NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 S 4.3144 8.2929 117.0995 58.9610 63.9226 175.5583 *32 I 3.2514 8.4063 118.0212 58.6600 33.7964 172.8102 33 Q 4.5918 8.3920 116.9688 56.8829 29.8513 175.8187 34 L 4.2531 7.7894 117.6171 55.3345 41.9180 177.4161 35 G 3.8472 7.8024 111.5199 45.3105 0.0000 174.8391 36 V 3.4866 8.5728 118.4111 66.7523 31.3021 174.0046 37 T 3.9298 7.8549 115.4790 66.7324 68.1483 176.4568 38 R 3.8539 7.2356 118.2766 59.6959 30.2205 178.6815 39 N 4.4493 7.9318 114.4795 55.9646 38.8204 177.2118 40 K 4.2005 7.9561 120.1623 59.2568 32.0658 179.0735 41 I 3.8124 7.1033 117.4174 62.1475 36.9061 178.0091 *43 T 4.1905 7.9082 118.7773 63.6565 70.5322 176.3069 44 A 4.0397 7.8390 122.7700 54.9933 18.2838 179.4507 45 Q 2.0000 7.5875 117.9307 58.5889 29.0106 177.4165 46 Y 4.0683 7.7853 119.9752 61.0159 38.6737 177.7679 47 E 3.8315 8.2210 119.8195 59.3047 29.6803 178.3778 48 C 3.9663 7.6197 118.5568 62.8363 31.4688 175.3111 49 Y 4.3614 7.3793 116.7840 60.9414 37.4099 178.2150 50 Q 3.9827 7.8341 118.6675 58.5906 29.0336 178.3370 51 K 4.1160 8.1089 120.6714 59.5204 32.0688 178.9625 52 I 3.7373 7.7713 114.9325 63.0686 36.8792 176.6365 *54 Q 4.3883 7.8809 120.1266 55.9235 30.5038 175.9920 55 D 4.5176 8.2575 116.8107 53.3807 41.3744 174.6589 56 P 4.4573 0.0000 0.0000 63.0448 31.9181 177.4213 57 I 3.6545 8.5269 119.5760 61.8411 35.9349 177.3740 *58 Q 3.4672 8.1838 118.0761 57.6045 24.9739 182.7355 *59 Q 4.3089 7.6739 117.9575 56.5848 26.1425 177.3596 60 A 3.7033 8.0616 126.6968 52.4530 15.8238 176.4902 *61 E 3.8481 8.1821 114.1579 55.4470 30.4632 178.1987 62 G 4.0426 8.1085 110.2530 42.8196 0.0000 171.7458 63 V 4.5855 8.1526 119.7397 61.4269 33.4243 174.7781 64 Y 5.2545 7.9940 124.0089 55.8406 41.4432 174.6322 65 C 4.5337 8.9106 118.4295 55.2885 41.5655 173.3377 66 N 5.2466 8.6710 120.9655 52.6123 39.3079 175.0665 67 R 4.4537 9.0954 117.8470 57.9293 29.7180 175.4151 68 T 4.8252 9.3230 116.0434 60.5377 71.8486 171.8098 69 W 5.2286 8.7544 135.0000 55.7210 31.8525 174.9983 70 D 4.4264 8.4003 126.6609 53.1155 39.3990 177.0061 71 G 3.3454 5.8970 108.2033 44.8841 0.0000 174.4167 72 W 4.7283 7.2669 115.8127 57.4725 31.8676 175.2747 73 L 5.0175 8.7026 116.4777 52.9031 44.9143 174.5766 74 C 5.3200 8.3954 120.3766 58.0234 33.2778 172.7392 75 W 4.9082 9.1694 125.0614 55.0129 32.2973 175.3711 76 N 5.2688 9.0553 121.6957 52.3212 39.9386 174.2625 77 D 5.0641 8.7509 119.9743 55.0208 41.5311 176.8636 78 V 4.6942 8.6991 115.3873 58.9837 36.0640 175.0421 79 A 4.4187 8.7533 125.0159 51.9461 18.9125 177.3611 80 A 3.8669 8.4597 123.6324 52.6519 19.2785 177.6609 81 G 3.8195 8.7450 109.0948 46.9824 0.0000 173.6478 82 T 4.7437 7.4560 106.3643 59.4481 72.9214 172.2044 83 E 4.9103 8.8433 126.1267 55.6186 31.4043 176.5477 84 S 4.7339 9.1868 126.5842 57.9848 65.3891 169.3262 *86 Q 4.3482 8.3776 113.7171 57.3998 30.0521 175.4168 87 L 4.6648 8.2491 120.8092 54.4012 42.8177 177.6718 88 C 4.4978 8.6248 119.8936 56.5369 40.0862 172.8334 89 P 3.6133 0.0000 0.0000 64.0283 30.7364 176.9812 90 D 4.6730 8.3122 116.0612 53.7734 37.4834 174.4920 91 Y 4.2238 7.3396 118.0624 60.0635 38.2205 175.7274 92 F 5.0133 7.2704 117.5147 54.9720 42.1884 175.8374 93 Q 4.0291 9.0961 122.3788 59.6048 28.2044 177.4621 94 D 4.7986 8.1602 115.4416 53.6158 40.9367 175.7258 95 F 4.8622 8.0565 121.9999 56.5023 39.6722 176.2281 96 D 4.5530 9.0471 126.9702 52.2197 39.4585 171.8022 97 P 4.6864 0.0000 0.0000 63.9475 31.6259 178.0693 98 S 4.3501 7.8113 114.9782 60.0500 62.9343 179.5794 99 E 4.4317 7.8806 118.4155 56.4918 30.7968 175.8651 100 K 4.9830 8.0844 