NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3607 8.3049 118.7914 55.0904 32.4085 174.3699 2 N 4.1753 8.3496 126.0903 52.6866 35.3643 173.6252 3 T 3.6241 7.8208 113.9970 64.0769 70.4064 173.6374 4 K 4.3068 8.1397 125.9608 55.0218 33.2332 175.2245 5 Y 4.7908 8.8461 124.7642 56.9217 39.7147 175.8771 6 N 4.8294 8.6353 120.2241 52.3014 41.1322 176.5774 7 K 3.9267 8.5356 123.9718 60.0194 32.4814 179.2470 8 E 3.9308 8.1533 118.2187 58.8603 29.3427 178.8821 9 F 4.2033 8.2160 120.4986 61.4893 39.5463 176.9446 10 L 3.5739 8.0466 118.4535 57.5543 41.2797 179.7546 11 L 3.5464 7.6923 118.9372 57.7739 41.5669 178.8144 12 Y 3.9487 7.8203 119.4492 60.6879 38.7531 177.9528 13 L 3.9776 8.1656 121.3090 57.7288 42.0218 178.5100 14 A 4.0402 8.2698 121.4775 55.1751 18.3148 179.4634 15 G 3.6430 7.6586 103.7243 48.2902 0.0000 175.5582 16 F 3.8277 8.0117 123.5793 60.5303 39.3264 177.4264 17 V 3.6870 8.4453 118.4784 66.0668 31.1842 177.7199 18 D 4.4993 8.2985 118.1350 57.7155 40.6167 178.2389 19 G 3.5597 7.7307 106.1719 45.5296 0.0000 174.2898 20 D 4.7402 8.3600 118.7027 52.2841 41.6068 176.4663 21 G 4.4024 7.3701 107.8309 45.1524 0.0000 173.3145 22 S 4.7477 9.0252 113.6979 56.7997 66.2493 172.6603 23 I 5.0334 8.5209 127.2767 59.7537 39.2680 174.8853 24 I 4.7174 8.9635 127.8429 59.2610 40.6309 174.4570 25 A 5.2798 8.7466 127.6048 50.2980 21.4611 175.2337 26 Q 4.6736 9.2470 120.1432 54.0945 33.6843 174.4623 27 I 4.7986 8.4182 121.7804 59.7520 39.5448 175.0927 28 K 4.6391 9.2642 127.7930 53.7171 34.2720 174.3837 29 P 4.6804 0.0000 0.0000 62.8744 32.3806 175.8852 30 N 4.4118 9.0517 119.9547 53.2752 41.7765 175.1929 31 Q 4.1175 9.1039 126.6308 57.9058 29.0693 177.2131 32 S 4.5354 8.2125 111.3309 58.1070 63.8840 174.3925 33 S 4.4826 7.9108 118.5231 57.4900 63.9163 175.0902 34 K 3.6830 8.1373 125.4382 59.4012 31.8225 177.7969 35 F 4.8626 7.4905 115.3490 57.1582 39.4441 176.7656 36 K 4.3242 9.2228 118.5492 57.0403 29.8748 175.0418 37 H 5.3983 7.6172 114.1740 54.5625 33.3397 172.7670 38 R 4.7847 9.3087 122.1577 54.5530 32.6575 174.6917 39 L 4.8552 8.7399 126.1868 54.4028 42.7939 176.0294 40 S 4.8173 9.2046 118.4884 56.3749 65.4154 172.4481 41 L 5.3090 8.6014 125.7539 53.3373 45.1169 175.4719 42 T 4.9313 9.2490 119.5686 61.8219 73.0488 172.4200 43 F 5.3490 9.3712 128.5492 56.6876 41.7966 174.1628 44 Q 4.6775 8.4563 126.2635 54.2214 33.0327 173.5565 45 V 4.5868 8.5740 125.0843 61.4754 34.3740 174.3184 46 T 5.1838 8.1628 124.1877 62.6446 70.4257 174.0078 47 Q 4.5624 8.8779 123.2988 54.5389 33.3550 173.1622 48 K 4.1113 8.7787 125.8559 57.5020 32.7044 177.6626 49 T 4.0621 8.8712 123.9519 66.4897 68.6458 176.4181 50 Q 4.1355 8.2281 118.3877 58.5358 28.6356 177.3987 51 R 4.6756 8.2067 117.8849 55.9386 30.6707 178.1304 52 R 3.9571 8.2448 121.8868 58.9260 29.8080 177.8587 53 W 4.4611 8.4743 116.5309 59.9664 27.4653 177.9194 54 F 3.1102 6.5971 120.1323 60.4902 39.0556 176.9060 55 L 4.0716 7.6221 118.1899 57.7424 41.4515 178.7639 56 D 4.4365 8.4539 119.3130 57.4801 40.7394 178.7372 57 K 3.8304 8.2484 120.0037 59.6996 32.0362 178.6325 58 L 3.7140 7.4283 118.6678 57.4594 41.3010 179.4247 59 V 3.7370 7.7504 117.7864 66.2892 31.1831 177.5022 60 D 4.2952 7.4963 116.3261 57.2934 41.1520 177.8067 61 E 3.9002 8.1167 118.3400 59.5460 29.5920 179.1291 62 I 4.0243 8.1299 118.7461 62.1480 37.3033 177.4634 63 G 4.0384 9.7070 106.9627 45.3307 0.0000 172.6993 64 V 4.3810 7.3269 110.9139 60.5389 35.8106 173.9345 65 G 3.8303 10.3911 107.8127 45.3919 0.0000 171.2581 66 Y 4.9109 7.5198 115.2572 56.0874 41.7869 173.6694 67 V 4.8614 8.5155 119.1831 61.1093 34.1827 174.5110 68 R 4.8146 8.9090 126.7362 54.7491 33.4413 173.6363 69 D 5.3032 8.6731 124.7265 53.3840 43.3497 176.7549 70 S 4.2682 9.4969 116.7126 58.3514 65.1753 