NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4686 8.1927 116.8032 58.7254 65.2323 175.6598 3 V 3.3635 7.6720 119.2963 65.6209 30.9132 176.1894 4 Y 3.9381 8.7378 117.4088 61.1009 37.9649 177.5925 5 D 4.4450 8.1569 118.1766 57.3625 41.3089 178.2529 6 A 4.0826 8.1249 121.0956 55.0304 18.4048 179.5511 7 A 3.8882 8.2001 119.0930 54.9344 18.1474 179.5493 8 A 4.0490 7.5365 118.0611 54.8351 18.4810 179.2002 9 Q 4.2361 7.8149 115.3423 56.9934 29.9393 177.1501 10 L 4.2086 7.3749 121.2795 53.8050 40.0670 177.0809 11 T 4.2052 7.6706 114.5225 60.3843 71.5336 175.1501 12 A 3.9397 8.4329 122.3089 55.7095 18.2504 179.6118 13 D 4.2874 7.9854 116.6997 57.2824 40.9406 179.0636 14 V 3.4717 7.4314 118.0127 65.9820 31.5202 178.2980 15 K 3.8644 8.2265 118.5052 59.1520 31.7173 179.3054 16 K 3.9413 7.9839 119.9817 59.6963 32.1808 178.7357 17 D 4.5453 8.0931 119.1779 57.1371 40.6260 178.8367 18 L 3.7429 7.9258 119.6476 57.7647 41.6995 179.7154 19 R 4.0296 8.1221 118.0578 59.4685 30.3034 178.9215 20 D 4.4948 8.5375 119.1920 57.4214 40.7663 179.0017 21 S 3.0070 8.3204 114.7914 60.6077 63.0972 176.3296 22 W 4.2618 8.6464 132.0593 59.9610 30.1968 177.7398 23 K 3.9723 7.9156 118.9881 58.8420 31.7426 178.1970 24 V 3.9151 7.0025 115.9086 64.9995 32.1924 177.8571 25 I 3.4097 7.6068 119.7084 64.3273 36.9732 178.0988 26 G 2.3544 6.8785 106.3228 45.6246 0.0000 174.3786 27 S 4.1711 7.2619 114.4118 59.6714 63.7610 174.3895 28 D 4.6255 7.2241 119.7601 51.2088 41.1841 175.3487 29 K 3.9103 8.0184 123.1550 58.5880 32.4369 178.4004 30 K 3.9987 7.9543 119.5280 59.3886 32.3349 178.9547 31 G 3.6205 8.2163 107.2152 47.5751 0.0000 175.4491 32 N 4.5077 8.4318 119.8233 55.2464 38.4745 178.0185 33 G 3.5012 8.1581 107.6271 47.7591 0.0000 176.0673 34 V 3.6355 7.8762 120.7322 65.4630 31.6221 177.9656 35 A 3.9446 7.9509 120.6016 55.0138 18.3331 179.5214 36 L 3.8271 8.1107 117.7034 57.9642 41.6302 179.5399 37 F 4.0636 8.2816 120.7310 61.5591 39.3507 177.2948 38 T 3.6614 8.1115 109.4511 64.7696 68.5097 176.8321 39 T 3.8766 7.7134 118.6678 66.0851 68.3355 176.3759 40 L 3.8628 7.5448 122.0997 58.3185 41.7788 179.1977 41 F 4.4652 7.5024 117.3408 60.4384 38.5316 177.6430 42 A 4.0259 7.8490 119.7978 55.2219 18.3111 178.9920 43 D 4.6660 8.2195 116.0648 55.4606 42.6121 176.8491 44 N 5.0955 8.3231 116.8938 49.7921 39.4331 174.3884 45 Q 4.2338 8.6323 122.4205 58.5228 28.8648 178.8427 46 E 4.0434 8.3039 118.8312 59.1663 29.6141 178.7001 47 T 4.4812 8.2780 110.2867 64.0111 68.9130 176.3895 48 I 3.7092 8.0290 123.3376 63.8314 36.7438 178.1299 49 G 3.5093 7.7886 105.6895 47.3167 0.0000 174.3846 50 Y 4.3324 7.6889 116.2336 58.2127 38.5525 175.7015 51 F 5.0572 8.1302 120.0679 56.5254 40.3526 177.5108 52 K 3.8842 8.4895 124.0989 59.6512 32.1214 178.4026 53 R 4.0039 8.0906 117.4058 59.2007 30.0265 177.1887 54 L 4.2662 8.0000 116.5286 55.4580 42.7808 179.0378 55 G 3.9193 7.8924 106.7171 46.7166 0.0000 177.3082 56 D 4.5908 8.4182 118.7143 53.5783 39.9003 176.5346 57 V 3.9560 8.0167 118.6565 62.8068 31.7124 177.1995 58 S 4.3663 7.9541 113.0558 60.3838 62.8167 175.7195 59 Q 4.1541 8.2218 121.5653 56.6975 28.9337 177.0928 60 G 3.9165 8.5140 108.9987 46.1948 0.0000 175.9172 61 M 3.9030 9.1130 120.9841 58.6085 31.9624 177.3994 62 A 4.0186 7.5353 118.9530 54.1693 18.8388 177.3037 63 N 4.5705 8.3273 115.2749 53.0141 39.3328 174.9726 64 D 4.4045 8.7682 129.0873 57.6370 41.0446 179.0693 65 K 4.0251 8.0254 118.3114 59.3123 32.0570 179.0591 66 L 4.0594 7.9336 120.2253 58.1247 42.1507 178.8186 67 R 3.9774 8.5177 119.2789 59.3644 30.1453 178.7187 68 G 3.6243 8.4675 105.9826 48.0468 0.0000 175.2137 69 H 4.1203 8.3460 120.6366 59.0477 29.6519 177.5750 70 S 3.8117 7.8781 116.1574 61.4772 62.7772 176.5173 71 I 3.8925 7.8454 122.4461 64.7803 36.9414 178.6295 72 T 4.0410 7.8303 116.3319 66.5292 68.2692 176.2845 73 L 3.9723 8.0148 122.4089 58.5992 42.0721 179.0597 74 M 4.2490 7.9225 118.2271 58.1946 31.8221 177.8348 75 Y 4.1229 7.9780 115.9921 59.6397 38.1413 177.6315 76 A 3.7457 7.7725 122.4986 54.8914 18.4850 179.6339 77 L 3.4837 7.4393 117.0145 57.5316 41.6483 179.2746 78 Q 3.5226 7.7225 119.5562 58.9087 28.7718 177.7425 79 N 4.2061 7.5646 116.7740 