NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 50 S 4.2722 8.1927 115.4090 58.2593 64.2101 175.5255 *52 V 3.9514 8.3601 115.0053 62.6599 33.1190 177.0340 53 E 3.9608 8.1137 119.9812 59.0874 29.1245 179.0103 54 V 3.6296 7.9426 118.0567 65.8658 32.0544 177.6113 55 L 4.1247 7.9494 118.0783 57.9184 41.3166 179.2802 56 A 4.0770 7.9657 119.2602 55.0662 18.3044 179.0798 57 D 4.4524 7.8631 116.3856 56.3968 41.8196 176.2726 58 H 4.9896 8.1149 116.1365 54.0118 29.5345 171.9233 59 P 4.3568 0.0000 0.0000 64.1391 31.9815 176.9265 60 G 3.9699 8.9765 108.8808 45.9969 0.0000 173.5851 61 E 4.6285 8.0450 117.9051 55.3397 31.8630 175.9064 62 L 5.0589 7.8102 117.3806 52.9442 44.2274 176.2505 63 V 4.5383 8.5740 114.9556 59.0909 35.4969 175.5511 64 R 4.3082 8.5407 121.7878 57.0108 30.7673 176.4499 65 T 4.6788 7.7415 111.8474 60.0180 71.2248 174.0589 66 D 4.6141 8.8029 119.7508 54.5376 39.9241 176.2500 67 S 4.7945 8.2163 115.7558 55.9209 63.9144 173.0439 68 P 4.3604 0.0000 0.0000 64.9958 31.4474 176.7772 69 N 4.4115 8.2017 114.8307 53.6487 39.2498 174.4524 70 F 5.4188 7.9320 116.7395 55.7457 43.7859 173.7299 71 L 5.1610 9.0553 121.7943 53.0619 45.7087 175.0839 72 S 5.1246 8.8855 114.0846 56.6248 67.0952 173.7094 73 S 4.8073 8.3784 116.2935 58.0577 64.3118 173.3129 74 V 4.4111 8.2756 119.4632 61.5777 32.2744 175.0799 75 L 4.5344 8.6645 127.3807 52.1869 43.5265 174.6761 76 P 4.4143 0.0000 0.0000 62.8337 31.9116 177.0979 77 T 4.2088 8.4276 110.8158 64.5344 70.2695 173.9091 78 H 5.3700 8.0224 121.0866 54.5876 33.0181 172.3104 79 W 5.3599 9.3800 134.7178 55.5785 35.1103 173.5707 80 R 4.4529 7.2311 123.8664 55.3938 30.9025 175.7044 81 S 4.4825 8.6519 121.3444 60.0376 62.7102 173.6620 82 N 4.3326 9.2832 124.6677 53.8508 38.0780 173.4248 83 K 4.3883 7.8492 117.7471 55.5541 33.1082 176.6348 84 T 4.0724 8.6505 122.1446 64.0682 68.9445 174.0898 85 L 3.9324 8.3731 125.3590 53.8361 42.3780 175.6774 86 P 4.3510 0.0000 0.0000 64.6440 31.7234 176.4451 87 I 4.3689 7.2702 118.5136 58.6607 39.3644 174.9408 88 A 4.0953 8.6715 128.7757 52.3936 18.9501 176.4581 89 F 4.6329 8.7994 124.8384 58.1148 40.9660 174.2000 90 K 5.1010 8.3482 124.1668 54.5443 36.3800 175.1342 91 V 4.5729 8.5380 123.7639 60.9986 34.2175 174.2670 92 V 4.8782 8.8812 127.6885 61.0360 33.9744 173.9486 93 A 4.6768 8.9777 130.9256 51.4588 18.9136 177.1516 94 L 4.1212 8.4469 122.6214 55.6954 42.6987 177.1170 95 G 3.9113 7.4314 107.0878 43.3387 0.0000 172.2293 96 D 4.4781 8.3208 119.3314 53.7800 41.1319 176.5870 97 V 4.3670 8.1128 123.2395 60.2196 34.2274 173.1367 98 P 4.4049 0.0000 0.0000 62.2729 31.9099 175.6472 99 D 4.5376 8.5063 121.3419 56.3951 41.1274 177.3854 100 G 3.9876 8.8442 111.2094 45.4691 0.0000 173.9946 101 T 3.9699 7.7121 117.7336 63.8468 69.1325 173.5905 102 L 4.6566 8.4328 125.6254 54.2001 43.9849 175.7705 103 V 5.0677 8.8475 120.8078 61.7148 35.0396 174.3210 104 T 5.3745 9.3896 124.0128 62.2077 72.3348 173.7824 105 V 5.2414 8.6594 118.0545 58.6904 35.0365 174.6439 *107 A 4.2134 8.3569 121.1635 52.5280 20.1562 176.4272 108 G 3.9786 8.3774 106.8322 46.9723 0.0000 171.0707 109 N 5.3729 8.5724 115.7346 52.2823 39.5818 174.5550 110 D 4.4935 8.7888 116.5306 56.3521 39.6908 176.9024 111 E 4.2435 8.2843 118.2576 57.4526 30.1002 176.0471 112 N 4.8158 8.1442 117.7284 52.1842 40.0539 174.0112 113 Y 4.0806 8.7799 125.0447 59.6252 38.2492 176.7432 114 S 4.0504 6.4867 113.3493 56.7434 63.6598 172.9610 115 A 4.1209 8.1916 130.8772 50.8671 19.2972 176.6562 116 E 3.9396 8.6744 122.2561 56.5557 30.7837 175.7125 117 L 5.1275 8.3402 124.9864 52.8148 46.0017 175.3974 118 