NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 A 4.3460 8.1233 123.5750 52.0874 19.8103 178.9681 10 N 4.1085 9.4111 119.1397 55.4864 39.5078 174.4867 11 S 4.1303 8.8831 117.1515 61.7352 63.3242 176.7533 12 T 3.5796 7.4986 118.0536 66.3916 68.3311 176.8777 13 V 3.0973 7.1859 119.9490 65.8782 31.5493 177.7809 14 L 3.7910 7.9845 119.1443 57.9473 40.9077 179.6243 15 S 4.1091 7.8493 112.4347 61.5595 62.1790 176.0900 16 F 4.6813 7.7374 118.8277 60.8680 38.9054 176.9367 17 C 4.3268 8.1960 115.6546 61.8431 28.1053 175.5825 18 A 3.6590 8.1230 122.8997 54.9058 17.8129 178.1901 19 F 4.7071 7.3734 109.5240 57.1580 38.6023 176.1532 20 A 4.3334 7.7821 124.9932 51.9781 18.7232 179.3224 21 V 3.7456 8.2037 112.1706 63.0248 32.3332 177.2552 22 D 4.7571 7.6452 120.0873 50.5753 42.3005 173.1194 23 P 4.2926 0.0000 0.0000 65.1908 31.6578 177.2359 24 A 3.9717 7.9691 118.5840 55.1753 18.4076 179.4121 25 K 3.8772 8.9216 118.2454 59.4521 32.2487 178.5326 26 A 4.0015 8.1452 121.1744 55.5769 18.2900 178.9607 27 Y 4.2422 8.1514 117.6725 60.8234 38.7987 178.4159 28 K 3.8039 8.1063 119.3192 59.6692 32.0555 178.9649 29 D 4.3277 8.5815 119.4409 57.6121 40.7318 178.3724 30 Y 4.1331 8.2371 119.9840 60.6317 38.8161 178.1391 31 L 3.4658 7.9003 119.7224 57.5488 41.5040 179.2479 32 A 4.2327 7.8548 119.5865 54.7889 18.2110 178.7568 33 S 4.4991 7.2008 112.0170 58.3251 63.0328 175.2441 34 G 3.7855 8.2421 110.2692 45.0323 0.0000 174.6043 35 G 2.7679 6.8672 108.1561 45.1057 0.0000 173.1277 36 Q 4.2404 8.3724 121.7041 54.0957 29.8896 174.1394 37 P 4.6107 0.0000 0.0000 62.4801 32.0331 176.2429 38 I 3.8721 8.5425 123.2139 62.2187 37.4511 175.4930 39 T 4.5507 8.9651 114.0702 60.6968 71.9282 172.7192 40 N 4.2185 8.7910 114.5797 54.2791 34.0204 175.4224 41 C 5.2247 7.5409 113.8351 56.9828 30.2756 174.9299 42 V 3.6904 8.4650 118.0056 62.2012 32.2262 175.0232 43 K 4.6835 8.5519 126.0045 54.9147 34.0527 176.0091 44 M 4.3953 8.6973 127.8734 54.3294 33.8441 176.1313 45 L 4.4777 7.7475 116.8777 52.9855 41.9020 174.4853 46 C 3.7215 8.0559 118.7234 59.7813 32.1001 174.5390 47 T 4.2169 8.1878 122.0626 58.7839 67.1538 172.4830 48 H 4.3594 6.7265 121.6487 57.4439 32.9383 174.3880 49 T 4.4086 7.0252 117.5409 60.8259 67.5469 174.5671 50 G 4.0302 8.5371 115.7171 45.3500 0.0000 171.1668 51 T 3.8766 8.5303 108.6915 62.9626 68.7190 175.9294 52 G 4.4767 8.3579 109.4573 45.0702 0.0000 173.6282 53 Q 4.0629 7.6651 118.9076 55.4943 29.3724 176.6566 54 A 3.7013 8.5947 123.0488 54.7552 18.6049 177.2213 55 I 5.0677 7.3373 113.4999 59.7255 40.4844 174.4970 56 T 4.8193 8.8771 115.8725 60.2647 72.6331 174.7637 57 V 4.1765 8.5974 113.1563 62.3560 32.1279 176.4436 58 T 4.1744 7.4573 108.3209 59.1877 71.4931 171.6995 59 P 4.1803 0.0000 0.0000 63.8222 31.8530 176.5756 60 E 4.6886 8.6576 122.1505 55.4915 31.0118 175.3713 61 A 4.6389 7.6369 120.8316 52.3880 19.3851 178.2809 62 N 5.2542 8.3377 117.1975 52.1311 41.1589 175.7860 63 M 4.0729 8.6315 117.2921 58.5824 32.3269 177.0765 64 D 4.9232 8.0697 116.7923 53.9340 41.5860 175.1237 65 Q 5.1763 7.7657 118.0141 54.3492 33.6291 173.8490 66 E 4.9823 9.1810 119.0201 54.7376 34.0593 175.1706 67 S 5.2585 8.2657 117.7104 57.0226 65.4489 173.3674 68 F 5.2804 9.5527 123.6159 55.2786 42.7288 174.9883 69 G 3.6799 9.0814 108.8140 46.2601 0.0000 174.4014 70 G 4.0053 9.0508 113.1951 48.1473 0.0000 174.8198 71 A 3.9822 7.9522 122.4186 54.9092 18.5054 179.3663 72 S 4.0404 7.7650 111.2144 61.3197 61.8517 175.3023 73 C 4.8022 8.6339 117.4069 58.7565 28.8165 172.2764 74 C 4.7652 7.9454 121.9541 55.1243 43.4612 172.9962 75 L 3.6173 8.5108 130.6157 58.7395 41.4856 178.4650 76 Y 3.8414 7.7335 115.5860 61.3144 37.7071 179.1779 77 C 4.4551 8.3581 116.7536 59.8166 40.0765 176.0268 78 R 3.6356 7.6882 118.9826 58.4523 29.9158 177.7137 79 C 4.1826 7.9448 114.2566 59.1387 28.7287 173.0073 80 H 4.0884 7.4446 116.6457 57.0547 26.2563 174.3496 81 I 4.5954 7.4227 110.2977 58.4824 40.3753 174.4981 82 D 4.5869 8.5032 121.1501 55.0378 41.2698 175.3230 83 H 4.4460 8.1949 116.7028 53.5340 31.4501 172.6402 84 P 4.3608 0.0000 0.0000 65.0294 33.6819 178.8851 85 N 3.1400 7.0635 106.5052 52.3842 39.5234 175.5555 *89 F 3.8617 8.8628 