NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.8012 8.2833 118.1546 52.0779 38.9169 174.7685 2 L 3.7912 8.2909 119.3915 57.5337 41.4442 178.1159 3 Y 3.9396 8.8186 120.3168 60.9371 39.0763 177.9429 4 Q 3.8458 8.7934 119.2451 58.7591 28.7390 178.4630 5 F 4.3203 8.3449 121.8253 61.1367 39.4177 176.9173 6 K 3.5078 8.1085 119.5752 59.6602 31.9828 178.5148 7 N 4.1974 7.7384 116.5045 56.2502 38.3658 177.3356 8 M 4.0976 8.0493 120.3923 58.5707 32.0860 178.8501 9 I 3.5496 7.5303 119.7925 64.4457 37.0158 178.5803 10 Q 4.2700 8.2499 118.6194 58.4312 28.2368 177.3588 11 C 4.5142 7.8149 118.2806 58.1503 44.0440 174.7500 12 T 4.1193 7.8470 110.0444 61.9850 69.8265 175.1219 13 V 4.5099 8.0604 121.0304 60.4940 31.2898 174.1533 14 P 4.6925 0.0000 0.0000 64.9112 31.7556 178.6149 15 S 4.1383 7.5617 113.6316 60.1259 63.2012 174.0155 *17 R 4.1257 7.5192 118.8855 55.8558 31.1304 175.3626 18 S 4.2443 8.2318 117.8268 58.1218 63.5358 175.4139 19 W 4.4959 9.2321 122.9086 59.8690 27.5620 177.8774 20 A 3.2143 6.5044 119.7482 53.5350 17.4487 178.6281 21 D 4.2538 7.8137 116.8944 55.9997 40.8496 177.4765 22 F 4.6743 7.9022 115.9843 57.1452 39.9564 176.0191 23 A 4.5721 7.8192 121.5611 53.0805 19.1023 177.0670 24 D 4.9701 7.5611 114.1693 53.2334 42.6132 171.7875 25 Y 4.6541 8.9342 123.4831 56.1730 42.6563 176.0261 26 G 3.9582 8.0441 116.6116 46.2094 0.0000 172.3593 27 C 4.3755 9.5144 115.0023 58.3136 40.7049 174.7081 28 Y 4.5128 8.5031 114.7027 56.9395 39.9650 175.0563 29 C 4.6584 8.5521 118.3534 59.2718 40.4789 171.8250 30 G 4.4003 9.2088 113.2708 45.2641 0.0000 172.4064 31 K 4.1101 8.9099 120.7879 59.5712 32.6947 177.7153 32 G 4.0357 7.4785 106.6523 45.6914 0.0000 174.0797 33 G 4.1748 7.8812 110.9769 43.0220 0.0000 172.1403 34 S 4.3639 7.1594 111.5110 58.2714 65.6097 175.5385 35 G 3.7462 8.6309 108.5674 44.9174 0.0000 172.0860 36 T 4.3909 8.2348 115.9092 61.6720 69.0830 173.2073 37 P 4.7637 0.0000 0.0000 63.1439 31.8328 177.1518 38 V 3.8379 8.8295 116.1511 63.8058 32.1416 175.1047 39 D 4.5880 7.6149 117.0861 51.5660 41.8075 175.3414 40 D 4.3778 8.8671 118.0587 57.7951 40.7603 178.6262 41 L 3.9542 8.0299 120.1207 58.2940 41.9920 178.3247 42 D 4.5526 8.8119 117.9875 57.5411 41.1668 178.4148 43 R 3.8694 8.2647 118.7214 59.3125 30.0022 178.2318 44 C 4.3237 8.4096 116.4763 60.5607 38.5996 175.7021 45 C 4.4637 8.3061 117.5125 59.7331 40.9101 175.9803 46 Q 3.4705 8.2874 122.0633 59.2301 28.5356 178.4406 47 T 3.8179 7.8701 110.8928 64.8090 68.7851 175.9720 48 H 3.9308 8.1812 121.1144 59.1659 29.8877 176.9773 49 D 4.2762 8.4382 120.9408 57.5590 40.7216 178.5945 50 N 4.4002 8.3320 117.0330 56.3131 38.4190 176.6756 51 C 4.2900 8.4991 120.4566 59.8868 44.8953 175.2843 52 Y 4.1848 8.1343 118.3511 61.2585 37.2269 178.1995 53 N 4.7306 8.0830 117.6628 55.7968 38.9239 177.0771 54 E 4.0999 8.3740 119.7392 59.4332 29.6139 179.2134 55 A 4.0416 8.2403 120.8201 55.1337 18.2484 179.2679 56 E 4.2922 8.2854 117.8389 58.3381 29.2343 178.8849 57 N 4.4094 7.9322 116.0423 54.5754 39.1556 175.5161 58 I 3.8951 7.4041 122.6120 60.3430 37.8471 175.3223 59 S 4.1360 8.7411 119.5433 59.9881 62.3259 173.9744 60 G 3.8183 8.7850 114.7720 46.3943 0.0000 173.0916 61 C 4.5850 8.0648 120.6691 54.8946 42.0428 172.8731 62 R 4.6907 8.1612 126.5813 53.1867 29.6983 174.0122 63 P 4.0268 0.0000 0.0000 65.5578 31.7011 178.6643 64 Y 4.2666 7.9496 114.8826 59.7994 38.0030 177.0228 65 F 4.6832 7.2107 116.8053 57.3368 41.2537 175.8633 66 K 4.0114 8.4000 122.9644 56.5500 32.1649 176.0813 67 T 4.2125 8.5053 123.9603 62.7901 68.8116 173.8617 68 Y 4.7406 7.6523 125.3814 55.3033 40.6771 174.2583 69 S 5.0853 9.7500 114.9530 56.8950 64.2524 172.6095 70 Y 5.4691 8.5512 123.8414 56.0832 41.3190 173.4004 71 E 4.3911 9.3520 119.6821 54.5134 33.6955 173.2941 72 C 5.3839 8.6609 125.0093 55.3045 47.2342 173.2027 73 T 4.6594 8.7502 122.9931 63.2939 72.2918 174.4895 74 Q 3.5280 9.8165 124.4179 57.1862 26.3207 174.8020 75 G 3.9620 8.4396 102.1611 45.8666 0.0000 173.5311 76 T 4.5653 7.8885 116.3871 61.2506 71.3918 172.3340 77 L 5.1542 8.4840 127.7413 53.8385 43.8386 175.4903 78 T 4.7214 8.9674 122.4108 61.9918 72.4601 172.1385 79 C 4.9683 8.7881 123.4819 55.8567 40.7587 173.9441 80 K 4.4163 8.9994 123.7360 55.6671 33.0251 