NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 E 4.3269 8.4444 116.7537 55.6349 31.5539 174.2795 8 V 4.3117 8.2336 123.3377 59.7471 33.9553 172.6891 9 K 5.1854 9.2197 127.5366 54.9850 36.3075 174.7422 10 Y 5.1356 9.1353 120.5624 55.4142 42.5137 172.8928 11 P 4.5762 0.0000 0.0000 62.6799 32.4129 175.2509 12 A 4.4628 8.9485 125.7966 49.9242 22.1931 175.0076 13 I 4.5099 8.2534 122.9227 60.1100 39.0456 174.8428 14 F 4.7187 8.9155 127.2927 55.9502 40.6528 174.8563 15 R 4.9671 9.0156 125.0014 54.3093 32.5745 173.9829 16 D 3.3700 8.6960 127.5392 53.2402 41.2818 175.4469 17 E 4.0446 7.9372 125.4188 55.7878 29.1284 176.8288 18 G 3.9826 7.6147 114.8075 45.2483 0.0000 175.0081 19 T 4.3123 7.2698 110.6073 61.4984 70.0342 173.3772 20 Y 5.2419 6.7905 119.2922 57.3245 41.6960 172.7407 21 W 4.8788 9.6829 119.3302 54.8463 32.6607 174.4184 22 D 5.0329 8.9306 124.0996 52.6294 42.7341 174.9494 23 V 4.3660 8.1419 126.5395 60.7744 34.0605 174.4504 24 R 4.6770 8.3179 123.1092 54.3745 33.7055 174.1535 25 F 4.8416 8.4484 118.7627 55.2251 40.6406 174.3481 26 P 4.1075 0.0000 0.0000 65.6061 31.2297 177.6828 27 D 4.6410 8.1704 115.5898 55.8901 41.6652 176.9929 28 V 4.3224 7.6384 118.8288 60.3528 31.5109 173.4891 29 P 4.2400 0.0000 0.0000 64.7283 31.7991 177.7874 30 A 4.0913 7.9264 119.0322 53.7449 18.4932 177.2270 31 A 4.5593 7.7953 118.4730 51.8999 19.0118 177.2594 32 Q 4.1990 7.8418 119.5983 58.8734 29.9674 175.3089 33 T 4.3594 8.0387 117.5825 61.8967 71.4393 171.5624 34 F 5.3769 8.3600 119.4057 56.6426 43.2413 174.2635 35 G 4.2855 9.0002 105.5561 45.7683 0.0000 174.6936 36 A 4.3603 8.9557 124.8041 54.3411 18.9554 178.1536 37 S 5.1113 7.8598 109.7928 56.7689 66.6204 175.4408 38 V 3.1793 8.0414 116.5351 64.5649 31.2021 178.8787 39 Q 3.9500 7.8942 116.8495 59.2947 28.4505 178.6426 40 V 3.6305 7.8613 119.6228 65.4527 31.5858 177.6865 41 A 4.0637 8.4383 120.6557 55.3937 18.2239 179.5291 42 A 4.2445 8.5438 119.3592 55.3000 18.5704 179.3129 43 D 4.3328 8.2433 116.6410 57.7244 41.2718 178.1970 44 N 4.3748 8.6210 117.0453 56.3971 38.4697 177.2654 45 A 4.1412 8.2843 122.0001 54.9604 18.5788 179.4341 46 A 4.0420 8.3352 119.4394 55.6220 18.4454 179.7058 47 N 4.3386 8.2473 114.4454 56.2128 38.5071 177.5549 48 A 3.9858 8.4467 122.7012 55.0715 18.4955 179.5580 49 L 3.6299 8.0372 117.2896 57.8889 41.4720 179.5976 50 A 4.0665 7.5054 118.7288 55.2637 18.3270 179.5490 51 I 3.7911 7.9862 118.0455 64.5728 37.0304 178.6443 52 A 4.0606 8.1678 120.5312 54.1596 18.4294 178.6698 53 L 4.7164 7.7483 115.4370 53.2379 41.8856 175.6348 54 F 4.4208 7.6169 122.1113 59.5304 39.1631 174.3923 55 E 3.5960 8.4386 127.6091 57.4189 26.9035 174.3027 56 Q 4.7242 7.7119 115.0826 53.4905 32.2363 175.9285 57 S 4.2032 8.4263 115.4991 58.8296 63.3673 174.2184 58 L 4.4832 8.3282 124.6451 52.8361 42.1851 175.2563 59 P 4.5556 0.0000 0.0000 61.6757 32.0826 174.4873 60 P 4.4172 0.0000 0.0000 62.5951 31.8918 175.9872 61 A 4.8678 8.3717 124.4653 51.5206 19.5729 177.9530 62 S 4.4610 9.5878 119.6579 58.1546 63.9604 174.0151 63 D 4.6548 8.4866 122.7130 53.2150 40.8219 175.7876 64 P 2.9700 0.0000 0.0000 63.5337 31.7670 177.7970 65 Q 4.0727 7.5969 116.9954 57.7438 28.6774 176.2210 66 Y 4.2602 7.0519 113.6690 58.5905 38.3397 175.6803 67 W 4.8608 7.5910 120.3966 55.7390 30.2351 175.8063 68 R 4.4684 8.6130 122.1715 54.9795 30.0599 175.6807 69 L 4.6751 8.3071 125.1619 53.0737 43.5816 176.5603 70 A 4.2967 8.8745 124.9657 51.6989 18.9412 179.1619 71 S 4.2241 8.6206 114.3710 61.0626 63.1506 175.3796 72 T 4.4163 7.8939 109.7193 61.4169 69.0741 173.3652 73 E 5.9800 8.2151 121.4194 54.3965 32.5041 175.0341 74 F 5.0983 8.3429 115.5910 55.8377 41.8516 172.7440 75 V 5.4298 8.4351 118.6863 60.6058 33.7292 174.7317 76 V 4.6497 8.0304 118.5314 59.5430 36.7595 173.8308 77 W 5.1715 9.1435 121.4812 55.7170 30.4629 176.0286 78 I 4.6675 9.1235 126.0350 59.5248 38.8550 174.4787 79 T 5.2411 8.8880 129.6076 