NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 Q 4.3074 8.3029 119.1258 54.4690 30.5062 176.6073 *26 W 4.2514 7.9604 116.3835 57.2882 28.6040 181.9335 27 R 4.2344 8.0432 121.9068 61.2059 30.9742 182.5026 28 A 4.1311 7.9089 121.0629 54.4971 18.2716 179.3110 29 A 3.9174 7.8881 118.9623 54.9570 18.9298 179.4543 30 G 3.7764 7.3061 102.3099 48.1353 0.0000 175.1443 31 A 4.0753 8.2359 122.7355 54.9167 18.4780 179.3432 32 A 3.8782 7.3900 118.9096 55.8911 18.4582 179.9381 33 T 3.8377 8.0128 114.0059 66.6966 68.3700 176.8427 34 V 3.4902 7.6743 120.3652 65.7279 31.5982 177.4599 35 L 3.8700 7.9046 119.4702 58.2696 41.7444 178.5962 36 L 3.8250 8.2473 120.2322 58.3684 42.0418 179.1655 37 V 3.6285 7.5310 117.4804 66.0243 31.3215 178.0465 38 I 3.6972 7.8694 119.5805 64.2983 36.8589 178.6479 39 V 3.5810 8.1656 119.4499 65.8771 31.3399 177.8604 40 L 4.0060 8.2765 119.1733 57.9251 41.5073 179.5899 41 L 4.0186 8.0798 118.2785 57.9449 41.5845 179.3911 42 A 4.2008 8.4122 121.0205 55.1306 18.1762 179.9618 43 G 3.6850 8.9634 104.9496 48.3084 0.0000 176.0984 44 S 4.4309 8.5125 118.2838 61.4362 62.8105 176.3891 45 Y 4.3972 8.3259 122.2330 60.8568 38.6778 177.7045 46 L 4.1162 8.6663 119.9845 57.3727 41.5678 179.4557 47 A 3.8857 8.4736 121.3632 55.2875 18.2973 179.7646 48 V 3.4188 7.3195 117.5871 65.3796 31.1810 178.0084 49 L 3.7872 7.5159 119.1459 57.8386 41.9632 178.4316 50 A 4.2190 8.1136 120.2598 55.0138 18.9985 179.1679 51 E 3.9814 8.8967 117.7033 58.3087 29.6596 177.9743 52 R 4.0258 6.9000 117.5248 57.6031 30.5306 177.1021 53 G 3.7582 9.0531 109.3717 45.0613 0.0000 173.0991 54 A 4.4771 7.5856 123.0872 49.2801 19.1190 174.4674 55 P 4.2657 0.0000 0.0000 65.4035 31.6725 177.6124 56 G 3.8806 8.9421 110.6174 45.1465 0.0000 173.4530 57 A 4.0478 7.9433 123.2540 52.3213 18.7502 177.5685 58 Q 4.4091 8.2575 118.5678 55.6000 30.8524 175.7428 59 L 4.2980 7.3203 122.0992 54.9647 41.5831 176.7974 60 I 4.3522 7.3683 107.2576 60.3831 38.6509 175.3768 61 T 4.3765 7.2944 109.5107 59.5735 71.7912 173.7617 62 Y 4.1227 8.1051 121.8570 61.2009 38.0455 176.8447 63 P 4.3488 0.0000 0.0000 66.3988 31.4434 178.7543 64 R 4.2154 8.1045 113.7178 59.3286 29.3789 178.5275 65 A 4.2108 7.9930 121.2560 55.0194 18.3152 179.3307 66 L 4.6182 8.5248 120.7836 57.6294 42.1695 179.0487 67 W 4.4082 8.3132 128.1005 59.9826 30.6202 177.8557 68 W 3.8493 8.6668 129.1152 60.4083 30.2248 178.0925 69 S 2.9966 8.2474 114.3221 61.0775 62.2438 176.7047 70 V 3.4529 7.3613 121.6226 65.5675 31.3608 177.8946 71 E 3.5594 7.3845 116.9968 58.8768 29.2326 179.3175 72 T 3.6095 7.0459 116.9145 66.1287 68.5499 176.5383 73 A 4.0626 7.9484 123.1882 55.4336 18.2536 179.1880 74 T 3.6625 7.6365 104.7212 61.7502 68.9717 175.0021 75 T 3.3152 7.8853 110.7537 62.5970 68.2421 173.4259 76 V 3.2824 7.4013 121.5083 66.2837 31.6061 177.2875 77 G 4.2866 8.1124 106.7761 46.4441 0.0000 173.0486 78 Y 4.0626 7.7914 121.2549 59.6331 38.3767 177.6016 79 G 4.2449 8.1583 107.7467 45.4384 0.0000 174.2594 80 D 4.6745 8.2322 119.3411 55.4121 39.9975 176.5325 81 L 4.4653 7.6070 118.1327 53.5476 45.6736 174.1168 82 Y 4.6282 7.1179 118.2280 55.7377 40.1033 171.8506 83 P 4.4241 0.0000 0.0000 62.3048 32.4875 176.3344 84 V 4.4017 8.8254 111.6875 60.9576 33.3069 176.3027 85 T 4.6296 8.0338 111.3204 59.2577 72.2987 174.7943 86 L 3.7218 8.2461 123.3215 58.5347 42.0212 179.5708 87 W 4.3203 7.9665 118.0566 59.3055 29.0060 178.7908 88 G 3.5967 7.9993 106.0489 47.9849 0.0000 176.1036 89 R 4.1118 8.4859 120.9444 58.6995 29.8863 178.9621 90 C 4.2325 8.2518 117.2437 62.6357 28.1363 176.0962 91 V 3.7562 8.5572 120.2337 65.7631 31.0435 177.7612 92 A 4.3344 8.3656 120.7034 55.5637 18.2510 179.6775 93 V 3.5763 7.9704 116.4507 66.2326 31.4909 178.4429 94 V 3.5980 7.7353 117.8321 65.8620 31.3541 178.2050 95 V 3.5464 7.9891 118.0315 66.1864 31.3778 177.7713 96 M 3.9269 8.3047 118.7313 58.4050 31.8023 178.6270 97 V 3.5230 8.0165 118.1298 66.1528 31.6827 177.6477 98 A 4.0777 8.4163 120.7599 55.2389 18.1451 179.6039 99 G 3.9317 8.3343 105.6414 47.5358 0.0000 175.5609 100 I 3.7803 8.3053 123.2972 64.2875 37.1299 178.5864 101 T 3.8644 8.2422 116.4546 66.9033 68.2492 176.4641 102 S 4.0198 8.5551 117.0999 62.0436 62.9148 176.9267 103 F 4.1629 8.4375 120.1862 60.6580 38.6380 178.1547 104 G 3.6809 8.4560 