NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4366 8.3044 120.3159 55.6311 33.4121 174.0992 2 M 4.1627 7.9118 119.1254 53.5058 35.8975 174.2971 3 F 4.9223 8.0530 122.1873 57.3171 39.0736 176.5945 4 G 4.0627 7.7211 104.1289 45.5839 0.0000 172.8249 5 R 4.8922 7.9979 118.6438 54.3246 33.8555 173.5790 6 F 5.4091 8.9854 123.8212 55.4919 42.1555 175.3041 7 T 3.8334 8.6693 112.3341 61.4213 69.7083 175.0011 8 E 3.9440 8.7550 122.3973 59.4803 29.1687 179.1708 9 R 3.9178 7.9417 117.5561 59.1170 30.1841 178.7316 10 A 4.1242 8.1375 120.6046 55.2783 18.4309 179.6017 11 Q 3.9658 8.5728 117.0365 58.9879 28.6399 179.1839 12 K 3.9322 8.0908 120.5827 59.6386 32.2074 179.3452 13 V 3.6388 7.5713 112.2369 64.4170 30.9745 178.5960 14 L 4.0301 8.0956 118.6228 57.4674 41.5433 179.3518 15 A 4.0242 8.3058 121.2115 55.1053 18.2532 179.7133 16 L 3.9669 8.3248 117.6100 57.7304 41.6142 179.4986 17 A 4.1055 8.2531 121.0649 55.0744 18.2280 179.5462 18 Q 3.7677 7.7659 117.5702 59.2729 29.1064 177.9434 19 E 3.9184 8.0414 120.1217 59.3461 29.5966 178.7024 20 E 3.9294 8.6345 118.8801 59.0729 29.5153 178.9403 21 A 3.8358 8.0438 120.9225 55.3924 18.2450 179.8317 22 L 4.1065 8.0248 117.2156 57.5459 41.3677 179.7914 23 R 3.9025 7.9868 118.4827 59.4362 30.4504 178.3534 24 L 4.1957 8.2214 118.1792 55.2633 41.8755 177.1145 25 G 4.0130 7.9792 107.1968 45.0211 0.0000 172.5571 26 H 5.0696 8.5442 115.6522 53.3386 31.4793 174.7119 27 N 5.0411 8.5877 119.4691 53.0744 39.6234 174.0075 28 N 5.1264 7.9138 114.3649 51.5519 40.9256 173.5002 29 I 3.9811 8.5789 122.6535 60.0571 39.0736 175.8620 30 G 4.3847 8.6264 115.3017 44.7809 0.0000 173.8429 31 T 4.0178 8.6605 109.7585 64.7905 68.2353 175.6376 32 E 3.8706 8.2450 119.9739 59.9629 29.1886 179.0356 33 H 4.1790 7.9121 116.7574 58.0045 28.8305 177.8028 34 I 3.7357 7.7317 121.7781 64.2024 37.0330 178.1688 35 L 3.9634 8.1862 121.5071 58.0938 41.9172 178.8205 36 L 4.0886 8.3066 120.7340 57.9748 42.0595 179.1511 37 G 3.6295 8.5189 106.2641 47.5301 0.0000 175.5435 38 L 4.0019 8.0523 121.2500 58.0460 41.5386 180.2337 39 V 3.6975 7.4515 110.1587 64.3128 31.5234 178.6729 40 R 4.0687 7.8740 117.0183 58.4039 29.9477 178.4490 41 E 4.0605 8.0211 119.4040 59.0622 29.6442 179.0254 42 G 4.0062 8.2034 104.9489 45.5050 0.0000 173.6236 43 E 4.4116 7.9335 118.8790 56.8007 31.3956 177.1523 44 G 3.9052 8.4834 105.6091 44.9465 0.0000 174.0698 45 I 3.6733 8.4813 123.1055 64.2957 37.1082 178.6690 46 A 3.9412 7.8622 121.0406 55.1886 18.2875 179.5772 47 A 3.9311 7.9423 118.8534 55.1690 18.4641 179.5839 48 K 3.8923 8.4321 118.2429 59.5154 32.2176 178.9763 49 A 3.9839 8.3487 121.4611 54.9415 18.3900 179.5620 50 L 3.9199 8.0908 117.5944 58.2485 41.7731 179.9018 51 Q 4.3092 8.5169 118.9677 58.3127 28.3634 178.6325 52 A 4.0918 8.0416 121.3220 54.8530 18.4350 178.8251 53 L 4.3203 7.6568 114.6863 55.0523 41.6346 178.0410 54 G 3.8867 7.9577 107.3649 45.3503 0.0000 174.1052 55 L 4.3641 7.6679 120.4498 54.5207 43.3327 175.6359 56 G 4.0014 7.9145 102.7456 43.2282 0.0000 174.4785 57 S 4.1631 8.4474 117.9754 61.5091 62.8745 177.0389 58 E 3.9758 8.1211 119.7554 59.1241 29.4979 179.3221 59 K 3.9449 7.9242 118.9822 59.4255 32.2101 179.2666 60 I 3.7131 7.6643 120.0239 64.3003 36.9528 178.2854 61 Q 3.9265 8.2381 120.5112 59.2651 28.9313 178.5719 62 K 3.9747 8.2235 119.5351 59.4839 31.8196 179.3013 63 E 4.0081 7.9344 117.9222 59.0631 29.6523 179.1824 64 V 3.6853 8.0585 118.6789 66.3009 31.6750 178.1248 65 E 4.0226 8.4257 118.2633 59.3311 29.0492 179.5106 66 S 4.2376 8.0583 114.3645 60.7392 62.8719 175.7669 67 L 4.3733 7.6455 121.0567 55.8583 42.1337 177.8807 68 I 4.3253 7.6921 110.0468 60.4182 39.1943 176.8765 69 G 3.9513 8.1802 109.8488 44.8578 0.0000 172.3661 70 R 4.7956 7.9556 116.0238 55.4455 34.5132 174.4761 71 G 3.6783 8.7083 104.9530 46.9267 0.0000 173.8753 72 Q 4.5793 8.1704 109.3656 55.5503 29.4086 175.9356 73 E 4.3267 8.1114 119.1248 57.4169 30.3426 176.3784 74 M 4.7457 8.6077 121.6704 54.6532 34.3462 174.5698 75 S 3.7413 8.4552 111.8769 60.2393 60.9943 172.6279 76 Q 4.2336 8.1765 118.2595 55.3028 29.4741 174.0031 77 T 3.4202 7.6762 116.8451 