NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8592 8.1676 115.8761 56.6490 40.7005 176.4811 11 H 3.7337 5.6467 116.4585 56.8913 28.7091 173.6721 12 E 3.6142 8.1087 122.5270 59.1453 30.2370 180.1767 13 M 4.4563 7.2705 115.4794 55.3567 32.2119 177.4867 14 R 4.6254 8.0386 115.6001 56.0496 35.4255 175.7867 15 E 4.0559 7.6263 116.0907 55.1524 29.9753 175.0247 16 P 4.3628 0.0000 0.0000 63.2008 32.4087 175.4599 17 R 4.4031 7.6644 115.8872 55.0740 33.1488 174.0822 18 I 4.3501 8.3658 122.3990 61.3286 37.1279 175.4149 19 E 4.3224 9.3408 130.0587 58.5569 30.4486 176.7423 20 K 5.2732 7.5009 115.1681 56.7789 35.9981 175.0475 21 V 5.2161 8.1535 121.9015 60.3837 34.0095 173.8253 22 V 4.4296 8.0777 128.6343 61.9371 33.1402 174.6940 23 V 4.7123 8.5041 121.7697 59.8443 34.1139 174.3739 24 H 5.2061 8.8313 124.0563 54.8736 34.2389 171.9273 25 M 4.4341 8.5185 123.0964 52.9065 33.3323 173.4680 26 G 3.4026 7.9280 108.0483 46.8985 0.0000 170.1782 27 I 3.7978 8.8003 129.2145 58.7067 36.5364 174.9881 28 G 3.2353 7.3018 117.8531 45.0042 0.0000 172.7615 29 H 4.7431 7.4924 118.9166 55.5741 30.6153 174.8262 *35 A 4.3320 6.9847 123.0348 52.1366 18.7365 178.5243 36 N 4.6079 8.9636 115.0789 55.7687 36.9873 175.9425 37 A 4.3880 7.6619 123.3385 53.6542 19.5619 179.2563 38 E 3.9689 8.2823 117.9866 59.6407 29.4520 178.7042 39 D 4.3405 8.1725 118.5768 57.4717 40.9146 178.5212 40 I 3.6893 7.7568 112.5371 64.3757 37.3230 177.6908 41 L 4.0346 7.5964 119.7200 57.2626 41.4492 179.6739 42 G 3.8264 8.0234 105.3518 47.5504 0.0000 175.6253 43 E 4.1095 7.9915 120.3524 58.7710 29.5112 179.0307 44 I 3.9873 8.4014 118.6050 63.3792 38.1233 177.1070 45 T 4.3919 7.7983 109.5993 63.0070 69.6854 175.5511 46 G 4.0848 8.4900 108.9859 44.8969 0.0000 172.7997 47 Q 4.6737 7.5903 115.4975 53.7362 31.6827 174.6869 48 M 4.3171 8.3192 117.6045 54.8635 32.6744 175.5954 49 P 4.7421 0.0000 0.0000 61.8239 34.1097 174.7117 50 V 4.4103 7.8215 116.2129 62.1623 34.7349 175.1092 51 R 4.3746 8.7444 126.9770 56.6770 31.1330 176.2238 52 T 4.5092 8.8196 118.5971 61.9964 71.4169 174.2075 53 K 5.0358 8.9025 125.7096 54.6370 34.5179 174.6435 54 A 4.8690 8.0834 121.8139 50.5679 22.4196 175.3212 55 K 4.5746 8.1075 115.3122 55.8939 36.0192 174.2213 56 R 4.1566 8.8191 127.3101 56.1543 30.0192 176.5697 57 T 4.3717 8.2714 118.2831 63.3249 69.5946 174.2520 58 V 4.4870 8.5242 123.8068 60.6991 34.4570 176.9815 59 G 3.7386 8.8590 115.4160 48.2449 0.0000 173.7658 60 E 4.1875 8.1337 119.2984 58.6238 28.9595 176.8360 61 F 4.0486 7.6467 116.9477 60.5466 38.9607 175.0192 62 D 4.9553 8.1819 118.6025 53.0184 41.4742 175.6654 63 I 3.7745 7.8386 115.7157 63.3165 38.9225 176.8619 64 R 3.7743 8.0283 121.6643 56.0650 29.1412 174.9226 65 E 3.8046 8.4686 127.6567 58.7872 30.1966 175.7551 66 G 4.2055 7.6851 110.3017 45.9004 0.0000 171.8133 67 D 4.6692 8.6278 124.0301 51.7562 41.6377 173.9247 68 P 4.2707 0.0000 0.0000 63.6459 31.7323 175.2293 69 I 4.6592 8.5410 120.1557 62.8837 45.2759 174.5282 70 G 4.1717 7.6839 106.3441 45.9955 0.0000 171.5471 71 A 5.9400 8.2889 119.7961 50.6526 23.1600 175.1811 72 K 4.9590 8.2541 116.5409 56.4087 36.4606 175.2269 73 V 4.5340 8.5940 120.5915 61.8420 34.9573 173.1627 74 T 4.5883 8.5288 118.8284 60.4286 70.1089 173.8850 75 L 4.7645 8.4408 126.6830 52.9045 44.3216 175.8194 76 R 4.7264 8.0009 120.7655 54.8525 33.6946 175.6612 77 D 4.5299 8.9984 121.5068 55.4279 38.6639 176.1119 78 E 3.9681 9.0514 123.2458 61.1824 29.3642 178.4063 79 M 3.9095 8.2667 117.6513 58.6995 31.8348 178.6067 80 A 4.1044 7.9110 119.8879 54.8520 18.9034 179.2811 81 E 3.9645 8.3124 117.0873 59.6777 29.5239 179.2589 82 E 4.0100 8.6826 117.2195 58.4759 29.7967 178.3805 83 F 4.4945 7.4970 118.3974 60.3096 40.0272 177.1077 84 L 3.9448 8.4910 118.7735 58.2980 41.3116 179.4696 85 Q 3.8840 7.9358 117.1204 59.0565 28.7590 178.9122 86 T 4.2358 7.4814 107.4625 62.9278 69.9307 176.3414 87 A 3.8672 7.7602 124.5611 54.5319 18.4101 179.0942 88 L 3.6249 8.3059 117.0849 57.4005 41.6603 177.9983 89 P 4.1667 0.0000 0.0000 65.8384 31.1955 177.7229 90 L 4.0680 7.6113 113.9688 55.9535 41.4471 176.7366 