105.4375 47.4783 0.0000 175.6846 105 L 3.9697 8.1208 122.9411 58.0527 42.0892 179.2621 106 V 3.6174 8.0661 118.4823 66.1865 31.3672 178.2154 107 T 3.9766 8.1744 115.5165 66.1810 68.2004 176.7072 108 A 3.9898 8.2732 122.6558 55.1669 18.4083 179.5332 109 A 3.9517 7.9781 119.1963 55.3572 18.2864 179.6274 110 L 3.8735 7.9885 117.4465 58.0292 42.4955 178.9384 111 A 4.3468 8.3850 120.9137 55.5603 18.2365 179.3187 112 T 3.8527 7.9714 113.0551 66.9677 68.7110 175.8314 113 W 4.3689 8.2806 128.7939 60.7738 30.6331 176.2014 114 F 4.4525 8.0930 120.5770 57.6939 38.6467 175.2224 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 25 Q 8.30 4.31 0.00 2.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 7.03 0.00 0.00 0.00 0.00 0.00 2.26 1.93 0.00 *26 W 7.96 4.25 0.00 2.50 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 27 R 8.04 4.23 0.00 1.84 1.93 0.00 3.24 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 0.00 28 A 7.91 4.13 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 29 A 7.89 3.92 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 30 G 7.31 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.24 4.08 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 32 A 7.39 3.88 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 33 T 8.01 3.84 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 1.12 0.00 0.00 34 V 7.67 3.49 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 0.96 0.00 0.00 0.95 0.00 0.00 35 L 7.90 3.87 0.00 1.75 1.81 0.91 0.45 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 36 L 8.25 3.82 0.00 1.69 1.68 0.85 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 37 V 7.53 3.63 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 0.97 0.00 0.00 0.96 0.00 0.00 38 I 7.87 3.70 1.99 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 1.63 0.77 0.90 0.00 0.00 39 V 8.17 3.58 2.25 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 1.04 0.00 0.00 0.98 0.00 0.00 40 L 8.28 4.01 0.00 1.85 1.73 0.93 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.08 4.02 0.00 1.85 1.74 0.96 0.88 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 42 A 8.41 4.20 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 43 G 8.96 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 44 S 8.51 4.43 0.00 4.22 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 45 Y 8.33 4.40 0.00 3.20 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 46 L 8.67 4.12 0.00 1.94 1.82 1.03 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.47 3.89 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 48 V 7.32 3.42 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 0.61 0.00 0.00 0.66 0.00 0.00 49 L 7.52 3.79 0.00 1.46 1.75 0.82 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 50 A 8.11 4.22 1.40 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 0.00 0.00 0.00 51 E 8.90 3.98 0.00 1.99 1.86 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 2.25 2.21 0.00 52 R 6.90 4.03 0.00 1.68 1.80 0.00 3.06 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 53 G 9.05 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 0.00 0.00 0.00 54 A 7.59 4.48 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 55 P 0.00 4.27 0.00 2.04 2.03 0.00 3.70 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 56 G 8.94 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 57 A 7.94 4.05 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 58 Q 8.26 4.41 0.00 1.79 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.55 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 59 L 7.32 4.30 0.00 1.32 1.26 0.71 -0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 60 I 7.37 4.35 1.74 0.00 0.00 0.78 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 0.49 0.79 0.00 0.00 61 T 7.29 4.38 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 1.14 0.00 0.00 62 Y 8.11 4.12 0.00 3.22 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 63 P 0.00 4.35 0.00 2.23 2.19 0.00 3.69 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 64 R 8.10 4.22 0.00 2.22 2.29 0.00 2.95 0.00 0.00 3.36 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.75 0.00 65 A 7.99 4.21 1.59 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 0.00 0.00 66 L 8.52 4.62 0.00 1.92 2.03 1.02 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 