63.2689 68.0708 171.3580 78 I 4.2611 7.9096 123.0063 61.7081 38.0977 175.2142 79 H 5.2370 8.5231 121.3190 54.3024 33.1714 172.0398 80 Y 4.8834 8.8044 118.5336 57.1368 39.0319 175.8620 81 T 4.1423 8.6916 114.2269 60.9262 70.1170 173.6169 82 P 4.2926 0.0000 0.0000 66.0095 31.1479 179.2188 83 R 4.0147 8.0058 116.1614 58.9536 30.0927 178.6952 84 A 4.0763 8.1879 120.7746 54.9792 18.4263 179.4891 85 K 3.8613 8.5953 118.6499 59.5543 32.2183 178.8175 86 K 3.9274 8.2423 119.8537 59.6502 32.0781 178.9246 87 V 3.7207 8.2221 118.7494 66.0474 30.9180 178.0565 88 I 3.9888 8.1332 119.7816 64.4717 36.8964 178.3038 89 E 4.0782 8.2897 119.4695 59.3416 29.2475 179.3748 90 L 4.0715 8.4966 119.8443 57.6784 41.6934 179.6250 91 S 4.2737 8.6235 114.8079 61.6510 62.8747 176.3133 92 M 3.9368 7.8690 121.1921 58.3168 31.8815 177.7246 93 D 4.3346 8.3388 118.4141 57.3365 41.3922 178.0856 94 E 3.9604 8.6077 119.3029 59.2403 29.4709 179.1662 95 A 3.5677 8.1021 120.8986 55.0700 18.4353 179.6895 96 R 4.1231 8.2088 117.2529 59.6230 29.9512 178.8584 97 K 4.0363 8.2290 117.7273 59.2337 32.1435 178.5587 98 L 4.3292 7.8897 116.9291 54.6529 41.8006 177.8212 99 G 3.8954 7.7619 106.8941 46.1336 0.0000 173.2472 100 H 3.9896 7.9675 118.0514 55.0015 29.1726 176.0283 101 S 2.7900 7.3761 117.8069 57.6511 62.9232 172.7544 102 Y 4.7791 6.1018 116.0512 56.4675 41.1866 174.0036 103 V 3.7730 8.4852 121.6162 61.9275 32.7491 176.1585 104 G 4.5047 8.8034 115.9231 45.3043 0.0000 174.2000 105 T 4.0651 8.6632 110.0872 64.6192 68.4952 175.7962 106 E 3.8575 8.2638 120.1329 60.0028 29.1926 179.0804 107 H 4.2368 7.9776 117.0512 57.8200 28.8008 177.6432 108 I 3.7966 7.9468 121.9073 64.4454 37.0355 178.1386 109 L 3.9853 7.9200 120.9448 58.2190 41.9692 178.8470 110 L 4.1327 8.1762 119.0792 57.7543 41.5089 179.8805 111 G 3.6449 8.4301 105.8172 47.7253 0.0000 175.7181 112 L 4.0633 8.0763 121.9729 57.5946 41.4764 179.7824 113 I 3.8654 7.6680 111.6322 63.8237 37.7012 177.9093 114 R 4.0120 7.9637 119.8463 58.8816 30.2759 177.8732 115 E 4.0746 8.3421 119.5390 58.9877 29.5890 179.0457 116 G 4.0787 7.7736 102.7187 45.7504 0.0000 173.4676 117 E 4.4868 8.0735 116.3573 55.3058 31.5689 176.2645 118 G 3.8854 8.8049 105.9009 44.1966 0.0000 174.4161 119 V 3.5868 8.2889 118.5793 65.6815 31.3849 177.6013 120 A 3.9530 8.0360 120.4163 55.2847 18.2592 179.4677 121 A 3.9719 7.9733 118.6230 55.4161 18.3991 179.9632 122 R 3.9044 7.8161 116.6903 59.1255 30.1345 179.3355 123 V 3.5606 8.1578 118.5248 65.9948 31.4997 178.0466 124 L 3.9673 7.8408 118.5869 58.0894 41.2867 179.4250 125 N 4.6277 8.2397 116.6123 55.5723 38.5365 176.8750 126 N 4.5339 8.2753 117.5776 55.2063 37.6859 177.0394 127 L 4.2417 7.8120 121.2574 57.1699 42.0157 176.3794 128 G 3.3401 7.4974 108.5305 44.8646 0.0000 173.9079 129 V 3.8411 7.5485 121.9846 62.6747 32.4699 174.8118 130 S 4.7398 8.1518 120.6312 55.5277 67.9973 174.9119 131 L 3.9255 8.4575 124.3505 58.9751 41.7253 179.1552 132 N 4.4440 8.1010 115.3143 55.7221 38.5970 177.6848 133 K 3.9534 7.9843 119.5499 59.3505 32.2593 179.0058 134 A 3.9705 8.1258 121.0643 55.1495 18.2704 179.6751 135 R 3.8539 8.0409 116.5168 59.7679 30.3424 179.3323 136 Q 4.0235 8.1191 117.4897 59.1131 28.6094 179.0556 137 Q 4.0019 8.0710 119.0425 58.7899 28.8162 178.8789 138 V 3.5561 7.9857 119.4249 66.0858 31.4298 178.2144 139 L 4.0653 8.1167 117.6267 57.3065 41.5668 179.3786 140 Q 4.1230 7.9659 118.1181 58.8445 28.5309 178.1496 141 L 4.0303 8.2680 121.3383 57.2426 41.9059 178.2888 142 L 4.0305 7.8706 118.6413 56.6857 40.4502 178.2274 143 G 5.0247 6.3790 121.9423 46.8697 0.0000 173.0553 144 S 4.5704 7.7790 115.5918 58.2925 63.8355 173.7830 145 N 4.4880 8.0306 123.9646 53.7538 38.7335 174.3140 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 4.44 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 2 M 7.91 4.16 0.00 1.88 1.71 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 3 F 8.05 4.92 0.00 3.02 2.84 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 4 G 7.72 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 0.00 0.00 0.00 5 R 8.00 4.89 0.00 1.98 1.87 0.00 3.22 0.00 0.00 3.44 