NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3132 8.2644 123.5805 52.4487 19.7790 176.0062 2 S 4.2379 8.1001 110.1873 56.5924 64.0624 172.5235 3 A 3.5586 8.3326 126.2948 51.1624 17.0118 178.2231 4 A 5.6572 7.7327 135.0000 51.9128 21.5332 177.9441 5 K 4.5167 6.9305 114.7599 55.4369 30.3928 176.4462 6 G 3.6722 8.6542 121.2491 45.8773 0.0000 177.8239 7 D 3.3700 8.3699 114.1950 51.6649 43.7283 175.0858 8 H 3.8438 9.1567 119.3859 57.3000 28.5341 176.7377 9 G 3.3729 8.8271 107.2992 46.8432 0.0000 173.4448 10 G 3.6991 7.0132 105.7571 45.8182 0.0000 171.2314 *12 G 3.8226 7.6591 107.2100 45.0759 0.0000 173.2062 13 A 4.1757 8.5438 119.3350 55.2296 18.1199 179.8824 14 R 3.9297 8.0192 116.8863 59.8579 30.2650 178.7174 15 T 3.9434 7.9174 115.0971 66.5757 68.5591 176.6091 16 W 3.9214 8.1169 120.0512 59.1944 29.0119 178.5843 17 R 3.9945 8.0232 119.1808 58.9604 29.5066 178.0592 18 F 4.3664 8.3397 120.6002 61.5497 39.3087 177.2004 19 L 3.9197 8.1202 118.5670 57.8098 41.3174 179.6482 20 T 3.7500 7.8680 115.7855 66.6961 68.1864 176.5489 21 F 4.9415 8.0098 117.7790 59.4031 39.2835 177.6494 22 G 4.0861 8.6415 104.3410 45.3996 0.0000 173.3309 23 L 4.4841 7.6631 119.6614 56.1483 44.1138 177.5883 24 A 3.9662 8.1743 120.3369 55.6521 18.2368 179.5618 25 L 3.9858 8.6341 116.6099 57.3590 41.7882 178.1808 26 P 4.3062 0.0000 0.0000 65.6786 31.2900 178.8152 27 S 4.1119 8.1736 114.1283 61.5539 62.7507 176.9161 28 V 3.5928 7.7526 120.6607 65.7170 31.2322 178.0316 29 A 4.0222 8.1064 120.8484 54.9101 18.1540 179.6467 30 L 3.9388 8.1093 117.6807 58.2356 41.7627 179.5719 31 C 4.1434 8.1073 116.4077 62.7163 27.9995 176.2048 32 T 3.6365 7.6639 117.6096 65.9412 67.7528 176.5549 33 L 3.9094 7.6260 121.8598 57.9636 42.5269 177.8817 34 N 4.2828 8.4215 117.1829 56.9889 39.0054 176.9601 35 S 3.9945 7.8260 116.0510 60.9220 63.6161 175.6398 36 W 5.3940 7.6172 121.0213 55.3401 26.9665 175.2980 37 L 4.7402 7.4721 121.9913 56.8237 49.3476 175.3757 38 H 4.9752 8.0976 112.7410 55.8020 30.0092 177.1644 39 S 4.6952 7.3213 116.5029 55.8927 62.1348 173.8384 40 G 3.7488 9.0534 117.5041 44.5637 0.0000 172.0830 41 H 4.0688 8.8739 121.7520 56.4995 28.9271 174.9958 42 R 4.2070 8.5005 123.9267 54.7279 30.8859 175.5473 43 E 3.8114 8.9587 123.3516 56.1640 29.5513 176.8457 44 R 4.0353 8.5465 123.0768 55.7520 29.8216 174.8362 45 P 4.4773 0.0000 0.0000 62.0579 32.2320 176.0032 46 A 4.2253 8.4725 122.8177 52.4996 18.8827 177.0995 47 F 4.5599 8.8858 123.6551 57.6877 40.2400 175.0736 48 I 3.9984 7.1785 127.3966 58.7283 40.2014 175.2874 49 P 4.1159 0.0000 0.0000 61.3312 29.7144 176.7910 50 Y 4.3255 7.3094 115.8648 59.0919 38.5603 178.2780 51 H 4.3180 9.1087 121.1295 58.3455 29.1195 175.8339 52 H 4.6698 8.4161 112.7856 55.4907 28.9357 174.2665 53 L 4.6930 7.1358 118.7487 53.1393 44.7302 175.5625 54 R 3.8351 8.6000 115.4718 57.1091 27.6459 177.3693 55 I 3.8049 7.6643 116.4478 61.9147 37.8166 177.3936 56 R 4.2742 8.1212 123.1996 55.2884 31.4242 174.4665 57 T 4.3148 7.9037 112.0471 61.6241 70.2451 175.4421 58 K 4.3193 7.2122 121.2543 54.3344 35.0492 173.0762 59 P 4.2028 0.0000 0.0000 62.1976 32.1948 176.2498 60 F 3.9879 7.7603 119.2177 57.8086 39.1123 176.1834 61 S 4.3955 8.3927 118.8985 58.3983 62.6201 173.7556 62 W 5.3355 7.7889 117.2456 55.2439 32.0037 175.9397 63 G 3.6926 8.5399 108.1473 47.3920 0.0000 174.0449 64 D 4.5562 8.8952 124.1504 52.8096 39.9064 177.4182 65 G 3.7913 8.4124 107.9906 46.2055 0.0000 174.4135 66 N 4.9455 8.7761 115.7191 52.8828 40.3375 173.5425 67 H 4.8133 8.0861 114.7642 54.4911 30.6162 174.7015 68 T 3.6113 8.3532 114.1011 60.9706 69.5980 174.9406 69 F 3.4540 9.1428 124.3371 60.8586 39.4477 176.5307 70 F 4.8024 7.9948 117.3356 56.4299 39.2731 175.6967 71 H 4.0193 7.9128 120.3676 56.6882 30.2683 173.5881 72 N 4.8428 9.2544 125.8174 51.0186 39.6425 172.6033 73 P 4.0379 0.0000 0.0000 65.7510 31.6973 178.1515 74 R 4.0216 8.0727 116.9492 58.5700 30.0124 177.3600 75 V 4.4275 7.7528 107.2816 60.6336 33.8033 174.8939 