NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.5123 8.1927 116.8038 58.1418 65.4561 175.3359 3 D 4.1221 8.1218 120.5017 56.1609 41.0882 176.1079 4 K 3.9302 8.2155 119.8688 59.4673 32.7940 177.8779 5 F 2.7739 7.8300 120.2326 61.0358 39.1153 176.5758 6 N 3.9680 7.7762 115.5665 56.2286 38.0342 177.2294 7 Q 3.8476 7.7492 120.1964 58.7474 29.4809 177.6248 8 F 4.1275 7.8487 121.7185 61.4016 39.5199 177.1142 9 I 3.1947 7.5636 118.2990 63.5877 37.3961 177.2662 10 N 4.2876 7.2905 116.2065 55.3076 38.4502 176.9781 11 R 3.9622 7.3037 118.8819 58.1391 30.3972 178.2949 12 V 3.8212 6.9357 110.0095 60.5746 32.2192 175.5531 13 L 4.3144 6.9710 120.9063 53.1960 42.1521 176.1929 14 S 4.3599 8.5324 120.7239 58.7953 62.9804 173.2607 15 H 4.8837 8.7351 118.9373 55.8871 29.2874 174.8201 16 E 4.5601 8.5883 122.6779 54.2365 31.0349 176.9419 17 G 2.1319 7.2528 113.7144 45.0372 0.0000 173.4071 18 G 3.9837 7.9683 108.3447 45.5193 0.0000 173.1202 19 Y 4.3122 7.6847 116.7944 58.4750 39.5949 175.9946 20 A 4.4260 7.4856 125.8255 50.7907 23.4997 174.9894 21 N 4.3432 8.1823 114.1019 53.4202 41.2367 173.0943 22 H 4.6141 8.7940 127.4673 53.0611 30.9897 172.1673 23 P 4.1875 0.0000 0.0000 62.0508 31.3764 173.7291 *26 P 4.4004 0.0000 0.0000 62.6183 34.1411 179.6221 27 G 3.7338 7.9230 108.7599 47.1292 0.0000 174.4802 28 G 3.8344 8.0273 106.6268 45.5522 0.0000 173.3307 29 E 4.0739 7.8283 122.0156 57.2277 30.7988 175.9388 30 T 5.2667 8.6984 122.5554 61.9259 72.7830 172.4401 31 N 5.0140 8.6865 123.4041 52.2965 42.9159 174.2617 32 W 3.5160 9.3460 124.3587 57.8815 27.2653 175.6956 33 G 4.0126 8.5429 104.7562 45.6444 0.0000 173.9272 34 I 4.2888 7.7111 122.1533 59.7470 38.1122 175.8280 35 T 4.5529 8.2717 116.3701 61.0133 71.0882 175.3568 36 K 3.9492 8.5816 123.1957 59.8985 32.0418 179.0910 37 R 3.9791 7.7117 117.0237 59.8744 30.1478 178.9270 38 T 4.0088 7.8206 114.3232 66.6733 68.7186 176.7511 39 A 4.0393 8.2560 122.9080 55.5005 18.1499 179.7470 40 Q 4.3499 8.1668 116.2907 58.2089 28.9176 177.8524 41 A 4.3970 7.5782 118.9059 52.8176 18.5579 177.1956 42 N 4.9130 7.9204 114.8579 52.8293 40.0507 175.8431 43 G 3.8742 8.8462 107.1883 45.2055 0.0000 173.3249 44 Y 4.4353 7.8140 121.2468 56.3175 39.0898 175.0988 45 N 4.6666 8.1248 124.0630 52.8395 39.7608 175.3979 46 G 3.4877 5.9658 107.1892 44.7920 0.0000 174.1118 47 S 4.4015 8.1719 113.7084 57.9106 62.6737 174.5041 *49 R 3.9858 8.5148 115.6044 55.9688 31.4465 175.9998 50 A 4.2644 7.6738 120.3101 51.2008 17.9210 177.0294 *52 T 4.2648 7.9609 111.9192 62.2027 71.2497 174.6709 53 R 2.5100 7.5665 120.8346 58.9730 29.9186 178.3022 54 E 3.8327 7.7510 118.6288 59.0810 29.6700 178.6407 55 Q 4.0967 8.2712 119.5170 57.9772 28.6434 178.2468 56 A 3.8486 7.6717 121.8718 55.2319 18.4532 179.5487 57 I 3.9775 7.9911 118.7631 64.7806 37.1964 178.6214 58 S 4.2228 7.9751 114.3969 61.6537 62.5788 176.6149 59 I 3.7752 7.7973 123.2982 64.4185 36.8265 177.8503 60 Y 4.6058 8.2424 117.6681 61.4349 37.6691 178.8596 61 R 3.1051 8.3706 119.4660 59.0116 30.0187 178.8071 62 K 4.0861 7.7636 116.4591 59.4642 32.0968 179.2437 63 A 4.0227 8.3905 119.8130 53.9761 18.7644 177.6253 64 F 5.1489 8.7869 117.2788 60.0348 41.1198 177.5143 65 W 4.0175 8.3770 127.0010 60.4826 30.8046 177.9680 66 E 3.8273 8.5135 118.6660 59.3183 28.8797 179.0011 67 R 3.5955 7.5633 117.5636 59.1999 30.0670 176.7861 68 Y 4.4678 7.5528 111.4671 