NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4P F 4.8979 8.1785 119.3442 56.9070 41.9055 173.9221 5P A 4.1742 8.1328 123.2341 50.8383 18.8853 175.5856 6P R 4.3201 8.8777 125.5758 55.1607 31.9486 174.7873 *7P N 4.5524 8.6673 121.6393 52.9251 39.4306 170.7641 *8P E 4.4453 8.2431 117.0728 56.4666 32.6664 178.6602 9P K 4.0492 7.9081 125.8125 60.1055 31.7366 181.8535 10P E 4.1232 8.0247 118.4760 60.9797 29.7789 181.0269 11P A 4.1892 7.8567 121.7621 54.8261 18.3908 179.2799 12P K 2.9094 7.9228 117.9804 59.6861 32.1763 178.6457 13P D 4.2831 7.7692 118.4093 57.3877 40.6591 178.8212 14P S 4.0923 8.3459 115.8539 61.6039 62.7899 176.7444 15P A 4.0290 8.0174 123.1894 55.3249 18.1844 179.7020 16P I 3.6194 7.7260 118.3055 64.7977 37.1439 178.8560 17P T 3.9840 8.5652 116.8483 66.6079 68.0859 176.4138 18P F 4.1072 8.1617 121.3173 61.3773 39.4518 176.8130 19P I 3.6094 7.7578 118.3734 64.4156 36.9612 178.2241 20P Q 4.1318 7.7136 119.6405 59.2936 28.7646 178.6283 21P K 4.1495 8.0992 123.9258 57.3340 32.1834 179.0544 *35P I 4.0991 7.0833 118.3832 61.1410 37.0147 180.3162 36P K 4.6933 8.3830 125.0311 53.6126 34.2325 175.4518 37P L 5.1581 8.5762 125.4648 52.3142 44.1489 176.0516 38P D 4.9537 8.9095 121.9475 52.1113 43.7938 175.3376 39P K 4.2624 8.9059 125.8587 56.4398 33.0127 176.1298 40P V 4.0732 8.5248 130.6490 62.4359 32.5363 175.9617 41P N 4.5075 8.8672 125.2782 52.1735 37.1638 171.2217 42P L 4.6823 8.5045 124.9487 51.9835 43.6788 176.4241 43P G 4.3306 8.1934 112.2677 44.2217 0.0000 173.2360 44P G 3.6854 8.5267 110.1716 46.8957 0.0000 177.3752 45P E 3.9591 8.9891 118.8190 57.9876 29.6322 175.7116 46P L 4.6217 7.5361 115.1109 54.9725 42.0648 176.6274 47P S 4.5276 7.3102 114.0913 58.1777 62.7624 172.6638 48P G 3.8976 8.1462 111.4725 44.1294 0.0000 173.5908 49P S 4.4152 8.4096 110.9639 58.0729 63.2722 175.4221 50P N 4.4472 7.7536 119.5608 55.9973 39.3672 174.3064 51P M 4.8421 7.0437 116.2742 54.4457 35.4142 173.2446 52P Y 4.7931 9.1791 122.3835 56.0810 42.2737 174.5304 53P V 4.7093 8.0679 122.0345 61.2268 34.9154 173.4909 54P Y 5.2525 9.1543 125.2602 56.3570 41.2910 174.1906 55P N 5.3770 9.1605 122.2150 52.1362 40.7590 174.5364 56P I 4.5557 8.9357 126.0026 60.7965 37.8831 177.2409 57P S 4.1440 9.0323 122.8733 61.6157 62.6873 175.6794 58P T 4.1764 8.1148 108.0506 61.3012 69.3293 173.3736 59P G 3.9912 8.6259 108.1776 44.6780 0.0000 174.2987 60P G 4.1154 10.8874 108.9368 45.9403 0.0000 171.8493 61P F 5.4931 8.2954 112.4389 56.2686 41.8550 173.2702 62P V 5.1145 9.3218 118.5428 61.6977 35.3428 173.1412 63P I 4.9043 9.1139 128.7238 59.6032 39.5903 174.6961 64P V 4.9633 9.2021 127.3093 60.9277 34.4109 175.0074 65P S 4.5042 8.8037 121.9236 58.0269 64.2022 174.0516 66P G 4.2481 8.6428 107.6372 45.4251 0.0000 172.3611 67P D 5.3198 7.6591 119.6391 52.3284 44.8826 175.7531 68P K 4.4474 10.4126 124.1433 57.5340 32.8392 178.2942 69P R 4.3006 8.5929 119.1757 56.1029 30.0199 176.1766 70P S 4.6934 7.5821 114.7454 55.2038 66.3217 171.8403 71P P 3.0710 0.0000 0.0000 62.8244 31.4696 176.0736 72P E 3.9735 8.6504 121.7574 59.2909 30.4525 175.9548 73P I 4.5178 7.3898 118.9467 59.9838 37.7846 175.3029 74P L 4.1523 8.5275 127.2977 55.4397 42.9306 176.6214 75P G 4.2239 7.4376 104.2075 46.1880 0.0000 171.5645 76P Y 4.7726 7.9626 117.3556 56.9600 40.4115 172.6518 77P S 4.5118 7.8979 112.6276 57.5680 65.8890 174.9175 78P T 4.4263 8.7087 114.6162 61.9661 69.4200 174.0737 79P S 4.6722 7.6408 116.4208 57.6842 67.2034 174.4985 80P G 4.1236 9.4481 107.5294 45.9503 0.0000 172.3124 81P S 5.1494 8.4872 115.1858 57.5714 65.8450 