124.3339 58.7293 40.5479 175.0469 90 C 4.1351 8.1939 117.0059 60.7525 24.5097 173.6130 91 D 4.5937 8.2473 120.0164 54.3809 39.6329 177.6729 92 L 4.3742 7.8631 120.6781 56.2619 42.9126 176.9824 93 K 3.9069 7.8513 118.1375 58.3467 32.1603 176.6002 94 G 3.8842 8.9610 113.9684 45.0130 0.0000 172.2491 95 K 4.6836 8.0774 119.0857 54.6139 36.1598 174.0702 96 Y 5.0365 8.8834 117.5270 56.6419 41.5598 175.1578 97 V 4.9235 9.0273 124.4632 61.5615 33.6556 174.4442 98 Q 5.0928 9.1978 128.1512 55.3293 29.5371 175.3235 99 I 4.2545 8.8869 125.5254 58.2989 40.1954 173.6000 100 P 4.5555 0.0000 0.0000 63.3371 32.0993 177.6963 101 T 3.8985 9.0910 120.8528 66.8447 68.7652 177.0314 102 T 3.8616 7.9993 110.5643 64.6170 69.0895 174.5823 103 C 4.3845 7.7055 116.9847 59.1137 28.2463 174.8960 104 A 4.1308 7.4713 123.2178 53.9067 17.9973 178.6667 105 N 4.5385 7.8108 112.5646 54.2927 38.7029 175.1642 106 D 4.8775 7.5277 117.3677 51.0993 41.4842 173.4140 107 P 3.9330 0.0000 0.0000 65.6027 31.6974 178.0427 108 V 3.8461 7.2216 117.6335 65.5699 31.3432 177.9270 109 G 4.3276 8.4431 105.9548 47.1335 0.0000 174.8253 110 F 3.8526 8.4900 123.3106 61.4819 39.1591 177.4478 111 T 3.7026 7.5156 107.2349 64.5413 68.5247 176.2226 112 L 4.1594 7.4575 120.8608 57.8480 41.9097 179.4825 113 R 4.0596 8.3666 115.8486 57.2650 30.1553 175.8285 114 N 4.9450 7.2141 115.0034 51.3782 41.5415 173.5049 115 T 4.8596 8.2398 114.0672 62.0913 72.6212 173.5008 116 V 4.2052 8.3641 125.8958 61.4343 32.7524 174.8765 117 C 4.2923 9.3387 129.7860 59.8757 31.8074 174.5483 118 T 3.9124 8.7999 116.8724 63.6716 68.8817 175.3651 119 V 3.9463 7.8318 121.5423 64.5612 32.1018 176.0269 120 C 4.4624 8.0602 110.9857 57.3861 30.9150 174.6051 121 G 3.8506 8.4826 108.8754 46.7009 0.0000 172.9370 122 M 4.7457 7.3170 118.8481 52.6052 34.7208 175.1765 123 W 4.7627 8.4239 120.1605 56.4526 29.7108 176.1465 124 K 4.2462 9.6043 126.3538 57.9119 32.0350 176.8568 125 G 3.9416 10.3342 113.3308 46.1600 0.0000 174.0069 126 Y 4.7885 8.1253 115.3697 56.2901 39.5683 174.2848 127 G 3.8777 8.7712 111.7217 46.1749 0.0000 174.1377 128 C 4.0074 8.2296 119.2191 60.6899 32.0713 173.4711 129 S 4.0874 8.6948 119.8429 59.2498 62.6255 172.2850 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 4.35 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 10 N 9.41 4.11 0.00 2.79 2.82 0.00 0.00 6.81 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 4.13 0.00 3.81 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 12 T 7.50 3.58 4.26 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 0.73 0.00 0.00 13 V 7.19 3.10 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 0.14 0.00 0.00 0.86 0.00 0.00 14 L 7.98 3.79 0.00 1.63 1.59 0.83 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 15 S 7.85 4.11 0.00 4.07 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 16 F 7.74 4.68 0.00 3.15 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 17 C 8.20 4.33 0.00 2.85 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 18 A 8.12 3.66 0.60 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 0.00 0.00 19 F 7.37 4.71 0.00 3.14 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 20 A 7.78 4.33 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 21 V 8.20 3.75 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 0.73 0.00 0.00 0.95 0.00 0.00 22 D 7.65 4.76 0.00 2.83 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 4.29 0.00 1.97 1.91 0.00 3.75 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 2.17 2.28 0.00 24 A 7.97 3.97 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 K 8.92 3.88 0.00 1.90 2.00 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.71 1.47 7.81 26 A 8.15 4.00 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 27 Y 8.15 4.24 0.00 3.00 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 28 K 8.11 3.80 0.00 2.02 1.81 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.66 7.81 29 D 8.58 4.33 0.00 2.81 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Y 8.24 4.13 0.00 3.13 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 7.90 3.47 0.00 1.64 1.46 0.57 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.85 4.23 