175.5112 71 G 3.8732 8.2767 120.4712 47.1329 0.0000 173.6229 72 S 4.6147 8.7478 120.4671 57.7893 63.5240 173.1398 73 V 5.0071 7.6045 113.8322 59.9625 35.8319 174.5138 74 S 5.3212 9.3093 117.5506 57.0273 67.0631 173.1479 75 N 5.4434 9.1318 118.6885 51.7504 42.6905 173.3716 76 Y 4.5377 8.7914 125.5451 57.5295 40.4287 174.2970 77 I 4.5871 7.2090 126.0787 59.2539 41.7025 173.9426 78 L 4.8213 8.7832 128.1168 53.6562 44.5030 176.6931 79 S 4.9150 8.8163 119.4554 56.1735 65.4076 174.4465 80 E 4.1232 8.1489 122.3226 55.7902 30.3231 176.7875 81 I 3.8307 8.5904 130.1879 65.0897 37.3995 179.2104 82 K 4.0611 8.0200 124.1039 59.3897 31.7048 179.1351 83 P 4.6378 0.0000 0.0000 65.4317 31.0637 178.2407 84 L 4.0699 8.1564 120.4006 58.2640 42.0037 178.3592 85 H 4.1176 8.6136 118.4695 59.2286 29.4525 176.6919 86 N 4.3935 8.3710 118.8908 56.6707 38.7426 176.5764 87 F 4.3475 8.7016 122.1962 61.5555 39.5316 177.1687 88 L 3.5385 8.3021 118.8912 57.6370 41.0758 179.4188 89 T 3.7646 7.6917 115.2271 67.1006 68.5537 176.1899 90 Q 4.1558 7.5166 117.5376 58.4936 29.0464 178.0315 91 L 3.9982 7.8055 121.8668 57.6890 41.8890 178.2825 92 Q 3.8169 8.1573 120.1130 59.1240 28.6371 177.1956 93 P 4.0017 0.0000 0.0000 64.6752 31.2838 176.8943 94 F 4.7671 7.5964 113.8716 57.2367 39.9363 176.2690 95 L 4.2396 7.4946 121.4736 54.6976 42.0474 176.6326 96 K 4.4265 9.8676 121.4320 57.6217 34.2741 177.6461 97 L 4.3221 8.2955 116.4248 55.7363 42.4924 177.4859 98 K 4.9124 8.0274 115.9251 55.2041 32.9848 177.7292 99 Q 3.8945 8.1421 122.6797 59.2059 28.8101 178.1761 100 K 3.9109 7.9365 120.1003 59.5958 32.1969 178.6230 101 Q 3.9628 8.0560 117.6419 58.8491 28.7103 178.3878 102 A 4.0192 7.9915 121.7924 55.4098 18.4317 179.5283 103 N 4.2869 8.2618 114.8996 56.1946 38.4662 177.7210 104 L 3.8980 8.1409 120.7981 57.6949 41.6404 179.5968 105 V 3.6466 8.1312 118.4933 66.0987 31.4571 178.0660 106 L 3.9935 8.0380 118.6633 57.6363 41.1971 179.4700 107 K 4.0989 7.7693 118.6687 59.4198 32.4341 178.6174 108 I 4.2146 8.1990 120.3931 64.7433 37.1011 178.2969 109 I 3.7961 8.0680 120.6094 64.7490 36.7552 178.4138 110 E 4.1122 8.2683 118.0189 58.8381 29.6054 178.4368 111 Q 4.4714 8.0865 116.4185 56.2107 28.6709 177.6069 112 L 4.0499 7.7878 121.1224 57.3234 41.4971 177.1398 113 P 4.2843 0.0000 0.0000 65.7270 31.1497 177.4672 114 S 4.6430 8.0643 109.5913 58.7393 63.8209 175.7046 115 A 4.1379 8.1579 125.3699 55.3042 18.2474 179.2068 116 K 4.4856 7.8423 111.7761 57.3929 32.0012 177.2740 117 E 4.6091 8.0701 119.1924 56.6614 31.6375 176.9984 118 S 4.7777 7.7525 109.4233 54.7981 66.4429 172.5271 119 P 3.1410 0.0000 0.0000 66.1872 30.8641 178.4846 120 D 4.2763 7.8628 117.9882 56.7428 40.7380 178.6704 121 K 3.8883 7.8968 119.8850 59.1897 32.3275 178.4653 122 F 4.0157 8.4168 121.3290 61.2774 39.3594 177.0436 123 L 3.8007 8.1773 118.9636 57.6876 41.5013 179.1965 124 E 3.6253 7.6631 118.7826 59.0821 29.5562 178.9343 125 V 2.0000 6.7478 118.0115 65.6578 31.4361 177.6423 126 C 3.8500 7.4431 116.5808 62.9742 27.8902 176.2856 127 T 4.1943 7.3404 112.3707 63.9594 68.3912 176.7681 128 W 4.4206 7.5807 121.5575 59.4471 28.9681 178.5324 129 V 3.6198 7.8082 118.3726 66.1191 30.7509 177.4873 130 D 4.4026 8.1031 118.5678 57.9390 40.7320 179.2635 131 Q 4.1433 8.1566 118.0029 58.9194 28.6394 179.0396 132 I 3.7422 7.7967 120.3365 64.2434 36.9400 178.2930 133 A 3.9925 7.8746 120.4212 54.9318 18.2676 179.0157 134 A 4.1044 8.0341 118.6166 55.5958 18.5355 179.6048 135 L 4.0956 7.6997 115.9140 57.0375 41.8720 177.8563 136 N 4.6265 7.5234 114.9558 53.0040 39.6498 175.4995 137 D 4.6425 8.1429 120.4997 53.3201 39.4117 176.6864 138 S 4.3076 7.6296 114.3599 58.2992 63.4699 173.7222 139 K 4.6873 8.5104 123.4243 56.0441 34.7201 176.7272 140 T 4.6572 7.7296 107.6328 60.9705 