R 4.4448 8.4076 120.1878 54.8815 33.1508 175.0189 119 N 4.4261 8.5356 121.0626 54.7092 35.8698 174.0699 120 A 4.7328 7.7151 115.8414 52.2008 20.5487 177.9469 121 T 5.3556 8.0015 112.9239 62.9817 72.0814 173.1222 122 A 4.4044 8.7698 125.2695 50.1646 22.6882 174.8620 123 A 5.0900 7.9632 120.8375 50.6789 20.2250 176.2736 *125 K 4.2977 8.4440 115.9800 58.3506 33.0552 175.9909 126 N 4.0446 9.9151 124.9518 54.7268 36.7600 174.7811 127 Q 3.6616 8.2871 111.6554 56.4356 26.6309 173.0003 128 V 4.8511 7.7929 117.0631 61.0014 34.4381 174.7172 129 A 4.7441 9.0773 130.0189 49.5783 20.7862 174.9939 130 R 4.8707 8.3369 122.7406 55.7113 31.4246 175.6581 131 F 4.2660 9.3852 126.8220 56.6257 38.9388 175.6902 132 N 4.4712 8.9980 123.4867 56.6457 39.5166 175.2353 133 D 4.7055 7.6115 116.2505 52.2533 41.5274 175.0141 134 L 4.4448 7.9655 121.4861 55.6511 43.1016 176.8677 135 R 4.7742 8.7384 124.0450 54.4533 34.9127 174.4156 136 F 4.5844 8.9909 121.1377 56.8409 39.8762 176.0966 137 V 3.8853 8.5967 123.8773 64.8422 32.2292 176.7408 138 G 3.8925 8.3111 107.2236 46.4183 0.0000 172.7489 139 R 4.9669 8.5945 121.7405 54.3748 31.9806 176.9156 140 S 3.7691 8.4282 116.6351 58.4771 63.4971 175.4033 141 G 3.8831 7.8613 106.9897 44.9106 0.0000 173.2669 142 R 4.0190 8.3022 116.2133 57.5023 30.2963 177.9630 143 G 3.8992 7.8303 104.9084 45.4967 0.0000 173.1559 144 K 4.6125 7.4902 117.6380 54.7081 36.2438 174.4381 145 S 4.5139 8.0979 113.7261 56.8785 66.6214 172.7775 146 F 5.4430 8.8807 118.2156 56.1770 41.8741 175.2962 147 T 4.6992 8.8921 118.9542 62.6834 70.3305 173.5222 148 L 4.7648 8.6266 127.7289 53.8490 44.3813 174.8155 149 T 4.9428 8.4502 123.1610 62.2600 71.0598 173.6248 150 I 4.8877 8.8940 126.6962 59.8474 39.9646 174.5608 151 T 4.7341 9.0014 124.1124 61.5289 71.3209 173.2277 152 V 4.3871 8.2694 126.8277 60.3164 33.6034 176.0522 153 F 4.7513 8.7330 131.7646 57.2866 37.2370 175.1510 154 T 4.1078 7.6820 109.1781 61.5243 70.0291 173.6476 155 N 4.7523 8.4404 120.1492 51.2628 38.8570 172.0000 156 P 4.7637 0.0000 0.0000 60.6320 33.0582 174.1233 157 P 4.6076 0.0000 0.0000 63.0080 32.0605 176.0143 158 Q 4.7386 8.9415 121.0229 54.1125 32.2011 174.6727 159 V 4.8341 8.3793 121.6606 61.1483 34.0606 174.3202 160 A 5.0322 9.1556 128.0015 50.5891 23.4582 174.6322 161 T 5.0667 8.8685 115.0279 61.5384 71.9718 173.6575 162 Y 4.7219 9.0515 127.5868 58.1012 39.8247 176.4696 163 H 4.3239 7.6747 118.8960 56.5532 29.3418 175.0920 164 R 4.5592 6.6981 118.1714 54.1553 34.0091 174.5745 165 A 4.5801 8.3505 121.2683 52.0184 19.7959 176.6904 166 I 4.5729 8.7469 119.5944 59.0325 41.2656 174.0520 167 K 4.5049 8.8556 130.9844 55.1008 34.1509 175.0253 168 I 5.1488 8.4157 127.8174 59.8220 40.3301 174.6773 169 T 5.0438 8.5240 116.1485 59.4005 72.1574 175.5948 170 V 3.5882 8.5566 121.1705 64.2974 31.5809 176.9015 171 D 4.3849 8.0631 118.2869 53.4505 41.7226 177.3129 172 G 3.5984 7.8747 107.7690 43.4802 0.0000 171.8338 173 P 4.2143 0.0000 0.0000 62.9281 31.3308 176.1071 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 50 S 8.19 4.27 0.00 4.00 3.68 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 *52 V 8.36 3.95 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 0.95 0.00 0.00 0.92 0.00 0.00 53 E 8.11 3.96 0.00 2.14 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 0.00 2.30 2.35 0.00 54 V 7.94 3.63 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 0.89 0.00 0.00 0.98 0.00 0.00 55 L 7.95 4.12 0.00 1.87 1.71 0.91 1.07 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 56 A 7.97 4.08 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 57 