56.7953 38.3895 175.7293 69 R 3.5170 7.4624 117.5525 56.9971 28.2032 178.2209 70 A 3.5855 7.0544 120.7341 54.5012 18.6217 179.4917 71 D 3.8120 6.4431 114.0788 55.3287 40.1532 176.8196 72 Q 4.1529 7.2262 121.4916 54.5446 28.1417 174.5163 *74 P 4.1605 0.0000 0.0000 61.8806 34.3570 176.8101 75 E 3.7928 8.6883 121.8812 59.6206 29.5686 179.2439 76 A 4.3192 8.0317 120.1004 55.0864 18.4874 179.6642 77 V 3.4832 7.8016 116.0989 66.1130 31.6721 177.6915 78 A 4.3678 8.3479 120.9500 55.5795 18.2080 179.6176 79 F 4.6239 8.5054 115.9961 61.2055 39.0493 178.0396 80 Q 4.2677 8.5315 117.6984 58.8133 28.5521 178.4425 81 F 4.6296 9.0973 122.4168 61.1958 39.4468 176.9312 82 F 3.4733 8.8958 120.6414 61.1581 39.1797 176.4300 83 D 4.2797 8.3169 117.3019 57.4661 40.9513 178.1489 84 A 4.0057 8.2387 121.0753 55.3289 18.3898 179.4347 85 C 3.7285 7.6478 115.1530 62.6850 27.8092 176.4908 86 V 3.3257 6.8274 118.4323 65.8852 31.1235 177.6138 87 N 4.3373 7.7762 114.8967 56.2181 38.5468 176.4735 88 H 4.8528 8.0782 115.2416 54.4481 30.3656 175.7863 89 G 4.1422 7.3941 108.2372 45.0182 0.0000 174.4794 90 Y 3.8640 9.0701 119.0815 60.8261 38.0574 178.9739 91 G 3.8216 8.3468 106.1133 48.0228 0.0000 175.1159 92 N 4.2529 8.1516 117.1060 55.9879 38.6904 176.9159 93 A 4.1656 7.9701 120.7041 54.9814 18.7908 179.1069 94 A 4.2465 8.4671 119.7471 55.3057 18.6084 181.1577 95 R 4.4724 7.9571 116.9184 56.2297 30.2821 178.9247 *97 L 4.2582 7.9322 121.7822 55.3359 44.1976 178.4898 98 Q 3.9740 8.2097 117.3224 59.1424 29.0518 179.0788 99 R 3.9316 8.6908 117.1631 59.1554 30.3272 178.9424 100 A 4.0124 8.2114 119.2704 55.0677 18.4282 178.0402 101 A 4.1599 7.8668 116.4479 52.3958 18.8994 177.5047 102 G 3.8633 7.7758 103.3100 46.7324 0.0000 174.1020 103 V 4.5005 7.4471 111.1331 57.8934 34.6998 174.3295 104 P 4.2926 0.0000 0.0000 63.2926 31.8083 177.5682 105 D 4.8696 8.4554 125.1150 52.2011 37.9566 175.8081 106 D 4.5551 7.9484 120.6210 54.1956 40.5982 178.4270 107 G 4.0109 9.2044 109.5925 45.2060 0.0000 173.6451 108 V 4.0294 7.7571 120.0629 62.0171 31.9202 176.3899 109 I 4.2477 8.3216 129.6641 59.6509 36.3465 175.7781 110 G 4.3190 7.6548 116.1277 43.9688 0.0000 171.2988 111 A 3.8994 8.6913 119.9245 55.3868 18.5155 180.2104 112 V 3.5086 7.6430 116.1265 66.1994 31.6598 178.3383 113 S 4.0954 7.9075 114.4310 61.6295 62.7916 176.5498 114 L 3.8801 8.1425 121.9747 57.3198 41.4002 179.3651 115 K 3.8279 8.1864 119.5518 59.4579 32.1961 178.6903 116 A 3.9477 7.7786 120.4015 55.2645 18.1049 179.4642 117 I 3.5633 7.5872 117.1547 64.5954 37.2976 177.8176 118 N 4.5789 7.9647 114.9050 54.5430 38.7279 177.1373 119 S 4.3070 7.5747 115.3316 59.9605 63.9370 175.1039 120 L 4.1706 7.0403 120.6669 53.2527 42.2780 175.6650 121 P 4.2787 0.0000 0.0000 62.8836 32.9045 177.0777 122 E 3.9283 8.8667 122.4633 59.8541 29.7101 179.1400 123 N 4.4088 8.1269 115.7406 56.1077 38.7397 176.9098 124 D 4.3851 8.1157 120.0399 57.3944 40.9413 178.4430 125 L 3.9749 7.9557 120.5736 58.3029 42.0145 179.0225 126 L 4.2861 8.2367 118.8645 57.1895 41.6037 179.0376 127 L 3.9788 8.3423 121.0197 58.4317 42.0591 179.4008 128 R 4.0065 8.0016 117.7130 59.0011 29.9931 178.7895 129 F 4.3526 8.7240 120.9485 61.6789 39.4807 177.0782 130 N 4.2031 8.6549 116.0061 55.9454 38.2179 177.2806 131 A 4.0427 8.1298 122.4432 55.2720 18.3883 179.5233 132 E 3.9831 8.3509 117.0500 59.5449 29.5583 179.8428 133 R 3.8866 