173.0933 82P F 4.3108 9.6644 124.0179 56.1702 40.9997 173.9954 83P D 4.4894 6.9648 124.7694 53.3322 43.9382 174.9826 84P V 4.1165 7.9362 115.8277 60.5303 33.3433 175.1352 85P N 4.3504 8.0128 118.4742 54.5752 38.3897 174.9767 86P G 3.9248 8.9285 110.6914 46.0779 0.0000 173.8828 87P K 4.4308 7.8339 120.5193 53.1223 32.5099 176.3734 88P E 3.9889 8.3449 124.2740 58.8192 29.6821 177.6207 89P N 4.3431 8.0656 116.9013 55.6502 37.4461 177.3729 90P I 3.7218 7.6126 121.5033 64.1528 37.3277 177.7602 91P A 4.0042 7.7642 121.2743 55.2760 17.9551 179.3793 92P S 4.1332 8.0325 110.4381 61.6779 62.7961 175.9236 93P F 4.1249 7.9350 123.1522 61.6509 39.1296 176.9547 94P M 3.8248 8.2205 118.1901 58.3667 31.4529 178.6396 95P E 3.9800 8.0709 118.3355 59.3710 29.6289 179.2047 96P S 4.1672 7.4383 114.5171 61.4521 63.0265 175.9432 97P Y 4.6882 7.3108 120.3797 60.5366 37.6710 178.5127 98P V 3.4563 7.8057 121.5247 66.4407 31.4383 176.3481 *99P E 4.2332 7.8663 114.5335 55.8450 31.5348 176.5564 100P Q 4.4696 8.2640 118.1502 56.1331 30.8377 177.3783 101P I 3.7386 7.9154 119.1103 63.7192 37.4009 178.3888 102P K 4.1236 8.0644 119.4203 59.4574 31.5723 179.3335 103P E 4.0508 8.0100 118.1518 59.0871 29.4395 178.6953 104P N 4.4327 8.1378 116.2877 55.4096 38.4213 177.1013 105P K 4.0777 7.5602 118.6571 58.3036 32.1646 178.5144 106P K 4.1790 7.5518 117.5127 57.5419 32.2609 176.5589 107P L 4.5078 7.6485 121.9917 54.2787 43.5344 176.7890 108P D 4.6967 8.3089 117.5349 53.7829 41.4945 172.1087 109P S 4.8923 7.5369 114.6092 56.9573 66.1676 177.0646 110P T 4.3529 8.7489 120.3017 63.4911 69.0428 173.2124 111P Y 4.2609 8.4948 124.7833 57.7389 39.5975 176.1756 112P A 3.9486 7.6758 125.5920 52.3804 17.9645 177.3516 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 4P F 8.18 4.90 0.00 3.11 3.14 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 0.00 0.00 0.00 5P A 8.13 4.17 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 6P R 8.88 4.32 0.00 1.83 1.96 0.00 3.59 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 *7P N 8.67 4.55 0.00 2.53 2.62 0.00 0.00 6.78 7.66 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 *8P E 8.24 4.45 0.00 1.91 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 2.21 1.88 0.00 9P K 7.91 4.05 0.00 1.75 1.85 0.00 1.76 0.00 0.00 1.85 0.00 0.00 2.96 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.44 1.08 7.81 10P E 8.02 4.12 0.00 1.97 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 2.31 1.94 0.00 11P A 7.86 4.19 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 12P K 7.92 2.91 0.00 1.78 1.75 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.15 0.98 7.81 13P D 7.77 4.28 0.00 2.88 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 14P S 8.35 4.09 0.00 4.04 4.05 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 15P A 8.02 4.03 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 16P I 7.73 3.62 1.95 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.05 0.91 0.00 0.00 17P T 8.57 3.98 4.42 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 1.22 0.00 0.00 18P F 8.16 4.11 0.00 3.03 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 19P I 7.76 3.61 1.98 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 1.57 1.00 0.87 0.00 0.00 20P Q 7.71 4.13 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 7.07 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 21P K 8.10 4.15 0.00 1.81 1.69 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.38 1.32 7.81 *35P I 7.08 4.10 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 1.27 1.11 0.91 0.00 0.00 36P K 