NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 H 4.8957 8.4444 120.6545 55.9417 31.9806 172.9982 1 M 4.7007 8.2378 117.3207 53.4168 35.8234 172.0058 2 R 5.2818 8.4792 124.0235 54.7466 33.4342 174.4817 3 C 4.7462 8.7826 116.2741 56.9276 33.5523 172.5434 4 R 4.6096 8.2324 120.3144 54.7796 31.5296 175.6913 5 V 4.0040 8.1285 126.1923 62.8297 32.6191 174.8802 6 Y 4.8675 8.8484 125.5031 56.1491 40.9016 176.5549 7 Y 4.1688 8.8342 117.7177 61.4093 38.0157 179.1705 8 E 4.1143 8.4611 116.0652 58.9905 29.8669 177.5508 9 D 4.7307 8.6748 118.7790 54.8794 41.4653 176.4585 10 T 4.8936 7.6790 109.0974 60.2841 70.6207 173.3654 11 D 5.1717 8.4601 122.3465 51.2190 42.0471 176.8041 12 S 4.2867 8.6064 112.4818 61.1884 62.8954 174.5926 13 E 4.0694 8.2068 120.1202 56.5153 29.5017 177.0293 14 G 3.9560 8.6643 106.2405 46.4063 0.0000 172.9666 15 V 4.7643 7.3986 111.7975 58.5582 36.4681 174.8110 16 V 4.0292 8.3058 122.3617 63.0393 31.7963 175.2199 17 Y 4.1541 8.7291 129.8606 58.3457 39.1585 176.5995 18 H 4.1424 8.3938 122.4722 59.1371 28.2219 177.5108 19 A 3.9330 6.7731 122.3025 54.4072 17.9018 179.0439 20 N 4.0788 8.1677 115.2548 56.1278 38.4329 177.0315 21 Y 4.0885 7.0481 118.6658 60.8215 37.6357 178.4831 22 L 4.0216 7.5231 120.0315 57.4996 41.5761 179.7104 23 K 3.9300 7.6398 117.9699 59.7312 32.1541 178.6492 24 Y 4.4255 7.5570 116.8999 61.5599 37.7705 178.7883 25 C 4.2409 8.2672 117.5335 62.7105 28.1573 175.6922 26 E 3.9823 8.5165 121.1307 59.4067 29.2443 178.9691 27 R 3.9619 8.4312 118.1501 59.3767 30.0073 178.9008 28 A 4.0607 8.0533 120.2982 55.0698 17.9613 179.8563 29 R 3.8155 7.9839 116.5160 59.6997 30.1603 179.5876 30 S 3.8364 8.2596 115.1419 61.4027 62.7302 176.3830 31 E 4.0633 8.6125 122.4456 59.0194 29.0634 178.4427 32 F 4.0149 7.5942 120.2712 61.3066 39.5753 176.9707 33 F 4.0539 7.4793 116.7369 60.4552 38.8131 177.7068 34 F 4.8146 8.6135 119.4412 60.0494 38.5783 177.8844 35 K 4.2390 8.5365 116.9764 59.0886 32.3718 178.0593 36 Q 4.3832 7.5003 118.2256 54.9682 29.0177 174.9121 37 N 4.4050 8.5164 116.0116 54.4714 36.8211 174.5307 38 V 4.7279 7.5617 108.6564 59.5595 35.9032 175.0454 39 L 4.9119 8.5049 121.7357 53.7840 42.6917 175.3287 40 P 3.5679 0.0000 0.0000 61.7482 31.2769 175.1949 41 E 4.8432 7.7243 113.8991 57.3384 32.0520 173.7887 42 N 4.9425 9.0791 115.7117 52.7399 39.1320 173.7181 43 E 3.3753 7.4266 110.8011 56.8400 30.9488 176.9202 44 E 4.5982 8.3430 117.8302 55.1631 31.8819 175.1611 45 G 4.2933 8.6830 106.8739 44.5374 0.0000 172.2057 46 V 4.5538 7.2993 112.6748 58.9965 36.5116 174.9777 47 F 4.6982 8.4784 121.0020 57.7188 39.9363 175.3962 48 V 4.5986 8.9620 114.9737 59.6313 35.4545 174.9110 49 I 4.0507 8.5458 125.9682 61.4440 37.2681 175.8597 50 R 4.4370 8.8540 126.9364 58.2279 31.2257 176.9734 51 S 4.6824 7.3907 110.6537 57.3550 66.1735 173.5478 52 I 5.0308 8.2197 121.1049 59.5582 40.9911 174.8273 53 K 4.6405 9.2357 125.2338 54.5916 34.8629 175.0870 54 A 4.8152 8.5841 125.9563 49.9499 22.4324 174.5251 55 D 4.6436 8.2794 120.2127 52.2473 44.4735 174.9207 56 F 4.7980 8.3659 120.7574 55.0693 40.8277 174.9607 57 F 5.0279 8.6559 122.4275 57.4465 42.6111 176.8390 58 T 4.1994 8.8705 123.2855 64.0659 69.0311 171.9336 59 P 4.9829 0.0000 0.0000 62.8604 32.5169 176.0306 60 A 5.0015 9.1442 124.5676 51.6898 21.1838 176.2910 61 S 4.7511 9.7085 112.9985 56.3577 66.3343 172.9667 62 L 3.8964 8.4059 121.5889 57.1163 40.4863 177.4655 63 G 3.8389 9.0259 114.2221 45.3051 0.0000 173.2581 64 Q 4.4308 7.6254 118.7310 55.8350 30.4227 175.1275 65 V 4.5254 8.5092 122.1453 61.5620 33.2890 174.8015 66 L 5.0595 8.9328 127.9617 53.0354 44.7146 174.9475 67 E 4.9610 9.2651 122.5827 54.5698 32.6579 174.4414 68 I 4.8267 9.1180 128.4625 59.9233 39.4480 174.7024 69 R 4.9567 9.0751 127.0626 54.6550 32.4676 175.3061 70 T 5.1816 8.4801 120.2042 61.6641 71.2579 173.3487 71 Q 4.6170 9.1741 123.7707 54.2600 32.6713 174.5742 72 I 4.2699 8.1930 121.5752 60.7299 37.1194 175.6861 