NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 S 4.1377 8.3349 115.3763 57.2358 64.3446 173.4116 20 W 4.3446 8.0274 121.4992 56.3075 29.6468 174.9624 21 K 4.2058 9.2911 121.7617 56.5900 33.8087 175.7906 22 R 4.9347 8.2824 121.1839 54.9246 32.2431 175.5107 23 C 4.4842 8.7409 123.4276 58.7138 32.1996 174.5792 24 A 3.6771 7.9526 129.5318 54.2256 18.2196 178.8798 25 G 4.0191 7.7801 104.6554 47.6792 0.0000 174.3046 26 C 4.6645 7.9231 111.9692 56.6044 31.1099 175.5771 27 G 3.7296 8.4955 108.6547 45.4713 0.0000 173.9614 28 G 4.0366 7.3042 107.0396 45.0489 0.0000 173.8194 29 K 4.5566 8.5880 120.3924 56.5435 33.0548 177.1420 30 I 4.0536 8.4667 125.3379 59.9675 37.3193 175.5106 31 A 2.5800 7.8615 129.0161 51.0673 19.4794 176.9864 32 D 4.4100 7.3656 115.9691 53.9215 41.6932 176.4922 33 R 3.8661 8.5775 122.7849 58.6183 31.1580 176.1419 34 F 5.5444 7.9709 115.7523 55.6720 42.2809 174.5449 35 L 4.8318 9.1235 121.6991 55.0588 44.5788 173.9813 36 L 5.4744 9.1314 117.7391 53.1824 45.1453 175.3195 37 Y 5.3428 8.8831 122.4972 55.9993 41.7520 174.2176 38 A 4.2906 9.1422 125.6783 51.7714 23.3758 175.8752 39 M 3.2574 8.9957 118.8003 57.7493 29.7206 176.4207 40 D 3.7507 7.5699 110.2814 54.1744 39.1940 173.9333 41 S 4.6213 7.2411 111.7833 56.8492 67.4938 173.5589 42 Y 5.1525 8.2138 118.6233 57.1772 40.2090 174.7374 43 W 5.4784 9.1799 120.6989 55.2319 34.2334 174.6058 44 H 4.5744 9.0226 120.9364 55.9338 29.1994 176.3732 45 S 4.1642 9.0826 118.1106 61.6387 62.0255 176.7636 46 R 4.0545 8.1055 116.7682 58.8839 29.1637 177.4735 47 C 4.7470 8.1533 115.7543 59.2929 29.3146 173.3019 48 L 4.0470 7.8414 123.7326 53.0140 40.9020 174.8955 49 K 5.0173 7.8061 123.6178 53.8341 36.0933 176.1675 50 C 4.4125 8.6269 122.5005 59.4551 32.0126 174.9483 51 S 4.1569 9.0889 124.1152 61.7555 62.8227 176.0065 52 S 4.2812 8.2059 113.7578 60.7233 62.1405 174.3412 53 C 4.5256 7.8821 112.1052 57.2383 30.4799 174.6364 54 Q 3.9139 8.3881 117.9902 56.3226 26.6768 173.4977 55 A 3.9970 7.2537 121.4951 52.4323 19.0275 178.0612 56 Q 4.6777 8.4217 120.5853 54.7138 27.9796 176.7079 57 L 3.9591 8.4848 124.8362 57.7151 41.8617 180.4401 58 G 3.6145 7.9291 103.3846 46.7966 0.0000 174.4193 59 D 4.6789 7.8202 120.2256 56.1101 41.8317 178.4477 60 I 4.0750 7.7483 112.3736 64.6715 38.2476 175.3371 61 G 4.0677 7.7803 107.0633 45.3898 0.0000 172.1890 62 T 4.6199 8.3912 108.3986 61.6706 70.2693 173.7915 63 S 5.1183 7.7371 115.6239 57.6902 66.3262 172.8185 64 S 4.9758 8.8053 114.6160 56.6686 66.8101 172.2939 65 Y 4.9073 8.8680 117.3935 56.2044 41.1300 174.8055 66 T 5.0903 8.2660 114.5439 59.9509 70.7552 174.0471 67 K 4.2214 9.0702 123.9030 56.7429 35.6245 175.0602 68 S 3.8145 9.7492 120.4725 59.7331 60.3399 173.5824 69 G 3.9837 8.5792 106.7541 45.6213 0.0000 173.7116 70 M 4.7721 7.9451 119.2536 53.6331 35.5387 174.9726 71 I 4.9352 8.4439 121.2837 59.7376 40.0562 174.8341 72 L 5.2546 9.1170 127.3657 52.5643 45.5963 176.5346 73 C 4.7118 8.6095 116.3518 57.7192 30.7952 174.5892 74 R 3.6936 8.8372 120.1516 59.8202 29.5454 178.3267 75 N 4.3130 8.1493 115.6264 56.5540 38.5316 176.9651 76 D 4.3628 8.0558 119.6276 56.9327 40.9784 178.0407 77 Y 4.1632 8.2017 120.5457 60.7319 38.6859 178.1234 78 I 3.2043 7.7961 120.9090 64.2403 36.9742 178.4240 79 R 3.7169 7.6957 118.1026 59.3461 30.0132 178.1004 80 L 3.8634 7.7325 117.3462 56.0269 41.8450 177.5332 81 F 4.6256 7.6542 114.0223 56.4327 40.9668 175.4794 82 G 3.4589 7.5414 109.6763 44.8545 0.0000 173.4348 83 N 4.6508 8.3321 117.4426 52.4596 38.8548 175.3966 84 S 4.5671 8.4999 118.9896 58.1670 64.6388 173.8543 85 G 4.1280 8.6656 107.0472 45.5681 0.0000 170.9630 86 A 5.0452 8.2573 121.1843 50.6102 22.6281 176.1694 87 C 4.2808 8.8294 122.4505 59.0819 32.0676 175.0795 88 S 4.0320 8.4117 122.8823 61.0287 62.8066 175.8570 89 A 4.2829 