NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 C 5.0279 8.2976 118.1114 56.4630 42.2464 172.5019 4 S 4.1453 7.8856 111.7771 55.4630 66.3793 167.8583 5 V 4.3594 8.8503 119.6409 60.5969 35.1777 173.9215 6 D 5.0913 8.5300 123.8284 52.8923 42.3617 175.7885 7 I 4.7617 8.6581 124.1696 59.4758 41.0703 174.4768 8 Q 5.1226 9.7109 124.8250 54.0407 32.2478 174.7555 9 G 4.2556 9.0367 110.6515 44.6788 0.0000 172.2716 10 N 5.5223 8.4190 124.8423 50.5520 40.4015 175.6118 11 D 4.4744 8.7538 116.9639 57.4427 41.0536 177.8175 12 Q 4.3331 8.2346 116.4373 55.4637 29.0557 175.6011 13 M 3.1149 7.7200 115.4916 56.5467 29.9260 177.0479 14 Q 4.5755 8.1318 116.2514 54.2054 33.3572 175.2853 15 F 5.5918 8.6734 120.2045 56.5260 40.6624 175.0922 16 N 4.9501 8.4306 119.9933 53.0819 37.8906 175.1539 17 T 4.2751 7.3996 108.8940 62.8422 70.2924 171.5319 18 N 5.4127 8.5191 123.2291 52.3798 39.2797 173.2764 19 A 5.2314 8.1979 120.6965 51.6455 22.6412 176.1923 20 I 4.5706 9.6613 124.7164 59.8216 40.2268 174.8572 21 T 4.9330 8.5431 122.3829 61.7201 71.1816 173.4744 22 V 3.8855 8.8728 127.0129 60.5727 34.0141 174.2537 23 D 4.4878 8.6457 128.1735 53.7332 40.9952 176.6255 24 K 4.0367 8.6850 126.8459 58.9103 32.6054 177.8590 25 S 4.2421 8.3653 114.5559 61.0283 62.5919 173.9744 26 C 4.5073 8.5062 117.8393 57.0645 34.6946 173.4939 27 K 4.2258 8.5316 121.2893 57.2025 33.6056 176.1664 28 Q 4.8690 7.8371 117.3655 54.0260 33.0083 174.0381 29 F 4.9320 8.4585 124.5061 56.5213 42.8832 173.6811 30 T 4.6838 7.3659 121.4710 61.4782 71.7678 172.9025 31 V 3.9816 8.2610 126.6613 61.0625 33.6904 174.1429 32 N 4.9102 8.6446 126.7759 51.6417 39.8171 173.4164 33 L 5.0337 8.5119 127.2526 53.8692 44.0491 175.5270 34 S 5.1724 9.1065 119.4778 57.0179 67.4815 172.5612 35 H 5.5699 8.9315 118.9061 52.6813 31.4796 170.5274 36 P 4.7286 0.0000 0.0000 62.8344 33.1861 175.8817 37 G 4.1169 7.8617 105.7799 45.2134 0.0000 172.3102 38 N 4.8808 9.2123 115.3862 53.6739 41.4307 175.7003 39 L 4.0485 8.1860 118.4306 54.1942 42.4007 175.0743 40 P 4.7105 0.0000 0.0000 61.8287 32.2893 176.8937 41 K 3.9323 8.7334 120.8670 59.7147 31.9397 177.5458 42 N 4.5836 8.1411 114.1348 54.2936 37.8977 175.5035 43 V 4.2010 8.1436 118.2028 64.0146 33.3798 175.6532 44 M 4.8850 7.6703 116.8223 54.5204 32.3504 175.2079 45 G 3.9644 8.0676 105.5599 46.5970 0.0000 173.5272 46 H 5.4829 9.2921 120.6750 53.8706 32.7920 172.2192 47 N 5.6520 8.8291 117.1701 51.1201 41.9388 172.5552 48 W 5.1674 9.3638 128.9231 55.7075 33.3419 174.0446 49 V 4.4554 8.1995 127.5548 60.6026 34.2227 173.7099 50 L 4.6888 7.9973 129.4625 53.1592 44.5680 175.2508 51 S 5.0973 8.5927 119.5372 57.4415 66.9791 173.8254 52 T 4.6443 8.5785 110.0531 61.1286 69.3785 174.9655 53 A 4.0885 8.6247 124.5894 55.4427 18.0535 180.1859 54 A 3.9173 7.8582 117.8411 55.1065 18.8736 178.7558 55 D 4.5034 7.8811 115.8351 55.6165 41.0167 178.1564 56 M 3.6037 7.5434 120.0015 58.8181 32.0246 177.7654 57 Q 3.8857 7.9489 118.9111 59.0223 29.2323 178.3279 58 G 3.5821 7.9599 106.1906 47.8162 0.0000 175.5751 59 V 3.6481 7.7814 121.0186 65.6090 31.5191 178.2922 60 V 3.6237 7.9905 118.4165 66.0885 31.4363 178.1021 61 T 3.8222 8.0744 109.6921 65.1969 68.5157 176.3634 62 D 4.5514 8.0850 120.9575 56.1357 41.1370 178.9543 63 G 3.9045 7.9962 108.0572 47.6468 0.0000 175.7774 64 M 4.2194 8.2912 121.6826 58.0327 31.7064 178.8080 65 A 4.1153 7.7766 119.5656 55.1479 18.8195 179.6141 66 S 4.2341 8.0342 113.3805 59.0011 62.9218 175.7948 67 G 4.2869 7.7343 106.0360 44.7305 0.0000 174.0817 68 L 2.6788 