NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.5006 8.2833 118.1270 52.3154 39.0216 174.8220 2 T 3.5708 7.5750 116.1662 66.9066 68.1205 175.0672 3 Y 4.1050 7.9247 119.3568 61.1258 38.3040 178.3716 4 Q 4.0447 8.6714 119.4006 58.8648 28.7686 178.3946 5 F 4.3929 8.1739 121.7302 61.3866 39.3766 177.0335 6 R 3.4609 7.9162 118.3031 59.3427 29.6017 178.3360 7 N 4.6324 7.7261 117.7528 55.9755 38.5313 177.1520 8 M 4.1528 8.1119 120.1425 58.5505 32.0790 178.8596 9 I 3.6044 7.5405 119.6520 64.5880 37.4834 178.4694 10 E 4.3614 8.2105 119.0399 59.1518 28.8934 178.7452 11 C 4.4022 8.4205 119.5366 60.0109 43.6568 175.6448 12 T 3.9260 8.1901 110.2747 63.0388 69.2824 174.8629 13 V 4.5007 8.2332 121.3686 60.1828 31.3312 173.7720 14 P 4.5550 0.0000 0.0000 65.1370 31.9358 178.0712 15 S 4.2698 7.5944 107.2463 59.2500 62.7061 173.7715 *17 R 4.3130 7.5499 118.3032 56.3177 31.1508 175.0493 18 S 4.4880 8.1183 115.4850 57.3689 63.3776 175.1523 19 W 4.7764 8.9573 124.3531 59.0262 27.6274 178.3177 20 W 3.2941 7.4051 119.6821 59.0939 28.1701 177.5408 21 D 4.2505 8.1353 118.2247 55.8275 40.1121 176.8073 22 F 4.8843 7.6352 116.0005 57.0967 39.9396 175.7420 23 A 4.4708 8.3562 123.8917 53.5857 19.1699 178.0751 24 D 4.7842 7.8066 114.5471 53.6037 42.2420 173.6336 25 Y 4.7331 8.1295 122.5332 56.6428 42.0554 176.1877 26 G 3.9540 8.4064 116.6128 46.5741 0.0000 172.4757 27 C 4.4519 9.2158 115.0692 57.6588 36.4177 173.7295 28 Y 4.3669 8.8992 116.7092 58.5094 39.7876 174.8022 29 C 4.9464 8.1356 117.7629 56.2526 38.3691 172.7146 30 G 3.2968 8.6101 118.7009 45.6212 0.0000 171.6884 *32 C 4.8921 7.1764 117.7106 57.2595 42.2595 171.8273 33 G 3.7823 7.9723 118.4758 44.7282 0.0000 175.4699 34 S 4.6738 7.6461 116.6904 58.2984 65.0128 172.6235 35 G 3.6742 8.6266 105.3968 44.4571 0.0000 172.7186 36 T 4.3233 8.3787 117.0476 61.8571 68.8417 173.1525 37 P 4.7335 0.0000 0.0000 63.2248 31.7413 176.9110 38 T 4.0574 9.3717 113.7996 63.4638 69.2712 173.4548 39 D 4.4412 7.6107 120.2352 51.8589 41.9221 176.1024 40 D 4.3948 8.5876 118.2786 57.8278 40.4817 178.8893 41 L 3.9648 7.9436 120.0215 58.1471 42.0485 178.3345 42 D 4.5018 8.8946 118.3009 57.5479 41.1516 178.4444 43 R 3.8446 8.3107 118.6277 59.1765 30.0726 178.2523 44 C 4.2727 8.1059 116.4397 60.5830 41.4893 175.7345 45 C 4.3924 8.1176 117.8847 59.7661 33.8615 176.0177 46 Q 3.3705 8.0111 121.5116 59.0777 28.5997 178.5743 47 V 3.5704 8.0017 119.4889 65.8828 31.4457 177.5853 48 H 3.9681 8.0013 118.0878 59.2295 29.6753 176.5915 49 C 4.1632 8.2795 118.4157 60.1277 34.2406 175.6882 50 N 4.1338 7.9854 118.0265 56.6392 38.5238 176.1340 51 C 4.2676 8.0040 120.1083 59.8691 39.9686 175.1810 52 Y 4.0359 8.1057 118.4259 61.1320 37.1798 178.6804 53 R 4.0139 8.0296 118.3899 59.3024 30.4273 178.8377 54 Q 4.1186 8.0812 117.3428 58.7995 28.7538 178.4272 55 A 4.1062 8.0078 121.5030 54.9116 18.1427 179.7671 56 G 3.6830 7.7643 103.2171 46.6283 0.0000 174.9852 57 E 4.3859 7.8812 119.0127 56.4848 29.9005 176.5542 58 I 4.0994 7.5103 122.2029 59.4997 37.3811 175.2486 59 S 4.1247 8.6354 120.0519 60.2334 62.6049 174.9790 60 G 3.7264 8.9668 112.5335 45.5046 0.0000 173.3434 61 C 4.4925 8.1882 120.8428 55.2747 41.5284 172.6683 62 R 4.6055 8.0219 128.1637 53.3094 28.9870 175.2848 63 P 3.8658 0.0000 0.0000 65.1955 31.5684 178.7491 64 K 3.8315 8.0123 117.9897 58.3637 32.2026 177.5900 65 F 4.4693 8.6466 115.3414 56.9297 41.1627 175.2765 66 K 3.8553 7.4279 122.0224 56.9513 32.0838 175.9929 67 T 4.1714 8.4002 123.7100 62.8245 69.2598 173.5091 68 Y 4.9283 8.3188 123.7878 55.3747 41.2913 174.4187 69 T 4.9461 9.1084 116.8160 62.2084 70.3021 173.9047 70 Y 5.3882 8.5637 123.0998 56.0825 41.6028 173.9383 71 Q 4.3727 9.7097 118.9990 54.0429 32.9039 172.1605 72 C 5.3740 8.7719 117.8142 54.0045 39.5941 174.0382 73 S 4.4395 9.5491 122.2393 56.7831 63.5839 172.8371 74 G 4.1791 9.6207 110.8320 46.6005 0.0000 171.9944 75 G 3.9882 8.2333 109.3317 46.2970 0.0000 171.4432 76 T 4.4661 7.4849 117.5318 62.0497 69.6018 173.4445 77 L 5.3076 8.4154 125.7883 53.2464 44.9528 176.1753 78 T 4.6185 9.2782 119.7087 62.1273 72.5059 172.2840 79 C 5.0211 8.8572 124.3488 56.0772 39.8046 173.7471 80 K 4.3329 9.0300 123.5758 55.6382 