8.1721 122.9741 54.8234 18.3120 178.0050 90 C 4.4283 8.1639 108.3705 57.5990 30.7046 175.4854 91 G 3.7516 8.3506 108.7336 45.5978 0.0000 173.7560 92 Q 4.5375 7.3513 118.9779 54.7482 30.3962 175.8029 93 S 4.6386 8.6490 116.3207 58.9134 64.1427 173.5498 94 I 4.5359 8.3405 122.2313 58.7682 40.0366 173.5538 95 P 4.5486 0.0000 0.0000 62.2940 32.1655 177.4241 96 A 4.1209 8.8296 125.4766 55.4142 18.3328 179.7233 97 S 4.3059 7.8788 108.0662 59.6837 63.8732 173.6089 98 E 4.4567 8.0091 123.8248 55.0252 30.9194 175.4048 99 L 4.6224 8.4664 126.3422 55.0673 42.6120 176.6401 100 V 4.6707 8.9623 115.4365 59.9777 36.3511 174.5879 101 M 4.5159 8.5567 121.6734 54.0917 34.1747 175.5004 102 R 5.2835 7.7724 118.6241 54.7589 34.0619 175.2277 103 A 4.5632 9.2248 122.7437 52.8230 22.7370 176.7349 104 Q 3.2747 9.8508 122.4423 56.9366 26.2803 175.0392 105 G 3.9226 8.4827 103.6021 45.5330 0.0000 173.4998 106 N 4.8986 8.0988 117.2436 51.4798 41.0764 173.9710 107 V 4.9152 7.5556 112.0917 59.9576 35.6903 174.3748 108 Y 4.9774 8.6503 119.5957 56.2159 42.5862 174.6271 109 H 4.4092 8.9643 119.6112 56.3725 29.7219 176.2367 110 L 3.9629 8.9445 121.9986 58.1442 41.5881 179.5027 111 K 4.2753 7.9968 114.5383 57.9775 32.3245 177.2852 112 C 4.4407 7.8797 115.6366 60.3074 28.8753 174.4331 113 F 4.3246 7.8676 124.3591 56.4447 37.3019 174.0138 114 T 4.9096 7.0201 112.7281 58.6372 72.2699 174.2568 115 C 4.1531 8.6503 123.9478 59.3500 31.9488 175.1009 116 S 4.0333 8.5560 123.8201 61.3443 62.6711 175.8913 117 T 4.2640 7.9380 116.4329 65.7255 68.7224 175.5169 118 C 4.3614 7.9357 112.8668 57.7199 30.6458 174.6922 119 R 4.0640 8.0950 118.1644 56.0891 28.2208 175.9814 120 N 4.4440 7.7330 116.3955 53.2781 39.7154 174.2135 121 R 4.3966 8.5076 124.0879 56.3914 30.8145 175.6558 122 L 4.6261 8.6176 127.3130 54.1967 42.8600 176.6496 123 V 4.5769 8.9650 115.3761 58.3138 35.5068 173.3954 124 P 4.6363 0.0000 0.0000 64.7467 31.4151 176.9934 125 G 4.0738 9.0332 111.8632 45.2253 0.0000 173.7145 126 D 4.6236 7.9658 119.8868 54.4970 41.9777 176.0346 127 R 5.0550 8.5664 121.1810 56.0298 31.4525 175.5874 128 F 5.1578 8.9918 116.6474 56.3456 41.9473 172.5101 129 H 5.1697 9.7097 116.3609 54.1759 32.1612 172.6740 130 Y 5.2248 8.5139 120.8201 56.2044 42.2133 174.1322 131 I 4.6483 8.4749 127.3357 60.3099 39.8675 175.5120 132 N 4.3301 10.0267 125.2138 54.2210 35.9843 174.9500 133 G 3.9307 7.0894 105.7481 45.5495 0.0000 174.0011 134 S 4.1806 7.5468 116.5444 57.8051 64.1649 173.6794 135 L 4.9693 7.8863 124.3305 53.7830 43.7261 175.6394 136 F 5.1547 9.1169 120.7666 55.7338 43.5441 174.7780 137 C 4.7293 8.8157 117.8700 57.2867 30.6615 173.8977 138 E 3.9125 8.8054 120.5591 59.4658 28.9711 177.0939 139 H 4.8607 8.0194 112.2585 55.8585 29.1787 174.6127 140 D 4.9500 7.8063 119.8462 53.0719 41.6042 176.3086 141 R 3.6312 8.3330 119.2984 56.6015 30.5413 175.6156 142 P 4.2840 0.0000 0.0000 61.6875 28.7601 176.4232 143 T 3.7138 7.6958 121.8860 67.3202 68.9413 175.0539 144 A 4.0943 7.7972 121.0575 55.2323 18.4942 179.2266 145 L 4.0364 7.5905 115.6655 58.9160 42.1932 178.1058 146 I 3.9102 7.6147 118.1034 60.6654 38.7836 175.1389 *211 G 3.8179 8.5432 107.6033 46.0819 0.0000 172.8322 *300 D 4.3440 7.7704 117.4107 53.8981 41.9223 174.8511 301 V 3.8812 8.2660 124.0941 62.6038 32.3957 174.9780 302 M 4.6203 8.6698 127.1846 53.4575 35.5042 174.6316 303 V 4.9051 8.0317 119.9245 60.8924 33.9002 175.3922 304 V 3.9056 9.1763 129.2168 63.2593 32.3387 176.0317 305 G 4.3167 8.7105 115.2068 45.1602 0.0000 173.0064 306 E 4.2597 8.5836 119.6535 55.2076 30.0813 175.6096 307 P 4.5761 0.0000 0.0000 63.4638 32.2348 175.1572 308 T 4.7567 8.4408 115.2568 59.9479 71.8696 172.7178 309 L 4.4902 8.3441 124.9464 54.7937 42.3502 177.6614 310 M 3.9149 8.9575 124.6860 58.8113 32.2060 178.1039 311 G 3.7682 