NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5950 8.3493 120.3166 53.2250 40.0546 175.1662 3 R 4.1840 8.4270 116.4099 55.2616 31.0493 174.6435 4 A 4.5563 9.1283 122.6215 51.3223 20.4662 177.6594 5 E 5.2760 8.7890 121.2104 54.5118 33.8682 175.4765 6 V 4.4094 8.8608 122.5261 61.1944 34.3926 174.1588 7 R 4.8843 8.2923 127.7496 55.1348 32.7899 174.4414 8 N 4.2602 9.3812 123.0349 54.4535 36.4500 174.4475 9 I 4.3403 7.6580 119.5635 58.6454 37.7195 173.5830 10 P 4.5264 0.0000 0.0000 63.0060 32.0507 176.2256 11 F 5.0330 9.8440 128.4596 57.5181 40.0228 174.7691 12 K 5.0572 8.6740 125.5110 53.8289 35.4750 175.7525 13 L 2.9225 7.5483 123.6086 56.9968 41.9346 177.6287 14 G 3.7784 7.6174 114.3470 45.4330 0.0000 173.0117 15 M 4.6498 7.3458 118.7948 54.4934 33.7756 174.8841 16 Y 5.0997 8.5406 116.9460 56.2353 42.1615 174.2827 17 L 5.0343 8.9881 125.0633 53.5454 44.8253 174.9929 18 T 5.1773 9.0289 123.0391 61.8796 71.6834 173.4919 19 V 4.4522 8.8292 119.4262 59.3065 35.3859 175.0114 20 G 3.5621 7.0121 109.7899 44.6596 0.0000 172.5337 21 G 3.4553 6.6356 105.9308 45.5484 0.0000 171.7981 22 V 4.7842 7.6555 119.0156 60.8885 35.0969 176.1850 23 V 3.9011 8.7936 128.1286 62.4133 32.2945 175.2510 24 N 4.7340 8.6887 124.7918 53.2144 40.0488 174.9045 25 S 4.0334 8.5424 117.2316 59.3181 64.3046 174.3584 26 N 4.0839 8.8447 117.7352 53.9282 36.0143 174.5129 27 A 4.2216 7.1367 119.9167 53.0630 19.1861 178.4198 28 T 4.5390 9.2914 119.7505 65.1221 69.6995 175.0369 29 R 5.7438 8.0325 114.9339 56.8201 32.4580 172.8074 30 F 5.4214 7.9572 113.9338 55.7912 41.7239 172.9362 31 S 5.3722 9.1252 113.4761 55.6667 66.9528 172.5290 32 I 4.8161 7.9292 120.6631 59.6523 40.1369 174.3675 33 N 5.1177 8.7511 122.9390 51.2909 42.5128 173.4405 34 V 4.6464 8.0638 123.4067 60.7248 34.3005 173.0479 35 G 4.0406 8.5268 117.2083 47.3725 0.0000 175.4272 36 E 4.7278 9.5552 121.7459 57.0762 32.1438 175.4520 37 S 4.5857 7.4247 111.2672 57.6819 65.2160 175.6939 38 T 4.1017 8.4556 109.8682 63.7013 68.8665 174.5037 39 D 4.5900 7.7841 119.9559 53.8983 41.4317 175.2936 40 S 4.5227 8.0213 113.3025 57.4663 64.8520 171.9411 41 I 4.7011 8.5393 127.4244 59.2566 39.3321 176.4931 42 A 4.1299 8.6710 129.5433 54.2212 19.5564 176.8007 43 M 4.2047 7.9455 115.1883 54.1649 35.3950 173.6348 44 H 4.9609 8.9904 127.5701 54.4951 32.4920 172.6709 45 M 4.3833 8.4901 126.1391 53.8148 34.3115 173.3908 46 D 4.7372 8.6166 127.0468 52.7010 43.9116 174.8195 47 H 4.6352 8.4499 122.9930 54.1232 31.1027 173.5154 48 R 4.5445 8.5228 124.7626 54.7648 31.1041 177.4628 49 F 3.9688 9.2657 124.4520 59.7990 40.4108 176.5450 50 S 4.5585 7.9931 113.5014 57.7862 63.7465 173.2248 51 Y 4.5968 9.0899 131.1883 56.9270 41.2412 175.1075 52 G 3.5054 7.9388 119.1426 47.0315 0.0000 174.1776 53 A 4.2522 8.5223 127.4636 52.1350 19.1394 176.9870 54 D 4.6825 8.1491 117.9530 52.9326 41.9155 175.8125 55 Q 4.8552 7.8147 121.5084 54.2570 32.6647 174.9955 56 N 3.1400 8.4114 121.3428 53.7008 35.8911 174.1269 57 V 4.2901 6.7434 116.9516 59.7205 35.9847 176.2172 58 L 4.8254 8.7787 123.1284 53.5744 43.7341 175.6812 59 V 4.6566 8.2803 122.9518 60.9797 34.5203 174.0240 60 L 4.7879 8.4997 127.7852 53.2493 44.6091 175.1115 61 N 5.2048 7.9624 119.9721 53.2704 43.3452 172.6340 62 S 5.2998 8.8944 113.3648 56.3741 67.2204 172.6264 63 L 4.5587 8.5432 122.7057 53.1790 44.6896 175.0675 64 V 4.4659 8.3641 126.9891 61.1434 33.2565 174.5872 65 H 4.3494 8.9089 126.0877 57.2578 29.8555 173.9637 66 N 4.1535 8.5521 123.2813 54.3090 38.1111 173.6379 67 V 4.0170 7.7725 111.9996 65.2604 33.3428 174.7908 68 G 3.7186 7.7651 103.8770 42.7974 0.0000 172.6750 69 W 4.6933 8.2345 119.1986 57.0144 29.4501 177.4394 70 Q 4.7857 8.6374 123.0954 55.6477 30.8902 175.3779 71 Q 4.2320 8.7741 126.8541 56.7546 29.6126 176.8963 72 E 4.4162 8.9452 126.5915 56.6507 30.5020 176.1113 73 E 4.8690 9.2825 122.7863 54.6891 32.7185 175.3102 74 