NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *4 D 4.5696 8.2185 119.5476 53.3330 41.2907 175.4593 5 A 3.7952 8.6986 126.4406 50.8753 19.9305 175.3948 6 Q 4.5342 8.3173 115.0606 52.3599 31.3288 179.1713 7 W 4.9770 8.2213 117.3794 57.7062 29.7598 176.4013 8 L 4.5219 8.5615 123.6017 55.2337 41.9128 177.3926 9 T 4.3504 9.5348 113.5002 60.8818 70.6086 175.5744 10 A 3.9948 8.7171 123.3526 55.4191 18.1415 179.7853 11 E 3.9396 8.0987 116.5172 59.6770 29.6403 179.2864 12 E 3.9949 8.3061 118.6113 59.4251 29.4723 179.6563 13 R 4.0144 8.3830 120.7789 59.9255 29.8997 179.4530 14 D 4.5344 8.1053 122.0038 58.1976 39.8997 180.4955 15 Q 4.6614 7.5901 117.9307 57.9255 28.8425 181.0992 16 L 4.7758 7.7614 117.4884 56.7858 43.5244 178.8050 17 I 3.7387 7.7435 119.7223 63.6267 36.9236 176.4090 18 P 4.3604 0.0000 0.0000 65.7690 31.1020 178.7002 19 G 3.6287 8.0650 103.7296 47.8766 0.0000 175.5960 20 L 4.2124 7.6855 123.7019 58.0020 41.6220 180.3539 21 K 4.8063 8.8478 125.3566 59.3831 31.4481 181.4485 22 A 4.2735 8.2261 120.9464 54.5180 18.3676 178.8073 23 A 4.3281 7.5742 117.0995 52.2014 19.0798 177.9204 24 G 3.8903 7.7777 104.1509 44.6521 0.0000 174.3853 25 W 4.6852 8.7437 120.9516 56.2551 30.6874 175.5677 26 S 5.1088 9.1269 116.5711 56.6308 66.4049 172.5939 27 E 4.9232 8.7529 120.9261 55.3076 30.1162 176.4541 28 L 4.1195 8.6183 125.4753 55.0248 41.8750 178.0233 29 S 4.2153 8.8154 118.9177 61.4742 62.9860 175.2514 30 E 4.4223 7.9893 116.2720 56.6136 29.9170 175.9022 31 R 4.6326 7.3640 116.3924 54.6535 34.1972 174.9887 32 D 4.4805 8.3049 120.4579 52.8850 39.8587 174.9136 33 A 4.9343 7.7236 124.5674 50.3038 23.2822 174.5279 34 I 5.1844 8.5950 112.6689 59.5264 40.8614 174.1180 35 Y 5.6702 9.4758 124.6163 56.3301 42.6120 173.7373 36 K 3.9135 7.9209 125.1778 54.7544 36.0574 173.6431 37 E 4.7870 7.8060 127.2667 54.4644 31.3840 174.6555 38 F 4.4642 9.4043 125.5686 55.6444 41.8872 174.6799 39 S 5.0130 8.0580 117.9933 56.8245 65.5518 173.3353 40 F 4.7344 8.9221 125.4036 55.8036 41.5911 176.4739 41 K 4.1747 9.3759 121.3017 57.8120 31.8327 173.1307 42 N 4.4139 7.4121 113.7592 50.9791 39.7544 174.5279 43 F 4.1266 7.5218 120.0241 60.7026 39.2773 176.5133 44 N 4.0393 8.1439 116.4052 56.8957 38.7111 176.4632 45 Q 3.7942 8.5687 120.7819 58.8459 29.0859 177.8878 46 A 2.6243 7.4317 121.7085 54.8184 18.3493 179.4673 47 F 3.6502 8.0469 119.4517 60.7043 39.1784 177.6940 48 G 3.4494 7.7345 105.7355 47.4927 0.0000 175.4825 49 F 4.0628 7.7345 122.9919 61.3672 39.3502 177.1262 50 M 3.7744 7.6278 118.2492 58.3817 31.5600 178.9889 51 S 3.9173 7.7227 115.5904 61.4315 62.9077 176.9726 52 R 3.9488 7.6262 120.6535 59.2218 29.7325 179.2833 53 V 3.7099 7.7393 117.9052 65.8137 31.5495 177.9334 54 A 3.9750 8.4826 121.0713 55.0690 18.2467 179.5830 55 L 3.8500 7.9446 117.4682 58.0383 41.6338 179.6059 56 Q 3.5507 7.7638 119.1923 58.7790 28.7628 177.9721 57 A 4.0169 7.9098 123.4996 54.6677 18.4279 179.4797 58 E 3.9490 8.0275 116.7570 58.9572 29.3018 179.3926 59 K 3.9887 7.7751 119.5493 58.9817 32.3976 177.8337 60 M 4.2260 7.9057 113.9932 53.8492 32.2537 174.9867 61 N 4.1021 7.5410 115.9629 54.6278 38.1252 173.5647 62 H 4.7878 8.0375 115.6587 54.7354 33.3306 171.3196 63 H 4.7476 8.4244 123.2179 53.2163 31.5009 171.7135 64 P 4.6124 0.0000 0.0000 62.0746 33.3115 174.5147 65 E 4.9080 8.7545 120.1317 54.5213 31.3695 175.4330 66 W 6.0418 9.1106 120.3133 55.2571 31.5785 173.6266 67 F 5.1815 9.7185 124.0925 56.5741 41.9455 173.2963 68 N 5.7402 7.8999 122.8782 50.6942 42.2715 173.9485 69 V 4.0880 7.8680 124.1733 61.8084 34.7652 176.4373 70 Y 3.6795 8.9075 132.0014 58.9885 