76 N 4.8243 8.9250 118.8211 50.6484 38.4876 173.0032 77 P 4.1795 0.0000 0.0000 61.9911 32.3635 176.2064 78 L 4.4212 7.6868 120.2279 52.8812 42.9577 176.1869 79 P 4.2879 0.0000 0.0000 65.8403 31.1073 177.7384 80 T 4.2131 7.6704 105.4154 60.8597 69.5281 173.1962 81 G 2.0149 7.2916 108.7599 43.0914 0.0000 173.1460 82 Y 4.2847 7.4234 116.6205 58.0811 38.2720 176.5906 83 E 4.3977 8.4754 121.4009 55.0957 30.8961 177.1246 84 K 4.0722 8.5909 118.4996 57.1938 32.0723 177.1446 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 A 8.26 4.31 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 2 S 8.10 4.24 0.00 3.83 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 3 A 8.33 3.56 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 4 A 7.73 5.66 1.29 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 0.00 0.00 0.00 5 K 6.93 4.52 0.00 1.62 0.79 0.00 1.59 0.00 0.00 1.50 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.27 1.31 7.81 6 G 8.65 3.67 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 0.00 0.00 0.00 7 D 8.37 3.37 0.00 2.67 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 8 H 9.16 3.84 0.00 3.50 3.34 0.00 5.87 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 G 8.83 3.37 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 0.00 10 G 7.01 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *12 G 7.66 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 13 A 8.54 4.18 1.39 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 0.00 0.00 0.00 14 R 8.02 3.93 0.00 1.94 1.99 0.00 3.21 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 15 T 7.92 3.94 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 0.84 0.00 0.00 16 W 8.12 3.92 0.00 3.48 3.32 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 17 R 8.02 3.99 0.00 2.06 2.20 0.00 3.25 0.00 0.00 3.44 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.82 0.00 18 F 8.34 4.37 0.00 3.28 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 19 L 8.12 3.92 0.00 1.72 1.54 -0.13 0.27 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 20 T 7.87 3.75 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 0.77 0.00 0.00 21 F 8.01 4.94 0.00 3.14 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 22 G 8.64 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 0.00 0.00 0.00 23 L 7.66 4.48 0.00 1.61 1.69 0.89 1.03 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 24 A 8.17 3.97 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 25 L 8.63 3.99 0.00 1.83 1.82 1.04 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 26 P 0.00 4.31 0.00 2.18 2.13 0.00 3.76 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 27 S 8.17 4.11 0.00 4.04 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 28 V 7.75 3.59 2.23 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 0.98 0.00 0.00 1.00 0.00 0.00 29 A 8.11 4.02 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 30 L 8.11 3.94 0.00 1.82 1.70 0.92 0.77 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 31 C 8.11 4.14 0.00 2.89 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 32 T 7.66 3.64 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 1.11 0.00 0.00 33 L 7.63 3.91 0.00 1.84 1.91 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.42 4.28 0.00 2.69 2.70 0.00 0.00 7.35 7.05 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 35 S 7.83 3.99 0.00 3.46 3.26 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 36 W 7.62 5.39 0.00 3.34 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 37 L 7.47 4.74 0.00 1.82 1.81 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 38 H 8.10 4.98 0.00 3.22 3.35 0.00 5.72 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 39 S 7.32 4.70 0.00 4.17 3.55 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 0.00 0.00 0.00 40 G 9.05 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 0.00 0.00 0.00 41 H 8.87 4.07 0.00 3.14 3.30 0.00 5.70 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.50 4.21 0.00 