69.3953 173.7755 141 R 4.1166 8.0851 121.6339 56.9612 30.9191 174.7679 142 K 4.3199 8.6849 123.5116 58.0238 34.1423 176.0952 143 T 4.3880 7.8383 115.2395 62.5733 69.2227 174.5508 144 T 4.7224 8.5704 117.1315 59.0062 73.2453 174.7876 145 S 4.0737 8.8441 115.6622 61.7731 62.3240 176.6035 146 E 3.9687 7.7998 121.0944 59.3456 29.2244 178.8683 147 T 4.0232 7.8451 114.5473 66.8354 68.6634 176.1117 148 V 3.6331 7.3138 118.1089 66.0057 31.6558 177.5181 149 R 4.0038 7.9716 118.1621 57.4237 29.5443 175.4406 150 A 4.7741 7.5292 121.0572 51.2971 20.4227 176.5882 151 V 3.7865 8.7209 125.2796 63.8604 31.9172 172.9472 152 L 4.3641 7.2883 119.7685 54.8137 38.8745 176.7235 153 D 4.5193 7.8849 121.2357 54.3042 40.9335 176.7014 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 M 8.30 4.36 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.14 0.00 2 N 8.35 4.18 0.00 2.96 2.95 0.00 0.00 7.19 6.65 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 3 T 7.82 3.62 3.88 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 0.77 0.00 0.00 4 K 8.14 4.31 0.00 1.62 1.61 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.43 7.81 5 Y 8.85 4.79 0.00 3.33 3.25 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 6 N 8.64 4.83 0.00 2.84 2.80 0.00 0.00 6.67 7.42 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 7 K 8.54 3.93 0.00 1.88 1.83 0.00 1.78 0.00 0.00 1.84 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.42 7.81 8 E 8.15 3.93 0.00 2.08 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 2.38 2.36 0.00 9 F 8.22 4.20 0.00 3.08 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 10 L 8.05 3.57 0.00 1.71 1.71 1.24 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.69 3.55 0.00 1.60 1.54 0.71 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.82 3.95 0.00 3.06 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 13 L 8.17 3.98 0.00 1.40 1.25 1.07 1.29 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 14 A 8.27 4.04 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 15 G 7.66 3.64 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 0.00 0.00 0.00 16 F 8.01 3.83 0.00 2.78 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 17 V 8.45 3.69 2.41 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 1.20 0.00 0.00 1.38 0.00 0.00 18 D 8.30 4.50 0.00 2.84 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 19 G 7.73 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 20 D 8.36 4.74 0.00 1.76 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 21 G 7.37 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 0.00 0.00 0.00 0.00 22 S 9.03 4.75 0.00 3.76 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 23 I 8.52 5.03 1.95 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 1.69 0.98 1.01 0.00 0.00 24 I 8.96 4.72 1.89 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 1.17 0.76 0.97 0.00 0.00 25 A 8.75 5.28 1.23 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 0.00 0.00 0.00 26 Q 9.25 4.67 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.69 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 27 I 8.42 4.80 1.89 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.57 0.97 0.00 0.00 28 K 9.26 4.64 0.00 1.69 1.74 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.43 7.81 29 P 0.00 4.68 0.00 1.94 1.98 0.00 3.75 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.15 0.00 30 N 9.05 4.41 0.00 2.67 2.63 0.00 0.00 6.98 6.75 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 31 Q 9.10 4.12 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 32 S 8.21 4.54 0.00 3.95 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 33 S 7.91 4.48 0.00 3.96 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 34 K 8.14 3.68 0.00 1.37 1.40 0.00 1.35 0.00 0.00 