91 A 4.7669 7.8993 122.0344 50.5802 21.6911 176.5708 92 E 4.7074 8.0351 116.0731 54.3137 29.9275 176.1337 93 L 3.9142 7.5571 117.8281 55.0714 41.6536 176.9313 94 A 5.6682 8.2893 122.3453 49.4767 22.8403 177.4509 95 T 3.7878 8.4971 115.0843 66.9764 68.6959 177.7634 96 S 4.2403 8.1933 114.2766 61.5332 62.7561 175.3874 97 Q 4.2342 7.9224 116.0019 57.1176 28.4946 175.5005 98 F 4.9863 8.0647 117.7851 55.3745 40.5726 175.4191 99 D 4.6773 10.5261 124.5151 54.4731 41.7159 175.3649 100 D 4.6876 8.5382 118.8228 55.7451 41.3385 177.5798 101 T 4.4645 8.8223 115.4995 63.0453 68.6323 174.6299 102 G 4.0023 8.2312 107.4874 47.3146 0.0000 173.4628 103 N 5.2853 7.7877 114.8953 51.2786 42.4201 173.3000 104 F 5.0011 8.0876 111.7084 56.3036 41.2674 173.0628 105 S 4.9535 8.2078 114.5544 56.7175 65.4245 172.8139 106 F 4.8086 8.8928 120.2846 55.6755 41.4087 172.7081 107 G 4.0052 8.9410 103.1910 43.8476 0.0000 175.5171 *128 L 4.1293 8.2148 125.6107 55.1576 42.6361 176.3614 129 D 4.8073 8.5000 125.8718 53.3385 43.2035 175.9635 130 V 4.5050 8.2838 120.4495 61.5976 34.7278 174.2226 131 T 4.7689 8.8487 124.8426 61.5866 71.4931 173.4358 132 V 4.6739 8.1258 124.5693 61.1128 34.6370 173.6578 133 N 4.9906 9.4716 127.7702 52.3286 40.0205 173.3200 134 L 5.2206 8.1879 126.4486 53.3340 44.1343 176.1177 135 V 4.1488 7.7305 119.6786 61.2808 34.7602 172.5152 136 R 4.1673 8.2708 119.8998 54.8698 30.8035 175.7275 137 P 4.0732 0.0000 0.0000 66.4863 31.7584 179.5291 138 G 3.9657 7.9157 107.1330 45.8001 0.0000 174.7034 139 Y 4.3173 7.7311 122.0238 59.6802 38.9835 175.9331 140 R 3.8674 8.1183 119.3273 59.2231 30.0345 178.1681 141 V 3.5506 7.5003 116.5422 65.1391 31.2024 176.7434 142 A 5.0909 7.5171 119.0730 51.1988 19.6035 177.1745 143 K 4.2319 7.4252 114.8895 56.0636 33.8430 176.7507 144 R 4.2482 7.6058 115.3675 55.5397 30.3610 176.7193 145 D 4.4278 8.4385 117.8486 57.1736 41.3856 177.5219 146 K 4.0153 7.9534 118.4058 57.5872 32.6987 177.1854 147 A 3.6761 8.6616 125.2952 52.5794 16.3369 177.0162 148 S 4.4948 7.2964 112.5405 60.2810 63.9418 173.6204 149 R 4.6803 9.1196 121.2449 54.8901 33.9460 173.9156 150 S 4.7039 8.4945 117.4487 57.5655 63.6324 173.6470 151 I 4.0126 8.1793 126.0052 60.1511 38.0009 174.5959 152 P 4.4532 0.0000 0.0000 62.6774 32.1320 177.3884 153 T 3.9936 8.6702 112.0459 64.9996 68.2992 176.4526 154 K 3.8760 8.1064 119.8844 59.6313 32.2899 178.0257 155 H 4.4269 7.6041 113.0728 56.4940 29.9719 175.1811 156 R 4.2568 7.6644 119.4486 56.5727 30.8150 175.2570 157 L 4.6077 8.0718 120.4449 53.9320 43.9548 175.4543 158 N 5.1181 8.1067 119.5517 50.4809 42.7618 174.2316 159 P 4.3248 0.0000 0.0000 66.1872 31.3640 178.4736 160 A 3.8740 7.9696 119.0616 55.0612 18.3777 178.9167 161 D 4.3572 8.2037 115.9760 57.2191 40.9351 179.4999 162 A 4.0289 8.0857 121.4156 55.1694 18.5127 179.2838 163 V 3.1676 7.7305 116.5897 66.1916 31.5645 177.6653 164 A 3.9666 8.2051 120.4634 55.6593 17.9634 179.0262 165 F 4.1301 7.8506 116.7388 61.5751 39.7385 177.0300 166 I 3.5663 8.2005 118.8592 64.4488 36.9003 177.8841 167 E 4.7110 8.4349 120.4007 58.6604 29.4213 178.0936 168 S 4.5105 7.6175 111.2126 57.7672 64.6785 175.1500 169 T 4.6669 7.7193 113.7436 62.9524 70.7806 173.3284 170 Y 3.3416 7.6383 120.8470 57.8477 35.2334 168.3121 171 D 4.3470 6.6171 117.4887 53.7136 42.5144 175.2994 172 V 4.7781 8.0096 117.5761 60.8401 35.3649 177.8124 173 E 4.5037 8.7871 126.0562 56.3946 28.9337 177.0898 174 V 3.6595 7.7973 117.5968 61.9473 31.8641 174.9986 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 10 F 8.17 4.86 0.00 3.35 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 11 H 5.65 3.73 0.00 3.18 2.87 0.00 5.50 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.11 3.61 0.00 1.65 1.83 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 2.30 2.27 0.00 13 M 7.27 4.46 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.62 0.00 14 R 8.04 4.63 0.00 1.84 1.90 0.00 3.29 0.00 0.00 3.35 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 15 E 7.63 4.06 0.00 2.17 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 2.59 2.25 0.00 16 P 0.00 4.36 0.00 