NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -3 P 4.3435 0.0000 0.0000 62.4488 32.6004 175.2735 -2 L 4.4845 8.2703 120.2114 52.9499 43.0484 175.2911 -1 G 4.0142 9.0419 113.4256 45.5284 0.0000 171.4388 0 S 4.8106 8.4034 113.9716 57.0299 63.8353 175.4070 1 M 4.1806 8.8849 126.5396 58.5370 32.2050 177.6162 2 E 4.1900 8.4183 119.1629 59.7276 29.7913 178.4592 3 D 4.4177 8.5600 119.0194 57.2562 40.8652 178.4255 4 F 4.0577 8.3651 121.0807 61.4172 39.5222 177.0606 5 V 3.6124 8.4357 118.0123 66.4585 30.9961 178.2584 6 R 4.0609 7.8075 115.8844 58.7387 29.9940 178.2801 7 Q 4.2462 7.6801 116.1257 56.8292 29.2529 176.1516 8 C 4.3504 7.6065 114.6540 58.9591 29.7371 173.6613 9 F 4.7120 7.3174 118.2196 55.0696 40.6651 175.6374 10 N 4.2216 8.8359 121.2556 53.9420 40.0957 174.1970 11 P 4.2948 0.0000 0.0000 66.1195 31.3490 178.5110 12 M 4.0315 7.9985 117.5728 58.4842 32.1786 177.8711 13 I 3.8127 7.8421 119.4665 64.5342 37.3036 178.2405 14 V 3.5879 7.9530 118.8336 66.0457 31.3604 177.4549 15 E 4.1505 8.6147 119.3192 59.5988 29.5043 178.8732 16 L 4.0631 8.1385 118.6291 57.7434 41.6408 179.4270 17 A 4.1240 8.5053 121.1565 55.0002 18.2522 179.5700 18 E 3.8002 8.7872 117.5843 59.4630 29.5052 179.3026 19 K 3.8611 8.1829 118.3024 59.8544 31.4587 178.8050 20 A 4.0968 8.1177 120.4749 55.6621 18.1636 179.5441 21 M 4.2631 7.8653 116.1535 58.2103 32.5068 178.8665 22 K 3.8931 8.6669 119.0352 59.6230 31.9933 178.7707 23 E 3.9250 8.4182 118.8218 58.6819 29.4184 177.5902 24 Y 4.6734 7.1912 114.9733 57.3287 38.7631 176.4475 25 G 3.9309 7.8233 106.2010 45.9940 0.0000 173.8408 26 E 4.5375 7.9855 118.4986 54.5071 31.3094 174.9359 27 D 4.7931 8.2371 121.4497 51.7933 42.5786 175.5737 28 P 3.9770 0.0000 0.0000 65.0096 31.4205 177.8441 29 K 4.1274 8.6962 117.3894 58.4213 31.9765 177.5378 30 I 4.1731 7.2092 117.8378 63.3464 38.9473 177.1368 31 E 4.4165 8.2622 121.5116 55.8866 25.9434 177.6888 32 T 4.2781 7.7468 113.1381 64.6177 69.7483 176.7345 33 N 4.5764 8.2670 118.9321 56.1304 38.5910 176.9848 34 K 4.0014 8.1552 120.4700 59.4290 32.3844 178.0987 35 F 4.4271 8.5274 120.7615 61.6359 39.2346 176.9884 36 A 3.7811 8.5238 120.1594 55.0919 18.1141 179.3743 37 A 4.3490 8.5850 119.3529 55.4770 18.3655 180.0112 38 I 3.6521 8.2164 118.5737 64.7145 37.1583 178.2728 39 C 3.7367 7.7639 117.4670 63.0205 27.7201 176.3576 40 T 3.9914 7.6897 117.0230 67.0518 68.0602 176.1726 41 H 4.0797 8.4337 120.1297 59.0561 29.8939 177.0761 42 L 3.5649 8.0257 121.0416 57.8124 41.4121 179.1236 43 E 4.0663 8.3792 119.3460 59.2812 29.4634 178.9740 44 V 3.4014 7.8370 118.2451 66.1701 31.2707 177.5967 45 C 3.8227 7.8592 116.4946 63.0588 27.7028 176.3530 46 F 4.5972 7.7294 117.9309 60.6414 38.4924 177.5493 47 M 4.2226 8.2697 118.1934 58.6497 31.9003 177.7191 48 Y 3.9326 8.0829 118.8247 59.0180 39.1365 176.3476 49 S 4.7876 7.0010 112.6048 56.6079 65.5008 173.6579 *75 R 4.3318 8.3326 121.5229 55.7066 32.2249 174.9021 76 F 5.5055 8.2324 115.2425 55.5874 41.9241 174.6058 77 E 4.8113 9.3953 124.0451 54.6505 31.4497 174.7072 78 I 4.4152 8.5923 127.2259 60.5594 39.3267 174.4940 79 I 4.2063 8.8482 128.4399 62.9841 38.3629 175.8819 80 E 3.8290 7.9043 119.1281 57.8389 29.7605 175.6418 81 