1.30 0.00 0.00 2.52 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.30 0.54 7.81 35 F 7.49 4.86 0.00 2.19 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 36 K 9.22 4.32 0.00 1.86 1.86 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.55 7.81 37 H 7.62 5.40 0.00 3.16 3.34 0.00 5.80 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 R 9.31 4.78 0.00 1.83 1.81 0.00 3.30 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 39 L 8.74 4.86 0.00 1.66 1.63 0.79 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 40 S 9.20 4.82 0.00 3.89 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 L 8.60 5.31 0.00 1.63 1.59 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 42 T 9.25 4.93 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 1.17 0.00 0.00 43 F 9.37 5.35 0.00 3.21 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 44 Q 8.46 4.68 0.00 1.96 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.53 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 45 V 8.57 4.59 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 1.26 0.00 0.00 0.76 0.00 0.00 46 T 8.16 5.18 4.20 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 1.25 0.00 0.00 47 Q 8.88 4.56 0.00 2.18 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.89 0.00 0.00 0.00 0.00 0.00 2.08 2.26 0.00 48 K 8.78 4.11 0.00 1.87 1.70 0.00 1.78 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.52 7.81 49 T 8.87 4.06 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 1.25 0.00 0.00 50 Q 8.23 4.14 0.00 2.22 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.48 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 51 R 8.21 4.68 0.00 1.89 1.68 0.00 3.04 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 52 R 8.24 3.96 0.00 2.04 2.01 0.00 3.33 0.00 0.00 3.29 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 53 W 8.47 4.46 0.00 3.68 3.41 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 54 F 6.60 3.11 0.00 1.51 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 55 L 7.62 4.07 0.00 1.87 1.79 1.03 1.29 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 56 D 8.45 4.44 0.00 2.89 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 57 K 8.25 3.83 0.00 2.02 1.71 0.00 1.78 0.00 0.00 1.84 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.50 7.81 58 L 7.43 3.71 0.00 1.60 0.73 0.65 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.75 3.74 2.34 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 1.22 0.00 0.00 1.23 0.00 0.00 60 D 7.50 4.30 0.00 2.67 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 61 E 8.12 3.90 0.00 1.83 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 2.03 2.18 0.00 62 I 8.13 4.02 1.87 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.45 0.66 0.00 0.00 63 G 9.71 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 64 V 7.33 4.38 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 0.78 0.00 0.00 1.04 0.00 0.00 65 G 10.39 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 0.00 0.00 0.00 66 Y 7.52 4.91 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 67 V 8.52 4.86 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 0.91 0.00 0.00 1.08 0.00 0.00 68 R 8.91 4.81 0.00 2.08 1.71 0.00 3.28 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 69 D 8.67 5.30 0.00 2.62 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 70 S 9.50 4.27 0.00 3.79 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 71 G 8.28 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 0.00 0.00 0.00 72 S 8.75 4.61 0.00 4.01 4.10 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 73 V 7.60 5.01 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 0.74 0.00 0.00 1.00 0.00 0.00 74 S 9.31 5.32 0.00 3.81 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 