NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *16 P 4.2514 0.0000 0.0000 62.6314 32.8047 176.8728 17 A 3.6296 7.0617 121.1339 50.4337 17.8982 175.2778 18 R 4.6738 9.1496 122.8148 54.3290 34.4460 173.4221 19 I 4.4755 8.3949 123.5565 61.5431 37.9678 175.4056 20 T 4.7829 8.9860 116.4124 59.8805 72.2229 172.9949 21 L 5.1442 8.4483 124.2872 54.1468 44.9655 175.1233 22 T 4.8531 8.8098 116.4535 60.3363 72.6636 172.1760 23 Y 5.3868 8.2735 120.7197 56.2533 42.6527 172.9819 24 K 4.2913 8.4130 127.8023 54.1153 34.7864 174.8097 25 E 4.0375 8.7102 128.9265 56.5376 30.3685 176.7829 26 G 4.2953 8.4320 114.2572 44.9938 0.0000 173.1251 27 A 4.2422 8.6099 123.6250 51.1783 19.0802 176.1157 28 P 4.3349 0.0000 0.0000 63.1474 31.7654 175.7202 29 I 4.1083 7.9031 120.8841 60.1414 38.2524 175.6721 30 T 4.0723 8.2195 122.5038 62.8781 68.6315 174.4946 31 I 3.8855 8.0975 128.2820 61.2370 37.8846 176.1931 32 M 4.3785 8.6925 125.5712 54.1570 32.9637 176.9354 33 D 4.2849 8.4330 119.1265 57.0932 41.4094 176.5832 34 N 4.4322 8.0465 114.3678 53.4875 37.9594 175.8030 35 G 3.7931 8.5790 108.6550 45.5260 0.0000 172.6287 36 N 4.9585 8.2547 119.1326 51.4674 41.1488 173.1350 37 I 4.7356 7.5274 111.3402 58.3292 40.5008 174.6969 38 D 4.4208 8.2913 120.9690 54.3684 41.7145 175.9857 39 T 4.2873 8.0359 113.3387 62.2619 69.9153 174.6308 40 E 3.8627 8.9658 120.9995 56.7306 27.9068 174.8593 41 L 4.0752 7.4721 119.7474 54.5128 42.9134 176.5146 42 L 4.5994 8.4428 125.4120 55.0782 41.2750 176.4370 43 V 3.7078 9.2843 128.3493 64.9477 32.8494 175.6923 44 G 4.1974 7.1111 104.1216 46.5879 0.0000 171.2738 45 T 5.1199 7.8623 116.4952 61.7524 71.9010 173.7219 46 L 5.0316 9.0278 127.4497 54.2917 43.8603 176.0107 47 T 5.0599 8.7611 119.8223 61.8520 71.1338 172.7743 48 L 5.2757 9.5751 129.9236 53.7582 44.1510 175.5595 49 G 4.2256 8.8457 112.2884 45.2146 0.0000 173.2756 50 G 4.2609 8.7659 105.9256 46.3468 0.0000 173.4196 51 Y 4.5776 6.4984 117.0591 55.4650 39.3005 175.1885 52 K 4.1374 9.6141 122.1715 56.2860 32.8543 176.4026 53 T 4.0325 8.3601 121.3428 65.4676 68.5687 174.8184 54 G 3.9968 9.1072 114.8699 45.0801 0.0000 173.5512 55 T 3.8383 7.6324 117.2775 64.2007 69.1657 173.5225 56 T 4.9840 8.0298 114.9885 59.4023 71.2003 175.5453 57 S 4.2357 8.8239 117.5530 61.2239 62.9876 176.3931 58 T 4.0690 7.2936 109.7414 63.3393 69.1933 175.6229 59 S 4.2865 8.0302 117.7639 59.1376 63.3163 173.0603 60 V 4.4764 7.3940 121.9003 60.8916 33.7437 173.6717 61 N 5.2004 8.4919 126.1033 51.7427 41.7051 172.8916 62 F 5.0110 8.9515 127.0597 57.0534 40.4223 175.2898 63 T 5.1337 9.0284 114.1236 60.0784 72.1337 172.4444 64 D 5.0828 8.9475 121.0151 51.9130 42.5312 175.3714 65 A 4.0325 8.7181 121.5538 55.2167 18.4233 178.7601 66 A 3.9421 8.1727 118.5826 53.7707 18.3803 179.1236 67 G 4.0725 8.5033 101.2818 45.8995 0.0000 173.0401 68 D 4.3856 7.5151 120.3285 53.2755 41.4179 174.0702 69 P 4.4371 0.0000 0.0000 64.2712 31.7174 176.6428 70 M 3.3226 9.4822 123.2440 55.0615 31.1191 176.2639 71 Y 5.2727 7.3097 114.6283 56.0941 41.6971 174.9319 72 L 4.8124 8.8023 122.8289 53.8565 44.0246 175.5791 73 T 4.9496 8.7658 120.1599 61.9851 70.3503 173.9772 74 F 4.6735 8.9515 126.1663 56.6197 41.0284 175.1222 75 T 5.4106 8.5506 119.2692 61.4527 71.7837 174.1096 76 S 3.8061 8.8175 120.4816 57.9657 64.0650 173.8161 77 Q 4.5449 8.1469 117.1994 55.8320 29.0206 176.1806 78 D 4.5797 8.1631 115.9601 53.0440 40.0201 177.1914 79 G 3.9120 8.2676 108.5057 45.7029 0.0000 173.6752 80 N 4.5713 8.2071 115.5362 52.3738 38.9139 174.6645 81 N 4.2041 8.1473 113.9086 54.0740 36.5335 173.7723 82 H 4.4311 7.7088 114.5056 56.8067 29.8344 174.7624 83 Q 5.5745 8.9450 120.5248 54.3355 33.4293 174.0184 84 F 5.4962 8.8945 115.4745 55.7179 41.7533 173.6548 85 T 5.2050 8.8323 111.4132 60.9001 71.4606 173.4106 86 T 5.3729 9.1087 112.4219 60.2218 72.9818 172.4480 