38.6491 171.1049 71 N 4.8583 9.5446 115.8037 52.6953 38.6600 174.1969 72 K 5.1108 8.2861 119.8009 54.9573 35.1004 175.4245 73 V 4.6910 9.1129 124.1795 61.4887 34.6059 173.9787 74 Q 5.1368 9.6032 128.5427 54.6350 30.7991 174.8727 75 I 5.3280 8.9054 125.2437 59.8781 40.7620 174.6608 76 T 5.5284 9.4959 123.4965 61.8649 71.7915 172.8392 77 L 5.1417 9.0437 126.7225 53.3544 44.3310 175.5404 78 T 4.7149 8.3558 116.1425 61.6134 70.7793 172.7722 79 S 4.8270 8.8440 122.5719 56.9471 63.4231 175.1092 80 H 4.3195 8.9379 122.3345 58.0760 28.5802 177.2698 81 D 4.2467 7.8113 118.6584 55.1784 39.3725 176.2294 82 C 4.6637 7.3870 111.5306 56.5358 30.9829 174.0327 83 G 3.9707 9.4579 108.6051 46.3589 0.0000 173.1294 84 G 3.7462 7.7717 105.4935 45.0310 0.0000 172.4863 85 L 4.9151 8.8351 123.0296 54.9018 43.4977 176.1708 86 T 5.0687 9.2391 115.6825 59.1033 72.3916 174.9610 87 K 3.9857 8.1932 118.7527 59.5132 31.7442 179.8938 88 R 3.7916 7.5614 117.3526 59.2765 29.8368 178.7753 89 D 4.3260 7.8355 118.2910 57.1978 40.7488 178.9996 90 V 3.4663 7.7416 120.7926 66.3773 31.6152 178.6839 91 K 4.0924 8.1576 123.6321 59.8077 31.4736 180.6516 92 L 4.1711 8.0572 121.7761 57.7855 41.9971 178.9021 93 A 3.7756 8.0229 120.8721 55.2269 18.0720 179.6526 94 Q 3.9900 8.2004 116.6453 58.9286 28.6445 178.8701 95 F 4.0763 8.3225 121.7648 61.3390 39.4023 177.1003 96 I 3.6559 8.2273 119.7589 64.6795 36.8303 178.2094 97 E 4.2290 8.5218 119.2130 59.3160 29.2693 179.6311 98 K 3.8962 7.7224 118.2102 59.3981 32.1595 179.2021 99 A 3.8747 7.7154 121.0121 55.1827 18.0407 179.5940 100 A 4.0801 8.4244 118.0848 54.3794 18.5067 178.6349 101 A 4.4016 7.4896 116.7324 51.2355 19.5180 176.9286 102 S 3.7661 8.0971 114.9380 60.6203 60.7885 172.1682 103 L 4.3740 8.3116 125.8502 54.4006 41.3822 178.5744 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 D 8.22 4.57 0.00 2.62 2.64 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 5 A 8.70 3.80 1.26 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 6 Q 8.32 4.53 0.00 2.07 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.90 0.00 0.00 0.00 0.00 0.00 2.20 1.92 0.00 7 W 8.22 4.98 0.00 3.29 2.99 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 8 L 8.56 4.52 0.00 1.57 1.62 0.90 0.68 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 9 T 9.53 4.35 4.39 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 1.30 0.00 0.00 10 A 8.72 3.99 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.10 3.94 0.00 2.07 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 2.40 2.47 0.00 12 E 8.31 3.99 0.00 2.23 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 2.33 2.36 0.00 13 R 8.38 4.01 0.00 2.01 1.97 0.00 3.12 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 14 D 8.11 4.53 0.00 2.82 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 7.59 4.66 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.72 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 16 L 7.76 4.78 0.00 1.70 1.65 0.90 0.80 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 17 I 7.74 3.74 2.00 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 1.50 0.74 0.93 0.00 0.00 18 P 0.00 4.36 0.00 2.16 2.12 0.00 3.54 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.18 0.00 19 G 8.07 3.63 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 0.00 0.00 0.00 20 L 7.69 4.21 0.00 1.69 1.61 0.65 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 21 K 8.85 4.81 0.00 1.73 1.82 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.19 7.81 22 A 8.23 4.27 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 23 A 7.57 4.33 1.63 