NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2727 8.3044 120.3466 55.5742 33.2851 174.7188 2 H 4.5653 8.6996 124.6425 54.0045 30.5997 171.2706 3 L 4.9151 7.8301 126.2598 52.4302 45.9594 177.0305 4 T 4.1832 8.6063 111.9378 60.6870 71.0286 173.9008 5 P 4.1895 0.0000 0.0000 65.8195 31.3387 178.7542 6 E 3.9002 8.0281 115.6487 59.5969 29.6477 178.8670 7 E 3.8970 7.9749 120.0136 58.7355 29.5170 179.3763 8 K 3.8457 8.1584 119.6728 59.4985 32.1948 178.8526 9 S 4.1673 8.3822 114.6249 60.6730 62.1662 176.0312 10 A 3.9860 7.9448 123.5414 54.9004 18.1078 179.8256 11 V 3.4011 7.7125 117.0386 66.3580 31.3394 178.4430 12 T 3.9682 8.0431 109.4023 64.7683 68.3546 176.2955 13 A 4.0289 8.0739 122.9344 54.7966 18.6815 179.0885 14 L 3.8924 7.9266 118.6693 57.9932 42.2062 178.9968 15 W 4.3401 8.7238 128.4704 60.2287 30.4118 177.9711 16 G 3.8236 8.0535 104.3660 46.6324 0.0000 174.0720 17 K 4.4229 7.7661 118.4887 56.1043 32.8569 176.3697 18 V 3.7637 7.1418 120.2515 61.7120 32.1188 175.5853 19 N 4.4636 8.3251 125.4904 52.7121 39.0834 175.5298 20 V 3.4811 8.1185 128.7108 65.9732 31.7552 177.3985 21 D 4.3165 8.0602 118.1978 57.2741 40.7786 178.2594 22 E 3.8257 8.2865 119.7106 59.3701 29.6405 179.0352 23 V 3.6020 8.0451 118.8438 65.7728 31.5131 178.2540 24 G 3.6733 8.4747 106.0772 47.6386 0.0000 175.9287 25 G 3.6158 8.0565 108.3119 47.4762 0.0000 175.4284 26 E 3.8763 8.2888 121.5509 58.9430 29.6593 178.8328 27 A 3.9474 8.2780 121.2426 54.9266 18.4451 179.4082 28 L 3.9489 8.1223 119.0694 58.0853 42.1931 179.0915 29 G 3.7384 8.1070 105.7894 48.2874 0.0000 175.8124 30 R 3.9124 8.3090 121.3020 58.3944 29.9970 178.8276 31 L 4.0273 8.0691 120.3621 58.4020 42.2042 179.1613 32 L 4.1947 7.9234 119.7322 56.5271 41.2832 179.5997 33 V 3.5680 7.3705 117.9371 65.7136 31.6722 177.8418 34 V 3.6025 7.8874 116.9643 64.0520 32.8156 175.5866 35 Y 3.8991 7.2572 116.1686 54.3716 37.8461 174.1873 36 P 4.9153 0.0000 0.0000 64.0067 31.9792 178.2280 37 W 4.3878 7.9142 116.7759 59.1280 28.0151 177.4986 38 T 4.2877 7.7798 110.5972 63.6354 68.3120 176.0750 39 Q 4.3601 8.2062 121.6877 58.0998 28.4580 178.0686 40 R 3.7051 7.5393 116.1738 58.7182 29.2732 177.6323 41 F 4.1935 7.4016 114.7185 58.0309 39.4620 176.0007 42 F 4.4409 7.8135 119.7648 56.8495 39.3929 177.2517 43 E 4.0244 8.3156 123.9488 59.5941 29.2878 178.9878 44 S 4.5254 8.0291 110.5182 59.6709 63.1721 174.6299 45 F 4.6610 8.5921 120.1771 58.5098 40.0492 176.2962 46 G 3.9846 7.6705 106.7414 44.4651 0.0000 175.8813 47 D 4.5171 8.6432 128.2635 54.1402 40.4216 175.2604 48 L 4.8572 8.2633 127.4002 54.4292 42.6017 178.4031 49 S 4.2948 8.2040 116.5693 60.8042 63.2894 174.4928 50 T 4.7432 7.4120 109.6937 58.1189 73.1140 172.7962 51 P 4.1951 0.0000 0.0000 66.0668 31.3907 178.7313 52 D 4.4115 8.1071 116.7819 57.2110 40.4952 178.6147 53 A 3.9871 7.6743 120.1563 54.9827 18.7084 179.5148 54 V 3.6874 8.0274 116.9805 66.6878 31.4737 178.3494 55 M 4.2631 8.4467 117.1922 57.3419 31.7610 177.9819 56 G 4.0980 7.7043 103.7396 43.3807 0.0000 173.2962 57 N 4.5706 7.7472 121.1715 52.2232 39.9036 174.0922 58 P 4.2783 0.0000 0.0000 65.6232 31.5618 178.5469 59 K 3.6971 8.2972 118.5734 58.6486 31.7742 179.4827 60 V 3.6519 7.7481 118.3576 65.9459 31.5148 178.0559 61 K 3.9076 8.0961 118.0256 59.3414 31.9836 179.1956 62 A 3.9385 8.0569 121.1141 55.4731 18.2147 179.2399 63 H 4.3746 8.3617 116.9460 59.1915 29.9689 177.6985 64 G 3.5886 8.3560 107.8825 47.7165 0.0000 175.5814 65 K 4.0084 8.3275 122.4142 58.9599 32.1149 178.9078 66 K 3.9997 7.9284 119.9482 59.4018 32.1619 178.8735 67 L 4.1228 8.2101 120.5374 58.7246 40.5600 178.9079 68 L 4.2718 8.2774 121.1464 57.4358 41.9854 179.1781 69 G 3.7192 8.3395 106.0635 47.7998 0.0000 175.6093 70 A 4.1275 7.8210 122.0157 54.6475 18.6780 179.1812 71 F 4.3181 8.5737 119.3408 61.6328 39.4215 177.0856 72 S 3.9939 9.0427 113.0161 61.8339 62.3295 176.0096 73 D 4.4894 8.4807 121.4291 57.1883 40.4123 178.9343 74 G 3.5459 8.0777 106.4133 47.6556 0.0000 175.5500 75 L 3.7240 7.0943 119.3182 56.5596 41.5983 178.4206 76 A 4.2228 7.4560 118.8746 52.7435 19.6325 176.6578 77 H 4.9180 7.9874 115.1337 54.9916 29.5908 175.5537 78 L 3.9367 7.8767 119.4698 