56.8155 39.2199 176.3284 80 F 4.5153 7.5648 118.9134 60.8518 38.8787 177.7616 81 I 3.4978 7.5964 119.2952 64.4907 36.6076 178.3105 82 D 4.4187 8.0645 118.4483 56.5700 40.8855 177.7307 83 Q 4.4258 7.5708 116.7094 55.7183 28.7825 177.1326 84 L 3.9269 7.3925 121.9082 57.8178 41.7502 177.7828 85 D 4.5068 7.8609 115.1956 54.8987 41.3635 176.4046 86 N 4.8013 8.0696 117.8884 50.2214 40.4458 172.0399 87 P 4.1775 0.0000 0.0000 65.7655 31.4136 177.9738 88 D 4.5623 8.1556 118.3168 56.9586 40.7793 178.3757 89 D 4.3694 8.2079 119.0794 56.8570 40.9150 178.5221 90 L 3.8421 8.0314 121.0870 58.1040 42.0581 179.2110 91 V 3.2979 7.7715 118.6161 66.0579 31.4802 177.8178 92 C 4.1327 7.7495 114.2751 61.1304 29.4286 175.9785 93 V 3.7366 7.8062 120.9660 65.5769 31.1284 178.2590 94 V 3.4947 7.8613 118.2615 65.9538 30.8005 177.9569 95 E 4.0012 8.3414 118.5022 59.0809 29.0170 179.2442 96 K 4.0002 7.8538 118.8906 59.5065 32.9326 178.3609 97 F 4.2899 8.6573 120.8473 61.2807 39.3130 176.9772 98 A 3.7194 8.4203 120.4543 54.5400 18.0927 179.3191 99 V 3.4651 7.3831 116.3118 66.9226 31.4297 178.1692 100 N 4.3480 7.9603 115.0767 56.4277 38.5194 177.1148 101 H 4.1504 7.5069 116.9760 58.5389 28.6653 177.8988 102 I 3.7354 8.2128 122.3218 64.6938 36.7305 178.5624 103 T 3.8739 7.6573 115.4292 66.3456 68.3220 175.9809 104 R 4.2026 7.5061 116.9886 55.4151 30.6566 176.2085 105 K 3.7832 7.9846 117.4130 57.5111 29.8381 176.2342 106 I 4.1564 7.5406 120.4618 59.8993 37.3987 177.1871 107 S 4.4811 8.4355 120.9133 57.5531 65.3214 174.7673 108 A 4.0146 8.5243 123.4710 55.2753 17.8544 179.8084 109 A 4.0153 7.9373 117.9957 55.2350 18.8702 179.0093 110 E 4.0973 8.2470 117.7338 59.4796 29.8113 178.7860 111 F 4.1750 8.7344 121.1375 61.1712 39.4840 177.0467 112 G 3.8917 8.4691 104.7626 46.8480 0.0000 175.1750 113 K 4.2228 7.8173 119.7203 58.3745 32.3560 178.1834 114 I 3.8677 7.6029 118.8432 62.6746 37.8981 177.1959 115 N 4.4603 8.1563 117.9143 56.5352 38.3636 177.2349 116 G 3.6194 8.0233 106.4978 47.5441 0.0000 173.6959 117 P 4.2542 0.0000 0.0000 65.1687 31.2387 178.8151 118 I 3.5513 7.7522 118.6333 64.0788 36.9951 178.3203 119 K 3.9247 8.1686 120.5365 59.5155 31.9959 179.0645 120 K 4.0059 8.0935 118.8064 59.3613 31.5314 179.5996 121 V 3.5553 7.9012 118.6381 65.8562 31.3471 178.1000 122 L 3.8493 8.1397 118.7827 57.8320 41.4990 179.3944 123 A 4.1487 8.2296 120.9124 55.0160 18.0744 179.6273 124 S 4.2255 7.9569 111.6912 60.3110 63.1082 175.7583 125 K 4.3905 7.0977 120.1175 55.4609 32.3651 175.5425 126 N 4.1467 7.9625 115.1728 54.3435 36.0698 174.0752 127 F 4.4812 8.1977 117.9140 55.7996 40.1450 177.3745 128 G 4.0686 8.6568 114.0966 44.1789 0.0000 172.2659 129 D 4.5099 8.9029 118.6294 57.4473 40.2002 178.6418 130 K 3.7886 8.2267 119.5350 60.0849 32.0815 178.2146 131 Y 4.1717 8.1897 116.3181 60.8630 37.8762 177.9490 132 A 4.2480 8.1801 121.4230 55.3291 18.4440 179.2894 133 N 4.3799 8.7873 115.3041 56.2861 38.4450 177.5622 134 A 3.9458 7.7439 121.6918 55.0178 18.4366 179.8019 135 W 3.8980 8.5092 117.2588 59.6570 29.0803 178.6745 136 A 4.1155 8.2754 120.9459 55.0207 17.5412 179.8414 137 K 3.9865 7.6211 116.3839 59.2346 32.4246 179.0907 138 L 3.9193 7.5785 120.7688 58.0560 41.9336 179.1442 139 V 3.7443 8.1608 118.1281 65.9645 31.4137 177.8499 140 A 4.4976 7.9876 121.9570 54.4106 17.8942 179.8054 141 V 3.3962 7.2627 116.3005 66.0506 31.7959 178.1760 142 V 3.4552 7.4298 117.4962 66.0029 31.4683 177.7581 143 Q 3.8722 8.2968 117.8042 58.9605 28.3087 178.8035 144 A 4.0486 7.8536 120.4068 54.1482 18.4621 178.4614 145 A 4.3196 7.7229 117.4007 52.4040 19.4656 177.1600 146 L 4.1580 7.4147 122.0507 54.6773 41.8695 176.4530 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 S 8.19 4.47 0.00 3.89 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 3 V 7.67 3.36 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 0.89 0.00 0.00 0.85 0.00 0.00 4 Y 8.74 3.94 0.00 3.03 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 5 D 8.16 4.45 0.00 2.84 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 A 8.12 4.08 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 7 A 8.20 3.89 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 8 A 