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 0.00 0.00 24 G 7.78 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 25 W 8.74 4.69 0.00 3.42 3.20 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 0.00 26 S 9.13 5.11 0.00 3.94 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 27 E 8.75 4.92 0.00 1.91 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 2.31 2.38 0.00 28 L 8.62 4.12 0.00 1.71 1.60 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.82 4.22 0.00 3.84 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 30 E 7.99 4.42 0.00 1.93 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 2.23 2.24 0.00 31 R 7.36 4.63 0.00 1.74 1.76 0.00 3.20 0.00 0.00 3.16 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 32 D 8.30 4.48 0.00 2.34 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 0.00 0.00 0.00 0.00 33 A 7.72 4.93 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 34 I 8.60 5.18 2.13 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.33 0.95 0.00 0.00 35 Y 9.48 5.67 0.00 3.13 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 36 K 7.92 3.91 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.39 7.81 37 E 7.81 4.79 0.00 1.86 1.58 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 2.12 2.35 0.00 38 F 9.40 4.46 0.00 2.91 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 0.00 0.00 0.00 0.00 39 S 8.06 5.01 0.00 3.52 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 40 F 8.92 4.73 0.00 2.78 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 41 K 9.38 4.17 0.00 1.77 1.73 0.00 1.85 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.25 7.81 42 N 7.41 4.41 0.00 2.81 3.00 0.00 0.00 5.92 8.12 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 43 F 7.52 4.13 0.00 2.67 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 44 N 8.14 4.04 0.00 2.87 2.95 0.00 0.00 6.85 6.76 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 45 Q 8.57 3.79 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 46 A 7.43 2.62 1.21 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 0.00 0.00 47 F 8.05 3.65 0.00 1.93 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 48 G 7.73 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 0.00 0.00 0.00 49 F 7.73 4.06 0.00 2.68 2.67 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 50 M 7.63 3.77 0.00 1.19 1.29 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 1.87 0.00 51 S 7.72 3.92 0.00 3.79 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 52 R 7.63 3.95 0.00 1.94 2.15 0.00 3.14 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 53 V 7.74 3.71 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 0.72 0.00 0.00 0.45 0.00 0.00 54 A 8.48 3.98 1.45 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 0.00 0.00 55 L 7.94 3.85 0.00 1.82 1.64 0.90 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 56 Q 7.76 3.55 0.00 0.93 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.90 0.00 57 A 7.91 4.02 1.19 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 58 E 8.03 3.95 0.00 2.10 1.97 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 2.33 2.46 0.00 59 K 7.78 3.99 0.00 1.70 1.82 0.00 1.67 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.36 7.81 60 M 7.91 4.23 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.59 0.00 61 N 7.54 4.10 0.00 2.87 2.86 0.00 0.00 6.80 7.77 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 62 H 8.04 4.79 0.00 3.12 2.98 0.00 5.77 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.42 4.75 0.00 3.02 3.05 0.00 5.94 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 64 P 0.00 4.61 0.00 1.61 1.69 0.00 