57.3441 41.9024 178.3820 79 D 4.6396 7.8966 116.2998 55.0587 41.7959 176.0373 80 N 5.0150 8.1512 119.3621 51.1316 39.5140 175.7907 81 L 4.0610 8.1314 120.8727 57.8676 41.8879 178.9833 82 K 4.0258 8.1276 117.0048 59.7415 31.8364 179.0679 83 G 3.7155 7.9247 104.7188 47.9012 0.0000 175.9756 84 T 3.7610 7.8235 117.2282 65.5589 68.5674 175.7201 85 F 4.7440 8.0278 116.9014 56.9692 39.3847 177.1653 86 A 4.0833 7.6302 122.4900 55.8051 18.1824 180.4286 87 T 3.9979 7.8756 107.4359 64.7120 69.0645 176.8780 88 L 4.1320 7.9818 121.4859 57.4220 41.6844 179.1410 89 S 4.3191 8.4544 113.6089 61.5679 62.3937 175.8979 90 E 3.9043 8.1176 121.1914 59.5104 29.2330 179.2576 91 L 3.9599 8.0357 120.1106 58.5586 42.1404 178.7783 92 H 4.2774 8.6386 116.3053 58.5421 28.1867 177.3539 93 C 3.4407 7.7348 120.7882 62.3886 31.1705 175.3459 94 D 4.1141 8.2131 119.7508 56.0861 40.5720 177.3848 95 K 4.3021 7.6957 116.5326 57.5318 33.9168 177.2832 96 L 4.1384 7.7221 116.8967 55.0735 42.1909 176.2815 97 H 4.1112 7.1682 114.0930 56.7450 26.3567 175.5575 98 V 4.0405 7.9207 119.4576 60.9772 31.9061 174.7659 99 D 4.3429 8.9445 127.2851 54.2932 41.3892 175.4544 100 P 3.3133 0.0000 0.0000 64.0731 31.8104 177.8956 101 E 3.8949 8.4021 119.5129 59.2355 29.2566 178.3175 102 N 4.2790 7.9524 116.6029 56.2529 38.5013 177.3050 103 F 4.4219 7.3616 119.2503 60.5252 39.0186 177.9897 104 R 4.0129 7.8361 117.4546 58.9961 29.9854 178.7879 105 L 3.7944 7.9429 118.8571 57.7157 41.5821 179.2928 106 L 4.0808 8.2492 120.5642 57.9853 41.9830 179.0734 107 G 3.7280 8.1555 105.6833 48.1908 0.0000 175.4444 108 N 4.4831 8.1431 118.9768 55.8295 38.4453 177.8319 109 V 3.6641 8.0353 119.8834 65.6551 31.5071 177.8748 110 L 3.8645 8.3404 120.7172 58.0911 41.9166 179.0312 111 V 3.5317 7.8336 118.1665 66.3144 31.3653 177.7757 112 C 4.0731 8.0176 116.2593 62.7164 27.9125 176.2920 113 V 3.4968 7.9992 120.1059 65.9217 31.0387 178.0273 114 L 3.8854 8.0169 118.8519 57.6747 41.2926 179.3650 115 A 3.6517 7.3631 120.6204 55.2273 18.0501 179.1909 116 H 4.0666 8.0594 115.8951 59.6442 30.0216 176.6979 117 H 3.8362 8.3135 119.3213 58.3703 30.0586 176.3045 118 F 4.7633 8.5130 117.4604 55.7856 40.1232 177.1874 119 G 3.8359 8.9549 109.5191 46.1277 0.0000 177.6632 120 K 4.1029 8.8489 122.9463 59.0453 32.4005 177.6686 121 E 4.0764 8.1081 119.7518 58.2505 30.0901 176.9837 122 F 4.5576 8.1867 123.7606 57.1563 37.9351 175.2537 123 T 4.1645 7.2925 115.4734 60.4268 71.2529 173.4681 124 P 4.1731 0.0000 0.0000 65.5800 31.3635 177.2755 125 P 4.2034 0.0000 0.0000 65.3595 31.2702 178.9003 126 V 3.5604 7.4398 117.4749 65.7195 31.3217 177.8094 127 Q 3.5049 8.1186 119.4661 59.0165 28.9694 178.1649 128 A 4.0102 8.0969 121.6209 55.1112 18.3721 179.5063 129 A 3.9084 7.9565 119.1272 55.6630 18.4659 179.5886 130 Y 3.9390 8.2638 115.1995 61.0280 37.8965 178.6287 131 Q 4.1470 8.7073 119.7482 58.8618 28.7402 178.8531 132 K 3.9454 7.9946 119.2166 59.5061 32.0334 179.5507 133 V 3.5118 7.7017 118.3348 66.1952 31.4147 178.5602 134 V 3.8073 8.4682 112.3323 64.1652 31.2867 178.4741 135 A 4.1140 8.2705 121.0428 54.8528 18.1968 179.8495 136 G 3.5281 8.4272 104.7210 48.0127 0.0000 176.1423 137 V 3.3647 8.0559 121.1916 65.4295 31.6534 177.9282 138 A 3.8639 8.1337 120.6398 55.2508 17.9895 179.3485 139 N 4.2941 8.2681 114.1353 56.4216 38.7494 177.2266 140 A 4.1599 7.9497 122.2005 55.0155 18.2939 179.6360 141 L 3.8126 7.8450 116.4616 56.8217 41.8922 178.4596 142 A 4.4092 7.6919 119.2171 52.8656 19.0221 178.3839 143 H 4.2867 7.8720 116.8380 58.3393 29.9646 175.7806 144 K 4.4798 8.1126 117.7310 56.0772 32.3309 176.2274 145 Y 4.1563 7.9633 117.5454 58.5037 38.3873 175.8561 146 H 4.4701 8.3216 117.5792 56.1394 28.3617 173.2422 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 4.27 0.00 2.25 2.00 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 2 H 8.70 4.57 0.00 3.14 3.18 0.00 5.74 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.83 4.92 0.00 1.55 1.51 0.82 0.98 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 4 T 8.61 4.18 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 1.22 0.00 0.00 5 P 0.00 4.19 0.00 2.15 2.14 0.00 3.56 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 