NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4832 8.3049 118.1888 55.1373 32.5527 174.3102 2 Q 4.4135 8.9022 118.7382 52.0363 32.3521 173.8759 3 D 4.7629 8.8157 122.5100 51.2287 44.0113 176.7397 4 A 3.7340 8.3272 121.3079 55.4618 17.9555 180.0952 5 I 3.4744 7.0808 117.5322 64.7543 37.3352 178.7298 6 T 3.8291 8.4238 110.5009 64.5265 68.5804 176.3113 7 A 4.0580 7.9907 124.0334 54.8852 18.2976 179.8152 8 V 3.5861 7.3720 118.3237 65.4760 31.5750 178.2854 9 I 3.6351 7.7793 119.6200 64.4735 37.0085 177.8277 10 N 4.2749 8.4662 118.4198 56.7781 38.2982 177.0329 11 S 4.1643 7.9916 115.2643 61.4754 63.1413 176.7030 12 S 3.9514 8.2957 118.9508 61.1914 62.4999 175.9946 13 D 4.2787 8.4633 121.4739 57.3864 40.8108 178.7753 14 V 3.7077 7.6923 117.8905 64.2513 31.2989 177.2568 15 Q 4.4196 7.4137 116.3243 54.8576 29.0907 175.9143 16 G 3.9024 8.1429 108.3124 46.2978 0.0000 173.5695 17 K 4.7062 7.8261 117.8516 54.1261 34.3677 176.1851 18 Y 4.1870 8.5526 119.6005 57.1973 38.6445 175.6615 19 L 4.0769 8.4589 121.9229 55.1243 42.1158 177.8969 20 D 4.8328 8.3949 125.1682 52.6106 43.1084 176.5519 21 T 3.8250 8.3700 114.4790 67.1978 68.6060 176.1668 22 A 3.9710 8.1346 121.8868 55.1899 18.3208 179.3206 23 A 3.9286 8.4230 119.0141 55.4502 18.4433 179.8641 24 L 3.9801 8.0859 117.4980 58.0950 41.7009 179.7211 25 E 4.0276 8.5897 118.7110 59.0058 29.3093 179.6824 26 K 3.9887 7.8509 118.3776 59.3934 32.2014 179.2635 27 L 3.7658 8.0040 119.3096 57.7964 41.5148 179.8546 28 K 4.2469 8.4750 118.7319 59.5119 31.7516 179.3426 29 S 4.1162 7.9145 112.6598 61.3891 62.5422 175.4464 30 Y 4.1458 7.9870 122.2230 60.7179 38.5566 177.6184 31 F 4.3997 7.8050 119.0021 60.7470 38.8725 177.7404 32 S 4.3357 8.3374 112.3211 60.3945 63.1436 175.3486 33 T 4.4754 7.6382 112.4032 61.4349 69.3779 176.2270 34 G 3.5276 7.4284 109.5114 48.1675 0.0000 175.1311 35 E 3.9238 8.0671 121.1197 58.9322 29.5954 178.5479 36 L 3.9691 7.7954 119.8179 58.1105 42.2013 178.9615 37 R 3.8955 7.9434 118.1135 59.1691 29.9251 179.1959 38 V 3.5621 7.8161 117.9664 65.9191 31.5756 177.9839 39 R 3.8417 8.0034 118.1520 59.5042 29.8992 178.2825 40 A 4.0136 8.3101 120.5639 55.1361 18.3491 179.4507 41 A 3.9492 8.2291 119.3424 55.6393 18.4201 180.0354 42 T 3.8656 8.2753 114.5993 66.9246 68.2527 177.2076 43 T 3.8702 7.8119 116.6980 66.6941 68.8866 176.5689 44 I 3.8563 8.0954 121.8246 64.4413 36.9372 178.2126 45 A 3.9802 7.8151 119.9996 55.2611 18.2716 179.1815 46 A 4.2186 7.7910 116.9381 53.7594 18.7579 177.9136 47 N 4.8797 7.8963 113.6027 52.7335 39.9671 176.0078 48 A 3.9861 8.3963 122.0648 55.7207 18.1413 180.3559 49 A 3.9553 7.9897 118.0187 55.0784 18.5122 179.5148 50 A 3.9338 7.9490 118.8559 55.3012 18.5315 179.6691 51 I 3.6412 7.9095 118.3497 64.6167 37.1531 178.8155 52 V 3.5847 7.6126 118.4599 65.7624 31.3568 177.8204 53 K 3.8991 8.3092 119.6128 59.7126 32.1092 178.4191 54 E 3.9701 8.3819 119.2628 58.9465 29.5694 178.6468 55 A 3.9260 8.1641 121.0025 55.1206 18.4789 179.6158 56 V 3.4567 8.0374 116.8390 66.1181 31.3335 177.8852 57 A 4.0483 7.8142 119.0243 55.4379 18.3436 179.6096 58 K 4.1800 8.1060 115.4466 58.3572 32.3981 178.0952 59 S 4.7375 8.2567 111.2422 57.4686 64.6384 175.5248 60 L 4.4778 8.2779 119.4296 55.6384 43.9797 177.3786 61 