NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 A 4.3189 8.2649 123.5806 52.1952 19.8175 175.8372 8 S 4.5313 8.1702 117.3139 55.3731 67.1008 172.3438 9 S 4.4559 9.3355 115.8689 58.9861 64.4063 173.8048 10 L 4.7764 7.5194 121.0517 52.0095 44.4180 174.0501 11 P 4.4638 0.0000 0.0000 62.2443 32.3248 176.5277 12 Q 3.9461 9.1323 124.5391 59.6163 28.8561 179.1510 13 S 4.1064 8.2267 114.3139 61.4282 62.6505 176.3266 14 F 4.2136 8.7156 124.5893 61.2757 39.2518 177.2555 15 L 3.6154 7.9227 118.0924 57.6533 41.2695 179.4157 16 L 3.9747 8.1694 119.3218 57.6077 41.5641 179.6498 17 K 3.9466 7.9619 118.4768 59.2924 31.8946 179.1991 18 C 3.8767 7.8554 117.3348 62.8554 28.1559 176.2177 19 L 4.0498 7.7719 120.3482 57.6208 41.0232 179.1986 20 E 3.9883 7.7588 119.5768 59.0898 29.5269 178.7536 21 Q 3.7538 7.8035 118.2457 58.4424 28.4914 178.6969 22 V 3.5297 7.5069 119.3681 66.1159 31.6329 178.2846 23 R 3.7604 7.6892 117.1755 59.0425 29.9034 178.8441 24 K 3.8331 8.2360 119.7063 59.8065 32.1852 178.9209 25 I 3.7950 8.0983 120.2877 64.3611 36.6546 178.4398 26 Q 4.3180 7.9020 120.6772 57.8704 28.4912 178.6062 27 G 3.6323 8.0031 106.9116 47.2270 0.0000 175.7945 28 D 4.4607 8.0467 121.4446 57.2295 40.8463 179.0183 29 G 3.5646 8.2239 106.1181 47.5363 0.0000 175.7211 30 A 3.9767 7.7768 122.5515 54.8010 18.3287 179.4183 31 A 3.8880 7.8793 119.2963 55.2102 18.3828 179.4735 32 L 3.8323 7.8527 118.5751 58.6747 42.3689 179.3504 33 Q 3.9608 8.5065 118.1356 58.6243 28.5230 178.7126 34 E 3.8493 8.4061 121.0015 59.0367 29.7632 178.4317 35 K 3.7449 8.2393 120.0929 59.8117 32.1483 178.6687 36 L 4.0715 8.0648 119.0022 57.7666 40.9900 178.6792 37 C 4.4325 8.2812 119.3089 58.5288 43.3498 175.5664 38 A 3.9161 8.0648 122.1295 55.6000 18.1683 179.5687 39 T 3.9055 8.0445 113.0180 65.8775 68.7020 175.1983 40 Y 5.0047 7.6293 117.3062 58.2785 39.5848 175.4595 41 K 4.3702 8.1800 114.9749 56.3076 29.9592 175.6939 42 L 4.5493 7.6074 121.4418 53.7283 40.1929 176.0848 43 C 4.6819 8.4820 119.1724 56.7291 43.3252 173.7419 44 H 4.8054 8.0024 116.4190 52.5751 29.7926 172.0199 45 P 4.2449 0.0000 0.0000 66.0498 30.8238 177.8929 46 E 3.9854 8.3140 117.7877 59.5977 29.1496 178.9675 47 E 4.1084 8.4092 117.4645 58.4150 29.7974 178.2322 48 L 4.5599 7.9123 117.4363 54.5685 42.2750 178.6130 49 V 3.5255 7.4079 119.7860 66.2027 31.4911 177.7914 50 L 4.0850 8.1018 117.9388 57.6991 41.3594 178.9650 51 L 4.3205 8.5969 118.5567 56.3755 41.5704 179.1108 52 G 3.7653 8.3506 108.7963 48.4321 0.0000 175.6691 *53 H 4.3740 7.9808 121.8024 59.2930 27.9831 182.3527 54 S 4.3277 8.0077 117.1015 61.4468 62.8485 176.0495 55 L 4.0574 8.2185 117.6241 54.3862 42.3605 176.2878 56 G 3.6278 7.6934 106.4025 46.4341 0.0000 174.7561 57 I 4.3159 7.9268 118.5066 58.7067 38.5259 175.0837 58 P 4.5113 0.0000 0.0000 62.6008 32.2765 175.9587 *59 W 4.5219 8.1459 119.2751 54.0561 29.9766 176.2733 60 A 4.0067 8.5868 127.9479 50.2329 18.2853 175.3526 61 P 4.6824 0.0000 0.0000 62.3180 32.6166 176.5120 62 L 4.7680 8.0818 121.7032 52.9985 42.3517 175.8699 63 S 4.3289 8.6862 119.3625 60.6957 60.2856 175.0596 64 S 3.6443 7.5660 110.2913 59.9916 59.7129 171.2191 65 C 4.8751 7.9004 124.7915 54.4701 42.6611 174.6185 66 P 4.2296 0.0000 0.0000 66.1298 31.2868 177.3116 67 S 4.5031 7.4236 109.3586 58.6150 65.3589 175.6736 68 Q 4.9023 7.6716 128.5697 53.8056 29.9341 172.5960 69 A 4.1187 8.9270 119.4183 56.4154 18.3787 178.2211 70 L 4.6937 7.6794 119.4465 52.9085 43.9037 183.8067 71 Q 4.4901 8.3534 124.6011 53.5217 26.8186 172.2372 72 L 4.2640 8.2159 120.8262 55.1642 40.6049 177.0040 73 A 4.0402 8.2940 119.8570 55.3854 18.0278 