2.09 2.13 0.00 6 E 8.03 3.90 0.00 2.13 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 0.00 2.33 2.32 0.00 7 E 7.97 3.90 0.00 2.16 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 2.29 2.28 0.00 8 K 8.16 3.85 0.00 1.90 1.74 0.00 1.57 0.00 0.00 1.51 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.35 7.81 9 S 8.38 4.17 0.00 4.02 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 10 A 7.94 3.99 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 11 V 7.71 3.40 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.43 0.00 0.00 12 T 8.04 3.97 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 1.24 0.00 0.00 13 A 8.07 4.03 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 14 L 7.93 3.89 0.00 1.91 1.97 0.24 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.72 4.34 0.00 3.80 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 16 G 8.05 3.82 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 0.00 17 K 7.77 4.42 0.00 1.93 2.03 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.54 7.81 18 V 7.14 3.76 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 -0.04 0.00 0.00 0.75 0.00 0.00 19 N 8.33 4.46 0.00 2.72 2.77 0.00 0.00 6.85 7.71 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 20 V 8.12 3.48 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 1.25 0.00 0.00 0.97 0.00 0.00 21 D 8.06 4.32 0.00 2.93 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 22 E 8.29 3.83 0.00 2.00 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 2.24 2.26 0.00 23 V 8.05 3.60 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 0.96 0.00 0.00 0.66 0.00 0.00 24 G 8.47 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 25 G 8.06 3.62 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 0.00 0.00 0.00 26 E 8.29 3.88 0.00 2.01 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 0.00 2.25 2.28 0.00 27 A 8.28 3.95 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.12 3.95 0.00 1.75 1.63 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.11 3.74 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 0.00 0.00 0.00 30 R 8.31 3.91 0.00 1.87 1.93 0.00 3.08 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 31 L 8.07 4.03 0.00 1.87 1.88 0.97 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.92 4.19 0.00 1.72 1.69 0.76 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.37 3.57 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.93 0.00 0.00 34 V 7.89 3.60 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 0.78 0.00 0.00 35 Y 7.26 3.90 0.00 2.60 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 36 P 0.00 4.92 0.00 2.32 2.30 0.00 3.81 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.88 0.00 37 W 7.91 4.39 0.00 3.56 3.48 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 38 T 7.78 4.29 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 1.06 0.00 0.00 39 Q 8.21 4.36 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 40 R 7.54 3.71 0.00 1.63 1.97 0.00 2.94 0.00 0.00 2.50 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 41 F 7.40 4.19 0.00 1.51 2.54 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 42 F 7.81 4.44 0.00 2.81 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 0.00 0.00 0.00 0.00 43 E 8.32 4.02 0.00 1.99 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 2.35 2.23 0.00 44 S 8.03 4.53 0.00 4.11 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.59 4.66 0.00 3.14 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 7.67 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 47 D 8.64 4.52 0.00 2.66 2.65 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 48 L 8.26 4.86 0.00 1.67 1.64 1.00 1.05 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 49 S 8.20 4.29 0.00 4.01 4.05 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 0.00 0.00 0.00 50 T 7.41 4.74 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.15 2.11 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 52 D 8.11 4.41 0.00 2.67 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 53 A 7.67 3.99 1.44 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 0.00 0.00 54 V 8.03 3.69 