NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 S 4.4089 8.3344 115.4195 57.6766 64.4760 173.5214 1 N 4.2668 8.5015 120.3317 52.8879 39.5110 173.8689 2 A 4.0168 9.6093 131.6268 55.6218 19.0555 178.9691 3 K 4.0476 8.0373 116.2255 59.5716 32.1670 179.5075 4 L 4.1174 7.9378 118.7578 57.5456 41.5769 178.9213 5 D 4.3899 8.4057 119.4034 57.4974 40.7285 178.8369 6 Q 4.1024 7.9141 118.6820 58.9073 28.6315 178.7839 7 I 3.4711 7.7390 120.4150 64.4473 37.1819 178.6764 8 R 3.9174 8.2237 119.0271 59.0373 29.8162 178.9082 9 L 3.9299 7.9732 120.1750 58.2138 42.1597 178.1813 10 Y 4.1874 7.9988 119.4052 60.8717 38.6638 178.0683 11 L 3.6147 7.9735 119.8265 57.9596 41.8638 179.4077 12 D 4.3075 8.0302 118.5342 57.5336 40.5549 178.8938 13 Q 3.9964 8.2300 117.7413 58.2431 28.7394 178.0598 14 K 4.2421 7.4921 116.8326 54.8864 32.6140 176.5203 15 G 3.8487 7.5927 106.6818 46.6179 0.0000 173.5106 16 A 4.7626 8.1256 120.6427 50.2248 21.6639 177.1496 17 E 4.5487 8.3950 117.3921 56.3330 31.9040 175.8764 18 L 4.8010 7.6038 121.0543 53.6940 45.8978 173.4158 19 A 4.9974 8.9809 128.1226 50.0559 21.8898 175.1616 20 I 4.5601 8.5148 122.8988 59.5299 39.7163 174.7943 21 F 4.9278 9.2119 127.4338 56.4554 40.1270 177.2387 22 S 4.5265 9.4017 115.1708 57.7035 64.8741 174.4433 23 D 3.9049 8.3338 121.3096 52.9463 42.0082 174.5922 24 P 4.1455 0.0000 0.0000 65.7981 31.2861 178.8242 25 V 3.7857 8.4269 117.1698 66.3596 31.4895 178.2910 26 T 3.9109 7.9073 115.0461 66.6972 68.3546 176.6048 27 I 3.7483 8.0864 121.9439 64.3786 37.0960 178.0493 28 N 4.6127 8.4587 119.3461 56.1930 38.5804 176.1612 29 Y 4.0433 8.0313 120.1859 60.9237 38.9330 178.0114 30 L 4.3423 8.1404 118.7306 56.8569 41.9151 177.8391 31 T 4.5461 8.0946 105.9176 60.1914 70.3002 175.1451 32 G 3.9134 8.5610 109.9364 46.2851 0.0000 172.6605 33 F 4.8113 8.1457 122.8634 56.2799 40.4108 174.0943 34 F 4.7351 8.2675 129.8927 56.1667 41.0906 173.8843 35 C 4.0751 7.0474 126.7365 57.0786 34.0716 172.5517 36 D 4.4217 8.0035 126.0209 51.8080 41.0957 173.9584 37 P 4.3828 0.0000 0.0000 63.0364 33.3003 177.7778 38 H 3.9370 7.7847 119.3095 58.2065 27.7662 177.4727 39 E 4.3740 9.1143 125.4457 57.3111 29.9026 176.7002 40 R 4.5247 7.8171 116.7672 56.3303 31.1430 175.9318 41 Q 4.2261 8.8717 118.9978 55.4700 29.5407 175.8513 42 L 4.9430 7.5512 122.5760 53.7588 45.1487 175.1856 43 F 5.2625 9.5768 124.1062 55.8883 44.0765 173.1513 44 L 5.2073 9.1915 125.2125 53.6098 44.1754 175.0696 45 F 4.9449 9.6094 126.8331 56.3764 40.5492 175.4360 46 V 4.4678 8.8341 126.4533 61.0594 31.0817 174.4310 47 Y 4.7360 8.4206 125.6085 57.8722 38.6076 176.8886 48 H 4.5387 9.3871 119.2148 58.0015 28.7024 175.8823 49 D 4.5915 7.5986 116.5758 54.4395 41.0242 176.3611 50 L 4.2127 7.6999 117.6351 52.9838 42.5880 176.1795 51 A 4.1314 8.2508 122.8670 51.8570 18.7332 175.7990 52 P 4.8518 0.0000 0.0000 62.7971 32.8345 175.7996 53 V 4.9750 9.0758 120.2937 61.3804 34.8837 173.7208 54 L 5.2792 9.5810 130.7651 54.0126 43.9587 174.6102 55 F 5.6071 9.8780 129.1694 56.8141 41.7899 174.5468 56 V 4.8492 8.2408 118.1526 58.6392 36.6746 173.3471 57 P 3.9520 0.0000 0.0000 62.3777 32.0438 177.4814 58 A 3.9218 8.3717 124.2663 55.4720 17.9524 180.3407 59 L 3.9959 7.7270 116.2286 58.2531 40.6967 178.2505 60 E 4.3865 8.2991 118.8557 56.7975 29.7769 178.1053 61 V 3.3969 7.5850 119.2395 65.8959 31.3364 177.5744 62 A 3.9087 7.8064 118.2469 55.2892 18.4627 179.3388 63 R 4.0078 7.9272 115.7151 59.3203 30.2842 178.8338 64 A 3.0468 7.8799 120.6473 55.1709 18.0064 179.9544 65 S 4.0882 7.8399 112.0376 61.4534 62.8363 176.6512 66 Q 4.0599 7.7097 120.2289 57.9174 28.4721 176.7740 67 A 4.5077 7.8277 120.4517 51.8905 20.8068 176.3487 68 I 4.1668 7.4308 117.0029 59.5126 38.8019 175.7702 69 S 4.3779 8.3109 119.3623 58.7483 63.9956 174.3303 70 F 4.6685 7.3710 115.8381 