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 6 F 8.99 5.41 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 7 T 8.67 3.83 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 8 E 8.76 3.94 0.00 2.01 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 0.00 2.37 2.39 0.00 9 R 7.94 3.92 0.00 1.87 1.98 0.00 3.33 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 10 A 8.14 4.12 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.57 3.97 0.00 2.30 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.58 0.00 12 K 8.09 3.93 0.00 1.96 1.99 0.00 1.64 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.48 7.81 13 V 7.57 3.64 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 0.89 0.00 0.00 1.05 0.00 0.00 14 L 8.10 4.03 0.00 1.82 1.74 0.51 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.31 4.02 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 16 L 8.32 3.97 0.00 1.89 1.73 0.94 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.25 4.11 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 7.77 3.77 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 19 E 8.04 3.92 0.00 2.10 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 2.29 2.34 0.00 20 E 8.63 3.93 0.00 2.05 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 2.44 2.46 0.00 21 A 8.04 3.84 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 22 L 8.02 4.11 0.00 1.81 1.71 0.89 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 23 R 7.99 3.90 0.00 1.87 2.10 0.00 3.26 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 24 L 8.22 4.20 0.00 2.00 1.71 1.02 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.98 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 0.00 0.00 0.00 26 H 8.54 5.07 0.00 2.98 3.14 0.00 5.67 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.59 5.04 0.00 2.70 2.93 0.00 0.00 6.60 7.44 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 28 N 7.91 5.13 0.00 2.64 2.72 0.00 0.00 6.16 7.97 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 29 I 8.58 3.98 0.87 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 1.04 0.37 0.53 0.00 0.00 30 G 8.63 4.38 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 0.00 31 T 8.66 4.02 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 1.24 0.00 0.00 32 E 8.24 3.87 0.00 2.01 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.17 0.00 33 H 7.91 4.18 0.00 3.30 3.46 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 34 I 7.73 3.74 2.04 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.91 0.98 0.00 0.00 35 L 8.19 3.96 0.00 1.75 1.80 0.93 0.87 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 36 L 8.31 4.09 0.00 1.84 1.80 0.93 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 37 G 8.52 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.05 4.00 0.00 2.01 1.75 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.45 3.70 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 0.82 0.00 0.00 1.03 0.00 0.00 40 R 7.87 4.07 0.00 2.01 1.99 0.00 3.32 0.00 0.00 3.14 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 41 E 8.02 4.06 0.00 2.18 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 42 G 8.20 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 0.00 0.00 0.00 43 E 7.93 4.41 0.00 1.88 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 2.22 2.36 0.00 44 G 8.48 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 45 I 8.48 3.67 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.04 0.91 0.00 0.00 46 A 7.86 3.94 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 A 7.94 3.93 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 48 K 8.43 3.89 0.00 1.93 1.95 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.44 1.46 7.81 49 A 8.35 3.98 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 50 L 8.09 3.92 0.00 1.87 1.73 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 51 Q 8.52 4.31 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 52 A 8.04 4.09 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 53 L 7.66 4.32 0.00 1.81 1.71 0.97 1.03 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 54 G 7.96 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 