NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 A 4.3850 8.1233 123.5882 52.2517 21.2066 178.6523 10 N 4.1016 8.2749 112.2022 56.2327 38.5734 175.8016 11 S 4.1069 8.8844 117.2541 61.9420 63.5136 176.1722 12 T 3.9060 8.0174 117.7829 66.8660 68.2252 176.4519 13 V 3.4796 8.0356 119.8058 66.1213 31.5098 177.9516 14 L 3.8725 8.3835 119.0097 57.8187 41.2450 179.6327 15 S 4.1453 8.7801 113.3726 61.3525 62.1850 175.8776 16 F 4.3866 8.0101 121.9086 61.7247 39.2885 176.5491 17 C 3.8165 8.1606 115.9840 61.9894 27.7388 175.5880 18 A 3.6648 7.7547 123.1582 55.1792 17.7740 178.4866 19 F 4.5070 7.4409 110.4613 57.7101 39.5399 176.4851 20 A 4.1756 7.1667 124.2832 51.6526 18.7326 178.2432 21 V 3.7301 8.4201 114.3149 63.7511 31.9878 176.1230 22 D 4.7645 7.5943 119.1823 50.4925 41.3980 173.5957 23 P 4.1731 0.0000 0.0000 65.3175 31.5374 177.1940 24 A 3.9284 8.0217 118.5074 55.4023 18.1895 179.4595 25 K 3.9176 9.0410 117.9144 59.6027 32.1903 178.8873 26 A 4.1672 8.0811 121.1655 55.2783 18.0870 179.0227 27 Y 4.1913 8.2264 118.2179 60.5687 38.7596 178.1348 28 K 3.8857 8.1196 119.5501 59.4879 32.0046 178.8762 29 D 4.3728 8.2943 118.0785 57.6235 41.1691 177.7697 30 Y 4.2088 8.3780 120.0316 60.9717 38.7263 178.4320 31 L 3.7846 8.2484 119.5644 57.6296 41.5843 179.0489 32 A 4.1711 8.0807 118.1289 53.6340 18.2452 177.8590 33 S 4.4223 7.3910 112.3791 57.7992 63.3409 174.6223 34 G 3.7145 8.3683 108.5225 46.1238 0.0000 174.6728 35 G 2.9235 7.2433 107.1992 44.1484 0.0000 174.0121 36 Q 4.1706 8.3881 122.1878 54.6974 29.7839 174.3823 37 P 4.7144 0.0000 0.0000 62.2887 32.1419 176.2023 38 I 4.1079 8.5236 121.7815 61.7109 37.6165 176.1834 39 T 4.7878 8.4167 114.8164 61.1807 71.0511 173.5739 40 N 4.2458 8.7761 117.5409 55.0697 35.6184 173.8719 41 C 4.4655 8.1511 116.2677 58.6343 28.9863 174.1943 42 V 3.8692 8.0203 118.7820 61.8448 32.2915 175.4471 43 K 4.6639 8.5408 123.4210 54.8282 34.2566 175.8863 44 M 4.2843 8.7648 124.1570 54.6987 33.4188 176.6399 45 L 4.3475 8.3725 124.1855 53.5443 41.1769 175.0054 46 C 4.8751 7.7406 119.0054 55.5130 33.0293 175.2279 47 T 3.6740 8.4578 114.2335 63.8717 66.7319 173.5552 48 H 4.2200 7.6054 116.3246 57.1640 26.3983 174.9205 49 T 4.6555 7.4391 106.3107 61.2938 69.3800 174.5432 50 G 3.9023 8.0862 112.8658 45.8376 0.0000 174.1984 51 T 3.8805 9.2521 109.5692 62.9159 68.7687 175.8816 52 G 3.9991 8.7810 110.1115 45.2925 0.0000 173.8323 53 Q 4.1309 7.4757 118.3519 55.7206 29.5671 176.3545 54 A 4.0575 8.4669 123.6384 54.6962 19.1488 177.7440 55 I 5.1123 7.3801 114.3762 59.9219 40.6384 174.9436 56 T 4.8453 9.0543 116.3443 60.0617 72.4338 175.2826 57 V 4.1543 8.6625 114.4345 63.1799 32.0598 176.5887 58 T 4.3698 7.6283 108.3920 58.9823 71.2958 171.5838 59 P 4.2142 0.0000 0.0000 63.8497 31.7035 175.9100 60 E 4.6275 10.3335 122.5276 55.6561 30.9588 175.4717 61 A 4.4666 7.5975 122.0709 52.5101 19.1124 178.3783 62 N 5.1101 9.1787 120.7237 51.8457 39.9548 175.4476 63 M 4.0857 8.7036 116.2327 58.5408 32.2837 176.7943 64 D 4.8986 8.9115 118.1142 54.0182 41.1630 175.2723 65 Q 5.3674 7.7559 117.9455 54.4250 33.3589 174.1511 66 E 4.7629 9.2879 118.3403 54.9902 34.0137 175.2363 67 S 5.3174 8.3766 118.9234 57.1726 65.3915 173.2090 68 F 5.2823 9.4205 122.2820 55.2087 43.5287 174.4021 69 G 3.9353 8.8902 108.1542 46.1705 0.0000 174.6421 70 G 4.4969 9.5954 114.7762 47.5147 0.0000 175.4356 71 A 4.0615 8.0531 123.3173 54.7159 18.1728 179.1189 72 S 4.3511 7.7829 109.7254 60.1329 63.5036 174.4421 73 C 4.4887 8.1278 119.1825 59.4374 30.0830 172.6559 74 C 4.3975 7.8295 120.0396 55.5867 39.1784 173.1357 75 L 3.5830 8.2417 130.6745 58.3961 41.4992 178.3295 76 Y 3.7508 7.2010 115.6846 61.2106 37.6736 178.8202 77 C 4.0404 8.1690 115.3841 60.3668 40.3884 176.1117 78 R 3.8165 8.3110 119.0986 59.3889 29.7052 178.5919 79 C 4.0504 8.1759 115.1848 60.2598 29.0715 172.7945 80 H 3.9074 8.4096 116.1441 56.1604 25.1375 173.3630 81 I 4.6201 6.9433 110.2800 58.9724 41.2954 175.4931 82 D 4.5049 8.1725 119.3748 54.4639 41.2683 175.3352 83 H 4.1599 8.1540 115.4033 54.2023 32.5515 171.2256 84 P 4.3107 0.0000 0.0000 65.4968 31.4342 178.2868 85 N 3.2200 6.3495 112.5134 54.4527 39.8861 174.3684 *89 F 3.7331 7.5784 120.1763 56.7877 40.8055 174.7414 90 C 3.9675 7.9943 118.3131 