NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.6134 8.2833 118.1449 52.3703 38.9215 174.8859 2 T 3.7380 8.1523 115.7871 66.6274 68.1339 175.3592 3 Y 4.1753 8.1982 119.6623 61.1289 38.3100 177.9830 4 Q 3.9982 8.5056 119.1276 58.8682 28.7588 178.5707 5 F 4.3304 8.2878 121.7458 61.0223 39.3235 176.9885 6 K 3.5266 7.9853 119.2907 59.6041 31.9928 178.5058 7 N 4.3350 8.0775 116.6045 56.5448 38.4808 177.3470 8 M 4.1674 8.1733 120.3134 58.5009 31.9746 178.8961 9 I 3.5693 7.5538 119.9081 64.3859 36.8462 178.4666 10 Q 4.0489 8.3447 119.0365 58.8296 28.1954 178.3744 11 C 4.3018 7.7448 118.7561 59.8627 43.9578 175.2972 12 T 4.0182 7.6589 109.0868 62.6106 70.2978 174.9347 13 V 4.5202 7.8574 121.4061 60.4042 31.2572 173.9545 14 P 4.5210 0.0000 0.0000 64.5410 32.1775 178.7974 15 K 3.9782 7.5152 115.3456 58.8932 32.6759 176.7779 *17 R 4.8709 7.5284 117.1580 55.8342 31.3569 175.1250 18 S 4.4722 8.1446 114.5109 57.7698 63.3200 175.3504 19 W 4.5695 9.0681 123.3647 59.4839 27.5285 178.5396 20 W 3.7946 7.5907 119.6432 59.4590 28.0999 177.9821 21 D 4.1420 7.8768 118.3001 56.8274 40.3945 177.9785 22 F 4.6472 8.2498 117.4706 59.1976 39.6349 177.7375 23 A 4.4483 7.9462 119.7819 53.9711 18.2064 177.1332 24 D 5.0164 8.1880 117.5272 53.7412 42.0664 173.5688 25 Y 4.4794 8.2239 118.6781 56.5228 40.6174 176.5618 26 G 4.0404 7.8927 116.5672 45.4879 0.0000 172.2467 27 C 4.4191 9.3157 115.0195 58.2495 37.1208 174.6975 28 Y 4.6017 8.7005 115.9176 57.9337 39.8312 177.1777 29 C 4.6382 8.5768 117.1513 58.7869 41.6381 174.3640 30 G 4.2917 8.2775 102.4357 44.8763 0.0000 174.3382 31 R 4.2153 8.8577 116.2213 55.7273 32.1378 175.3142 32 G 3.7648 8.2429 113.7476 41.4204 0.0000 174.1382 33 G 3.7772 8.2764 106.4159 44.9018 0.0000 172.7976 34 S 4.4753 6.5080 111.6696 57.1354 65.8480 173.0623 35 G 3.9091 8.5719 105.6936 45.7191 0.0000 172.3338 36 T 4.3408 8.0802 115.2633 61.8569 69.1065 173.3539 37 P 4.7263 0.0000 0.0000 63.1050 31.7734 176.7066 38 I 3.9408 8.8305 116.2842 63.2387 38.3546 174.7138 39 D 4.5703 7.4485 118.6039 51.7299 41.7058 175.4165 40 D 4.3946 8.6732 117.9454 57.5388 40.6946 178.4998 41 L 3.9449 7.9866 120.4478 58.2799 42.1226 178.3869 42 D 4.5586 8.8698 118.1205 57.3764 41.0863 178.1873 43 R 3.7758 8.1158 119.3904 59.3579 30.0420 177.5576 44 C 4.2118 8.3530 116.5318 60.6745 41.5102 175.7441 45 C 4.4511 8.2129 117.2702 59.8831 40.1246 175.8975 46 Q 3.5474 8.0817 121.4053 59.1067 28.5502 178.5763 47 V 3.4893 7.8482 119.2979 66.1606 31.4191 177.4925 48 H 4.0241 8.1054 118.0670 59.1966 29.6543 177.0475 49 D 4.1867 8.1615 120.7378 57.4448 40.6640 178.5315 50 N 4.3432 8.3670 117.2372 56.3015 38.4626 176.6514 51 C 4.2349 8.5497 120.3091 59.9868 44.9414 175.2738 52 Y 4.1490 8.1598 118.4828 61.1971 37.1535 178.3708 53 N 4.3838 8.1338 116.6847 56.3501 39.0139 177.3497 54 S 4.2449 8.1546 116.3648 61.5774 63.0660 176.4720 55 A 4.0033 8.1022 123.4781 55.3373 17.8858 179.7068 56 R 4.4150 7.8762 116.1735 58.0034 30.1327 178.5699 57 E 4.2512 7.7817 118.0689 58.1907 29.7480 177.3008 58 Q 4.0021 7.7690 118.9493 55.5920 28.8498 176.2014 59 G 3.8699 8.4529 113.0736 46.7483 0.0000 173.3843 60 G 3.8130 8.8591 111.4645 45.1532 0.0000 174.0208 61 C 4.3173 8.0845 120.2653 56.0379 44.1747 172.5280 62 R 4.6130 8.0654 127.7833 53.3370 30.0650 174.7601 63 P 3.8906 0.0000 0.0000 65.3449 31.5149 178.5567 64 K 4.0455 7.7597 116.5594 58.3612 32.2076 178.1783 65 Q 4.2911 7.7350 115.5648 55.4434 30.3530 175.6815 66 K 4.0464 7.7773 119.7914 56.1471 32.6105 175.9431 67 T 4.2049 8.3471 123.7664 62.7512 69.3071 173.4560 68 Y 4.9253 7.7786 123.7374 55.1501 41.1967 174.3025 69 S 5.1484 9.5836 116.0474 57.1274 65.0840 173.5779 70 Y 5.3425 8.5024 121.4919 56.0093 41.3905 173.4350 71 E 4.3968 9.3612 119.7687 54.4936 33.6704 173.3212 72 C 5.1766 8.7843 125.8075 54.8314 42.3720 172.6868 73 K 4.4327 8.4214 127.3282 55.2772 33.9693 177.4614 74 A 4.0685 9.0548 128.9798 52.5871 17.7559 176.5624 75 G 3.2523 7.5270 105.5436 45.1281 0.0000 173.2490 76 T 4.4160 8.2088 113.4985 59.4333 69.2739 173.6506 77 L 4.8285 8.3378 127.0808 54.7293 42.6874 176.9643 78 S 4.7210 8.9938 118.5491 56.9884 67.0481 172.3523 79 C 4.9291 8.7926 121.9160 56.0830 39.4310 174.0132 80 S 4.4749 8.9978 120.1782 58.2760 63.7479 175.3729 81 G 3.7541 8.6849 