55 L 7.67 4.36 0.00 1.88 1.64 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 56 G 7.91 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 0.00 0.00 0.00 57 S 8.45 4.16 0.00 3.87 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 58 E 8.12 3.98 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 59 K 7.92 3.94 0.00 1.94 1.89 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.52 1.52 7.81 60 I 7.66 3.71 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.72 0.90 0.00 0.00 61 Q 8.24 3.93 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 62 K 8.22 3.97 0.00 1.95 1.84 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.55 7.81 63 E 7.93 4.01 0.00 2.04 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 0.00 2.46 2.53 0.00 64 V 8.06 3.69 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 1.02 0.00 0.00 0.94 0.00 0.00 65 E 8.43 4.02 0.00 2.11 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 2.30 2.44 0.00 66 S 8.06 4.24 0.00 3.87 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 67 L 7.65 4.37 0.00 1.76 1.70 0.94 0.82 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 68 I 7.69 4.33 1.91 0.00 0.00 0.64 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 0.59 0.93 0.00 0.00 69 G 8.18 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 7.96 4.80 0.00 1.77 1.88 0.00 3.28 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 71 G 8.71 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 0.00 0.00 0.00 0.00 72 Q 8.17 4.58 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.70 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 73 E 8.11 4.33 0.00 2.18 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 2.37 2.34 0.00 74 M 8.61 4.75 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.49 0.00 75 S 8.46 3.74 0.00 4.01 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 76 Q 8.18 4.23 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.36 6.22 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 77 T 7.68 3.42 4.18 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 1.17 0.00 0.00 78 I 7.91 4.26 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.20 0.79 0.00 0.00 79 H 8.52 5.24 0.00 3.06 3.15 0.00 5.62 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Y 8.80 4.88 0.00 2.80 2.93 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 81 T 8.69 4.14 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 82 P 0.00 4.29 0.00 2.20 2.18 0.00 3.62 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 83 R 8.01 4.01 0.00 1.89 2.00 0.00 3.15 0.00 0.00 3.46 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.72 0.00 84 A 8.19 4.08 1.51 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 85 K 8.60 3.86 0.00 1.95 2.03 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.43 7.81 86 K 8.24 3.93 0.00 2.08 1.97 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.48 7.81 87 V 8.22 3.72 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 1.21 0.00 0.00 1.10 0.00 0.00 88 I 8.13 3.99 2.03 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 1.83 0.84 0.97 0.00 0.00 89 E 8.29 4.08 0.00 2.22 2.02 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 2.35 2.52 0.00 90 L 8.50 4.07 0.00 1.70 1.74 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 91 S 8.62 4.27 0.00 4.06 4.25 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 92 M 7.87 3.94 0.00 2.29 2.24 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.58 0.00 93 D 8.34 4.33 0.00 2.84 2.82 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 94 E 8.61 3.96 0.00 2.20 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 2.53 2.50 0.00 95 A 8.10 3.57 1.19 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 0.00 0.00 96 R 8.21 4.12 0.00 2.08 2.13 0.00 3.03 0.00 0.00 2.96 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 97 K 8.23 4.04 0.00 1.98 1.87 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.60 7.81 98 L 7.89 4.33 0.00 1.76 1.72 0.98 0.98 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 99 G 7.76 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 0.00 100 H 7.97 3.99 0.00 