NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 P 4.4589 0.0000 0.0000 62.3460 33.0386 175.9216 14 Q 4.2924 8.0354 117.7990 54.5922 30.0287 175.9023 15 K 4.1772 8.8553 121.7395 59.4204 34.4535 177.1464 16 Q 4.4114 7.9917 114.7708 56.5734 29.1263 177.1703 17 I 3.9226 7.2969 118.4032 63.6146 37.7675 176.9429 18 Q 4.2642 7.8591 119.3430 57.5151 29.3309 177.3908 19 E 4.1563 7.9815 117.8287 58.3108 30.0130 177.7188 20 M 4.4414 8.0994 117.3713 56.9651 32.3427 177.5583 21 K 3.8309 7.6989 118.2607 57.9327 32.6936 177.5499 22 E 4.1588 7.9830 119.0387 57.9000 29.6923 176.2590 23 A 4.5257 8.3215 120.4529 52.5025 20.6532 177.3820 24 F 5.0634 7.9940 122.8978 59.3895 41.5198 176.6767 25 S 4.0710 8.0524 115.7687 60.9395 62.7135 174.7867 26 M 4.4408 7.7346 117.2272 55.5675 33.3165 177.3490 27 I 3.8565 7.7610 119.2440 64.5763 37.6695 177.7337 28 D 4.5247 7.6647 120.1017 53.4682 40.8104 178.1212 29 V 3.4995 8.0285 120.3080 66.0134 31.5268 175.9753 30 D 4.5971 8.0398 114.8635 52.3533 39.6148 176.1371 31 R 4.1529 8.1058 118.6300 56.2040 27.4520 175.4159 32 D 4.6522 9.6599 117.4080 52.3405 40.8077 176.9877 33 G 3.9806 8.6586 107.5412 47.1068 0.0000 173.7725 *34 F 4.5987 7.3108 114.4849 56.1078 42.2343 176.8227 35 V 4.9745 8.0456 117.0037 62.3429 33.0048 174.2844 36 S 4.2997 8.7398 122.2014 57.7955 62.7934 174.5247 37 K 4.0973 8.7204 125.3009 58.7093 31.9921 177.1033 38 E 4.7036 7.8191 111.4608 55.4796 32.4401 182.3395 39 D 4.4294 8.2400 116.9170 58.2807 41.1312 178.3040 40 I 3.7722 7.8520 122.0925 65.1191 37.2400 179.1516 41 K 4.1305 7.9980 123.3439 59.1590 31.5700 180.7750 42 A 4.1675 7.9919 120.1083 55.7135 18.1391 179.5860 43 I 3.6573 7.3699 115.5917 64.0902 38.3321 177.8103 44 S 4.2999 8.3020 116.6257 62.1103 62.3337 176.7066 45 E 4.0781 8.5289 121.3868 60.8464 29.2396 179.9743 46 Q 4.4483 8.0245 119.3595 58.3662 29.1496 176.8629 47 L 4.7425 7.6263 115.6415 55.5643 46.1191 182.5954 48 G 3.9146 8.9688 105.0347 45.9133 0.0000 175.0779 49 R 4.6001 9.1644 115.0239 53.9847 33.6162 177.0076 50 A 4.7370 8.1555 119.1349 50.5489 20.4909 175.1291 51 P 4.4349 0.0000 0.0000 62.6255 32.4110 176.3450 52 D 4.5682 8.3487 120.0753 54.4116 41.5758 177.2222 53 D 4.4210 8.5515 120.6832 56.6167 41.5016 177.8067 54 K 4.2889 8.1541 119.0491 57.6859 32.4083 177.9114 55 E 4.6260 8.0778 116.7102 56.0579 30.0946 182.1332 56 L 4.7351 8.0521 119.7201 55.9870 43.8920 182.1854 57 T 4.3096 7.8551 113.4463 65.5772 69.3455 176.5822 58 A 4.2375 7.5865 121.8595 54.2980 18.4477 177.6605 59 M 4.5819 7.9243 116.7232 55.3248 32.7647 178.1456 60 L 4.0370 8.2188 121.1304 56.9226 41.0339 182.4339 61 K 4.5287 7.9674 114.6272 56.9859 31.8876 176.3360 62 E 4.6248 7.8882 118.7955 55.9902 29.9985 176.4214 63 A 4.6784 7.6243 117.9102 48.8771 19.2118 175.6321 64 P 4.4231 0.0000 0.0000 60.6841 30.3762 175.6750 65 G 3.3085 8.4708 102.3520 44.0273 0.0000 170.0623 66 P 3.3756 0.0000 0.0000 63.8330 31.4003 176.9526 67 L 4.4387 8.3633 117.9560 55.4031 46.3170 171.2850 68 N 4.8251 7.7700 127.4048 52.8643 40.8726 176.4030 69 F 4.0011 8.3477 122.7429 61.0599 39.8028 176.5210 70 T 3.6317 7.1949 115.5093 63.3468 68.6979 174.9372 71 M 4.6083 7.4008 120.9304 55.0608 35.4312 176.9985 *72 F 3.9202 7.0388 119.7855 61.6279 38.5392 183.0562 73 L 4.1130 7.0897 119.0887 57.7097 41.3111 179.1514 74 S 4.4959 7.6125 110.1793 59.3698 63.1152 174.1481 75 I 4.5349 7.1236 121.2736 61.3414 37.7494 175.8977 76 F 4.7767 8.1472 119.3094 57.8699 40.9513 177.1405 77 S 4.5529 8.2960 114.1220 59.0576 62.1015 174.0115 78 D 4.6927 8.1287 122.9626 54.8743 42.4698 177.6088 79 K 4.3443 8.0196 119.8945 56.1786 33.1645 182.9571 80 L 4.4736 7.8648 116.2880 54.7715 41.2990 176.1183 81 S 4.5133 7.5917 114.5742 58.7753 62.7539 173.2169 82 G 4.0256 8.7607 117.5404 45.9009 0.0000 172.9281 83 T 4.4454 7.7444 113.8046 60.5227 68.8767 173.2027 84 D 5.0650 8.1011 123.6054 51.6040 44.0880 177.5705 85 S 4.3956 8.3081 115.5876 59.0340 64.3798 173.8435 86 E 3.9688 8.6817 119.4732 58.5140 29.4757 177.7632 87 E 4.1884 8.0953 117.8409 58.6303 29.9364 177.9302 88 T 4.0989 7.7170 116.0446 66.3957 68.4597 176.8298 89 I 3.9388 7.4763 121.5823 64.1212 37.0529 177.8211 90 R 4.5519 7.7057 