NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3730 8.2649 123.5956 52.0853 19.9462 175.6620 2 N 4.7007 8.5980 116.6217 50.9970 40.5473 172.9596 3 A 4.7241 8.4656 125.6477 49.3506 22.8041 175.0117 4 F 3.9163 8.8135 120.4035 59.7553 39.4156 171.1442 5 L 3.1144 7.8448 134.3483 54.1073 41.5479 174.5905 *8 L 4.2697 8.4008 121.6520 54.3942 43.6482 177.5187 9 R 4.2409 7.6699 116.7765 54.6001 30.9349 174.6385 10 P 4.3782 0.0000 0.0000 61.8825 32.0570 176.7076 11 G 3.6217 8.3366 109.6114 46.1834 0.0000 173.3405 12 S 4.2602 8.1230 116.4245 56.2200 64.7731 174.3868 13 L 3.7086 8.2923 127.8371 55.9525 41.1618 177.8373 *15 R 4.1301 7.9371 114.5157 55.9252 31.3393 176.3924 *17 C 4.9405 8.0459 113.6574 57.3193 42.0543 173.7975 18 K 4.3937 7.7434 117.9619 56.7065 32.0938 176.8078 *21 Q 4.3437 8.0272 117.1583 55.9578 29.8415 173.8072 22 C 5.0796 9.3235 118.2040 53.4444 43.7759 174.3422 23 S 4.7924 8.4681 116.9787 57.5542 64.7711 175.0007 24 F 2.9825 7.6671 120.5003 57.6916 36.6147 175.0971 *27 A 4.0935 8.0183 127.4077 51.6933 20.7715 180.9744 28 R 4.4959 7.4972 117.1792 55.5295 29.1989 178.7787 *30 I 3.7950 7.8948 117.2804 61.0667 38.8248 177.5429 31 F 4.2280 7.9515 116.3853 57.7416 39.3316 177.1446 32 K 4.1888 8.6428 125.1849 57.8090 31.2980 176.4903 33 D 4.5176 7.6516 116.9691 53.7349 43.1068 176.6160 34 A 4.0204 8.4796 128.1121 55.4590 18.6129 179.8572 35 E 3.9735 8.2239 117.1573 59.1060 29.7173 179.0052 36 R 3.9428 8.7563 118.8935 59.2855 30.1198 178.9336 37 T 3.7017 7.9739 115.5612 66.3496 68.2763 177.0414 38 K 4.2940 8.3547 120.6048 59.3805 31.9085 179.0137 39 L 3.9498 7.5184 119.2132 58.1984 42.2346 178.6605 40 F 4.1978 8.0692 120.4334 61.0785 39.3710 177.0916 41 W 4.1219 8.9713 128.3633 60.3106 30.2700 177.6362 42 I 3.6792 8.0479 118.4855 63.8905 37.6537 177.6429 43 S 4.2180 7.6631 115.1447 61.1705 62.9632 175.4857 44 Y 3.7396 7.0360 121.4292 60.1275 38.3084 177.1189 45 S 3.9413 7.0449 111.0069 57.8313 63.8540 174.4086 46 D 4.2065 7.5021 121.6747 57.2065 40.9452 177.5095 47 G 3.7630 7.9935 102.1583 45.3458 0.0000 172.4828 48 D 4.9163 8.1474 119.0651 52.2717 40.7161 177.0631 49 Q 4.1117 8.8371 126.9693 58.4277 29.0161 177.7187 50 C 4.2291 9.9940 115.6764 58.2247 40.8265 175.4203 51 A 3.9573 8.1902 123.7162 55.3963 17.7218 179.0346 52 S 4.1178 7.9543 105.9998 58.8276 63.5535 173.8949 53 S 3.6341 8.3887 117.7814 59.3954 60.1470 170.9197 54 P 4.2281 0.0000 0.0000 65.1785 32.0931 178.3305 55 C 4.4766 7.8719 117.0524 56.8069 41.5267 173.3703 56 Q 4.2651 8.9549 124.5474 54.6384 30.2601 174.7446 57 N 3.9425 9.3405 113.1277 54.4998 35.8344 175.2402 58 G 3.7374 8.2049 101.0240 46.2096 0.0000 174.4565 59 G 3.9687 7.6861 106.8182 45.7085 0.0000 173.7577 60 S 4.9031 9.4106 116.0038 56.6683 65.6778 173.0293 61 C 5.1988 8.8470 124.8360 55.5149 41.6815 172.5123 62 K 4.6936 8.6924 125.4053 54.5330 34.7491 174.9222 63 D 4.8556 8.9117 127.3512 54.6882 42.1991 175.2850 64 Q 4.4908 8.5511 122.1797 54.3869 32.5062 174.6627 65 L 4.3548 8.4729 119.5963 55.5250 40.9366 176.9645 66 Q 3.4445 8.4991 125.9521 56.1698 26.7635 173.5818 67 S 4.5794 7.3962 110.5038 58.5797 64.7656 174.3779 68 Y 5.4575 7.4988 117.9465 55.9831 41.5438 174.2644 69 I 4.5679 8.8017 119.1042 60.0511 41.3325 173.9712 70 C 5.2276 8.9919 124.9501 55.9055 36.7038 173.0229 71 F 4.6092 9.5857 123.6999 56.4869 40.2258 175.0371 72 C 5.1349 8.8097 120.8757 55.2343 43.7781 173.3070 73 L 4.6170 8.6525 119.4080 53.9449 42.5227 177.1036 74 P 4.0492 0.0000 0.0000 64.5754 31.6373 177.4158 75 A 4.2092 7.9861 117.1442 52.2146 18.8377 176.0419 76 F 5.8145 8.2266 115.1878 56.2541 43.4420 174.0509 77 E 4.5895 8.6514 118.5982 55.4149 34.3720 175.3506 78 G 4.2590 9.0366 104.8566 45.6835 0.0000 174.3894 79 R 3.8848 8.4914 119.9144 58.7746 30.1994 177.1805 80 N 4.9735 8.3367 112.9588 52.7884 39.1073 174.3799 81 C 4.3244 8.2413 