NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3553 8.0333 117.3307 63.4194 70.6858 172.6495 2 E 4.5642 8.7975 125.7542 55.1416 29.7778 174.8804 3 L 4.5691 8.6791 126.1096 54.3377 43.8416 176.1146 4 T 4.6188 8.0749 109.8527 60.0965 71.3019 175.6838 5 K 3.3324 8.8267 122.5779 59.8793 32.1062 179.5480 6 C 4.3826 7.9685 117.5465 59.2892 39.9171 175.9836 7 K 3.8865 8.0856 120.1239 59.3224 31.6146 179.4571 8 V 3.4231 7.6892 118.7565 66.0679 31.5308 178.2168 9 S 4.0876 8.0768 114.0119 61.6371 62.5476 175.9969 10 H 4.1816 8.3154 121.5630 59.0316 29.4613 177.1078 11 A 3.9986 8.1230 121.8880 54.4349 18.4089 178.6090 12 I 4.1319 7.6948 109.3427 60.6637 37.8743 177.6095 13 K 3.8786 7.6294 122.3568 60.2836 32.0236 177.9828 14 D 4.5771 7.9201 115.6148 55.6437 41.2663 176.5313 15 I 3.9297 7.9926 119.6564 60.9850 38.6345 174.7477 16 D 4.6652 7.6925 120.9904 56.7037 41.5403 176.0383 17 G 4.1106 9.7180 115.2147 45.7222 0.0000 173.3115 18 Y 4.0257 7.9299 117.0280 59.7526 38.2676 176.3875 19 Q 3.2807 9.7962 122.7428 56.8069 27.7232 173.7900 20 G 3.9038 8.5498 102.0714 45.7227 0.0000 173.6178 21 I 4.3519 7.7256 121.3826 59.5899 38.4976 176.2041 22 S 5.3604 9.0032 122.6751 56.6542 65.7346 175.3557 23 L 4.2431 8.5295 121.1225 57.7316 41.2308 179.8262 24 L 4.1263 7.9412 118.7517 57.9164 41.7154 179.1123 25 E 3.8944 7.9859 118.5809 59.1648 29.3710 179.5507 26 W 4.0521 8.2330 118.7774 59.6090 29.0912 178.3746 27 A 4.1596 8.4462 121.1579 55.2483 17.7070 178.9155 28 C 2.0000 7.5550 116.7517 58.8598 43.1096 175.7460 29 V 3.5077 7.9036 120.0378 66.2795 31.0539 178.0751 30 L 4.0776 8.5742 118.7782 57.4007 41.3357 179.2221 31 F 3.1034 8.1075 120.8697 61.4410 39.1127 176.9531 32 H 4.2138 7.7382 113.6896 58.4236 28.5433 177.7345 33 T 4.2518 7.6461 117.5909 65.7187 68.5507 175.6028 34 S 4.4655 7.8579 111.4098 56.5921 64.4172 174.5883 35 G 3.0107 8.2966 108.6701 46.5710 0.0000 173.8139 36 Y 3.6992 7.7508 113.5551 58.4286 35.5348 168.9000 37 D 5.0178 7.8446 121.3946 53.1303 40.6178 177.2202 38 T 4.0557 8.8275 118.8002 63.8535 68.8107 175.6127 39 Q 4.6067 8.6495 120.2504 55.3859 29.3188 175.2854 40 A 4.1452 7.9354 121.8319 52.2878 19.5584 177.5624 41 V 4.4842 8.2019 121.0280 61.1130 34.3995 174.6938 42 V 4.4101 8.3403 127.5548 61.0431 34.7131 174.0806 43 N 4.9122 8.7413 125.1670 53.0687 39.6245 175.0996 44 D 4.3779 9.1523 122.5884 53.3179 42.4300 173.9513 45 N 4.2344 9.3991 125.5848 53.8416 35.5857 175.3923 46 G 4.0258 8.2624 104.9025 45.2005 0.0000 171.9317 47 S 4.7589 7.5279 113.4529 56.4549 66.0901 172.6709 48 T 5.0100 8.9489 116.2074 61.8395 72.2943 173.1015 49 E 5.2677 9.0080 125.2889 54.8981 32.5441 174.4801 50 Y 4.9671 9.1682 121.3967 57.3400 41.4398 177.6950 51 G 4.3610 9.0438 112.8230 44.3908 0.0000 173.0909 52 L 3.9628 8.8097 118.9699 57.5030 41.7451 179.0989 53 F 4.6093 8.4346 113.2162 57.5435 39.9069 175.1093 54 Q 3.6352 8.0714 119.2918 57.0629 26.5660 174.1538 55 I 4.1056 8.0146 118.9592 61.2071 38.8901 177.3404 56 S 5.1816 8.9844 121.9945 57.8852 63.5502 174.0241 57 D 4.9196 8.9498 125.0525 53.6680 39.3855 177.4238 58 R 2.6804 8.1096 121.5435 58.4405 30.4042 178.0000 59 F 4.7932 7.5344 112.9025 57.6957 42.3047 176.7086 60 W 4.4100 8.0412 120.4464 58.3492 29.1657 173.4810 61 C 5.4250 7.9320 110.8255 53.3306 46.5083 172.6569 62 K 4.8940 9.0292 121.7134 55.0506 33.5874 175.4619 63 S 5.0421 8.4235 120.8607 56.1610 66.2858 175.0423 64 S 4.0735 8.7514 114.4674 61.3464 62.3412 175.1918 65 E 4.1950 7.6807 117.0219 58.2538 29.7420 176.7664 66 F 4.5456 7.8368 121.3123 