8.1307 105.9199 46.1544 0.0000 175.0991 312 G 3.8861 7.5464 107.7739 45.1749 0.0000 172.8864 313 E 4.2943 8.6414 119.1589 56.0258 30.3632 175.9954 314 F 5.0640 7.8149 115.8365 54.7272 41.1238 174.7500 315 G 3.9371 9.0493 110.5518 45.3508 0.0000 172.7928 316 D 5.0024 8.4489 117.6497 52.8462 39.4708 178.3572 317 E 3.9735 8.3827 120.9674 59.6203 29.6777 177.7382 318 D 4.6945 8.0290 116.7679 53.8409 41.6507 175.1953 319 E 3.5756 7.6929 121.6421 55.6213 30.5369 176.2936 320 R 4.4139 8.6160 125.0203 54.0320 33.4498 174.9200 321 L 4.3967 8.5444 124.1841 54.9055 42.5693 176.6846 322 I 4.5686 8.2966 123.0317 60.0807 39.1349 175.2150 323 T 4.6321 8.9185 123.5391 61.8361 70.9588 173.5854 324 R 4.8010 8.6843 125.9087 55.5783 31.0950 175.8880 325 L 4.9870 9.1901 123.8860 52.8766 45.6749 174.9415 326 E 4.8047 8.7126 122.5210 54.6054 31.1967 175.2138 327 N 4.6280 9.1272 125.4160 53.9543 38.6482 174.4588 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 19 S 8.33 4.14 0.00 3.92 3.83 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 20 W 8.03 4.34 0.00 3.34 2.97 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 21 K 9.29 4.21 0.00 1.35 1.31 0.00 1.30 0.00 0.00 1.59 0.00 0.00 2.59 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.07 0.21 7.81 22 R 8.28 4.93 0.00 1.66 1.81 0.00 3.20 0.00 0.00 3.32 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 23 C 8.74 4.48 0.00 2.86 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 24 A 7.95 3.68 0.14 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 0.00 0.00 25 G 7.78 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 26 C 7.92 4.66 0.00 3.10 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 27 G 8.50 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 28 G 7.30 4.04 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 0.00 29 K 8.59 4.56 0.00 1.66 1.82 0.00 2.10 0.00 0.00 1.84 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.54 7.81 30 I 8.47 4.05 1.75 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 0.67 0.34 0.79 0.00 0.00 31 A 7.86 2.58 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 D 7.37 4.41 0.00 2.68 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 33 R 8.58 3.87 0.00 1.70 1.62 0.00 2.96 0.00 0.00 3.19 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.10 0.00 34 F 7.97 5.54 0.00 2.98 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 35 L 9.12 4.83 0.00 2.02 1.83 1.09 0.76 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 36 L 9.13 5.47 0.00 1.78 1.64 0.87 0.73 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 37 Y 8.88 5.34 0.00 2.93 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 38 A 9.14 4.29 1.02 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 39 M 9.00 3.26 0.00 2.19 2.28 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 2.45 2.50 0.00 40 D 7.57 3.75 0.00 2.66 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 41 S 7.24 4.62 0.00 3.60 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 42 Y 8.21 5.15 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 43 W 9.18 5.48 0.00 3.25 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 44 H 9.02 4.57 0.00 3.35 3.27 0.00 5.83 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 45 S 9.08 4.16 0.00 3.96 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 46 R 8.11 4.05 0.00 2.02 2.08 0.00 3.06 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 47 C 8.15 4.75 0.00 3.42 3.29 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 48 L 7.84 4.05 0.00 1.01 1.27 -0.42 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 49 K 7.81 5.02 0.00 1.72 1.63 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.15 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.46 7.81 50 C 8.63 4.41 0.00 2.96 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 