179.7587 74 G 3.6337 7.9496 103.1555 47.8277 0.0000 176.2310 75 C 4.2609 8.2114 120.7573 59.5687 41.5090 175.5873 76 L 3.9987 7.7828 120.3643 57.7882 41.1836 179.1442 77 S 4.1993 7.6616 111.7156 61.8170 62.1298 176.5361 78 Q 4.0801 8.3164 120.4044 58.7895 28.5456 178.1165 79 L 4.1764 8.1117 121.4290 58.6334 42.0463 178.5708 80 H 4.1479 8.7778 118.3786 59.3990 29.8468 177.2769 81 S 4.3519 8.4962 117.1396 61.7032 62.6946 176.7487 82 G 3.1577 8.5294 108.5352 47.8024 0.0000 175.4225 83 L 4.2094 8.2792 122.1393 57.4427 41.5618 179.6861 84 F 4.3185 8.4127 120.5134 61.0028 39.2604 177.0492 85 L 3.5558 7.7566 119.9663 58.3794 41.8529 178.7019 86 Y 4.2460 7.5951 116.3863 60.7657 37.2059 178.2420 87 Q 4.0742 8.1713 121.1382 58.8955 29.0952 178.6386 88 G 3.4044 7.4776 106.7741 47.5862 0.0000 175.5750 89 L 4.0913 8.1103 122.4718 57.7509 41.5121 179.8514 90 L 4.0332 8.0374 117.3711 57.8116 41.8314 179.3403 91 Q 4.1209 7.7465 116.8229 58.5970 28.4459 178.2707 92 A 4.2233 7.9497 121.0168 54.6203 18.6227 178.8833 93 L 3.7349 7.7024 114.4096 55.4900 41.8950 177.4585 94 E 3.7640 8.8368 118.3676 57.5102 27.1072 176.7156 95 G 3.8742 8.0741 108.8782 44.7999 0.0000 173.7308 96 I 3.4790 8.7795 124.9456 60.5888 36.2440 174.1544 97 S 4.6044 7.2448 111.5814 56.1398 65.9118 174.9518 98 P 4.2175 0.0000 0.0000 66.1869 31.0634 178.4930 99 E 4.0960 8.2281 115.8635 58.7325 29.6650 178.2892 100 L 4.5127 7.5540 117.7347 55.3812 42.3638 178.9677 101 G 3.9930 8.1591 106.8426 47.5133 0.0000 173.7021 102 P 4.2386 0.0000 0.0000 65.6216 31.3259 178.7251 103 T 3.8562 7.8786 113.8264 66.6727 68.3196 176.3063 104 L 3.9444 8.1871 122.3536 58.0392 42.0608 178.2996 105 D 4.3665 8.4786 118.4772 57.6110 41.0848 178.4974 106 T 3.8298 7.9043 116.1405 66.6157 68.6474 176.2213 107 L 3.9577 7.6286 122.2057 58.2144 41.9496 178.8517 108 Q 3.9617 8.4940 119.7247 59.1744 28.9938 178.1408 109 L 4.0151 8.1671 120.2030 58.1209 41.6722 179.3012 110 D 4.3966 8.2041 118.6780 57.3586 40.6870 179.1637 111 V 3.8231 7.8403 118.3683 65.6546 31.4838 177.9069 112 A 4.0873 8.4334 120.9691 55.4821 18.3123 179.3729 113 D 4.3993 8.4491 117.5275 57.5296 40.9726 178.8327 114 F 4.6872 8.3521 120.6649 61.3463 39.4292 177.0874 115 A 3.9411 8.2998 120.4815 55.3482 18.1165 179.6213 116 T 3.9381 8.2735 114.4832 67.2702 68.7205 176.5807 117 T 4.0641 8.6370 117.8338 67.2179 68.5859 176.5837 118 I 4.0764 8.0178 121.1364 64.0140 37.0534 178.2299 119 W 4.0483 8.4712 129.2166 60.8205 30.6790 178.0552 120 Q 3.9255 8.5985 118.1162 58.8856 28.0687 178.9462 121 Q 3.6989 7.9417 120.4103 59.2891 29.0511 177.8919 122 M 3.7825 7.7827 119.6970 58.3188 31.8158 178.6754 123 E 3.5851 7.7899 118.5824 59.3569 29.4400 178.7570 124 E 3.8099 7.6938 117.7893 59.0852 29.6600 178.0773 125 L 4.3465 7.5901 115.8732 53.6795 42.2098 176.7057 126 G 3.7658 8.0034 107.2952 47.2174 0.0000 174.3623 127 M 4.3568 8.1387 117.5322 54.1952 33.1400 176.6659 128 A 3.5912 7.4638 122.4830 51.0864 18.9734 175.8468 129 P 4.3430 0.0000 0.0000 62.6113 32.0402 176.8051 130 A 4.0027 8.5802 124.0290 54.1046 18.6333 177.3072 131 L 4.5160 7.6473 117.4560 53.1496 42.3233 175.9225 132 Q 4.1396 8.4868 125.8425 54.9103 29.3193 174.8632 133 P 4.2739 0.0000 0.0000 63.0581 31.7572 175.7740 134 T 4.5850 8.2712 119.8592 61.2019 70.3909 174.1905 135 Q 3.9320 8.8668 127.5198 56.4034 29.5494 176.8120 136 G 3.7537 8.2213 113.1812 44.2825 0.0000 172.2271 137 A 3.9353 8.3024 122.6990 52.3512 18.0204 177.2429 138 M 4.2712 8.3806 123.5574 53.7781 32.6477 175.0017 139 P 3.9990 0.0000 0.0000 62.8332 31.8045 175.4781 140 A 4.3369 7.9597 123.9807 51.1255 20.0407 177.5885 