54.5575 39.1776 172.9510 67 P 4.1758 0.0000 0.0000 65.2877 31.4747 177.4178 68 E 4.2234 7.5763 111.4345 56.4094 29.6363 176.5377 69 S 4.8276 7.8711 114.6344 58.3065 62.7671 174.3087 70 E 3.9747 8.9058 126.3495 57.3320 30.2562 176.0531 71 N 4.1378 8.2111 117.8434 54.3436 37.7975 175.0906 72 I 3.7013 8.1386 120.1707 64.8277 37.7455 177.7031 73 C 4.4410 8.7280 116.3473 57.2969 40.4668 173.4371 74 G 3.8443 8.0327 107.7177 45.9767 0.0000 173.4713 75 I 4.5675 7.1296 116.5494 58.7612 41.6565 173.4576 76 S 4.6298 8.4457 120.5372 58.0328 63.1072 175.8358 77 C 3.9649 8.7391 125.0998 60.0528 40.1414 176.2094 78 D 4.1890 7.7210 120.3601 56.7324 40.1306 178.3741 79 K 4.1918 7.9832 118.1210 58.0950 32.1583 177.9660 80 L 4.8172 7.7574 120.1139 53.7237 41.6220 177.1015 81 L 5.0458 7.9501 117.6108 53.5970 42.0097 175.5779 82 D 4.9290 7.7522 119.0312 51.9057 41.6659 175.5490 83 D 4.5678 8.4831 116.8341 54.5819 40.9998 176.5793 84 E 4.3798 8.0466 120.2124 55.3300 29.1604 176.7181 85 L 4.5909 8.1900 125.4110 55.1466 42.0274 178.5948 86 D 4.2955 7.9624 119.9210 57.2178 40.7928 177.9978 87 D 4.3000 7.9958 119.2893 56.2352 39.5554 178.2202 88 D 4.2660 7.9983 119.9016 57.2714 40.8469 178.5942 89 I 3.0630 7.7797 120.1093 64.0485 36.9241 178.3195 90 A 3.7664 7.9349 121.7105 55.2170 18.1616 178.9301 91 C 4.1267 8.1719 116.8007 59.6128 43.7924 175.5576 92 A 3.7327 7.7008 122.7793 55.0399 17.7189 179.8037 93 K 3.7658 7.8838 117.0860 59.3445 32.0286 179.7788 94 K 4.0190 7.7025 119.0596 59.4194 31.8707 179.4631 95 I 2.9293 7.4676 120.0746 64.0657 36.7083 178.4674 96 L 4.1159 8.2758 119.8825 57.8516 41.2281 179.4999 97 A 4.1036 8.1056 119.9142 54.6515 18.3592 179.2358 98 I 4.0731 7.7337 117.4377 63.7396 37.8534 177.6622 99 K 4.3188 8.0424 118.4074 56.1911 33.0680 176.8233 100 G 4.1602 8.3125 104.5192 45.1226 0.0000 173.7356 101 I 3.8404 8.3388 117.6501 64.1936 37.7377 176.9003 102 D 4.7539 8.1088 116.8339 55.5316 40.6891 176.3967 103 Y 3.8370 7.9802 121.6583 59.9370 38.9823 175.9320 104 W 4.2705 8.6651 121.7048 55.2775 28.1724 177.0741 105 K 4.0213 8.4496 123.8956 58.8994 31.9852 178.8207 106 A 4.1348 8.1168 121.5011 54.7773 19.0065 178.6292 107 Y 4.1582 8.2379 117.6954 60.9595 38.9944 178.5301 108 K 3.6460 8.1950 118.7978 58.8348 32.4598 176.2574 109 P 4.3765 0.0000 0.0000 64.8912 31.5955 176.6597 110 M 4.5220 7.9333 116.6983 55.4780 33.3980 175.4793 111 C 5.0246 7.9986 116.1330 56.8389 41.2258 174.7962 112 S 4.1156 8.0456 114.7225 58.7195 63.0849 173.3847 113 E 4.5168 7.8747 116.7810 55.5510 32.3817 174.5709 114 K 3.8294 8.4268 115.9164 57.6414 29.3838 175.6898 115 L 4.7239 7.4855 117.9538 56.4702 43.2434 179.7932 116 E 4.0591 8.3613 118.7325 59.2503 29.5571 179.0090 117 Q 3.8433 8.0241 115.4138 58.6235 28.4681 177.0989 118 W 4.6578 7.8169 116.8971 56.6399 29.1349 175.9501 119 R 4.2064 7.8815 120.3774 55.5117 30.0993 175.1732 120 C 4.4810 8.7257 125.5530 56.4517 43.8998 173.1021 121 E 3.8634 8.8368 127.5892 58.9360 29.3503 175.4529 122 K 3.8307 8.1285 118.4483 55.4768 31.6825 174.7079 123 P 4.4119 0.0000 0.0000 62.8292 31.1805 176.4914 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 T 8.03 4.36 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 1.23 0.00 0.00 2 E 8.80 4.56 0.00 1.98 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 2.31 2.43 0.00 3 L 8.68 4.57 0.00 1.50 1.55 0.89 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.07 4.62 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 1.25 0.00 0.00 5 K 8.83 3.33 0.00 2.18 1.96 0.00 2.06 0.00 0.00 2.11 0.00 0.00 3.00 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.60 1.77 7.81 6 C 7.97 4.38 0.00 3.