L 3.9929 7.7861 116.4995 55.7810 42.0735 175.6404 62 Y 3.6819 7.9670 115.8878 59.3144 35.3165 169.5735 63 S 4.8302 7.4504 112.1102 56.5888 66.7109 174.0421 64 D 4.5169 8.5729 118.3190 57.3120 40.8462 179.1178 65 I 3.7218 7.5814 119.7167 64.3768 37.0499 177.3723 66 T 4.2910 7.7437 107.5510 62.7693 69.5493 175.0671 67 R 4.3149 7.4625 120.6303 54.3060 31.1225 173.9596 68 P 2.9700 0.0000 0.0000 63.9221 31.4511 176.2823 69 G 4.1699 8.8558 111.0725 45.7785 0.0000 174.2455 70 G 4.7536 7.8043 113.1999 44.9663 0.0000 175.6747 *72 M 4.3377 8.6476 125.0618 54.3591 33.4122 174.6696 73 Y 4.2850 7.6849 120.7452 58.4277 39.8608 174.2434 74 T 3.0165 7.2132 116.2600 62.1048 69.1862 172.8931 75 T 3.7859 8.2233 114.9289 64.8115 68.6804 176.5706 76 R 3.8391 7.8042 121.0160 59.5008 30.1403 178.6225 77 R 3.9876 7.8149 117.5143 59.0136 30.0668 178.2489 78 Y 3.8678 8.1432 119.2462 60.8281 38.8270 178.1339 79 A 4.1345 8.4072 121.4122 55.1801 18.4110 179.4962 80 A 3.9367 7.8827 118.9206 55.2810 18.4498 179.4067 81 C 3.9828 8.2947 117.6814 62.6821 31.7303 175.9750 82 I 3.7681 7.7593 114.3303 63.5620 37.1517 178.1534 83 R 3.6970 7.9317 121.1020 59.2518 29.7977 178.0655 84 D 4.4107 7.9588 118.7160 57.4909 40.8222 178.7656 85 L 4.1871 7.8870 119.3542 58.0133 41.5895 179.3481 86 D 4.3390 8.0520 118.8238 57.4092 40.6615 178.4664 87 Y 4.3486 7.5369 116.9716 61.4200 37.9244 177.9140 88 Y 4.7064 8.0072 117.7981 61.3703 38.0750 178.7845 89 L 4.2292 8.4056 121.0079 58.3849 42.3007 178.9894 90 R 3.5641 8.0863 118.5939 59.5241 29.8835 178.1243 91 Y 3.9575 8.4711 116.7859 60.8719 37.8503 178.0441 92 A 3.9699 8.5872 122.2267 55.2538 18.3418 179.9159 93 T 3.7176 7.7327 114.4680 66.7881 68.4254 176.4996 94 Y 4.3116 7.7081 118.3938 61.1955 37.8691 178.6214 95 A 3.7836 8.0883 121.5979 55.2154 18.1600 179.2895 96 M 3.5952 7.4566 115.6223 58.5356 32.3744 177.8956 97 L 4.0959 7.7454 119.0816 58.2109 42.6190 178.5985 98 A 4.2025 8.3664 120.6863 52.5851 18.1081 177.9837 99 G 4.0419 8.7198 105.2304 46.0844 0.0000 173.1085 100 D 4.5653 7.4774 116.1372 52.4505 44.1849 172.8573 101 P 4.4625 0.0000 0.0000 62.8394 31.9032 177.7443 102 S 4.0918 8.6841 117.2325 62.0024 62.5803 176.2153 103 I 3.6457 7.7524 121.5666 63.6925 37.5377 177.7995 104 L 3.9829 7.8509 120.0065 57.8716 41.3087 179.1022 105 D 4.3997 8.0576 117.0681 57.5043 40.9345 178.2104 106 E 4.1797 8.4233 118.3001 58.1845 29.6957 178.3031 107 R 4.4626 8.1301 114.8708 55.6513 31.4726 175.5032 108 V 3.9644 7.2035 115.8612 64.3864 33.7198 177.1859 109 L 3.9539 8.2181 118.7994 56.3018 41.6827 174.7234 110 N 4.6822 7.1545 118.5378 54.0701 38.0967 173.9928 111 G 4.2484 8.5063 107.2507 45.7121 0.0000 172.8518 112 L 3.6744 7.7549 123.4956 57.5588 41.8655 178.7041 113 K 3.7679 7.9621 119.0762 59.9454 32.1076 178.3303 114 E 4.0516 7.9445 117.9346 59.4570 29.5024 179.1065 115 T 3.9141 8.0300 115.9425 66.8003 68.4462 176.0992 116 Y 4.4673 8.1795 118.6209 61.4436 37.7640 178.2807 117 N 4.3608 8.0700 116.1213 56.5350 38.7596 177.2632 118 S 4.2976 8.4170 114.6609 61.5443 63.2370 176.1922 119 L 4.2814 8.0591 120.7082 55.1888 41.5292 178.0646 120 G 3.8516 8.0245 107.0052 45.1885 0.0000 173.4202 121 V 3.5698 7.4893 119.6925 61.1326 31.9216 174.5373 122 P 4.3114 0.0000 0.0000 