73 K 4.2160 9.0483 130.2900 58.9443 32.8954 176.9860 74 E 4.7609 7.9939 119.4592 54.6412 33.3926 173.5377 75 L 4.8371 8.4916 127.6540 53.5234 44.3762 175.3359 76 R 4.5098 8.3916 124.8981 53.4011 33.8256 176.4063 77 K 3.6065 8.5462 118.8751 59.2604 31.8886 177.7285 78 V 4.4869 7.5975 113.9630 62.3632 32.9772 174.0766 79 F 5.5699 7.4490 113.1219 56.5223 41.8792 173.5564 80 V 5.0267 9.2305 118.4703 60.1981 35.0138 174.0968 81 V 5.0250 9.6266 124.8759 61.2576 33.9218 174.0341 82 L 5.2435 9.1979 127.8480 52.9651 44.7864 174.9720 83 F 5.4233 9.2082 125.6790 56.6728 41.7089 174.2564 84 Q 4.9862 8.6635 124.6061 54.0692 32.7306 174.1873 85 E 4.9909 8.8912 121.4967 54.5606 33.9885 174.6102 86 I 5.0363 8.9391 124.1540 59.8199 40.1117 174.2247 87 Y 4.8249 9.0183 124.1989 56.1544 41.5617 174.1873 88 C 4.7014 8.2670 124.1176 58.4992 32.3001 173.7308 89 I 4.4005 8.4258 118.8907 61.1422 39.5762 175.4988 90 Q 4.6127 7.6443 122.6025 54.7390 32.4987 173.4697 91 N 4.9968 8.7651 121.9999 52.4113 40.1381 175.9337 92 A 4.1047 7.9376 121.2343 55.1950 18.4384 179.6523 93 S 4.0876 8.1029 108.5750 59.6492 63.3421 175.2666 94 L 3.8865 7.5547 119.8165 54.1320 40.0544 174.1614 95 E 3.9212 7.5222 119.6798 55.6991 29.8618 174.8917 96 P 4.4251 0.0000 0.0000 63.5594 32.0480 175.3632 97 M 4.7184 7.9606 116.1063 53.8539 33.6425 174.3044 98 K 4.1375 8.6061 123.0004 55.5259 32.9664 174.8531 99 P 5.2793 0.0000 0.0000 62.7625 32.0918 175.5225 100 F 5.1386 7.9624 115.9090 54.8438 41.7482 173.5648 101 K 3.4244 8.6743 122.2589 56.5108 32.7352 177.1120 102 V 4.9348 8.3689 126.1892 63.3070 34.5149 174.8877 103 F 4.9897 7.6424 118.6521 57.2962 42.6248 172.6596 104 A 4.9408 7.4720 125.2972 50.3951 22.9868 175.2342 105 S 4.8478 8.7209 114.7317 56.6589 67.2095 172.4688 106 E 5.3302 9.3761 123.3517 54.6756 32.1645 174.5487 107 I 4.9688 8.8966 127.2848 59.3504 41.3203 174.1303 108 K 4.9880 8.4257 127.7088 54.8371 34.3073 174.7896 109 F 5.3492 9.6300 126.1354 55.8468 42.3136 175.4252 110 G 4.4526 9.3142 110.8750 44.9581 0.0000 171.7862 111 F 5.0504 8.6314 120.8501 56.2814 42.2681 174.0839 112 V 4.9017 7.7101 118.1876 59.0759 36.2589 174.7687 113 N 4.7708 8.7254 120.6402 53.5607 38.9631 176.4577 114 R 3.8830 9.3601 124.6948 59.7109 30.5061 178.6499 115 S 4.3353 8.2070 112.1793 61.2772 62.9989 175.3610 116 T 4.2724 7.8932 107.6057 61.2436 69.5569 174.5851 117 Y 3.4378 8.2177 117.8965 58.7763 36.3041 169.7006 118 S 4.5172 7.8758 117.1951 57.4699 63.9496 172.0747 119 P 4.9122 0.0000 0.0000 63.1029 31.5823 175.4360 120 I 4.8510 8.7220 116.7865 58.3443 41.1211 174.7922 121 A 4.3451 8.5524 123.7867 51.7414 18.9948 177.6213 122 I 3.2324 8.2077 122.1681 60.8343 37.7081 174.8101 123 P 4.0899 0.0000 0.0000 62.4282 32.1545 176.8639 124 K 3.7061 8.7464 122.2874 59.8170 32.0058 178.3714 125 L 3.7715 7.6882 119.7194 58.6407 41.6855 179.0123 126 F 4.8504 7.4576 116.6780 60.2084 38.9853 177.6513 127 K 4.0187 8.3580 119.5228 59.5560 32.0370 178.5111 128 E 3.9841 8.5601 119.2045 59.6070 29.2220 179.3622 129 L 4.0637 7.6615 116.8119 58.0719 41.8241 179.4945 130 L 4.2106 8.2648 117.7098 57.6122 41.5547 179.0778 131 N 4.4858 8.1719 115.9623 56.0982 38.6208 175.4757 132 A 4.3343 7.9235 125.3554 52.3771 18.7404 176.9587 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 0 H 8.44 4.90 0.00 3.12 3.58 0.00 5.67 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 8.24 4.70 0.00 2.08 1.79 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.59 0.00 2 R 8.48 5.28 0.00 1.68 1.75 0.00 3.22 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 3 C 8.78 4.75 0.00 2.86 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 4 R 8.23 4.61 0.00 1.60 1.35 0.00 3.10 0.00 0.00 3.05 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.71 0.00 5 V 8.13 4.00 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 0.97 0.00 0.00 0.94 0.00 0.00 6 Y 8.85 4.87 0.00 3.03 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 7 Y 