8.38 4.69 0.00 1.40 1.69 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.81 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.33 1.00 7.81 37P L 8.58 5.16 0.00 1.49 1.73 0.60 1.12 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 38P D 8.91 4.95 0.00 2.69 2.62 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 39P K 8.91 4.26 0.00 1.83 1.74 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.14 7.81 40P V 8.52 4.07 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 0.81 0.00 0.00 1.09 0.00 0.00 41P N 8.87 4.51 0.00 2.78 2.63 0.00 0.00 6.74 7.79 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 42P L 8.50 4.68 0.00 1.66 1.66 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 43P G 8.19 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 44P G 8.53 3.69 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 0.00 0.00 0.00 45P E 8.99 3.96 0.00 2.00 1.90 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 2.23 1.91 0.00 46P L 7.54 4.62 0.00 1.75 1.68 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 47P S 7.31 4.53 0.00 3.81 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 0.00 48P G 8.15 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 0.00 0.00 0.00 49P S 8.41 4.42 0.00 4.08 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 50P N 7.75 4.45 0.00 2.56 2.80 0.00 0.00 6.46 7.66 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 51P M 7.04 4.84 0.00 1.85 1.76 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 52P Y 9.18 4.79 0.00 2.98 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 53P V 8.07 4.71 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 0.91 0.00 0.00 0.71 0.00 0.00 54P Y 9.15 5.25 0.00 3.06 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 55P N 9.16 5.38 0.00 2.76 2.86 0.00 0.00 6.63 6.99 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 56P I 8.94 4.56 2.17 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.81 0.99 0.00 0.00 57P S 9.03 4.14 0.00 4.00 4.16 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 58P T 8.11 4.18 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 1.23 0.00 0.00 59P G 8.63 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 60P G 10.89 4.12 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 0.00 0.00 0.00 61P F 8.30 5.49 0.00 3.36 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 62P V 9.32 5.11 2.28 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 1.02 0.00 0.00 1.15 0.00 0.00 63P I 9.11 4.90 1.96 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.70 0.85 0.00 0.00 64P V 9.20 4.96 2.37 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 1.04 0.00 0.00 1.09 0.00 0.00 65P S 8.80 4.50 0.00 3.81 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 66P G 8.64 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 0.00 0.00 0.00 0.00 67P D 7.66 5.32 0.00 2.69 2.43 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 68P K 10.41 4.45 0.00 2.08 1.98 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.67 7.81 69P R 8.59 4.30 0.00 1.87 1.81 0.00 2.98 0.00 0.00 2.42 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.72 0.00 70P S 7.58 4.69 0.00 3.80 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 71P P 0.00 3.07 0.00 1.74 1.11 0.00 3.39 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 72P E 8.65 3.97 0.00 2.06 1.92 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 2.33 2.34 0.00 73P I 7.39 4.52 1.46 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.07 0.24 0.00 0.00 74P L 8.53 4.15 0.00 1.25 0.97 0.46 0.39 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 