D 7.86 4.45 0.00 2.84 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 58 H 8.11 4.99 0.00 3.16 3.21 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.36 0.00 2.18 2.06 0.00 3.83 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 60 G 8.98 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 61 E 8.05 4.63 0.00 2.03 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 2.24 2.44 0.00 62 L 7.81 5.06 0.00 1.48 1.52 0.80 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 63 V 8.57 4.54 1.72 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 0.72 0.00 0.00 0.85 0.00 0.00 64 R 8.54 4.31 0.00 1.64 1.84 0.00 3.18 0.00 0.00 3.27 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 65 T 7.74 4.68 4.49 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 66 D 8.80 4.61 0.00 2.74 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 67 S 8.22 4.79 0.00 4.01 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 68 P 0.00 4.36 0.00 2.05 2.08 0.00 3.74 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 2.02 2.11 0.00 69 N 8.20 4.41 0.00 2.44 1.95 0.00 0.00 6.57 7.41 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 70 F 7.93 5.42 0.00 2.93 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 71 L 9.06 5.16 0.00 1.54 1.66 0.90 0.97 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 72 S 8.89 5.12 0.00 3.84 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 73 S 8.38 4.81 0.00 3.93 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 74 V 8.28 4.41 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 0.93 0.00 0.00 1.00 0.00 0.00 75 L 8.66 4.53 0.00 1.27 1.23 -0.29 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.41 0.00 1.97 1.90 0.00 3.31 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.24 0.00 77 T 8.43 4.21 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 78 H 8.02 5.37 0.00 3.11 3.17 0.00 5.70 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 W 9.38 5.36 0.00 3.22 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 80 R 7.23 4.45 0.00 1.52 1.22 0.00 3.04 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 81 S 8.65 4.48 0.00 3.91 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 82 N 9.28 4.33 0.00 2.86 2.93 0.00 0.00 7.16 6.66 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 83 K 7.85 4.39 0.00 1.65 1.68 0.00 1.50 0.00 0.00 0.67 0.00 0.00 2.91 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.65 1.41 7.81 84 T 8.65 4.07 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 1.29 0.00 0.00 85 L 8.37 3.93 0.00 1.60 1.41 0.93 0.80 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 86 P 0.00 4.35 0.00 2.07 2.11 0.00 2.89 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.05 0.00 87 I 7.27 4.37 1.98 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 1.33 0.61 0.93 0.00 0.00 88 A 8.67 4.10 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 89 F 8.80 4.63 0.00 2.95 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 90 K 8.35 5.10 0.00 1.53 1.52 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.34 1.51 7.81 91 V 8.54 4.57 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 0.88 0.00 0.00 92 V 8.88 4.88 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 0.94 0.00 0.00 0.80 0.00 0.00 93 A 8.98 4.68 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 94 L 8.45 4.12 0.00 1.38 1.64 0.86 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 95 G 7.43 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 96 D 8.32 4.48 0.00 2.65 2.63 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 0.00 0.00 0.00 0.00 97 V 8.11 4.37 