NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 P 4.4502 0.0000 0.0000 62.1323 32.7612 176.0321 6 R 3.6744 7.9964 119.3680 55.8839 31.3382 174.3379 7 R 4.6059 8.8040 122.0153 54.8111 32.4288 174.6163 8 Y 4.7945 9.0062 125.1275 56.8611 40.5458 175.8755 9 K 4.7605 8.6526 126.7860 54.5314 32.8138 175.2010 10 I 4.5988 8.7280 126.6610 58.4654 40.8197 174.7819 11 F 4.9141 8.8986 125.1625 56.9447 40.2867 175.0216 12 M 4.7506 8.9760 122.3421 53.3707 35.1758 175.5076 13 D 4.8216 8.7134 123.2323 54.4086 42.0945 177.7866 14 K 4.3383 8.6794 122.6184 56.9204 31.9306 178.5830 15 K 4.4476 7.9795 120.8461 55.3799 32.9401 175.9164 16 K 4.7595 8.8697 125.2758 55.3209 35.1186 175.8789 17 R 5.1600 9.1955 121.7147 55.0289 32.0943 174.8788 18 I 4.9936 9.1522 126.1272 59.4662 39.6634 174.7952 19 A 5.1387 8.9317 129.3384 50.5251 21.0725 175.5913 20 L 5.0874 8.9803 122.7925 53.0260 44.5181 175.8107 21 I 4.6670 8.8122 124.3713 59.3999 41.4475 174.5049 22 A 5.4137 8.3207 126.1544 50.5641 22.1859 175.8034 23 H 4.6616 9.4723 119.4845 56.0154 29.9463 176.5357 24 D 4.4314 9.2719 120.7160 57.9154 40.7341 179.0616 25 R 4.3482 8.0299 114.1613 57.2216 30.5172 177.4816 26 R 4.8689 7.8883 118.3828 55.2050 30.7300 178.0307 27 K 4.0180 7.8550 119.6804 59.7569 32.1342 179.3104 28 R 4.0425 8.0623 117.7030 59.1792 30.0665 178.7144 29 D 4.5111 8.2157 118.3523 57.3951 40.9195 178.2907 30 L 3.9160 8.3587 120.9225 57.9943 42.0289 178.5067 31 L 3.9824 8.0976 120.2557 58.3432 42.0115 178.7484 32 E 3.9873 8.4023 118.9743 59.0182 29.4534 178.2628 33 W 4.3595 8.4908 127.3840 60.8696 31.0994 177.7315 34 V 3.5397 8.5325 118.3900 66.0282 30.6885 177.9332 35 S 4.0397 7.8086 112.1653 60.9117 62.3112 175.4155 36 F 4.3867 7.9339 118.3227 58.3196 39.1121 175.8000 37 N 4.8549 7.4389 115.4660 52.3244 39.8002 175.9512 38 L 3.9893 8.1763 121.6268 58.1258 41.3016 179.5734 39 G 3.6063 7.8748 103.6457 48.1368 0.0000 175.4537 40 T 4.1201 7.7185 117.7865 66.3187 68.7717 177.0324 41 L 4.1817 8.0452 121.0106 57.4707 41.3935 179.0250 42 S 4.4144 7.9558 112.1537 59.6422 63.2988 175.5784 43 K 4.1970 7.8844 121.4378 57.1125 32.2629 175.4554 44 H 5.0530 7.4261 114.8817 53.6614 32.5179 172.6882 45 E 4.5349 8.9296 120.5375 55.2694 31.1490 174.7182 46 L 5.4150 8.3011 125.4906 53.2481 45.3216 174.9597 47 Y 5.2904 9.2790 119.7443 56.5203 42.4075 174.2885 48 A 5.3594 9.1974 121.6809 50.6764 23.2740 176.1425 49 T 4.1584 8.6287 110.1078 61.8425 69.8859 175.3516 50 G 3.7345 8.8366 109.7029 48.6561 0.0000 176.2267 51 T 3.9980 7.7777 117.9364 66.1255 68.6726 177.0136 52 T 3.9676 7.9901 117.3510 66.6504 68.5022 176.1886 53 G 3.8136 8.2698 107.4463 48.1255 0.0000 175.3786 54 A 4.0175 7.9516 123.4955 54.6132 18.3856 179.6872 55 L 3.9393 8.0281 117.4342 57.9423 41.7688 179.7375 56 L 4.0028 8.1275 118.9971 57.9316 41.6103 179.6913 57 Q 4.1685 8.0357 117.9395 59.0602 28.4558 178.4907 58 E 3.9745 8.6039 119.4953 58.4403 29.8102 177.9755 59 K 4.4423 8.3925 116.2084 56.4522 32.9282 176.8103 60 L 4.6302 7.5526 116.0799 52.7376 43.9357 176.5692 61 G 3.9228 7.9541 106.3145 46.2044 0.0000 173.7296 62 L 4.0387 8.0038 122.4760 54.6138 42.8897 177.0199 63 K 4.3617 8.3287 126.4737 53.4135 31.4940 176.0527 64 V 4.5972 7.6857 117.0704 58.8511 35.9499 175.1321 65 H 4.4285 8.6572 122.0261 55.5940 29.8559 174.4265 66 R 4.9255 8.5438 122.5745 54.9358 31.4781 176.5674 67 L 4.5425 8.7271 125.2999 53.3954 44.1080 176.3327 68 K 4.2966 9.0730 119.4877 56.3057 33.5708 177.4161 69 S 4.4012 8.7070 117.5105 58.8402 63.7098 175.6294 70 G 3.8138 9.0774 114.5193 48.5639 0.0000 173.5506 71 P 4.5252 0.0000 0.0000 63.5315 31.4884 176.8797 72 L 4.6349 7.7653 118.6561 55.0000 42.1158 176.9757 73 G 4.0234 8.5511 107.1631 45.8107 0.0000 177.1511 74 G 3.5865 8.3660 107.3761 47.6775 0.0000 175.3488 75 D 4.3517 8.0326 121.2176 56.5535 