NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4756 8.3044 120.3259 55.2546 32.3013 173.2387 2 S 4.3556 7.5892 116.4370 56.4035 65.7631 172.1607 3 G 4.3334 8.4874 114.8502 46.0312 0.0000 171.0759 4 I 4.6074 7.8680 118.8390 59.4650 40.4867 175.1595 5 V 4.5572 8.3749 125.6584 61.2948 34.0674 174.8407 6 I 4.4781 7.8700 125.3169 59.1062 41.2172 175.8617 7 D 4.7721 8.7775 125.7759 54.5722 41.2376 175.6605 8 K 4.6782 8.0631 115.4519 53.8543 35.0781 175.0611 9 E 4.8508 8.2584 118.8122 53.6096 32.0691 175.8656 10 K 3.8704 8.1552 119.3779 57.0027 32.7113 178.7138 11 V 3.6371 8.3839 116.7893 63.5985 31.6651 175.2829 12 H 4.9662 7.2094 118.2660 53.2606 33.6171 173.0324 13 S 4.0449 8.1248 116.7160 60.9963 62.0121 176.5371 14 K 4.3662 8.5903 115.2989 56.2037 31.9726 176.8678 15 M 4.4360 8.1076 119.1082 53.2127 33.0665 174.8509 16 P 4.4745 0.0000 0.0000 63.4040 32.0820 176.0202 17 D 4.8014 8.6696 119.0570 56.1388 42.1970 176.3557 18 V 4.8354 7.7230 116.2870 61.0265 35.2304 175.2755 19 V 4.3169 8.6386 125.4503 61.3073 34.3953 174.0412 20 K 4.5164 8.7402 127.8814 55.7651 33.0546 176.7998 21 N 4.1096 8.7695 121.5720 54.1976 35.6967 174.3218 22 A 4.2728 8.4490 121.7584 51.9086 20.6078 178.3520 23 K 4.6957 10.2991 123.8583 54.7833 33.6174 174.8875 24 I 4.5396 8.7282 126.8536 60.4927 38.7927 174.9119 25 A 4.8443 9.2403 130.1999 50.3551 20.8093 175.8639 26 L 4.7864 8.4596 123.3918 54.5993 43.2293 176.2925 27 I 4.5883 8.2127 126.1057 59.5306 38.5767 176.4454 28 D 4.6605 9.0427 128.6128 56.6488 41.6310 176.9343 29 S 4.3348 8.0330 111.6879 57.5267 63.2304 172.8445 30 A 4.3803 8.3220 127.7447 51.7992 19.8691 178.3654 31 L 4.7433 8.1948 124.0434 52.9238 41.3824 176.1340 32 E 5.4548 7.4787 112.1469 56.5694 32.0342 175.3191 33 I 4.1891 7.7879 121.8571 59.5338 38.6044 176.1411 34 K 3.9727 8.5356 124.9428 56.3867 32.7778 177.7178 35 K 3.8803 8.8611 123.6686 60.0486 31.9267 179.1664 36 T 3.9263 7.8259 109.5870 64.4877 68.7460 176.2006 37 E 3.8779 8.0135 121.7904 59.0843 29.6535 178.7592 38 I 3.8390 7.7112 119.2421 64.5342 37.2213 177.6620 39 E 3.8969 8.2779 119.7586 59.4230 29.5129 178.8726 40 A 3.9379 7.9642 120.5400 55.1854 18.3022 179.7937 41 K 3.7980 8.1641 115.7779 58.7085 32.1492 179.4673 42 V 3.7029 7.8350 119.3336 65.4867 31.3659 177.7559 43 Q 3.8721 8.0527 118.9860 59.1119 28.9295 176.8165 44 I 3.9205 7.3435 114.4607 61.6137 38.2710 175.5077 45 S 4.3846 7.2875 114.0722 57.9124 63.3167 173.2283 46 D 4.4903 8.4072 124.9642 53.5703 41.6685 175.6030 47 P 4.2461 0.0000 0.0000 65.8978 31.5020 178.6879 48 S 4.2742 8.0305 110.7238 60.5200 63.3642 175.3342 49 K 4.4514 8.1603 119.3967 56.1922 31.9510 178.1624 50 I 3.8284 7.3149 121.4790 64.9049 37.2432 178.3896 51 Q 4.1028 8.0939 118.0243 58.6376 28.6965 178.3797 52 D 4.3299 8.0582 119.8074 57.2269 41.1064 178.0742 53 F 4.1796 8.4048 121.1909 61.5853 39.3711 177.1975 54 L 3.3709 7.8679 118.1478 57.5154 41.3595 179.3925 55 N 4.3116 7.8256 116.1820 56.1110 38.4782 177.3481 56 Q 3.9699 7.7940 119.0604 58.9800 28.8101 178.9492 57 E 3.8669 7.7302 119.3533 59.6830 29.4948 179.5852 58 T 4.0705 7.5388 109.2974 64.7870 68.6310 176.1614 59 N 4.3531 8.0893 119.1377 56.1998 38.6278 177.5879 60 T 3.8425 8.0882 117.2847 66.4761 68.5435 176.4338 61 F 4.0508 8.6677 122.8975 61.3532 39.4661 177.1362 62 K 3.8091 8.3204 119.1271 59.4056 31.6412 178.7668 63 Q 3.8910 7.6939 117.9335 58.8402 28.9902 177.7994 64 M 4.0496 8.1496 119.7997 58.5046 32.2587 178.4988 65 V 3.3557 7.6662 118.8677 65.7896 31.7141 177.7518 66 E 4.2205 7.6544 119.1969 57.9788 29.0058 178.6331 67 K 4.2681 7.4045 116.6372 57.6960 32.1870 178.5985 68 I 3.9879 7.7553 121.6179 64.0434 37.2510 177.9800 69 K 3.9856 8.1013 119.9929 59.4853 31.9342 178.8297 70 K 3.9959 