NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 L 4.3053 8.1429 120.7689 54.3827 43.2504 178.6878 4 K 4.3494 7.9332 118.9749 54.5865 31.1373 179.2500 5 D 4.6746 8.2766 125.7305 59.4088 40.3844 182.8798 6 K 4.3124 8.2682 125.1466 61.0849 31.7875 184.2817 7 I 3.9739 7.3961 121.2896 65.2992 35.2511 180.0878 8 L 4.3184 7.8130 119.1597 57.6567 41.4452 179.7756 9 G 3.7353 8.0715 107.9793 48.6867 0.0000 176.7389 10 V 3.6661 7.8035 121.5925 65.6746 31.6358 179.4787 11 A 3.9157 8.0422 123.6381 55.2000 18.3140 180.0986 12 K 4.0522 9.0196 123.8803 60.8764 31.6074 181.3899 13 E 4.1679 7.9945 118.0376 61.1477 29.6693 180.7183 14 L 4.2590 8.1506 119.2060 57.5941 42.0713 179.3115 15 F 4.6160 8.5725 120.3828 60.9152 39.9405 177.0185 16 I 4.4229 7.4231 119.4929 61.0588 32.2238 177.0531 *18 N 4.7862 7.8254 119.8130 52.0762 41.0685 175.4030 19 G 3.9505 8.0390 103.1860 44.4976 0.0000 174.0521 20 Y 4.1205 8.4705 119.6570 60.8168 38.8957 176.8986 21 N 4.3621 8.4217 115.2205 56.3997 38.8564 176.3627 22 A 4.1026 8.1003 119.4156 55.1911 18.6473 178.2465 23 T 4.1976 7.2614 103.9099 61.3504 69.7733 174.2488 24 T 4.4619 7.7660 115.3518 60.1303 71.1484 174.4578 25 T 3.9462 8.6462 121.5322 66.9706 68.2657 176.6481 26 G 3.5965 8.0226 107.0813 47.6905 0.0000 175.0476 27 E 3.9808 8.2982 123.4587 59.7698 29.3613 180.4333 28 I 3.8085 7.8951 121.0130 64.9710 35.6165 180.4189 29 V 4.3532 7.3788 120.7824 65.8938 32.0510 182.5745 30 K 4.2501 8.1964 126.1243 59.5907 32.9659 180.6802 31 L 4.6027 7.4769 120.7831 50.9982 39.4509 178.1935 32 S 5.5065 8.3970 127.4699 57.9406 64.7054 175.1503 33 E 3.6848 8.7075 124.6901 56.5734 26.1285 173.5285 34 S 4.6038 7.8949 117.2296 57.0278 66.2051 175.7401 35 S 4.3704 8.6790 123.0447 58.0102 62.8235 174.9991 36 K 3.9242 8.8032 123.8110 57.9648 31.7382 179.6843 37 G 3.7101 8.3060 109.9615 49.0249 0.0000 174.8233 38 N 4.2848 8.5096 118.6826 55.8600 37.7947 178.1979 39 L 4.3273 7.1749 118.8123 52.0915 38.8789 178.6980 40 Y 4.9513 7.2491 116.6417 57.3854 40.4618 171.6742 *43 F 4.6395 8.0635 121.0865 56.6422 38.3209 176.3509 44 K 3.8037 7.9853 129.6822 56.5872 32.2979 175.4470 45 T 4.4531 7.4822 107.6934 60.7608 71.6071 175.7260 46 K 4.0833 8.5601 121.4401 59.5556 31.8037 178.1262 47 E 4.2301 8.3636 116.4472 58.3877 29.2438 177.8317 48 N 4.5238 7.9450 118.6495 55.7295 39.2045 176.5995 49 L 3.3827 7.6758 121.7867 57.8356 42.4131 178.4004 50 F 3.8868 8.5113 120.9853 61.4064 39.0367 176.9300 51 L 3.6177 7.1913 117.1201 57.7866 41.9312 178.2705 52 E 3.9568 7.6705 119.4610 59.2080 29.5583 178.7554 53 I 3.6019 7.4475 119.8487 64.3399 37.0974 178.3253 54 L 3.8464 7.2843 119.2818 57.7159 41.3295 179.4377 55 N 4.3398 7.8655 116.6446 56.1554 38.5327 177.5492 56 I 3.8448 