7.9364 119.8963 57.7994 41.9018 178.8150 69 D 4.4561 7.8471 115.6401 56.0813 41.1952 176.8657 70 K 4.4456 7.6341 118.4381 55.7608 32.6066 175.8856 71 D 4.3672 8.3841 115.8828 55.2572 39.1428 173.3295 72 Y 4.0704 7.5921 112.8927 58.9322 36.0188 170.4475 73 L 4.7682 7.7108 116.3507 52.6518 46.4363 176.7165 74 K 4.3764 8.4798 123.2801 54.6983 32.7105 174.4359 75 P 4.4028 0.0000 0.0000 64.5958 31.5769 175.5290 76 D 4.3632 8.9139 121.4099 54.9259 38.7901 173.1852 77 D 4.3650 7.8683 118.8759 54.4836 41.1167 177.1470 78 S 4.3286 8.6352 121.9005 60.5895 63.3357 175.5097 79 R 4.0075 8.4242 120.0463 57.9260 30.1191 176.6354 80 V 4.0343 7.4204 117.6986 61.9089 31.0072 175.5465 81 I 3.9225 8.4536 129.9739 64.3330 37.4907 176.4700 82 A 4.6135 7.3665 120.3445 51.7170 22.1841 174.8916 83 H 5.2753 8.5348 112.9052 55.3959 31.0796 173.4975 84 T 4.6277 8.7127 111.1477 60.5714 71.2851 173.8035 85 K 4.5652 9.0777 121.7723 55.1506 33.9129 176.6173 86 L 4.6326 8.6721 124.5344 55.0561 42.7272 176.0998 87 I 4.6978 9.3175 119.4712 59.2234 41.3419 175.1942 88 G 4.3058 9.1619 112.4019 44.1749 0.0000 172.9468 89 S 4.2948 7.8039 114.5266 59.8074 63.0654 174.6926 90 G 3.9886 9.1697 112.7585 45.4244 0.0000 173.3926 91 E 4.5688 7.8626 119.4739 56.0385 31.4182 175.5923 92 K 4.7648 8.2482 117.4251 56.5571 35.2547 174.6573 93 D 4.7494 9.0137 120.8931 53.4035 45.0082 174.0746 94 S 5.4194 8.6733 120.4641 56.7306 66.5833 173.7433 95 V 4.5491 8.4419 120.9414 60.4528 34.6902 174.1869 96 T 5.6265 8.8925 120.0530 60.8504 71.4397 173.1343 97 F 5.0944 7.8346 118.9003 54.8604 42.4910 173.2264 98 D 4.9190 8.8164 119.4625 53.7499 41.5330 177.2012 99 V 3.9295 8.2972 127.0208 66.0876 31.5866 177.4382 100 S 4.4734 8.5479 113.8024 59.5568 62.6523 174.9601 101 K 4.2360 8.3984 120.1795 57.3442 32.2747 176.8280 102 L 4.6220 7.5784 118.8776 52.6554 43.6603 175.5995 103 K 4.7244 9.3833 122.5757 54.3248 34.5560 175.4187 104 E 4.1659 8.6307 124.9086 57.5989 29.9803 177.4018 105 G 3.9597 8.9668 111.8076 45.2760 0.0000 173.2877 106 E 4.0364 7.1780 118.2996 55.5379 30.6155 175.4474 107 Q 4.3154 8.0435 122.5712 55.0119 30.3335 174.2126 108 Y 5.3732 8.0145 122.4983 56.4363 41.4427 174.8108 109 M 5.4764 9.3023 122.1081 53.5077 35.8508 174.6406 110 F 5.0060 8.4986 117.9874 55.2429 41.2637 174.2246 111 F 5.1991 7.6986 114.6202 56.7794 41.8250 171.7173 112 C 5.5414 8.8440 119.3434 57.0769 32.6513 174.7625 113 T 4.0046 9.1279 117.6734 64.1508 68.5469 173.7597 114 P 4.1372 0.0000 0.0000 63.9195 32.5024 175.9403 115 H 4.5722 7.6027 116.6551 53.3701 29.2195 172.3220 116 P 4.5035 0.0000 0.0000 64.6332 31.5988 178.1461 117 F 4.3372 7.2405 112.9339 58.4483 38.6638 175.6384 118 M 4.2839 7.6149 123.1973 54.3606 30.4625 174.8515 119 K 4.9831 7.8568 121.8435 55.9312 36.4704 174.4291 120 G 3.6150 7.4386 106.3549 46.1576 0.0000 172.3593 121 T 5.2338 8.2133 109.5927 60.0686 71.1500 173.5992 122 L 5.3893 8.9072 124.2628 53.9003 45.2660 175.3447 123 T 4.9936 9.0223 122.0155 61.7203 73.1557 174.3421 124 L 4.9851 8.5301 122.7150 54.5303 41.8584 176.8391 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 3 C 8.30 5.03 0.00 2.84 3.38 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 4 S 7.89 4.15 0.00 3.60 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 5 V 8.85 4.36 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 0.49 0.00 0.00 0.84 0.00 0.00 6 D 8.53 5.09 0.00 2.49 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 7 I 8.66 4.76 1.57 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.38 0.75 