NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2738 8.3144 120.1355 55.8111 33.4571 175.1328 2 E 3.8794 8.4491 123.7987 54.4090 30.3219 175.0815 3 T 4.2238 8.7203 118.3133 61.1820 72.1128 175.0261 4 A 3.9990 8.5197 123.4412 55.3626 18.4399 179.9205 5 A 4.1303 8.0296 118.5693 55.3531 18.4441 179.6110 6 A 4.0183 8.2025 119.3434 55.0405 18.3684 179.7105 7 K 4.0844 8.4341 119.9733 59.0140 32.2109 178.7283 8 F 4.1083 8.5299 120.9979 61.4589 39.3701 176.9960 9 E 4.0122 8.4346 118.2270 59.3650 29.0248 179.3594 10 R 3.8806 8.0352 118.0229 59.5392 30.2715 178.2262 11 Q 4.0020 8.0791 116.7278 57.8788 29.1417 176.2355 12 H 4.7196 7.9518 113.8686 53.7555 31.6505 173.0653 13 M 4.7056 7.8629 118.6845 53.8802 33.3672 176.2775 14 D 4.6997 9.1145 123.4635 52.7893 42.1778 175.2732 15 S 4.7000 8.4711 115.3602 58.3473 63.4694 175.6300 16 S 4.2901 7.9586 115.9689 60.8334 63.0013 174.6287 17 T 4.7345 7.3918 114.9756 60.7964 71.8016 174.1305 18 S 4.1674 8.5858 117.7041 61.1832 63.3105 173.7019 19 A 4.2731 7.1833 120.6566 50.3262 21.8141 175.1142 20 A 3.4616 7.8899 122.7703 52.2427 18.7991 178.3842 21 S 4.2583 8.6573 119.4049 60.9882 63.3491 173.9815 22 S 4.6777 7.5588 112.8590 56.6734 65.7840 174.3040 23 S 4.2860 8.5957 113.7069 60.2400 63.0894 174.1970 24 N 4.6896 7.8285 118.2656 53.7688 39.3789 175.4578 25 Y 4.0278 7.9610 119.3294 62.1113 38.6924 177.6579 26 C 4.2155 8.4759 117.0097 60.0577 35.9847 175.8057 27 N 4.3828 8.1996 117.6397 56.3119 38.0696 177.1179 28 Q 3.8678 7.9306 120.9264 59.3758 29.3234 178.0210 29 M 3.7230 7.7552 121.4294 57.8025 31.7374 178.6942 30 M 4.0469 8.1819 119.3582 57.9632 32.0570 178.7847 31 K 3.9305 7.7412 120.3094 59.5306 32.1781 178.9391 32 S 4.2350 8.2603 113.0781 60.1159 63.3590 175.3629 33 R 4.4294 7.6635 118.5993 55.4956 29.9782 175.6416 34 N 4.2636 7.8079 113.5692 54.8049 36.3626 174.8077 35 L 4.6015 8.2302 116.2167 54.9008 42.1033 177.7489 36 T 4.9370 7.5740 106.2577 60.0981 69.5533 174.9661 37 K 4.1520 8.4554 123.4520 59.8379 32.3904 177.2702 38 D 4.7230 7.9760 116.1551 54.9465 42.5813 176.2433 39 R 3.8164 7.1223 113.1647 54.4146 32.3507 174.4639 40 C 4.6897 8.5664 116.2417 55.9090 40.1292 173.8765 41 K 4.1401 8.6402 127.5808 55.9774 32.2677 174.7631 42 P 4.7060 0.0000 0.0000 65.1106 32.4484 176.7245 43 V 4.9858 7.5750 117.2113 61.1974 34.5726 174.3544 44 N 4.7036 9.2423 124.7805 52.8193 42.9047 172.8370 45 T 4.8032 7.9325 121.9108 61.7519 71.3748 173.1029 46 F 4.8548 8.9599 124.7225 55.6574 42.0632 174.6115 47 V 4.4565 8.9904 123.1112 60.8464 33.3988 175.8130 48 H 5.8268 8.6663 127.1924 54.6874 26.9553 172.9785 49 E 4.8316 7.7529 116.7561 53.3823 34.0908 177.0818 50 S 4.3242 8.3522 114.8796 58.3567 64.8867 174.8351 51 L 3.9680 7.9569 123.2615 58.5809 41.8202 179.4289 52 A 4.0267 8.0171 119.9575 55.4310 18.1308 179.2217 53 D 4.3388 7.9744 116.2927 57.3842 41.1713 178.9370 54 V 3.7834 7.8991 118.8790 66.1354 31.6098 178.1284 55 Q 3.9143 8.6018 118.0355 58.8628 28.4704 178.6686 56 A 4.0340 8.1450 121.4885 54.6505 18.2390 179.6299 57 V 3.4148 7.6528 117.0982 66.1015 31.2800 176.9313 58 C 3.7628 7.7971 114.6761 57.9166 39.8779 174.1285 59 S 4.6809 7.5460 114.3568 57.9645 63.9282 174.3157 60 Q 4.1101 7.3156 120.0798 56.2124 30.5487 178.4583 61 K 4.3479 8.5402 134.8028 56.4214 32.7558 174.5979 62 N 4.2697 8.7544 127.5488 53.6637 39.5694 174.3566 63 V 4.5839 8.4093 118.2001 59.2425 36.6989 174.9000 64 A 4.2770 8.4147 125.0044 52.3584 19.0680 178.4536 65 C 4.7583 8.9689 118.7661 55.8140 41.4033 175.2149 66 K 3.7017 8.9931 121.9017 59.8000 