87 K 5.1065 9.3115 121.2312 55.1537 36.4522 174.9740 88 V 4.8843 8.3830 120.3968 61.3604 33.5629 174.9431 89 I 4.8879 9.2097 129.2551 60.1017 41.5715 175.6361 90 G 4.1615 9.5248 115.4803 44.9807 0.0000 172.0281 91 K 5.3405 8.3727 118.3199 54.6522 35.5472 177.0101 92 D 4.7791 8.8505 124.8090 52.0146 41.4927 177.0929 93 S 4.1714 8.6279 112.9196 60.8880 63.0726 174.8913 94 R 4.2161 7.9685 115.8367 55.6823 29.3546 175.8370 95 D 4.4435 7.9263 114.9745 55.4503 40.3609 173.7468 96 F 4.8045 8.3480 116.6836 56.4876 39.7413 174.7588 97 D 4.9886 8.8908 123.6377 55.1879 41.5487 175.9778 98 I 4.4089 9.2533 124.0519 59.8388 39.5723 174.8016 99 S 5.0571 8.7417 123.6304 55.8261 62.9327 171.8344 100 P 4.9244 0.0000 0.0000 61.4432 32.6620 176.0651 101 K 4.3226 8.6708 120.0502 56.3778 33.3732 176.5978 102 V 4.6614 8.7256 124.4522 61.3254 34.1457 175.2588 103 N 4.2289 10.7311 128.2646 54.3399 36.5745 175.7264 104 G 3.9756 9.0181 106.2714 45.2071 0.0000 174.0051 105 E 4.8012 7.5257 118.5153 54.3635 33.5139 175.3431 106 N 5.2996 8.2889 126.5565 53.3298 37.7937 177.1335 *109 G 3.9284 8.6696 111.5143 46.3852 0.0000 172.5367 110 D 4.1535 8.1136 118.6314 55.0036 40.9075 176.1442 111 D 4.6131 8.5636 124.3913 52.8511 40.6230 174.9369 112 V 4.4102 8.1175 126.3349 60.8883 34.2392 174.5635 113 V 4.2053 8.2098 126.2144 62.1093 31.9743 175.8590 114 L 4.3672 8.4933 128.1313 54.4134 42.1618 177.2474 115 A 4.2038 8.8246 124.7837 52.2565 18.9883 177.8820 116 T 3.9645 8.2707 117.3324 64.7506 68.0683 173.4612 117 G 3.8520 8.7752 121.7894 44.3021 0.0000 173.1974 118 S 4.8952 7.3382 113.4548 55.9734 67.6393 173.1624 119 Q 4.4592 9.2158 121.0278 54.9529 32.3882 173.0416 120 D 5.0737 8.4464 126.2632 53.5265 42.3559 175.7348 121 F 4.5215 9.0625 120.9470 55.5527 42.7037 174.1083 122 F 5.0879 8.8457 122.3448 56.4597 40.8906 175.1180 123 V 4.5443 9.0118 124.4028 62.4197 32.5893 174.7073 124 R 5.3008 9.0443 128.0986 54.0891 32.9198 175.9353 125 S 4.2452 8.8947 118.7940 59.0121 63.8244 173.3081 126 I 4.1903 8.6909 122.3205 60.2481 38.0434 177.4568 127 G 3.8165 7.5474 107.8924 45.2910 0.0000 171.7437 128 S 4.6869 8.8925 114.5631 58.3995 62.5505 174.6809 129 K 4.0642 8.6342 125.7328 57.6713 32.0676 175.3520 130 G 3.1297 8.6255 105.3750 45.7890 0.0000 173.9642 131 G 4.0352 8.5472 112.9281 44.1623 0.0000 172.7532 132 K 4.3318 8.2160 118.9710 56.3074 32.5185 177.1617 133 L 4.4039 8.9178 125.3275 54.4319 42.5820 176.1643 134 A 4.7446 7.7339 123.0876 49.9533 20.5711 177.2381 135 A 4.1013 8.8207 124.4380 51.7404 19.1641 178.1937 136 G 4.0812 8.0510 107.1159 44.9519 0.0000 171.6551 137 K 4.6599 8.0417 119.1251 55.9259 33.1441 176.4555 138 Y 5.1518 8.9450 121.2129 56.4969 41.3081 174.8722 139 T 4.8423 8.7678 112.4827 60.1182 72.9801 172.2534 140 D 4.7290 7.8525 120.6858 52.6205 44.2824 174.3630 141 A 4.1465 8.5291 129.2424 51.4432 18.8387 176.1906 142 V 4.5385 8.1062 122.9118 61.8751 33.5406 174.9065 143 T 4.7865 8.7383 124.5242 61.7007 71.1423 173.4617 144 V 4.4999 8.3859 125.2979 60.2457 33.6675 174.9807 145 T 4.4229 8.4453 121.7805 61.7477 70.6414 173.4438 146 V 4.6239 8.2069 127.0004 61.4024 32.6805 175.7626 147 S 4.3873 9.0586 125.0875 57.2851 64.2533 173.4288 148 N 4.1447 8.3518 115.1100 55.1364 35.7798 174.8163 149 Q 4.2729 7.9613 120.0886 56.1059 29.2376 176.1826 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 *16 P 0.00 4.25 0.00 1.83 1.89 0.00 3.61 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.09 0.00 17 A 7.06 3.63 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 18 R 9.15 4.67 0.00 1.83 1.79 0.00 3.13 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 19 I 8.39 4.48 1.89 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.76 0.96 0.00 0.00 20 T 8.99 4.78 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 21 L 8.45 5.14 0.00 1.69 1.62 1.28 1.05 