7.54 4.05 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 9 Q 7.81 4.24 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.27 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 10 L 7.37 4.21 0.00 1.69 1.53 0.76 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.67 4.21 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 1.18 0.00 0.00 12 A 8.43 3.94 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 13 D 7.99 4.29 0.00 2.66 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 14 V 7.43 3.47 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.87 0.00 0.00 15 K 8.23 3.86 0.00 1.90 1.77 0.00 1.70 0.00 0.00 1.50 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.62 7.81 16 K 7.98 3.94 0.00 1.89 1.98 0.00 1.57 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.46 1.57 7.81 17 D 8.09 4.55 0.00 2.78 2.59 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 18 L 7.93 3.74 0.00 1.63 1.24 0.53 -0.68 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 19 R 8.12 4.03 0.00 2.03 2.04 0.00 3.13 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 20 D 8.54 4.49 0.00 2.98 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 21 S 8.32 3.01 0.00 3.33 3.30 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 22 W 8.65 4.26 0.00 3.76 3.36 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 23 K 7.92 3.97 0.00 2.02 2.03 0.00 1.88 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.48 7.81 24 V 7.00 3.92 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 1.06 0.00 0.00 1.11 0.00 0.00 25 I 7.61 3.41 1.61 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.67 0.65 0.00 0.00 26 G 6.88 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 0.00 0.00 0.00 27 S 7.26 4.17 0.00 3.90 4.01 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 0.00 0.00 0.00 28 D 7.22 4.63 0.00 2.72 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 0.00 0.00 0.00 0.00 29 K 8.02 3.91 0.00 1.74 1.70 0.00 1.28 0.00 0.00 0.72 0.00 0.00 2.27 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.23 1.38 7.81 30 K 7.95 4.00 0.00 1.82 1.78 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.50 7.81 31 G 8.22 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 32 N 8.43 4.51 0.00 2.69 2.74 0.00 0.00 6.99 8.44 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 33 G 8.16 3.50 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 0.00 0.00 0.00 34 V 7.88 3.64 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 1.11 0.00 0.00 0.97 0.00 0.00 35 A 7.95 3.94 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 36 L 8.11 3.83 0.00 1.94 1.70 0.82 1.11 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 37 F 8.28 4.06 0.00 2.96 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 38 T 8.11 3.66 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 1.25 0.00 0.00 39 T 7.71 3.88 4.33 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 1.21 0.00 0.00 40 L 7.54 3.86 0.00 1.64 1.45 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.50 4.47 0.00 3.00 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 42 A 7.85 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 43 D 8.22 4.67 0.00 2.66 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 8.32 5.10 0.00 2.96 2.91 0.00 0.00 6.59 7.87 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 45 Q 8.63 4.23 0.00 2.24 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.88 0.00 0.00 0.00 0.00 0.00 2.43 2.29 0.00 46 E 8.30 4.04 0.00 2.20 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.39 0.00 47 T 8.28 4.48 4.69 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 1.44 0.00 0.00 48 I 8.03 3.71 1.76 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.20 0.13 0.65 0.00 0.00 49 G 7.79 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 0.00 0.00 0.00 50 Y 7.69 4.33 0.00 2.60 2.46 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 51 F 8.13 5.06 0.00 3.20 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 52 K 8.49 3.88 0.00 1.78 1.83 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.45 7.81 53 R 8.09 4.00 0.00 1.86 2.05 0.00 3.32 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 54 L 8.00 4.27 0.00 2.00 