51 S 9.09 4.16 0.00 3.89 3.96 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 0.00 0.00 0.00 52 S 8.21 4.28 0.00 3.84 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 53 C 7.88 4.53 0.00 3.11 3.25 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 54 Q 8.39 3.91 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 55 A 7.25 4.00 1.24 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 0.00 0.00 56 Q 8.42 4.68 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.82 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 57 L 8.48 3.96 0.00 1.58 1.62 0.78 0.63 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 58 G 7.93 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 59 D 7.82 4.68 0.00 2.77 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 60 I 7.75 4.07 1.87 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 1.72 0.52 0.90 0.00 0.00 61 G 7.78 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 0.00 0.00 0.00 0.00 62 T 8.39 4.62 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 1.20 0.00 0.00 63 S 7.74 5.12 0.00 3.69 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 64 S 8.81 4.98 0.00 3.73 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 Y 8.87 4.91 0.00 2.78 2.29 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 66 T 8.27 5.09 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 67 K 9.07 4.22 0.00 1.68 1.29 0.00 1.67 0.00 0.00 0.91 0.00 0.00 2.56 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.30 0.98 7.81 68 S 9.75 3.81 0.00 4.22 4.04 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 69 G 8.58 3.98 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 0.00 0.00 0.00 70 M 7.95 4.77 0.00 2.06 2.21 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.56 0.00 71 I 8.44 4.94 1.84 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.71 0.77 0.00 0.00 72 L 9.12 5.25 0.00 1.72 1.66 1.28 0.77 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 73 C 8.61 4.71 0.00 3.15 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 74 R 8.84 3.69 0.00 2.15 2.08 0.00 3.32 0.00 0.00 3.56 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.80 0.00 75 N 8.15 4.31 0.00 2.81 2.84 0.00 0.00 7.13 8.08 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 76 D 8.06 4.36 0.00 2.72 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 77 Y 8.20 4.16 0.00 2.92 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 78 I 7.80 3.20 1.90 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.33 0.79 0.00 0.00 79 R 7.70 3.72 0.00 1.82 1.98 0.00 3.19 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 1.52 1.58 0.00 80 L 7.73 3.86 0.00 1.16 0.63 0.86 0.81 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 81 F 7.65 4.63 0.00 2.30 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 82 G 7.54 3.46 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 0.00 83 N 8.33 4.65 0.00 2.64 2.77 0.00 0.00 6.58 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 84 S 8.50 4.57 0.00 3.97 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 85 G 8.67 4.13 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 0.00 0.00 0.00 86 A 8.26 5.05 1.13 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 0.00 0.00 87 C 8.83 4.28 0.00 2.78 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.41 4.03 0.00 3.20 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 89 A 8.17 4.28 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.43 0.00 3.14 3.23 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 91 G 8.35 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 7.35 4.54 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 93 S 8.65 4.64 0.00 3.84 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 94 I 8.34 4.54 1.79 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.69 