NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 M 4.3628 8.3001 118.7941 53.8876 32.9286 178.4921 2 A 4.1206 8.7641 124.1351 52.4609 18.9219 176.6045 *3 P 4.2780 0.0000 0.0000 67.0660 32.0012 172.8282 *4 V 4.0959 7.1937 114.5088 59.1877 32.2287 172.5527 *5 K 4.7401 8.1370 127.7093 52.9549 35.6962 173.8338 *6 S 4.8460 8.2534 124.2862 57.0787 66.3248 177.4361 7 Q 4.0632 7.7439 121.0619 59.0353 28.6927 177.8792 8 E 4.0886 8.2753 118.1945 59.2092 29.0033 178.7724 9 S 4.1841 8.3232 116.1603 60.4584 62.7055 175.9561 10 I 3.6036 7.6900 122.3473 63.9686 37.5220 177.1475 11 N 4.1639 8.2739 118.0263 56.6743 38.6103 176.9260 12 Q 3.9206 7.8952 118.9316 58.8986 28.8618 178.5274 13 K 3.9256 7.6743 119.6039 59.1964 32.1905 178.6769 14 L 3.9594 8.2139 120.9967 58.0414 41.8014 178.7567 15 A 3.9463 7.9278 119.8228 55.0693 18.5657 179.0576 16 L 4.0245 7.6765 118.9201 58.2290 41.9356 179.4115 17 V 3.6052 7.2134 115.9639 65.9881 31.7809 177.5677 18 I 3.8291 7.8482 118.4298 63.6247 37.4699 177.4475 19 K 3.9162 7.6905 120.4477 58.6880 32.5187 177.5577 20 S 4.7335 7.8765 111.1582 57.4911 63.1647 173.7215 21 G 4.0986 8.1077 106.7100 46.8659 0.0000 174.0777 22 K 4.3620 8.1406 119.6642 54.6134 33.9599 175.5572 23 Y 5.0486 7.0714 122.0046 56.2473 41.7932 173.9427 24 T 4.8470 8.9162 114.3645 61.8520 72.7556 173.4303 25 L 5.1897 8.9525 124.9607 54.1439 44.7848 177.3247 26 G 4.1902 9.4408 109.8519 46.0676 0.0000 173.6635 27 Y 4.2849 8.7835 123.0783 59.8183 38.8153 178.6627 28 K 4.0525 8.1864 119.8934 59.9441 32.4646 178.8824 29 S 4.2648 8.1329 115.1540 61.4812 62.7114 176.5631 30 T 3.9060 8.5851 113.1310 64.8807 68.4655 176.7343 31 V 3.6077 8.0002 121.3715 65.4059 31.5428 177.8603 32 K 3.9707 8.1132 119.4031 59.7350 32.0251 179.0374 33 S 4.1756 8.5713 115.8398 61.5482 62.5216 176.6859 34 L 4.0605 8.3631 121.1561 57.8918 41.4568 179.5308 35 R 3.9924 8.2715 117.5087 59.0667 29.9928 178.5749 36 Q 4.1024 7.8572 119.1319 57.1328 29.1412 177.1078 37 G 3.9581 7.7061 106.3618 44.8500 0.0000 174.0993 38 K 4.0267 7.8091 120.7122 59.1195 32.5012 177.4416 39 S 4.2992 7.8540 112.4363 58.2836 63.2552 173.5639 40 K 4.3658 8.4449 125.9900 58.3007 33.4825 176.5108 41 L 5.1251 7.8155 119.4261 53.5017 46.0853 174.8629 42 I 5.0646 8.2052 117.5305 59.1683 41.4000 173.9538 43 I 4.9485 8.4392 124.3907 59.5527 40.5948 174.2395 44 I 4.4897 8.5366 127.2939 59.2036 39.1403 175.6812 45 A 4.4952 8.8424 132.6697 53.7990 19.1991 176.6568 46 A 4.6957 7.8118 115.7452 49.7188 23.0307 176.0472 47 N 4.7963 8.4667 118.6250 52.4330 37.1060 174.4211 48 T 3.9879 7.7326 111.3598 60.3256 69.9268 173.9862 49 P 4.4533 0.0000 0.0000 62.5417 33.4608 177.4780 50 V 3.5797 8.3412 117.9899 66.3414 31.4444 178.2247 51 L 3.9730 7.8026 117.9255 58.0497 40.0123 179.6494 52 R 4.1375 7.8967 117.4788 58.8965 30.1902 178.8817 53 K 4.2620 8.4364 120.0639 59.4889 32.2480 178.9487 54 S 4.3581 8.7074 113.8136 61.1742 62.2357 175.7134 55 E 3.8650 7.8552 121.0852 59.1393 29.3283 178.8205 56 L 3.7921 7.2948 118.1711 57.7146 41.6905 179.3469 57 E 4.1377 8.1694 118.3737 59.5236 29.2934 178.7431 58 Y 3.9858 8.3728 119.7081 61.0097 38.9160 177.7608 59 Y 4.2571 8.5800 117.5570 61.0279 37.7020 178.2971 60 A 4.0768 8.1599 120.9997 55.4511 18.5575 179.0810 61 M 4.0962 7.8161 115.6149 58.6512 32.3713 178.0618 62 L 4.0238 7.3663 118.0749 57.8330 42.1157 178.1411 63 S 4.4748 7.6216 110.9042 58.7543 65.7477 173.8441 64 K 4.3365 8.5601 127.1647 58.6445 31.5830 176.7443 65 T 3.5157 8.9271 112.7229 61.9328 67.5476 170.1743 66 K 4.8029 7.7831 118.8560 55.4235 36.4349 175.2530 67 V 4.5627 8.1051 117.5352 62.2862 34.4793 171.4236 68 Y 4.7486 8.7209 129.8364 56.3938 40.8094 174.2128 69 Y 4.5777 8.3843 125.5834 56.6077 37.1760 175.2981 70 F 4.5683 8.7594 126.5814 61.2218 39.9572 177.6199 71 Q 3.8371 7.7498 111.9371 56.2257 29.1383 173.7994 