0.00 0.00 8 Q 9.71 5.12 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 9 G 9.04 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 0.00 0.00 0.00 0.00 10 N 8.42 5.52 0.00 2.90 3.02 0.00 0.00 6.85 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 11 D 8.75 4.47 0.00 2.81 2.80 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 12 Q 8.23 4.33 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 13 M 7.72 3.11 0.00 2.29 2.30 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.33 0.00 14 Q 8.13 4.58 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.73 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 15 F 8.67 5.59 0.00 3.24 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 16 N 8.43 4.95 0.00 2.92 2.98 0.00 0.00 6.72 7.73 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 17 T 7.40 4.28 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 1.17 0.00 0.00 18 N 8.52 5.41 0.00 2.85 3.09 0.00 0.00 5.89 8.04 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 19 A 8.20 5.23 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 20 I 9.66 4.57 1.97 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.58 0.95 0.00 0.00 21 T 8.54 4.93 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 1.21 0.00 0.00 22 V 8.87 3.89 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 0.60 0.00 0.00 -0.19 0.00 0.00 23 D 8.65 4.49 0.00 2.75 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 24 K 8.69 4.04 0.00 1.91 1.95 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.45 7.81 25 S 8.37 4.24 0.00 3.86 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 26 C 8.51 4.51 0.00 3.07 3.20 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 27 K 8.53 4.23 0.00 1.69 1.83 0.00 1.61 0.00 0.00 1.81 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.45 7.81 28 Q 7.84 4.87 0.00 1.80 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.69 0.00 0.00 0.00 0.00 0.00 2.20 2.31 0.00 29 F 8.46 4.93 0.00 2.67 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 0.00 0.00 0.00 30 T 7.37 4.68 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 0.96 0.00 0.00 31 V 8.26 3.98 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 -0.27 0.00 0.00 -0.06 0.00 0.00 32 N 8.64 4.91 0.00 2.65 2.62 0.00 0.00 6.15 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 33 L 8.51 5.03 0.00 1.73 1.69 1.20 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 34 S 9.11 5.17 0.00 3.90 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 35 H 8.93 5.57 0.00 3.30 3.31 0.00 5.62 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 36 P 0.00 4.73 0.00 2.20 2.20 0.00 3.91 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.02 0.00 37 G 7.86 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 0.00 0.00 0.00 38 N 9.21 4.88 0.00 2.62 2.83 0.00 0.00 6.98 8.07 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 39 L 8.19 4.05 0.00 1.83 1.63 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.71 0.00 2.22 2.17 0.00 3.73 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 2.25 1.95 0.00 41 K 8.73 3.93 0.00 1.82 1.92 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.50 7.81 42 N 8.14 4.58 0.00 2.90 2.95 0.00 0.00 5.79 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 43 V 8.14 4.20 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 0.81 0.00 0.00 0.95 0.00 0.00 44 M 7.67 4.89 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.61 0.00 45 G 8.07 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 46 H 9.29 5.48 0.00 3.18 3.20 0.00 