1.84 1.89 0.00 3.28 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 43 E 8.96 3.81 0.00 1.93 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 2.29 2.28 0.00 44 R 8.55 4.04 0.00 1.95 1.87 0.00 2.38 0.00 0.00 2.98 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.30 0.00 45 P 0.00 4.48 0.00 2.33 2.18 0.00 3.92 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.09 0.00 46 A 8.47 4.23 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 47 F 8.89 4.56 0.00 2.96 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 48 I 7.18 4.00 1.13 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.59 -0.24 0.00 0.00 49 P 0.00 4.12 0.00 1.84 1.93 0.00 3.28 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.79 0.00 50 Y 7.31 4.33 0.00 2.94 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 51 H 9.11 4.32 0.00 3.23 3.42 0.00 5.69 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 H 8.42 4.67 0.00 3.27 3.40 0.00 5.47 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 7.14 4.69 0.00 1.64 1.60 0.91 0.82 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 54 R 8.60 3.84 0.00 1.94 2.01 0.00 3.45 0.00 0.00 3.30 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 55 I 7.66 3.80 1.89 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 1.44 0.76 0.89 0.00 0.00 56 R 8.12 4.27 0.00 1.65 1.67 0.00 3.14 0.00 0.00 2.96 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.48 0.00 57 T 7.90 4.31 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 1.18 0.00 0.00 58 K 7.21 4.32 0.00 1.61 1.54 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.21 1.31 7.81 59 P 0.00 4.20 0.00 2.09 1.90 0.00 3.72 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.90 0.00 60 F 7.76 3.99 0.00 2.35 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 61 S 8.39 4.40 0.00 4.22 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 62 W 7.79 5.34 0.00 3.40 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 63 G 8.54 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.90 4.56 0.00 2.80 2.79 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 65 G 8.41 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 66 N 8.78 4.95 0.00 2.57 2.92 0.00 0.00 6.98 8.58 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 67 H 8.09 4.81 0.00 3.13 3.18 0.00 5.95 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 68 T 8.35 3.61 4.34 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 1.39 0.00 0.00 69 F 9.14 3.45 0.00 2.84 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 70 F 7.99 4.80 0.00 3.07 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 71 H 7.91 4.02 0.00 3.32 3.30 0.00 5.89 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 72 N 9.25 4.84 0.00 2.72 2.81 0.00 0.00 6.76 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 73 P 0.00 4.04 0.00 2.11 2.19 0.00 3.75 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.22 0.00 74 R 8.07 4.02 0.00 1.87 1.95 0.00 3.29 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 75 V 7.75 4.43 2.17 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 0.82 0.00 0.00 1.01 0.00 0.00 76 N 8.92 4.82 0.00 2.51 2.80 0.00 0.00 7.00 7.90 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 77 P 0.00 4.18 0.00 1.43 0.49 0.00 3.75 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 1.95 1.84 0.00 78 L 7.69 4.42 0.00 1.73 1.56 0.86 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.29 0.00 2.03 2.14 0.00 3.62 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.10 0.00 80 T 7.67 4.21 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 1.21 0.00 0.00 81 G 7.29 2.01 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 82 Y 7.42 4.28 0.00 2.91 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 83 E 8.48 4.40 0.00 2.03 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 2.31 2.35 0.00 84 K 8.59 4.07 0.00 1.73 1.75 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.52 7.81 * Residues marked with a * may have inaccurate shift predictions.