NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 L 4.5933 7.9432 120.0239 54.5669 43.7631 177.8523 32 E 4.2438 7.9777 120.7354 56.6118 31.2415 174.4359 33 E 4.1471 8.8407 119.3740 58.0223 30.4192 178.1397 34 Q 3.9835 7.6207 117.4277 59.3495 28.9353 177.9104 35 L 4.0722 7.1618 118.3388 56.8979 42.0460 177.9722 36 N 4.8162 7.8232 115.6279 54.7050 40.5722 176.0977 37 K 3.9818 8.1927 119.6280 59.0344 31.6976 178.8999 38 S 4.4155 8.1862 113.2675 60.2843 62.7028 175.7480 39 L 4.0037 7.7177 122.6519 58.1509 41.8842 179.0289 40 K 3.9930 8.1567 118.2890 59.7964 32.2040 179.3004 41 T 3.9792 7.5203 115.1448 65.3899 68.1989 176.1243 42 I 3.9961 7.2041 120.5147 63.2537 38.1905 177.5329 43 A 4.0779 7.8282 120.6206 54.8154 17.4463 178.1722 44 S 4.4159 7.7226 111.3742 59.2155 62.7350 175.6955 45 Q 4.0748 8.1528 119.4227 59.4791 28.3527 179.7184 46 K 3.8769 8.2658 121.6531 59.0046 32.5030 178.4749 47 A 4.6927 7.8790 121.2847 54.9605 17.9933 178.8052 48 A 4.1593 9.3807 120.0620 54.7774 18.5962 179.5272 49 I 3.5031 8.5111 117.6872 64.4473 37.4042 178.6081 50 E 4.1362 9.0370 118.7612 59.4022 29.2209 178.8542 51 N 4.4755 7.7972 116.3395 55.6717 38.3623 176.6317 52 Y 4.0052 8.9448 122.3993 60.6613 38.5608 177.7123 53 N 4.2406 8.6655 117.0218 55.0737 39.1756 177.0303 54 Q 4.1291 8.4468 121.5131 59.3705 28.8025 178.7550 55 L 4.7479 8.7492 122.3311 57.3675 41.6519 179.5884 56 K 4.0377 7.5179 117.8476 59.4787 31.9336 179.2338 57 E 4.0110 9.1969 119.9804 59.1145 29.3316 178.9401 58 D 4.5032 8.0890 119.1938 57.4294 41.0029 177.5147 59 Y 4.1934 10.1382 119.5921 61.0363 38.6360 177.8250 60 N 4.1173 8.7270 116.9965 56.7739 38.8028 177.4948 61 T 3.8195 7.5402 115.5245 66.7550 68.4028 176.5466 62 L 4.3538 7.8961 122.2319 56.9561 41.5827 179.4686 63 K 3.5471 8.1056 118.9654 59.3455 31.7932 179.5611 64 R 4.0365 8.1860 118.5196 59.4281 29.9708 178.7041 65 E 3.6887 8.0658 118.2805 59.7691 29.2730 179.0106 66 L 3.9378 8.6853 121.3792 58.2487 41.9710 178.9408 67 S 3.5561 8.8707 114.5683 60.7856 62.4722 174.9691 68 D 4.6511 8.5956 119.3961 54.5599 41.5753 176.4690 69 R 4.5815 7.6734 115.9581 56.7485 32.5734 177.5391 70 D 4.4366 9.1173 119.5474 56.9154 40.5051 178.0905 71 D 4.3073 8.0207 119.3746 56.0538 39.7179 178.2604 72 E 3.7014 7.8783 119.8711 59.2604 29.2478 178.9892 73 V 3.8138 7.2989 115.9009 64.3824 31.7068 176.3431 74 K 4.5487 7.7120 114.6082 56.5521 34.5902 177.7886 75 R 4.2109 8.9303 119.4417 58.5889 30.2534 178.4771 76 L 5.0376 7.9605 119.5684 56.4062 41.5041 178.6828 77 R 4.2370 7.9051 116.2168 57.2812 30.1547 177.3395 78 E 4.2129 7.7169 118.5209 57.7124 30.9989 177.7587 79 D 4.2987 7.6813 119.0557 57.5182 41.0294 178.8902 80 I 3.7096 8.0030 120.2608 64.3554 36.9039 178.4595 81 A 4.0689 7.4363 120.0329 54.4464 18.3268 178.9299 82 K 4.1361 7.9467 117.8428 58.6093 32.2928 178.7193 83 E 4.0088 8.0127 119.1948 59.3166 29.2042 178.6886 84 N 4.2180 7.8726 114.8715 55.6011 38.9123 176.6727 85 E 4.1079 7.7975 121.5758 58.9430 29.7147 178.6566 86 L 4.0573 7.6650 118.5761 57.8421 41.5321 179.2285 87 R 4.0666 8.7169 118.2784 59.2900 29.9533 178.8630 88 T 4.0959 7.5394 114.9779 65.5787 68.5380 177.1338 89 K 3.9207 8.3759 121.1712 59.9803 32.8054 178.9727 90 A 3.9688 7.9758 122.3165 55.2530 18.2766 178.5190 91 E 3.8925 7.9591 116.2606 59.5083 29.0798 179.0572 92 E 3.9748 8.7317 118.2311 60.6506 29.8531 178.5037 93 E 4.0587 8.7382 119.4885 58.3436 29.4509 178.0813 94 A 4.0578 8.3072 122.1137 55.2826 18.5472 178.4082 95 D 4.2823 8.1818 116.6396 58.0979 41.5876 178.4452 96 K 4.1346 8.1339 118.5372 59.8680 32.8293 179.0560 97 L 4.0268 7.9678 120.2651 57.4793 41.5582 178.6242 98 N 4.1807 8.4131 117.4448 56.9422 38.8304 176.5052 99 K 4.2623 7.6255 116.5254 57.2328 32.3740 178.8681 100 E 3.9311 7.9375 120.2076 59.4825 29.3907 179.2866 101 V 3.5604 7.7102 117.5430 66.0785 31.8263 177.2029 102 E 3.4874 7.6896 118.2230 59.7150 29.2316 177.9796 103 D 4.3742 8.3474 118.5648 56.4902 41.3093 177.7737 104 L 3.9677 8.4763 119.5507 58.6009 41.7572 180.0737 105 T 3.7405 8.7816 115.9313 66.4868 68.3218 176.3116 106 A 4.2866 7.8498 122.6899 55.3208 18.2314 179.7443 107 S 4.2233 8.7077 112.3896 61.4855 63.0736 176.1864 108 L 4.0638 8.8477 