72 G 3.3792 6.7351 108.9889 44.5584 0.0000 175.0324 73 G 3.7035 8.5768 113.7469 47.7825 0.0000 174.2021 74 N 4.2763 8.1756 117.0638 55.0191 39.3695 174.5787 75 N 4.3789 8.2045 114.5581 54.8553 37.5324 175.0927 76 E 4.1694 8.1600 118.5455 58.8095 30.3239 179.6671 77 L 3.9499 7.9113 120.4189 57.8218 42.0543 178.8125 78 G 3.9186 8.2946 105.7372 47.9448 0.0000 175.7569 79 T 3.9024 7.7852 117.2393 66.3861 68.4718 176.3064 80 A 4.0405 7.4129 121.3197 55.3372 18.6045 179.7518 81 V 3.4205 7.5397 114.7333 63.4698 31.9270 175.7871 82 G 4.0100 7.5262 108.3655 44.1476 0.0000 174.9293 83 K 4.1209 8.7314 125.9475 59.0582 32.6582 177.7376 84 L 4.0871 8.0537 118.1697 57.7247 41.5577 177.2930 85 F 4.6109 7.7374 121.4988 58.2727 37.2200 174.4930 86 R 4.1329 8.4353 123.5448 57.7082 29.9442 177.9449 87 V 4.3302 7.5955 110.2811 58.9778 34.8383 175.5985 88 G 2.3586 8.1481 110.7302 43.6989 0.0000 171.4900 89 V 4.7254 8.1419 125.0321 61.1059 34.5719 174.2628 90 V 5.1014 8.5391 127.5264 61.3494 35.4725 174.1685 91 S 5.2571 9.0172 122.2702 56.8049 66.2725 172.9069 92 I 4.9024 8.7597 123.8012 59.7792 39.9070 174.8784 93 L 4.8977 8.3676 125.9186 52.3294 45.4904 174.6508 94 E 3.9040 8.8939 120.0798 57.1938 29.5516 177.9586 95 A 3.9745 8.6886 131.1068 53.6100 18.8341 178.1698 96 G 3.9558 9.6679 102.9638 45.1762 0.0000 172.3208 97 D 4.3406 6.9632 117.1970 54.1678 44.1554 172.5971 98 S 4.2511 8.3354 110.5173 58.2914 61.5714 174.4155 99 D 4.5492 7.7308 124.6805 55.0125 40.1264 178.3241 100 I 3.5875 7.7147 120.4281 64.1605 37.4671 177.2085 101 L 3.9586 7.4396 121.3139 58.4045 41.6627 179.1527 102 T 3.8953 7.7426 114.2415 66.8641 68.5796 176.2878 103 T 3.9990 7.7721 116.4440 66.7227 68.6355 176.2562 104 L 4.0866 7.7533 119.9830 57.1776 42.1608 176.9525 105 A 4.3248 7.4888 124.2949 52.6278 18.4932 176.8120 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 *1 M 8.30 4.36 0.00 2.05 1.07 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.12 0.00 2 A 8.76 4.12 1.28 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 0.00 0.00 0.00 *3 P 0.00 4.28 0.00 2.10 1.96 0.00 3.74 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.58 0.00 *4 V 7.19 4.10 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 0.80 0.00 0.00 0.93 0.00 0.00 *5 K 8.14 4.74 0.00 1.70 1.53 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.25 0.99 7.81 *6 S 8.25 4.85 0.00 3.59 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 7 Q 7.74 4.06 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.86 0.00 0.00 0.00 0.00 0.00 2.51 2.45 0.00 8 E 8.28 4.09 0.00 2.26 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 0.00 2.39 2.42 0.00 9 S 8.32 4.18 0.00 3.91 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 10 I 7.69 3.60 1.75 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 0.98 1.15 0.71 0.00 0.00 11 N 8.27 4.16 0.00 2.82 2.76 0.00 0.00 7.19 7.24 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 12 Q 7.90 3.92 0.00 2.27 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.68 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 13 K 7.67 3.93 0.00 1.86 1.93 0.00 1.50 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.44 7.81 14 L 8.21 3.96 0.00 1.78 1.71 0.84 0.86 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 15 A 7.93 3.95 1.33 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 16 L 7.68 4.02 0.00 1.65 1.66 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.21 3.61 2.32 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 0.88 0.00 0.00 1.02 0.00 0.00 18 I 7.85 3.83 1.91 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.36 0.94 0.00 0.00 19 K 7.69 3.92 0.00 1.83 2.01 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.47 1.48 7.81 20 S 7.88 4.73 0.00 3.95 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 21 G 8.11 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 