54.9860 39.0549 172.9887 71 P 4.2238 0.0000 0.0000 62.9888 32.0880 175.7971 72 V 4.8009 7.9091 123.3029 61.0387 34.1331 174.4423 73 F 5.0420 9.4853 126.2803 55.7255 42.4301 174.6963 74 G 4.9944 8.9105 109.2999 44.4566 0.0000 171.9158 75 Y 5.2319 7.8751 116.9593 55.1404 41.3807 175.7809 76 V 4.1264 8.7827 115.9550 60.3535 32.8075 177.1591 77 D 4.3706 8.4006 121.2975 57.2152 40.7103 178.0427 78 S 4.3991 8.0186 111.5753 59.2181 63.6697 173.7279 79 E 4.5478 7.9705 121.5528 55.0115 30.8740 175.8046 80 N 4.5795 8.6376 121.3252 52.6882 39.9967 174.2862 81 P 3.8723 0.0000 0.0000 65.5104 31.3466 178.6332 82 W 4.2028 7.5985 118.2678 59.6157 29.0872 178.1478 83 E 3.9886 8.7095 118.6342 59.1841 28.8878 179.3506 84 K 3.9541 8.0973 119.6731 59.4731 32.3041 178.7993 85 I 3.2657 7.5464 120.1723 64.1990 36.7667 178.0715 86 K 3.6130 7.5214 118.4769 59.6503 31.9922 178.2843 87 A 4.0351 7.7712 119.7350 54.6586 18.3593 179.2484 88 V 3.5198 7.4298 109.2582 61.6277 32.5153 177.0437 89 L 4.2514 6.9299 118.3337 53.5387 42.0736 175.6199 90 P 4.3175 0.0000 0.0000 65.3577 31.7096 176.2818 91 N 4.7312 7.6000 114.9966 52.9723 41.5532 173.5697 92 T 4.6415 8.5376 114.0455 61.5221 69.2815 173.9960 93 A 4.4277 8.1878 122.0501 52.1872 19.1251 178.0618 94 A 4.0682 8.1109 120.3011 53.3302 18.9040 178.9824 95 K 4.2625 8.8805 121.5894 58.5116 34.0009 177.1050 96 T 4.9272 8.6443 116.7757 61.6339 72.0945 173.3814 97 I 4.7256 8.8765 127.0230 59.5259 40.8944 174.0006 98 Y 4.7988 8.8525 123.7785 56.4053 40.2640 174.7325 99 A 4.9872 8.5991 123.9484 49.8682 23.8567 175.6022 100 E 4.5877 8.7676 119.1501 55.0915 28.2819 177.6060 101 F 4.3936 8.4282 122.7864 60.1590 39.3045 176.6274 102 D 4.6214 8.2174 118.4932 55.8452 41.1428 175.9982 103 H 4.6503 8.1325 116.9000 57.0954 31.9330 173.8039 104 L 4.0906 8.2006 121.8024 55.0237 42.3007 176.9504 105 N 4.6854 8.6063 124.0466 52.2254 39.7514 176.1532 106 V 3.5650 8.1526 119.9084 66.1028 31.4947 177.7343 107 N 4.3172 8.1254 115.8181 56.2931 38.3899 177.3477 108 K 4.3910 8.1584 119.3834 59.4155 32.2884 178.8953 109 F 4.2148 8.3651 120.9192 61.8288 39.0667 176.9538 110 H 3.9049 8.1045 114.7251 58.4305 28.8173 177.5277 111 G 2.1023 7.7352 107.8655 47.4091 0.0000 175.7245 112 L 4.2005 7.6383 121.8789 57.3489 41.4142 179.4038 113 Q 4.5507 7.6253 118.1518 57.5321 28.6548 177.9290 114 T 3.9799 7.2671 109.6735 63.1951 69.0365 175.1645 115 I 3.9765 7.3808 121.0227 62.0913 38.8143 175.6431 116 F 4.7964 8.6216 120.2618 55.7981 40.2813 176.3036 117 S 4.5842 8.7773 119.4319 58.3854 63.6360 174.1175 118 G 3.9942 7.8070 108.5268 45.4598 0.0000 172.6772 119 Q 4.5151 8.9857 121.9587 55.7055 30.0977 174.5594 120 F 5.0021 9.1719 125.2491 56.5115 40.5366 174.8696 121 N 4.8450 8.9870 120.1575 50.8915 42.6390 173.3084 122 N 3.6780 7.9094 119.6447 53.0547 39.5209 175.6478 123 L 4.5084 8.7814 126.0502 56.2959 42.0403 179.0788 124 T 3.9390 7.7449 110.2282 64.1662 68.5358 174.4469 125 P 4.2326 0.0000 0.0000 65.4939 31.1597 177.7842 126 Y 3.6347 7.8129 116.5975 60.4756 38.8025 177.6732 127 V 3.6224 7.6697 117.6283 66.3516 31.7515 177.6612 128 Q 4.1147 8.3099 116.5732 58.5510 28.5594 177.5385 129 G 3.7002 7.3279 110.3670 44.7993 0.0000 173.2984 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 0 S 8.33 4.41 0.00 4.02 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 1 N 8.50 4.27 0.00 3.02 2.81 0.00 0.00 6.82 6.91 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 2 A 9.61 4.02 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 3 K 8.04 4.05 0.00 1.88 1.97 0.00 1.75 0.00 0.00 1.94 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.61 1.56 7.81 4 L 7.94 4.12 0.00 1.79 1.69 0.77 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 5 D 8.41 4.39 0.00 2.95 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 6 Q 