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 7.20 4.50 0.00 3.85 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.24 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 35 G 6.87 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 0.00 0.00 0.00 36 Q 8.37 4.24 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.86 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 37 P 0.00 4.61 0.00 2.23 2.32 0.00 3.78 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 2.04 2.12 0.00 38 I 8.54 3.87 1.79 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.50 0.82 0.00 0.00 39 T 8.97 4.55 4.26 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 1.29 0.00 0.00 40 N 8.79 4.22 0.00 2.90 3.09 0.00 0.00 6.74 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 7.54 5.22 0.00 3.06 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 42 V 8.46 3.69 2.14 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 0.77 0.00 0.00 1.03 0.00 0.00 43 K 8.55 4.68 0.00 1.61 1.56 0.00 1.55 0.00 0.00 1.57 0.00 0.00 2.73 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.99 0.52 7.81 44 M 8.70 4.40 0.00 1.86 1.98 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 2.87 0.00 45 L 7.75 4.48 0.00 1.47 1.47 0.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 46 C 8.06 3.72 0.00 2.91 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 47 T 8.19 4.22 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 1.18 0.00 0.00 48 H 6.73 4.36 0.00 3.18 3.33 0.00 5.88 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 7.03 4.41 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 50 G 8.54 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 0.00 0.00 0.00 51 T 8.53 3.88 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 1.25 0.00 0.00 52 G 8.36 4.48 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 0.00 53 Q 7.67 4.06 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.70 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 54 A 8.59 3.70 -0.04 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 0.00 0.00 55 I 7.34 5.07 1.79 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 1.44 0.45 0.93 0.00 0.00 56 T 8.88 4.82 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 1.23 0.00 0.00 57 V 8.60 4.18 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 0.79 0.00 0.00 0.96 0.00 0.00 58 T 7.46 4.17 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 1.19 0.00 0.00 59 P 0.00 4.18 0.00 1.86 1.92 0.00 3.17 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.40 0.00 60 E 8.66 4.69 0.00 1.96 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 2.59 2.25 0.00 61 A 7.64 4.64 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 62 N 8.34 5.25 0.00 2.83 2.81 0.00 0.00 6.90 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 63 M 8.63 4.07 0.00 2.01 2.14 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 2.61 2.51 0.00 64 D 8.07 4.92 0.00 2.74 2.68 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 65 Q 7.77 5.18 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.16 6.72 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 66 E 9.18 4.98 0.00 1.74 1.42 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 2.24 2.44 0.00 67 S 8.27 5.26 0.00 3.69 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 9.55 5.28 0.00 3.00 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 69 G 9.08 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 70 G 9.05 4.01 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 0.00 0.00 0.00 71 A 7.95 3.98 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 7.76 4.04 0.00 3.88 4.18 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 73 C 8.63 4.80 0.00 3.10 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 74 C 7.95 4.77 0.00 3.07 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 75 L 8.51 3.62 0.00 1.46 1.22 0.41 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 7.73 3.84 0.00 3.06 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 77 C 8.36 4.46 0.00 3.11 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 78 R 7.69 3.64 0.00 1.81 1.82 0.00 3.22 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 79 C 7.94 4.18 0.00 