31.6369 178.0790 67 N 4.5174 8.0309 112.8009 53.0980 37.6105 175.7669 68 G 3.9570 8.1907 108.6845 45.4900 0.0000 174.3022 69 Q 4.2050 8.4492 119.3540 56.4266 29.1819 176.5120 70 T 4.6633 8.2987 108.8114 61.6344 69.2014 173.6599 71 N 5.0118 8.0056 117.7899 54.0167 38.6154 174.8835 72 C 5.3118 7.5454 115.0202 57.0064 43.5522 172.5669 73 Y 5.0139 8.8308 118.3018 56.5331 42.3208 173.8994 74 Q 4.9843 9.1989 126.1304 54.2576 31.0484 174.9079 75 S 4.5237 8.8974 122.3390 58.7261 63.0756 174.3078 76 Y 4.5269 9.2096 122.0458 60.7455 37.9288 176.8391 77 S 4.8324 7.8296 113.9917 56.8540 64.8728 173.8346 78 T 4.1493 8.0263 112.5314 62.1447 69.6558 173.5141 79 M 5.0267 8.9945 121.9710 53.2934 36.8790 174.7670 80 S 4.7659 9.5218 117.7989 58.5351 63.5392 173.1217 81 I 5.0888 9.0642 120.2686 59.4635 41.7897 174.1200 82 T 4.9903 8.9067 119.1314 61.9366 71.7790 172.9027 83 D 4.9764 9.3141 127.2679 53.4800 42.7309 174.7344 84 C 5.4728 9.2293 121.8382 55.2303 42.9887 172.9471 85 R 5.2463 8.7818 123.8935 54.0543 32.9159 174.1389 86 E 4.0482 9.4586 128.2283 56.4479 30.2739 176.8562 87 T 4.1833 8.5803 116.2305 60.9711 69.7389 175.9017 88 G 3.6043 8.6029 111.6105 48.1741 0.0000 174.6088 89 S 4.4926 7.2452 112.6051 57.9150 63.7476 174.4837 90 S 4.0622 7.3511 117.1523 58.4402 62.7556 173.4052 91 K 4.4237 8.3306 127.6236 54.6832 34.4491 174.4601 92 Y 4.4190 8.8408 127.5285 57.8664 38.9172 174.2657 93 P 3.1540 0.0000 0.0000 63.1268 32.2686 176.7098 94 N 4.6249 7.5629 119.2652 52.1182 36.9332 173.8738 95 C 4.3700 7.8725 116.2937 56.7891 42.4668 173.4838 96 A 5.0843 8.5971 125.5186 50.3964 22.0450 174.4037 97 Y 5.0574 9.2830 119.0401 56.0610 42.1896 175.2917 98 K 4.4788 9.0912 122.6191 56.0532 33.9452 175.8336 99 T 5.0138 8.5567 121.4285 62.6757 70.1679 174.3359 100 T 4.6181 8.8394 122.6340 61.7695 72.0950 173.5427 101 Q 4.7057 8.8473 125.5832 56.0437 29.8632 175.1231 102 A 4.6153 8.8471 123.0283 51.0808 23.6945 174.8339 103 N 5.3086 8.6546 116.8518 52.1183 41.0879 173.3043 104 K 4.8009 8.8178 124.7182 54.8125 37.6357 175.5819 105 H 4.9350 9.1401 119.3345 55.9631 29.9241 174.9647 106 I 4.8088 8.5509 115.7005 59.4814 40.6144 174.4348 107 I 4.9471 8.2237 124.3911 59.7056 40.1278 175.0562 108 V 4.7810 8.6905 119.5669 59.2663 36.0305 174.5960 109 A 4.8637 8.7110 125.4355 51.5519 20.0889 175.7763 110 C 5.0910 8.7248 119.7064 55.2320 37.8858 173.1153 111 E 4.6605 8.7244 121.3464 56.4766 33.6203 175.4385 112 G 4.0518 9.3680 110.5121 44.8382 0.0000 171.5910 113 N 5.0021 8.1615 116.0793 50.6165 40.3489 172.1809 114 P 4.3452 0.0000 0.0000 62.7939 32.0394 175.8809 115 Y 5.1750 8.2321 121.4112 56.5464 38.6515 174.4832 116 V 4.4378 7.9603 119.3114 58.3510 36.8520 173.3712 117 P 4.4620 0.0000 0.0000 62.9489 31.1569 176.9840 118 V 4.4626 8.6591 115.3773 61.1500 33.7470 175.1344 119 H 5.0042 7.8198 119.5508 55.0023 33.4153 171.7007 120 F 4.7006 8.7647 127.8246 57.3204 39.5117 174.4277 121 D 4.5867 8.4537 126.9906 56.1394 42.0279 175.9130 122 A 4.5579 6.4005 117.1481 51.4678 22.3289 174.9595 123 S 5.2495 8.9200 113.4922 56.6946 66.0092 174.6654 124 V 4.1491 8.8150 114.8072 61.7201 32.5504 175.3846 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 K 8.31 4.27 0.00 1.77 1.82 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.44 7.81 2 E 8.45 3.88 0.00 2.09 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 0.00 2.40 2.38 0.00 3 T 8.72 4.22 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 1.23 0.00 0.00 4 A 8.52 4.00 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 5 A 8.03 4.13 