32.8735 178.6059 81 G 3.6805 8.8995 112.6336 48.7190 0.0000 175.1676 82 N 4.3520 7.4614 110.6422 53.9334 37.0723 174.3016 83 N 4.7127 8.2321 117.5906 52.5753 39.6827 175.5514 84 N 4.7036 8.4476 120.2698 51.5934 40.2374 175.8087 85 A 4.1639 8.5046 121.3319 55.7171 18.1872 180.2591 86 C 4.1343 8.2164 115.7547 59.8744 43.9052 175.4799 87 A 3.9668 8.8528 122.6107 55.0135 18.0406 179.5049 88 A 3.8593 8.9576 120.5698 55.3484 18.5913 180.1429 89 S 3.9757 8.1503 113.7367 61.6036 62.9282 176.8023 90 S 3.8832 8.0066 115.7857 61.5436 62.1391 175.2750 91 C 2.9167 7.9589 121.2757 59.5058 41.8653 175.3583 92 D 4.0367 7.8276 119.9557 57.2546 40.1965 177.8312 93 C 4.1630 7.7963 117.1108 59.9108 37.1902 175.4914 94 D 3.5607 7.8344 120.0202 57.2432 40.4175 179.0956 95 R 3.7782 7.8136 118.8685 59.5679 30.0983 178.5557 96 L 3.8984 7.7889 118.4432 57.6834 41.4794 179.4667 97 A 3.7733 8.1793 120.8742 54.8784 18.0285 179.5522 98 A 3.4028 7.9271 118.7801 55.1363 18.5787 179.6913 99 I 3.7810 7.9808 118.7569 64.4163 37.1948 177.6737 100 C 4.2050 8.4228 119.7847 59.9169 37.7202 175.5451 101 F 4.3092 8.3314 119.3534 60.8367 38.2594 177.5897 102 A 4.2939 7.8658 119.1057 54.1124 18.2182 178.7817 103 G 3.9808 7.9621 101.5566 43.4725 0.0000 173.0201 104 A 4.8162 7.2971 123.8292 49.1570 21.0747 175.1308 105 P 4.3217 0.0000 0.0000 62.9189 31.9890 175.3865 106 Y 4.2197 8.5328 122.9191 55.9737 39.4104 174.8065 107 N 4.8309 9.0730 128.2233 52.0381 38.8022 174.9052 108 D 4.9414 9.0753 127.3521 57.7401 41.2664 179.4291 109 N 4.3185 8.8720 116.2480 56.4246 38.6566 175.7218 110 N 4.2854 8.4583 113.6628 53.4705 38.4493 173.6928 111 Y 4.3302 7.3231 120.2653 57.4455 40.2338 174.7016 112 N 3.9229 8.4043 124.7584 53.0305 37.8642 173.7542 113 I 3.8937 6.9871 109.6024 59.8999 39.4603 176.1548 114 D 4.3936 8.2574 120.0812 54.0023 41.1860 176.6021 115 L 3.9284 8.2608 128.5471 57.4190 41.5769 179.0656 116 K 3.8135 8.0588 118.0145 59.5322 32.2415 178.0038 117 A 4.2642 7.9767 118.3705 53.4922 18.9351 178.5485 118 R 4.4684 7.9001 114.1682 56.2514 31.2839 176.0269 119 C 4.9073 8.0757 114.0791 56.1607 41.7580 173.5355 120 N 4.5370 7.9568 123.7975 53.6231 38.7808 173.7990 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 4.50 0.00 2.70 3.04 0.00 0.00 6.10 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 7.58 3.57 3.42 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 0.82 0.00 0.00 3 Y 7.92 4.11 0.00 3.08 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 4 Q 8.67 4.04 0.00 1.69 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 5 F 8.17 4.39 0.00 3.17 3.12 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 0.00 0.00 0.00 0.00 6 R 7.92 3.46 0.00 1.30 1.81 0.00 2.39 0.00 0.00 2.37 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.50 0.00 7 N 7.73 4.63 0.00 3.10 3.02 0.00 0.00 6.68 7.51 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 8 M 8.11 4.15 0.00 2.12 2.32 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.68 0.00 9 I 7.54 3.60 1.93 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.06 0.96 0.00 0.00 10 E 8.21 4.36 0.00 2.21 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 0.00 2.49 2.65 0.00 11 C 8.42 4.40 0.00 3.24 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 12 T 8.19 3.93 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 1.26 0.00 0.00 13 V 8.23 4.50 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 1.17 0.00 0.00 1.07 0.00 0.00 14 P 0.00 4.55 0.00 2.11 2.14 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.40 0.00 15 S 7.59 4.27 0.00 3.99 4.09 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 *17 R 7.55 4.31 0.00 1.91 1.74 0.00 3.16 0.00 0.00 2.