G 4.2151 8.8559 111.9442 45.6918 0.0000 174.4892 82 R 4.1829 7.2035 117.5220 55.3087 30.9539 176.4915 83 D 4.4481 8.6568 119.5629 54.9195 42.9695 177.7354 84 R 4.0783 8.6998 124.9449 59.8504 30.0981 179.1479 85 T 3.9831 8.3093 115.6588 66.8177 68.5361 176.3516 86 M 4.0604 8.0990 119.4028 58.4871 32.2469 177.7781 87 A 3.9220 8.4662 121.2590 55.1912 18.5636 179.7306 88 W 4.1795 8.2301 117.3208 60.0087 28.9847 178.7693 89 T 3.9377 8.1707 115.8334 66.7936 67.9854 176.6087 90 V 3.6112 8.3151 120.1898 65.9813 31.5088 178.0219 91 V 3.7005 8.1083 118.2737 66.3749 31.1156 177.7904 92 N 4.4290 8.7860 116.5216 56.2367 38.3314 177.2624 93 S 4.2109 8.4530 114.9003 61.5007 62.3928 176.4474 94 I 3.6005 7.9032 122.2545 64.6335 36.4914 178.2003 95 C 4.4068 8.5217 117.2680 61.5564 27.7022 174.5147 96 N 5.1241 7.5774 113.6727 52.4252 38.1682 175.5207 97 T 4.2150 8.1224 116.8113 66.2365 69.7729 175.5434 98 T 4.6508 7.6411 113.4330 61.0380 67.4441 176.1977 99 G 4.1033 8.5252 107.5788 45.0290 0.0000 172.7471 100 V 3.7156 7.7390 119.8701 62.3687 31.9686 175.6509 101 E 4.0018 8.8450 126.7023 56.3869 29.9188 176.2968 102 K 4.2425 8.6098 127.3603 55.1623 32.8815 174.8312 103 P 4.4947 0.0000 0.0000 62.6810 31.8430 176.7617 104 K 4.0977 8.6581 119.6374 58.3819 32.4160 177.2930 105 F 5.0407 7.8434 115.4802 54.8673 42.2567 174.7264 106 L 3.2690 8.5440 123.7054 54.1616 41.7356 176.0257 107 P 4.8350 0.0000 0.0000 61.6662 33.5843 174.6917 108 D 4.6747 8.6020 116.1586 56.2352 42.4966 176.8354 109 L 5.2418 7.6897 115.7998 53.5208 47.0016 174.2728 110 Y 4.8201 9.0426 121.2444 55.8714 41.8516 173.7967 111 D 4.7048 8.0001 126.9198 52.8156 41.7872 176.3596 112 Y 4.1743 8.5053 125.7206 60.8027 38.0407 178.2104 113 K 3.9777 8.1904 120.2509 59.3823 32.3085 177.5375 114 E 4.1315 8.1680 114.1470 55.5610 30.3103 175.4878 115 N 4.0079 7.9696 116.1332 52.2285 37.3050 173.0274 116 R 4.5877 6.6705 114.0211 55.0644 33.7488 176.4314 117 F 4.9228 8.7643 119.3355 57.4626 41.1148 174.4135 118 I 5.0510 8.9789 121.5970 59.7426 40.6168 174.2394 119 E 4.7964 9.4853 126.8351 55.1267 31.2176 175.0184 120 I 4.6762 9.4650 126.1470 59.4442 39.4001 175.3929 121 G 4.3954 9.1082 113.4388 44.3533 0.0000 171.8525 122 V 4.9668 8.2981 122.1441 61.0782 33.9200 174.4658 123 T 4.7526 8.8022 122.3141 60.2023 70.6652 174.2002 124 R 4.7407 9.5903 122.4779 56.1143 30.1199 176.2977 125 R 4.5753 7.8316 119.0131 54.8350 32.6678 175.7531 126 E 4.1341 8.5954 117.9404 57.1895 30.5041 178.4791 127 V 3.7722 8.5793 117.4810 64.8425 31.7104 178.4121 128 H 4.2060 8.2960 115.5671 58.9902 28.6120 177.5758 129 T 3.8906 8.0637 117.0966 66.9870 68.3019 175.7640 130 Y 3.8695 8.1317 121.1433 60.7150 38.6698 176.9949 131 Y 3.9804 8.5838 120.9805 61.1041 38.8760 178.5098 132 L 4.1048 8.1996 119.5442 57.5038 41.6821 179.1454 133 E 3.7951 8.0209 118.7941 59.2897 29.4023 179.4271 134 K 3.5706 7.8537 119.2070 59.2658 32.2689 178.4085 135 A 3.8056 7.8687 121.4627 55.5842 18.0277 179.4860 136 N 4.3416 8.3628 113.5193 55.7765 38.5838 177.5976 137 K 3.9385 7.6263 120.9900 59.4819 32.4854 178.8458 138 I 3.9313 7.5483 111.8299 61.5373 38.7716 175.8617 139 K 3.8114 7.7059 119.3668 57.4998 29.9062 174.4583 140 S 