119.9375 54.7210 35.0224 176.0723 101 V 4.3269 8.8477 123.6771 61.4824 33.1286 175.0351 102 T 4.9919 8.2184 123.5186 61.6717 72.2588 173.1080 103 K 4.3184 8.6595 127.6990 55.3378 35.4643 175.5958 104 I 4.5678 8.3992 127.1893 59.7050 37.4343 171.3345 105 C 4.8760 8.9060 126.9851 53.8144 45.4425 173.2316 106 D 4.7995 8.8264 126.4218 54.1880 41.4034 177.5851 107 Q 4.0343 8.6744 117.5064 58.7266 28.8739 176.9104 108 D 4.4211 8.0071 116.9343 54.6232 41.1095 176.7453 109 G 3.6849 8.0373 107.4697 45.9267 0.0000 171.9658 110 N 5.0375 7.6356 115.9316 50.3019 41.5865 174.3675 111 W 4.7224 8.7199 123.0519 56.5676 30.2296 175.8103 112 F 4.3236 9.5489 126.4655 59.0966 39.8976 174.0228 113 R 5.1166 7.5864 123.6579 54.0428 33.1162 175.1263 114 H 3.8671 9.3179 123.6261 55.7353 30.2407 174.6393 115 P 4.0643 0.0000 0.0000 65.5141 31.5979 177.5402 116 A 4.1892 8.2241 121.1193 54.2746 18.8283 178.1376 117 S 4.3675 7.9921 107.7765 57.8934 64.1802 174.6095 118 N 4.3323 8.3355 117.4082 53.6558 38.1265 173.6341 119 R 4.2545 7.5897 117.4748 56.3597 31.5406 175.8094 120 T 4.4911 8.6396 122.4066 63.7214 68.9770 173.2975 121 W 4.9231 9.1393 135.0000 55.8387 33.1626 174.5879 122 T 4.1007 7.7827 122.6982 61.4707 71.1271 173.8353 123 N 3.6526 8.1947 124.9206 52.6462 39.2984 174.4125 124 Y 4.4065 7.8960 122.6913 57.5859 38.6695 178.2021 125 T 3.9482 7.8921 112.2420 64.6440 68.8428 175.5694 126 Q 4.1390 7.8051 118.9664 57.4170 29.5059 177.6145 127 C 3.9994 7.9930 118.5669 59.8735 40.4307 174.9918 128 N 5.1652 7.4924 116.3163 51.9765 38.3016 176.9673 129 V 3.8814 7.6983 121.6591 61.5070 31.6727 178.1424 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 31 S 8.29 4.31 0.00 3.67 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 *32 I 8.41 3.25 1.87 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 1.47 0.89 0.91 0.00 0.00 33 Q 8.39 4.59 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.01 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 34 L 7.79 4.25 0.00 1.65 1.73 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 35 G 7.80 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 36 V 8.57 3.49 2.08 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 0.85 0.00 0.00 0.93 0.00 0.00 37 T 7.85 3.93 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 1.01 0.00 0.00 38 R 7.24 3.85 0.00 1.80 1.96 0.00 3.28 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.94 0.00 39 N 7.93 4.45 0.00 2.77 2.82 0.00 0.00 6.92 7.61 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 40 K 7.96 4.20 0.00 1.96 1.96 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.67 7.81 41 I 7.10 3.81 1.76 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 -0.21 0.82 0.00 0.00 *43 T 7.91 4.19 4.41 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 1.21 0.00 0.00 44 A 7.84 4.04 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 45 Q 7.59 2.00 0.00 1.25 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.67 0.00 0.00 0.00 0.00 0.00 2.09 1.16 0.00 46 Y 7.79 4.07 0.00 2.97 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 47 E 8.22 3.83 0.00 2.31 1.90 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 2.29 2.36 0.00 48 C 7.62 3.97 0.00 3.01 2.43 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 49 Y 7.38 4.36 0.00 2.82 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 50 Q 7.83 3.98 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.95 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 51 K 8.11 4.12 0.00 2.05 1.84 0.00 1.66 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.75 1.47 7.81 52 I 7.77 3.74 2.11 