113.2354 57.9488 38.2545 174.1875 82 E 4.0449 8.2326 117.1229 57.9507 29.8930 176.5177 83 T 4.4037 8.1144 118.5614 62.6699 69.6363 173.4860 84 H 4.6185 8.8112 124.1314 54.5506 29.1435 176.4457 85 K 3.9675 8.2824 125.6729 59.4557 31.9748 178.0680 86 D 4.6700 7.8534 115.4675 54.9565 40.6805 175.9769 87 D 5.0157 7.7620 119.0600 54.5690 41.5490 176.4373 88 Q 4.5756 8.0179 114.6895 55.7097 30.1044 177.2481 89 L 4.3472 7.7951 120.3649 54.8217 40.3751 175.5581 90 I 4.7268 7.0050 114.6388 58.6823 41.1663 178.1007 91 C 4.4110 9.9350 120.1209 60.0923 40.1356 176.9369 92 V 3.3293 7.7273 117.7514 63.5975 31.4773 175.6217 93 N 4.5316 7.9972 119.7492 52.7335 37.6711 174.2152 94 E 4.0761 8.9811 128.1625 57.5854 27.3838 174.5121 95 N 4.5420 8.3186 110.7285 53.6834 37.5980 174.3452 96 G 3.9486 8.8558 100.4981 45.7287 0.0000 175.2786 97 G 3.8910 8.3426 105.5774 45.7465 0.0000 173.6562 98 C 4.6115 8.3109 117.0417 55.8252 41.1504 173.8137 99 E 3.9607 8.8208 124.5208 58.4536 29.7314 176.7404 100 Q 4.3772 7.6960 112.6147 55.6976 31.0337 175.6451 101 Y 4.9886 6.6432 118.5063 57.5803 41.1347 174.5922 102 C 5.3885 8.6895 121.3293 55.0668 48.1075 173.0389 103 S 4.7785 9.2505 122.3400 56.6902 65.1538 173.8418 104 D 4.8993 8.6454 124.5630 54.5536 42.1768 175.9315 105 H 4.7295 8.3769 116.7676 54.3472 32.3969 173.3159 106 T 4.0165 8.5600 115.7448 63.5497 68.9473 172.9692 107 G 4.3285 9.2025 121.2719 45.9230 0.0000 173.3786 108 T 4.3035 6.6517 111.1456 60.2723 69.3764 173.7512 109 K 4.4965 8.2110 119.8752 55.3875 34.4039 176.0770 110 R 4.4966 8.2797 116.3773 56.3036 30.4664 175.8232 111 S 4.9648 8.9147 115.2459 56.9568 66.1409 172.0760 112 C 5.5106 8.7337 118.0181 55.5548 44.1076 173.0312 113 R 4.8241 9.1378 120.3886 54.7380 34.4020 173.2636 114 C 5.0698 8.3828 115.4788 55.3592 39.8236 174.1505 115 H 4.4252 9.2686 121.0338 55.1622 30.2644 174.4535 116 E 4.1078 8.3111 123.9802 58.1258 29.8251 177.3946 117 G 3.9289 9.5336 112.8473 45.1986 0.0000 171.9013 118 Y 5.2574 7.6258 115.4088 56.2971 42.3047 174.6627 119 S 4.7078 9.1873 114.6174 56.4631 66.4376 172.6565 120 L 4.6352 8.5218 128.4443 54.9248 42.7429 176.6187 121 L 4.4634 9.3223 127.0722 54.0507 42.9341 177.8848 122 A 4.1307 8.6236 122.3791 54.4902 18.3783 178.1433 123 D 4.4422 8.1143 114.6872 53.3782 39.8934 178.1676 124 G 4.1096 8.1455 107.9152 46.0836 0.0000 174.5284 125 V 4.3518 7.7249 110.4714 61.7165 35.0218 176.1643 126 S 5.0439 8.9689 116.2832 57.7621 64.7250 172.8887 127 C 5.5811 8.8043 119.1622 55.5226 41.9405 173.5630 128 T 4.9176 8.9712 116.6053 59.4341 70.6278 171.3440 129 P 4.4624 0.0000 0.0000 63.0863 31.6232 176.2103 130 T 4.4356 9.0195 113.2203 61.5239 70.1929 174.0360 131 V 4.3422 7.2902 114.5161 59.2712 34.6669 174.9599 132 E 3.8889 8.4702 120.7006 58.4280 29.9139 176.1192 133 Y 4.8371 7.3042 114.8863 55.2520 38.4362 173.1640 134 P 4.3436 0.0000 0.0000 61.9556 32.6883 176.9831 135 C 4.3948 8.4023 115.0274 59.6478 30.0104 174.4083 136 G 3.9985 8.8533 108.5906 45.5675 0.0000 173.4819 137 K 4.5610 7.4377 117.9219 54.6693 34.2944 176.6429 138 I 4.2574 7.9845 123.8358 59.1555 36.8660 174.7977 139 P 4.2496 0.0000 0.0000 65.5430 31.3676 178.9599 140 I 3.9300 7.7668 108.8182 62.7548 37.6902 176.4181 141 L 4.4103 8.0752 120.3522 55.5198 42.4537 176.3659 142 E 4.1696 7.8134 122.2653 56.5447 29.3604 176.4259 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 A 8.26 4.37 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 2 N 8.60 4.70 0.00 2.79 2.73 0.00 0.00 6.71 6.46 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 3 A 8.47 4.72 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 4 F 8.81 3.92 0.00 2.94 3.07 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 5 L 7.84 3.11 0.00 1.35 1.32 0.68 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 *8 L 8.40 4.27 0.00 1.67 1.71 0.79 0.86 