58.6763 29.1306 174.2017 91 D 4.5192 8.8633 123.1760 54.5795 39.1561 177.0040 92 L 4.4301 8.6098 121.5019 55.8445 43.1198 176.9111 93 K 3.9956 7.9677 119.6616 57.9989 32.2377 176.7554 94 G 3.8559 8.9964 114.5535 45.0091 0.0000 172.1839 95 K 4.5541 7.3373 118.2718 54.6164 36.1714 173.9415 96 Y 5.0964 9.1097 117.7054 56.5776 41.3482 175.2574 97 V 4.8081 8.8635 124.2471 61.7839 33.4805 174.3878 98 Q 5.1172 9.1366 127.8160 54.9556 29.8763 175.2725 99 I 4.3463 9.1922 125.1189 58.3319 41.0957 173.6433 100 P 4.6205 0.0000 0.0000 63.0016 31.7986 177.3961 101 T 3.9055 8.8543 120.6972 67.2530 68.1506 176.7685 102 T 3.9541 7.8976 109.8589 63.9755 69.3842 175.2720 103 C 4.4666 8.0613 118.0754 59.4999 28.7361 175.0923 104 A 4.0370 7.2834 122.8982 54.6433 17.9664 178.5054 105 N 4.6375 7.9044 112.7761 53.6283 38.9575 175.3760 106 D 4.7319 7.8230 119.3476 51.9529 43.4346 173.3937 107 P 3.9640 0.0000 0.0000 65.4487 31.7594 178.1621 108 V 4.1964 7.1526 117.7371 65.5563 31.2494 178.1826 109 G 3.9056 8.2517 106.0511 46.8664 0.0000 175.1373 110 F 3.7665 8.2971 123.3311 61.4879 39.1252 177.5178 111 T 3.6426 7.5478 107.2925 64.4620 68.5589 176.1617 112 L 4.1554 7.0990 120.9132 57.3273 41.8402 178.6884 113 R 4.2362 7.8803 115.5047 55.9415 30.5399 175.5761 114 N 4.9916 6.9584 115.2538 51.3935 41.7915 173.5367 115 T 4.9381 8.2830 114.4324 62.0070 72.5418 173.4826 116 V 4.2275 8.3731 125.3814 61.7565 32.9067 175.0780 117 C 4.3749 9.0358 129.4817 59.5552 31.9162 174.7362 118 T 3.8821 8.6433 116.3547 64.6191 68.5758 175.7986 119 V 3.6602 7.5596 121.5906 64.9043 30.7249 176.0530 120 C 4.3706 7.9494 112.5559 57.3109 30.7216 174.6845 121 G 3.7094 8.2445 109.0446 46.5820 0.0000 173.0814 122 M 4.7941 7.0072 116.0773 52.2001 35.0886 175.3910 123 W 4.9414 8.4432 120.4192 56.5341 29.6248 176.3113 124 K 4.1414 9.1235 124.3633 58.3331 31.8208 177.5219 125 G 3.9297 9.6985 112.2794 45.7388 0.0000 172.8067 126 Y 4.8400 8.7365 116.4771 55.8312 38.7002 173.6257 127 G 3.6787 8.6837 113.3667 45.9966 0.0000 173.2753 128 C 4.0150 8.1938 119.4785 60.4195 32.1060 173.4508 129 S 4.0700 8.6810 119.3078 59.1928 62.6658 172.0902 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 9 A 8.12 4.38 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 10 N 8.27 4.10 0.00 2.83 2.89 0.00 0.00 6.94 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 11 S 8.88 4.11 0.00 3.89 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 12 T 8.02 3.91 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 1.28 0.00 0.00 13 V 8.04 3.48 1.94 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 0.13 0.00 0.00 0.93 0.00 0.00 14 L 8.38 3.87 0.00 1.83 1.63 0.85 0.55 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 15 S 8.78 4.15 0.00 4.02 4.15 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 16 F 8.01 4.39 0.00 3.11 3.35 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 17 C 8.16 3.82 0.00 2.83 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 18 A 7.75 3.66 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 19 F 7.44 4.51 0.00 2.99 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 20 A 7.17 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.42 3.73 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 0.71 0.00 0.00 0.93 0.00 0.00 22 D 7.59 4.76 0.00 2.62 2.50 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 23 P 0.00 4.17 0.00 2.05 1.98 0.00 3.74 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.33 0.00 24 A 8.02 3.93 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 25 K 9.04 3.92 0.00 2.01 2.00 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.59 1.48 7.81 26 A 8.08 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 8.23 4.19 0.00 2.94 3.09 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 0.00 28 K 8.12 3.89 0.00 2.06 1.84 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.78 7.81 29 D 8.29 4.37 0.00 2.92 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 30 Y 8.38 4.21 0.00 3.36 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 31 L 8.25 3.78 0.00 1.72 1.56 0.67 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.08 4.17 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 33 S 7.39 4.42 0.00 3.79 3.71 