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 1.62 0.82 1.05 0.00 0.00 *54 Q 7.88 4.39 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.47 6.97 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 55 D 8.26 4.52 0.00 2.66 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 56 P 0.00 4.46 0.00 2.16 2.06 0.00 3.53 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 1.99 2.08 0.00 57 I 8.53 3.65 1.87 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 1.27 0.69 0.91 0.00 0.00 *58 Q 8.18 3.47 0.00 2.19 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 7.46 0.00 0.00 0.00 0.00 0.00 2.19 1.90 0.00 *59 Q 7.67 4.31 0.00 2.06 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.54 0.00 0.00 0.00 0.00 0.00 2.28 1.93 0.00 60 A 8.06 3.70 1.31 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 *61 E 8.18 3.85 0.00 2.00 1.80 0.00 0.00 0.00 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 1.90 0.00 62 G 8.11 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 0.00 0.00 0.00 63 V 8.15 4.59 2.08 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 0.97 0.00 0.00 0.93 0.00 0.00 64 Y 7.99 5.25 0.00 3.01 2.78 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 65 C 8.91 4.53 0.00 1.65 1.18 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 66 N 8.67 5.25 0.00 2.77 2.92 0.00 0.00 7.02 7.66 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 67 R 9.10 4.45 0.00 1.96 2.31 0.00 3.13 0.00 0.00 3.31 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.83 0.00 68 T 9.32 4.83 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 0.81 0.00 0.00 69 W 8.75 5.23 0.00 2.82 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 70 D 8.40 4.43 0.00 2.78 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 71 G 5.90 3.35 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 0.00 72 W 7.27 4.73 0.00 3.19 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 73 L 8.70 5.02 0.00 1.49 1.18 0.84 0.74 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 74 C 8.40 5.32 0.00 3.16 2.81 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 75 W 9.17 4.91 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 76 N 9.06 5.27 0.00 2.77 2.90 0.00 0.00 7.08 8.06 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 77 D 8.75 5.06 0.00 2.61 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 78 V 8.70 4.69 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 0.83 0.00 0.00 1.04 0.00 0.00 79 A 8.75 4.42 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 80 A 8.46 3.87 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 81 G 8.75 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 0.00 0.00 0.00 0.00 82 T 7.46 4.74 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 1.23 0.00 0.00 83 E 8.84 4.91 0.00 1.97 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 2.19 2.24 0.00 84 S 9.19 4.73 0.00 3.41 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 *86 Q 8.38 4.35 0.00 1.67 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 7.04 0.00 0.00 0.00 0.00 0.00 2.05 1.90 0.00 87 L 8.25 4.66 0.00 1.47 1.70 0.89 0.96 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 88 C 8.62 4.50 0.00 2.99 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 89 P 0.00 3.61 0.00 0.49 1.59 0.00 4.10 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 90 D 8.31 4.67 0.00 2.99 2.93 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 91 Y 7.34 4.22 0.00 1.82 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 0.00 0.00 0.00 0.00 92 F 7.27 5.01 0.00 2.49 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 93 Q 9.10 4.03 