NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 T 4.3323 8.1329 117.3755 63.7561 70.6006 176.7307 5 E 3.6285 8.1432 115.6137 57.7512 29.7997 176.4183 6 E 4.0862 8.4199 120.8238 59.3776 30.9241 178.8158 7 R 4.0512 7.2295 116.0950 58.6124 29.9450 180.9857 8 L 4.4806 7.3231 117.0996 55.6474 39.2458 178.5062 9 H 4.2723 7.9969 118.4614 58.8951 29.1191 176.9955 10 Y 4.4738 8.1779 119.1218 59.5499 37.2350 177.9165 11 Q 3.4343 6.6327 122.0371 59.0790 28.9805 178.6723 12 V 3.2542 7.4643 118.4588 65.6417 31.7889 177.7643 13 G 3.6555 9.1050 105.9988 48.1526 0.0000 175.3367 14 Q 4.0165 8.2328 121.9054 58.6020 29.0580 178.3186 15 R 3.7710 7.2560 118.7671 59.1586 30.0663 178.8056 16 A 3.9598 7.7118 120.6501 55.1062 18.2960 179.0746 17 L 3.8200 7.8385 118.7836 58.3124 42.1044 178.9855 18 I 3.6607 7.8017 119.2959 64.7641 37.1532 178.1729 19 Q 3.9800 8.1152 118.2622 59.1818 28.6052 179.4663 20 A 3.9442 8.1461 121.3338 55.5819 18.2650 179.5077 21 M 4.0990 7.7847 117.0633 57.9740 32.2823 178.9364 22 Q 4.1341 8.2959 118.1052 59.0694 28.6340 178.6311 23 I 3.7248 7.9937 121.2414 64.3930 37.2260 177.9392 24 S 4.4346 8.1234 111.6199 59.0327 63.0527 174.7873 25 A 4.6042 7.5909 122.1618 51.8072 20.2844 177.5952 26 M 4.1125 7.2693 117.6770 54.7647 33.1910 175.5525 27 P 4.3733 0.0000 0.0000 66.3048 31.6220 179.2275 28 E 4.0136 8.1696 116.7048 61.0247 29.6374 180.9483 29 L 4.1865 7.8041 120.6052 57.7680 42.2377 178.7743 30 V 3.5823 8.2133 118.7042 66.0985 31.4094 177.8559 31 E 3.9171 8.8229 118.1437 59.4961 29.3912 179.2612 32 A 4.0034 7.9529 120.7551 55.1886 18.3340 179.8752 33 V 3.6540 8.4123 117.1306 66.1107 31.3306 178.4119 34 Q 4.1211 7.7470 116.8736 58.5790 28.6989 177.7931 35 K 4.3153 7.8386 116.2436 55.2750 32.4908 176.8084 36 R 3.7813 7.4069 115.7534 57.4235 28.7177 177.5771 37 D 4.6428 8.3243 116.0897 52.7585 37.9244 175.2598 38 L 3.9275 7.8110 122.7115 57.5519 42.2121 179.2594 39 A 3.9377 7.8700 120.3802 55.1982 18.2891 179.4228 40 R 3.8495 7.7660 115.3440 59.6033 30.4473 178.3658 41 I 3.8259 7.9979 119.8178 64.3384 36.6354 178.3153 42 K 3.9413 8.3014 120.1905 58.9815 31.8055 177.7402 43 A 4.4373 7.5642 117.7563 52.2636 18.9963 177.3805 44 L 4.6529 7.5327 116.1154 54.3454 42.8215 177.0342 45 I 4.3617 7.3769 118.7292 62.2318 40.2880 176.9777 46 D 4.3091 7.8546 119.5631 57.1233 40.6211 177.3448 47 P 3.6715 0.0000 0.0000 65.7642 31.2111 178.3896 48 M 3.8852 7.7212 119.0986 59.0062 31.4814 179.3444 49 R 3.8632 7.2766 119.5236 61.8329 29.6712 182.1414 50 S 4.4998 7.2876 115.1068 61.5167 62.8811 176.2314 51 F 4.4550 8.1589 120.1603 59.9651 38.9265 175.9520 52 S 4.5546 8.1603 116.4354 58.6539 64.0730 173.7235 *53 D 4.6858 8.4597 117.8329 53.5511 40.0200 177.3018 54 A 2.8912 7.5017 123.8435 51.3333 19.9474 178.0381 55 T 4.1380 7.4383 120.7544 66.6636 68.9938 173.8924 56 Y 4.9475 7.1309 116.6356 55.9023 41.7708 173.5482 57 I 4.9639 8.2716 119.2054 60.1061 41.4925 175.1191 58 T 4.7313 8.4793 120.2025 62.0596 72.9884 172.8320 59 V 4.6525 8.5986 125.7522 61.2410 33.4628 174.8208 60 G 4.3350 9.2984 116.5389 45.2106 0.0000 172.1447 61 D 5.1217 8.3526 120.9623 51.9093 41.8112 178.1527 62 A 4.0480 8.6684 118.7430 56.5686 18.4156 179.1207 63 S 4.3206 7.8645 110.5617 59.5451 63.4265 174.8479 64 G 4.0025 8.0220 108.0283 45.6323 0.0000 174.7498 65 Q 4.0856 8.3268 121.1301 56.1870 29.0974 182.6364 66 R 4.9168 8.1382 116.6692 55.7598 28.8306 177.5875 67 L 4.1112 7.6135 123.3899 58.3769 42.1681 178.4706 *90 N 4.3324 7.7512 115.2882 52.8847 39.5687 174.2327 91 A 3.8928 8.2942 117.6435 52.2568 16.9045 178.1677 92 K 4.7178 7.7917 114.4193 54.9207 35.8039 175.7433 93 S 5.1663 8.4757 118.3841 57.8564 65.0739 172.6754 94 Y 4.8023 8.1253 119.6897 56.6692 41.7271 172.7476 95 V 4.5677 8.5767 118.7074 61.1978 34.0106 174.5153 96 S 4.9433 8.9030 122.3494 56.7500 64.8409 173.0371 97 V 