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.49 0.00 18 S 8.12 4.49 0.00 3.87 3.86 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 19 W 8.96 4.78 0.00 3.60 3.31 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 20 W 7.41 3.29 0.00 3.12 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 21 D 8.14 4.25 0.00 1.94 1.95 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 22 F 7.64 4.88 0.00 3.25 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 8.36 4.47 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 24 D 7.81 4.78 0.00 2.66 2.11 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 25 Y 8.13 4.73 0.00 3.17 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 26 G 8.41 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 0.00 0.00 0.00 27 C 9.22 4.45 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 28 Y 8.90 4.37 0.00 3.34 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 29 C 8.14 4.95 0.00 3.47 3.43 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 30 G 8.61 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 0.00 0.00 0.00 *32 C 7.18 4.89 0.00 3.17 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 33 G 7.97 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 7.65 4.67 0.00 3.96 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 35 G 8.63 3.67 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 0.00 0.00 0.00 36 T 8.38 4.32 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 2.10 2.17 0.00 3.75 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.15 0.00 38 T 9.37 4.06 4.21 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 1.24 0.00 0.00 39 D 7.61 4.44 0.00 2.93 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 40 D 8.59 4.39 0.00 2.75 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 41 L 7.94 3.96 0.00 1.76 1.60 0.56 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 42 D 8.89 4.50 0.00 3.24 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 43 R 8.31 3.84 0.00 2.10 1.94 0.00 3.19 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.90 0.00 44 C 8.11 4.27 0.00 3.48 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 45 C 8.12 4.39 0.00 3.30 3.43 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 46 Q 8.01 3.37 0.00 0.95 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.80 0.00 0.00 0.00 0.00 0.00 2.00 1.46 0.00 47 V 8.00 3.57 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 0.88 0.00 0.00 0.92 0.00 0.00 48 H 8.00 3.97 0.00 3.25 3.38 0.00 5.64 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 C 8.28 4.16 0.00 3.07 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 50 N 7.99 4.13 0.00 2.81 2.90 0.00 0.00 6.91 7.99 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 51 C 8.00 4.27 0.00 3.24 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 52 Y 8.11 4.04 0.00 3.11 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 53 R 8.03 4.01 0.00 1.98 2.02 0.00 3.20 0.00 0.00 3.26 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.96 0.00 54 Q 8.08 4.12 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 55 A 8.01 4.11 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 56 G 7.76 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 57 E 7.88 4.39 0.00 2.07 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 2.60 0.00 58 I 7.51 4.10 1.97 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 1.33 0.80 0.89 0.00 0.00 59 S 8.64 4.12 0.00 3.95 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 60 G 8.97 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 61 C 8.19 4.49 0.00 3.02 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 62 R 8.02 4.61 0.00 1.98 1.97 0.00 3.12 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 63 P 0.00 3.87 0.00 1.22 0.82 0.00 3.49 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.84 0.00 64 K 8.01 3.83 0.00 1.88 1.77 0.00 1.55 0.00 0.00 1.99 0.00 0.00 3.27 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.08 7.81 65 F 8.65 4.47 0.00 2.89 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 66 K 7.43 3.86 0.00 1.63 1.73 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.52 7.81 67 T 8.40 4.17 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 1.15 0.00 0.00 68 Y 8.32 4.93 0.00 2.90 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 69 T 9.11 4.95 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 1.26 0.00 0.00 70 Y 8.56 5.39 0.00 3.12 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 71 Q 9.71 4.37 0.00 1.90 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.77 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 72 C 8.77 5.37 0.00 3.09 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 73 S 9.55 4.44 