1.88 1.16 0.85 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 55 G 7.89 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.42 4.59 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 57 V 8.02 3.96 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 1.01 0.00 0.00 0.70 0.00 0.00 58 S 7.95 4.37 0.00 4.06 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 59 Q 8.22 4.15 0.00 2.30 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.88 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 60 G 8.51 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 M 9.11 3.90 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.63 0.00 62 A 7.54 4.02 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 63 N 8.33 4.57 0.00 2.86 2.96 0.00 0.00 7.01 8.11 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 64 D 8.77 4.40 0.00 2.75 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 65 K 8.03 4.03 0.00 1.86 1.93 0.00 1.72 0.00 0.00 1.85 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.57 1.53 7.81 66 L 7.93 4.06 0.00 1.87 1.94 1.16 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.52 3.98 0.00 2.17 2.06 0.00 3.16 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 68 G 8.47 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 69 H 8.35 4.12 0.00 3.22 3.24 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 S 7.88 3.81 0.00 3.93 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 I 7.85 3.89 1.91 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 1.55 1.40 1.11 0.00 0.00 72 T 7.83 4.04 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 1.24 0.00 0.00 73 L 8.01 3.97 0.00 1.57 1.73 0.87 0.88 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 74 M 7.92 4.25 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.89 0.00 75 Y 7.98 4.12 0.00 3.21 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 76 A 7.77 3.75 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 77 L 7.44 3.48 0.00 1.53 1.12 0.98 1.12 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 78 Q 7.72 3.52 0.00 2.41 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.78 0.00 0.00 0.00 0.00 0.00 2.51 2.63 0.00 79 N 7.56 4.21 0.00 2.82 2.71 0.00 0.00 7.30 7.15 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 80 F 7.56 4.52 0.00 2.96 2.72 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 81 I 7.60 3.50 1.52 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.07 0.80 0.00 0.00 82 D 8.06 4.42 0.00 2.79 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 7.57 4.43 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.63 2.55 0.00 84 L 7.39 3.93 0.00 1.49 1.67 0.75 0.86 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 85 D 7.86 4.51 0.00 2.65 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 86 N 8.07 4.80 0.00 2.71 2.65 0.00 0.00 7.10 7.85 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 87 P 0.00 4.18 0.00 2.31 2.17 0.00 3.68 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 88 D 8.16 4.56 0.00 2.91 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 89 D 8.21 4.37 0.00 2.78 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 90 L 8.03 3.84 0.00 1.84 1.67 0.71 0.68 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 91 V 7.77 3.30 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 0.57 0.00 0.00 0.00 0.00 0.00 92 C 7.75 4.13 0.00 3.14 3.16 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 0.00 0.00 0.00 93 V 7.81 3.74 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 1.26 0.00 0.00 1.01 0.00 0.00 94 V 7.86 3.49 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 0.73 0.00 0.00 0.32 0.00 0.00 95 E 8.34 4.00 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 2.27 2.43 0.00 96 K 7.85 4.00 0.00 1.85 2.17 0.00 1.72 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.58 7.81 97 F 8.66 4.29 0.00 3.40 3.42 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 98 A 8.42 3.72 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 99 V 7.38 3.47 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 1.00 0.00 0.00 1.03 0.00 0.00 100 N 7.96 4.35 0.00 2.59 2.71 0.00 0.00 7.00 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 H 7.51 4.15 0.00 3.25 3.31 0.00 5.81 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 0.00 102 I 8.21 3.74 2.01 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.72 0.90 0.00 0.00 103 T 7.66 3.87 4.36 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 1.20 0.00 0.00 104 R 7.51 4.20 0.00 1.85 1.96 0.00 3.13 0.00 0.00 3.11 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.82 0.00 105 K 7.98 3.78 0.00 2.01 1.98 0.00 1.87 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.57 7.81 106 I 7.54 4.16 2.