7.8603 118.0874 59.2418 30.1674 179.0866 134 L 4.3928 8.1358 118.7912 57.8355 41.6213 179.7360 135 V 3.6658 8.1171 118.2029 66.0527 31.3089 177.6166 136 F 3.9937 8.3593 119.1900 61.6748 39.2879 176.0212 137 Y 4.4283 8.2618 117.4617 59.2933 38.5819 176.2391 138 T 4.7855 8.0798 109.5006 60.2799 69.8747 175.7957 139 K 3.9724 8.0632 123.1603 59.2295 32.3049 177.3387 140 L 4.3592 8.2263 116.0433 54.0306 42.5891 176.3068 141 G 3.4690 6.5982 105.1502 45.7116 0.0000 171.0154 142 T 4.0654 7.3264 116.7468 62.1004 68.3463 174.5118 143 F 4.6872 7.8672 124.7789 55.8877 41.6235 175.5580 144 T 4.7477 8.2087 109.5161 61.6060 69.1328 175.1619 145 S 4.0106 8.4785 120.2369 61.5218 62.7459 174.3898 146 F 5.0428 7.3332 116.1435 54.8196 41.7696 174.9583 147 G 4.0027 8.5124 110.8347 45.4049 0.0000 174.8700 148 K 4.1276 8.6850 118.4417 59.0037 32.3219 178.5493 149 G 4.0033 8.1245 106.3185 45.4536 0.0000 175.1823 150 W 3.9300 8.4959 131.1056 60.3830 30.6560 178.1330 151 V 3.7255 8.3250 117.7787 65.9806 30.9624 177.4532 152 R 3.8769 8.1211 118.1478 59.6825 29.9856 178.5099 153 R 4.0442 7.8488 116.9528 58.6881 29.3933 178.8381 154 V 3.3498 7.1996 118.2865 65.2228 31.3541 177.9015 155 A 3.9846 8.1836 121.0853 55.0656 17.6231 179.5563 156 Q 3.9322 8.2114 116.7655 59.2047 28.7630 178.8027 157 N 4.3401 7.8360 116.9524 56.1197 38.3428 177.2235 158 L 3.9493 7.5848 120.4290 58.1745 42.6621 178.5562 159 I 3.8371 8.0147 120.1407 64.7865 36.9736 177.5637 160 H 4.0405 8.5597 118.9062 59.5022 28.2885 176.9505 161 A 4.1645 8.2683 121.6925 54.1548 17.9771 178.8879 162 S 4.3115 7.6965 110.9989 59.6563 63.4527 175.4892 163 A 4.0209 7.5919 126.1647 54.7310 18.8355 177.0416 164 D 5.5395 7.2300 115.6898 53.1848 41.1919 173.4417 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 2 S 8.19 4.51 0.00 3.93 4.02 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 3 D 8.12 4.12 0.00 2.89 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 4 K 8.22 3.93 0.00 1.99 2.01 0.00 1.94 0.00 0.00 2.10 0.00 0.00 3.23 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.90 1.67 7.81 5 F 7.83 2.77 0.00 1.58 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 6 N 7.78 3.97 0.00 2.72 2.74 0.00 0.00 6.73 8.26 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 7 Q 7.75 3.85 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.95 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 8 F 7.85 4.13 0.00 3.07 2.64 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 0.00 9 I 7.56 3.19 0.71 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.77 0.37 0.00 0.00 10 N 7.29 4.29 0.00 2.66 2.74 0.00 0.00 7.03 7.55 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 11 R 7.30 3.96 0.00 1.71 1.67 0.00 3.34 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.79 0.00 12 V 6.94 3.82 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 0.10 0.00 0.00 -0.64 0.00 0.00 13 L 6.97 4.31 0.00 1.40 1.52 1.32 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.53 4.36 0.00 3.90 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 0.00 15 H 8.74 4.88 0.00 3.25 3.47 0.00 5.93 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.59 4.56 0.00 1.95 1.76 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 2.17 2.34 0.00 17 G 7.25 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 7.97 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 Y 7.68 4.31 0.00 2.90 