62.9831 32.0302 177.0551 123 I 3.7934 8.3724 124.4410 64.2384 37.2817 178.2736 124 S 4.1029 8.1232 114.4552 61.5920 62.6448 176.3092 125 A 3.9493 7.8978 123.9164 55.0191 18.2223 179.5061 126 T 3.8177 7.7711 113.9273 66.7980 68.4589 176.9950 127 V 3.5685 8.1796 120.4882 66.0801 31.4551 177.9864 128 Q 3.9523 8.2937 117.6355 58.9033 28.4577 178.8163 129 A 4.2121 7.8974 122.9803 54.7865 18.3814 179.7631 130 I 3.5893 7.7784 118.3056 64.5616 37.2509 178.7092 131 Q 3.8605 8.4048 119.0537 58.8351 28.5166 178.7272 132 A 3.9493 8.0948 121.9705 55.4114 18.3883 179.5119 133 M 3.8447 8.0811 117.5305 58.2265 31.8658 178.7993 134 K 3.3760 7.5066 119.8117 59.4328 32.3894 178.7169 135 E 3.9214 7.8777 118.2519 59.3009 29.2577 179.5249 136 V 3.5584 7.8294 118.2461 66.2485 31.5469 178.0746 137 T 3.8884 8.2859 115.6331 66.7653 68.3907 176.2178 138 A 4.0590 8.2429 122.6325 55.5363 18.1290 179.8410 139 S 4.1079 7.8268 112.3541 61.4863 62.9211 176.5773 140 L 4.1081 7.5222 121.9132 58.3337 42.1671 179.0604 141 V 3.9174 7.9998 110.2601 61.4529 32.0417 176.6939 142 G 3.9721 7.9939 104.8981 44.1103 0.0000 172.5680 143 P 4.2368 0.0000 0.0000 65.7991 31.1806 178.5930 144 D 4.3504 8.0765 116.3878 57.6882 40.9220 178.9304 145 A 4.1885 8.0656 120.6723 54.9378 18.4496 179.7731 146 G 3.6156 8.4533 104.9127 47.7584 0.0000 176.1829 147 K 4.0078 8.4943 121.3309 59.3192 31.8417 179.0100 148 E 3.9670 8.1530 119.4849 59.7053 29.4912 178.8182 149 M 4.2628 8.4924 118.9358 58.2682 31.9296 178.9077 150 G 3.8539 8.3337 105.9781 47.6917 0.0000 175.8771 151 V 3.4462 7.3861 120.3279 66.2123 31.4829 177.7238 152 Y 4.2707 7.1011 115.9936 60.5000 37.6989 178.1229 153 F 4.3875 8.3183 119.0580 60.9086 39.0456 177.4386 154 D 4.4141 8.6018 118.7699 57.3742 40.5205 178.2920 155 Y 3.8982 8.1274 120.1321 60.7164 38.6097 178.2247 156 I 3.7360 7.7812 119.3346 64.6436 37.5282 177.8171 157 C 4.1988 8.2305 117.5263 62.9647 27.8218 176.3324 158 S 4.1358 8.3560 117.0791 61.6233 62.2406 177.0556 159 G 3.5683 7.7211 106.4675 46.9131 0.0000 174.8546 160 L 4.3396 7.4276 120.0157 56.4021 42.2317 176.7594 161 S 4.3064 7.6524 118.9501 58.7249 62.8096 173.8275 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 M 8.30 4.48 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.52 0.00 2 Q 8.90 4.41 0.00 1.94 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.69 0.00 0.00 0.00 0.00 0.00 2.22 2.32 0.00 3 D 8.82 4.76 0.00 2.80 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 4 A 8.33 3.73 0.66 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 0.00 0.00 5 I 7.08 3.47 1.87 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.84 0.89 0.00 0.00 6 T 8.42 3.83 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 1.16 0.00 0.00 7 A 7.99 4.06 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 8 V 7.37 3.59 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 1.26 0.00 0.00 0.91 0.00 0.00 9 I 7.78 3.64 1.97 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 1.38 0.57 0.87 0.00 0.00 10 N 8.47 4.27 0.00 2.88 2.78 0.00 0.00 7.04 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 11 S 7.99 4.16 0.00 4.12 4.09 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 12 S 8.30 3.95 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 