0.00 3.82 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 74 G 9.62 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 0.00 0.00 0.00 75 G 8.23 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 76 T 7.48 4.47 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 1.22 0.00 0.00 77 L 8.42 5.31 0.00 1.49 1.57 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 78 T 9.28 4.62 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 1.22 0.00 0.00 79 C 8.86 5.02 0.00 2.80 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 80 K 9.03 4.33 0.00 1.79 1.85 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.43 7.81 81 G 8.90 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 82 N 7.46 4.35 0.00 2.92 2.96 0.00 0.00 7.00 7.92 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 83 N 8.23 4.71 0.00 2.80 2.88 0.00 0.00 6.93 7.75 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 84 N 8.45 4.70 0.00 2.99 2.98 0.00 0.00 6.10 7.46 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 85 A 8.50 4.16 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 86 C 8.22 4.13 0.00 2.98 3.28 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 87 A 8.85 3.97 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.96 3.86 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 89 S 8.15 3.98 0.00 3.96 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 90 S 8.01 3.88 0.00 3.82 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 91 C 7.96 2.92 0.00 2.34 2.71 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 92 D 7.83 4.04 0.00 2.78 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 93 C 7.80 4.16 0.00 3.19 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 94 D 7.83 3.56 0.00 2.43 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 95 R 7.81 3.78 0.00 1.77 1.91 0.00 3.04 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 96 L 7.79 3.90 0.00 1.84 1.62 0.87 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.18 3.77 1.09 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 0.00 0.00 98 A 7.93 3.40 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 99 I 7.98 3.78 1.95 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 1.39 1.39 0.89 0.00 0.00 100 C 8.42 4.20 0.00 3.11 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 0.00 101 F 8.33 4.31 0.00 2.96 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 0.00 102 A 7.87 4.29 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 0.00 103 G 7.96 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 0.00 0.00 0.00 104 A 7.30 4.82 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 0.00 105 P 0.00 4.32 0.00 2.12 2.07 0.00 3.70 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.13 0.00 106 Y 8.53 4.22 0.00 2.93 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 0.00 107 N 9.07 4.83 0.00 2.83 2.75 0.00 0.00 6.78 9.17 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 0.00 108 D 9.08 4.94 0.00 2.81 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 0.00 109 N 8.87 4.32 0.00 2.90 2.83 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 0.00 110 N 8.46 4.29 0.00 1.82 1.92 0.00 0.00 6.59 7.44 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 0.00 111 Y 7.32 4.33 0.00 2.94 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 0.00 112 N 8.40 3.92 0.00 1.82 2.52 0.00 0.00 7.18 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 0.00 113 I 6.99 3.89 1.76 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 1.13 0.60 0.75 0.00 0.00 114 D 8.26 4.39 0.00 2.72 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 8.26 3.93 0.00 1.67 1.62 0.86 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.06 3.81 0.00 1.72 1.99 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.50 7.81 117 A 7.98 4.26 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 0.00 118 R 7.90 4.47 0.00 1.93 1.91 0.00 3.06 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 119 C 8.08 4.91 0.00 2.92 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 0.00 120 N 7.96 4.54 0.00 2.58 2.92 0.00 0.00 6.94 7.56 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 * Residues marked with a * may have inaccurate shift predictions.