141 F 4.6803 8.2458 121.0705 54.9702 38.6847 175.1907 142 A 4.0693 8.3808 126.7693 54.6646 18.9214 179.1498 143 S 4.7146 8.2089 109.6090 56.6016 66.2833 174.9069 144 A 3.9473 8.4757 124.0726 55.6297 18.0446 179.7839 145 F 4.0295 8.2152 118.3238 61.5728 39.4832 177.1089 146 Q 3.9782 7.9215 117.7757 59.0391 28.5020 179.0927 147 R 3.7640 8.1869 119.1899 58.9883 30.1491 179.4225 148 R 3.7765 7.8845 117.7511 59.2047 30.1140 178.9794 149 A 3.8730 7.8571 121.0138 54.8676 18.2626 179.7027 150 G 3.5680 8.3510 104.8796 47.8091 0.0000 175.9729 151 G 3.4590 7.7735 107.8925 47.6608 0.0000 175.7924 152 V 3.5514 7.4677 120.8936 65.4523 31.3402 178.1882 153 L 3.8454 7.9740 118.5648 57.8383 41.5646 179.4834 154 V 3.5713 8.2648 118.2295 66.0552 31.4172 177.8582 155 A 3.9619 8.2238 120.7477 55.2055 18.1124 179.5918 156 S 4.0903 7.9733 111.6938 61.5666 62.3414 176.1841 157 H 4.3364 8.4149 119.4432 58.6343 28.4854 177.3086 158 L 2.9190 7.8772 122.5526 57.8976 41.3263 178.8347 159 Q 3.9166 7.9180 119.3397 59.4318 28.8824 178.5298 160 S 4.2672 7.9973 115.8489 61.3355 62.8199 176.4339 161 F 4.3615 8.4934 123.9113 61.2882 39.1685 177.1252 162 L 4.0747 8.3780 118.5642 57.1928 41.2325 179.2043 163 E 3.9921 8.0297 118.8814 59.1562 29.3540 179.4820 164 V 3.6069 7.5700 118.4250 66.2325 31.6118 178.1166 165 S 4.0192 7.7923 114.9168 61.9249 62.5954 176.2796 166 Y 4.0088 8.2218 122.0826 60.5987 38.5173 178.2467 167 R 3.8666 7.8405 118.9520 59.1472 30.3179 178.9427 168 V 3.5214 7.8109 117.9434 66.2058 31.5425 178.0676 169 L 3.9283 8.1249 118.7649 57.7991 41.3643 179.4247 170 R 3.6389 8.0060 118.9707 59.4859 29.5453 178.1590 171 H 4.1052 7.9083 117.2657 59.3652 30.0862 176.7185 172 L 3.9823 7.5703 118.8124 58.4319 41.4565 178.9357 173 A 4.1671 7.8631 120.1738 51.7800 19.8294 177.0752 174 Q 3.3517 7.9573 115.2477 55.6472 26.4430 172.6218 175 P 4.3980 0.0000 0.0000 62.8469 31.3051 176.8249 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 7 A 8.26 4.32 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 8.17 4.53 0.00 4.01 3.74 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 9 S 9.34 4.46 0.00 3.95 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 10 L 7.52 4.78 0.00 1.69 1.76 1.06 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.46 0.00 2.27 2.20 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.01 0.00 12 Q 9.13 3.95 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.89 0.00 0.00 0.00 0.00 0.00 2.44 2.52 0.00 13 S 8.23 4.11 0.00 4.13 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 0.00 14 F 8.72 4.21 0.00 3.15 3.36 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 15 L 7.92 3.62 0.00 1.85 1.61 0.94 0.66 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 16 L 8.17 3.97 0.00 1.64 1.67 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.96 3.95 0.00 1.90 1.81 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.76 7.81 18 C 7.86 3.88 0.00 2.87 2.97 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 0.00 0.00 0.00 19 L 7.77 4.05 0.00 1.83 1.81 0.75 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 20 E 7.76 3.99 0.00 2.05 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 2.24 2.30 0.00 21 Q 7.80 3.75 0.00 0.98 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.58 0.00 0.00 0.00 0.00 0.00 2.17 2.34 0.00 22 V 7.51 3.53 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 1.19 0.00 0.00 1.10 0.00 0.00 23 R 7.69 3.76 0.00 2.00 1.87 0.00 3.14 0.00 0.00 3.00 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.59 0.00 24 K 8.24 3.83 0.00 1.86 1.87 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.41 