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 22 T 8.81 4.85 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 1.26 0.00 0.00 23 Y 8.27 5.39 0.00 3.06 2.84 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 24 K 8.41 4.29 0.00 1.73 1.46 0.00 1.66 0.00 0.00 1.53 0.00 0.00 2.75 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.20 1.28 7.81 25 E 8.71 4.04 0.00 2.18 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 2.35 2.49 0.00 26 G 8.43 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 0.00 0.00 0.00 0.00 27 A 8.61 4.24 1.22 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 28 P 0.00 4.33 0.00 2.17 2.09 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 29 I 7.90 4.11 1.58 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.50 0.61 0.00 0.00 30 T 8.22 4.07 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 1.16 0.00 0.00 31 I 8.10 3.89 1.82 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 1.33 0.70 0.85 0.00 0.00 32 M 8.69 4.38 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.42 0.00 33 D 8.43 4.28 0.00 2.61 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 34 N 8.05 4.43 0.00 2.84 2.90 0.00 0.00 6.19 7.00 0.00 0.00 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 8.58 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 0.00 0.00 0.00 36 N 8.25 4.96 0.00 2.69 2.65 0.00 0.00 6.69 7.28 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 37 I 7.53 4.74 1.58 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.62 0.62 0.00 0.00 38 D 8.29 4.42 0.00 2.58 2.54 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 39 T 8.04 4.29 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 1.22 0.00 0.00 40 E 8.97 3.86 0.00 2.13 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 2.23 2.41 0.00 41 L 7.47 4.08 0.00 1.55 1.52 0.77 0.38 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 42 L 8.44 4.60 0.00 1.59 1.60 1.20 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 43 V 9.28 3.71 2.26 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 0.87 0.00 0.00 0.98 0.00 0.00 44 G 7.11 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 0.00 0.00 0.00 0.00 45 T 7.86 5.12 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 1.13 0.00 0.00 46 L 9.03 5.03 0.00 1.66 1.71 0.35 0.90 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 47 T 8.76 5.06 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 1.30 0.00 0.00 48 L 9.58 5.28 0.00 2.18 2.05 1.10 0.87 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 49 G 8.85 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 0.00 0.00 0.00 0.00 50 G 8.77 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 51 Y 6.50 4.58 0.00 3.14 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 52 K 9.61 4.14 0.00 1.82 1.93 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.46 7.81 53 T 8.36 4.03 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 1.24 0.00 0.00 54 G 9.11 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 55 T 7.63 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 1.06 0.00 0.00 56 T 8.03 4.98 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 1.22 0.00 0.00 57 S 8.82 4.24 0.00 4.09 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 58 T 7.29 4.07 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 1.32 0.00 0.00 59 S 8.03 4.29 0.00 4.03 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 60 V 7.39 4.48 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 0.28 0.00 0.00 0.84 0.00 0.00 61 N 8.49 5.20 0.00 2.73 2.48 0.00 0.00 6.79 7.13 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 62 F 8.95 5.01 0.00 3.01 2.86 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 63 T 9.03 5.13 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 1.18 0.00 0.00 64 D 8.95 5.08 0.00 2.79 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 