13 D 8.46 4.28 0.00 2.80 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 14 V 7.69 3.71 2.07 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 0.87 0.00 0.00 0.92 0.00 0.00 15 Q 7.41 4.42 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.60 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 16 G 8.14 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 17 K 7.83 4.71 0.00 1.77 1.78 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.54 7.81 18 Y 8.55 4.19 0.00 2.88 2.95 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 0.00 0.00 0.00 19 L 8.46 4.08 0.00 1.70 1.67 0.96 1.03 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 20 D 8.39 4.83 0.00 2.96 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 21 T 8.37 3.83 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 1.28 0.00 0.00 22 A 8.13 3.97 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.42 3.93 1.44 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 0.00 0.00 24 L 8.09 3.98 0.00 1.89 1.78 0.99 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 25 E 8.59 4.03 0.00 2.11 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 2.57 2.51 0.00 26 K 7.85 3.99 0.00 2.01 1.81 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.69 7.81 27 L 8.00 3.77 0.00 1.86 1.64 0.95 0.50 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 28 K 8.48 4.25 0.00 2.00 1.95 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.59 1.73 7.81 29 S 7.91 4.12 0.00 4.04 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 30 Y 7.99 4.15 0.00 2.96 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 31 F 7.81 4.40 0.00 3.30 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 32 S 8.34 4.34 0.00 4.05 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 33 T 7.64 4.48 4.19 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 1.27 0.00 0.00 34 G 7.43 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.07 3.92 0.00 2.07 1.94 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 2.37 2.42 0.00 36 L 7.80 3.97 0.00 1.70 1.82 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.94 3.90 0.00 2.01 1.96 0.00 2.93 0.00 0.00 3.47 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 38 V 7.82 3.56 2.21 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 1.09 0.00 0.00 0.95 0.00 0.00 39 R 8.00 3.84 0.00 2.11 1.91 0.00 3.16 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 40 A 8.31 4.01 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 41 A 8.23 3.95 1.42 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 0.00 0.00 0.00 42 T 8.28 3.87 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 1.22 0.00 0.00 43 T 7.81 3.87 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 1.27 0.00 0.00 44 I 8.10 3.86 1.88 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 1.53 1.05 0.95 0.00 0.00 45 A 7.82 3.98 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 7.79 4.22 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 47 N 7.90 4.88 0.00 2.91 2.79 0.00 0.00 6.67 6.37 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 48 A 8.40 3.99 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 49 A 7.99 3.96 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 50 A 7.95 3.93 