NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2524 8.2549 120.8625 56.5843 31.1574 174.4043 3 H 4.5228 8.5038 119.0126 53.9560 30.7195 172.6442 4 L 3.6342 9.1191 119.8901 56.7578 40.6171 174.2733 5 K 4.3834 8.1720 113.8579 55.5034 32.2946 176.9644 6 S 4.4473 7.8490 112.1003 59.3581 65.9830 176.2497 7 G 3.9178 8.9236 108.7107 45.7047 0.0000 172.8179 8 R 4.7287 8.1705 116.8364 53.6740 34.2824 174.6304 9 K 3.9549 8.1658 118.8721 57.4545 32.9669 176.7565 10 L 4.3477 7.7888 114.4403 54.5356 43.5767 172.0751 11 N 4.9142 9.7054 121.0475 51.0216 41.4623 173.0152 12 R 4.6142 6.5642 124.2692 55.1069 32.5807 174.7223 13 H 4.5532 8.7409 120.4964 57.1081 31.1498 177.2610 14 S 2.9901 8.1082 116.0107 57.4828 67.2844 174.3877 15 S 4.3563 8.5362 116.5398 61.4997 63.0960 176.4491 16 H 4.1360 8.2941 122.5515 58.4416 29.4325 177.1714 17 R 3.4599 7.4857 120.1133 59.0301 29.9207 178.0668 18 L 3.6138 8.6381 121.0573 58.0566 42.1172 178.8919 19 A 3.9462 7.9219 120.7030 54.6603 18.1843 179.0976 20 L 3.7665 7.6289 119.0827 58.6502 42.0468 178.7949 21 Y 4.0438 7.1683 116.0273 61.3156 37.4182 179.0853 22 R 4.0354 7.7439 118.3308 58.7693 29.9404 178.2838 23 N 4.6447 7.9979 115.8328 55.0931 39.3046 177.0423 24 Q 4.1423 8.3122 118.6565 57.7501 28.6500 178.3799 25 A 4.0352 8.1825 122.7363 55.2597 18.7549 179.4889 26 K 3.8396 7.7244 115.6229 60.0138 31.9856 179.5614 27 S 4.0828 7.8586 115.1500 61.4588 63.0657 176.1336 28 L 3.9006 7.9362 122.9850 58.0725 41.3714 179.1087 29 L 4.2791 7.4685 117.6308 58.2751 42.1818 178.2547 30 T 3.7516 7.6552 113.2691 67.6318 68.3777 174.8297 31 H 4.6834 8.6587 119.2452 55.7290 29.6121 176.4846 32 G 4.4174 8.0455 115.0787 45.7415 0.0000 174.0949 33 R 5.1423 7.6199 115.6483 54.1847 34.1551 175.0910 34 I 4.7964 9.2911 121.5225 60.0352 41.9832 174.1875 35 T 5.2135 8.6679 121.1724 61.6398 70.8021 173.9834 36 T 4.5280 7.9651 115.1672 61.7490 72.2294 172.6341 37 T 4.5886 8.5034 110.4169 60.9572 70.7940 175.6450 38 V 3.5620 8.0615 122.8434 66.0410 31.3324 176.9387 39 P 4.2605 0.0000 0.0000 65.1972 31.4707 178.2783 40 K 4.0590 8.7018 118.1381 58.3890 32.1164 177.8575 41 A 4.4036 7.7433 120.2407 53.8340 19.9708 178.4517 42 K 4.1628 8.4189 115.0250 57.8915 31.9727 177.7383 43 E 4.2781 7.7175 119.9167 57.7559 30.6602 176.9951 44 L 3.4732 7.2255 119.6249 59.2312 41.4759 178.2466 45 R 3.6340 8.0883 114.6082 60.7306 29.6226 177.9110 46 G 3.7217 8.1463 106.2784 47.3699 0.0000 175.0875 47 F 4.1852 7.9917 122.9651 61.0247 39.2488 177.4677 48 V 3.5772 7.7006 116.8598 66.1215 31.4722 177.4426 49 D 4.2200 8.0959 118.2862 57.8313 40.7844 178.5616 50 H 3.9667 7.6572 116.9199 59.2310 29.7066 177.1759 51 L 3.7629 7.1006 119.1891 58.6077 41.5209 178.7438 52 I 3.6241 8.4325 120.4639 64.0474 36.5905 177.2717 53 H 3.8559 8.1621 124.8961 59.1252 30.2848 177.0510 54 L 4.0721 7.4817 121.2807 57.8156 41.8694 178.1898 55 A 3.4611 8.1479 120.0656 54.9524 18.2735 179.1176 56 K 3.7873 8.0200 116.2657 58.8911 32.4505 178.2141 57 R 4.1126 6.9124 115.8895 55.3442 31.2748 176.4962 58 G 3.2781 8.9243 110.5185 45.6723 0.0000 175.8819 59 D 3.9966 8.3885 113.7578 52.7694 41.7024 176.2481 60 L 4.0912 8.2434 126.2462 58.2775 42.1746 178.2488 61 H 4.0444 8.3936 117.6489 59.6607 29.4188 176.7182 62 A 4.0056 8.2755 121.6651 55.6189 18.1116 178.6897 63 R 4.0155 7.8725 117.2895 58.7209 29.6674 178.4384 64 R 3.8327 8.2039 117.3585 59.6066 30.1327 178.7570 65 L 3.9339 7.7310 117.3485 