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.09 3.89 0.00 1.88 1.82 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.43 7.81 8 V 7.69 3.42 1.70 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 0.81 0.00 0.00 0.37 0.00 0.00 9 S 8.08 4.09 0.00 4.10 4.12 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 10 H 8.32 4.18 0.00 3.29 3.47 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 11 A 8.12 4.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 I 7.69 4.13 1.70 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.16 0.83 0.00 0.00 13 K 7.63 3.88 0.00 1.70 1.91 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.63 1.51 7.81 14 D 7.92 4.58 0.00 2.61 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 15 I 7.99 3.93 1.55 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.96 0.56 0.00 0.00 16 D 7.69 4.67 0.00 2.88 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 17 G 9.72 4.11 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 0.00 0.00 0.00 18 Y 7.93 4.03 0.00 3.36 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 19 Q 9.80 3.28 0.00 2.28 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.36 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 20 G 8.55 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 21 I 7.73 4.35 1.81 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.47 0.11 0.00 0.00 22 S 9.00 5.36 0.00 4.07 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.53 4.24 0.00 1.79 1.84 0.95 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 24 L 7.94 4.13 0.00 1.77 2.03 1.04 1.10 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 25 E 7.99 3.89 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 26 W 8.23 4.05 0.00 3.35 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.45 4.16 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.55 2.00 0.00 1.23 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 29 V 7.90 3.51 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 0.92 0.00 0.00 0.77 0.00 0.00 30 L 8.57 4.08 0.00 1.88 1.72 0.35 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.11 3.10 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 32 H 7.74 4.21 0.00 3.14 3.37 0.00 5.90 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.65 4.25 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 1.49 0.00 0.00 34 S 7.86 4.47 0.00 3.94 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 0.00 35 G 8.30 3.01 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 36 Y 7.75 3.70 0.00 3.28 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 D 7.84 5.02 0.00 2.69 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 38 T 8.83 4.06 4.45 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 1.23 0.00 0.00 39 Q 8.65 4.61 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.85 0.00 0.00 0.00 0.00 0.00 2.54 2.38 0.00 40 A 7.94 4.15 1.26 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 0.00 0.00 0.00 41 V 8.20 4.48 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 0.54 0.00 0.00 0.90 0.00 0.00 42 V 8.34 4.41 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 0.97 0.00 0.00 0.93 0.00 0.00 43 N 8.74 4.91 0.00 2.62 2.70 0.00 0.00 6.75 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 44 D 9.15 4.38 0.00 2.50 2.42 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 45 N 9.40 4.23 0.00 2.88 2.83 0.00 0.00 7.29 7.65 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 