NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 N 4.7238 8.2827 118.1334 53.3389 40.9517 176.2375 8 K 3.7409 8.2391 118.3358 58.6570 32.5406 176.4967 9 F 4.6266 8.6910 119.4320 61.3650 40.6288 175.5145 10 K 3.8606 8.3452 120.9395 59.5477 32.1760 180.1853 11 K 4.0004 8.2341 117.0652 56.5391 31.4479 178.8685 *13 A 4.2441 8.1645 123.7663 52.2694 20.5387 179.9695 14 L 3.9101 7.9120 115.7475 57.8655 41.5006 179.6883 15 R 3.8370 8.0845 118.6778 59.3169 29.9783 178.7320 16 V 3.5611 7.6232 117.5268 65.9915 31.3822 177.8141 17 I 3.6205 7.6217 118.0285 64.4039 37.1561 177.8910 18 A 4.0990 8.0998 121.5675 55.3463 18.0197 179.5152 19 E 4.0139 8.2958 115.5842 58.7054 29.6460 178.6635 20 S 4.5162 7.6021 113.2266 57.6912 63.6662 174.4263 21 L 4.2869 7.0935 123.6065 54.4268 42.0412 177.8918 22 S 4.4675 9.1533 118.8636 57.9834 65.3070 175.4542 23 E 3.9809 8.6715 121.7299 59.4272 29.1620 179.4709 24 E 4.1042 8.1535 118.5395 59.1950 29.6105 178.7944 25 E 4.0605 8.3746 118.7866 59.3012 29.4939 179.3877 26 I 3.7204 8.1166 119.8808 64.4568 37.2467 178.2995 27 A 4.1637 8.2719 121.6830 55.0275 17.9264 179.9030 28 G 3.7728 8.0503 103.4170 48.1736 0.0000 175.6329 29 L 4.0919 7.9836 120.6679 57.1926 41.8010 179.2669 30 K 4.3182 8.3818 119.7575 59.3178 31.6462 179.1919 31 E 4.2962 8.1367 116.7604 56.7313 29.3469 178.0970 *33 F 3.8040 7.9871 120.3172 57.6435 40.8715 178.6637 34 N 4.6673 8.1336 116.7692 53.2037 37.4656 176.4830 *36 I 4.0451 7.8865 120.3414 61.5043 39.5333 176.8769 37 D 4.3693 7.6667 121.0698 53.0993 38.8621 176.1988 38 A 3.9350 7.7596 125.1840 54.7359 19.0361 178.4531 39 D 4.6076 7.9780 112.7524 52.6130 39.7954 176.3073 40 K 3.9412 7.7449 118.2987 57.8114 30.0857 175.9389 41 S 4.3131 8.2642 111.6273 58.5855 63.6612 175.2178 42 G 4.1650 9.6981 110.0485 45.5861 0.0000 173.3354 43 Q 4.8632 7.7513 117.6811 54.3319 33.0805 174.3474 44 I 4.5023 8.8395 125.2658 60.2781 38.9101 175.7072 45 T 4.6290 8.7583 117.7056 60.3560 70.9069 175.6733 46 F 4.3868 9.0699 123.5827 61.8411 39.3220 176.9352 47 E 3.7282 8.2084 117.3629 59.5095 29.2604 179.1322 48 E 3.9081 7.9802 118.0061 59.1611 29.4347 179.1458 49 L 3.9203 8.1419 120.7740 58.1638 41.9685 179.1982 50 K 3.8022 7.8277 117.2460 59.3615 31.9707 178.9006 51 A 4.1965 7.7606 119.9433 54.4003 18.6692 179.1385 52 G 3.7857 8.2955 103.9211 46.4279 0.0000 176.0740 53 L 4.0771 8.0789 121.8232 57.7167 41.5476 179.5512 54 K 4.1018 8.1022 118.1696 60.2241 32.1351 179.1647 55 R 4.1203 7.9147 118.1644 58.1685 29.9608 177.6008 56 V 4.2659 7.5987 110.3324 61.2017 31.6774 176.3250 57 G 4.0842 8.3872 106.6777 45.3604 0.0000 174.1393 58 A 4.3994 8.0879 121.2498 53.4470 21.0916 177.5247 59 N 4.0270 8.0284 109.9698 54.7257 36.8725 172.4846 60 L 4.4365 7.3045 119.4673 53.4276 43.8328 177.8072 61 K 4.2572 8.6054 119.1843 56.1100 33.8399 178.0411 62 E 3.9889 8.7864 122.1051 59.7542 29.5530 179.4868 63 S 4.2354 8.1043 113.6661 61.4896 63.1075 176.2081 64 E 4.0512 8.0545 121.7830 59.1713 29.0971 179.0803 65 I 3.8404 7.8674 119.3221 64.2185 37.2319 177.9260 66 L 3.9485 8.0960 120.4150 58.1496 42.2019 178.3020 67 D 4.5368 8.1657 118.9189 57.1804 40.6156 179.0285 68 L 3.8854 7.8819 117.9349 55.8837 41.3080 178.4548 *70 Q 4.1429 8.1090 118.1577 55.4015 30.7342 177.5749 71 A 4.1176 8.0218 119.6385 55.0271 18.5295 178.6983 72 A 4.0766 8.1647 118.2378 54.8488 19.1428 177.8979 73 D 4.8214 7.3649 118.1890 53.3123 39.4936 177.1310 74 V 3.7548 7.7894 115.0046 63.0344 32.3256 176.9585 75 D 4.7284 7.8886 116.6868 52.0591 39.4361 175.8647 76 N 4.3401 7.9002 115.5376 54.6043 36.6900 175.6990 77 S 4.1481 8.3493 112.6887 59.3974 63.5588 175.4446 78 G 3.9741 9.3510 109.0299 45.5975 0.0000 172.9668 79 T 4.9265 8.0751 108.6493 59.8551 72.4008 173.4353 80 I 4.7119 8.8345 124.6487 60.1297 38.9806 175.6376 81 D 5.2072 9.5408 128.2475 52.3681 41.6458 177.0462 82 Y 3.3851 8.5661 118.2887 60.6549 38.5380 178.1071 83 K 3.6898 7.9688 118.7278 59.4635 32.2866 179.0253 84 E 3.9752 8.8268 119.2089 59.2079 29.3016 179.2939 85 F 4.1509 8.5031 121.0252 61.3258 