115.5108 57.2223 29.7722 176.2686 91 N 4.9636 8.0775 115.2742 53.8040 41.6541 176.6167 92 A 3.9816 7.8468 119.9171 55.2092 18.2560 179.7233 93 F 4.2665 8.3739 115.9588 60.1333 38.7585 177.1294 94 A 4.1412 7.5071 118.3792 53.5370 18.4705 178.3386 95 M 4.1679 7.5854 116.0226 55.6466 32.2458 176.4810 96 F 4.9250 7.6600 117.8669 56.9028 40.7342 175.7183 97 D 4.8494 7.8941 119.2525 53.4117 41.1887 176.1382 98 E 3.9922 8.2081 116.6668 58.7956 29.2506 179.4885 99 Q 4.4561 8.2359 114.6041 55.4789 28.9259 175.4637 100 E 4.1187 8.1836 116.7397 57.6132 27.6231 175.6857 101 T 4.1995 7.8258 106.9599 61.5877 69.4702 174.6309 102 K 4.4094 8.6254 120.1072 56.2921 30.0679 175.4177 103 K 4.9268 8.5540 115.1737 55.8123 36.1159 175.4500 104 L 4.9068 8.9471 124.6495 53.4286 44.4886 176.0182 105 N 4.9189 8.7730 118.2272 53.1405 40.0701 176.4664 106 I 3.6166 8.6823 120.8234 64.6184 38.1723 178.3318 107 E 3.9282 8.1632 118.7881 59.3056 29.1870 178.6941 108 Y 4.2827 7.8843 119.3672 60.7980 39.0415 177.3076 109 I 3.0818 7.4128 118.9615 63.7043 37.9181 177.9027 110 K 3.7892 7.7161 119.2273 59.4902 31.8128 178.5918 111 D 4.2557 8.0590 118.1019 57.4361 40.8563 178.1140 112 L 3.7260 8.1746 119.5814 57.9480 41.5188 179.5932 113 L 3.6833 7.9672 118.8476 57.0467 41.3816 178.8632 114 E 4.0889 8.3168 118.8522 57.8936 29.7898 176.7491 115 N 4.8826 8.1297 113.2080 53.0383 38.1935 173.5267 116 M 4.8321 7.1396 118.3347 53.8477 37.1873 176.0978 117 G 3.7362 8.2423 107.8913 47.5709 0.0000 176.7731 118 D 4.6183 8.9713 118.4162 56.4910 39.4486 175.8552 119 N 4.1706 7.6792 114.0527 48.9691 37.5523 176.4139 120 F 5.0451 8.9895 123.4825 57.6269 40.1359 174.7534 121 N 4.9328 8.9451 118.6517 51.5373 39.6918 176.3706 122 K 4.1019 8.6515 119.1295 60.0424 32.0885 178.5803 123 D 4.3377 8.1984 118.6682 57.2228 40.9943 178.1222 124 E 3.7969 8.7055 119.0036 60.3426 29.4381 179.3927 125 M 4.3983 8.4064 118.5444 58.1652 31.8760 178.3502 126 R 3.9898 8.0667 119.1132 60.3093 30.0520 178.1159 127 M 4.2836 8.7899 118.2850 58.2359 31.8936 178.8329 128 T 3.7930 8.0517 115.6456 66.1085 69.1124 176.1464 129 F 4.5525 8.2344 117.9495 57.9608 39.0972 177.5189 130 K 4.0302 7.5041 119.5703 58.7523 31.9155 176.6118 131 E 4.6276 7.8321 115.7849 55.5048 30.2745 174.8396 132 A 4.5281 7.8456 119.0469 50.7747 19.6175 176.8640 133 P 4.4244 0.0000 0.0000 62.5396 32.1234 175.2530 134 V 4.8670 8.4155 127.1995 61.8276 34.3046 174.8967 135 E 4.5910 8.9144 124.1734 55.3330 32.5670 172.9264 136 G 4.3014 9.8799 113.6940 45.6773 0.0000 173.4234 137 G 4.0609 8.3447 110.1239 45.3246 0.0000 173.6205 138 K 4.9912 7.9898 123.3633 53.9685 33.9895 180.0233 139 F 5.0499 9.3125 128.0903 56.0330 41.2035 174.2366 140 D 4.5746 8.1694 127.0813 53.4703 41.1146 176.4232 141 Y 3.7241 8.3633 126.0672 59.2235 38.3388 177.4890 142 V 3.4297 6.8953 120.5151 65.6159 31.8630 177.4665 143 K 3.8000 9.6450 120.0522 59.4630 32.2543 178.4630 144 F 3.8766 8.0652 120.9327 61.6440 38.9370 176.9865 145 T 4.0344 7.8537 113.9971 66.7868 68.5298 175.9025 146 A 4.0929 7.7949 121.8796 55.2750 18.2813 178.9516 147 M 3.7894 7.6034 116.1956 59.1968 32.0312 178.6065 148 I 3.7532 7.1491 117.0468 62.9557 36.9288 176.9424 149 K 4.4150 7.9829 118.9993 55.6950 32.5663 177.4560 150 G 4.0681 7.8878 106.0421 46.1600 0.0000 174.9874 151 S 4.4634 7.6055 113.9833 58.6529 63.6299 175.0221 152 G 4.2333 7.8013 112.0008 45.8342 0.0000 172.8106 153 E 4.7089 8.3466 118.3700 54.0391 33.8590 172.5916 154 E 4.1802 8.7081 120.1509 56.2934 29.6458 176.7407 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 13 P 0.00 4.46 0.00 2.06 2.08 0.00 3.59 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 1.92 2.09 0.00 14 Q 8.04 4.29 0.00 1.99 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.88 0.00 0.00 0.00 0.00 0.00 2.25 1.98 0.00 15 K 8.86 4.18 0.00 1.79 1.84 0.00 1.68 0.00 0.00 1.88 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.43 7.81 16 Q 7.99 4.41 0.00 2.32 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.71 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 17 I 7.30 3.92 2.05 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 1.30 0.56 0.95 0.00 0.00 18 Q 7.86 4.26 