7.91 4.10 0.00 2.34 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.62 2.62 0.00 7 I 7.74 3.47 2.04 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.76 0.98 0.00 0.00 8 R 8.22 3.92 0.00 1.87 2.11 0.00 3.29 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.82 0.00 9 L 7.97 3.93 0.00 1.97 1.85 0.97 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 10 Y 8.00 4.19 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 11 L 7.97 3.61 0.00 1.82 1.82 0.93 1.19 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 12 D 8.03 4.31 0.00 2.84 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 13 Q 8.23 4.00 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.87 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 14 K 7.49 4.24 0.00 1.31 1.69 0.00 1.63 0.00 0.00 1.31 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.49 0.32 7.81 15 G 7.59 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 16 A 8.13 4.76 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 17 E 8.39 4.55 0.00 2.00 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 2.23 2.09 0.00 18 L 7.60 4.80 0.00 1.55 1.19 0.40 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.98 5.00 0.91 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 0.00 0.00 20 I 8.51 4.56 1.74 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.55 0.51 0.00 0.00 21 F 9.21 4.93 0.00 3.00 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 22 S 9.40 4.53 0.00 4.08 4.29 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 23 D 8.33 3.90 0.00 2.67 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 24 P 0.00 4.15 0.00 2.14 1.94 0.00 3.59 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 25 V 8.43 3.79 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 1.10 0.00 0.00 1.06 0.00 0.00 26 T 7.91 3.91 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 1.21 0.00 0.00 27 I 8.09 3.75 1.94 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.90 1.11 0.00 0.00 28 N 8.46 4.61 0.00 3.22 3.08 0.00 0.00 6.44 7.12 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 29 Y 8.03 4.04 0.00 3.15 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 30 L 8.14 4.34 0.00 1.61 1.67 -0.14 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 31 T 8.09 4.55 4.40 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 1.49 0.00 0.00 32 G 8.56 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.15 4.81 0.00 3.08 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 34 F 8.27 4.74 0.00 2.98 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 35 C 7.05 4.08 0.00 2.22 2.32 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 36 D 8.00 4.42 0.00 2.45 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.38 0.00 2.43 2.20 0.00 3.74 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 2.00 1.89 0.00 38 H 7.78 3.94 0.00 3.35 2.40 0.00 5.64 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 39 E 9.11 4.37 0.00 1.98 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 2.18 1.89 0.00 40 R 7.82 4.52 0.00 1.97 2.00 0.00 3.03 0.00 0.00 2.98 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.61 0.00 41 Q 8.87 4.23 0.00 2.06 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.59 0.00 0.00 0.00 0.00 0.00 2.23 1.82 0.00 42 L 7.55 4.94 0.00 1.53 1.36 1.12 0.58 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 43 F 9.58 5.26 0.00 2.93 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 0.00 0.00 0.00 44 L 9.19 5.21 0.00 1.95 1.77 1.26 1.00 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 45 F 9.61 4.94 0.00 3.21 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 46 V 8.83 4.47 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 1.11 0.00 0.00 1.11 0.00 0.00 47 Y 8.42 4.74 0.00 3.24 3.05 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 48 H 9.39 