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.41 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 94 D 8.16 4.80 0.00 2.77 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.06 4.86 0.00 3.08 3.02 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 96 D 9.05 4.55 0.00 2.57 2.58 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 97 P 0.00 4.69 0.00 2.17 2.21 0.00 3.74 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 1.99 1.97 0.00 98 S 7.81 4.35 0.00 3.65 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 99 E 7.88 4.43 0.00 1.99 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 100 K 8.08 4.98 0.00 1.54 1.65 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.31 7.81 101 V 8.85 4.33 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 0.18 0.00 0.00 0.81 0.00 0.00 102 T 8.22 4.99 4.15 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 1.15 0.00 0.00 103 K 8.66 4.32 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.77 0.66 7.81 104 I 8.40 4.57 1.87 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 1.23 0.60 0.91 0.00 0.00 105 C 8.91 4.88 0.00 2.21 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 0.00 106 D 8.83 4.80 0.00 2.81 2.66 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 0.00 0.00 0.00 0.00 107 Q 8.67 4.03 0.00 2.14 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.00 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 108 D 8.01 4.42 0.00 2.65 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 0.00 109 G 8.04 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 0.00 110 N 7.64 5.04 0.00 2.78 2.70 0.00 0.00 7.02 7.68 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 0.00 111 W 8.72 4.72 0.00 3.20 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 0.00 112 F 9.55 4.32 0.00 3.22 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 0.00 113 R 7.59 5.12 0.00 1.50 1.80 0.00 3.28 0.00 0.00 3.34 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.75 0.00 114 H 9.32 3.87 0.00 3.15 3.12 0.00 5.59 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 P 0.00 4.06 0.00 2.12 2.05 0.00 3.09 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.81 0.00 116 A 8.22 4.19 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 0.00 117 S 7.99 4.37 0.00 3.98 3.94 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 0.00 118 N 8.34 4.33 0.00 2.84 2.97 0.00 0.00 7.14 7.16 0.00 0.00 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 R 7.59 4.25 0.00 1.97 1.88 0.00 3.25 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.69 0.00 120 T 8.64 4.49 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 1.26 0.00 0.00 121 W 9.14 4.92 0.00 3.55 3.40 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 0.00 122 T 7.78 4.10 4.17 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 0.79 0.00 0.00 123 N 8.19 3.65 0.00 2.48 2.55 0.00 0.00 6.96 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 0.00 124 Y 7.90 4.41 0.00 2.93 2.74 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 0.00 125 T 7.89 3.95 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 1.48 0.00 0.00 126 Q 7.81 4.14 0.00 2.15 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.08 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 127 C 7.99 4.00 0.00 1.87 1.18 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 0.00 128 N 7.49 5.17 0.00 2.68 2.60 0.00 0.00 6.54 7.67 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 0.00 129 V 7.70 3.88 2.08 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 0.86 0.00 0.00 0.93 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.