R 5.1084 8.5588 121.0673 54.4912 33.9370 174.8896 75 S 4.7711 9.0869 116.0093 56.4361 65.4609 175.2446 76 K 3.9542 8.9072 125.2597 59.0863 32.9696 177.3786 77 K 4.1305 7.8442 119.9710 56.6992 32.1422 177.5262 78 F 4.9393 8.3198 126.8120 56.5018 40.0930 172.4562 79 P 4.5514 0.0000 0.0000 61.9969 31.2119 177.0872 80 F 4.9232 7.4052 115.1492 56.6480 42.8471 175.4480 81 T 4.9594 8.4179 119.4823 61.3089 71.9289 173.8102 82 K 3.9085 8.6711 125.2285 57.9762 32.4955 177.5282 83 G 3.9489 8.5558 111.4076 45.2277 0.0000 172.9089 84 D 5.0817 7.7349 119.0212 52.5044 43.9865 175.7503 85 H 4.9539 8.8041 117.1742 56.2816 29.6929 174.7597 86 F 5.1980 8.6538 114.9304 55.8704 41.9977 173.0987 87 Q 5.0531 8.7443 119.8006 55.3020 32.0157 173.7606 88 T 5.0998 9.2051 122.1502 62.2420 73.1739 172.8784 89 T 5.2694 8.8268 121.4363 61.9267 72.1221 173.1665 90 I 5.3375 9.1471 125.8679 60.1120 41.3679 174.4289 91 T 5.4069 9.1734 119.7785 61.1654 71.2530 171.9148 92 F 5.3938 7.8468 117.7646 55.9875 41.0853 173.1786 93 D 5.1186 8.5442 119.7075 51.9121 41.7533 176.2428 94 T 3.9866 8.4067 107.1786 63.9225 69.3215 175.2048 95 H 4.6552 8.5154 119.3298 56.6828 30.8522 174.3772 96 T 4.9620 7.5307 114.6013 61.7561 73.1844 173.0773 97 F 5.0745 9.5099 124.6583 56.5917 41.1151 174.2946 98 Y 5.1164 9.5147 122.1549 56.5355 39.9061 174.7513 99 I 5.1591 9.1059 125.6950 59.4642 40.9141 174.4157 100 Q 5.0512 9.2045 127.1540 54.4645 32.0267 175.1340 101 L 4.8402 8.9816 126.8265 53.3802 43.7793 177.7547 102 S 4.1293 8.8007 115.9968 62.0063 62.6164 175.6785 103 N 4.5881 8.0109 113.9110 52.6599 37.3037 175.8439 104 G 3.9853 8.2342 108.1402 45.3528 0.0000 174.0425 105 E 4.4496 8.3226 119.7425 56.4595 30.7581 175.9397 106 T 5.2236 8.4145 110.9595 60.0710 72.2444 173.1900 107 V 4.6367 9.0342 121.8004 61.2964 35.2116 173.9585 108 E 5.3191 8.9254 125.1619 54.6715 32.7894 175.1136 109 F 5.1311 8.9828 124.4169 55.5715 43.2311 172.0482 110 P 4.4914 0.0000 0.0000 63.1910 32.0460 176.4362 111 N 4.9046 8.9808 122.2784 52.1916 37.3876 175.4468 112 R 3.9094 8.3327 122.5845 58.3580 30.5178 177.4838 113 N 4.6896 8.2341 111.9042 52.1448 39.2585 174.5535 114 K 4.1632 7.6091 116.2224 56.2531 30.2833 175.2911 115 D 4.4673 8.0579 115.9362 54.2781 41.7744 176.5405 116 A 4.8087 8.0861 120.9932 51.9782 21.0384 175.7344 117 A 4.6846 6.9670 114.8885 50.5942 22.5158 175.7723 118 F 4.9738 9.0226 117.8631 55.9375 43.3006 175.2260 119 N 5.0583 9.1829 118.1032 53.0070 40.4488 173.7063 120 L 5.2884 8.5413 121.9632 53.4523 46.0101 174.8824 121 I 5.2356 9.0384 126.8837 59.7169 40.3726 174.1697 122 Y 5.3881 8.7537 123.7980 55.5976 41.5818 173.3184 123 L 5.2364 9.0105 122.2489 53.5105 44.7218 175.0340 124 A 4.6575 8.8368 126.0836 51.2945 23.0473 176.5248 125 G 3.9293 8.9495 104.6377 44.8801 0.0000 173.8089 126 D 4.8617 8.9049 115.6801 51.6459 38.9601 174.5451 127 A 4.8461 7.2523 120.1136 51.1784 23.1264 176.5170 128 R 4.6690 8.4827 113.6408 54.8830 33.2350 174.2543 129 L 4.9579 8.4482 120.2942 53.7877 42.8887 176.3794 130 T 4.6798 8.5573 112.3213 61.9273 71.1942 173.7161 131 F 5.1593 7.5588 115.8464 55.9751 41.4478 173.3673 132 V 4.8700 8.2770 117.7075 60.6110 34.3074 173.8207 133 R 4.7077 9.2355 121.8444 54.4464 33.8495 174.0469 134 L 5.1119 8.4479 125.4267 53.6486 44.7255 175.7459 135 E 4.5533 8.9167 124.1371 57.0850 29.2688 175.3858 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 D 8.35 4.60 0.00 2.79 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 3 R 8.43 4.18 0.00 2.40 2.04 0.00 2.37 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 4 A 9.13 4.56 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 5 E 8.79 5.28 0.00 1.83 1.85 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 2.22 2.43 0.00 6 V 8.86 4.41 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 1.06 0.00 0.00 0.95 0.00 0.00 7 R 8.29 4.88 0.00 1.84 1.77 0.00 3.42 