63.1061 69.8768 174.8106 *81 A 4.1793 8.5112 131.0458 52.8682 20.0122 175.3782 82 D 4.5895 8.5421 118.7825 52.9660 42.3037 176.0287 83 V 4.0221 8.3437 126.4438 61.7286 32.4187 174.8755 84 Q 4.6976 8.2012 125.2911 53.9352 31.9624 174.5954 85 F 4.6579 8.8324 119.2778 55.6066 41.2894 175.0749 86 G 4.3156 8.4034 113.1349 42.2313 0.0000 170.2265 87 P 4.3173 0.0000 0.0000 62.6822 31.6474 176.7435 88 G 3.7455 8.6268 109.2139 45.9443 0.0000 173.2744 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 7 E 8.44 4.33 0.00 2.01 1.82 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 2.13 1.88 0.00 8 V 8.23 4.31 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 1.01 0.00 0.00 0.95 0.00 0.00 9 K 9.22 5.19 0.00 1.65 1.82 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.44 7.81 10 Y 9.14 5.14 0.00 2.97 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 11 P 0.00 4.58 0.00 2.00 1.44 0.00 4.15 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 12 A 8.95 4.46 0.63 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 0.00 0.00 13 I 8.25 4.51 1.62 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.55 0.82 0.00 0.00 14 F 8.92 4.72 0.00 1.51 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 15 R 9.02 4.97 0.00 1.76 1.78 0.00 3.04 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.44 0.00 16 D 8.70 3.37 0.00 1.87 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 0.00 0.00 0.00 0.00 17 E 7.94 4.04 0.00 1.16 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 1.90 1.74 0.00 18 G 7.61 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 19 T 7.27 4.31 4.35 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 1.25 0.00 0.00 20 Y 6.79 5.24 0.00 3.31 3.11 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 0.00 21 W 9.68 4.88 0.00 3.52 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 22 D 8.93 5.03 0.00 2.93 2.49 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 0.00 23 V 8.14 4.37 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 -0.12 0.00 0.00 -0.00 0.00 0.00 24 R 8.32 4.68 0.00 1.70 1.72 0.00 2.61 0.00 0.00 3.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.32 0.00 25 F 8.45 4.84 0.00 3.06 2.94 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 0.00 0.00 0.00 26 P 0.00 4.11 0.00 2.01 1.77 0.00 3.83 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.50 0.00 27 D 8.17 4.64 0.00 2.76 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 28 V 7.64 4.32 1.69 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 0.73 0.00 0.00 0.11 0.00 0.00 29 P 0.00 4.24 0.00 2.05 2.07 0.00 3.68 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 30 A 7.93 4.09 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 31 A 7.80 4.56 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 32 Q 7.84 4.20 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.62 0.00 0.00 0.00 0.00 0.00 1.84 2.23 0.00 33 T 8.04 4.36 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 1.10 0.00 0.00 34 F 8.36 5.38 0.00 2.98 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 35 G 9.00 4.29 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 0.00 36 A 8.96 4.36 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 37 S 7.86 5.11 0.00 4.26 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 38 V 8.04 3.18 1.58 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 -0.84 0.00 0.00 0.67 0.00 0.00 39 Q 7.89 3.95 0.00 2.24 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.92 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 40 V 7.86 3.63 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 1.17 0.00 0.00 0.98 0.00 0.00 41 A 8.44 4.06 1.58 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 0.00 0.00 0.00 42 A 8.54 4.24 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 0.00 0.00 0.00 0.00 0.00 0.00 43 D 8.24 4.33 0.00 2.87 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 44 N 8.62 4.37 0.00 