75 N 9.13 5.44 0.00 2.47 2.54 0.00 0.00 6.96 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 76 Y 8.79 4.54 0.00 3.07 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 I 7.21 4.59 0.75 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.16 0.63 0.00 0.00 78 L 8.78 4.82 0.00 1.67 1.69 0.97 0.68 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 79 S 8.82 4.91 0.00 3.91 3.88 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 80 E 8.15 4.12 0.00 2.09 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 2.43 2.45 0.00 81 I 8.59 3.83 1.93 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 1.56 0.79 0.97 0.00 0.00 82 K 8.02 4.06 0.00 1.76 1.81 0.00 1.80 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.06 7.81 83 P 0.00 4.64 0.00 2.37 2.45 0.00 3.84 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 2.27 2.10 0.00 84 L 8.16 4.07 0.00 1.99 2.04 1.11 0.89 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 85 H 8.61 4.12 0.00 3.38 3.49 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.37 4.39 0.00 3.02 3.16 0.00 0.00 6.89 7.80 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 87 F 8.70 4.35 0.00 3.16 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 88 L 8.30 3.54 0.00 1.64 1.58 0.97 0.52 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 89 T 7.69 3.76 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 1.20 0.00 0.00 90 Q 7.52 4.16 0.00 2.17 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.99 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 91 L 7.81 4.00 0.00 0.87 1.04 0.73 0.63 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 92 Q 8.16 3.82 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.52 0.00 0.00 0.00 0.00 0.00 2.27 2.76 0.00 93 P 0.00 4.00 0.00 0.87 1.60 0.00 3.58 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.94 0.00 94 F 7.60 4.77 0.00 2.99 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 95 L 7.49 4.24 0.00 1.68 1.64 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 96 K 9.87 4.43 0.00 1.77 1.79 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.37 7.81 97 L 8.30 4.32 0.00 1.76 1.69 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.03 4.91 0.00 1.91 1.79 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.35 1.28 7.81 99 Q 8.14 3.89 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.91 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 100 K 7.94 3.91 0.00 1.83 1.76 0.00 1.73 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.48 1.49 7.81 101 Q 8.06 3.96 0.00 2.33 2.16 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 2.62 2.50 0.00 102 A 7.99 4.02 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 0.00 103 N 8.26 4.29 0.00 2.69 2.79 0.00 0.00 7.06 6.07 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 0.00 104 L 8.14 3.90 0.00 1.81 1.75 0.91 0.86 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 0.00 105 V 8.13 3.65 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 1.18 0.00 0.00 1.01 0.00 0.00 106 L 8.04 3.99 0.00 1.85 1.65 0.85 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 107 K 7.77 4.10 0.00 1.69 1.87 0.00 1.28 0.00 0.00 0.88 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.56 1.07 7.81 108 I 8.20 4.21 2.17 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.19 1.00 0.00 0.00 109 I 8.07 3.80 2.15 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 1.61 1.37 1.00 0.00 0.00 110 E 8.27 4.11 0.00 2.15 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 0.00 2.39 2.58 0.00 111 Q 8.09 4.47 0.00 2.32 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.79 0.00 0.00 0.00 0.00 0.00 2.83 3.10 0.00 112 L 7.79 4.05 0.00 1.74 1.79 0.99 1.41 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 0.00 113 P 0.00 4.28 0.00 2.07 2.18 