65 A 8.72 4.03 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 66 A 8.17 3.94 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 67 G 8.50 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 0.00 0.00 0.00 68 D 7.52 4.39 0.00 2.69 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 69 P 0.00 4.44 0.00 2.03 2.04 0.00 3.80 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 2.03 2.10 0.00 70 M 9.48 3.32 0.00 1.05 1.77 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.20 0.00 71 Y 7.31 5.27 0.00 2.89 2.87 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 0.00 0.00 0.00 72 L 8.80 4.81 0.00 1.72 1.66 0.79 0.71 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 73 T 8.77 4.95 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 1.23 0.00 0.00 74 F 8.95 4.67 0.00 1.56 2.75 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 75 T 8.55 5.41 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 1.19 0.00 0.00 76 S 8.82 3.81 0.00 3.47 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 77 Q 8.15 4.54 0.00 1.93 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.91 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 78 D 8.16 4.58 0.00 2.77 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 79 G 8.27 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 80 N 8.21 4.57 0.00 2.78 2.64 0.00 0.00 7.02 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 81 N 8.15 4.20 0.00 2.82 2.87 0.00 0.00 7.02 8.16 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 82 H 7.71 4.43 0.00 3.30 3.49 0.00 5.56 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 8.94 5.57 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.83 0.00 0.00 0.00 0.00 0.00 2.41 2.66 0.00 84 F 8.89 5.50 0.00 3.04 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 85 T 8.83 5.21 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 1.20 0.00 0.00 86 T 9.11 5.37 4.52 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 1.30 0.00 0.00 87 K 9.31 5.11 0.00 1.94 2.26 0.00 1.40 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.48 7.81 88 V 8.38 4.88 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 0.58 0.00 0.00 0.81 0.00 0.00 89 I 9.21 4.89 2.05 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.54 1.07 0.00 0.00 90 G 9.52 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 0.00 0.00 0.00 91 K 8.37 5.34 0.00 1.81 1.76 0.00 1.87 0.00 0.00 2.01 0.00 0.00 3.23 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.58 1.42 7.81 92 D 8.85 4.78 0.00 2.96 2.90 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 93 S 8.63 4.17 0.00 4.00 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 94 R 7.97 4.22 0.00 1.53 1.90 0.00 3.15 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.67 0.00 95 D 7.93 4.44 0.00 2.68 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 96 F 8.35 4.80 0.00 3.53 2.88 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 97 D 8.89 4.99 0.00 2.66 2.73 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 0.00 0.00 0.00 98 I 9.25 4.41 1.90 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 1.19 0.91 1.07 0.00 0.00 99 S 8.74 5.06 0.00 3.92 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 0.00 100 P 0.00 4.92 0.00 1.98 1.82 0.00 3.75 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.48 0.00 101 K 8.67 4.32 0.00 1.83 1.82 0.00 1.54 0.00 0.00 1.53 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.34 7.81 102 V 8.73 4.66 2.06 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 1.09 0.00 0.00 0.98 0.00 0.00 103 N 10.73 4.23 0.00 2.88 2.85 0.00 0.00 7.21 7.53 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 0.00 104 G 9.02 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 0.00 105 E 7.53 4.80 0.00 1.90 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 2.23 2.24 0.00 106 N 8.29 