7.6276 114.0585 63.9089 37.6681 177.8219 57 E 4.1802 8.2173 120.1583 58.6695 29.5132 178.5038 58 E 3.8109 8.5805 119.9610 59.2449 29.5816 179.1660 59 S 4.0429 8.5975 115.5449 61.3843 62.9682 176.5154 60 K 3.5615 7.7962 121.2147 59.1660 31.6531 178.9611 61 W 4.5413 7.9554 128.1829 60.8655 30.8325 177.8476 62 Q 3.5658 8.0419 119.0366 58.3077 28.3044 176.9608 63 E 4.2434 8.2483 119.6553 57.4944 29.4374 177.6877 64 Q 3.9841 7.7693 119.9465 58.8999 29.0829 177.6468 65 W 4.1603 8.1474 132.1910 60.6568 30.3645 178.8822 66 K 3.6067 7.2313 121.8913 59.6457 31.2571 181.9581 67 S 4.4155 7.6257 114.4055 60.0259 63.0540 175.2910 68 E 4.5325 7.4358 119.3836 56.0888 31.0350 177.3859 69 Q 3.5181 7.1810 117.2630 57.5717 28.5235 177.9126 70 I 3.6737 7.3633 114.2930 63.6967 37.6052 177.7934 71 K 4.2272 7.3588 119.1418 57.8475 31.8593 176.9360 72 A 4.2588 7.3289 122.4727 51.6256 18.3917 177.3387 73 K 4.0739 9.2970 124.0524 59.3184 32.7438 178.3102 74 T 4.5431 7.4542 108.2022 59.9958 72.4457 174.9236 75 N 4.5574 8.8775 118.0106 56.2420 38.0024 177.8632 76 R 4.5171 8.7047 120.6620 59.5795 30.1182 178.5051 77 E 4.0848 8.2098 118.6061 59.4556 29.5248 179.2183 78 K 4.2883 8.2302 118.1949 59.6722 32.1400 179.0870 79 F 4.2125 8.6954 120.7062 61.5784 39.3327 176.5036 80 Y 3.9391 8.2486 116.0080 61.1363 37.7774 178.7630 81 L 4.2971 8.5336 122.4449 58.0366 42.3885 177.9883 82 Y 3.5180 8.4751 119.8873 60.9611 38.2033 178.1985 83 N 4.3221 7.7572 115.5704 56.1315 38.4491 177.1080 84 E 4.0403 8.3024 120.1671 59.4175 29.6535 179.0083 85 L 4.0849 8.5927 119.1479 58.3408 41.5733 179.6801 86 S 3.1717 7.5896 113.7804 61.6617 62.6993 176.7599 87 L 3.9057 7.5689 120.6629 57.6728 41.4798 179.1060 88 T 4.1063 7.5495 108.1869 63.0784 69.5320 175.4280 89 T 4.0012 7.1777 111.4846 61.9396 69.0656 173.6682 90 E 4.3104 8.3647 119.5271 56.2319 30.2696 175.0373 91 Y 4.7189 7.4699 117.2586 57.8185 39.6415 173.0332 92 Y 3.7008 8.0078 125.7619 58.9588 39.1709 171.3444 93 Y 3.6750 7.2888 116.2123 60.4829 38.1980 176.4583 94 P 4.4421 0.0000 0.0000 63.3447 31.7564 177.0742 95 L 4.3710 7.8578 119.1329 55.4389 42.0376 178.1514 96 Q 3.8193 7.3122 118.7211 59.2032 28.6698 179.0603 97 N 4.2276 8.0194 116.4305 56.3808 38.5216 177.0915 98 A 4.0896 8.4243 122.3484 55.0308 18.3049 179.8340 99 I 3.7807 7.6643 118.0077 64.7146 37.0792 178.2347 100 I 3.5559 7.3271 119.1575 64.5834 36.9902 178.0735 101 E 4.0919 7.7856 118.2318 59.3582 29.4576 178.9980 102 F 3.8089 7.5613 120.6973 61.4206 39.1229 176.2396 103 Y 3.8260 8.4146 119.0034 59.8945 38.5603 177.2259 104 T 4.2329 7.1940 108.2649 60.7203 68.6625 174.7085 105 E 4.7384 7.2590 122.7653 59.4175 36.5424 176.8142 *106 Y 4.4991 7.5099 122.5938 55.0825 35.8613 177.5503 107 Y 4.7410 