125.3483 57.8317 41.7556 178.6681 109 F 4.0324 9.0950 121.5160 61.4568 38.9150 176.8781 110 D 4.3982 8.4212 118.2684 57.6892 40.6656 178.4422 111 E 4.0488 9.2447 119.8872 59.9321 29.3119 178.8086 112 A 3.9336 8.0977 120.6967 54.8924 18.2449 178.9289 113 N 4.0341 8.1775 113.2622 56.6340 39.0541 176.9009 114 N 3.9152 9.2753 118.5888 56.9668 38.8305 176.6130 115 L 3.9128 8.0971 121.6286 58.1957 42.2289 179.0979 116 V 3.5342 7.9328 118.1498 65.6983 31.1288 177.5070 117 A 3.9094 8.5179 121.0811 55.4632 18.3507 178.8606 118 D 4.3733 7.8854 114.5398 57.5000 41.4576 177.9213 119 A 4.1034 8.0905 122.0545 54.7550 18.5180 180.9177 120 R 3.9642 8.5296 115.4900 55.7560 28.8897 178.3794 *122 E 4.3476 8.0862 121.2011 57.3523 31.6251 177.0242 123 K 3.8467 7.9110 118.4431 59.7070 32.2483 176.8632 124 Y 4.2368 9.0455 120.2532 61.1232 37.6828 178.4165 125 A 3.9922 8.2152 121.8520 54.7905 18.7502 178.6014 126 I 3.6532 7.6421 114.0282 61.5602 37.7087 176.4797 127 E 4.4352 8.2639 122.2405 57.8686 29.7098 177.6754 128 I 3.9094 7.5048 119.2275 63.5344 37.3273 177.7376 129 L 4.0624 7.3685 117.7887 57.0552 41.0373 179.0693 130 N 4.3089 7.6279 115.7157 55.8847 38.8523 177.1892 131 K 3.8807 7.7316 119.0477 58.2806 31.9413 178.5088 132 R 4.4215 7.5848 117.5874 57.4389 31.6977 177.7359 133 L 3.8515 8.3136 118.5027 58.0246 41.8011 179.5225 134 T 4.1124 8.9303 116.2978 66.5764 68.6781 177.1221 135 E 4.1502 7.7456 118.7403 59.0388 29.7732 178.6716 136 Q 4.2760 8.8717 117.0209 57.0468 28.8302 176.1610 137 L 4.5434 7.3873 117.2506 54.8446 43.3539 176.7209 138 R 4.3885 7.5189 116.1326 58.2633 31.2221 178.2737 139 E 4.0488 8.4599 117.2515 58.7311 29.5477 177.7353 140 K 4.3866 7.9652 115.5454 56.7572 32.7317 176.5172 141 D 4.8950 7.6708 119.7489 54.0544 41.4539 178.1674 *143 L 4.3252 7.9905 120.3323 54.4035 43.7848 177.2231 144 L 4.2302 7.3058 121.4291 54.8309 41.6209 176.3313 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 L 7.94 4.59 0.00 1.72 1.85 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 32 E 7.98 4.24 0.00 2.09 1.96 0.00 0.00 0.00 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 2.36 0.00 33 E 8.84 4.15 0.00 2.03 1.93 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 2.37 2.39 0.00 34 Q 7.62 3.98 0.00 2.36 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.53 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 35 L 7.16 4.07 0.00 1.72 1.75 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 36 N 7.82 4.82 0.00 2.78 2.74 0.00 0.00 7.21 6.67 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 37 K 8.19 3.98 0.00 1.90 1.84 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.56 7.81 38 S 8.19 4.42 0.00 3.89 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 39 L 7.72 4.00 0.00 1.99 1.82 0.92 0.48 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 40 K 8.16 3.99 0.00 1.84 1.84 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.67 7.81 41 T 7.52 3.98 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 1.20 0.00 0.00 42 I 7.20 4.00 2.02 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 1.45 0.92 0.91 0.00 0.00 43 A 7.83 4.08 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 44 S 7.72 4.42 0.00 4.03 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 45 Q 8.15 4.07 0.00 2.33 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.50 2.43 0.00 46 K 8.27 3.88 0.00 1.85 1.98 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.17 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.47 7.81 47 A 7.88 4.69 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 48 A 9.38 4.16 1.37 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 49 I 8.51 3.50 1.97 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.77 1.07 0.00 0.00 50 E 9.04 4.14 0.00 2.17 2.33 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 2.52 2.37 0.00 51 N 7.80 4.48 0.00 3.11 2.93 0.00 0.00 6.56 7.36 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 52 Y 8.94 4.01 0.00 2.89 3.14 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 53 N 8.67 4.24 0.00 2.83 2.79 0.00 0.00 6.62 7.53 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 54 Q 8.45 4.13 0.00 2.04 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.82 