7.8451 117.4382 59.0321 31.9953 178.7783 71 S 4.3756 7.7281 113.3496 59.2321 63.3867 175.2600 72 G 3.8942 8.1593 110.8024 44.7836 0.0000 173.6635 73 A 4.2410 7.4120 123.4460 52.5158 18.9188 177.1325 74 N 5.0465 8.7966 117.9081 52.5272 39.3416 174.1921 75 V 5.1322 7.5528 120.0610 61.7378 35.5924 173.3779 76 V 4.8670 9.3113 127.3757 60.0823 34.5781 174.4640 77 L 4.9572 8.8087 126.6249 53.1304 43.2910 174.8855 78 C 4.9051 8.9138 125.8784 58.3053 32.4138 174.3861 79 Q 4.2522 9.4450 127.5831 58.0221 30.0738 175.2622 80 K 4.8999 7.7707 118.3832 54.5841 35.7846 176.0309 81 G 4.1672 8.5793 106.9916 46.7815 0.0000 172.9511 82 I 5.1370 8.0717 121.2725 59.0717 39.9615 175.5786 83 D 4.6451 9.0249 127.2515 52.8119 40.7735 177.3108 84 D 4.4156 8.8091 118.4814 57.5306 40.3490 179.2940 85 V 3.6524 7.9779 118.1333 65.9946 31.5313 177.8196 86 A 4.1614 9.2902 120.8241 54.9662 18.2112 179.6991 87 Q 3.9221 8.4582 117.4311 59.1708 28.6924 178.2342 88 H 3.9580 8.3365 119.2731 59.3603 29.8268 176.4331 89 Y 4.0694 7.7376 120.8367 60.9927 38.6024 178.0879 90 L 3.7271 7.8533 119.2620 57.6392 41.6394 179.5866 91 A 3.8786 7.7554 120.5793 55.1357 18.1817 179.6322 92 K 3.7726 7.7504 116.7115 59.3948 32.2952 178.0156 93 E 4.1208 7.6482 116.5036 56.0240 29.5456 177.2885 94 G 3.8484 7.6954 107.0412 46.0858 0.0000 173.2714 95 I 4.3477 7.8023 121.0222 60.3011 38.1923 175.0923 96 Y 4.2877 8.8588 129.0409 57.2477 39.6556 173.9799 97 A 5.9400 8.3049 127.6255 49.2604 22.9474 174.5835 98 V 4.7354 8.2973 119.1482 61.1123 35.3594 174.3556 99 R 5.0576 8.4734 122.3913 53.9003 32.8823 174.6041 100 R 4.0331 8.3911 114.5061 55.9422 27.9832 177.2503 101 V 3.7802 7.6189 117.2415 62.1270 32.4408 175.4323 102 K 3.9627 8.6179 126.3478 56.5039 33.8204 177.7170 103 K 3.8997 8.6822 123.6442 59.7560 32.1251 179.1893 104 S 4.2728 8.0714 113.8909 61.8085 62.8167 176.0986 105 D 4.3306 8.0488 122.0555 57.1846 40.6183 178.4666 106 M 4.0773 8.0842 119.1584 58.5010 32.0426 178.7447 107 E 3.9908 8.3774 118.7141 59.1759 29.5549 179.4888 108 K 3.9163 8.2042 118.5368 59.6017 32.2285 179.1208 109 L 3.9261 8.4263 119.2327 57.9519 41.4483 179.3973 110 A 3.9592 8.0880 120.3417 55.3592 18.1642 179.7026 111 K 3.8534 7.8552 116.2876 59.3619 32.3720 178.5056 112 A 4.2362 8.2363 120.3772 53.7467 18.5904 178.4343 113 T 4.7069 8.0502 106.7330 60.5265 69.8724 175.1642 114 G 3.5789 8.3485 109.6207 46.6008 0.0000 173.1640 115 A 4.9318 7.9243 119.6451 50.0129 21.4861 177.5029 116 K 4.4242 8.3180 119.6158 54.3715 33.8570 176.5041 117 I 3.9532 8.4634 126.5926 61.8143 37.4217 176.1546 118 V 4.1718 8.5447 122.0850 60.9127 32.6115 177.5619 119 T 4.3552 8.6249 113.4380 61.8935 69.7873 174.1036 120 D 4.7981 7.4819 121.3832 52.4561 44.6236 175.8507 121 L 4.0589 8.5189 125.0847 57.6072 41.8773 178.3535 122 D 4.5833 8.2438 115.3981 54.3217 39.4171 176.1507 123 D 4.6827 7.6005 118.7272 54.0497 41.7474 176.0047 124 L 4.1723 7.6471 122.9041 54.6928 42.1190 175.7427 125 T 4.7901 8.0364 115.0830 58.8751 71.9898 172.8438 126 P 4.2914 0.0000 0.0000 65.6332 31.4073 179.1016 127 S 3.9537 7.4940 111.6741 60.6322 63.3944 175.2722 128 V 4.0728 7.7785 113.3397 61.3436 31.3184 175.5389 129 L 4.8907 7.2395 120.3858 54.0059 43.1051 176.1445 130 G 4.3002 8.9284 107.6879 44.0197 0.0000 172.2083 131 E 5.3606 8.6448 119.1406 54.5905 33.0426 175.4213 132 A 4.8442 8.2124 122.0077 51.0043 22.8514 177.3019 133 E 3.9453 8.9183 122.7295 59.7088 31.0959 177.4240 134 T 4.8951 8.1839 113.3731 60.9917 71.6097 172.5320 135 V 4.9155 8.7400 129.5471 61.0129 34.0805 174.0500 136 E 5.0731 9.0108 124.6452 55.1295 33.4087 173.3277 137 E 5.4846 9.0512 122.4678 54.8982 31.7687 175.0974 138 R 4.7966 8.7759 121.0765 54.9550 33.5720 173.9041 139 K 4.7058 8.6345 120.1155 