8.83 4.17 0.00 3.19 3.03 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 0.00 0.00 0.00 0.00 8 E 8.46 4.11 0.00 2.11 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 2.44 2.43 0.00 9 D 8.67 4.73 0.00 2.98 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 10 T 7.68 4.89 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 1.29 0.00 0.00 11 D 8.46 5.17 0.00 2.98 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 12 S 8.61 4.29 0.00 4.02 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 13 E 8.21 4.07 0.00 2.01 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 0.00 2.34 2.32 0.00 14 G 8.66 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 15 V 7.40 4.76 2.27 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 0.80 0.00 0.00 1.00 0.00 0.00 16 V 8.31 4.03 1.87 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 -0.06 0.00 0.00 1.01 0.00 0.00 17 Y 8.73 4.15 0.00 3.08 2.99 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 18 H 8.39 4.14 0.00 3.10 3.17 0.00 5.71 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 19 A 6.77 3.93 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 20 N 8.17 4.08 0.00 2.45 2.28 0.00 0.00 6.84 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 21 Y 7.05 4.09 0.00 2.25 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 22 L 7.52 4.02 0.00 1.81 1.74 1.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 23 K 7.64 3.93 0.00 1.67 1.77 0.00 1.57 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.43 7.81 24 Y 7.56 4.43 0.00 3.15 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 25 C 8.27 4.24 0.00 3.22 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 26 E 8.52 3.98 0.00 2.20 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 0.00 2.38 2.56 0.00 27 R 8.43 3.96 0.00 2.15 2.07 0.00 3.39 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.01 0.00 28 A 8.05 4.06 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 29 R 7.98 3.82 0.00 1.95 1.80 0.00 2.73 0.00 0.00 3.37 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.92 0.00 30 S 8.26 3.84 0.00 3.65 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 31 E 8.61 4.06 0.00 2.21 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 0.00 2.37 2.42 0.00 32 F 7.59 4.01 0.00 2.78 2.99 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 33 F 7.48 4.05 0.00 2.93 3.24 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 34 F 8.61 4.81 0.00 3.18 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 35 K 8.54 4.24 0.00 1.85 1.97 0.00 1.54 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.72 1.33 7.81 36 Q 7.50 4.38 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 37 N 8.52 4.41 0.00 2.85 2.95 0.00 0.00 6.63 7.23 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 38 V 7.56 4.73 2.36 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 1.08 0.00 0.00 1.39 0.00 0.00 39 L 8.50 4.91 0.00 1.80 1.77 1.01 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 3.57 0.00 1.73 1.34 0.00 3.93 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.66 0.00 41 E 7.72 4.84 0.00 2.18 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 2.20 2.33 0.00 42 N 9.08 4.94 0.00 2.88 3.03 0.00 0.00 6.97 7.04 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 43 E 7.43 3.38 0.00 2.14 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 0.00 2.33 2.36 0.00 44 E 8.34 4.60 0.00 2.00 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 0.00 2.32 2.36 0.00 45 G 8.68 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 0.00 0.00 0.00 0.00 46 V 7.30 4.55 1.92 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 0.61 0.00 0.00 0.63 0.00 0.00 47 F 8.48 4.70 0.00 2.91 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 48 V 8.96 4.60 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 0.36 0.00 0.00 0.89 0.00 0.00 49 I 8.55 4.05 1.83 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 0.95 0.56 0.71 0.00 0.00 50 R 8.85 4.44 0.00 1.64 1.92 0.00 3.38 0.00 0.00 3.30 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 51 S 7.39 4.68 0.00 3.81 3.85 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 0.00 0.00 0.00 52 I 8.22 5.03 1.88 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 1.28 0.62 0.95 0.00 0.00 53 K 9.24 4.64 0.00 1.64 1.66 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.34 7.81 54 A 8.58 4.