109.3255 46.4432 0.0000 175.1979 82 S 4.2340 7.9850 114.8252 60.7966 63.4940 174.9074 83 N 4.1932 7.4889 117.7856 53.7195 38.9191 175.5292 84 N 4.6807 8.5377 120.7878 52.2809 40.1163 175.4195 85 S 3.9985 8.4801 113.1582 61.9058 62.3847 176.7572 86 C 4.1725 8.1845 120.3102 59.6056 42.7452 174.9311 87 A 4.0302 8.6347 122.4408 55.3174 17.9862 179.3683 88 A 3.8835 8.4616 119.3596 55.6759 18.4692 180.0536 89 T 3.7561 7.8847 114.1245 66.8412 68.5652 177.2655 90 V 3.5945 8.0317 120.4761 65.8064 31.4912 177.2560 91 C 2.8474 8.1385 118.7512 59.1196 44.0027 175.0379 92 D 4.1414 7.8705 119.5684 57.4092 40.8070 177.3686 93 C 4.1361 8.0864 116.9676 60.2651 40.3064 176.0034 94 D 3.8595 7.9257 120.0819 57.1138 40.3802 178.6264 95 R 3.8075 8.1357 119.5203 59.6026 30.0457 178.4418 96 L 3.8858 8.0045 118.4641 57.7247 41.5461 179.5178 97 A 3.6714 7.8838 120.3856 54.8949 18.1307 179.4806 98 A 3.4454 7.9873 119.5174 55.1625 18.2695 179.9384 99 I 3.6017 7.7721 118.3064 64.6488 36.6738 177.8092 100 C 4.2913 8.2265 119.3364 59.6787 43.2116 175.5457 101 F 4.3111 8.3056 118.6108 60.7303 38.5413 177.1596 102 A 4.3145 7.8046 119.0374 54.8694 18.2580 179.2035 103 G 3.7582 7.8610 101.9069 44.7552 0.0000 173.5522 104 A 4.7153 7.0391 123.3242 49.6601 20.5574 175.3460 105 P 4.3711 0.0000 0.0000 62.7575 32.0355 175.2984 106 Y 4.2331 8.5414 123.3838 55.9291 39.8016 174.0515 107 N 4.9692 8.7596 126.5941 51.6861 40.3590 174.9159 108 D 4.7019 9.0411 126.3856 57.6945 41.1148 178.5591 109 N 4.4812 8.7394 115.5409 55.3717 38.7571 175.3633 110 N 4.4862 8.2910 115.4824 52.7253 38.8910 173.4108 111 Y 4.4417 7.5808 119.9467 57.5814 40.1349 174.8449 112 N 4.0376 8.3852 124.9068 53.1887 37.8024 173.6933 113 I 3.8551 7.0267 109.8797 60.1857 39.2898 176.5479 114 D 4.4438 8.2640 120.3589 53.6649 40.7528 176.4042 115 L 3.9215 8.2750 128.0242 57.5421 41.5399 179.1028 116 K 3.8510 8.0487 117.8794 59.5043 32.2387 178.1580 117 A 4.1817 7.8762 119.8703 53.9532 18.6114 178.7046 118 R 4.5174 7.8903 113.5894 56.1267 31.3650 176.0708 119 C 4.9340 8.1361 116.2761 56.6348 41.1173 174.1753 120 Q 4.1765 8.0906 124.5625 56.1684 28.4831 175.6824 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 N 8.28 4.61 0.00 2.88 3.08 0.00 0.00 6.12 6.34 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 2 T 8.15 3.74 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 1.10 0.00 0.00 3 Y 8.20 4.18 0.00 3.10 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Q 8.51 4.00 0.00 1.81 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 5 F 8.29 4.33 0.00 3.29 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 6 K 7.99 3.53 0.00 1.28 1.77 0.00 0.61 0.00 0.00 1.08 0.00 0.00 2.68 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.10 0.67 7.81 7 N 8.08 4.34 0.00 3.07 3.04 0.00 0.00 7.09 7.82 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 8 M 8.17 4.17 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.61 0.00 9 I 7.55 3.57 1.83 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 -0.03 0.84 0.00 0.00 10 Q 8.34 4.05 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.84 0.00 0.00 0.00 0.00 0.00 2.49 2.62 0.00 11 C 7.74 4.30 0.00 3.16 3.41 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 12 T 7.66 4.02 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 1.19 0.00 0.00 13 V 7.86 4.52 2.35 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 1.22 0.00 0.00 1.00 0.00 0.00 14 P 0.00 4.52 0.00 2.24 2.20 0.00 3.47 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.94 0.00 15 K 7.52 3.98 0.00 2.02 2.12 0.00 1.35 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.39 7.81 *17 R 7.53 4.87 0.00 1.91 1.83 0.00 3.05 0.00 0.00 2.89 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.47 0.00 18 S 8.14 4.47 0.00 3.90 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 19 W 9.07 4.57 0.00 3.56 3.48 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 20 W 7.59 3.79 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 21 D 7.88 4.14 0.00 2.24 2.