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 6 A 8.20 4.02 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 7 K 8.43 4.08 0.00 1.95 2.05 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.32 7.81 8 F 8.53 4.11 0.00 3.27 3.26 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 9 E 8.43 4.01 0.00 2.29 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 2.53 2.69 0.00 10 R 8.04 3.88 0.00 1.80 2.09 0.00 3.36 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 8.08 4.00 0.00 1.55 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.49 0.00 0.00 0.00 0.00 0.00 2.24 2.46 0.00 12 H 7.95 4.72 0.00 1.88 2.59 0.00 5.60 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.86 4.71 0.00 1.99 2.18 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.67 0.00 14 D 9.11 4.70 0.00 2.75 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 15 S 8.47 4.70 0.00 3.94 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 16 S 7.96 4.29 0.00 4.03 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 17 T 7.39 4.73 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 1.19 0.00 0.00 18 S 8.59 4.17 0.00 3.96 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 19 A 7.18 4.27 1.13 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 0.00 0.00 0.00 0.00 0.00 0.00 20 A 7.89 3.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.66 4.26 0.00 3.91 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 7.56 4.68 0.00 3.96 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 23 S 8.60 4.29 0.00 4.04 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 24 N 7.83 4.69 0.00 2.88 2.84 0.00 0.00 6.64 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 25 Y 7.96 4.03 0.00 3.09 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 26 C 8.48 4.22 0.00 3.16 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 27 N 8.20 4.38 0.00 3.03 2.92 0.00 0.00 6.77 7.39 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 28 Q 7.93 3.87 0.00 2.11 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.25 2.45 0.00 29 M 7.76 3.72 0.00 0.74 1.23 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.39 0.00 30 M 8.18 4.05 0.00 1.68 1.82 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.37 0.00 31 K 7.74 3.93 0.00 1.89 1.91 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.44 7.81 32 S 8.26 4.24 0.00 3.96 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 33 R 7.66 4.43 0.00 1.96 2.12 0.00 3.59 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.93 0.00 34 N 7.81 4.26 0.00 2.90 2.94 0.00 0.00 6.81 7.91 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 35 L 8.23 4.60 0.00 1.77 1.63 0.81 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.57 4.94 4.42 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 1.47 0.00 0.00 37 K 8.46 4.15 0.00 1.93 1.91 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.43 7.81 38 D 7.98 4.72 0.00 2.60 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.12 3.82 0.00 1.83 1.67 0.00 2.96 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.57 0.00 40 C 8.57 4.69 0.00 3.10 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 41 K 8.64 4.14 0.00 1.81 1.78 0.00 1.76 0.00 0.00 1.61 0.00 0.00 3.16 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.43 7.81 42 P 0.00 4.71 0.00 2.15 2.10 0.00 3.63 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 2.13 2.19 0.00 43 V 7.57 4.99 2.11 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 0.80 0.00 0.00 0.98 0.00 0.00 44 N 9.24 4.70 0.00 2.64 2.27 0.00 0.00 6.77 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 