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 1.06 0.00 0.00 0.97 0.00 0.00 55 M 8.45 4.26 0.00 1.95 2.09 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 2.60 2.87 0.00 56 G 7.70 4.10 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 0.00 0.00 0.00 57 N 7.75 4.57 0.00 3.03 2.82 0.00 0.00 6.96 6.98 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 58 P 0.00 4.28 0.00 2.24 2.25 0.00 3.71 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 59 K 8.30 3.70 0.00 1.54 0.74 0.00 1.65 0.00 0.00 1.48 0.00 0.00 2.81 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.17 1.25 7.81 60 V 7.75 3.65 2.26 0.00 0.00 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 1.06 0.00 0.00 61 K 8.10 3.91 0.00 1.94 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.57 7.81 62 A 8.06 3.94 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 63 H 8.36 4.37 0.00 3.53 3.45 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.36 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 65 K 8.33 4.01 0.00 1.90 1.98 0.00 1.84 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.51 7.81 66 K 7.93 4.00 0.00 2.04 1.98 0.00 1.81 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.50 7.81 67 L 8.21 4.12 0.00 2.00 1.92 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.28 4.27 0.00 2.00 1.84 0.84 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.34 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.82 4.13 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 71 F 8.57 4.32 0.00 3.19 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 72 S 9.04 3.99 0.00 4.57 4.30 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 73 D 8.48 4.49 0.00 2.87 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 74 G 8.08 3.55 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 0.00 0.00 0.00 75 L 7.09 3.72 0.00 1.40 1.42 -0.37 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.46 4.22 1.12 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 0.00 0.00 77 H 7.99 4.92 0.00 3.08 3.14 0.00 5.82 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 78 L 7.88 3.94 0.00 1.54 1.64 0.75 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.90 4.64 0.00 2.64 2.69 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 80 N 8.15 5.01 0.00 2.70 2.62 0.00 0.00 7.11 6.80 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 81 L 8.13 4.06 0.00 1.76 1.84 0.88 0.95 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 82 K 8.13 4.03 0.00 1.69 1.86 0.00 1.65 0.00 0.00 1.37 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.46 7.81 83 G 7.92 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.82 3.76 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 0.63 0.00 0.00 85 F 8.03 4.74 0.00 3.13 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 0.00 86 A 7.63 4.08 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 87 T 7.88 4.00 4.26 0.00 0.00 0.00 0.00 0.00 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 88 L 7.98 4.13 0.00 2.07 1.91 1.17 0.94 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 89 S 8.45 4.32 0.00 4.17 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 90 E 8.12 3.90 0.00 2.25 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 2.34 2.46 0.00 91 L 8.04 3.96 0.00 1.86 1.86 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.64 4.28 0.00 3.54 3.74 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.73 3.44 0.00 1.23 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 8.21 4.11 0.00 2.73 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 95 K 7.70 4.30 0.00 1.80 1.78 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.34 7.81 96 L 7.72 4.14 0.00 1.74 1.63 0.71 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.17 4.11 0.00 3.36 3.44 0.00 5.64 0.00 0.00 0.00 0.00 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.92 4.04 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 0.21 0.00 0.00 0.51 0.00 0.00 99 D 8.94 4.34 0.00 2.78 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 0.00 100 P 0.00 3.31 0.00 1.97 1.85 0.00 3.42 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.45 0.00 101 E 8.40 3.89 0.00 2.03 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 