0.00 0.00 0.00 22 K 8.14 4.36 0.00 1.76 1.60 0.00 1.57 0.00 0.00 1.53 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.41 7.81 23 Y 7.07 5.05 0.00 2.97 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 24 T 8.92 4.85 4.31 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 0.00 0.00 1.29 0.00 0.00 25 L 8.95 5.19 0.00 1.48 1.42 0.75 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 26 G 9.44 4.19 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 0.00 0.00 0.00 27 Y 8.78 4.28 0.00 2.98 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 28 K 8.19 4.05 0.00 1.96 1.87 0.00 1.82 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.61 7.81 29 S 8.13 4.26 0.00 3.96 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 30 T 8.59 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 1.29 0.00 0.00 31 V 8.00 3.61 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 1.06 0.00 0.00 0.61 0.00 0.00 32 K 8.11 3.97 0.00 1.88 2.00 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.65 7.81 33 S 8.57 4.18 0.00 4.06 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 34 L 8.36 4.06 0.00 1.68 1.86 0.97 0.97 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 35 R 8.27 3.99 0.00 1.92 1.98 0.00 3.21 0.00 0.00 3.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 36 Q 7.86 4.10 0.00 2.04 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.50 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 37 G 7.71 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 0.00 0.00 0.00 38 K 7.81 4.03 0.00 1.71 1.85 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.48 7.81 39 S 7.85 4.30 0.00 3.89 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 40 K 8.44 4.37 0.00 1.73 1.84 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.53 7.81 41 L 7.82 5.13 0.00 1.78 1.45 0.94 0.75 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 42 I 8.21 5.06 1.96 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.58 0.92 0.00 0.00 43 I 8.44 4.95 1.90 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 1.10 0.68 1.11 0.00 0.00 44 I 8.54 4.49 1.69 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 1.16 1.47 0.56 0.00 0.00 45 A 8.84 4.50 1.33 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 46 A 7.81 4.70 1.18 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 0.00 0.00 47 N 8.47 4.80 0.00 2.63 2.73 0.00 0.00 7.00 7.70 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 48 T 7.73 3.99 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 49 P 0.00 4.45 0.00 2.27 2.20 0.00 3.70 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 2.05 1.99 0.00 50 V 8.34 3.58 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 0.93 0.00 0.00 0.92 0.00 0.00 51 L 7.80 3.97 0.00 1.72 1.69 0.90 0.96 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 52 R 7.90 4.14 0.00 1.98 2.07 0.00 3.11 0.00 0.00 3.03 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 53 K 8.44 4.26 0.00 1.97 2.03 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.63 1.62 7.81 54 S 8.71 4.36 0.00 3.95 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 55 E 7.86 3.86 0.00 2.18 1.82 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 1.53 2.12 0.00 56 L 7.29 3.79 0.00 1.90 1.61 0.80 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.17 4.14 0.00 2.36 2.09 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 2.47 2.69 0.00 58 Y 8.37 3.99 0.00 3.29 3.30 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 59 Y 8.58 4.26 0.00 3.30 2.96 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 60 A 8.16 4.08 1.49 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 0.00 0.00 61 M 7.82 4.10 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.38 0.00 62 L 7.37 4.02 0.00 1.76 1.66 0.97 1.29 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 63 S 