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.66 0.00 8 N 9.38 4.26 0.00 2.92 2.96 0.00 0.00 6.89 7.17 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 9 I 7.66 4.34 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.64 0.97 0.00 0.00 10 P 0.00 4.53 0.00 2.02 2.08 0.00 3.74 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.27 0.00 11 F 9.84 5.03 0.00 3.21 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 12 K 8.67 5.06 0.00 1.78 1.67 0.00 1.81 0.00 0.00 1.78 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.49 7.81 13 L 7.55 2.92 0.00 1.35 1.39 0.85 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 14 G 7.62 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 0.00 0.00 0.00 15 M 7.35 4.65 0.00 2.32 2.49 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 16 Y 8.54 5.10 0.00 3.00 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 17 L 8.99 5.03 0.00 0.81 1.18 0.74 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 18 T 9.03 5.18 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 1.42 0.00 0.00 19 V 8.83 4.45 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 0.73 0.00 0.00 1.08 0.00 0.00 20 G 7.01 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 6.64 3.46 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 0.00 22 V 7.66 4.78 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 0.82 0.00 0.00 0.61 0.00 0.00 23 V 8.79 3.90 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 1.15 0.00 0.00 24 N 8.69 4.73 0.00 2.65 2.66 0.00 0.00 6.83 7.16 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 25 S 8.54 4.03 0.00 3.74 3.75 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 26 N 8.84 4.08 0.00 2.85 2.90 0.00 0.00 6.92 7.35 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 27 A 7.14 4.22 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 T 9.29 4.54 4.49 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 29 R 8.03 5.74 0.00 1.69 1.87 0.00 2.51 0.00 0.00 2.91 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.25 0.00 30 F 7.96 5.42 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 31 S 9.13 5.37 0.00 3.55 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 32 I 7.93 4.82 1.77 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.73 0.87 0.00 0.00 33 N 8.75 5.12 0.00 1.44 2.13 0.00 0.00 6.19 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 34 V 8.06 4.65 1.64 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 0.66 0.00 0.00 0.97 0.00 0.00 35 G 8.53 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 0.00 0.00 0.00 36 E 9.56 4.73 0.00 1.95 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 2.31 2.40 0.00 37 S 7.42 4.59 0.00 3.95 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 38 T 8.46 4.10 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 0.71 0.00 0.00 39 D 7.78 4.59 0.00 2.74 2.67 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 40 S 8.02 4.52 0.00 3.94 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 41 I 8.54 4.70 1.77 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.67 0.91 0.00 0.00 42 A 8.67 4.13 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 M 7.95 4.20 0.00 1.18 0.57 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.96 0.00 44 H 8.99 4.96 0.00 3.35 3.35 0.00 5.77 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 M 8.49 4.38 0.00 1.80 1.58 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.96 0.00 46 D 8.62 4.74 0.00 2.22 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 0.00 0.00 0.00 47 H 8.45 4.64 0.00 1.94 2.22 0.00 5.84 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 R 8.52 4.54 0.00 1.61 1.77 0.00 2.99 0.00 0.00 3.27 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.31 0.00 49 F 9.27 3.97 0.00 3.43 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 50 S 7.99 4.56 0.00 3.87 3.80 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 51 Y 