3.04 2.99 0.00 5.63 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 S 7.38 2.79 0.00 3.51 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 0.00 102 Y 6.10 4.78 0.00 2.94 2.90 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 0.00 103 V 8.49 3.77 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 0.70 0.00 0.00 0.38 0.00 0.00 104 G 8.80 4.50 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 0.00 105 T 8.66 4.07 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 1.27 0.00 0.00 106 E 8.26 3.86 0.00 2.02 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 0.00 2.15 2.13 0.00 107 H 7.98 4.24 0.00 3.36 3.55 0.00 5.83 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 0.00 108 I 7.95 3.80 2.15 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.18 1.01 0.00 0.00 109 L 7.92 3.99 0.00 1.79 1.82 0.93 0.72 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 0.00 110 L 8.18 4.13 0.00 1.91 1.85 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 111 G 8.43 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.08 4.06 0.00 1.91 1.75 0.95 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 113 I 7.67 3.87 1.88 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 1.48 0.78 0.92 0.00 0.00 114 R 7.96 4.01 0.00 1.94 2.23 0.00 3.33 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 115 E 8.34 4.07 0.00 2.26 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 2.34 2.51 0.00 116 G 7.77 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 0.00 0.00 0.00 117 E 8.07 4.49 0.00 1.98 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 2.21 2.22 0.00 118 G 8.80 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 0.00 119 V 8.29 3.59 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 1.04 0.00 0.00 0.94 0.00 0.00 120 A 8.04 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 0.00 121 A 7.97 3.97 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 0.00 122 R 7.82 3.90 0.00 1.96 1.98 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 123 V 8.16 3.56 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.97 0.00 0.00 124 L 7.84 3.97 0.00 1.90 1.70 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 125 N 8.24 4.63 0.00 2.81 2.88 0.00 0.00 7.30 8.06 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 0.00 126 N 8.28 4.53 0.00 2.87 3.04 0.00 0.00 7.05 8.47 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 0.00 127 L 7.81 4.24 0.00 1.86 1.76 0.94 0.94 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 0.00 128 G 7.50 3.34 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 0.00 129 V 7.55 3.84 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 0.98 0.00 0.00 0.93 0.00 0.00 130 S 8.15 4.74 0.00 3.85 3.69 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 0.00 131 L 8.46 3.93 0.00 1.71 1.69 0.93 0.58 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 0.00 132 N 8.10 4.44 0.00 2.77 2.84 0.00 0.00 7.09 7.38 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 0.00 133 K 7.98 3.95 0.00 1.92 1.85 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.50 7.81 134 A 8.13 3.97 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 0.00 135 R 8.04 3.85 0.00 1.94 2.00 0.00 3.14 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 136 Q 8.12 4.02 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 137 Q 8.07 4.00 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 138 V 7.99 3.56 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 1.12 0.00 0.00 0.96 0.00 0.00 139 L 8.12 4.07 0.00 1.69 1.71 0.92 0.82 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 0.00 140 Q 7.97 4.12 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 141 L 8.27 4.03 0.00 1.81 1.71 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 142 L 7.87 4.03 0.00 1.83 1.80 0.93 0.59 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 0.00 143 G 6.38 5.02 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 0.00 0.00 0.00 144 S 7.78 4.57 0.00 3.85 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 0.00 145 N 8.03 4.49 0.00 2.66 2.69 0.00 0.00 6.90 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