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 19 E 7.98 4.16 0.00 2.02 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 0.00 2.40 2.34 0.00 20 M 8.10 4.44 0.00 2.16 2.43 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.64 0.00 21 K 7.70 3.83 0.00 0.79 1.79 0.00 1.13 0.00 0.00 1.36 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.16 0.65 7.81 22 E 7.98 4.16 0.00 2.20 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 2.35 2.36 0.00 23 A 8.32 4.53 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 24 F 7.99 5.06 0.00 3.18 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 25 S 8.05 4.07 0.00 4.22 3.86 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 26 M 7.73 4.44 0.00 1.96 2.10 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 2.50 2.58 0.00 27 I 7.76 3.86 2.05 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.44 1.02 0.00 0.00 28 D 7.66 4.52 0.00 2.37 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 0.00 0.00 0.00 0.00 29 V 8.03 3.50 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 1.03 0.00 0.00 30 D 8.04 4.60 0.00 2.80 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 31 R 8.11 4.15 0.00 1.89 1.90 0.00 3.05 0.00 0.00 3.09 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 32 D 9.66 4.65 0.00 2.71 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 33 G 8.66 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 *34 F 7.31 4.60 0.00 2.33 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 0.00 0.00 0.00 0.00 35 V 8.05 4.97 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 1.05 0.00 0.00 1.03 0.00 0.00 36 S 8.74 4.30 0.00 3.90 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 37 K 8.72 4.10 0.00 1.77 1.83 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.57 7.81 38 E 7.82 4.70 0.00 1.88 1.85 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 2.19 1.82 0.00 39 D 8.24 4.43 0.00 2.90 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 40 I 7.85 3.77 1.90 0.00 0.00 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 1.54 0.60 0.95 0.00 0.00 41 K 8.00 4.13 0.00 1.76 1.82 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.07 7.81 42 A 7.99 4.17 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 43 I 7.37 3.66 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.75 0.99 0.00 0.00 44 S 8.30 4.30 0.00 4.09 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 45 E 8.53 4.08 0.00 1.98 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 2.24 2.19 0.00 46 Q 8.02 4.45 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.71 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 47 L 7.63 4.74 0.00 1.78 1.47 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.97 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 49 R 9.16 4.60 0.00 1.80 1.69 0.00 3.22 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.15 0.00 50 A 8.16 4.74 1.23 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 51 P 0.00 4.43 0.00 2.06 2.01 0.00 3.69 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 52 D 8.35 4.57 0.00 2.71 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 53 D 8.55 4.42 0.00 2.76 2.65 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 54 K 8.15 4.29 0.00 1.86 1.82 0.00 1.69 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.43 7.81 55 E 8.08 4.63 0.00 2.01 1.81 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 2.17 2.10 0.00 56 L 8.05 4.74 0.00 1.61 1.56 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 57 T 7.86 4.31 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 1.22 0.00 0.00 58 A 7.59 4.24 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 59 M 7.92 4.58 0.00 2.07 2.06 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 2.70 2.49 0.00 60 L 8.22 4.04 0.00 1.61 1.61 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 61 K 7.97 4.53 0.00 1.72 1.85 0.00 1.56 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.48 7.81 62 E 7.89 4.62 0.00 1.85 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 2.24 2.22 0.00 63 A 7.62 4.68 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 64 P 0.00 4.42 0.00 2.04 2.05 0.00 3.68 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 