39.2184 178.8230 76 Q 4.0365 7.9920 118.8481 58.3594 28.7874 178.1562 77 Q 3.9615 8.1781 119.3028 59.1959 28.7169 179.1832 78 I 3.7388 7.8106 120.8157 64.0886 37.1299 178.5930 79 G 3.6293 8.1435 106.4374 47.8299 0.0000 175.4856 80 A 3.9520 8.2430 123.5772 55.1036 18.3066 179.6056 81 M 3.8597 8.1202 117.2563 58.4265 31.9972 178.8478 82 I 3.7059 7.9236 120.0345 64.5610 37.1677 178.3736 83 A 2.6144 7.5816 119.1396 53.5939 18.1544 178.3547 84 E 4.3501 7.4753 115.2993 55.4532 29.9677 176.9826 85 G 3.8605 7.5998 106.9931 45.7979 0.0000 174.9271 86 K 4.1647 8.0673 118.5968 57.0161 32.5552 177.0290 87 I 4.6390 7.3403 119.3087 59.5332 40.1674 174.4875 88 D 4.9888 9.2651 122.3894 52.7485 41.2333 175.2728 89 V 4.6541 7.7612 118.8278 61.7196 35.4204 173.0157 90 L 5.0287 9.0137 129.9851 53.4200 44.4707 174.8087 91 I 4.8341 8.9170 128.1155 59.6929 39.6685 174.7836 92 F 5.3672 9.3960 130.4286 56.4335 41.9331 173.0579 93 F 5.2737 9.3049 126.1623 56.7182 39.9381 175.1426 94 W 5.3138 8.5834 119.7105 54.7720 31.7737 174.5739 95 D 4.4650 9.1016 120.6228 52.1765 40.0421 174.2681 96 P 3.9914 0.0000 0.0000 63.2461 32.0587 176.2840 97 L 4.4715 8.0150 118.9001 56.3116 44.2130 176.6207 98 E 4.7993 8.4049 115.2590 54.6826 30.0199 174.6246 99 P 4.4235 0.0000 0.0000 62.3999 32.9134 176.8129 100 Q 4.0502 8.6964 119.8744 55.7003 29.2764 177.4184 101 A 3.9882 8.6076 123.6390 55.2853 18.3400 178.3664 102 H 4.7717 7.6812 107.7623 55.3659 29.4790 175.0867 103 D 4.4534 7.4665 121.0932 54.1877 41.0845 176.4985 104 V 3.6254 8.5993 123.1324 63.0818 32.4653 174.9942 105 D 4.4051 8.7909 126.2705 54.4461 41.5548 176.9402 106 V 3.5034 8.3725 126.6923 65.7276 31.4353 177.5464 107 K 3.6923 8.0827 117.5941 59.7794 32.0320 178.7155 108 A 4.0088 8.1175 120.0587 55.1392 18.2669 179.7974 109 L 3.9485 7.4287 116.8074 58.0153 41.9507 179.7482 110 I 3.7404 7.9640 113.2591 63.8212 37.2418 178.2238 111 R 3.7903 8.3261 120.9433 59.4177 30.1080 178.4094 112 I 3.7757 7.7775 117.7999 63.7384 37.9915 177.6125 113 A 4.1463 8.1477 121.8861 55.1070 18.1186 179.7276 114 T 3.9556 7.7830 114.2377 66.3417 68.5022 177.0361 115 V 3.1573 7.5247 119.7719 66.1030 31.3337 176.3209 116 Y 4.3688 7.7909 112.3289 56.3043 38.3951 175.3674 117 N 4.1180 7.7194 117.1108 54.4626 37.4616 172.6088 118 I 4.7195 7.7957 112.7658 58.1051 41.1943 175.4921 119 P 4.4394 0.0000 0.0000 62.9314 32.3269 175.5171 120 V 4.8556 8.4105 123.2771 61.0567 34.3803 174.1912 121 A 4.7092 9.3615 130.8175 50.4783 20.2537 176.9024 122 I 5.2509 8.7893 114.1674 60.4167 38.7662 176.0361 123 T 4.5061 7.3498 111.4755 59.3842 72.6941 174.4843 124 R 3.2858 7.8330 122.7012 59.4235 30.0546 179.0268 125 S 4.2171 7.8492 113.5856 61.7280 62.8659 176.4172 126 T 3.6887 7.8297 119.0757 66.4245 68.2369 176.3487 127 A 4.0216 7.8908 122.2466 55.2769 17.6909 179.4653 128 D 4.7437 8.1837 117.5548 57.5312 40.7283 178.9625 129 F 4.1066 8.4889 117.6420 60.4137 39.3432 177.2692 130 L 4.2220 8.4506 118.9651 58.1345 41.3407 179.5899 131 I 3.9879 8.0371 116.6774 63.0701 38.0691 176.8926 132 S 4.5519 7.5123 111.9612 57.4722 64.1035 174.3253 133 S 4.2544 7.5232 118.8564 57.6129 62.6730 173.1342 134 P 4.3603 0.0000 0.0000 65.5435 31.1512 178.6053 135 L 4.1681 7.8657 117.7101 57.4378 41.8507 178.9760 136 M 3.9932 7.9880 118.2871 58.4198 32.0752 176.6639 137 N 4.9952 7.7531 111.0163 52.9967 38.8124 173.7566 138 D 5.1874 7.6134 117.9224 52.0830 45.4473 175.5842 139 V 4.2560 8.4533 113.3257 62.1463 32.4717 175.2065 140 Y 5.0390 8.5299 120.1601 56.0060 41.9570 172.8483 141 E 4.5842 8.8470 121.2539 54.5730 31.1452 175.0473 142 K 4.7989 9.1796 125.6341 55.2191 36.7139 174.9003 143 I 4.7651 8.3528 122.3267 60.1277 38.7164 174.6962 144 Q 4.5909 9.0060 129.5402 54.1800 30.8212 174.7876 145 I 3.8100 8.1778 127.6768 60.7756 37.9568 177.2409 146 D 4.6729 