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.28 4.64 0.00 2.15 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 0.00 0.00 0.00 56 F 8.37 4.80 0.00 2.75 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 57 F 8.66 5.03 0.00 3.02 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 58 T 8.87 4.20 4.60 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 0.81 0.00 0.00 59 P 0.00 4.98 0.00 2.23 2.22 0.00 3.81 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 60 A 9.14 5.00 1.49 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 0.00 0.00 0.00 61 S 9.71 4.75 0.00 4.01 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 62 L 8.41 3.90 0.00 1.49 1.56 0.27 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 63 G 9.03 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 0.00 0.00 0.00 64 Q 7.63 4.43 0.00 2.17 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.74 0.00 0.00 0.00 0.00 0.00 2.50 2.32 0.00 65 V 8.51 4.53 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 0.93 0.00 0.00 0.86 0.00 0.00 66 L 8.93 5.06 0.00 1.29 1.40 0.80 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 67 E 9.27 4.96 0.00 1.91 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 2.17 2.22 0.00 68 I 9.12 4.83 1.90 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 1.30 0.48 0.96 0.00 0.00 69 R 9.08 4.96 0.00 1.74 1.80 0.00 3.00 0.00 0.00 3.02 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 70 T 8.48 5.18 4.17 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 1.10 0.00 0.00 71 Q 9.17 4.62 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.92 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 72 I 8.19 4.27 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.42 0.90 0.00 0.00 73 K 9.05 4.22 0.00 1.84 2.05 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.49 1.38 7.81 74 E 7.99 4.76 0.00 2.15 1.92 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 2.25 2.35 0.00 75 L 8.49 4.84 0.00 1.60 1.46 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.39 4.51 0.00 0.69 1.48 0.00 3.26 0.00 0.00 2.95 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.32 0.00 77 K 8.55 3.61 0.00 1.76 1.82 0.00 1.66 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.44 7.81 78 V 7.60 4.49 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 1.12 0.00 0.00 0.99 0.00 0.00 79 F 7.45 5.57 0.00 3.30 3.19 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 80 V 9.23 5.03 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 1.04 0.00 0.00 81 V 9.63 5.03 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 1.15 0.00 0.00 1.21 0.00 0.00 82 L 9.20 5.24 0.00 1.80 1.58 0.71 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 83 F 9.21 5.42 0.00 3.09 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 0.00 84 Q 8.66 4.99 0.00 1.90 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.53 0.00 0.00 0.00 0.00 0.00 2.22 2.29 0.00 85 E 8.89 4.99 0.00 1.97 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 0.00 1.91 1.85 0.00 86 I 8.94 5.04 1.88 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 1.31 0.82 0.93 0.00 0.00 87 Y 9.02 4.82 0.00 2.81 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 88 C 8.27 4.70 0.00 2.47 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 89 I 8.43 4.40 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.78 0.86 0.00 0.00 90 Q 7.64 4.61 0.00 2.07 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.99 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 91 N 8.77 5.00 0.00 2.74 2.72 0.00 0.00 6.95 