2.73 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 80 H 7.44 4.09 0.00 3.37 3.36 0.00 5.59 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 81 I 7.42 4.60 1.85 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 1.33 0.74 0.86 0.00 0.00 82 D 8.50 4.59 0.00 2.68 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 83 H 8.19 4.45 0.00 2.56 2.74 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 4.36 0.00 2.02 1.98 0.00 2.81 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.47 0.00 85 N 7.06 3.14 0.00 2.56 2.62 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 8.86 3.86 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 90 C 8.19 4.14 0.00 3.02 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 91 D 8.25 4.59 0.00 2.75 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 92 L 7.86 4.37 0.00 1.79 1.76 1.02 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 93 K 7.85 3.91 0.00 1.71 1.75 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.45 7.81 94 G 8.96 3.88 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 0.00 95 K 8.08 4.68 0.00 1.75 2.00 0.00 1.61 0.00 0.00 1.78 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.36 7.81 96 Y 8.88 5.04 0.00 2.97 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 9.03 4.92 2.33 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 1.48 0.00 0.00 1.10 0.00 0.00 98 Q 9.20 5.09 0.00 2.29 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.36 0.00 0.00 0.00 0.00 0.00 2.63 2.46 0.00 99 I 8.89 4.25 1.99 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.90 0.22 0.00 0.00 100 P 0.00 4.56 0.00 1.77 2.02 0.00 2.20 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 2.04 0.00 101 T 9.09 3.90 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 0.00 102 T 8.00 3.86 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 7.71 4.38 0.00 2.49 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 0.00 104 A 7.47 4.13 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 N 7.81 4.54 0.00 2.86 2.96 0.00 0.00 6.60 7.59 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 0.00 106 D 7.53 4.88 0.00 2.73 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 3.93 0.00 1.77 1.12 0.00 3.51 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 108 V 7.22 3.85 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 0.91 0.00 0.00 0.78 0.00 0.00 109 G 8.44 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 0.00 110 F 8.49 3.85 0.00 3.04 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 0.00 111 T 7.52 3.70 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 112 L 7.46 4.16 0.00 1.81 1.81 0.94 1.47 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 8.37 4.06 0.00 1.56 1.88 0.00 3.07 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.84 0.00 114 N 7.21 4.94 0.00 1.49 2.39 0.00 0.00 6.73 7.33 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 0.00 115 T 8.24 4.86 4.35 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 1.26 0.00 0.00 116 V 8.36 4.21 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 0.49 0.00 0.00 0.11 0.00 0.00 117 C 9.34 4.29 0.00 3.04 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 0.00 118 T 8.80 3.91 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 0.00 119 V 7.83 3.95 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 0.85 0.00 0.00 0.93 0.00 0.00 120 C 8.06 4.46 0.00 3.10 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 0.00 121 G 8.48 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 0.00 122 M 7.32 4.75 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.54 0.00 123 W 8.42 4.76 0.00 3.64 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 K 9.60 4.25 0.00 2.03 1.86 0.00 1.82 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.51 7.81 125 G 10.33 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 0.00 126 Y 8.13 4.79 0.00 3.20 3.08 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 0.00 127 G 8.77 3.88 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 0.00 128 C 8.23 4.01 0.00 3.13 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 0.00 129 S 8.69 4.09 0.00 4.06 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.