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 34 G 8.37 3.71 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 0.00 0.00 0.00 35 G 7.24 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 0.00 0.00 0.00 36 Q 8.39 4.17 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.98 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 37 P 0.00 4.71 0.00 2.15 2.34 0.00 3.79 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 38 I 8.52 4.11 1.77 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.53 0.88 0.00 0.00 39 T 8.42 4.79 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 40 N 8.78 4.25 0.00 2.91 3.00 0.00 0.00 6.78 7.66 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 41 C 8.15 4.47 0.00 3.06 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 42 V 8.02 3.87 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 0.90 0.00 0.00 1.04 0.00 0.00 43 K 8.54 4.66 0.00 1.47 1.39 0.00 1.62 0.00 0.00 1.53 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.30 1.35 7.81 44 M 8.76 4.28 0.00 1.74 1.90 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.79 0.00 45 L 8.37 4.35 0.00 1.54 1.56 0.90 0.83 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 46 C 7.74 4.88 0.00 2.96 2.82 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 47 T 8.46 3.67 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 1.17 0.00 0.00 48 H 7.61 4.22 0.00 3.25 3.40 0.00 5.65 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 7.44 4.66 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 1.28 0.00 0.00 50 G 8.09 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 51 T 9.25 3.88 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 1.30 0.00 0.00 52 G 8.78 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 0.00 0.00 0.00 53 Q 7.48 4.13 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 54 A 8.47 4.06 -0.23 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 55 I 7.38 5.11 1.78 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 1.48 0.50 0.92 0.00 0.00 56 T 9.05 4.85 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 1.22 0.00 0.00 57 V 8.66 4.15 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 0.78 0.00 0.00 0.97 0.00 0.00 58 T 7.63 4.37 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 1.22 0.00 0.00 59 P 0.00 4.21 0.00 1.81 1.88 0.00 3.08 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.38 0.00 60 E 10.33 4.63 0.00 1.87 1.88 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 2.46 2.36 0.00 61 A 7.60 4.47 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 62 N 9.18 5.11 0.00 2.96 3.03 0.00 0.00 6.77 7.22 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 63 M 8.70 4.09 0.00 2.04 2.20 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 64 D 8.91 4.90 0.00 2.72 2.69 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 65 Q 7.76 5.37 0.00 1.89 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.39 6.61 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 66 E 9.29 4.76 0.00 1.94 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 2.23 2.42 0.00 67 S 8.38 5.32 0.00 3.66 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 68 F 9.42 5.28 0.00 2.99 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 69 G 8.89 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 0.00 0.00 0.00 70 G 9.60 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 8.05 4.06 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 72 S 7.78 4.35 0.00 4.02 4.03 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 73 C 8.13 4.49 0.00 2.96 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 74 C 7.83 4.40 0.00 3.01 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 75 L 8.24 3.58 0.00 1.31 0.98 0.28 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 7.20 3.75 0.00 2.92 2.84 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 77 C 8.17 4.04 0.00 3.16 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 78 R 8.31 3.82 0.00 1.61 1.81 0.00 3.22 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 79 C 8.18 4.05 0.00 2.82 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 80 H 8.41 3.91 0.00 3.25 3.38 0.00 5.61 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 81 I 6.94 4.62 1.78 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 