65 G 8.47 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 0.00 0.00 0.00 66 P 0.00 3.38 0.00 2.07 1.85 0.00 3.73 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 67 L 8.36 4.44 0.00 1.54 1.52 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 68 N 7.77 4.83 0.00 2.76 2.73 0.00 0.00 6.72 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 69 F 8.35 4.00 0.00 1.51 1.45 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 70 T 7.19 3.63 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 1.02 0.00 0.00 71 M 7.40 4.61 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.65 0.00 *72 F 7.04 3.92 0.00 2.49 2.18 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 73 L 7.09 4.11 0.00 1.35 1.53 0.14 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 74 S 7.61 4.50 0.00 3.97 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 75 I 7.12 4.53 2.08 0.00 0.00 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 1.43 0.78 1.09 0.00 0.00 76 F 8.15 4.78 0.00 3.29 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 77 S 8.30 4.55 0.00 3.87 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 78 D 8.13 4.69 0.00 2.62 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 79 K 8.02 4.34 0.00 1.71 1.77 0.00 1.86 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.28 1.25 7.81 80 L 7.86 4.47 0.00 1.65 1.73 0.98 0.80 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 81 S 7.59 4.51 0.00 3.96 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 82 G 8.76 4.03 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 0.00 0.00 0.00 83 T 7.74 4.45 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 1.22 0.00 0.00 84 D 8.10 5.07 0.00 2.68 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 85 S 8.31 4.40 0.00 4.07 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 86 E 8.68 3.97 0.00 2.08 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 2.37 2.40 0.00 87 E 8.10 4.19 0.00 2.04 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 2.31 2.44 0.00 88 T 7.72 4.10 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 1.23 0.00 0.00 89 I 7.48 3.94 2.03 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.76 1.23 0.00 0.00 90 R 7.71 4.55 0.00 1.99 2.36 0.00 3.42 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.85 0.00 91 N 8.08 4.96 0.00 3.07 2.82 0.00 0.00 6.94 7.19 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 92 A 7.85 3.98 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 93 F 8.37 4.27 0.00 3.16 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 0.00 0.00 0.00 0.00 94 A 7.51 4.14 1.48 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 0.00 0.00 95 M 7.59 4.17 0.00 1.45 1.94 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.41 0.00 96 F 7.66 4.93 0.00 2.82 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 97 D 7.89 4.85 0.00 2.78 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 98 E 8.21 3.99 0.00 2.02 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 2.24 1.92 0.00 99 Q 8.24 4.46 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.27 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 100 E 8.18 4.12 0.00 2.10 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 2.33 2.27 0.00 101 T 7.83 4.20 4.32 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 1.26 0.00 0.00 102 K 8.63 4.41 0.00 1.87 1.71 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.47 7.81 103 K 8.55 4.93 0.00 1.69 1.80 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.39 1.43 7.81 104 L 8.95 4.91 0.00 1.74 1.62 0.84 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 105 N 8.77 4.92 0.00 2.85 2.79 0.00 0.00 6.53 7.02 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 0.00 106 I 8.68 3.62 2.04 0.00 0.00 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 1.47 1.05 0.95 0.00 0.00 107 E 8.16 3.93 0.00 2.01 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 2.37 2.29 0.00 108 Y 7.88 4.28 0.00 2.91 3.07 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 0.00 109 I 7.41 3.08 1.37 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.87 0.55 0.00 0.00 110 K 7.72 3.79 0.00 1.85 1.60 0.00 0.99 0.00 0.00 1.32 0.00 0.00 2.64 