8.3515 126.9782 53.5005 37.7623 176.7894 147 Y 4.1814 7.5311 120.9848 60.5271 38.4065 177.7496 148 E 3.9374 8.1961 120.1516 59.1300 29.9203 177.9762 149 E 3.8803 8.4155 119.3841 59.3915 29.8048 178.1655 150 E 3.9014 7.8505 119.1952 59.4360 29.6224 178.5786 151 L 3.9904 8.2410 120.3511 58.3553 42.0735 178.8494 152 E 3.9936 8.2500 118.5016 59.2151 29.5041 179.3819 153 R 3.9197 7.8488 117.7506 59.4244 30.1756 179.2948 154 R 3.9430 7.8473 117.1676 59.2487 29.9951 179.2670 155 I 3.7452 8.0943 122.0586 65.1077 37.0906 179.1562 156 R 3.9428 8.1709 121.6401 61.5314 28.9151 180.5555 157 K 4.0846 7.6852 117.7878 59.4190 32.1345 179.3685 158 V 3.6928 7.3797 116.5825 66.1560 31.6876 178.1573 159 V 3.5921 7.8222 116.9080 63.9075 31.3986 175.5608 160 E 4.1223 8.2618 122.4611 56.7543 29.8686 173.9117 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 5 P 0.00 4.45 0.00 2.03 2.04 0.00 3.66 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.91 0.00 6 R 8.00 3.67 0.00 0.98 0.95 0.00 3.08 0.00 0.00 3.11 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.76 0.00 7 R 8.80 4.61 0.00 1.47 1.71 0.00 3.02 0.00 0.00 3.07 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.53 0.00 8 Y 9.01 4.79 0.00 2.82 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 9 K 8.65 4.76 0.00 1.54 1.61 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.32 1.03 7.81 10 I 8.73 4.60 1.84 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 1.23 0.88 0.89 0.00 0.00 11 F 8.90 4.91 0.00 2.91 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 12 M 8.98 4.75 0.00 1.53 0.80 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 2.19 0.00 13 D 8.71 4.82 0.00 2.72 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 8.68 4.34 0.00 1.77 1.73 0.00 1.69 0.00 0.00 0.61 0.00 0.00 2.86 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.36 0.96 7.81 15 K 7.98 4.45 0.00 1.75 1.81 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.66 7.81 16 K 8.87 4.76 0.00 1.77 1.76 0.00 1.80 0.00 0.00 2.05 0.00 0.00 3.07 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.53 1.79 7.81 17 R 9.20 5.16 0.00 1.77 2.02 0.00 3.35 0.00 0.00 3.32 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 18 I 9.15 4.99 1.99 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 1.24 0.89 1.02 0.00 0.00 19 A 8.93 5.14 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 20 L 8.98 5.09 0.00 1.56 1.54 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 21 I 8.81 4.67 1.10 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.85 0.04 0.00 0.00 22 A 8.32 5.41 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 23 H 9.47 4.66 0.00 3.33 3.48 0.00 5.66 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 D 9.27 4.43 0.00 2.79 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 25 R 8.03 4.35 0.00 1.97 1.99 0.00 3.37 0.00 0.00 3.52 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 26 R 7.89 4.87 0.00 2.15 2.19 0.00 3.33 0.00 0.00 3.20 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 27 K 7.86 4.02 0.00 1.97 1.91 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.76 7.81 28 R 8.06 4.04 0.00 1.92 2.04 0.00 3.17 0.00 0.00 3.37 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.77 0.00 29 D 8.22 4.51 0.00 3.16 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 30 L 8.36 3.92 0.00 1.54 1.81 0.26 0.33 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 31 L 8.10 3.98 0.00 2.09 1.81 0.94 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.40 3.99 0.00 2.25 2.31 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 2.75 2.56 0.00 33 W 8.49 4.36 0.00 3.68 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 34 V 8.53 3.54 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 0.94 0.00 0.00 1.19 0.00 0.00 35 S 7.81 4.04 0.00 3.86 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 