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 20 A 7.49 4.43 1.04 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 21 N 8.18 4.34 0.00 2.41 2.70 0.00 0.00 6.87 7.89 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 22 H 8.79 4.61 0.00 3.14 3.14 0.00 6.02 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 23 P 0.00 4.19 0.00 2.05 2.05 0.00 3.53 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 1.98 2.09 0.00 *26 P 0.00 4.40 0.00 2.26 2.28 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 27 G 7.92 3.73 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 0.00 0.00 0.00 28 G 8.03 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 0.00 0.00 0.00 0.00 29 E 7.83 4.07 0.00 2.21 1.89 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 2.35 2.29 0.00 30 T 8.70 5.27 4.10 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 1.25 0.00 0.00 31 N 8.69 5.01 0.00 2.98 2.69 0.00 0.00 6.94 8.05 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 32 W 9.35 3.52 0.00 3.51 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 33 G 8.54 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 0.00 0.00 0.00 34 I 7.71 4.29 2.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.70 0.85 0.00 0.00 35 T 8.27 4.55 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 1.24 0.00 0.00 36 K 8.58 3.95 0.00 2.05 2.05 0.00 1.89 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.50 1.57 7.81 37 R 7.71 3.98 0.00 1.89 2.05 0.00 3.26 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.86 0.00 38 T 7.82 4.01 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 1.11 0.00 0.00 39 A 8.26 4.04 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 40 Q 8.17 4.35 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 41 A 7.58 4.40 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 42 N 7.92 4.91 0.00 2.68 2.75 0.00 0.00 7.12 7.14 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 43 G 8.85 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 Y 7.81 4.44 0.00 3.06 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 45 N 8.12 4.67 0.00 2.57 2.72 0.00 0.00 7.13 7.65 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 46 G 5.97 3.49 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 0.00 0.00 0.00 47 S 8.17 4.40 0.00 3.92 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 *49 R 8.51 3.99 0.00 1.64 1.91 0.00 2.21 0.00 0.00 2.59 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.42 0.00 50 A 7.67 4.26 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 *52 T 7.96 4.26 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 1.27 0.00 0.00 53 R 7.57 2.51 0.00 0.67 1.37 0.00 2.72 0.00 0.00 2.92 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.60 0.00 54 E 7.75 3.83 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 55 Q 8.27 4.10 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.49 2.27 0.00 56 A 7.67 3.85 1.27 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 0.00 0.00 57 I 7.99 3.98 2.03 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.01 1.09 0.00 0.00 58 S 7.98 4.22 0.00 4.10 4.18 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 59 I 7.80 3.78 1.87 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.70 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0.00 3.21 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 129 F 8.72 4.35 0.00 3.10 3.23 