4.7844 8.3910 125.0626 61.4569 33.9828 174.5859 98 R 4.6554 8.8316 130.1608 55.0469 32.3196 175.9136 99 K 4.7865 10.2558 127.7362 52.7497 34.0793 170.8108 100 G 3.3286 9.2566 114.9425 44.9156 0.0000 170.2570 101 S 3.5365 9.0285 132.0368 58.7493 61.2436 169.1366 102 L 3.6603 9.4855 128.0133 54.3592 38.3678 171.7135 103 G 4.0061 8.1718 109.6196 45.1928 0.0000 171.9478 104 S 4.9370 8.0873 113.2580 56.6574 67.4180 173.4244 105 S 5.1777 8.9014 116.2582 56.8349 64.3457 172.7507 106 L 5.0848 8.6883 128.7194 53.3657 43.2240 176.0307 107 R 5.4400 8.2848 121.7073 53.0442 31.9940 175.4544 108 G 3.9410 8.5921 111.8927 46.0062 0.0000 171.6991 109 K 5.1268 8.7817 122.0586 54.4698 35.9001 175.3993 110 S 4.9381 8.7853 118.9093 55.9075 65.9970 171.5970 111 P 4.6447 0.0000 0.0000 62.5741 32.6158 175.5897 112 I 4.4958 8.1123 122.7846 60.3542 38.4830 175.1687 113 Q 5.1061 8.7402 128.0347 54.3704 31.8185 176.1670 114 D 4.7680 8.1988 119.6617 51.9011 42.1501 177.8134 115 A 4.3850 8.5366 117.6869 55.3764 18.2409 178.1673 116 T 4.3897 8.0305 104.5805 60.9085 70.2057 175.3123 117 G 3.9782 7.9609 110.6344 44.9206 0.0000 174.1551 118 K 3.8908 7.4957 119.3628 56.1573 32.4168 176.3193 119 V 3.9120 8.4429 123.6846 63.4693 31.0872 175.0947 120 I 4.2651 8.5861 121.8507 61.6358 39.2654 175.5395 121 G 4.1256 7.4129 108.2828 47.1569 0.0000 171.2177 122 I 4.7022 8.1233 117.6829 60.2869 42.2884 174.5719 123 V 4.7220 8.8360 130.3201 61.5723 33.3731 174.6092 124 S 5.0229 9.0582 121.9862 56.4605 64.1159 171.3415 125 V 4.0769 8.5326 125.6208 61.9614 32.7857 174.6922 126 G 3.5374 8.3736 115.7415 44.5892 0.0000 171.8329 127 Y 5.1402 8.7242 118.6875 56.4514 43.0745 174.2708 128 T 5.2183 8.5185 115.8001 62.1911 72.4797 174.1793 129 I 4.4322 8.7421 125.8656 59.4342 39.7399 175.8223 130 E 4.1690 8.6667 125.4259 56.4839 29.4640 177.1604 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 4 T 8.13 4.33 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 5 E 8.14 3.63 0.00 2.07 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 2.23 1.93 0.00 6 E 8.42 4.09 0.00 1.98 1.94 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 2.32 2.30 0.00 7 R 7.23 4.05 0.00 1.80 1.85 0.00 3.32 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.49 0.00 8 L 7.32 4.48 0.00 1.70 1.37 0.86 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 9 H 8.00 4.27 0.00 3.26 3.35 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 10 Y 8.18 4.47 0.00 3.24 3.21 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 11 Q 6.63 3.43 0.00 1.57 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.87 0.00 0.00 0.00 0.00 0.00 2.20 2.24 0.00 12 V 7.46 3.25 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 0.77 0.00 0.00 0.89 0.00 0.00 13 G 9.10 3.66 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 0.00 0.00 0.00 14 Q 8.23 4.02 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 15 R 7.26 3.77 0.00 1.51 1.61 0.00 3.33 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 1.54 1.70 0.00 16 A 7.71 3.96 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 17 L 7.84 3.82 0.00 1.85 1.80 0.91 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 18 I 7.80 3.66 1.86 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 1.51 0.63 0.91 0.00 0.00 19 Q 8.12 3.98 0.00 2.36 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.55 0.00 20 A 8.15 3.94 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 0.00 0.00 0.00 0.00 0.00 21 M 7.78 4.10 0.00 2.00 2.28 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.45 0.00 22 Q 8.30 4.13 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.63 2.55 0.00 23 I 7.99 3.72 1.87 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 1.37 1.35 0.91 0.00 0.00 24 S 8.12 4.43 0.00 4.10 3.97 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 25 A 7.59 4.60 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 