45 T 7.93 4.80 2.95 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 0.92 0.00 0.00 46 F 8.96 4.85 0.00 2.99 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 47 V 8.99 4.46 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 1.05 0.00 0.00 1.01 0.00 0.00 48 H 8.67 5.83 0.00 3.09 3.48 0.00 5.61 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.75 4.83 0.00 1.95 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 50 S 8.35 4.32 0.00 4.07 4.02 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 51 L 7.96 3.97 0.00 1.80 1.76 1.02 1.29 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 52 A 8.02 4.03 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 53 D 7.97 4.34 0.00 2.84 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 54 V 7.90 3.78 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 1.24 0.00 0.00 1.06 0.00 0.00 55 Q 8.60 3.91 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 56 A 8.14 4.03 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 57 V 7.65 3.41 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 1.07 0.00 0.00 0.96 0.00 0.00 58 C 7.80 3.76 0.00 2.86 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 59 S 7.55 4.68 0.00 3.90 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 60 Q 7.32 4.11 0.00 1.63 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.96 0.00 0.00 0.00 0.00 0.00 1.76 2.15 0.00 61 K 8.54 4.35 0.00 2.12 1.86 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.49 7.81 62 N 8.75 4.27 0.00 2.69 2.63 0.00 0.00 7.00 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 8.41 4.58 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 0.76 0.00 0.00 0.81 0.00 0.00 64 A 8.41 4.28 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 65 C 8.97 4.76 0.00 3.10 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 66 K 8.99 3.70 0.00 1.75 1.90 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.56 7.81 67 N 8.03 4.52 0.00 2.79 2.90 0.00 0.00 6.24 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 68 G 8.19 3.96 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 0.00 0.00 0.00 69 Q 8.45 4.20 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.79 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 70 T 8.30 4.66 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 1.18 0.00 0.00 71 N 8.01 5.01 0.00 3.08 3.15 0.00 0.00 6.07 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 72 C 7.55 5.31 0.00 3.00 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 73 Y 8.83 5.01 0.00 2.81 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 74 Q 9.20 4.98 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 75 S 8.90 4.52 0.00 3.90 3.87 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 0.00 0.00 0.00 0.00 76 Y 9.21 4.53 0.00 3.01 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 77 S 7.83 4.83 0.00 3.90 3.81 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 78 T 8.03 4.15 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 1.02 0.00 0.00 79 M 8.99 5.03 0.00 1.93 1.99 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 80 S 9.52 4.77 0.00 3.89 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 9.06 5.09 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.58 1.03 0.00 0.00 82 T 8.91 4.99 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 1.29 0.00 0.00 83 D 9.31 4.98 0.00 2.58 2.62 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 84 C 9.23 5.47 0.00 2.95 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 85 R 8.78 5.25 0.00 1.95 1.79 