178.4564 81 G 3.7401 8.7266 110.1964 47.6020 0.0000 174.3409 82 D 4.5842 7.9603 117.9002 54.0314 39.9172 176.1513 83 N 4.5236 7.6186 118.4452 52.9932 39.1895 175.5535 84 N 4.6888 8.5850 120.8515 51.9477 39.9693 175.7332 85 A 3.9367 8.4531 121.0769 55.5381 18.2429 180.0199 86 C 4.1214 8.2453 116.0457 59.8688 42.0354 175.3695 87 A 4.0353 8.8688 122.3527 55.2124 18.0066 179.4095 88 A 3.8866 8.6022 119.4456 55.3549 18.4790 180.0677 89 S 3.9998 8.1904 113.6635 61.7553 62.9851 177.1359 90 V 3.5427 8.0019 121.1813 66.0908 31.2982 177.0385 91 C 2.9105 8.1466 118.5930 59.3547 43.0306 175.1092 92 D 4.1448 7.9626 119.4103 57.3706 40.7799 177.3723 93 C 4.1563 8.1284 117.0003 60.2529 38.5303 176.0015 94 D 3.8246 7.9805 120.1245 57.1125 40.4081 178.7534 95 R 3.7881 8.1685 119.5113 59.5571 30.0787 178.5968 96 L 3.9350 8.1089 118.7613 57.5865 41.5500 179.4667 97 A 3.6778 7.8781 120.6090 54.8422 18.1995 179.4287 98 A 3.4548 8.0617 119.6816 55.2831 18.1866 180.0030 99 I 3.6271 7.3989 117.1025 64.5335 37.5919 177.4971 100 C 4.4251 8.2356 119.4137 59.7856 37.6352 175.6000 101 F 4.3366 8.6323 119.5661 60.6835 38.2190 177.5282 102 A 4.2729 7.8711 119.0436 54.0954 18.2379 178.7884 103 G 3.9058 7.7545 101.2296 43.7361 0.0000 173.2610 104 A 4.7266 7.1547 123.7043 49.6062 20.6055 175.6252 105 P 4.3757 0.0000 0.0000 62.6943 32.0475 175.3177 106 Y 4.2095 8.5228 123.1673 55.8144 39.9417 174.3926 107 N 4.8310 8.6129 126.9343 51.7384 39.4403 174.5051 108 D 4.6521 9.0146 127.0519 57.5808 41.1094 179.4178 109 A 4.0373 8.7212 121.1567 54.5565 18.5504 177.7266 110 N 4.3336 8.3076 112.3545 53.1504 39.0261 174.3584 111 Y 4.2678 7.4245 120.9982 58.3648 39.7237 174.8174 112 N 4.1147 8.0896 125.1427 53.3030 37.6511 173.4546 113 I 3.9024 7.0015 110.3189 59.9866 39.4713 175.9194 114 D 4.4876 8.1982 120.5793 53.1747 40.2091 176.5760 115 L 3.8937 8.4326 127.0578 57.5682 42.0055 179.7948 116 K 3.7824 8.2225 117.5548 59.2481 32.1829 177.3101 117 A 4.2487 7.9570 119.9496 53.7034 18.8721 178.0092 118 R 4.5653 7.9913 111.6638 56.3051 31.3810 175.6750 119 C 4.9872 7.9789 115.8296 56.5465 41.1551 173.7889 120 N 4.5114 8.2307 122.3345 53.6184 38.2651 175.3403 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 4.80 0.00 3.04 3.14 0.00 0.00 6.10 5.79 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 2 L 8.29 3.79 0.00 1.57 1.70 0.72 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 3 Y 8.82 3.94 0.00 2.96 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 4 Q 8.79 3.85 0.00 1.87 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 5 F 8.34 4.32 0.00 3.20 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 6 K 8.11 3.51 0.00 1.33 1.45 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.35 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.67 0.21 7.81 7 N 7.74 4.20 0.00 2.78 2.84 0.00 0.00 7.07 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 8 M 8.05 4.10 0.00 2.01 2.26 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 9 I 7.53 3.55 1.84 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 -0.00 0.68 0.00 0.00 10 Q 8.25 4.27 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.69 0.00 0.00 0.00 0.00 0.00 2.49 2.54 0.00 11 C 7.81 4.51 0.00 3.15 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 12 T 7.85 4.12 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 1.25 0.00 0.00 13 V 8.06 4.51 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 1.18 0.00 0.00 0.93 0.00 0.00 14 P 0.00 4.69 0.00 2.23 2.18 0.00 3.44 0.00 0.00 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.92 0.00 15 S 7.56 4.14 0.00 4.21 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 *17 R 7.52 4.13 0.00 1.99 1.75 0.00 3.03 0.00 0.00 2.25 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.62 0.00 18 S 8.23 4.24 0.00 3.82 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 19 W 9.23 4.50 0.00 3.63 3.38 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 20 A 6.50 3.21 0.43 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 0.00 0.00 21 D 7.81 4.25 0.00 1.86 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 0.00 0.00 0.00 22 F 7.90 4.67 0.00 3.15 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 23 A 7.82 4.57 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 