0.74 1.53 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 1.96 1.96 0.00 17 R 7.66 4.40 0.00 1.78 1.87 0.00 2.75 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.53 0.00 18 I 8.37 4.35 1.97 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.84 0.98 0.00 0.00 19 E 9.34 4.32 0.00 1.80 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 2.30 2.27 0.00 20 K 7.50 5.27 0.00 1.79 1.82 0.00 1.64 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.20 7.81 21 V 8.15 5.22 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 1.04 0.00 0.00 0.99 0.00 0.00 22 V 8.08 4.43 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 0.85 0.00 0.00 0.86 0.00 0.00 23 V 8.50 4.71 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 0.13 0.00 0.00 0.70 0.00 0.00 24 H 8.83 5.21 0.00 3.17 2.97 0.00 5.52 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 8.52 4.43 0.00 1.88 1.83 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 26 G 7.93 3.40 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 27 I 8.80 3.80 1.96 0.00 0.00 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 1.21 0.73 0.70 0.00 0.00 28 G 7.30 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 0.00 0.00 0.00 29 H 7.49 4.74 0.00 3.12 3.31 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *35 A 6.98 4.33 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 36 N 8.96 4.61 0.00 2.88 2.93 0.00 0.00 5.76 7.26 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 37 A 7.66 4.39 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 38 E 8.28 3.97 0.00 1.99 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 2.31 2.46 0.00 39 D 8.17 4.34 0.00 2.67 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 40 I 7.76 3.69 1.88 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 1.91 0.81 0.91 0.00 0.00 41 L 7.60 4.03 0.00 1.91 1.72 0.86 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.02 3.83 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 0.00 0.00 0.00 43 E 7.99 4.11 0.00 2.09 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 0.00 2.35 2.47 0.00 44 I 8.40 3.99 1.99 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.87 1.06 0.00 0.00 45 T 7.80 4.39 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 0.94 0.00 0.00 46 G 8.49 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 47 Q 7.59 4.67 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.87 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 48 M 8.32 4.32 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 49 P 0.00 4.74 0.00 2.14 2.06 0.00 3.36 0.00 0.00 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.88 0.00 50 V 7.82 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 0.98 0.00 0.00 0.94 0.00 0.00 51 R 8.74 4.37 0.00 1.72 1.83 0.00 3.34 0.00 0.00 3.26 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 52 T 8.82 4.51 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 1.21 0.00 0.00 53 K 8.90 5.04 0.00 1.62 1.75 0.00 1.73 0.00 0.00 0.61 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.26 7.81 54 A 8.08 4.87 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 55 K 8.11 4.57 0.00 1.59 1.66 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.43 7.81 56 R 8.82 4.16 0.00 1.99 2.01 0.00 3.21 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 57 T 8.27 4.37 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 1.24 0.00 0.00 58 V 8.52 4.49 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 1.07 0.00 0.00 1.02 0.00 0.00 59 G 8.86 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 60 E 8.13 4.19 0.00 2.14 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 0.00 2.31 2.34 0.00 61 F 7.65 4.05 0.00 3.03 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 62 D 8.18 4.96 0.00 2.97 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 63 I 7.84 3.77 1.94 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.82 1.01 0.00 0.00 64 R 8.03 3.77 0.00 1.79 2.24 0.00 3.23 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.64 0.00 65 E 8.47 3.80 0.00 2.04 1.83 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 2.38 2.40 0.00 66 G 7.69 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 0.00 0.00 0.00 0.00 67 D 8.63 4.67 0.00 2.67 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 68 P 0.00 4.27 0.00 1.93 2.05 0.00 3.65 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.15 0.00 69 I 8.54 4.66 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 1.13 0.79 0.90 0.00 0.00 70 G 7.68 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 71 A 8.29 5.