56.2975 32.9434 177.2580 140 I 4.4031 9.2842 127.0634 59.7599 38.6755 176.5259 141 G 4.1005 8.1957 118.5423 46.7490 0.0000 171.8734 142 D 4.9221 8.7336 121.8599 52.9555 39.9077 175.7081 143 D 4.8793 7.8764 118.5714 53.3091 44.3998 175.0845 144 R 4.9879 8.5391 120.6955 55.2241 31.8188 175.2564 145 M 4.9131 8.7356 123.5451 53.0890 35.8797 175.0078 146 T 5.0510 8.4875 116.7730 61.9668 71.4766 173.6902 147 F 4.9872 9.4878 125.4550 55.7871 41.7322 174.8497 148 V 4.4418 8.7054 125.4020 61.9129 32.1275 174.2859 149 M 4.7934 9.2309 128.2006 53.6094 35.4471 176.0077 150 G 3.9002 8.6014 106.6511 46.6156 0.0000 174.0858 151 C 4.3580 7.7369 116.8912 60.0825 28.1430 174.8878 152 K 4.1780 8.3299 123.3721 56.4168 31.7478 176.9149 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 4.48 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 2 S 7.59 4.36 0.00 3.88 3.65 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 3 G 8.49 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 0.00 0.00 0.00 0.00 4 I 7.87 4.61 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.20 0.89 0.00 0.00 5 V 8.37 4.56 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 0.10 0.00 0.00 1.00 0.00 0.00 6 I 7.87 4.48 1.80 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.61 0.97 0.00 0.00 7 D 8.78 4.77 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 8 K 8.06 4.68 0.00 1.78 1.65 0.00 1.69 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.40 1.32 7.81 9 E 8.26 4.85 0.00 2.28 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 0.00 2.16 2.23 0.00 10 K 8.16 3.87 0.00 1.34 0.90 0.00 1.08 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.50 1.40 7.81 11 V 8.38 3.64 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 0.65 0.00 0.00 0.95 0.00 0.00 12 H 7.21 4.97 0.00 3.07 3.10 0.00 5.77 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.12 4.04 0.00 3.98 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 14 K 8.59 4.37 0.00 1.77 1.87 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.46 7.81 15 M 8.11 4.44 0.00 1.82 2.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.42 0.00 16 P 0.00 4.47 0.00 2.46 2.11 0.00 3.81 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 17 D 8.67 4.80 0.00 2.67 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 18 V 7.72 4.84 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 0.76 0.00 0.00 0.99 0.00 0.00 19 V 8.64 4.32 2.06 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 0.98 0.00 0.00 0.96 0.00 0.00 20 K 8.74 4.52 0.00 1.67 1.71 0.00 1.93 0.00 0.00 1.69 0.00 0.00 2.73 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.39 1.45 7.81 21 N 8.77 4.11 0.00 2.79 2.86 0.00 0.00 7.00 7.27 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 22 A 8.45 4.27 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 23 K 10.30 4.70 0.00 1.66 1.76 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.38 7.81 24 I 8.73 4.54 1.87 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 1.14 0.56 0.91 0.00 0.00 25 A 9.24 4.84 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 26 L 8.46 4.79 0.00 1.66 1.64 0.93 0.84 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 27 I 8.21 4.59 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.69 0.98 0.00 0.00 28 D 9.04 4.66 0.00 2.69 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 29 S 8.03 4.33 0.00 3.97 3.76 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 30 A 8.32 4.38 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 31 L 8.19 4.74 0.00 1.82 1.75 0.93 0.73 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 32 E 7.48 5.45 0.00 2.01 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 2.14 2.21 0.00 33 I 7.79 4.19 1.66 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 