3.33 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.65 0.00 65 E 8.75 4.91 0.00 2.24 2.05 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 2.31 2.29 0.00 66 W 9.11 6.04 0.00 3.47 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 67 F 9.72 5.18 0.00 3.23 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 68 N 7.90 5.74 0.00 2.56 2.43 0.00 0.00 7.02 7.71 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 69 V 7.87 4.09 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 0.99 0.00 0.00 0.73 0.00 0.00 70 Y 8.91 3.68 0.00 3.15 2.44 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 0.00 0.00 0.00 0.00 71 N 9.54 4.86 0.00 3.13 2.81 0.00 0.00 5.80 7.62 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 72 K 8.29 5.11 0.00 1.80 1.85 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.60 7.81 73 V 9.11 4.69 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 1.18 0.00 0.00 1.10 0.00 0.00 74 Q 9.60 5.14 0.00 2.44 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.53 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 75 I 8.91 5.33 2.24 0.00 0.00 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 1.80 1.50 1.26 0.00 0.00 76 T 9.50 5.53 4.45 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 1.41 0.00 0.00 77 L 9.04 5.14 0.00 1.54 1.55 0.71 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.36 4.71 4.30 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 1.27 0.00 0.00 79 S 8.84 4.83 0.00 4.04 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 80 H 8.94 4.32 0.00 3.40 3.62 0.00 5.65 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 D 7.81 4.25 0.00 2.74 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 82 C 7.39 4.66 0.00 2.58 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 83 G 9.46 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 84 G 7.77 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 85 L 8.84 4.92 0.00 1.79 1.50 0.96 0.65 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 86 T 9.24 5.07 4.45 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 1.38 0.00 0.00 87 K 8.19 3.99 0.00 1.86 1.87 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.45 1.48 7.81 88 R 7.56 3.79 0.00 1.57 1.43 0.00 2.95 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.69 0.00 89 D 7.84 4.33 0.00 2.83 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 90 V 7.74 3.47 2.16 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 0.95 0.00 0.00 0.91 0.00 0.00 91 K 8.16 4.09 0.00 1.79 1.80 0.00 1.87 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.32 7.81 92 L 8.06 4.17 0.00 1.82 1.79 0.85 0.90 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 93 A 8.02 3.78 0.64 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 0.00 0.00 94 Q 8.20 3.99 0.00 2.27 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.62 0.00 95 F 8.32 4.08 0.00 3.18 3.23 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 96 I 8.23 3.66 2.37 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.86 1.14 0.00 0.00 97 E 8.52 4.23 0.00 2.28 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 0.00 2.93 2.75 0.00 98 K 7.72 3.90 0.00 1.60 1.86 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.60 7.81 99 A 7.72 3.87 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 0.00 100 A 8.42 4.08 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 101 A 7.49 4.40 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 0.00 102 S 8.10 3.77 0.00 4.09 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 0.00 103 L 8.31 4.37 0.00 1.58 1.38 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.