58.0228 42.0082 179.6013 66 V 3.7098 7.3959 117.5316 65.6594 31.3859 177.5725 67 L 4.1350 8.1371 118.8360 57.8400 41.8352 178.6697 68 R 4.0486 7.4575 117.0568 59.6567 30.0905 178.1769 69 D 4.7343 7.8342 118.7505 56.8767 41.0287 179.0399 70 L 4.3686 7.8109 124.2449 53.6486 39.5443 177.0653 71 Q 4.2919 8.3882 124.1520 58.9186 29.4309 177.5190 72 D 4.4347 7.3585 117.2142 53.8283 42.4632 176.5816 73 V 3.6341 8.3214 126.6408 65.9384 31.5980 177.5003 74 K 3.7921 8.2523 118.9749 59.8146 31.9095 178.2025 75 L 3.9662 8.1420 119.7429 57.8275 41.8489 179.0973 76 V 3.5070 7.6631 118.5000 66.4277 31.4684 177.4987 77 R 3.8805 8.1634 117.0539 59.0026 29.9549 178.5612 78 K 4.0064 8.1353 118.7171 60.2032 32.4650 178.1055 79 L 4.0898 8.1641 120.7301 57.5347 41.8230 178.4343 80 F 4.0769 8.6952 118.9869 59.9501 40.5849 176.6841 81 D 4.7402 8.4978 117.9335 49.7144 37.7541 175.9413 82 E 5.6834 7.3023 130.0057 57.4504 29.7073 178.1249 83 I 3.6817 7.2882 123.2412 64.6017 37.6609 177.1293 84 A 4.4265 7.9778 123.5612 53.1393 19.2348 177.9307 85 P 4.1684 0.0000 0.0000 65.3873 31.9498 178.4939 86 R 3.9144 7.2405 114.5956 57.8356 29.9457 176.4823 87 Y 4.6995 7.7026 115.1895 58.5910 38.9529 178.9834 88 R 3.3090 7.1324 116.5436 58.0928 31.9282 175.5992 89 D 4.7679 7.6877 118.4844 54.8516 41.6984 176.4775 90 R 4.3431 8.6053 119.9502 54.4687 31.8451 174.5027 91 Q 4.4218 8.8723 127.0799 56.7439 29.2489 175.2780 92 G 3.9213 10.8075 111.7559 46.5658 0.0000 169.7062 93 G 3.7413 8.7502 114.2418 45.6950 0.0000 172.6946 94 Y 4.3592 8.4890 119.4621 56.8535 41.0844 175.0554 95 T 5.0101 7.8886 113.6765 60.1478 70.6026 172.6787 96 R 4.7100 8.9921 128.1781 54.4421 33.4339 173.9921 97 V 4.9891 8.4485 124.9970 61.1971 33.9720 174.4040 98 L 4.7981 9.3975 128.3797 52.6807 44.7370 175.9608 99 K 4.4980 8.7079 124.1039 56.2448 32.8602 177.6010 100 L 4.4477 8.3071 125.0736 54.1563 43.4314 175.7727 101 A 4.3348 8.4208 121.6777 52.2265 20.8996 174.7301 102 E 3.8880 9.1373 124.7858 56.6246 28.2154 174.5767 103 R 4.2086 7.9937 122.4751 55.0312 30.9181 175.8733 104 R 4.0754 8.3279 118.5055 55.9638 29.9575 176.0326 105 R 4.3421 8.4919 125.8170 54.6214 28.3366 175.8479 106 G 4.5402 7.6979 115.8544 45.1682 0.0000 170.1544 107 D 4.4168 8.4678 121.0295 52.3385 41.1981 176.8546 108 G 3.7842 8.9074 108.1263 46.0494 0.0000 173.3507 109 A 4.0899 9.1370 123.6794 51.2580 19.2445 175.9161 110 P 4.3563 0.0000 0.0000 62.9847 32.3823 176.3813 111 L 4.5370 8.5451 124.6793 54.7304 43.4127 175.6291 112 A 5.1004 8.9828 121.7154 50.5926 23.6777 174.3129 113 L 4.9176 9.5429 121.2288 53.4414 44.8354 175.3082 114 V 5.1032 9.0894 126.9133 61.0966 34.1792 174.1465 115 E 5.1696 9.1031 124.6298 54.1066 33.9732 174.4920 116 L 4.9243 8.5212 120.1922 53.3158 41.6656 176.6939 117 V 3.6249 7.7722 123.9231 62.3585 32.5579 175.7243 118 E 4.7872 8.8546 124.9310 56.4172 30.0618 176.6099 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 R 8.25 4.25 0.00 1.80 1.92 0.00 3.20 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 1.69 0.00 3 H 8.50 4.52 0.00 3.18 3.26 0.00 6.07 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 4 L 9.12 3.63 0.00 1.80 1.77 0.93 0.59 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 5 K 8.17 4.38 0.00 1.77 1.82 0.00 1.88 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.49 7.81 6 S 7.85 4.45 0.00 3.93 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 7 G 8.92 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 