4.54 0.00 3.25 3.43 0.00 5.50 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.60 4.59 0.00 2.81 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 L 7.70 4.21 0.00 1.35 1.45 0.81 0.15 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 51 A 8.25 4.13 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 52 P 0.00 4.85 0.00 1.34 1.80 0.00 3.59 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.32 0.00 53 V 9.08 4.97 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 1.52 0.00 0.00 1.32 0.00 0.00 54 L 9.58 5.28 0.00 2.13 1.61 1.24 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 55 F 9.88 5.61 0.00 3.67 3.51 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 56 V 8.24 4.85 2.06 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 0.75 0.00 0.00 0.88 0.00 0.00 57 P 0.00 3.95 0.00 2.03 1.69 0.00 3.59 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 2.05 2.06 0.00 58 A 8.37 3.92 1.21 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 0.00 0.00 59 L 7.73 4.00 0.00 1.75 1.76 0.90 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.30 4.39 0.00 2.11 2.17 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 2.27 2.49 0.00 61 V 7.58 3.40 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 1.00 0.00 0.00 0.91 0.00 0.00 62 A 7.81 3.91 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 63 R 7.93 4.01 0.00 2.00 2.16 0.00 3.20 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.73 0.00 64 A 7.88 3.05 0.47 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 65 S 7.84 4.09 0.00 3.87 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 66 Q 7.71 4.06 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.80 0.00 0.00 0.00 0.00 0.00 2.56 2.51 0.00 67 A 7.83 4.51 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 68 I 7.43 4.17 1.47 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 1.23 0.55 -0.42 0.00 0.00 69 S 8.31 4.38 0.00 3.95 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 70 F 7.37 4.67 0.00 3.13 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 71 P 0.00 4.22 0.00 2.27 1.93 0.00 4.05 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.17 0.00 72 V 7.91 4.80 1.86 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 0.64 0.00 0.00 0.68 0.00 0.00 73 F 9.49 5.04 0.00 3.28 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 74 G 8.91 4.99 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 75 Y 7.88 5.23 0.00 3.25 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 76 V 8.78 4.13 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 0.66 0.00 0.00 1.00 0.00 0.00 77 D 8.40 4.37 0.00 2.64 2.73 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 78 S 8.02 4.40 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 E 7.97 4.55 0.00 2.39 2.06 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 2.36 2.31 0.00 80 N 8.64 4.58 0.00 2.83 2.88 0.00 0.00 6.91 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 81 P 0.00 3.87 0.00 1.32 0.89 0.00 3.64 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.60 0.00 82 W 7.60 4.20 0.00 3.53 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 83 E 8.71 3.99 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 2.37 2.59 0.00 84 K 8.10 3.95 0.00 2.07 2.07 0.00 1.60 0.00 0.00 1.88 0.00 0.00 3.35 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.80 1.82 7.81 85 I 7.55 3.27 1.78 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 -0.36 0.58 0.00 0.00 86 K 7.52 3.61 0.00 1.63 1.97 0.00 1.50 0.00 0.00 1.52 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.42 7.81 87 A 7.77 4.04 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 88 V 7.43 3.52 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 0.57 0.00 0.00 0.82 0.00 0.00 89 L 6.93 4.25 0.00 1.54 1.59 0.31 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 