36 F 7.93 4.39 0.00 2.95 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 37 N 7.44 4.85 0.00 1.85 2.24 0.00 0.00 6.84 6.89 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 38 L 8.18 3.99 0.00 1.60 1.68 0.85 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 39 G 7.87 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 40 T 7.72 4.12 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 1.29 0.00 0.00 41 L 8.05 4.18 0.00 1.67 1.75 0.85 0.73 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 42 S 7.96 4.41 0.00 4.01 4.08 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 0.00 0.00 0.00 43 K 7.88 4.20 0.00 1.61 1.76 0.00 1.64 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.74 7.81 44 H 7.43 5.05 0.00 3.09 3.49 0.00 5.64 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 E 8.93 4.53 0.00 2.16 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 2.21 2.30 0.00 46 L 8.30 5.41 0.00 1.52 1.51 0.92 0.96 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 47 Y 9.28 5.29 0.00 2.90 2.85 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 48 A 9.20 5.36 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 49 T 8.63 4.16 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 1.13 0.00 0.00 50 G 8.84 3.73 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 0.00 0.00 0.00 51 T 7.78 4.00 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 52 T 7.99 3.97 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 53 G 8.27 3.81 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 0.00 0.00 0.00 54 A 7.95 4.02 1.38 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 0.00 0.00 55 L 8.03 3.94 0.00 1.96 1.75 0.95 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 56 L 8.13 4.00 0.00 1.82 1.71 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 8.04 4.17 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.58 2.59 0.00 58 E 8.60 3.97 0.00 1.97 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 0.00 2.32 2.34 0.00 59 K 8.39 4.44 0.00 1.78 1.83 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.61 7.81 60 L 7.55 4.63 0.00 1.79 1.60 0.90 0.84 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 61 G 7.95 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 L 8.00 4.04 0.00 1.57 1.54 0.89 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.33 4.36 0.00 1.81 1.62 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.30 1.01 7.81 64 V 7.69 4.60 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 0.83 0.00 0.00 0.89 0.00 0.00 65 H 8.66 4.43 0.00 2.66 3.18 0.00 5.60 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 R 8.54 4.93 0.00 1.69 1.87 0.00 3.28 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.79 0.00 67 L 8.73 4.54 0.00 1.51 1.87 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 68 K 9.07 4.30 0.00 1.79 1.74 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.43 7.81 69 S 8.71 4.40 0.00 3.87 3.79 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 70 G 9.08 3.81 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 0.00 0.00 0.00 71 P 0.00 4.53 0.00 2.05 2.25 0.00 3.64 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 2.04 2.22 0.00 72 L 7.77 4.63 0.00 1.59 1.64 0.91 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.55 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 0.00 0.00 0.00 74 G 8.37 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 0.00 0.00 0.00 75 D 8.03 4.35 0.00 2.92 2.93 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 0.00 0.00 0.00 76 Q 7.99 4.04 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 77 Q 8.18 3.96 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.59 0.00 78 I 7.81 3.74 1.81 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 1.39 0.77 0.85 0.00 0.00 79 G 8.14 