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 0.92 0.00 0.00 1.05 0.00 0.00 98 P 0.00 4.40 0.00 2.24 1.97 0.00 3.71 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 2.14 2.13 0.00 99 D 8.51 4.54 0.00 2.66 2.62 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 0.00 100 G 8.84 3.99 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 0.00 0.00 0.00 101 T 7.71 3.97 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 1.33 0.00 0.00 102 L 8.43 4.66 0.00 1.66 1.62 0.82 0.76 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 0.00 103 V 8.85 5.07 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 1.22 0.00 0.00 0.95 0.00 0.00 104 T 9.39 5.37 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 1.36 0.00 0.00 105 V 8.66 5.24 1.88 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 0.91 0.00 0.00 0.57 0.00 0.00 *107 A 8.36 4.21 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.38 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 0.00 109 N 8.57 5.37 0.00 2.99 3.27 0.00 0.00 7.19 7.72 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 0.00 110 D 8.79 4.49 0.00 2.82 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 0.00 111 E 8.28 4.24 0.00 2.22 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 0.00 2.34 2.27 0.00 112 N 8.14 4.82 0.00 2.79 2.83 0.00 0.00 6.76 8.53 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 0.00 113 Y 8.78 4.08 0.00 3.15 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 0.00 114 S 6.49 4.05 0.00 3.49 3.01 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 0.00 115 A 8.19 4.12 0.56 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 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.67 3.94 0.00 2.01 1.88 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 2.33 2.30 0.00 117 L 8.34 5.13 0.00 1.35 1.24 0.66 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.41 4.44 0.00 1.84 1.69 0.00 3.27 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 119 N 8.54 4.43 0.00 3.03 2.91 0.00 0.00 6.92 7.35 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 0.00 120 A 7.72 4.73 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 0.00 121 T 8.00 5.36 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 0.00 122 A 8.77 4.40 -0.02 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 0.00 0.00 123 A 7.96 5.09 1.14 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 0.00 0.00 *125 K 8.44 4.30 0.00 1.81 1.74 0.00 1.86 0.00 0.00 1.81 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.40 1.46 7.81 126 N 9.92 4.04 0.00 2.88 2.86 0.00 0.00 7.12 8.34 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 0.00 127 Q 8.29 3.66 0.00 2.29 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.86 0.00 0.00 0.00 0.00 0.00 2.47 2.34 0.00 128 V 7.79 4.85 2.09 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 0.75 0.00 0.00 0.97 0.00 0.00 129 A 9.08 4.74 1.17 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 0.00 130 R 8.34 4.87 0.00 1.83 1.82 0.00 3.25 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 131 F 9.39 4.27 0.00 3.13 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 0.00 132 N 9.00 4.47 0.00 2.67 2.87 0.00 0.00 6.96 8.