8 R 8.17 4.73 0.00 1.78 2.10 0.00 3.43 0.00 0.00 3.29 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 9 K 8.17 3.95 0.00 1.88 1.88 0.00 1.82 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.74 1.57 7.81 10 L 7.79 4.35 0.00 1.60 1.59 0.97 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 11 N 9.71 4.91 0.00 2.66 2.69 0.00 0.00 7.35 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 12 R 6.56 4.61 0.00 1.77 1.84 0.00 3.02 0.00 0.00 2.81 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.28 0.00 13 H 8.74 4.55 0.00 3.29 3.37 0.00 5.65 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.11 2.99 0.00 4.09 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 15 S 8.54 4.36 0.00 4.08 4.22 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 16 H 8.29 4.14 0.00 2.92 3.01 0.00 5.78 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 17 R 7.49 3.46 0.00 1.70 1.79 0.00 3.13 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.12 0.00 18 L 8.64 3.61 0.00 1.57 1.81 0.92 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 19 A 7.92 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 20 L 7.63 3.77 0.00 1.60 1.55 0.87 0.75 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 21 Y 7.17 4.04 0.00 2.43 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 22 R 7.74 4.04 0.00 2.00 2.05 0.00 3.15 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.90 0.00 23 N 8.00 4.64 0.00 2.88 2.85 0.00 0.00 6.85 6.95 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 24 Q 8.31 4.14 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.59 0.00 25 A 8.18 4.04 1.63 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 26 K 7.72 3.84 0.00 2.07 1.93 0.00 1.68 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.90 7.81 27 S 7.86 4.08 0.00 4.01 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 28 L 7.94 3.90 0.00 1.93 1.76 0.97 0.78 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 29 L 7.47 4.28 0.00 1.62 1.73 1.03 1.24 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 30 T 7.66 3.75 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 0.89 0.00 0.00 31 H 8.66 4.68 0.00 3.15 3.32 0.00 5.75 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.05 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 0.00 0.00 0.00 0.00 33 R 7.62 5.14 0.00 1.65 1.81 0.00 3.24 0.00 0.00 3.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 34 I 9.29 4.80 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.95 0.93 0.00 0.00 35 T 8.67 5.21 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 1.22 0.00 0.00 36 T 7.97 4.53 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 1.27 0.00 0.00 37 T 8.50 4.59 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 1.22 0.00 0.00 38 V 8.06 3.56 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 1.02 0.00 0.00 1.03 0.00 0.00 39 P 0.00 4.26 0.00 2.21 2.08 0.00 3.66 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 40 K 8.70 4.06 0.00 1.80 1.94 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.66 1.51 7.81 41 A 7.74 4.40 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 42 K 8.42 4.16 0.00 1.82 1.87 0.00 1.68 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.62 7.81 43 E 7.72 4.28 0.00 2.14 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 0.00 2.28 2.04 0.00 44 L 7.23 3.47 0.00 1.90 1.62 0.95 0.84 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 45 R 8.09 3.63 0.00 2.09 1.91 0.00 3.15 0.00 0.00 3.17 8.