0.86 0.00 0.00 95 P 0.00 4.55 0.00 2.03 1.92 0.00 3.80 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 96 A 8.83 4.12 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 97 S 7.88 4.31 0.00 3.98 3.96 0.00 0.00 0.00 0.00 0.00 0.00 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7.02 4.91 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 1.24 0.00 0.00 115 C 8.65 4.15 0.00 2.87 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 0.00 116 S 8.56 4.03 0.00 2.98 3.64 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 0.00 117 T 7.94 4.26 4.52 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 118 C 7.94 4.36 0.00 3.08 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 0.00 119 R 8.09 4.06 0.00 2.01 2.14 0.00 3.16 0.00 0.00 3.21 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 120 N 7.73 4.44 0.00 2.70 2.73 0.00 0.00 6.72 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 0.00 121 R 8.51 4.40 0.00 1.82 1.84 0.00 3.24 0.00 0.00 3.36 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 122 L 8.62 4.63 0.00 1.24 1.41 0.19 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8.54 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 0.00 0.00 0.00 *300 D 7.77 4.34 0.00 2.69 2.63 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 0.00 301 V 8.27 3.88 2.02 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 0.69 0.00 0.00 0.90 0.00 0.00 302 M 8.67 4.62 0.00 1.27 0.83 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 303 V 8.03 4.91 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 0.84 0.00 0.00 0.96 0.00 0.00 304 V 9.18 3.91 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 1.02 0.00 0.00 0.91 0.00 0.00 305 G 8.71 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 306 E 8.58 4.26 0.00 1.96 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 2.32 2.24 0.00 307 P 0.00 4.58 0.00 2.03 1.99 0.00 3.68 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 308 T 8.44 4.76 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 309 L 8.34 4.49 0.00 1.67 1.59 0.96 0.77 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 0.00 310 M 8.96 3.91 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.78 0.00 311 G 8.13 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 0.00 312 G 7.55 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 313 E 8.64 4.29 0.00 1.98 1.85 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 2.31 2.22 0.00 314 F 7.81 5.06 0.00 3.14 2.97 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 0.00 315 G 9.05 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 0.00 316 D 8.45 5.00 0.00 3.03 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 0.00 317 E 8.38 3.97 0.00 2.16 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 2.45 2.35 0.00 318 D 8.03 4.69 0.00 2.67 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 0.00 319 E 7.69 3.58 0.00 1.63 1.69 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 1.89 1.47 0.00 320 R 8.62 4.41 0.00 1.48 1.66 0.00 3.27 0.00 0.00 3.06 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 321 L 8.54 4.40 0.00 1.49 1.56 0.89 0.80 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 0.00 322 I 8.30 4.57 1.82 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.42 0.87 0.00 0.00 323 T 8.92 4.63 4.38 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 1.25 0.00 0.00 324 R 8.68 4.80 0.00 1.73 1.92 0.00 3.31 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 325 L 9.19 4.99 0.00 1.70 1.63 1.12 0.79 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 0.00 326 E 8.71 4.80 0.00 2.12 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 0.00 2.01 1.67 0.00 327 N 9.13 4.63 0.00 2.86 2.66 0.00 0.00 7.06 5.12 0.00 0.00 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.