7.62 4.47 0.00 3.96 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 64 K 8.56 4.34 0.00 1.77 1.62 0.00 1.64 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.48 7.81 65 T 8.93 3.52 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 1.22 0.00 0.00 66 K 7.78 4.80 0.00 2.01 1.99 0.00 1.50 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.37 7.81 67 V 8.11 4.56 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 0.11 0.00 0.00 0.95 0.00 0.00 68 Y 8.72 4.75 0.00 3.02 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 69 Y 8.38 4.58 0.00 2.70 2.87 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 70 F 8.76 4.57 0.00 3.22 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 71 Q 7.75 3.84 0.00 2.37 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.61 0.00 0.00 0.00 0.00 0.00 2.15 2.09 0.00 72 G 6.74 3.38 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 0.00 73 G 8.58 3.70 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 0.00 0.00 0.00 74 N 8.18 4.28 0.00 2.81 2.96 0.00 0.00 6.88 8.00 0.00 0.00 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 N 8.20 4.38 0.00 3.07 2.85 0.00 0.00 7.24 7.42 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 76 E 8.16 4.17 0.00 2.08 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 2.49 2.50 0.00 77 L 7.91 3.95 0.00 1.50 1.84 0.63 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 78 G 8.29 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 79 T 7.79 3.90 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 1.20 0.00 0.00 80 A 7.41 4.04 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 81 V 7.54 3.42 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 -0.09 0.00 0.00 0.82 0.00 0.00 82 G 7.53 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 83 K 8.73 4.12 0.00 1.72 1.88 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.56 7.81 84 L 8.05 4.09 0.00 1.71 1.77 0.93 0.83 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 85 F 7.74 4.61 0.00 2.69 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 86 R 8.44 4.13 0.00 1.97 2.08 0.00 3.04 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 87 V 7.60 4.33 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 0.68 0.00 0.00 0.87 0.00 0.00 88 G 8.15 2.36 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 0.00 89 V 8.14 4.73 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 0.98 0.00 0.00 1.02 0.00 0.00 90 V 8.54 5.10 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 1.21 0.00 0.00 91 S 9.02 5.26 0.00 3.86 3.74 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 92 I 8.76 4.90 1.90 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 1.35 1.00 0.95 0.00 0.00 93 L 8.37 4.90 0.00 1.49 1.55 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.89 3.90 0.00 2.03 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 2.37 2.34 0.00 95 A 8.69 3.97 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 96 G 9.67 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 0.00 0.00 0.00 97 D 6.96 4.34 0.00 2.57 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 S 8.34 4.25 0.00 3.96 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 99 D 7.73 4.55 0.00 2.90 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 0.00 100 I 7.71 3.59 1.84 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 1.48 1.26 0.90 0.00 0.00 101 L 7.44 3.96 0.00 1.92 1.65 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 102 T 7.74 3.90 4.37 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 1.21 0.00 0.00 103 T 7.77 4.00 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 1.19 0.00 0.00 104 L 7.75 4.09 0.00 1.55 1.65 0.87 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 105 A 7.49 4.32 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 * Residues marked with a * may have inaccurate shift predictions.