46 G 8.26 4.03 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 0.00 0.00 0.00 47 S 7.53 4.76 0.00 3.76 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 48 T 8.95 5.01 4.47 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 0.75 0.00 0.00 49 E 9.01 5.27 0.00 2.01 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 2.30 2.24 0.00 50 Y 9.17 4.97 0.00 2.95 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 51 G 9.04 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 0.00 0.00 0.00 0.00 52 L 8.81 3.96 0.00 1.58 1.72 0.91 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 53 F 8.43 4.61 0.00 3.23 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 54 Q 8.07 3.64 0.00 2.41 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.84 0.00 0.00 0.00 0.00 0.00 2.55 2.69 0.00 55 I 8.01 4.11 2.01 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 0.98 0.80 0.96 0.00 0.00 56 S 8.98 5.18 0.00 4.13 4.12 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 57 D 8.95 4.92 0.00 2.75 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 58 R 8.11 2.68 0.00 1.00 1.04 0.00 2.42 0.00 0.00 2.49 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 59 F 7.53 4.79 0.00 1.87 2.15 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 60 W 8.04 4.41 0.00 3.51 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 61 C 7.93 5.43 0.00 3.09 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 62 K 9.03 4.89 0.00 1.89 1.69 0.00 1.57 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.35 1.37 7.81 63 S 8.42 5.04 0.00 3.94 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 64 S 8.75 4.07 0.00 3.87 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 65 E 7.68 4.19 0.00 2.17 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 0.00 2.42 2.35 0.00 66 F 7.84 4.55 0.00 2.95 3.01 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 67 P 0.00 4.18 0.00 1.91 2.05 0.00 3.37 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.04 0.00 68 E 7.58 4.22 0.00 2.02 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 0.00 2.22 2.15 0.00 69 S 7.87 4.83 0.00 4.32 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 70 E 8.91 3.97 0.00 2.04 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 71 N 8.21 4.14 0.00 2.88 2.75 0.00 0.00 7.03 7.57 0.00 0.00 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 I 8.14 3.70 1.74 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.50 1.00 0.00 0.00 73 C 8.73 4.44 0.00 3.17 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 74 G 8.03 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 75 I 7.13 4.57 1.86 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 1.27 1.15 0.90 0.00 0.00 76 S 8.45 4.63 0.00 3.86 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 77 C 8.74 3.96 0.00 2.14 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 78 D 7.72 4.19 0.00 2.62 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 79 K 7.98 4.19 0.00 1.88 2.05 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.60 7.81 80 L 7.76 4.82 0.00 1.94 1.80 0.97 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.95 5.05 0.00 1.83 1.74 1.17 0.95 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 82 D 7.75 4.93 0.00 2.76 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 83 D 8.48 4.57 0.00 2.68 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 84 E 8.05 4.38 0.00 2.11 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 85 L 8.19 4.59 0.00 1.73 1.72 0.97 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 