26 M 7.27 4.11 0.00 2.13 2.02 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 2.85 2.59 0.00 27 P 0.00 4.37 0.00 2.16 2.10 0.00 3.61 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 28 E 8.17 4.01 0.00 1.97 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 2.32 1.94 0.00 29 L 7.80 4.19 0.00 1.75 1.81 0.92 0.93 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 30 V 8.21 3.58 2.24 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 0.98 0.00 0.00 0.97 0.00 0.00 31 E 8.82 3.92 0.00 2.21 1.98 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 2.33 2.48 0.00 32 A 7.95 4.00 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 0.00 0.00 0.00 0.00 0.00 33 V 8.41 3.65 2.12 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 1.03 0.00 0.00 1.00 0.00 0.00 34 Q 7.75 4.12 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.87 0.00 0.00 0.00 0.00 0.00 2.40 2.57 0.00 35 K 7.84 4.32 0.00 1.74 1.83 0.00 1.85 0.00 0.00 1.70 0.00 0.00 3.17 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.61 7.81 36 R 7.41 3.78 0.00 1.98 2.00 0.00 3.32 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 37 D 8.32 4.64 0.00 2.65 2.56 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 0.00 0.00 0.00 0.00 38 L 7.81 3.93 0.00 1.76 1.72 0.94 0.69 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 39 A 7.87 3.94 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 40 R 7.77 3.85 0.00 1.94 2.09 0.00 3.32 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 41 I 8.00 3.83 2.00 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 1.40 0.87 0.90 0.00 0.00 42 K 8.30 3.94 0.00 1.95 1.98 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.44 7.81 43 A 7.56 4.44 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 44 L 7.53 4.65 0.00 1.80 1.65 0.95 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 45 I 7.38 4.36 1.83 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 1.56 1.48 0.87 0.00 0.00 46 D 7.85 4.31 0.00 2.67 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 47 P 0.00 3.67 0.00 1.56 1.59 0.00 3.44 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 1.99 2.04 0.00 48 M 7.72 3.89 0.00 2.01 2.17 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.64 0.00 49 R 7.28 3.86 0.00 1.90 1.85 0.00 3.27 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 50 S 7.29 4.50 0.00 3.93 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 51 F 8.16 4.45 0.00 2.99 3.01 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 52 S 8.16 4.55 0.00 4.17 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 *53 D 8.46 4.69 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 54 A 7.50 2.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 7.44 4.14 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 1.30 0.00 0.00 56 Y 7.13 4.95 0.00 3.00 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 57 I 8.27 4.96 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.57 0.89 0.00 0.00 58 T 8.48 4.73 4.36 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 1.25 0.00 0.00 59 V 8.60 4.65 2.24 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 0.78 0.00 0.00 0.93 0.00 0.00 60 G 9.30 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 61 D 8.35 5.12 0.00 2.37 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.67 4.05 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 63 S 7.86 4.32 0.00 3.88 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 G 8.02 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.33 4.09 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 7.04 0.00 0.00 0.00 0.00 0.00 2.37 1.94 0.00 66 R 8.14 4.92 0.00 1.81 1.78 0.00 3.22 0.00 0.00 3.28 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.16 0.00 67 L 7.61 4.11 0.00 1.74 1.81 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 *90 N 7.75 4.33 