5.56 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.83 5.65 0.00 2.91 3.00 0.00 0.00 5.50 8.88 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 48 W 9.36 5.17 0.00 3.42 3.12 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 49 V 8.20 4.46 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 0.00 0.00 0.68 0.00 0.00 0.85 0.00 0.00 50 L 8.00 4.69 0.00 0.83 1.12 0.91 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 51 S 8.59 5.10 0.00 4.13 4.07 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 52 T 8.58 4.64 4.24 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 1.43 0.00 0.00 53 A 8.62 4.09 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 54 A 7.86 3.92 1.28 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 55 D 7.88 4.50 0.00 2.75 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 56 M 7.54 3.60 0.00 1.82 1.79 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.76 0.00 57 Q 7.95 3.89 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 58 G 7.96 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.78 3.65 2.38 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 1.19 0.00 0.00 1.09 0.00 0.00 60 V 7.99 3.62 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 1.05 0.00 0.00 0.73 0.00 0.00 61 T 8.07 3.82 4.23 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 62 D 8.09 4.55 0.00 2.78 2.80 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 63 G 8.00 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 64 M 8.29 4.22 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.83 0.00 65 A 7.78 4.12 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 66 S 8.03 4.23 0.00 4.12 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 67 G 7.73 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 0.00 0.00 0.00 0.00 68 L 7.94 2.68 0.00 1.42 1.47 0.87 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 69 D 7.85 4.46 0.00 2.63 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 70 K 7.63 4.45 0.00 1.94 1.85 0.00 1.94 0.00 0.00 1.80 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.37 7.81 71 D 8.38 4.37 0.00 2.80 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 72 Y 7.59 4.07 0.00 3.19 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 73 L 7.71 4.77 0.00 1.70 1.44 0.67 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.48 4.38 0.00 1.81 1.86 0.00 1.79 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.43 7.81 75 P 0.00 4.40 0.00 2.08 2.01 0.00 3.89 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 76 D 8.91 4.36 0.00 2.82 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 77 D 7.87 4.37 0.00 2.96 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 78 S 8.64 4.33 0.00 4.03 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 79 R 8.42 4.01 0.00 2.00 2.07 0.00 3.17 0.00 0.00 3.16 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.58 0.00 80 V 7.42 4.03 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 0.83 0.00 0.00 0.94 0.00 0.00 81 I 8.45 3.92 1.52 0.00 0.00 0.58 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 0.56 0.56 0.00 0.00 82 A 7.37 4.61 1.01 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 83 H 8.53 5.28 0.00 3.08 3.20 0.00 5.71 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 84 T 8.71 4.63 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 1.35 0.00 0.00 85 K 9.08 4.57 0.00 1.67 1.83 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.58 7.81 86 L 8.67 4.63 0.00 1.74 1.74 1.16 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 