1.29 0.01 0.87 0.00 0.00 34 K 8.54 3.97 0.00 1.81 1.74 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.44 7.81 35 K 8.86 3.88 0.00 1.80 1.81 0.00 1.71 0.00 0.00 1.86 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.59 1.51 7.81 36 T 7.83 3.93 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 37 E 8.01 3.88 0.00 2.12 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 0.00 2.37 2.38 0.00 38 I 7.71 3.84 1.90 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.55 0.99 0.00 0.00 39 E 8.28 3.90 0.00 2.30 1.96 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 2.31 2.35 0.00 40 A 7.96 3.94 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 41 K 8.16 3.80 0.00 1.73 0.90 0.00 1.93 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.29 1.48 7.81 42 V 7.84 3.70 2.25 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 1.02 0.00 0.00 1.16 0.00 0.00 43 Q 8.05 3.87 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.73 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 44 I 7.34 3.92 1.89 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.75 0.78 0.00 0.00 45 S 7.29 4.38 0.00 3.77 3.75 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 46 D 8.41 4.49 0.00 2.74 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.25 0.00 2.17 2.14 0.00 3.59 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 2.12 2.11 0.00 48 S 8.03 4.27 0.00 3.98 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 49 K 8.16 4.45 0.00 1.85 1.90 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.42 1.47 7.81 50 I 7.31 3.83 1.92 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.18 1.00 0.00 0.00 51 Q 8.09 4.10 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.92 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 52 D 8.06 4.33 0.00 3.00 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 53 F 8.40 4.18 0.00 3.14 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 54 L 7.87 3.37 0.00 1.80 1.55 0.94 0.45 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 55 N 7.83 4.31 0.00 2.91 2.81 0.00 0.00 6.89 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 56 Q 7.79 3.97 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 57 E 7.73 3.87 0.00 1.82 1.79 0.00 0.00 0.00 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 1.81 0.00 58 T 7.54 4.07 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 1.18 0.00 0.00 59 N 8.09 4.35 0.00 2.98 2.87 0.00 0.00 6.92 6.84 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 60 T 8.09 3.84 4.39 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 1.23 0.00 0.00 61 F 8.67 4.05 0.00 3.14 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 62 K 8.32 3.81 0.00 2.02 1.71 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.24 1.26 7.81 63 Q 7.69 3.89 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.75 0.00 0.00 0.00 0.00 0.00 2.63 2.47 0.00 64 M 8.15 4.05 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.41 0.00 65 V 7.67 3.36 1.54 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 0.83 0.00 0.00 0.10 0.00 0.00 66 E 7.65 4.22 0.00 2.08 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 1.90 1.58 0.00 67 K 7.40 4.27 0.00 1.86 1.83 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.59 7.81 68 I 7.76 3.99 2.06 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.93 0.95 0.00 0.00 69 K 8.10 3.99 0.00 1.90 2.11 0.00 1.74 0.00 0.00 2.00 0.00 0.00 3.09 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.52 7.81 70 K 7.85 4.00 0.00 1.80 1.87 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.65 7.81 71 S 7.73 4.38 0.00 3.98 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 72 G 8.16 3.89 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 0.00 