4.7112 7.4930 110.5442 56.7340 65.7139 173.0132 141 E 4.5337 8.8538 124.7345 56.3841 29.8229 176.5738 142 K 4.5249 7.8381 117.3952 56.9180 34.6619 176.4276 143 T 4.4928 8.0432 116.3651 63.3173 69.0785 174.4568 144 H 4.4860 9.3358 127.3400 55.9804 31.5461 173.8105 145 I 4.9040 8.7361 125.6888 59.7294 40.4292 174.0884 146 H 5.1069 9.2188 125.8546 54.7028 32.9606 171.7347 147 I 4.9976 8.8976 127.4644 59.6364 39.7593 174.9156 148 F 5.3323 9.3913 125.0536 55.6365 42.4693 174.5069 149 S 5.5489 8.5862 115.9248 55.4897 66.0757 174.9841 150 F 4.3502 9.3017 118.3172 59.2137 38.7025 176.2658 151 T 4.5089 7.8600 110.6262 61.8871 69.3546 175.9010 152 G 4.0856 7.9406 109.8697 44.9919 0.0000 173.6498 153 E 4.3855 8.2180 121.5793 56.3644 30.7701 175.3923 154 E 5.1968 8.4853 121.6587 55.3823 33.3603 174.0035 155 M 4.9123 8.8137 119.5107 54.3146 36.1224 173.4286 156 A 5.0603 7.9177 126.0902 49.7761 23.4321 175.2930 157 T 3.9711 8.2929 116.2770 64.5385 68.8843 174.9334 158 K 3.6703 9.1240 123.4892 56.8008 29.5730 175.0312 159 A 3.4572 7.5282 118.6053 53.0506 16.5465 177.7640 160 D 4.7284 7.7447 119.5453 54.7066 41.1247 175.5803 161 Y 4.1078 8.6204 123.7113 57.6937 38.4876 176.2537 162 T 3.7095 7.8355 120.7866 64.6272 67.7347 172.5065 163 L 4.4671 7.4975 119.3167 53.4972 43.2835 176.8917 164 D 4.6569 8.2498 120.5800 52.8001 41.5325 177.0063 165 E 3.8975 8.7505 119.6478 59.8009 29.4088 179.3479 166 E 3.8816 8.1257 118.2691 59.4557 29.8863 178.4972 167 S 4.0503 8.0922 112.6104 61.6629 62.3774 176.4357 168 R 4.0285 8.0509 120.3002 58.9961 29.7661 178.8188 169 A 4.0016 8.3606 121.0721 55.0897 18.3289 179.8564 170 R 3.8104 8.0198 116.6424 59.3375 30.0731 179.1692 171 I 3.4234 7.4036 118.9742 64.4669 37.0948 178.6240 172 K 3.5625 7.9676 119.0387 59.6065 31.7373 179.6353 173 T 3.9340 7.9760 116.2305 66.5506 68.3313 176.6982 174 R 3.8519 7.8809 120.6508 59.3693 30.0606 178.5224 175 L 3.8719 7.8195 118.8480 57.7534 41.4666 179.4953 176 F 4.5389 7.7285 117.6929 60.9170 38.7483 177.7427 177 T 3.8848 8.1770 115.3695 66.6997 68.2103 176.5429 178 I 3.7936 7.9769 121.6101 64.5498 37.1683 178.3199 179 R 3.5722 8.2654 119.6308 59.4504 29.7719 178.5190 180 Q 3.8401 8.2139 117.4720 58.9595 28.8005 177.9777 181 E 3.9394 8.4790 121.5699 59.2589 29.7127 178.5287 182 M 3.4369 8.1101 118.8537 58.2789 31.9537 178.4634 183 A 4.0308 8.1697 121.0564 55.4008 18.2736 179.3085 184 S 4.0172 7.8708 110.4061 61.2132 62.5671 175.8156 185 R 4.5307 7.5094 116.7558 55.1776 29.9440 177.3598 186 G 3.9572 7.9844 106.8898 46.7342 0.0000 175.3369 187 L 4.3612 7.8961 120.9546 55.2840 42.0478 178.7647 188 W 4.1733 8.0627 128.6248 60.2547 30.5699 176.8326 189 D 4.2022 8.2645 116.5377 57.7666 40.6753 178.2091 190 S 4.1041 7.8626 112.5415 61.1736 62.0193 175.4508 191 F 4.0516 7.8786 123.3241 61.4767 38.8733 177.1882 192 R 3.0281 7.2797 116.7584 58.2517 29.7242 177.4031 193 Q 4.2935 7.1073 115.3606 55.6120 29.2879 176.0048 194 S 4.4980 6.9147 112.9922 57.5952 63.5213 173.4461 195 E 4.0954 7.8055 122.8764 55.6200 29.9238 175.6835 196 R 4.6448 8.1882 122.0364 53.5219 32.2698 175.7897 197 G 3.7053 8.3752 107.6995 45.5052 0.0000 173.4837 198 E 4.0344 8.4555 118.8113 56.2885 29.7043 