87 I 9.32 4.70 1.94 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.93 1.04 0.00 0.00 88 G 9.16 4.31 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 0.00 89 S 7.80 4.29 0.00 4.07 3.83 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 0.00 0.00 0.00 90 G 9.17 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 91 E 7.86 4.57 0.00 2.16 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 2.33 2.25 0.00 92 K 8.25 4.76 0.00 1.71 1.74 0.00 1.59 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.32 1.41 7.81 93 D 9.01 4.75 0.00 2.82 2.52 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 0.00 94 S 8.67 5.42 0.00 3.67 3.59 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 95 V 8.44 4.55 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 0.96 0.00 0.00 1.11 0.00 0.00 96 T 8.89 5.63 4.19 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 1.14 0.00 0.00 97 F 7.83 5.09 0.00 3.10 3.12 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 98 D 8.82 4.92 0.00 2.76 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 99 V 8.30 3.93 2.18 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 0.94 0.00 0.00 0.90 0.00 0.00 100 S 8.55 4.47 0.00 4.05 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 0.00 101 K 8.40 4.24 0.00 1.81 1.83 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.64 7.81 102 L 7.58 4.62 0.00 1.81 1.62 1.01 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 103 K 9.38 4.72 0.00 1.85 1.70 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.42 7.81 104 E 8.63 4.17 0.00 2.02 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 2.35 2.35 0.00 105 G 8.97 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 0.00 106 E 7.18 4.04 0.00 1.85 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 1.47 1.94 0.00 107 Q 8.04 4.32 0.00 1.91 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.62 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 108 Y 8.01 5.37 0.00 3.38 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 0.00 109 M 9.30 5.48 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.60 0.00 110 F 8.50 5.01 0.00 1.99 2.86 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 0.00 0.00 0.00 111 F 7.70 5.20 0.00 3.02 3.06 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 0.00 112 C 8.84 5.54 0.00 3.10 2.87 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 0.00 113 T 9.13 4.00 4.30 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 0.00 0.00 0.00 1.41 0.00 0.00 114 P 0.00 4.14 0.00 1.75 1.43 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.99 0.00 115 H 7.60 4.57 0.00 2.69 2.08 0.00 5.65 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 P 0.00 4.50 0.00 2.07 2.08 0.00 3.65 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.91 0.00 117 F 7.24 4.34 0.00 3.13 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 0.00 118 M 7.61 4.28 0.00 1.16 1.74 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 2.22 0.00 119 K 7.86 4.98 0.00 1.66 1.91 0.00 1.56 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.38 7.81 120 G 7.44 3.61 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 0.00 0.00 0.00 121 T 8.21 5.23 4.33 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 1.24 0.00 0.00 122 L 8.91 5.39 0.00 2.01 1.77 0.96 0.89 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 0.00 123 T 9.02 4.99 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 1.25 0.00 0.00 124 L 8.53 4.99 0.00 1.70 1.60 0.99 0.98 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