0.00 0.00 73 A 7.41 4.24 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 74 N 8.80 5.05 0.00 2.86 3.01 0.00 0.00 6.15 7.61 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 75 V 7.55 5.13 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 0.87 0.00 0.00 0.88 0.00 0.00 76 V 9.31 4.87 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 0.81 0.00 0.00 1.00 0.00 0.00 77 L 8.81 4.96 0.00 1.64 1.68 0.93 0.51 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 78 C 8.91 4.91 0.00 3.02 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 79 Q 9.45 4.25 0.00 2.14 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.27 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 80 K 7.77 4.90 0.00 1.80 1.76 0.00 1.61 0.00 0.00 2.07 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.46 1.49 7.81 81 G 8.58 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 0.00 0.00 0.00 0.00 82 I 8.07 5.14 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.75 0.97 0.00 0.00 83 D 9.02 4.65 0.00 2.80 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 84 D 8.81 4.42 0.00 2.80 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.98 3.65 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 1.17 0.00 0.00 0.95 0.00 0.00 86 A 9.29 4.16 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 0.00 0.00 87 Q 8.46 3.92 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.55 0.00 88 H 8.34 3.96 0.00 3.25 3.35 0.00 5.79 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Y 7.74 4.07 0.00 3.12 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 90 L 7.85 3.73 0.00 1.77 1.68 0.98 1.73 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 91 A 7.76 3.88 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 92 K 7.75 3.77 0.00 1.59 1.83 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.42 7.81 93 E 7.65 4.12 0.00 1.84 1.75 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 1.47 1.60 0.00 94 G 7.70 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 0.00 0.00 0.00 95 I 7.80 4.35 1.93 0.00 0.00 0.79 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 0.68 0.93 0.00 0.00 96 Y 8.86 4.29 0.00 3.06 2.78 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 97 A 8.30 5.94 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 98 V 8.30 4.74 2.16 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 1.14 0.00 0.00 1.08 0.00 0.00 99 R 8.47 5.06 0.00 2.03 1.89 0.00 3.25 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.62 0.00 100 R 8.39 4.03 0.00 1.94 2.04 0.00 3.18 0.00 0.00 3.01 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 101 V 7.62 3.78 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 0.96 0.00 0.00 0.99 0.00 0.00 102 K 8.62 3.96 0.00 1.96 1.73 0.00 1.72 0.00 0.00 1.87 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.50 7.81 103 K 8.68 3.90 0.00 1.82 1.81 0.00 1.73 0.00 0.00 1.87 0.00 0.00 3.21 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.51 7.81 104 S 8.07 4.27 0.00 4.08 4.11 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 0.00 105 D 8.05 4.33 0.00 2.89 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 0.00 106 M 8.08 4.08 0.00 2.04 2.29 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.95 0.00 107 E 8.38 3.99 0.00 2.14 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 2.33 2.59 0.00 108 K 8.20 3.92 0.00 1.95 1.85 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.71 7.81 109 L 8.43 3.93 0.00 1.86 1.74 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 110 A 8.09 3.96 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 0.00 111 K 7.86 3.85 0.00 1.78 1.85 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.50 7.81 112 A 8.24 4.24 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 0.00 