39.4440 177.1264 86 I 3.3347 7.6233 119.2150 64.3727 36.6848 178.1543 87 A 3.8961 7.6309 119.6708 55.2175 18.3492 179.2565 88 A 4.0481 7.9984 119.4075 55.3856 18.4974 179.8812 89 T 3.6045 7.6282 108.3655 64.8686 68.4216 176.3284 90 L 4.0884 7.4506 120.1325 56.5100 41.6799 177.8052 91 H 4.9889 8.0897 114.9835 54.5278 29.8515 174.6410 92 L 4.5739 7.5142 121.5115 51.9253 43.0604 176.2492 93 N 4.1861 8.8758 122.7883 56.9284 38.5423 176.1380 94 K 3.8463 8.1168 117.7210 59.3323 32.2392 178.4989 95 I 4.1375 7.4249 119.0633 63.6950 37.8002 177.9070 96 E 4.2241 8.4735 119.9431 58.6968 29.0754 179.0686 97 R 4.1028 8.2313 116.3207 58.2338 29.5955 177.5412 98 E 4.6507 8.2088 118.7673 56.4374 29.6490 177.1323 99 D 4.4234 8.0900 121.7614 57.9583 40.8474 178.5277 100 H 4.3969 8.1439 116.1684 58.7252 28.7731 177.6431 101 L 4.3552 8.1381 120.5395 57.8840 41.5086 179.1433 102 F 3.9924 8.9160 120.7350 60.9175 39.1606 177.0539 103 A 4.2025 8.3966 120.5383 55.2294 18.1730 179.5366 104 A 3.9536 8.1616 119.1600 55.1036 18.5145 179.5086 105 F 3.4603 8.5279 119.7729 61.5927 39.2260 177.4784 106 T 3.9778 8.1839 107.6140 64.3032 68.6873 175.6965 107 Y 3.9899 7.3983 122.2505 60.6973 38.8723 177.3960 108 F 4.3334 7.5087 117.1506 59.4387 40.6317 176.5843 109 D 4.4635 7.7728 119.9922 52.2068 37.2719 176.3068 110 K 3.6654 7.7687 122.4925 59.3829 32.6959 177.9311 111 D 4.5851 8.4224 114.9444 52.4285 39.5548 176.3143 112 G 4.0474 8.0703 107.5633 47.2969 0.0000 175.4092 113 S 4.2446 8.4569 115.6572 59.1326 63.4332 175.2820 114 G 4.0575 10.1571 109.6874 45.1872 0.0000 172.7298 115 Y 5.1720 7.5133 116.0540 56.3973 42.3756 174.7095 116 I 4.4795 9.2105 124.7684 60.6221 38.7180 175.5089 117 T 4.7331 8.7212 117.5530 59.5143 71.2874 173.9521 118 P 4.1988 0.0000 0.0000 66.1419 31.1763 178.4165 119 D 4.3221 8.0463 116.0485 57.2781 41.1018 178.0418 120 E 3.9548 7.7118 118.9873 59.0912 29.4639 178.9442 121 L 3.9417 8.1881 119.5004 58.0327 41.5173 179.4772 122 Q 3.9637 8.0119 117.8612 59.2171 29.2479 177.7368 123 Q 4.1469 8.3311 119.0329 59.1233 28.5725 178.9473 124 A 4.1983 8.2282 120.6383 55.4694 18.6275 179.0976 125 C 4.3723 7.9028 112.9897 61.3164 29.1023 174.8433 126 E 4.4409 7.8520 121.8805 56.0129 27.0249 175.7738 127 E 4.3173 7.7434 121.8158 58.5435 32.3395 176.6419 *136 E 4.3482 8.1059 110.6025 54.9800 31.5224 178.1180 137 E 4.1341 8.0496 117.9827 59.9669 30.0781 178.6248 138 L 3.7551 8.1372 119.6951 56.1553 42.4938 178.5892 *140 R 4.1634 8.0524 119.7144 56.4014 31.4176 176.1611 141 D 4.4845 7.5789 114.0017 56.1609 41.7128 177.5158 142 V 3.7984 7.6940 118.3130 65.4483 31.7858 176.5702 143 D 4.8173 7.7194 120.0661 53.3171 39.0625 175.2821 144 Q 4.1238 8.3303 122.5375 57.5516 29.2328 176.9994 145 D 4.7435 8.2510 114.9430 52.1809 39.8800 175.7477 146 N 4.2785 7.8400 116.0822 54.9653 36.3887 174.3287 147 D 4.5998 8.7421 114.5193 52.8510 40.0274 177.0409 148 G 3.9322 8.7533 107.6377 45.8885 0.0000 173.4121 149 R 4.9320 7.9810 116.6658 54.3203 34.7607 174.7235 150 I 4.8243 8.8564 122.1562 59.9758 39.4358 175.6727 151 D 5.0478 9.6208 128.1671 52.2234 41.7968 177.0880 152 Y 3.0432 8.2041 118.2197 60.7277 37.9585 177.5754 153 N 4.0914 8.0843 116.6861 56.4690 38.4314 177.1156 154 E 4.0302 8.8310 119.3874 59.0640 29.5728 178.8736 155 F 4.2831 7.9952 120.2052 61.1791 39.5765 177.0614 156 V 3.4770 7.4521 116.6188 65.1730 32.3901 176.5583 157 A 4.0907 7.5353 122.4039 52.4100 14.9370 177.4632 *160 Q 4.3445 7.8193 121.6453 55.5542 29.2721 175.6979 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 7 N 8.28 4.72 0.00 2.79 2.95 0.00 0.00 6.64 7.29 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 8 K 8.24 3.74 0.00 1.81 1.88 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.61 7.81 9 F 8.69 4.63 0.00 2.88 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.35 3.86 0.00 1.78 1.93 0.00 1.76 0.00 0.00 1.79 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.37 7.81 11 K 8.23 4.00 0.00 2.03 1.81 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.61 7.81 *13 A 8.16 4.24 