.08 0.00 3.92 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.33 3.42 0.00 0.85 0.29 0.74 0.87 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 0.00 100 A 7.56 3.50 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 8.06 4.12 0.00 1.71 1.94 1.10 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.69 3.92 0.00 1.89 1.92 0.00 3.17 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 103 W 8.66 4.59 0.00 3.39 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 0.00 104 L 7.82 4.13 0.00 2.21 2.07 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.07 3.81 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.54 0.00 0.00 106 Q 7.80 4.03 0.00 2.38 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.70 0.00 0.00 0.00 0.00 0.00 2.47 2.67 0.00 107 A 9.26 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 0.00 108 A 8.47 4.17 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 N 8.05 4.39 0.00 2.74 2.91 0.00 0.00 6.86 7.69 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 0.00 110 Q 7.62 4.51 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.67 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 111 R 7.37 4.75 0.00 1.95 1.89 0.00 3.34 0.00 0.00 3.46 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.83 0.00 112 P 0.00 4.44 0.00 2.16 2.16 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 113 E 7.94 4.09 0.00 2.07 1.93 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 2.25 2.24 0.00 114 R 8.51 4.00 0.00 1.83 2.02 0.00 3.20 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 115 R 7.98 4.24 0.00 1.88 1.90 0.00 3.17 0.00 0.00 3.35 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 116 A 8.65 3.89 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.25 4.18 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 0.00 118 V 7.97 3.68 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 0.96 0.00 0.00 119 R 7.79 3.97 0.00 2.02 2.00 0.00 3.12 0.00 0.00 3.47 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 120 I 7.64 4.00 1.97 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.11 1.11 0.00 0.00 121 A 7.80 3.97 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 0.00 122 H 8.50 4.14 0.00 3.29 3.37 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.16 3.94 0.00 2.31 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 2.40 2.50 0.00 124 L 8.33 4.11 0.00 1.70 1.62 0.70 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 125 M 7.82 4.33 0.00 1.98 2.15 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 2.75 2.54 0.00 126 D 7.73 4.65 0.00 2.90 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 0.00 127 A 8.00 4.04 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 7.76 3.89 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.60 4.35 0.00 2.16 1.93 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 2.25 2.29 0.00 130 G 7.23 4.96 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 0.00 131 K 7.62 4.48 0.00 1.84 1.87 0.00 1.61 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.40 7.81 132 G 8.08 3.90 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 0.00 0.00 0.00 133 G 8.87 3.59 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 0.00 134 A 8.28 3.83 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 0.00 135 V 7.64 3.60 2.29 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 0.93 0.00 0.00 0.97 0.00 0.00 136 K 7.56 3.99 0.00 1.83 1.78 0.00 1.69 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.58 7.81 137 K 7.47 3.69 0.00 1.36 0.74 0.00 0.61 0.00 0.00 0.77 0.00 0.00 2.62 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.84 0.43 7.81 138 K 7.89 4.61 0.00 2.28 2.13 0.00 1.80 0.00 0.00 1.88 0.00 0.00 3.14 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.62 1.77 7.81 139 E 8.77 4.02 0.00 2.13 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 140 D 8.49 4.44 0.00 2.83 2.49 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 0.00 141 V 7.45 3.84 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 1.06 0.00 0.00 1.13 0.00 0.00 142 E 7.96 4.01 0.00 2.17 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 0.00 2.31 2.48 0.00 143 R 7.77 4.05 0.00 1.85 1.95 0.00 3.19 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 144 M 7.50 4.04 0.00 1.89 2.16 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 2.96 0.00 145 A 7.06 4.36 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 0.00 146 E 8.91 4.11 0.00 2.21 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 2.29 2.25 0.00 147 A 7.61 3.48 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 0.00 148 N 8.09 5.14 0.00 3.00 3.03 0.00 0.00 6.51 7.69 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 0.00 149 R 8.84 3.98 0.00 1.85 1.98 0.00 3.71 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 150 A 8.02 3.84 0.67 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 0.00 151 Y 7.15 3.96 0.00 2.70 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 0.00 0.00 0.00 152 A 7.56 4.54 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 0.00 153 H 8.10 4.88 0.00 3.39 3.41 0.00 5.48 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 8.26 5.04 0.00 3.16 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 0.00 155 R 8.76 3.99 0.00 1.91 2.13 0.00 3.41 0.00 0.00 3.34 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.78 0.00 156 W 8.88 4.10 0.00 3.61 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