1.32 0.60 0.72 0.00 0.00 82 D 8.17 4.50 0.00 2.61 2.65 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 83 H 8.15 4.16 0.00 2.78 2.67 0.00 5.88 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 P 0.00 4.31 0.00 2.08 1.98 0.00 2.75 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 85 N 6.35 3.22 0.00 2.68 2.68 0.00 0.00 6.88 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 *89 F 7.58 3.73 0.00 2.87 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 C 7.99 3.97 0.00 3.16 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 91 D 8.86 4.52 0.00 2.81 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 92 L 8.61 4.43 0.00 1.71 1.79 1.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 93 K 7.97 4.00 0.00 1.79 1.85 0.00 2.02 0.00 0.00 2.01 0.00 0.00 3.08 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.50 7.81 94 G 9.00 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 95 K 7.34 4.55 0.00 1.80 1.89 0.00 1.79 0.00 0.00 1.83 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.41 7.81 96 Y 9.11 5.10 0.00 2.94 2.90 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 97 V 8.86 4.81 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 1.46 0.00 0.00 1.07 0.00 0.00 98 Q 9.14 5.12 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.37 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 99 I 9.19 4.35 1.97 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 1.07 0.99 0.12 0.00 0.00 100 P 0.00 4.62 0.00 1.77 1.99 0.00 2.20 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 2.06 0.00 101 T 8.85 3.91 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 102 T 7.90 3.95 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 1.25 0.00 0.00 103 C 8.06 4.47 0.00 2.31 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 0.00 104 A 7.28 4.04 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.90 4.64 0.00 2.88 2.96 0.00 0.00 5.78 8.06 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 0.00 106 D 7.82 4.73 0.00 2.80 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 P 0.00 3.96 0.00 1.74 1.10 0.00 3.49 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 1.46 1.43 0.00 108 V 7.15 4.20 1.86 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 0.91 0.00 0.00 0.75 0.00 0.00 109 G 8.25 3.91 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 0.00 0.00 0.00 110 F 8.30 3.77 0.00 3.08 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 0.00 111 T 7.55 3.64 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 1.40 0.00 0.00 112 L 7.10 4.16 0.00 1.99 1.77 0.87 0.87 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 0.00 113 R 7.88 4.24 0.00 1.54 1.85 0.00 3.06 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 114 N 6.96 4.99 0.00 1.44 2.40 0.00 0.00 6.72 8.57 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 0.00 115 T 8.28 4.94 4.36 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 1.27 0.00 0.00 116 V 8.37 4.23 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 0.48 0.00 0.00 0.10 0.00 0.00 117 C 9.04 4.37 0.00 3.03 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 0.00 118 T 8.64 3.88 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 1.21 0.00 0.00 119 V 7.56 3.66 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 0.84 0.00 0.00 0.93 0.00 0.00 120 C 7.95 4.37 0.00 3.13 3.14 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 0.00 121 G 8.24 3.71 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 0.00 0.00 0.00 122 M 7.01 4.79 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.46 0.00 123 W 8.44 4.94 0.00 3.87 3.32 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 0.00 124 K 9.12 4.14 0.00 2.00 1.89 0.00 1.67 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.51 7.81 125 G 9.70 3.93 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 0.00 0.00 0.00 126 Y 8.74 4.84 0.00 3.17 3.05 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 0.00 0.00 0.00 127 G 8.68 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.19 4.02 0.00 3.03 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 0.00 129 S 8.68 4.07 0.00 3.99 3.78 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 * Residues marked with a * may have inaccurate shift predictions.