176.7136 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 -3 P 0.00 4.34 0.00 2.21 2.13 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.00 0.00 -2 L 8.27 4.48 0.00 1.61 1.65 0.93 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 -1 G 9.04 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 0 S 8.40 4.81 0.00 3.96 3.79 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 0.00 0.00 0.00 0.00 1 M 8.88 4.18 0.00 2.28 2.10 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.89 0.00 2 E 8.42 4.19 0.00 2.23 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 0.00 2.62 2.65 0.00 3 D 8.56 4.42 0.00 3.02 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.37 4.06 0.00 3.15 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 5 V 8.44 3.61 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 0.05 0.00 0.00 0.85 0.00 0.00 6 R 7.81 4.06 0.00 1.91 2.03 0.00 3.30 0.00 0.00 3.32 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.02 0.00 7 Q 7.68 4.25 0.00 1.90 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.70 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 8 C 7.61 4.35 0.00 1.50 2.23 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 9 F 7.32 4.71 0.00 3.07 2.85 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 10 N 8.84 4.22 0.00 2.86 2.80 0.00 0.00 6.85 7.71 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 11 P 0.00 4.29 0.00 2.33 2.32 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 12 M 8.00 4.03 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.65 0.00 13 I 7.84 3.81 2.14 0.00 0.00 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 1.66 0.98 0.85 0.00 0.00 14 V 7.95 3.59 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 1.33 0.00 0.00 1.02 0.00 0.00 15 E 8.61 4.15 0.00 2.31 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 2.36 2.54 0.00 16 L 8.14 4.06 0.00 2.01 1.79 1.18 0.86 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 17 A 8.51 4.12 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 18 E 8.79 3.80 0.00 2.19 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 2.06 2.75 0.00 19 K 8.18 3.86 0.00 1.98 1.92 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.86 1.66 7.81 20 A 8.12 4.10 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 21 M 7.87 4.26 0.00 2.05 2.19 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.62 0.00 22 K 8.67 3.89 0.00 1.79 1.86 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.52 7.81 23 E 8.42 3.92 0.00 1.98 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.17 0.00 24 Y 7.19 4.67 0.00 3.17 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 25 G 7.82 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 26 E 7.99 4.54 0.00 2.02 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 2.30 2.27 0.00 27 D 8.24 4.79 0.00 2.66 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 28 P 0.00 3.98 0.00 1.39 0.49 0.00 3.55 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 1.69 1.76 0.00 29 K 8.70 4.13 0.00 1.84 1.86 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.64 1.35 7.81 30 I 7.21 4.17 1.97 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 1.42 0.53 0.92 0.00 0.00 31 E 8.26 4.42 0.00 