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.24 3.95 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 M 8.12 3.86 0.00 1.84 2.10 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.42 0.00 82 I 7.92 3.71 1.96 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 1.41 0.93 0.92 0.00 0.00 83 A 7.58 2.61 1.17 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 84 E 7.48 4.35 0.00 1.85 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 2.20 2.27 0.00 85 G 7.60 3.86 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 0.00 0.00 0.00 86 K 8.07 4.16 0.00 1.68 1.68 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.38 1.48 7.81 87 I 7.34 4.64 1.75 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.66 0.93 0.00 0.00 88 D 9.27 4.99 0.00 2.64 2.70 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 89 V 7.76 4.65 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 1.07 0.00 0.00 1.00 0.00 0.00 90 L 9.01 5.03 0.00 1.82 1.54 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 91 I 8.92 4.83 1.76 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 1.14 0.96 0.48 0.00 0.00 92 F 9.40 5.37 0.00 2.93 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 93 F 9.30 5.27 0.00 3.08 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 94 W 8.58 5.31 0.00 2.89 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 0.00 0.00 0.00 0.00 95 D 9.10 4.47 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 96 P 0.00 3.99 0.00 1.82 1.02 0.00 3.41 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.42 0.00 97 L 8.02 4.47 0.00 1.46 1.60 0.88 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.40 4.80 0.00 1.91 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 2.20 2.33 0.00 99 P 0.00 4.42 0.00 2.20 2.30 0.00 3.86 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 100 Q 8.70 4.05 0.00 1.83 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.77 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 101 A 8.61 3.99 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 0.00 102 H 7.68 4.77 0.00 3.25 3.44 0.00 5.54 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 D 7.47 4.45 0.00 2.83 2.30 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 0.00 104 V 8.60 3.63 2.30 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 0.83 0.00 0.00 0.96 0.00 0.00 105 D 8.79 4.41 0.00 2.82 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 0.00 106 V 8.37 3.50 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 0.12 0.00 0.00 0.06 0.00 0.00 107 K 8.08 3.69 0.00 2.13 1.79 0.00 1.85 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.54 1.10 7.81 108 A 8.12 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 109 L 7.43 3.95 0.00 2.01 1.82 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 110 I 7.96 3.74 1.81 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.52 0.79 0.00 0.00 111 R 8.33 3.79 0.00 1.95 2.08 0.00 3.02 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 112 I 7.78 3.78 1.90 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.20 1.00 0.00 0.00 113 A 8.15 4.15 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 0.00 114 T 7.78 3.96 4.34 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 1.22 0.00 0.00 115 V 7.52 3.16 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 0.17 0.00 0.00 0.72 0.00 0.00 116 Y 7.79 4.37 0.00 3.13 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 0.00 117 N 7.72 4.12 0.00 2.82 2.83 0.00 0.00 6.97 7.45 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 0.00 118 I 7.80 4.72 2.17 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.88 1.08 0.00 0.00 119 P 0.00 4.44 0.00 2.14 2.03 0.00 3.91 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.10 0.00 120 V 8.41 4.86 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 0.82 0.00 0.00 0.97 0.00 0.00 121 A 9.36 4.71 