67 W 8.31 4.41 0.00 3.55 3.38 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 68 W 8.67 3.85 0.00 3.46 3.50 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 69 S 8.25 3.00 0.00 3.89 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 0.00 70 V 7.36 3.45 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 1.03 0.00 0.00 1.00 0.00 0.00 71 E 7.38 3.56 0.00 1.70 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 0.00 0.00 0.00 1.78 1.94 0.00 72 T 7.05 3.61 3.64 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 0.95 0.00 0.00 73 A 7.95 4.06 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 74 T 7.64 3.66 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 75 T 7.89 3.32 4.13 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 0.00 0.00 0.00 1.22 0.00 0.00 76 V 7.40 3.28 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 -0.16 0.00 0.00 0.70 0.00 0.00 77 G 8.11 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 78 Y 7.79 4.06 0.00 3.11 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 79 G 8.16 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 0.00 0.00 0.00 0.00 80 D 8.23 4.67 0.00 2.95 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 81 L 7.61 4.47 0.00 1.84 1.54 1.24 0.76 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 82 Y 7.12 4.63 0.00 3.05 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 83 P 0.00 4.42 0.00 2.15 1.67 0.00 3.93 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.06 0.00 84 V 8.83 4.40 2.11 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 0.85 0.00 0.00 0.98 0.00 0.00 85 T 8.03 4.63 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 1.28 0.00 0.00 86 L 8.25 3.72 0.00 1.56 1.43 0.55 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 87 W 7.97 4.32 0.00 3.48 3.25 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 88 G 8.00 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 89 R 8.49 4.11 0.00 1.93 2.00 0.00 3.10 0.00 0.00 3.15 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 90 C 8.25 4.23 0.00 3.34 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 91 V 8.56 3.76 2.48 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 1.35 0.00 0.00 1.19 0.00 0.00 92 A 8.37 4.33 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 0.00 0.00 0.00 0.00 0.00 0.00 93 V 7.97 3.58 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 1.09 0.00 0.00 1.01 0.00 0.00 94 V 7.74 3.60 2.30 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 1.02 0.00 0.00 1.04 0.00 0.00 95 V 7.99 3.55 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 0.78 0.00 0.00 1.01 0.00 0.00 96 M 8.30 3.93 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.49 0.00 97 V 8.02 3.52 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 1.09 0.00 0.00 0.96 0.00 0.00 98 A 8.42 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 99 G 8.33 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.31 3.78 1.89 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 1.51 0.85 0.93 0.00 0.00 101 T 8.24 3.86 4.36 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 1.21 0.00 0.00 102 S 8.56 4.02 0.00 3.72 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 0.00 103 F 8.44 4.16 0.00 3.25 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 0.00 104 G 8.46 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 0.00 0.00 0.00 105 L 8.12 3.97 0.00 1.98 1.73 0.92 1.07 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 0.00 106 V 8.07 3.62 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 1.03 0.00 0.00 0.88 0.00 0.00 107 T 8.17 3.98 4.43 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 1.27 0.00 0.00 108 A 8.27 3.99 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.98 3.95 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 110 L 7.99 3.87 0.00 1.88 1.81 0.99 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.39 4.35 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 0.00 112 T 7.97 3.85 4.53 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 1.27 0.00 0.00 113 W 8.28 4.37 0.00 3.23 3.28 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 0.00 114 F 8.09 4.45 0.00 3.42 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 * Residues marked with a * may have inaccurate shift predictions.