75P G 7.44 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 0.00 0.00 0.00 0.00 76P Y 7.96 4.77 0.00 3.09 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 77P S 7.90 4.51 0.00 3.33 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 78P T 8.71 4.43 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 79P S 7.64 4.67 0.00 3.99 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 80P G 9.45 4.12 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 0.00 0.00 0.00 81P S 8.49 5.15 0.00 4.12 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 82P F 9.66 4.31 0.00 1.51 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83P D 6.96 4.49 0.00 2.49 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 0.00 0.00 0.00 0.00 84P V 7.94 4.12 2.02 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 0.62 0.00 0.00 0.92 0.00 0.00 85P N 8.01 4.35 0.00 2.83 2.75 0.00 0.00 6.91 7.29 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 86P G 8.93 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 0.00 0.00 0.00 87P K 7.83 4.43 0.00 1.66 1.61 0.00 1.50 0.00 0.00 1.46 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.26 1.49 7.81 88P E 8.34 3.99 0.00 2.05 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 2.36 2.42 0.00 89P N 8.07 4.34 0.00 2.93 3.04 0.00 0.00 6.31 7.68 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 90P I 7.61 3.72 1.87 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.58 0.82 0.00 0.00 91P A 7.76 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 92P S 8.03 4.13 0.00 3.92 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 93P F 7.94 4.12 0.00 3.01 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 94P M 8.22 3.82 0.00 2.12 2.27 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 3.11 0.00 95P E 8.07 3.98 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 2.32 2.60 0.00 96P S 7.44 4.17 0.00 3.53 3.69 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 97P Y 7.31 4.69 0.00 3.07 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 98P V 7.81 3.46 2.19 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 0.94 0.00 0.00 0.90 0.00 0.00 *99P E 7.87 4.23 0.00 1.77 1.75 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 2.13 2.40 0.00 100P Q 8.26 4.47 0.00 2.28 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.87 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 101P I 7.92 3.74 1.97 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.03 0.89 0.00 0.00 102P K 8.06 4.12 0.00 1.79 1.83 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.63 7.81 103P E 8.01 4.05 0.00 2.13 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 2.38 2.38 0.00 104P N 8.14 4.43 0.00 2.88 2.92 0.00 0.00 6.86 7.40 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 105P K 7.56 4.08 0.00 1.91 1.86 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.66 7.81 106P K 7.55 4.18 0.00 1.70 1.84 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.57 1.60 7.81 107P L 7.65 4.51 0.00 1.65 1.50 0.92 0.64 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 108P D 8.31 4.70 0.00 2.62 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 109P S 7.54 4.89 0.00 3.55 3.58 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 110P T 8.75 4.35 4.31 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 1.38 0.00 0.00 111P Y 8.49 4.26 0.00 3.02 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 112P A 7.68 3.95 0.78 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 * Residues marked with a * may have inaccurate shift predictions.