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 51 I 7.91 3.64 2.05 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.78 0.94 0.00 0.00 52 V 7.61 3.58 2.22 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 1.13 0.00 0.00 1.09 0.00 0.00 53 K 8.31 3.90 0.00 1.96 1.98 0.00 1.71 0.00 0.00 1.59 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.78 3.59 1.93 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.74 0.93 0.00 0.00 131 Q 8.40 3.86 0.00 2.23 2.10 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 2.51 2.50 0.00 132 A 8.09 3.95 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 0.00 133 M 8.08 3.84 0.00 1.66 1.94 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 134 K 7.51 3.38 0.00 1.45 1.86 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.69 7.81 135 E 7.88 3.92 0.00 2.14 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 2.48 2.43 0.00 136 V 7.83 3.56 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 1.08 0.00 0.00 0.94 0.00 0.00 137 T 8.29 3.89 4.58 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 1.42 0.00 0.00 138 A 8.24 4.06 1.43 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 0.00 139 S 7.83 4.11 0.00 4.05 3.95 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 0.00 0.00 0.00 140 L 7.52 4.11 0.00 1.60 1.92 0.94 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 141 V 8.00 3.92 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 0.82 0.00 0.00 1.10 0.00 0.00 142 G 7.99 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 0.00 143 P 0.00 4.24 0.00 2.18 2.13 0.00 3.63 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 144 D 8.08 4.35 0.00 2.70 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 0.00 145 A 8.07 4.19 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 0.00 146 G 8.45 3.62 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 0.00 0.00 0.00 147 K 8.49 4.01 0.00 2.08 1.89 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.46 7.81 148 E 8.15 3.97 0.00 2.15 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 0.00 2.42 2.61 0.00 149 M 8.49 4.26 0.00 2.15 2.31 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.86 0.00 150 G 8.33 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 0.00 151 V 7.39 3.45 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.84 0.00 0.00 152 Y 7.10 4.27 0.00 2.80 2.92 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 0.00 153 F 8.32 4.39 0.00 3.14 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 0.00 154 D 8.60 4.41 0.00 2.82 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 0.00 155 Y 8.13 3.90 0.00 3.29 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 0.00 156 I 7.78 3.74 2.07 0.00 0.00 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 1.64 0.98 0.61 0.00 0.00 157 C 8.23 4.20 0.00 3.11 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 0.00 158 S 8.36 4.14 0.00 3.73 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 0.00 159 G 7.72 3.57 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 0.00 0.00 0.00 160 L 7.43 4.34 0.00 1.80 1.76 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 161 S 7.65 4.31 0.00 3.88 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 * Residues marked with a * may have inaccurate shift predictions.