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 9 R 7.67 4.24 0.00 1.75 1.81 0.00 3.18 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 10 P 0.00 4.38 0.00 1.98 1.93 0.00 3.65 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 1.98 2.04 0.00 11 G 8.34 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.12 4.26 0.00 3.70 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.29 3.71 0.00 1.36 1.43 0.53 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 *15 R 7.94 4.13 0.00 1.82 1.93 0.00 3.31 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 *17 C 8.05 4.94 0.00 3.15 3.06 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 0.00 0.00 0.00 0.00 18 K 7.74 4.39 0.00 1.83 1.88 0.00 1.83 0.00 0.00 1.83 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.60 7.81 *21 Q 8.03 4.34 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 22 C 9.32 5.08 0.00 3.15 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 23 S 8.47 4.79 0.00 4.12 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 24 F 7.67 2.98 0.00 2.23 2.61 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 *27 A 8.02 4.09 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 28 R 7.50 4.50 0.00 1.33 1.68 0.00 3.18 0.00 0.00 3.27 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.46 0.00 *30 I 7.89 3.79 1.59 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.42 -0.28 0.00 0.00 31 F 7.95 4.23 0.00 2.90 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 32 K 8.64 4.19 0.00 1.86 1.94 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.47 7.81 33 D 7.65 4.52 0.00 2.73 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 34 A 8.48 4.02 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 35 E 8.22 3.97 0.00 2.11 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 2.39 2.47 0.00 36 R 8.76 3.94 0.00 2.00 1.87 0.00 3.24 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.98 0.00 37 T 7.97 3.70 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 0.64 0.00 0.00 38 K 8.35 4.29 0.00 1.90 1.97 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.66 1.79 7.81 39 L 7.52 3.95 0.00 1.69 1.80 0.93 1.22 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 40 F 8.07 4.20 0.00 2.58 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 W 8.97 4.12 0.00 3.85 3.37 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 42 I 8.05 3.68 2.04 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.94 0.94 0.00 0.00 43 S 7.66 4.22 0.00 3.75 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 44 Y 7.04 3.74 0.00 1.62 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 0.00 0.00 0.00 0.00 45 S 7.04 3.94 0.00 3.53 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 46 D 7.50 4.21 0.00 2.73 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 47 G 7.99 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 48 D 8.15 4.92 0.00 2.65 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 8.84 4.11 0.00 2.43 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.76 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 50 C 9.99 4.23 0.00 3.34 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 51 A 8.19 3.96 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 52 S 7.95 4.12 0.00 3.93 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 53 S 8.39 3.63 0.00 3.89 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 54 P 0.00 4.23 0.00 1.73 1.81 0.00 3.52 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.62 0.00 55 C 7.87 4.48 0.00 2.95 3.07 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 56 Q 8.95 4.27 0.00 2.08 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.18 0.00 0.00 0.00 0.00 0.00 2.26 2.45 0.00 57 N 9.34 3.94 0.00 1.55 1.42 0.00 0.00 6.90 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 G 8.20 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 0.00 0.00 0.00 59 G 