86 D 7.96 4.30 0.00 2.68 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 87 D 8.00 4.30 0.00 2.91 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 88 D 8.00 4.27 0.00 2.96 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 89 I 7.78 3.06 1.83 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 1.31 0.66 0.59 0.00 0.00 90 A 7.93 3.77 1.26 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 0.00 0.00 0.00 91 C 8.17 4.13 0.00 3.00 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 92 A 7.70 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 K 7.88 3.77 0.00 1.71 1.61 0.00 1.23 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.71 1.17 7.81 94 K 7.70 4.02 0.00 1.96 2.01 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.61 7.81 95 I 7.47 2.93 1.66 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.25 -0.25 0.00 0.00 96 L 8.28 4.12 0.00 1.93 1.84 1.14 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.11 4.10 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 98 I 7.73 4.07 2.26 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.77 1.03 0.00 0.00 99 K 8.04 4.32 0.00 1.97 1.97 0.00 2.05 0.00 0.00 2.04 0.00 0.00 3.24 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.49 1.61 7.81 100 G 8.31 4.16 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 0.00 0.00 0.00 101 I 8.34 3.84 1.49 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.89 0.67 0.00 0.00 102 D 8.11 4.75 0.00 2.78 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 0.00 103 Y 7.98 3.84 0.00 2.62 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 0.00 0.00 0.00 104 W 8.67 4.27 0.00 3.70 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 0.00 105 K 8.45 4.02 0.00 1.71 1.86 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.28 7.81 106 A 8.12 4.13 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 0.00 107 Y 8.24 4.16 0.00 2.95 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 0.00 108 K 8.19 3.65 0.00 1.78 1.79 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.36 7.81 109 P 0.00 4.38 0.00 2.19 2.14 0.00 3.96 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 110 M 7.93 4.52 0.00 1.83 2.13 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.65 0.00 111 C 8.00 5.02 0.00 2.85 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 0.00 112 S 8.05 4.12 0.00 3.74 3.78 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 0.00 113 E 7.87 4.52 0.00 2.03 1.89 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 2.18 2.35 0.00 114 K 8.43 3.83 0.00 1.96 1.88 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.77 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.35 1.45 7.81 115 L 7.49 4.72 0.00 1.79 1.83 0.96 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.36 4.06 0.00 2.01 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 2.42 2.26 0.00 117 Q 8.02 3.84 0.00 1.78 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.25 0.00 0.00 0.00 0.00 0.00 2.22 1.31 0.00 118 W 7.82 4.66 0.00 3.55 3.31 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 0.00 119 R 7.88 4.21 0.00 1.84 2.10 0.00 3.48 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.60 0.00 120 C 8.73 4.48 0.00 3.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.84 3.86 0.00 1.99 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 2.30 2.26 0.00 122 K 8.13 3.83 0.00 1.74 1.84 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.44 7.81 123 P 0.00 4.41 0.00 2.03 2.01 0.00 3.70 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 2.04 2.20 0.00