7.54 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 92 A 7.94 4.10 1.26 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 93 S 8.10 4.09 0.00 4.00 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 94 L 7.55 3.89 0.00 1.80 1.97 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 95 E 7.52 3.92 0.00 1.94 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 2.35 2.31 0.00 96 P 0.00 4.43 0.00 2.09 2.00 0.00 3.78 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 2.04 2.10 0.00 97 M 7.96 4.72 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.72 0.00 98 K 8.61 4.14 0.00 1.76 1.83 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.61 7.81 99 P 0.00 5.28 0.00 2.01 2.04 0.00 3.75 0.00 0.00 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.93 0.00 100 F 7.96 5.14 0.00 3.06 3.10 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 0.00 101 K 8.67 3.42 0.00 1.25 1.26 0.00 1.19 0.00 0.00 1.33 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.99 0.72 7.81 102 V 8.37 4.93 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 1.19 0.00 0.00 1.01 0.00 0.00 103 F 7.64 4.99 0.00 2.30 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 0.00 0.00 0.00 0.00 104 A 7.47 4.94 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 0.00 105 S 8.72 4.85 0.00 3.80 3.69 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 0.00 106 E 9.38 5.33 0.00 2.24 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 2.37 0.00 107 I 8.90 4.97 1.95 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.68 0.33 0.00 0.00 108 K 8.43 4.99 0.00 1.82 1.56 0.00 1.32 0.00 0.00 1.47 0.00 0.00 2.15 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.43 7.81 109 F 9.63 5.35 0.00 3.15 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 0.00 110 G 9.31 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 0.00 0.00 0.00 0.00 111 F 8.63 5.05 0.00 2.93 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 0.00 112 V 7.71 4.90 1.66 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 0.57 0.00 0.00 0.08 0.00 0.00 113 N 8.73 4.77 0.00 2.64 2.74 0.00 0.00 7.26 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 0.00 114 R 9.36 3.88 0.00 1.73 2.03 0.00 3.16 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 115 S 8.21 4.34 0.00 3.89 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 0.00 116 T 7.89 4.27 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 1.24 0.00 0.00 117 Y 8.22 3.44 0.00 3.06 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 0.00 118 S 7.88 4.52 0.00 3.85 3.82 0.00 0.00 0.00 0.00 0.00 0.00 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 4.91 0.00 2.13 2.11 0.00 3.74 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 120 I 8.72 4.85 1.93 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.01 0.95 0.00 0.00 121 A 8.55 4.35 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 0.00 122 I 8.21 3.23 1.88 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.67 1.04 0.00 0.00 123 P 0.00 4.09 0.00 1.58 1.66 0.00 2.74 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 124 K 8.75 3.71 0.00 1.73 1.73 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.48 7.81 125 L 7.69 3.77 0.00 1.35 0.85 0.61 0.96 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 0.00 126 F 7.46 4.85 0.00 3.18 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 0.00 127 K 8.36 4.02 0.00 1.90 1.96 0.00 1.54 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.55 7.81 128 E 8.56 3.98 0.00 2.20 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 2.34 2.49 0.00 129 L 7.66 4.06 0.00 2.11 1.79 1.16 0.85 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 0.00 130 L 8.26 4.21 0.00 1.91 1.76 1.13 0.94 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 0.00 131 N 8.17 4.49 0.00 2.91 2.89 0.00 0.00 6.99 6.86 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 0.00 132 A 7.92 4.33 1.29 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