9.09 4.60 0.00 2.92 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 52 G 7.94 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 53 A 8.52 4.25 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 54 D 8.15 4.68 0.00 2.89 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Q 7.81 4.86 0.00 1.89 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.78 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 56 N 8.41 3.14 0.00 2.58 2.47 0.00 0.00 6.90 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 57 V 6.74 4.29 1.85 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 0.72 0.00 0.00 0.89 0.00 0.00 58 L 8.78 4.83 0.00 1.73 1.48 0.96 0.42 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 59 V 8.28 4.66 1.83 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 0.63 0.00 0.00 0.79 0.00 0.00 60 L 8.50 4.79 0.00 1.27 0.22 0.77 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 61 N 7.96 5.20 0.00 2.64 2.73 0.00 0.00 6.61 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 8.89 5.30 0.00 4.09 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 0.00 63 L 8.54 4.56 0.00 0.27 0.89 -0.18 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 64 V 8.36 4.47 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 0.84 0.00 0.00 0.92 0.00 0.00 65 H 8.91 4.35 0.00 3.15 3.21 0.00 5.91 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 N 8.55 4.15 0.00 2.65 2.77 0.00 0.00 6.96 7.67 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 67 V 7.77 4.02 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 0.82 0.00 0.00 0.91 0.00 0.00 68 G 7.77 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 W 8.23 4.69 0.00 3.20 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 70 Q 8.64 4.79 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.87 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 71 Q 8.77 4.23 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.95 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 72 E 8.95 4.42 0.00 1.87 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 73 E 9.28 4.87 0.00 2.11 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 2.30 2.43 0.00 74 R 8.56 5.11 0.00 1.61 1.73 0.00 3.26 0.00 0.00 3.12 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.53 0.00 75 S 9.09 4.77 0.00 3.79 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 76 K 8.91 3.95 0.00 1.90 1.92 0.00 1.54 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.41 1.52 7.81 77 K 7.84 4.13 0.00 1.85 1.85 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.63 1.41 7.81 78 F 8.32 4.94 0.00 2.91 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 79 P 0.00 4.55 0.00 1.94 1.92 0.00 3.30 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.80 0.00 80 F 7.41 4.92 0.00 2.22 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 81 T 8.42 4.96 4.46 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 1.32 0.00 0.00 82 K 8.67 3.91 0.00 1.65 1.68 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.55 0.91 7.81 83 G 8.56 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 84 D 7.73 5.08 0.00 2.93 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 85 H 8.80 4.95 0.00 3.06 3.26 0.00 5.66 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 F 8.65 5.20 0.00 3.29 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 87 Q 8.74 5.05 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 88 T 9.21 5.10 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 89 T 8.83 5.27 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 90 I 9.15 5.34 2.14 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.89 1.41 0.00 0.00 91 T 9.17 5.41 3.79 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 1.21 0.00 0.00 92 F 7.85 5.39 0.00 2.54 2.63 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 93 D 8.54 5.12 0.00 2.83 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 8.41 