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.38 0.98 0.00 0.00 107 S 8.44 4.48 0.00 4.10 4.06 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 0.00 108 A 8.52 4.01 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 0.00 109 A 7.94 4.02 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 0.00 110 E 8.25 4.10 0.00 2.23 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 2.34 2.39 0.00 111 F 8.73 4.18 0.00 3.33 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 0.00 112 G 8.47 3.89 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 0.00 0.00 0.00 113 K 7.82 4.22 0.00 1.90 1.91 0.00 1.95 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.52 1.71 7.81 114 I 7.60 3.87 1.57 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.13 0.75 0.00 0.00 115 N 8.16 4.46 0.00 3.00 2.89 0.00 0.00 6.72 7.61 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 0.00 116 G 8.02 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 0.00 117 P 0.00 4.25 0.00 2.21 2.18 0.00 3.67 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 2.06 2.14 0.00 118 I 7.75 3.55 1.97 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.72 0.58 0.00 0.00 119 K 8.17 3.92 0.00 1.93 2.00 0.00 1.67 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 1.47 1.54 7.81 120 K 8.09 4.01 0.00 1.97 1.82 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.58 7.81 121 V 7.90 3.56 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.92 0.00 0.00 122 L 8.14 3.85 0.00 1.92 1.95 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 123 A 8.23 4.15 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 0.00 124 S 7.96 4.23 0.00 4.03 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 K 7.10 4.39 0.00 2.04 1.95 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.62 7.81 126 N 7.96 4.15 0.00 2.58 2.76 0.00 0.00 6.80 7.01 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 0.00 127 F 8.20 4.48 0.00 3.10 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 0.00 128 G 8.66 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 0.00 129 D 8.90 4.51 0.00 2.74 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 K 8.23 3.79 0.00 1.77 1.70 0.00 1.60 0.00 0.00 1.40 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.22 1.39 7.81 131 Y 8.19 4.17 0.00 3.46 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 0.00 132 A 8.18 4.25 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.79 4.38 0.00 2.89 2.89 0.00 0.00 6.89 6.90 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 0.00 134 A 7.74 3.95 1.28 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 0.00 0.00 135 W 8.51 3.90 0.00 3.62 3.35 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 0.00 136 A 8.28 4.12 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 0.00 137 K 7.62 3.99 0.00 1.82 1.82 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.65 7.81 138 L 7.58 3.92 0.00 1.38 1.68 0.62 0.88 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 0.00 139 V 8.16 3.74 2.34 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 1.27 0.00 0.00 1.20 0.00 0.00 140 A 7.99 4.50 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 0.00 141 V 7.26 3.40 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 0.57 0.00 0.00 0.79 0.00 0.00 142 V 7.43 3.46 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 0.47 0.00 0.00 0.47 0.00 0.00 143 Q 8.30 3.87 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.65 2.73 0.00 144 A 7.85 4.05 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 0.00 145 A 7.72 4.32 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 7.41 4.16 0.00 1.63 1.55 0.65 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00