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 46 G 8.15 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 47 F 7.99 4.19 0.00 2.92 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 48 V 7.70 3.58 2.24 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 0.99 0.00 0.00 1.09 0.00 0.00 49 D 8.10 4.22 0.00 2.90 2.64 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 50 H 7.66 3.97 0.00 3.13 3.28 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 51 L 7.10 3.76 0.00 1.82 1.62 0.92 0.58 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 52 I 8.43 3.62 1.61 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 1.48 0.67 0.59 0.00 0.00 53 H 8.16 3.86 0.00 2.40 3.12 0.00 5.74 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.48 4.07 0.00 1.89 1.64 0.86 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.15 3.46 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 56 K 8.02 3.79 0.00 1.68 1.80 0.00 1.66 0.00 0.00 1.45 0.00 0.00 2.95 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.51 1.44 7.81 57 R 6.91 4.11 0.00 1.96 1.80 0.00 3.15 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 58 G 8.92 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 0.00 0.00 0.00 59 D 8.39 4.00 0.00 3.02 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 60 L 8.24 4.09 0.00 1.78 1.74 0.94 0.91 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 61 H 8.39 4.04 0.00 3.28 3.34 0.00 5.93 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 62 A 8.28 4.01 1.50 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 63 R 7.87 4.02 0.00 2.18 1.93 0.00 3.02 0.00 0.00 2.97 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.50 0.00 64 R 8.20 3.83 0.00 1.89 1.98 0.00 3.21 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.89 0.00 65 L 7.73 3.93 0.00 1.70 1.69 0.78 0.57 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 66 V 7.40 3.71 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 0.99 0.00 0.00 1.07 0.00 0.00 67 L 8.14 4.14 0.00 1.60 1.80 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.46 4.05 0.00 1.97 1.94 0.00 3.32 0.00 0.00 3.23 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.94 0.00 69 D 7.83 4.73 0.00 2.74 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 70 L 7.81 4.37 0.00 1.72 1.65 0.95 0.96 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 71 Q 8.39 4.29 0.00 2.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.94 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 72 D 7.36 4.43 0.00 2.82 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 73 V 8.32 3.63 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 0.92 0.00 0.00 0.89 0.00 0.00 74 K 8.25 3.79 0.00 1.99 1.91 0.00 1.65 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.57 7.81 75 L 8.14 3.97 0.00 1.98 1.83 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 76 V 7.66 3.51 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 0.55 0.00 0.00 0.86 0.00 0.00 77 R 8.16 3.88 0.00 2.05 2.00 0.00 3.22 0.00 0.00 3.25 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 78 K 8.14 4.01 0.00 1.82 2.04 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.52 7.81 79 L 8.16 4.09 0.00 2.00 1.97 1.09 0.93 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 80 F 8.70 4.08 0.00 3.19 3.14 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 0.00 0.00 0.00 81 D 8.50 4.74 0.00 2.83 