5.30 0.00 2.67 2.56 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 *109 G 8.67 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 0.00 110 D 8.11 4.15 0.00 2.65 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 0.00 111 D 8.56 4.61 0.00 2.60 2.60 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 0.00 112 V 8.12 4.41 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 0.97 0.00 0.00 0.99 0.00 0.00 113 V 8.21 4.21 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 0.94 0.00 0.00 114 L 8.49 4.37 0.00 1.26 1.43 0.19 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.82 4.20 1.38 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 0.00 0.00 116 T 8.27 3.96 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 1.21 0.00 0.00 117 G 8.78 3.85 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 0.00 0.00 0.00 118 S 7.34 4.90 0.00 3.94 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 0.00 119 Q 9.22 4.46 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 1.88 1.44 0.00 120 D 8.45 5.07 0.00 2.22 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 0.00 0.00 0.00 0.00 121 F 9.06 4.52 0.00 2.84 2.84 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 0.00 122 F 8.85 5.09 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 0.00 123 V 9.01 4.54 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 1.26 0.00 0.00 1.10 0.00 0.00 124 R 9.04 5.30 0.00 1.83 1.85 0.00 3.47 0.00 0.00 3.42 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 125 S 8.89 4.25 0.00 3.78 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 0.00 126 I 8.69 4.19 1.83 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.66 0.72 0.00 0.00 127 G 7.55 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 0.00 128 S 8.89 4.69 0.00 3.83 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 0.00 129 K 8.63 4.06 0.00 1.98 1.89 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.49 1.43 7.81 130 G 8.63 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 0.00 0.00 0.00 131 G 8.55 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 0.00 132 K 8.22 4.33 0.00 1.67 1.76 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.66 1.48 7.81 133 L 8.92 4.40 0.00 1.48 1.59 0.75 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.73 4.74 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 0.00 135 A 8.82 4.10 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 0.00 136 G 8.05 4.08 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 0.00 0.00 0.00 137 K 8.04 4.66 0.00 1.69 1.83 0.00 1.80 0.00 0.00 1.81 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.46 7.81 138 Y 8.94 5.15 0.00 3.06 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 0.00 139 T 8.77 4.84 4.18 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 1.27 0.00 0.00 140 D 7.85 4.73 0.00 1.82 1.61 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 0.00 141 A 8.53 4.15 1.18 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 0.00 0.00 142 V 8.11 4.54 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 0.93 0.00 0.00 0.80 0.00 0.00 143 T 8.74 4.79 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 1.19 0.00 0.00 144 V 8.39 4.50 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 0.70 0.00 0.00 0.12 0.00 0.00 145 T 8.45 4.42 4.14 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 1.15 0.00 0.00 146 V 8.21 4.62 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 0.81 0.00 0.00 0.87 0.00 0.00 147 S 9.06 4.39 0.00 3.70 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 0.00 148 N 8.35 4.14 0.00 2.82 2.85 0.00 0.00 6.72 7.69 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 0.00 149 Q 7.96 4.27 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.65 0.00 0.00 0.00 0.00 0.00 2.55 2.28 0.00 * Residues marked with a * may have inaccurate shift predictions.