2.01 1.95 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 2.34 2.47 0.00 32 T 7.75 4.28 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 1.51 0.00 0.00 33 N 8.27 4.58 0.00 2.83 3.01 0.00 0.00 6.79 7.71 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 34 K 8.16 4.00 0.00 1.87 2.08 0.00 1.75 0.00 0.00 1.92 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.57 1.55 7.81 35 F 8.53 4.43 0.00 3.13 3.24 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 36 A 8.52 3.78 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 37 A 8.58 4.35 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 38 I 8.22 3.65 2.10 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.82 0.95 0.00 0.00 39 C 7.76 3.74 0.00 1.98 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 40 T 7.69 3.99 4.64 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 1.39 0.00 0.00 41 H 8.43 4.08 0.00 3.18 3.45 0.00 5.60 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 142 K 7.84 4.52 0.00 1.77 1.92 0.00 1.68 0.00 0.00 1.93 0.00 0.00 3.15 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.53 7.81 143 T 8.04 4.49 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 1.31 0.00 0.00 144 H 9.34 4.49 0.00 3.27 3.20 0.00 5.72 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 0.00 145 I 8.74 4.90 1.52 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 0.90 0.39 0.50 0.00 0.00 146 H 9.22 5.11 0.00 3.20 3.06 0.00 5.57 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 I 8.90 5.00 1.96 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.42 0.92 0.00 0.00 148 F 9.39 5.33 0.00 2.85 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 0.00 149 S 8.59 5.55 0.00 4.01 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 0.00 150 F 9.30 4.35 0.00 3.49 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 0.00 151 T 7.86 4.51 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 1.41 0.00 0.00 152 G 7.94 4.09 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 0.00 0.00 0.00 153 E 8.22 4.39 0.00 2.16 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 2.34 2.30 0.00 154 E 8.49 5.20 0.00 1.82 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 2.14 2.31 0.00 155 M 8.81 4.91 0.00 2.05 1.76 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.89 0.00 156 A 7.92 5.06 0.30 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 0.00 157 T 8.29 3.97 3.66 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 1.19 0.00 0.00 158 K 9.12 3.67 0.00 1.91 1.89 0.00 1.93 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.42 7.81 159 A 7.53 3.46 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 0.00 160 D 7.74 4.73 0.00 2.64 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 0.00 161 Y 8.62 4.11 0.00 3.03 3.04 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 0.00 162 T 7.84 3.71 4.50 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 1.58 0.00 0.00 163 L 7.50 4.47 0.00 1.53 1.48 -0.02 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 164 D 8.25 4.66 0.00 2.91 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 0.00 165 E 8.75 3.90 0.00 1.99 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 0.00 2.40 2.32 0.00 