2.32 2.41 0.00 102 N 7.95 4.28 0.00 2.47 2.72 0.00 0.00 6.92 7.47 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 0.00 103 F 7.36 4.42 0.00 3.09 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 0.00 104 R 7.84 4.01 0.00 1.98 1.97 0.00 3.13 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.90 0.00 105 L 7.94 3.79 0.00 1.71 1.37 0.70 -0.24 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 0.00 106 L 8.25 4.08 0.00 1.85 1.87 0.92 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.16 3.73 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 0.00 108 N 8.14 4.48 0.00 2.95 2.95 0.00 0.00 6.72 7.41 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 0.00 109 V 8.04 3.66 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 1.11 0.00 0.00 1.14 0.00 0.00 110 L 8.34 3.86 0.00 1.74 1.80 0.89 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.83 3.53 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 1.28 0.00 0.00 1.17 0.00 0.00 112 C 8.02 4.07 0.00 3.18 2.92 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 0.00 113 V 8.00 3.50 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 0.95 0.00 0.00 0.87 0.00 0.00 114 L 8.02 3.89 0.00 1.09 1.26 0.65 1.00 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 0.00 115 A 7.36 3.65 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 0.00 116 H 8.06 4.07 0.00 3.14 3.41 0.00 5.78 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.31 3.84 0.00 2.96 2.68 0.00 5.97 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.51 4.76 0.00 3.27 3.07 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 0.00 119 G 8.95 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.85 4.10 0.00 1.90 2.01 0.00 1.51 0.00 0.00 1.67 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.55 7.81 121 E 8.11 4.08 0.00 2.08 2.41 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 2.32 2.26 0.00 122 F 8.19 4.56 0.00 3.04 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.29 4.16 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 1.28 0.00 0.00 124 P 0.00 4.17 0.00 2.16 2.15 0.00 3.58 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 2.12 2.20 0.00 125 P 0.00 4.20 0.00 2.11 2.06 0.00 3.49 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 2.08 2.11 0.00 126 V 7.44 3.56 1.90 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 0.94 0.00 0.00 0.89 0.00 0.00 127 Q 8.12 3.50 0.00 1.75 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.44 2.64 0.00 128 A 8.10 4.01 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 0.00 129 A 7.96 3.91 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 0.00 130 Y 8.26 3.94 0.00 3.35 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 0.00 131 Q 8.71 4.15 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.74 2.63 0.00 132 K 7.99 3.95 0.00 2.00 1.84 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.98 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.46 1.58 7.81 133 V 7.70 3.51 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 0.94 0.00 0.00 0.77 0.00 0.00 134 V 8.47 3.81 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 0.99 0.00 0.00 1.14 0.00 0.00 135 A 8.27 4.11 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 0.00 136 G 8.43 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.06 3.36 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 0.67 0.00 0.00 0.76 0.00 0.00 138 A 8.13 3.86 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 0.00 139 N 8.27 4.29 0.00 2.82 2.89 0.00 0.00 7.04 7.80 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 0.00 140 A 7.95 4.16 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 0.00 141 L 7.85 3.81 0.00 0.87 0.58 -0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.69 4.41 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 0.00 143 H 7.87 4.29 0.00 3.28 3.44 0.00 5.76 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.11 4.48 0.00 1.85 1.85 0.00 1.80 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.50 1.79 7.81 145 Y 7.96 4.16 0.00 3.07 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 0.00 146 H 8.32 4.47 0.00 3.21 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00