2.98 2.91 0.00 0.00 6.96 8.19 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 45 A 8.28 4.14 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.25 4.34 0.00 2.95 2.88 0.00 0.00 6.94 6.64 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 48 A 8.45 3.99 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 49 L 8.04 3.63 0.00 1.80 1.60 0.89 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 50 A 7.51 4.07 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 51 I 7.99 3.79 1.98 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 1.38 0.81 0.89 0.00 0.00 52 A 8.17 4.06 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 53 L 7.75 4.72 0.00 1.82 1.67 0.78 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 54 F 7.62 4.42 0.00 3.08 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 55 E 8.44 3.60 0.00 1.65 1.71 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 1.66 1.47 0.00 56 Q 7.71 4.72 0.00 2.13 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.69 6.83 0.00 0.00 0.00 0.00 0.00 2.27 2.48 0.00 57 S 8.43 4.20 0.00 3.86 3.81 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 58 L 8.33 4.48 0.00 1.70 1.78 0.97 1.14 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 59 P 0.00 4.56 0.00 2.25 2.08 0.00 3.84 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 1.89 1.95 0.00 60 P 0.00 4.42 0.00 2.15 2.09 0.00 3.74 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 2.08 2.13 0.00 61 A 8.37 4.87 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 62 S 9.59 4.46 0.00 4.21 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 63 D 8.49 4.65 0.00 2.92 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 64 P 0.00 2.97 0.00 1.64 1.37 0.00 3.79 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.31 0.00 65 Q 7.60 4.07 0.00 1.78 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.07 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 66 Y 7.05 4.26 0.00 2.89 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 67 W 7.59 4.86 0.00 3.55 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 68 R 8.61 4.47 0.00 1.82 1.91 0.00 3.31 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 69 L 8.31 4.68 0.00 1.75 1.64 1.04 1.02 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 70 A 8.87 4.30 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 71 S 8.62 4.22 0.00 4.01 4.04 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 72 T 7.89 4.42 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 1.14 0.00 0.00 73 E 8.22 5.98 0.00 2.06 1.91 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 2.34 2.06 0.00 74 F 8.34 5.10 0.00 3.03 3.15 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 0.00 0.00 0.00 75 V 8.44 5.43 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 0.18 0.00 0.00 1.11 0.00 0.00 76 V 8.03 4.65 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 0.86 0.00 0.00 0.82 0.00 0.00 77 W 9.14 5.17 0.00 3.32 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 78 I 9.12 4.67 2.41 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.44 1.19 0.00 0.00 79 T 8.89 5.24 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 1.30 0.00 0.00 *81 A 8.51 4.18 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 82 D 8.54 4.59 0.00 2.65 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.34 4.02 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 0.47 0.00 0.00 0.97 0.00 0.00 84 Q 8.20 4.70 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.46 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 85 F 8.83 4.66 0.00 3.06 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 86 G 8.40 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 0.00 0.00 0.00 0.00 87 P 0.00 4.32 0.00 2.21 2.10 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 88 G 8.63 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 * Residues marked with a * may have inaccurate shift predictions.