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 82 E 7.30 5.68 0.00 2.16 2.26 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 2.16 2.06 0.00 83 I 7.29 3.68 2.09 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.99 1.05 0.00 0.00 84 A 7.98 4.43 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 85 P 0.00 4.17 0.00 2.15 2.09 0.00 3.74 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 86 R 7.24 3.91 0.00 1.07 1.80 0.00 2.97 0.00 0.00 3.14 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 87 Y 7.70 4.70 0.00 3.17 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 88 R 7.13 3.31 0.00 1.83 1.83 0.00 3.24 0.00 0.00 3.22 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 89 D 7.69 4.77 0.00 2.71 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 90 R 8.61 4.34 0.00 1.71 1.87 0.00 3.00 0.00 0.00 3.04 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.36 0.00 91 Q 8.87 4.42 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.25 0.00 0.00 0.00 0.00 0.00 2.32 2.30 0.00 92 G 10.81 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 93 G 8.75 3.74 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 0.00 0.00 0.00 94 Y 8.49 4.36 0.00 2.74 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 0.00 0.00 0.00 95 T 7.89 5.01 4.52 0.00 0.00 0.00 0.00 0.00 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 96 R 8.99 4.71 0.00 1.90 1.72 0.00 3.10 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 97 V 8.45 4.99 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 0.91 0.00 0.00 0.93 0.00 0.00 98 L 9.40 4.80 0.00 1.50 1.52 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.71 4.50 0.00 1.64 1.75 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.47 7.81 100 L 8.31 4.45 0.00 1.78 1.65 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.42 4.33 1.20 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 0.00 0.00 0.00 0.00 0.00 102 E 9.14 3.89 0.00 2.03 2.29 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 2.14 2.24 0.00 103 R 7.99 4.21 0.00 2.04 1.95 0.00 3.08 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 104 R 8.33 4.08 0.00 1.91 2.05 0.00 3.09 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 105 R 8.49 4.34 0.00 1.84 1.89 0.00 3.35 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 106 G 7.70 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 D 8.47 4.42 0.00 2.74 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 0.00 108 G 8.91 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 0.00 109 A 9.14 4.09 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 0.00 110 P 0.00 4.36 0.00 2.13 2.24 0.00 3.70 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 111 L 8.55 4.54 0.00 1.60 1.63 0.96 1.01 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 0.00 112 A 8.98 5.10 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 0.00 113 L 9.54 4.92 0.00 1.78 1.58 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 114 V 9.09 5.10 2.10 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 0.96 0.00 0.00 0.94 0.00 0.00 115 E 9.10 5.17 0.00 2.05 2.01 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 2.33 2.15 0.00 116 L 8.52 4.92 0.00 1.66 1.90 1.09 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 117 V 7.77 3.62 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 0.73 0.00 0.00 0.95 0.00 0.00 118 E 8.85 4.79 0.00 2.10 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 2.00 2.05 0.00