7.69 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 0.00 0.00 0.00 60 S 9.41 4.90 0.00 3.74 3.72 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 61 C 8.85 5.20 0.00 2.93 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 62 K 8.69 4.69 0.00 2.00 1.90 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.53 7.81 63 D 8.91 4.86 0.00 2.85 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 64 Q 8.55 4.49 0.00 2.09 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 65 L 8.47 4.35 0.00 1.62 1.63 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 8.50 3.44 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.90 0.00 0.00 0.00 0.00 0.00 2.28 2.45 0.00 67 S 7.40 4.58 0.00 3.82 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 68 Y 7.50 5.46 0.00 2.92 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 69 I 8.80 4.57 1.96 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 1.14 1.18 0.61 0.00 0.00 70 C 8.99 5.23 0.00 3.08 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 71 F 9.59 4.61 0.00 3.02 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 72 C 8.81 5.13 0.00 2.94 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 73 L 8.65 4.62 0.00 2.01 1.74 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.05 0.00 2.06 2.09 0.00 3.75 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.18 0.00 75 A 7.99 4.21 0.82 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 76 F 8.23 5.81 0.00 3.02 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 77 E 8.65 4.59 0.00 1.89 1.84 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 2.30 2.31 0.00 78 G 9.04 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 0.00 0.00 0.00 0.00 79 R 8.49 3.88 0.00 1.77 2.02 0.00 3.20 0.00 0.00 3.12 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 80 N 8.34 4.97 0.00 2.97 2.94 0.00 0.00 6.99 7.07 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 81 C 8.24 4.32 0.00 3.18 3.13 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 82 E 8.23 4.04 0.00 2.17 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 0.00 2.32 2.31 0.00 83 T 8.11 4.40 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 1.25 0.00 0.00 84 H 8.81 4.62 0.00 3.28 3.23 0.00 5.82 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.28 3.97 0.00 1.66 1.78 0.00 1.71 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.57 1.32 7.81 86 D 7.85 4.67 0.00 2.62 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 87 D 7.76 5.02 0.00 2.75 2.61 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 88 Q 8.02 4.58 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.63 0.00 0.00 0.00 0.00 0.00 2.44 2.22 0.00 89 L 7.80 4.35 0.00 1.58 1.61 0.98 1.00 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 90 I 7.00 4.73 1.86 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 1.55 0.58 0.91 0.00 0.00 91 C 9.93 4.41 0.00 3.22 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 92 V 7.73 3.33 2.07 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 0.68 0.00 0.00 0.92 0.00 0.00 93 N 8.00 4.53 0.00 2.84 3.00 0.00 0.00 7.04 7.18 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 94 E 8.98 4.08 0.00 2.18 1.99 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 2.29 2.21 0.00 95 N 8.32 4.54 0.00 2.94 2.82 0.00 0.00 7.59 8.28 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 96 G 8.86 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 97 G 8.34 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 98 C 8.31 4.61 0.00 3.02 3.07 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 99 E 8.82 3.96 0.00 1.94 1.93 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 2.22 2.23 0.00 100 Q 7.70 4.38 0.00 1.77 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.62 0.00 0.00 0.00 0.00 0.00 1.95 2.07 0.00 101 Y 6.64 4.99 0.00 2.89 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 