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 K 8.25 4.96 0.00 1.76 1.89 0.00 1.45 0.00 0.00 1.71 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.39 7.81 73 V 8.59 4.53 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 0.99 0.00 0.00 0.92 0.00 0.00 74 T 8.53 4.59 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 1.16 0.00 0.00 75 L 8.44 4.76 0.00 1.61 1.62 0.53 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.00 4.73 0.00 1.63 1.78 0.00 3.30 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.61 0.00 77 D 9.00 4.53 0.00 2.90 2.40 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 78 E 9.05 3.97 0.00 2.02 2.27 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 2.42 2.43 0.00 79 M 8.27 3.91 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.59 0.00 80 A 7.91 4.10 1.40 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 81 E 8.31 3.96 0.00 2.19 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 0.00 2.39 2.57 0.00 82 E 8.68 4.01 0.00 2.01 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 2.36 2.43 0.00 83 F 7.50 4.49 0.00 3.34 3.21 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 84 L 8.49 3.94 0.00 1.91 1.83 1.08 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 7.94 3.88 0.00 1.92 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.18 2.51 0.00 86 T 7.48 4.24 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 1.13 0.00 0.00 87 A 7.76 3.87 0.91 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 88 L 8.31 3.62 0.00 1.69 1.71 0.98 1.11 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 89 P 0.00 4.17 0.00 1.99 2.12 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.11 0.00 90 L 7.61 4.07 0.00 1.65 1.75 0.91 1.05 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 91 A 7.90 4.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.04 4.71 0.00 1.93 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 2.19 2.29 0.00 93 L 7.56 3.91 0.00 1.68 1.84 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.29 5.67 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 95 T 8.50 3.79 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 1.18 0.00 0.00 96 S 8.19 4.24 0.00 4.03 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 97 Q 7.92 4.23 0.00 2.54 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.83 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 98 F 8.06 4.99 0.00 3.16 3.03 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 0.00 0.00 0.00 0.00 99 D 10.53 4.68 0.00 2.68 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 0.00 100 D 8.54 4.69 0.00 2.72 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 0.00 101 T 8.82 4.46 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 1.24 0.00 0.00 102 G 8.23 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 0.00 103 N 7.79 5.29 0.00 2.81 2.85 0.00 0.00 6.54 8.13 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 0.00 104 F 8.09 5.00 0.00 2.71 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 0.00 105 S 8.21 4.95 0.00 3.56 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 0.00 106 F 8.89 4.81 0.00 3.10 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 0.00 107 G 8.94 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 *128 L 8.21 4.13 0.00 1.67 1.66 0.94 1.12 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 0.00 129 D 8.50 4.81 0.00 2.63 2.45 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 0.00 130 V 8.28 4.50 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 0.00 0.00 0.93 0.00 0.00 0.80 0.00 0.00 131 T 8.85 4.77 4.10 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 1.09 0.00 0.00 132 V 8.13 4.67 