24 D 7.56 4.97 0.00 2.60 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 0.00 0.00 0.00 0.00 25 Y 8.93 4.65 0.00 2.97 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 26 G 8.04 3.96 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 0.00 0.00 0.00 27 C 9.51 4.38 0.00 3.04 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 28 Y 8.50 4.51 0.00 3.28 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 29 C 8.55 4.66 0.00 3.38 3.44 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 30 G 9.21 4.40 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 0.00 31 K 8.91 4.11 0.00 1.79 1.92 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.54 7.81 32 G 7.48 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 0.00 0.00 0.00 33 G 7.88 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 7.16 4.36 0.00 3.91 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 35 G 8.63 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 36 T 8.23 4.39 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 4.76 0.00 2.09 2.06 0.00 3.74 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 38 V 8.83 3.84 2.04 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 0.68 0.00 0.00 0.95 0.00 0.00 39 D 7.61 4.59 0.00 2.90 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 40 D 8.87 4.38 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 8.03 3.95 0.00 1.63 1.69 0.59 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 42 D 8.81 4.55 0.00 3.18 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 43 R 8.26 3.87 0.00 2.09 1.97 0.00 3.21 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.83 0.00 44 C 8.41 4.32 0.00 3.51 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 8.31 4.46 0.00 3.40 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 8.29 3.47 0.00 1.18 1.91 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 1.94 1.16 0.00 47 T 7.87 3.82 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 1.26 0.00 0.00 48 H 8.18 3.93 0.00 3.24 3.47 0.00 5.59 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 D 8.44 4.28 0.00 2.95 2.83 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 50 N 8.33 4.40 0.00 2.92 2.86 0.00 0.00 6.70 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 51 C 8.50 4.29 0.00 3.08 3.19 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 52 Y 8.13 4.18 0.00 3.14 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 53 N 8.08 4.73 0.00 2.92 2.92 0.00 0.00 6.99 6.94 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 54 E 8.37 4.10 0.00 2.20 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 2.48 2.47 0.00 55 A 8.24 4.04 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 56 E 8.29 4.29 0.00 2.21 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 2.28 2.21 0.00 57 N 7.93 4.41 0.00 2.89 2.88 0.00 0.00 7.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 7.40 3.90 1.99 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 1.18 0.54 0.91 0.00 0.00 59 S 8.74 4.14 0.00 3.82 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 60 G 8.79 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 0.00 0.00 0.00 61 C 8.06 4.59 0.00 3.01 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 8.16 4.69 0.00 1.99 2.01 0.00 3.14 0.00 0.00 3.29 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 63 P 0.00 4.03 0.00 1.14 0.57 0.00 3.51 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.83 0.00 64 Y 7.95 4.27 0.00 2.42 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 65 F 7.21 4.68 0.00 3.23 3.08 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 0.00 0.00 0.00 66 K 8.40 4.01 0.00 1.70 1.77 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.12 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.54 7.81 67 T 8.51 4.21 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 1.19 0.00 0.00 68 Y 7.65 4.74 0.00 3.16 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 69 S 9.75 5.09 0.00 3.95 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 70 Y 8.55 5.47 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 71 E 9.35 4.39 0.00 1.92 1.73 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 2.15 2.15 0.00 72 C 8.66 5.38 0.00 3.10 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 