0.00 3.78 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 2.08 2.15 0.00 114 S 8.06 4.64 0.00 4.05 4.14 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 0.00 115 A 8.16 4.14 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 0.00 116 K 7.84 4.49 0.00 1.80 1.81 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.75 1.59 7.81 117 E 8.07 4.61 0.00 2.14 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 2.27 2.41 0.00 118 S 7.75 4.78 0.00 3.93 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 0.00 119 P 0.00 3.14 0.00 2.04 1.76 0.00 3.80 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 1.99 2.02 0.00 120 D 7.86 4.28 0.00 2.67 2.71 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 0.00 0.00 0.00 121 K 7.90 3.89 0.00 1.86 1.95 0.00 1.39 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.60 1.52 7.81 122 F 8.42 4.02 0.00 3.43 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 0.00 123 L 8.18 3.80 0.00 1.77 1.58 0.84 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 124 E 7.66 3.63 0.00 1.89 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 0.00 1.77 2.29 0.00 125 V 6.75 2.00 1.68 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 0.76 0.00 0.00 0.43 0.00 0.00 126 C 7.44 3.85 0.00 2.92 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 0.00 127 T 7.34 4.19 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 1.17 0.00 0.00 128 W 7.58 4.42 0.00 3.53 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 0.00 129 V 7.81 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 1.04 0.00 0.00 0.96 0.00 0.00 130 D 8.10 4.40 0.00 2.96 2.74 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 0.00 131 Q 8.16 4.14 0.00 2.34 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.69 0.00 132 I 7.80 3.74 2.06 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 1.49 0.88 0.94 0.00 0.00 133 A 7.87 3.99 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 0.00 134 A 8.03 4.10 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 0.00 135 L 7.70 4.10 0.00 1.80 1.74 0.93 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 136 N 7.52 4.63 0.00 2.90 2.76 0.00 0.00 7.08 7.86 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 0.00 137 D 8.14 4.64 0.00 2.65 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 0.00 138 S 7.63 4.31 0.00 4.01 3.77 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 0.00 139 K 8.51 4.69 0.00 1.71 1.75 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.61 7.81 140 T 7.73 4.66 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 1.21 0.00 0.00 141 R 8.09 4.12 0.00 1.80 1.87 0.00 3.18 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 142 K 8.68 4.32 0.00 1.71 1.76 0.00 1.83 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.42 7.81 143 T 7.84 4.39 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 1.27 0.00 0.00 144 T 8.57 4.72 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 1.27 0.00 0.00 145 S 8.84 4.07 0.00 3.98 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 0.00 146 E 7.80 3.97 0.00 1.93 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 2.33 2.48 0.00 147 T 7.85 4.02 4.35 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 1.27 0.00 0.00 148 V 7.31 3.63 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 0.90 0.00 0.00 0.81 0.00 0.00 149 R 7.97 4.00 0.00 2.01 2.09 0.00 3.28 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 150 A 7.53 4.77 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 0.00 151 V 8.72 3.79 2.46 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 0.78 0.00 0.00 0.86 0.00 0.00 152 L 7.29 4.36 0.00 1.62 1.62 0.91 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 153 D 7.88 4.52 0.00 2.68 2.58 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