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 1.18 0.00 0.00 0.80 0.00 0.00 133 N 9.47 4.99 0.00 2.74 2.63 0.00 0.00 6.64 6.53 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 0.00 134 L 8.19 5.22 0.00 1.76 1.48 1.19 1.10 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 0.00 135 V 7.73 4.15 1.54 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 0.16 0.00 0.00 0.61 0.00 0.00 136 R 8.27 4.17 0.00 1.79 1.76 0.00 3.18 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 137 P 0.00 4.07 0.00 2.07 2.10 0.00 3.66 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 138 G 7.92 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 0.00 139 Y 7.73 4.32 0.00 3.20 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 0.00 140 R 8.12 3.87 0.00 1.93 1.93 0.00 3.25 0.00 0.00 3.26 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 141 V 7.50 3.55 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 0.91 0.00 0.00 0.97 0.00 0.00 142 A 7.52 5.09 1.04 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 0.00 143 K 7.43 4.23 0.00 1.62 1.78 0.00 1.76 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.76 1.30 7.81 144 R 7.61 4.25 0.00 1.90 1.91 0.00 3.18 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.55 0.00 145 D 8.44 4.43 0.00 2.68 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 0.00 146 K 7.95 4.02 0.00 1.80 1.71 0.00 1.79 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.42 7.81 147 A 8.66 3.68 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 0.00 148 S 7.30 4.49 0.00 3.88 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 0.00 149 R 9.12 4.68 0.00 1.78 1.70 0.00 3.07 0.00 0.00 3.08 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.55 0.00 150 S 8.49 4.70 0.00 3.91 3.73 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 0.00 151 I 8.18 4.01 1.97 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 1.44 1.14 1.04 0.00 0.00 152 P 0.00 4.45 0.00 2.21 2.00 0.00 3.64 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 153 T 8.67 3.99 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 1.23 0.00 0.00 154 K 8.11 3.88 0.00 1.77 1.97 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.60 7.81 155 H 7.60 4.43 0.00 3.21 3.37 0.00 5.95 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.66 4.26 0.00 2.01 1.90 0.00 3.42 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.75 0.00 157 L 8.07 4.61 0.00 1.52 1.70 0.87 0.90 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 0.00 158 N 8.11 5.12 0.00 2.93 2.68 0.00 0.00 6.90 8.03 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 0.00 159 P 0.00 4.32 0.00 2.14 2.16 0.00 3.61 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.40 0.00 160 A 7.97 3.87 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 0.00 161 D 8.20 4.36 0.00 2.78 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 0.00 162 A 8.09 4.03 1.65 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 0.00 0.00 163 V 7.73 3.17 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 0.80 0.00 0.00 0.29 0.00 0.00 164 A 8.21 3.97 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 0.00 165 F 7.85 4.13 0.00 3.08 3.31 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 0.00 166 I 8.20 3.57 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.90 0.94 0.00 0.00 167 E 8.43 4.71 0.00 1.84 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 0.00 2.27 2.15 0.00 168 S 7.62 4.51 0.00 3.91 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 0.00 169 T 7.72 4.67 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 1.31 0.00 0.00 170 Y 7.64 3.34 0.00 3.03 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 0.00 171 D 6.62 4.35 0.00 2.87 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 0.00 172 V 8.01 4.78 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 0.85 0.00 0.00 0.90 0.00 0.00 173 E 8.79 4.50 0.00 1.98 1.55 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 2.39 2.24 0.00 174 V 7.80 3.66 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 1.01 0.00 0.00 0.87 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.