0.00 2.73 2.88 0.00 0.00 7.00 7.96 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 91 A 8.29 3.89 1.41 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 0.00 0.00 92 K 7.79 4.72 0.00 1.76 1.73 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.61 7.81 93 S 8.48 5.17 0.00 3.77 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 94 Y 8.13 4.80 0.00 3.02 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 95 V 8.58 4.57 2.13 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 0.82 0.00 0.00 0.95 0.00 0.00 96 S 8.90 4.94 0.00 4.08 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 97 V 8.39 4.78 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 0.86 0.00 0.00 0.95 0.00 0.00 98 R 8.83 4.66 0.00 1.84 1.84 0.00 3.20 0.00 0.00 3.27 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 99 K 10.26 4.79 0.00 1.52 1.57 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.27 0.99 7.81 100 G 9.26 3.33 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 0.00 101 S 9.03 3.54 0.00 3.81 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 0.00 102 L 9.49 3.66 0.00 1.80 1.60 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 103 G 8.17 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 0.00 104 S 8.09 4.94 0.00 3.95 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 0.00 105 S 8.90 5.18 0.00 4.00 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 0.00 106 L 8.69 5.08 0.00 1.68 1.58 0.93 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.28 5.44 0.00 1.88 2.06 0.00 3.14 0.00 0.00 3.45 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.41 0.00 108 G 8.59 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 0.00 109 K 8.78 5.13 0.00 0.79 1.35 0.00 1.26 0.00 0.00 1.47 0.00 0.00 2.78 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.21 1.31 7.81 110 S 8.79 4.94 0.00 3.82 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 0.00 111 P 0.00 4.64 0.00 2.00 1.99 0.00 3.73 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 2.06 2.16 0.00 112 I 8.11 4.50 1.97 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 1.23 0.67 0.92 0.00 0.00 113 Q 8.74 5.11 0.00 1.90 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.82 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 114 D 8.20 4.77 0.00 2.60 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 A 8.54 4.39 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 0.00 116 T 8.03 4.39 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 1.21 0.00 0.00 117 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 0.00 118 K 7.50 3.89 0.00 1.92 1.76 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.39 7.81 119 V 8.44 3.91 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 0.87 0.00 0.00 0.95 0.00 0.00 120 I 8.59 4.27 1.88 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 1.37 0.80 1.01 0.00 0.00 121 G 7.41 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 0.00 122 I 8.12 4.70 1.89 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 1.13 1.17 0.98 0.00 0.00 123 V 8.84 4.72 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 0.85 0.00 0.00 0.93 0.00 0.00 124 S 9.06 5.02 0.00 3.89 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 0.00 125 V 8.53 4.08 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 0.95 0.00 0.00 0.91 0.00 0.00 126 G 8.37 3.54 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 0.00 0.00 0.00 127 Y 8.72 5.14 0.00 2.99 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 0.00 128 T 8.52 5.22 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 1.26 0.00 0.00 129 I 8.74 4.43 1.95 0.00 0.00 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 1.31 1.54 0.97 0.00 0.00 130 E 8.67 4.17 0.00 1.98 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 2.33 2.32 0.00 * Residues marked with a * may have inaccurate shift predictions.