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 14 L 7.91 3.91 0.00 1.83 1.65 0.80 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 15 R 8.08 3.84 0.00 1.92 1.92 0.00 3.30 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 16 V 7.62 3.56 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 1.02 0.00 0.00 0.95 0.00 0.00 17 I 7.62 3.62 1.98 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 1.42 0.72 0.86 0.00 0.00 18 A 8.10 4.10 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 19 E 8.30 4.01 0.00 2.06 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 2.34 2.39 0.00 20 S 7.60 4.52 0.00 4.00 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 21 L 7.09 4.29 0.00 1.66 1.61 0.88 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 22 S 9.15 4.47 0.00 4.16 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 23 E 8.67 3.98 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 24 E 8.15 4.10 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 25 E 8.37 4.06 0.00 2.22 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 2.27 2.39 0.00 26 I 8.12 3.72 2.07 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 1.75 1.06 1.01 0.00 0.00 27 A 8.27 4.16 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.05 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 L 7.98 4.09 0.00 1.85 1.88 0.87 0.93 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 30 K 8.38 4.32 0.00 1.85 2.00 0.00 1.44 0.00 0.00 1.44 0.00 0.00 2.16 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.38 1.25 7.81 31 E 8.14 4.30 0.00 2.24 2.28 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 2.85 2.59 0.00 *33 F 7.99 3.80 0.00 2.86 3.17 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 34 N 8.13 4.67 0.00 2.92 2.85 0.00 0.00 7.11 8.16 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 *36 I 7.89 4.05 1.58 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 0.33 0.78 0.00 0.00 37 D 7.67 4.37 0.00 1.91 2.23 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 38 A 7.76 3.93 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 39 D 7.98 4.61 0.00 2.74 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 40 K 7.74 3.94 0.00 1.89 1.91 0.00 1.71 0.00 0.00 1.96 0.00 0.00 3.06 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.38 1.50 7.81 41 S 8.26 4.31 0.00 3.96 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 42 G 9.70 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 43 Q 7.75 4.86 0.00 1.87 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.62 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 44 I 8.84 4.50 1.93 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 -0.02 0.85 0.00 0.00 45 T 8.76 4.63 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 46 F 9.07 4.39 0.00 3.05 3.13 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 0.00 0.00 0.00 47 E 8.21 3.73 0.00 2.06 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 2.39 2.44 0.00 48 E 7.98 3.91 0.00 2.20 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 49 L 8.14 3.92 0.00 1.91 1.85 1.01 0.81 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 50 K 7.83 3.80 0.00 1.59 1.64 0.00 1.44 0.00 0.00 0.79 0.00 0.00 2.42 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.95 0.52 7.81 51 A 7.76 4.20 1.30 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 52 G 8.30 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 0.00 0.00 0.00 53 L 8.08 4.08 0.00 1.71 1.77 0.97 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.10 4.10 0.00 2.00 2.09 0.00 1.51 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.64 1.56 7.81 55 R 7.91 4.12 0.00 1.99 2.02 0.00 3.16 0.00 0.00 3.21 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 56 V 7.60 4.27 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 0.72 0.00 0.00 1.03 0.00 0.00 57 G 8.39 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 0.00 0.00 0.00 58 A 8.09 4.40 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 59 N 8.03 4.03 0.00 2.78 2.80 0.00 0.00 6.99 7.78 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 