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.25 4.65 0.00 3.31 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 23 A 7.95 4.45 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 24 D 8.19 5.02 0.00 2.71 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 0.00 0.00 0.00 0.00 25 Y 8.22 4.48 0.00 3.29 2.89 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 26 G 7.89 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 27 C 9.32 4.42 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 28 Y 8.70 4.60 0.00 3.36 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 29 C 8.58 4.64 0.00 3.42 3.49 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 30 G 8.28 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 0.00 0.00 0.00 31 R 8.86 4.22 0.00 1.80 1.86 0.00 3.21 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 32 G 8.24 3.76 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 0.00 0.00 0.00 33 G 8.28 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 0.00 0.00 0.00 34 S 6.51 4.48 0.00 3.92 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 35 G 8.57 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 36 T 8.08 4.34 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 37 P 0.00 4.73 0.00 2.06 2.01 0.00 3.72 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.89 0.00 38 I 8.83 3.94 1.84 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.49 0.88 0.00 0.00 39 D 7.45 4.57 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 40 D 8.67 4.39 0.00 2.75 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 41 L 7.99 3.94 0.00 1.77 1.73 0.59 0.14 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 42 D 8.87 4.56 0.00 3.16 2.91 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 43 R 8.12 3.78 0.00 2.06 2.12 0.00 3.15 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 44 C 8.35 4.21 0.00 3.50 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 C 8.21 4.45 0.00 3.35 3.45 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 46 Q 8.08 3.55 0.00 0.93 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.04 1.63 0.00 47 V 7.85 3.49 2.18 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 0.81 0.00 0.00 0.91 0.00 0.00 48 H 8.11 4.02 0.00 3.24 3.31 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 8.16 4.19 0.00 3.04 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 50 N 8.37 4.34 0.00 2.81 2.84 0.00 0.00 6.68 8.46 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 51 C 8.55 4.23 0.00 3.00 3.16 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 0.00 0.00 0.00 0.00 52 Y 8.16 4.15 0.00 3.04 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 53 N 8.13 4.38 0.00 2.88 2.90 0.00 0.00 7.08 7.15 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 54 S 8.15 4.24 0.00 4.03 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 55 A 8.10 4.00 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 56 R 7.88 4.41 0.00 1.92 1.98 0.00 3.14 0.00 0.00 3.06 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 57 E 7.78 4.25 0.00 2.10 2.00 0.00 0.00 0.00 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 2.35 0.00 58 Q 7.77 4.00 0.00 2.19 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.99 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 59 G 8.45 3.87 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 0.00 0.00 0.00 60 G 8.86 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.08 4.32 0.00 2.96 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 62 R 8.07 4.61 0.00 1.80 1.76 0.00 3.18 0.00 0.00 3.30 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.74 0.00 63 P 0.00 3.89 0.00 0.76 0.64 0.00 3.46 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 64 K 7.76 4.05 0.00 1.70 1.80 0.00 1.76 0.00 0.00 2.00 0.00 0.00 3.10 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.43 1.39 7.81 65 Q 7.73 4.29 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.85 0.00 0.00 0.00 0.00 0.00 2.21 2.34 0.00 66 K 7.78 4.05 0.00 1.71 1.67 0.00 1.64 0.00 0.00 1.68 0.00 0.00 3.26 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.55 7.81 67 T 8.35 4.20 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 68 Y 7.78 4.93 0.00 3.15 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 69 S 9.58 5.15 0.00 3.84 3.87 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 Y 8.50 5.34 0.00 3.14 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 71 E 9.36 4.40 0.00 1.93 1.73 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 2.15 2.15 0.00 72 C 8.78 5.18 0.00 3.09 