1.46 7.81 25 I 8.10 3.80 2.09 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 1.57 0.78 0.97 0.00 0.00 26 Q 7.90 4.32 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 27 G 8.00 3.63 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 0.00 0.00 0.00 28 D 8.05 4.46 0.00 2.87 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 29 G 8.22 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.78 3.98 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 31 A 7.88 3.89 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 32 L 7.85 3.83 0.00 1.84 1.88 0.89 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 8.51 3.96 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.60 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 34 E 8.41 3.85 0.00 2.13 2.01 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 2.27 2.42 0.00 35 K 8.24 3.74 0.00 1.97 1.87 0.00 1.49 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.41 7.81 36 L 8.06 4.07 0.00 1.73 1.77 0.94 0.87 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 37 C 8.28 4.43 0.00 3.04 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 38 A 8.06 3.92 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 39 T 8.04 3.91 3.51 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 0.28 0.00 0.00 40 Y 7.63 5.00 0.00 3.08 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 41 K 8.18 4.37 0.00 1.88 1.94 0.00 1.81 0.00 0.00 1.04 0.00 0.00 2.84 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.40 1.44 7.81 42 L 7.61 4.55 0.00 2.01 1.69 0.99 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 43 C 8.48 4.68 0.00 2.88 2.97 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 0.00 0.00 0.00 44 H 8.00 4.81 0.00 3.20 3.41 0.00 5.84 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.24 0.00 2.27 2.34 0.00 3.72 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 2.10 2.08 0.00 46 E 8.31 3.99 0.00 2.11 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 0.00 2.43 2.50 0.00 47 E 8.41 4.11 0.00 2.09 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 2.35 2.47 0.00 48 L 7.91 4.56 0.00 1.80 1.70 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 49 V 7.41 3.53 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 1.06 0.00 0.00 1.04 0.00 0.00 50 L 8.10 4.09 0.00 1.76 1.74 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 51 L 8.60 4.32 0.00 1.88 1.75 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.35 3.77 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 0.00 0.00 0.00 *53 H 7.98 4.37 0.00 2.89 3.04 0.00 7.24 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 S 8.01 4.33 0.00 3.88 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 55 L 8.22 4.06 0.00 1.71 1.63 1.01 1.02 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 S 7.57 3.64 0.00 3.99 3.97 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 0.00 0.00 0.00 65 C 7.90 4.88 0.00 3.10 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 66 P 0.00 4.23 0.00 2.06 2.12 0.00 3.82 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 67 S 7.42 4.50 0.00 3.79 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 68 Q 7.67 4.90 0.00 2.03 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.56 0.00 0.00 0.00 0.00 0.00 2.18 2.13 0.00 69 A 8.93 4.12 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 70 L 7.68 4.69 0.00 1.50 1.52 0.92 0.84 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 71 Q 8.35 4.49 0.00 2.07 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 5.51 0.00 0.00 0.00 0.00 0.00 2.28 1.95 0.00 72 L 8.22 4.26 0.00 1.76 2.19 0.94 