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 D 7.61 4.71 0.00 2.65 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 0.00 134 L 7.97 4.44 0.00 1.66 1.51 0.55 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 135 R 8.74 4.77 0.00 1.77 1.82 0.00 3.36 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.79 0.00 136 F 8.99 4.58 0.00 3.14 3.10 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 0.00 137 V 8.60 3.89 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 0.82 0.00 0.00 0.98 0.00 0.00 138 G 8.31 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 0.00 0.00 0.00 139 R 8.59 4.97 0.00 1.85 1.94 0.00 3.23 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.80 0.00 140 S 8.43 3.77 0.00 3.29 2.63 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 0.00 0.00 0.00 0.00 141 G 7.86 3.88 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 0.00 0.00 0.00 142 R 8.30 4.02 0.00 1.77 1.94 0.00 3.18 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 143 G 7.83 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 0.00 144 K 7.49 4.61 0.00 1.73 1.57 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.29 1.36 7.81 145 S 8.10 4.51 0.00 3.81 3.68 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 0.00 146 F 8.88 5.44 0.00 2.97 2.82 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 0.00 147 T 8.89 4.70 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 1.27 0.00 0.00 148 L 8.63 4.76 0.00 1.78 1.59 0.84 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.45 4.94 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 1.20 0.00 0.00 150 I 8.89 4.89 1.82 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 1.38 0.75 0.82 0.00 0.00 151 T 9.00 4.73 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 0.36 0.00 0.00 152 V 8.27 4.39 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 1.09 0.00 0.00 0.20 0.00 0.00 153 F 8.73 4.75 0.00 3.11 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 0.00 154 T 7.68 4.11 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 1.30 0.00 0.00 155 N 8.44 4.75 0.00 2.69 2.80 0.00 0.00 6.91 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 0.00 156 P 0.00 4.76 0.00 2.24 2.07 0.00 3.85 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 157 P 0.00 4.61 0.00 1.86 1.65 0.00 3.65 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.32 0.00 158 Q 8.94 4.74 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.76 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 159 V 8.38 4.83 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 0.77 0.00 0.00 0.86 0.00 0.00 160 A 9.16 5.03 1.17 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 0.00 161 T 8.87 5.07 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 1.27 0.00 0.00 162 Y 9.05 4.72 0.00 3.15 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 0.00 163 H 7.67 4.32 0.00 3.15 3.36 0.00 5.54 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 R 6.70 4.56 0.00 1.84 1.79 0.00 3.23 0.00 0.00 3.08 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.48 0.00 165 A 8.35 4.58 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 0.00 166 I 8.75 4.57 1.67 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 0.76 1.07 0.66 0.00 0.00 167 K 8.86 4.50 0.00 1.70 1.58 0.00 1.16 0.00 0.00 1.35 0.00 0.00 2.75 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.06 1.43 7.81 168 I 8.42 5.15 2.08 0.00 0.00 0.70 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 1.11 1.07 0.00 0.00 169 T 8.52 5.04 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 1.12 0.00 0.00 170 V 8.56 3.59 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 0.73 0.00 0.00 0.91 0.00 0.00 171 D 8.06 4.38 0.00 2.63 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 0.00 172 G 7.87 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 0.00 0.00 0.00 173 P 0.00 4.21 0.00 2.14 1.93 0.00 3.45 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.14 0.00 * Residues marked with a * may have inaccurate shift predictions.