73 T 8.75 4.66 4.23 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 1.20 0.00 0.00 74 Q 9.82 3.53 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.02 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 75 G 8.44 3.96 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 0.00 0.00 0.00 76 T 7.89 4.57 4.38 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 1.22 0.00 0.00 77 L 8.48 5.15 0.00 1.64 1.57 1.09 0.89 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 78 T 8.97 4.72 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 1.22 0.00 0.00 79 C 8.79 4.97 0.00 2.81 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 80 K 9.00 4.42 0.00 1.93 1.81 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.44 7.81 81 G 8.73 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 82 D 7.96 4.58 0.00 2.82 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 83 N 7.62 4.52 0.00 2.88 2.92 0.00 0.00 6.95 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 84 N 8.58 4.69 0.00 3.00 3.00 0.00 0.00 6.14 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 8.45 3.94 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 86 C 8.25 4.12 0.00 3.00 3.27 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 87 A 8.87 4.04 1.52 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 0.00 0.00 88 A 8.60 3.89 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 89 S 8.19 4.00 0.00 4.08 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 90 V 8.00 3.54 2.15 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 1.02 0.00 0.00 0.85 0.00 0.00 91 C 8.15 2.91 0.00 2.23 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 92 D 7.96 4.14 0.00 2.91 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 93 C 8.13 4.16 0.00 3.24 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 94 D 7.98 3.82 0.00 2.73 2.72 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 95 R 8.17 3.79 0.00 1.78 1.97 0.00 3.20 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 1.57 1.64 0.00 96 L 8.11 3.93 0.00 1.69 1.64 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.88 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.06 3.45 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 99 I 7.40 3.63 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 1.38 0.64 0.89 0.00 0.00 100 C 8.24 4.43 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 8.63 4.34 0.00 2.94 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 0.00 102 A 7.87 4.27 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 0.00 103 G 7.75 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 0.00 0.00 0.00 104 A 7.15 4.73 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 0.00 105 P 0.00 4.38 0.00 2.10 2.04 0.00 3.70 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 2.06 2.11 0.00 106 Y 8.52 4.21 0.00 2.83 2.76 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 0.00 107 N 8.61 4.83 0.00 2.78 2.80 0.00 0.00 6.73 8.09 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 0.00 108 D 9.01 4.65 0.00 2.79 2.78 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 0.00 109 A 8.72 4.04 1.31 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 0.00 0.00 110 N 8.31 4.33 0.00 1.92 1.78 0.00 0.00 6.48 7.63 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 0.00 111 Y 7.42 4.27 0.00 3.00 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 0.00 112 N 8.09 4.11 0.00 1.84 2.53 0.00 0.00 7.18 7.57 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 0.00 113 I 7.00 3.90 1.75 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 1.12 0.59 0.73 0.00 0.00 114 D 8.20 4.49 0.00 2.68 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 0.00 115 L 8.43 3.89 0.00 1.69 1.63 0.87 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.22 3.78 0.00 1.68 1.97 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.44 7.81 117 A 7.96 4.25 1.30 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 0.00 118 R 7.99 4.57 0.00 1.85 1.90 0.00 3.06 0.00 0.00 3.16 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 119 C 7.98 4.99 0.00 2.99 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 0.00 120 N 8.23 4.51 0.00 2.70 2.71 0.00 0.00 6.99 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.