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 73 A 8.29 4.04 1.29 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 74 G 7.95 3.63 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 0.00 0.00 0.00 75 C 8.21 4.26 0.00 3.09 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 76 L 7.78 4.00 0.00 1.70 1.77 0.99 1.16 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 77 S 7.66 4.20 0.00 4.11 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 0.00 78 Q 8.32 4.08 0.00 2.39 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.54 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 79 L 8.11 4.18 0.00 2.03 1.71 0.95 0.63 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 80 H 8.78 4.15 0.00 3.34 3.60 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.50 4.35 0.00 4.14 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 82 G 8.53 3.16 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 0.00 0.00 0.00 83 L 8.28 4.21 0.00 1.87 1.83 0.24 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 84 F 8.41 4.32 0.00 2.98 3.19 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 0.00 85 L 7.76 3.56 0.00 1.59 1.21 0.69 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 7.60 4.25 0.00 3.05 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 87 Q 8.17 4.07 0.00 2.32 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 88 G 7.48 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 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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 0.00 106 T 7.90 3.83 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 1.24 0.00 0.00 107 L 7.63 3.96 0.00 1.69 1.83 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 108 Q 8.49 3.96 0.00 2.27 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 109 L 8.17 4.02 0.00 1.87 1.73 0.97 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 110 D 8.20 4.40 0.00 2.85 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.84 3.82 2.31 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 1.15 0.00 0.00 1.11 0.00 0.00 112 A 8.43 4.09 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 0.00 113 D 8.45 4.40 0.00 2.88 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 1.16 1.60 0.00 122 M 7.78 3.78 0.00 1.77 1.76 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.44 0.00 123 E 7.79 3.59 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 1.69 1.79 0.00 124 E 7.69 3.81 0.00 1.99 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 2.25 2.31 0.00 125 L 7.59 4.35 0.00 1.52 1.58 0.83 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 126 G 8.00 3.77 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 0.00 0.00 0.00 127 M 8.14 4.36 0.00 1.84 1.93 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.37 0.00 128 A 7.46 3.59 0.48 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 0.00 0.00 0.00 0.00 0.00 0.00 129 P 0.00 4.34 0.00 2.23 2.08 0.00 3.58 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.11 0.00 130 A 8.58 4.00 1.29 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 0.00 131 L 7.65 4.52 0.00 1.61 1.63 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 132 Q 8.49 4.14 0.00 2.01 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.68 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 133 P 0.00 4.27 0.00 1.37 1.95 0.00 3.01 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 2.02 0.00 134 T 8.27 4.59 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 1.22 0.00 0.00 135 Q 8.87 3.93 0.00 1.96 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.19 2.31 0.00 136 G 8.22 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 