7.3795 119.1733 56.1083 39.4337 173.9090 *109 T 4.0289 7.9430 123.0747 63.4439 68.5415 173.8487 110 N 4.8213 8.4588 123.8932 54.1623 38.9672 175.7314 111 S 4.2979 8.0150 111.6321 61.4484 62.4353 176.0944 112 I 3.7888 7.5692 122.4557 64.2328 36.5563 177.8811 113 N 4.3892 7.7698 117.7031 57.2593 38.6513 177.6118 114 E 4.2384 8.3076 121.4078 61.4979 29.4883 181.6648 115 K 4.2366 8.2970 124.7410 59.7171 31.6363 180.4801 116 M 4.5627 7.9053 116.4615 55.3680 31.4759 177.4389 117 N 4.4628 8.0457 123.0705 57.4030 38.9495 177.6817 118 K 4.0539 7.6510 125.7007 59.6010 31.4878 181.9723 119 L 4.2465 7.8890 121.9291 58.6068 42.3498 179.3747 120 Q 4.3756 7.8249 120.8283 60.5283 27.9773 181.2657 121 N 4.6266 8.3539 118.5637 55.6535 38.2413 177.5228 122 K 4.0679 7.6322 120.8697 59.5681 32.3770 177.9584 123 Y 4.3871 8.0258 119.1848 60.2137 38.9002 177.1434 124 I 3.9364 7.7224 113.6297 63.4543 38.1003 177.5255 125 D 4.3953 7.8925 119.0476 56.7599 40.0660 178.4300 126 A 3.8366 7.9617 121.2538 55.5938 18.1871 179.1311 127 Y 3.7022 7.9812 115.1954 60.8304 37.9443 177.8447 128 H 4.2336 8.1881 119.0106 59.2437 30.0498 177.2029 129 V 3.6895 7.8885 120.0405 66.1085 31.3393 177.9954 130 I 3.7807 7.3974 118.7614 64.6376 36.9965 178.5540 131 F 5.0533 8.3490 118.8319 60.5159 38.7469 177.6309 132 K 4.0105 8.3939 119.3628 59.8559 31.9812 178.7861 133 E 4.1542 8.6537 118.7989 59.0440 29.1702 179.7198 134 G 2.5963 8.2651 108.6821 48.0447 0.0000 176.1285 135 N 4.6327 7.9014 122.1996 56.5932 37.3358 178.8905 136 L 4.3654 7.9961 123.4417 58.4521 41.7367 179.6074 137 N 4.3763 8.5384 117.5042 54.7693 37.6474 177.1831 138 G 3.9450 7.3110 106.7125 47.6479 0.0000 174.8692 139 E 4.0915 7.7459 121.5294 57.2456 30.0235 176.0677 140 W 4.7124 6.6845 113.7769 56.0671 30.3762 173.0908 141 S 4.7762 8.5203 112.0857 56.6452 62.5434 172.8542 142 I 4.0814 8.3807 127.7018 60.5828 38.0191 175.7483 143 N 4.6092 8.6148 120.4207 53.9050 38.7072 174.8859 144 D 4.6827 7.4937 118.6990 51.3326 42.4594 176.0342 145 V 3.4412 8.0088 125.5978 65.7479 31.8791 176.9774 146 N 4.5596 8.3447 116.0819 56.0843 36.8562 176.6845 147 A 3.9873 8.0497 122.4874 55.1585 18.7393 179.5393 148 V 3.5353 7.7053 116.3770 65.9969 31.2913 178.6797 149 S 4.2880 8.5836 115.4476 61.6361 62.9396 176.3872 150 K 3.7771 7.7261 121.2538 59.7119 31.7120 179.3610 151 I 3.6784 7.7340 119.3236 64.2219 37.0884 177.9813 152 A 3.4496 7.8835 121.2163 55.3985 18.1662 179.0608 153 A 3.4328 7.4538 119.0295 55.5348 18.0930 179.5607 154 N 4.4948 7.9509 113.3891 56.1492 39.0125 177.1019 155 A 4.0096 8.5312 122.5172 55.3700 18.4242 179.6415 156 V 3.1470 7.8948 116.1738 66.2423 31.6727 177.6056 157 N 4.4116 8.8923 117.0611 56.7859 38.6085 176.9259 158 G 3.7141 8.0262 