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 55 L 8.75 4.75 0.00 1.70 1.66 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.52 4.04 0.00 1.69 1.79 0.00 1.45 0.00 0.00 1.50 0.00 0.00 2.76 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.26 1.16 7.81 57 E 9.20 4.01 0.00 2.01 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 0.00 2.32 2.52 0.00 58 D 8.09 4.50 0.00 2.85 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 10.14 4.19 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 60 N 8.73 4.12 0.00 2.79 2.82 0.00 0.00 7.17 6.61 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 61 T 7.54 3.82 4.42 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 1.26 0.00 0.00 62 L 7.90 4.35 0.00 1.69 1.66 0.99 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.11 3.55 0.00 1.70 1.70 0.00 1.37 0.00 0.00 1.46 0.00 0.00 2.71 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.10 0.93 7.81 64 R 8.19 4.04 0.00 2.00 1.94 0.00 3.12 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 65 E 8.07 3.69 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.54 0.00 66 L 8.69 3.94 0.00 1.70 1.76 1.08 0.74 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 67 S 8.87 3.56 0.00 3.79 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.60 4.65 0.00 2.77 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 69 R 7.67 4.58 0.00 1.94 1.88 0.00 3.21 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.69 0.00 70 D 9.12 4.44 0.00 2.78 2.70 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 71 D 8.02 4.31 0.00 2.86 2.91 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 72 E 7.88 3.70 0.00 2.18 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 2.46 2.46 0.00 73 V 7.30 3.81 2.22 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 0.83 0.00 0.00 0.92 0.00 0.00 74 K 7.71 4.55 0.00 1.73 1.78 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.40 7.81 75 R 8.93 4.21 0.00 1.78 1.95 0.00 3.27 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.92 0.00 76 L 7.96 5.04 0.00 1.78 1.70 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 77 R 7.91 4.24 0.00 1.94 1.95 0.00 3.35 0.00 0.00 3.33 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 78 E 7.72 4.21 0.00 2.14 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.27 0.00 79 D 7.68 4.30 0.00 2.75 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 80 I 8.00 3.71 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 1.45 1.08 0.91 0.00 0.00 81 A 7.44 4.07 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 82 K 7.95 4.14 0.00 2.04 1.96 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.58 7.81 83 E 8.01 4.01 0.00 2.18 1.97 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 2.56 2.49 0.00 84 N 7.87 4.22 0.00 2.85 2.88 0.00 0.00 7.01 7.79 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 85 E 7.80 4.11 0.00 1.99 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 0.00 2.30 2.34 0.00 86 L 7.66 4.06 0.00 1.87 1.69 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 87 R 8.72 4.07 0.00 1.81 2.12 0.00 3.24 0.00 0.00 3.16 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.89 0.00 88 T 7.54 4.10 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 1.25 0.00 0.00 89 K 8.38 3.92 0.00 1.94 2.06 0.00 1.32 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.72 1.45 7.81 90 A 7.98 3.97 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 91 E 7.96 3.89 0.00 2.20 1.93 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 2.33 2.52 0.00 92 E 8.73 3.97 0.00 2.04 2.02 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 2.34 2.54 0.00 93 E 8.74 4.06 0.00 2.12 2.00 0.00 0.00 0.00 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 2.32 0.00 94 A 8.31 4.06 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 95 D 8.18 4.28 0.00 2.79 2.91 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 96 K 8.13 4.13 0.00 2.02 2.05 0.00 1.38 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.47 7.81 97 L 7.97 4.03 0.00 1.79 1.77 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.41 4.18 0.00 2.82 2.96 0.00 0.00 7.17 6.42 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 99 K 7.63 4.26 0.00 1.94 