3.99 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 1.15 0.00 0.00 95 H 8.52 4.66 0.00 3.40 3.32 0.00 5.76 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 96 T 7.53 4.96 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 0.40 0.00 0.00 97 F 9.51 5.07 0.00 3.13 3.08 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 98 Y 9.51 5.12 0.00 3.02 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 99 I 9.11 5.16 2.09 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 1.19 1.01 1.00 0.00 0.00 100 Q 9.20 5.05 0.00 2.20 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.69 0.00 0.00 0.00 0.00 0.00 2.31 2.53 0.00 101 L 8.98 4.84 0.00 1.73 1.47 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.80 4.13 0.00 3.79 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 0.00 103 N 8.01 4.59 0.00 2.79 2.84 0.00 0.00 6.21 7.00 0.00 0.00 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 G 8.23 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 0.00 105 E 8.32 4.45 0.00 2.06 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 2.34 2.25 0.00 106 T 8.41 5.22 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 107 V 9.03 4.64 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 1.09 0.00 0.00 0.97 0.00 0.00 108 E 8.93 5.32 0.00 1.86 1.71 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 2.26 2.40 0.00 109 F 8.98 5.13 0.00 3.02 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 0.00 110 P 0.00 4.49 0.00 1.87 1.86 0.00 3.23 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.64 0.00 111 N 8.98 4.90 0.00 2.49 2.80 0.00 0.00 7.13 7.19 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 0.00 112 R 8.33 3.91 0.00 1.87 1.99 0.00 3.27 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 113 N 8.23 4.69 0.00 2.92 2.87 0.00 0.00 7.00 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 0.00 114 K 7.61 4.16 0.00 1.87 1.79 0.00 1.65 0.00 0.00 1.53 0.00 0.00 2.92 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.44 1.31 7.81 115 D 8.06 4.47 0.00 2.55 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 A 8.09 4.81 1.18 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 0.00 0.00 117 A 6.97 4.68 1.11 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 0.00 118 F 9.02 4.97 0.00 3.18 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 0.00 119 N 9.18 5.06 0.00 2.71 2.88 0.00 0.00 6.49 6.74 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 0.00 120 L 8.54 5.29 0.00 1.83 1.59 1.05 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 121 I 9.04 5.24 1.93 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.78 0.91 0.00 0.00 122 Y 8.75 5.39 0.00 3.20 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 0.00 123 L 9.01 5.24 0.00 1.81 1.61 1.09 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 124 A 8.84 4.66 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 G 8.95 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 0.00 0.00 0.00 126 D 8.90 4.86 0.00 2.68 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 0.00 127 A 7.25 4.85 0.50 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 0.00 128 R 8.48 4.67 0.00 1.83 1.93 0.00 2.72 0.00 0.00 3.12 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 129 L 8.45 4.96 0.00 1.50 1.52 0.91 0.84 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 0.00 130 T 8.56 4.68 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 1.15 0.00 0.00 131 F 7.56 5.16 0.00 2.99 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 0.00 132 V 8.28 4.87 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 0.71 0.00 0.00 0.91 0.00 0.00 133 R 9.24 4.71 0.00 1.83 2.04 0.00 3.28 0.00 0.00 3.12 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 134 L 8.45 5.11 0.00 1.52 1.53 0.80 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.92 4.55 0.00 2.05 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 2.25 2.30 0.00