A 8.30 3.94 1.21 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 0.00 0.00 0.00 0.00 0.00 138 M 8.38 4.27 0.00 1.98 1.97 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 2.50 2.56 0.00 139 P 0.00 4.00 0.00 1.56 2.10 0.00 3.68 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.99 0.00 140 A 7.96 4.34 1.15 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 0.00 0.00 141 F 8.25 4.68 0.00 2.98 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 0.00 142 A 8.38 4.07 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 0.00 143 S 8.21 4.71 0.00 4.15 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 0.00 144 A 8.48 3.95 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 0.00 145 F 8.22 4.03 0.00 3.11 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 0.00 146 Q 7.92 3.98 0.00 2.34 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 147 R 8.19 3.76 0.00 1.96 1.86 0.00 3.10 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.93 0.00 148 R 7.88 3.78 0.00 1.67 1.84 0.00 2.82 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.75 0.00 149 A 7.86 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 G 8.35 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 G 7.77 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 V 7.47 3.55 2.16 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 1.01 0.00 0.00 0.98 0.00 0.00 153 L 7.97 3.85 0.00 1.81 1.58 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 154 V 8.26 3.57 2.01 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 1.10 0.00 0.00 0.96 0.00 0.00 155 A 8.22 3.96 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 0.00 156 S 7.97 4.09 0.00 4.08 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 0.00 157 H 8.41 4.34 0.00 3.44 3.52 0.00 5.70 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 7.88 2.92 0.00 1.21 1.58 0.65 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 159 Q 7.92 3.92 0.00 2.43 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 160 S 8.00 4.27 0.00 4.06 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 0.00 161 F 8.49 4.36 0.00 3.25 3.27 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 0.00 162 L 8.38 4.07 0.00 1.74 1.72 0.98 1.29 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 0.00 163 E 8.03 3.99 0.00 2.19 2.01 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 2.30 2.57 0.00 164 V 7.57 3.61 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 1.03 0.00 0.00 1.05 0.00 0.00 165 S 7.79 4.02 0.00 3.89 3.84 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 0.00 166 Y 8.22 4.01 0.00 3.16 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 0.00 167 R 7.84 3.87 0.00 2.00 1.96 0.00 3.52 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.81 0.00 168 V 7.81 3.52 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 1.03 0.00 0.00 0.98 0.00 0.00 169 L 8.12 3.93 0.00 1.55 1.58 0.97 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 170 R 8.01 3.64 0.00 1.46 1.74 0.00 2.93 0.00 0.00 3.06 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.36 0.00 171 H 7.91 4.11 0.00 3.12 3.48 0.00 6.03 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 L 7.57 3.98 0.00 1.80 1.74 0.96 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 173 A 7.86 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 174 Q 7.96 3.35 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.89 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 175 P 0.00 4.40 0.00 2.02 1.96 0.00 3.67 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 * Residues marked with a * may have inaccurate shift predictions.