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.30 0.72 7.81 111 D 8.06 4.26 0.00 2.80 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 0.00 112 L 8.17 3.73 0.00 1.30 1.11 -0.90 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 113 L 7.97 3.68 0.00 1.35 0.63 0.87 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.32 4.09 0.00 2.06 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 2.34 2.42 0.00 115 N 8.13 4.88 0.00 2.68 2.77 0.00 0.00 6.80 8.26 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 0.00 116 M 7.14 4.83 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 117 G 8.24 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 0.00 118 D 8.97 4.62 0.00 2.72 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 0.00 119 N 7.68 4.17 0.00 2.79 3.03 0.00 0.00 6.89 7.33 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 0.00 120 F 8.99 5.05 0.00 2.83 2.97 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 0.00 121 N 8.95 4.93 0.00 2.87 2.95 0.00 0.00 7.20 6.95 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 0.00 122 K 8.65 4.10 0.00 1.89 1.94 0.00 1.57 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.67 7.81 123 D 8.20 4.34 0.00 2.89 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 0.00 124 E 8.71 3.80 0.00 1.70 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 2.12 2.49 0.00 125 M 8.41 4.40 0.00 2.23 2.37 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 3.04 0.00 126 R 8.07 3.99 0.00 2.13 2.13 0.00 3.28 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.76 0.00 127 M 8.79 4.28 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.58 0.00 128 T 8.05 3.79 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 1.20 0.00 0.00 129 F 8.23 4.55 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 0.00 130 K 7.50 4.03 0.00 1.81 2.07 0.00 1.77 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.51 7.81 131 E 7.83 4.63 0.00 1.92 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 2.30 2.32 0.00 132 A 7.85 4.53 1.60 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 0.00 0.00 133 P 0.00 4.42 0.00 2.01 2.18 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.90 0.00 134 V 8.42 4.87 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 0.88 0.00 0.00 1.19 0.00 0.00 135 E 8.91 4.59 0.00 1.94 1.77 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 2.13 2.08 0.00 136 G 9.88 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 0.00 137 G 8.34 4.06 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 0.00 0.00 0.00 138 K 7.99 4.99 0.00 1.47 1.69 0.00 1.80 0.00 0.00 1.57 0.00 0.00 2.76 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.32 1.25 7.81 139 F 9.31 5.05 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 0.00 140 D 8.17 4.57 0.00 2.65 2.31 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 0.00 141 Y 8.36 3.72 0.00 2.10 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 0.00 142 V 6.90 3.43 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 0.92 0.00 0.00 0.31 0.00 0.00 143 K 9.64 3.80 0.00 1.58 1.73 0.00 1.62 0.00 0.00 1.51 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.37 7.81 144 F 8.07 3.88 0.00 2.58 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 0.00 145 T 7.85 4.03 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 1.34 0.00 0.00 146 A 7.79 4.09 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 0.00 147 M 7.60 3.79 0.00 1.88 1.89 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.38 0.00 148 I 7.15 3.75 1.93 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.73 0.91 0.00 0.00 149 K 7.98 4.41 0.00 1.72 1.76 0.00 2.06 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.36 1.52 7.81 150 G 7.89 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 0.00 151 S 7.61 4.46 0.00 3.77 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 0.00 152 G 7.80 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 0.00 153 E 8.35 4.71 0.00 1.93 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 2.12 1.88 0.00 154 E 8.71 4.18 0.00 1.90 1.84 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 2.25 2.29 0.00 * Residues marked with a * may have inaccurate shift predictions.