60 L 7.30 4.44 0.00 1.71 1.81 0.95 1.07 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 61 K 8.61 4.26 0.00 1.84 1.75 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.46 7.81 62 E 8.79 3.99 0.00 2.05 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 2.54 2.36 0.00 63 S 8.10 4.24 0.00 4.11 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.05 4.05 0.00 2.21 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 0.00 2.42 2.42 0.00 65 I 7.87 3.84 2.19 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 1.46 0.69 1.07 0.00 0.00 66 L 8.10 3.95 0.00 1.58 1.84 0.19 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.17 4.54 0.00 2.96 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 68 L 7.88 3.89 0.00 1.79 1.83 0.91 0.65 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 *70 Q 8.11 4.14 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.21 0.00 71 A 8.02 4.12 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 72 A 8.16 4.08 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 73 D 7.36 4.82 0.00 2.92 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 74 V 7.79 3.75 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.98 0.00 0.00 75 D 7.89 4.73 0.00 2.82 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 76 N 7.90 4.34 0.00 2.87 2.90 0.00 0.00 6.92 7.55 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 77 S 8.35 4.15 0.00 4.02 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 78 G 9.35 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.08 4.93 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 80 I 8.83 4.71 2.01 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 1.37 1.14 1.16 0.00 0.00 81 D 9.54 5.21 0.00 2.84 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 82 Y 8.57 3.39 0.00 2.14 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 K 7.97 3.69 0.00 1.81 1.78 0.00 1.73 0.00 0.00 1.80 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.56 7.81 84 E 8.83 3.98 0.00 2.39 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 2.45 2.40 0.00 85 F 8.50 4.15 0.00 3.34 3.26 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 86 I 7.62 3.33 1.66 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.23 0.75 0.00 0.00 87 A 7.63 3.90 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 88 A 8.00 4.05 1.30 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 89 T 7.63 3.60 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 0.46 0.00 0.00 90 L 7.45 4.09 0.00 1.63 1.65 0.84 0.96 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 91 H 8.09 4.99 0.00 3.17 3.28 0.00 5.79 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 L 7.51 4.57 0.00 1.77 1.53 0.90 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 93 N 8.88 4.19 0.00 2.73 2.83 0.00 0.00 7.09 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.12 3.85 0.00 1.78 1.91 0.00 1.82 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.51 7.81 95 I 7.42 4.14 1.79 0.00 0.00 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 1.70 0.77 0.79 0.00 0.00 96 E 8.47 4.22 0.00 2.18 2.23 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 2.33 2.36 0.00 97 R 8.23 4.10 0.00 2.00 2.25 0.00 3.07 0.00 0.00 3.26 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.73 0.00 98 E 8.21 4.65 0.00 2.30 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 2.39 2.63 0.00 99 D 8.09 4.42 0.00 2.67 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 0.00 100 H 8.14 4.40 0.00 3.28 3.42 0.00 5.62 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 0.00 101 L 8.14 4.36 0.00 2.15 2.16 1.06 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 102 F 8.92 3.99 0.00 3.23 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 0.00 103 A 8.40 4.20 1.55 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 0.00 0.00 104 A 8.16 3.95 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 F 8.53 3.46 0.00 2.72 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 0.00 106 T 8.18 3.98 4.56 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 