0.00 102 C 8.69 5.39 0.00 3.04 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 0.00 103 S 9.25 4.78 0.00 3.68 3.60 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 0.00 104 D 8.65 4.90 0.00 2.49 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 0.00 105 H 8.38 4.73 0.00 3.29 3.12 0.00 5.62 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 T 8.56 4.02 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 1.21 0.00 0.00 107 G 9.20 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 0.00 108 T 6.65 4.30 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 1.22 0.00 0.00 109 K 8.21 4.50 0.00 1.91 1.80 0.00 1.63 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.43 7.81 110 R 8.28 4.50 0.00 1.94 1.98 0.00 3.05 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 111 S 8.91 4.96 0.00 3.96 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 0.00 112 C 8.73 5.51 0.00 3.00 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 0.00 113 R 9.14 4.82 0.00 1.85 1.90 0.00 3.15 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 114 C 8.38 5.07 0.00 2.76 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 0.00 115 H 9.27 4.43 0.00 2.76 3.00 0.00 5.60 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.31 4.11 0.00 1.96 1.89 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 2.34 2.35 0.00 117 G 9.53 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 0.00 0.00 0.00 118 Y 7.63 5.26 0.00 2.95 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 0.00 119 S 9.19 4.71 0.00 3.83 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 0.00 120 L 8.52 4.64 0.00 1.68 1.57 0.95 1.04 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 0.00 121 L 9.32 4.46 0.00 1.78 1.60 0.93 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.62 4.13 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 0.00 123 D 8.11 4.44 0.00 2.87 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 0.00 124 G 8.15 4.11 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 0.00 0.00 0.00 125 V 7.72 4.35 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 0.76 0.00 0.00 1.08 0.00 0.00 126 S 8.97 5.04 0.00 3.86 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 0.00 127 C 8.80 5.58 0.00 2.68 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 0.00 128 T 8.97 4.92 4.27 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 1.27 0.00 0.00 129 P 0.00 4.46 0.00 1.81 1.60 0.00 3.67 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 1.98 2.06 0.00 130 T 9.02 4.44 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 1.23 0.00 0.00 131 V 7.29 4.34 2.03 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 0.68 0.00 0.00 0.84 0.00 0.00 132 E 8.47 3.89 0.00 1.71 1.74 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 1.47 1.74 0.00 133 Y 7.30 4.84 0.00 2.98 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 0.00 134 P 0.00 4.34 0.00 1.56 1.63 0.00 3.71 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 2.00 1.72 0.00 135 C 8.40 4.39 0.00 3.14 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 0.00 136 G 8.85 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 0.00 137 K 7.44 4.56 0.00 1.92 1.77 0.00 1.77 0.00 0.00 1.80 0.00 0.00 3.07 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.54 1.60 7.81 138 I 7.98 4.26 1.89 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 1.43 0.62 0.93 0.00 0.00 139 P 0.00 4.25 0.00 2.27 2.34 0.00 3.64 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.36 0.00 140 I 7.77 3.93 1.89 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 1.43 0.54 0.93 0.00 0.00 141 L 8.08 4.41 0.00 1.73 1.77 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 142 E 7.81 4.17 0.00 2.14 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 2.53 2.42 0.00 * Residues marked with a * may have inaccurate shift predictions.