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 73 K 8.42 4.43 0.00 1.99 1.60 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.38 7.81 74 A 9.05 4.07 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 75 G 7.53 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 0.00 0.00 0.00 76 T 8.21 4.42 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 1.22 0.00 0.00 77 L 8.34 4.83 0.00 1.57 1.70 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 78 S 8.99 4.72 0.00 3.75 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 79 C 8.79 4.93 0.00 2.81 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 80 S 9.00 4.47 0.00 3.84 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.68 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 82 S 7.99 4.23 0.00 4.01 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 83 N 7.49 4.19 0.00 2.60 2.97 0.00 0.00 7.06 7.88 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 84 N 8.54 4.68 0.00 2.99 3.00 0.00 0.00 5.90 7.64 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 85 S 8.48 4.00 0.00 3.90 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 86 C 8.18 4.17 0.00 3.00 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 87 A 8.63 4.03 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.46 3.88 1.31 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 0.00 0.00 0.00 89 T 7.88 3.76 4.41 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 1.18 0.00 0.00 90 V 8.03 3.59 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 0.99 0.00 0.00 0.82 0.00 0.00 91 C 8.14 2.85 0.00 2.14 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 92 D 7.87 4.14 0.00 2.90 2.66 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 0.00 0.00 0.00 0.00 93 C 8.09 4.14 0.00 3.31 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 94 D 7.93 3.86 0.00 2.67 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 95 R 8.14 3.81 0.00 1.78 2.04 0.00 3.19 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 96 L 8.00 3.89 0.00 1.82 1.63 0.94 0.81 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 97 A 7.88 3.67 0.90 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 98 A 7.99 3.45 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 99 I 7.77 3.60 1.96 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 1.38 0.69 0.90 0.00 0.00 100 C 8.23 4.29 0.00 3.12 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 0.00 101 F 8.31 4.31 0.00 2.74 2.52 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 0.00 102 A 7.80 4.31 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 G 7.86 3.76 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 0.00 0.00 0.00 104 A 7.04 4.72 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 0.00 105 P 0.00 4.37 0.00 2.11 2.05 0.00 3.71 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 106 Y 8.54 4.23 0.00 2.88 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 0.00 107 N 8.76 4.97 0.00 2.80 2.70 0.00 0.00 6.75 8.19 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 0.00 108 D 9.04 4.70 0.00 2.82 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 0.00 109 N 8.74 4.48 0.00 2.85 2.86 0.00 0.00 6.93 8.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 N 8.29 4.49 0.00 2.32 1.95 0.00 0.00 6.42 7.03 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 0.00 111 Y 7.58 4.44 0.00 3.04 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 0.00 112 N 8.39 4.04 0.00 2.21 2.59 0.00 0.00 7.19 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 0.00 113 I 7.03 3.86 1.77 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.60 0.76 0.00 0.00 114 D 8.26 4.44 0.00 2.69 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.28 3.92 0.00 1.67 1.63 0.86 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.05 3.85 0.00 1.71 2.00 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.49 7.81 117 A 7.88 4.18 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 0.00 118 R 7.89 4.52 0.00 1.86 1.91 0.00 3.05 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 119 C 8.14 4.93 0.00 2.99 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 0.00 120 Q 8.09 4.18 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.65 0.00 0.00 0.00 0.00 0.00 2.30 2.51 0.00 * Residues marked with a * may have inaccurate shift predictions.