166 E 8.13 3.88 0.00 2.02 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 2.37 2.37 0.00 167 S 8.09 4.05 0.00 3.93 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 0.00 168 R 8.05 4.03 0.00 2.00 2.20 0.00 3.65 0.00 0.00 3.55 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.92 0.00 169 A 8.36 4.00 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 0.00 170 R 8.02 3.81 0.00 2.02 1.94 0.00 3.12 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.87 0.00 171 I 7.40 3.42 1.60 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.50 -0.07 0.00 0.00 172 K 7.97 3.56 0.00 1.77 1.45 0.00 1.69 0.00 0.00 1.84 0.00 0.00 3.07 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.50 1.73 7.81 173 T 7.98 3.93 4.38 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 1.25 0.00 0.00 174 R 7.88 3.85 0.00 1.87 1.96 0.00 3.11 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 175 L 7.82 3.87 0.00 1.40 1.16 0.56 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 176 F 7.73 4.54 0.00 3.26 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 0.00 177 T 8.18 3.88 4.37 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 1.20 0.00 0.00 178 I 7.98 3.79 2.32 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 1.34 0.84 1.25 0.00 0.00 179 R 8.27 3.57 0.00 1.50 1.94 0.00 2.85 0.00 0.00 2.71 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 180 Q 8.21 3.84 0.00 2.28 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.62 0.00 181 E 8.48 3.94 0.00 2.41 2.40 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 2.47 2.69 0.00 182 M 8.11 3.44 0.00 1.95 2.22 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 1.33 0.00 183 A 8.17 4.03 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 0.00 184 S 7.87 4.02 0.00 4.13 3.95 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 0.00 185 R 7.51 4.53 0.00 1.99 1.91 0.00 3.54 0.00 0.00 3.39 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 186 G 7.98 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 187 L 7.90 4.36 0.00 1.78 1.53 0.94 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 188 W 8.06 4.17 0.00 3.45 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 0.00 189 D 8.26 4.20 0.00 2.72 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 0.00 190 S 7.86 4.10 0.00 3.90 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 0.00 191 F 7.88 4.05 0.00 3.11 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 0.00 192 R 7.28 3.03 0.00 0.67 1.02 0.00 3.33 0.00 0.00 3.48 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.41 0.00 193 Q 7.11 4.29 0.00 1.87 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 2.21 2.35 0.00 194 S 6.91 4.50 0.00 3.89 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 0.00 195 E 7.81 4.10 0.00 1.73 1.78 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 2.30 2.28 0.00 196 R 8.19 4.64 0.00 1.89 1.84 0.00 3.07 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.55 0.00 197 G 8.38 3.71 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 0.00 0.00 0.00 198 E 8.46 4.03 0.00 1.93 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 2.08 1.99 0.00 * Residues marked with a * may have inaccurate shift predictions.