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 0.00 130 N 8.65 4.20 0.00 2.96 2.92 0.00 0.00 6.98 8.04 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 0.00 131 A 8.13 4.04 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 0.00 132 E 8.35 3.98 0.00 2.10 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 2.64 2.58 0.00 133 R 7.86 3.89 0.00 1.94 2.19 0.00 2.56 0.00 0.00 2.88 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.13 0.00 134 L 8.14 4.39 0.00 1.95 1.87 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 135 V 8.12 3.67 2.32 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 1.06 0.00 0.00 1.05 0.00 0.00 136 F 8.36 3.99 0.00 3.20 3.29 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 0.00 137 Y 8.26 4.43 0.00 2.88 3.12 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 0.00 0.00 0.00 138 T 8.08 4.79 4.33 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 1.52 0.00 0.00 139 K 8.06 3.97 0.00 1.92 1.88 0.00 1.80 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.44 7.81 140 L 8.23 4.36 0.00 1.84 1.79 0.84 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 141 G 6.60 3.47 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 0.00 142 T 7.33 4.07 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 1.11 0.00 0.00 143 F 7.87 4.69 0.00 2.33 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 0.00 144 T 8.21 4.75 4.28 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 1.22 0.00 0.00 145 S 8.48 4.01 0.00 2.72 3.30 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 0.00 146 F 7.33 5.04 0.00 2.67 2.69 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 0.00 147 G 8.51 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 0.00 0.00 0.00 148 K 8.69 4.13 0.00 1.82 1.96 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.50 7.81 149 G 8.12 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 0.00 0.00 0.00 150 W 8.50 3.93 0.00 3.63 3.31 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 0.00 151 V 8.32 3.73 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 1.20 0.00 0.00 1.51 0.00 0.00 152 R 8.12 3.88 0.00 1.93 2.09 0.00 3.24 0.00 0.00 3.38 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 153 R 7.85 4.04 0.00 1.93 2.04 0.00 2.92 0.00 0.00 3.06 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.06 0.00 154 V 7.20 3.35 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 0.68 0.00 0.00 -0.41 0.00 0.00 155 A 8.18 3.98 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 0.00 156 Q 8.21 3.93 0.00 2.24 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.55 0.00 157 N 7.84 4.34 0.00 2.89 3.00 0.00 0.00 6.67 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 0.00 158 L 7.58 3.95 0.00 1.66 1.88 0.97 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 159 I 8.01 3.84 2.00 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 1.41 1.07 0.92 0.00 0.00 160 H 8.56 4.04 0.00 3.28 3.48 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 A 8.27 4.16 1.49 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 0.00 0.00 162 S 7.70 4.31 0.00 4.09 4.12 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 0.00 0.00 0.00 163 A 7.59 4.02 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 0.00 164 D 7.23 5.54 0.00 2.90 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 * Residues marked with a * may have inaccurate shift predictions.