1.27 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 0.00 0.00 0.00 122 I 8.79 5.25 1.93 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 1.03 1.43 0.77 0.00 0.00 123 T 7.35 4.51 4.09 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 0.00 0.00 0.00 1.17 0.00 0.00 124 R 7.83 3.29 0.00 0.86 1.61 0.00 3.11 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.60 0.00 125 S 7.85 4.22 0.00 4.10 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 0.00 126 T 7.83 3.69 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 1.23 0.00 0.00 127 A 7.89 4.02 0.83 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 0.00 128 D 8.18 4.74 0.00 3.11 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 0.00 129 F 8.49 4.11 0.00 3.12 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 0.00 130 L 8.45 4.22 0.00 2.10 1.85 0.98 0.90 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 0.00 131 I 8.04 3.99 2.39 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.69 1.18 0.00 0.00 132 S 7.51 4.55 0.00 4.06 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 0.00 133 S 7.52 4.25 0.00 3.94 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 0.00 134 P 0.00 4.36 0.00 2.24 2.11 0.00 3.65 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 2.12 2.12 0.00 135 L 7.87 4.17 0.00 1.54 1.37 0.72 0.57 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 0.00 136 M 7.99 3.99 0.00 2.06 2.35 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.62 0.00 137 N 7.75 5.00 0.00 2.84 2.86 0.00 0.00 6.88 7.94 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 0.00 138 D 7.61 5.19 0.00 2.74 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 0.00 139 V 8.45 4.26 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 1.02 0.00 0.00 140 Y 8.53 5.04 0.00 3.05 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 0.00 141 E 8.85 4.58 0.00 1.68 1.78 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 1.99 1.66 0.00 142 K 9.18 4.80 0.00 1.90 1.91 0.00 1.26 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.23 1.49 7.81 143 I 8.35 4.77 1.86 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 1.21 0.85 0.85 0.00 0.00 144 Q 9.01 4.59 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 7.00 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 145 I 8.18 3.81 1.03 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.46 0.03 0.00 0.00 146 D 8.35 4.67 0.00 2.77 2.49 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 0.00 147 Y 7.53 4.18 0.00 2.95 2.85 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 0.00 148 E 8.20 3.94 0.00 2.13 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 2.41 2.46 0.00 149 E 8.42 3.88 0.00 2.32 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 0.00 2.31 2.35 0.00 150 E 7.85 3.90 0.00 2.04 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 2.34 2.34 0.00 151 L 8.24 3.99 0.00 1.90 1.88 0.93 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 152 E 8.25 3.99 0.00 2.06 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 2.65 2.51 0.00 153 R 7.85 3.92 0.00 2.04 1.99 0.00 3.13 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 154 R 7.85 3.94 0.00 2.06 1.98 0.00 3.14 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 155 I 8.09 3.75 1.88 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 1.39 0.79 0.92 0.00 0.00 156 R 8.17 3.94 0.00 1.80 1.95 0.00 3.28 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 157 K 7.69 4.08 0.00 2.02 1.92 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.46 7.81 158 V 7.38 3.69 2.22 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 0.79 0.00 0.00 0.95 0.00 0.00 159 V 7.82 3.59 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 0.89 0.00 0.00 0.93 0.00 0.00 160 E 8.26 4.12 0.00 2.17 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00