0.00 3.14 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 86 E 9.46 4.05 0.00 1.90 1.76 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 2.12 1.89 0.00 87 T 8.58 4.18 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 1.22 0.00 0.00 88 G 8.60 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.25 4.49 0.00 4.15 3.96 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 90 S 7.35 4.06 0.00 3.76 3.81 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 91 K 8.33 4.42 0.00 1.76 1.58 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.44 7.81 92 Y 8.84 4.42 0.00 2.94 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 93 P 0.00 3.15 0.00 1.81 1.33 0.00 3.67 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 94 N 7.56 4.62 0.00 2.81 2.78 0.00 0.00 6.95 6.94 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 95 C 7.87 4.37 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 96 A 8.60 5.08 1.13 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 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 9.28 5.06 0.00 2.98 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 98 K 9.09 4.48 0.00 1.73 1.77 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.59 7.81 99 T 8.56 5.01 4.32 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 1.33 0.00 0.00 100 T 8.84 4.62 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 1.23 0.00 0.00 101 Q 8.85 4.71 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 102 A 8.85 4.62 1.22 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 0.00 0.00 103 N 8.65 5.31 0.00 2.70 2.71 0.00 0.00 6.75 6.68 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 0.00 104 K 8.82 4.80 0.00 1.77 1.86 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.45 7.81 105 H 9.14 4.93 0.00 3.09 3.35 0.00 5.59 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.55 4.81 1.84 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.23 1.14 0.00 0.00 107 I 8.22 4.95 1.67 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.61 0.84 0.00 0.00 108 V 8.69 4.78 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 0.73 0.00 0.00 0.86 0.00 0.00 109 A 8.71 4.86 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 0.00 110 C 8.72 5.09 0.00 2.13 1.69 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 0.00 111 E 8.72 4.66 0.00 1.96 1.67 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 2.23 2.30 0.00 112 G 9.37 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.16 5.00 0.00 2.66 2.71 0.00 0.00 6.92 7.69 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 0.00 114 P 0.00 4.35 0.00 2.23 2.05 0.00 3.82 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.23 5.17 0.00 2.88 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 0.00 116 V 7.96 4.44 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 0.70 0.00 0.00 0.89 0.00 0.00 117 P 0.00 4.46 0.00 0.49 1.00 0.00 3.33 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 118 V 8.66 4.46 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 0.66 0.00 0.00 0.97 0.00 0.00 119 H 7.82 5.00 0.00 3.20 3.10 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.76 4.70 0.00 2.73 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 0.00 121 D 8.45 4.59 0.00 2.57 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 A 6.40 4.56 1.15 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 0.00 0.00 123 S 8.92 5.25 0.00 4.05 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 0.00 124 V 8.81 4.15 2.09 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 0.68 0.00 0.00 0.93 0.00 0.00