1.61 0.00 0.00 107 Y 7.40 3.99 0.00 2.78 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 0.00 108 F 7.51 4.33 0.00 2.91 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 0.00 109 D 7.77 4.46 0.00 2.09 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 K 7.77 3.67 0.00 1.70 1.79 0.00 1.61 0.00 0.00 1.52 0.00 0.00 2.83 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.48 1.29 7.81 111 D 8.42 4.59 0.00 2.77 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 0.00 112 G 8.07 4.05 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 0.00 0.00 0.00 113 S 8.46 4.24 0.00 4.15 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 0.00 114 G 10.16 4.06 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 0.00 0.00 0.00 115 Y 7.51 5.17 0.00 2.77 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 I 9.21 4.48 1.84 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.23 0.82 0.00 0.00 117 T 8.72 4.73 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 1.23 0.00 0.00 118 P 0.00 4.20 0.00 2.17 2.16 0.00 3.59 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 2.11 2.16 0.00 119 D 8.05 4.32 0.00 2.70 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 0.00 120 E 7.71 3.95 0.00 2.21 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 2.29 2.33 0.00 121 L 8.19 3.94 0.00 1.84 1.71 0.78 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 122 Q 8.01 3.96 0.00 2.18 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 123 Q 8.33 4.15 0.00 2.37 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 124 A 8.23 4.20 1.74 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 0.00 0.00 125 C 7.90 4.37 0.00 3.15 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 0.00 126 E 7.85 4.44 0.00 2.23 1.98 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 2.36 2.33 0.00 127 E 7.74 4.32 0.00 1.99 2.23 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 2.26 2.32 0.00 *136 E 8.11 4.35 0.00 2.05 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 0.00 2.13 1.88 0.00 137 E 8.05 4.13 0.00 2.13 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 2.35 2.32 0.00 138 L 8.14 3.76 0.00 1.71 1.74 0.87 0.81 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 *140 R 8.05 4.16 0.00 1.77 2.18 0.00 3.27 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.68 0.00 141 D 7.58 4.48 0.00 2.71 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 0.00 142 V 7.69 3.80 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 0.82 0.00 0.00 0.99 0.00 0.00 143 D 7.72 4.82 0.00 2.71 2.60 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 0.00 144 Q 8.33 4.12 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 145 D 8.25 4.74 0.00 2.80 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 0.00 146 N 7.84 4.28 0.00 2.84 2.94 0.00 0.00 6.83 8.97 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 0.00 147 D 8.74 4.60 0.00 2.70 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 0.00 148 G 8.75 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 0.00 149 R 7.98 4.93 0.00 1.71 1.92 0.00 2.76 0.00 0.00 2.95 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.64 0.00 150 I 8.86 4.82 1.97 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 1.35 0.72 1.13 0.00 0.00 151 D 9.62 5.05 0.00 2.59 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 Y 8.20 3.04 0.00 1.74 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 0.00 153 N 8.08 4.09 0.00 2.88 2.82 0.00 0.00 7.09 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 0.00 154 E 8.83 4.03 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 155 F 8.00 4.28 0.00 3.25 3.18 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 0.00 156 V 7.45 3.48 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 0.76 0.00 0.00 0.27 0.00 0.00 157 A 7.54 4.09 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 *160 Q 7.82 4.34 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.60 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00 * Residues marked with a * may have inaccurate shift predictions.