1.81 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.75 1.46 7.81 100 E 7.94 3.93 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.47 0.00 101 V 7.71 3.56 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 1.04 0.00 0.00 0.93 0.00 0.00 102 E 7.69 3.49 0.00 2.30 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 2.28 2.32 0.00 103 D 8.35 4.37 0.00 2.83 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 0.00 104 L 8.48 3.97 0.00 1.70 1.75 0.93 0.66 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 0.00 105 T 8.78 3.74 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 1.27 0.00 0.00 106 A 7.85 4.29 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 0.00 0.00 107 S 8.71 4.22 0.00 4.03 4.16 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 0.00 0.00 0.00 0.00 108 L 8.85 4.06 0.00 1.93 1.90 0.93 0.88 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 0.00 109 F 9.10 4.03 0.00 3.21 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 0.00 110 D 8.42 4.40 0.00 2.95 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 0.00 111 E 9.24 4.05 0.00 1.89 2.02 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 2.51 2.50 0.00 112 A 8.10 3.93 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 0.00 113 N 8.18 4.03 0.00 2.87 2.84 0.00 0.00 6.77 7.08 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 0.00 114 N 9.28 3.92 0.00 2.94 2.98 0.00 0.00 6.98 6.54 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 0.00 115 L 8.10 3.91 0.00 1.85 1.86 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 116 V 7.93 3.53 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 0.99 0.00 0.00 0.87 0.00 0.00 117 A 8.52 3.91 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 0.00 118 D 7.89 4.37 0.00 2.71 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 0.00 119 A 8.09 4.10 1.37 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 0.00 120 R 8.53 3.96 0.00 1.97 2.12 0.00 2.67 0.00 0.00 3.02 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.48 0.00 *122 E 8.09 4.35 0.00 2.24 2.20 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 2.28 2.38 0.00 123 K 7.91 3.85 0.00 1.82 2.05 0.00 1.91 0.00 0.00 1.69 0.00 0.00 3.11 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.42 7.81 124 Y 9.05 4.24 0.00 3.12 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.22 3.99 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 0.00 126 I 7.64 3.65 2.02 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 1.19 0.76 0.91 0.00 0.00 127 E 8.26 4.44 0.00 2.17 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 2.15 2.29 0.00 128 I 7.50 3.91 1.80 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.65 0.84 0.00 0.00 129 L 7.37 4.06 0.00 1.65 1.71 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 130 N 7.63 4.31 0.00 2.92 2.83 0.00 0.00 6.83 7.56 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 0.00 131 K 7.73 3.88 0.00 1.87 1.82 0.00 1.53 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.42 7.81 132 R 7.58 4.42 0.00 1.97 1.91 0.00 3.12 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.85 0.00 133 L 8.31 3.85 0.00 1.71 1.73 0.91 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 134 T 8.93 4.11 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 1.20 0.00 0.00 135 E 7.75 4.15 0.00 2.34 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 0.00 2.31 2.32 0.00 136 Q 8.87 4.28 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.38 2.28 0.00 137 L 7.39 4.54 0.00 1.68 1.85 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 138 R 7.52 4.39 0.00 2.09 1.93 0.00 3.17 0.00 0.00 3.33 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.88 0.00 139 E 8.46 4.05 0.00 1.92 2.00 0.00 0.00 0.00 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 2.42 0.00 140 K 7.97 4.39 0.00 1.74 1.83 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.63 7.81 141 D 7.67 4.90 0.00 2.84 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 *143 L 7.99 4.33 0.00 1.66 1.77 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 144 L 7.31 4.23 0.00 1.74 1.57 0.96 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 * Residues marked with a * may have inaccurate shift predictions.