113 T 8.05 4.71 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 1.22 0.00 0.00 114 G 8.35 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 0.00 115 A 7.92 4.93 1.21 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 0.00 0.00 116 K 8.32 4.42 0.00 1.62 1.75 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.53 7.81 117 I 8.46 3.95 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.47 0.92 0.00 0.00 118 V 8.54 4.17 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 0.81 0.00 0.00 1.02 0.00 0.00 119 T 8.62 4.36 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 1.26 0.00 0.00 120 D 7.48 4.80 0.00 2.64 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 0.00 121 L 8.52 4.06 0.00 1.68 1.66 0.94 1.00 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 0.00 122 D 8.24 4.58 0.00 2.76 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 0.00 123 D 7.60 4.68 0.00 2.78 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 0.00 124 L 7.65 4.17 0.00 1.83 1.60 0.92 0.92 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 0.00 125 T 8.04 4.79 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 0.00 126 P 0.00 4.29 0.00 2.20 2.16 0.00 3.59 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 2.12 2.26 0.00 127 S 7.49 3.95 0.00 3.81 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 0.00 128 V 7.78 4.07 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 0.70 0.00 0.00 1.02 0.00 0.00 129 L 7.24 4.89 0.00 1.53 1.67 0.96 0.79 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 0.00 130 G 8.93 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 0.00 0.00 0.00 0.00 131 E 8.64 5.36 0.00 2.14 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 2.21 2.26 0.00 132 A 8.21 4.84 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 0.00 0.00 133 E 8.92 3.95 0.00 1.91 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 2.32 2.40 0.00 134 T 8.18 4.90 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 1.19 0.00 0.00 135 V 8.74 4.92 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 0.40 0.00 0.00 0.82 0.00 0.00 136 E 9.01 5.07 0.00 2.20 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 2.21 2.33 0.00 137 E 9.05 5.48 0.00 2.34 2.03 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 2.42 2.38 0.00 138 R 8.78 4.80 0.00 1.94 2.01 0.00 2.21 0.00 0.00 3.00 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.82 0.00 139 K 8.63 4.71 0.00 1.70 1.83 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.73 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.50 7.81 140 I 9.28 4.40 1.99 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 1.69 1.73 1.02 0.00 0.00 141 G 8.20 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 0.00 0.00 0.00 142 D 8.73 4.92 0.00 2.80 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 0.00 143 D 7.88 4.88 0.00 2.81 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 0.00 144 R 8.54 4.99 0.00 1.84 1.90 0.00 3.18 0.00 0.00 3.36 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 145 M 8.74 4.91 0.00 1.78 1.78 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 2.53 2.45 0.00 146 T 8.49 5.05 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 1.26 0.00 0.00 147 F 9.49 4.99 0.00 2.93 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 0.00 148 V 8.71 4.44 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 0.94 0.00 0.00 0.89 0.00 0.00 149 M 9.23 4.79 0.00 1.94 1.93 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.50 0.00 150 G 8.60 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 0.00 151 C 7.74 4.36 0.00 2.96 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 0.00 152 K 8.33 4.18 0.00 1.76 1.70 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.62 7.81