90 P 0.00 4.32 0.00 1.95 2.08 0.00 3.90 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.71 0.00 91 N 7.60 4.73 0.00 2.53 2.61 0.00 0.00 6.76 7.70 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 92 T 8.54 4.64 3.68 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 0.79 0.00 0.00 93 A 8.19 4.43 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 94 A 8.11 4.07 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 95 K 8.88 4.26 0.00 1.72 1.85 0.00 1.61 0.00 0.00 1.81 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.52 1.48 7.81 96 T 8.64 4.93 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 1.14 0.00 0.00 97 I 8.88 4.73 0.57 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.61 0.10 0.00 0.00 98 Y 8.85 4.80 0.00 2.66 2.71 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 99 A 8.60 4.99 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 100 E 8.77 4.59 0.00 2.18 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 0.00 2.46 2.35 0.00 101 F 8.43 4.39 0.00 2.86 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 0.00 102 D 8.22 4.62 0.00 2.73 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 0.00 103 H 8.13 4.65 0.00 3.12 3.37 0.00 5.93 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.20 4.09 0.00 1.94 1.66 1.32 1.58 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 0.00 105 N 8.61 4.69 0.00 3.00 2.94 0.00 0.00 5.88 7.68 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 0.00 106 V 8.15 3.56 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 0.98 0.00 0.00 0.85 0.00 0.00 107 N 8.13 4.32 0.00 2.84 2.95 0.00 0.00 7.15 7.68 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 0.00 108 K 8.16 4.39 0.00 2.21 2.39 0.00 1.84 0.00 0.00 1.91 0.00 0.00 3.08 0.00 0.00 3.08 0.00 0.00 0.00 0.00 2.11 1.73 7.81 109 F 8.37 4.21 0.00 2.94 3.05 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 0.00 110 H 8.10 3.90 0.00 3.07 3.08 0.00 5.75 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 G 7.74 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 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.64 4.20 0.00 1.76 1.99 0.99 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 7.63 4.55 0.00 1.73 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.98 0.00 0.00 0.00 0.00 0.00 1.83 1.20 0.00 114 T 7.27 3.98 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 1.01 0.00 0.00 115 I 7.38 3.98 1.82 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.61 -0.04 0.00 0.00 116 F 8.62 4.80 0.00 3.27 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 0.00 117 S 8.78 4.58 0.00 3.98 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 0.00 118 G 7.81 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 0.00 119 Q 8.99 4.52 0.00 2.19 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 120 F 9.17 5.00 0.00 3.28 3.41 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 0.00 121 N 8.99 4.85 0.00 1.44 1.79 0.00 0.00 6.38 7.56 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 0.00 122 N 7.91 3.68 0.00 2.08 2.49 0.00 0.00 7.03 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 0.00 123 L 8.78 4.51 0.00 1.73 1.68 0.15 0.48 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 0.00 124 T 7.74 3.94 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 1.30 0.00 0.00 125 P 0.00 4.23 0.00 2.25 2.18 0.00 3.73 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 2.16 2.17 0.00 126 Y 7.81 3.63 0.00 2.12 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 0.00 127 V 7.67 3.62 2.22 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 0.84 0.00 0.00 1.28 0.00 0.00 128 Q 8.31 4.11 0.00 2.03 2.11 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 2.37 2.36 0.00 129 G 7.33 3.70 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 0.00 0.00 0.00