106.8996 47.9355 0.0000 175.5611 159 I 3.6515 7.5125 121.0405 63.8900 37.1651 178.3047 160 V 3.5356 7.2991 117.4648 66.3758 31.4705 177.9570 161 T 3.8842 7.4422 113.8907 65.9650 68.3185 175.5638 162 F 4.9513 7.5299 117.2039 57.6736 38.8208 175.8123 163 T 4.7263 7.4852 109.6619 61.7967 69.3470 173.6845 164 H 4.5380 8.4395 122.0443 57.0638 29.4973 175.9993 165 E 4.7125 7.3538 109.8607 53.5035 31.5037 176.6525 166 Q 4.5335 7.9586 116.3217 54.2180 31.5282 173.4715 167 N 4.0730 8.6226 115.5035 54.6887 40.0102 175.1828 168 I 3.8156 8.5204 129.1547 64.6611 38.1289 178.3177 169 N 4.3893 8.2021 120.0363 57.2297 37.3990 179.6443 170 E 4.1132 8.3133 120.8853 59.3333 29.8457 178.7736 171 R 3.9031 7.7274 117.7833 59.7587 30.1250 178.9829 172 I 3.7945 7.7337 121.1052 64.8290 37.0039 179.3007 173 K 4.0494 7.7726 124.6923 59.8918 31.5694 181.2035 174 L 4.2294 8.1433 120.5770 57.5895 41.5103 179.3515 175 M 4.0280 8.1515 118.1992 58.6723 32.2097 177.7593 176 N 4.2685 8.4711 117.0612 56.4275 38.7201 177.1160 177 K 3.9455 8.2896 120.7915 59.5219 32.2395 178.2497 178 F 4.1192 8.3704 120.7130 61.6382 39.4577 176.9077 179 S 4.0513 8.6231 114.9247 61.8457 62.6309 176.9463 180 Q 4.2970 7.9382 123.0365 58.8046 28.6900 178.0073 181 I 3.6171 7.6689 119.5867 64.3725 37.4914 177.5999 182 F 3.9360 8.1206 121.5517 61.5021 39.2426 177.0100 183 L 3.6255 7.8501 119.2603 58.1048 42.0148 178.4829 184 N 4.4796 8.2047 116.9121 56.1776 38.6773 176.4834 185 G 3.6371 7.5651 105.1834 46.0112 0.0000 174.5231 186 L 4.1809 7.1109 119.9925 56.3442 42.5532 176.5838 187 S 4.3277 7.4222 117.2441 58.7985 62.7439 173.8987 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 L 8.14 4.31 0.00 1.59 1.74 0.92 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 4 K 7.93 4.35 0.00 1.76 1.80 0.00 1.76 0.00 0.00 1.84 0.00 0.00 2.91 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.44 1.07 7.81 5 D 8.28 4.67 0.00 2.65 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 6 K 8.27 4.31 0.00 1.75 1.85 0.00 1.78 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.45 1.08 7.81 7 I 7.40 3.97 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 1.52 0.53 0.91 0.00 0.00 8 L 7.81 4.32 0.00 1.93 1.77 1.11 0.91 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 9 G 8.07 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 0.00 0.00 0.00 10 V 7.80 3.67 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 0.83 0.00 0.00 0.93 0.00 0.00 11 A 8.04 3.92 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 12 K 9.02 4.05 0.00 1.72 1.87 0.00 1.83 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.36 7.81 13 E 7.99 4.17 0.00 2.07 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 2.27 2.24 0.00 14 L 8.15 4.26 0.00 1.48 1.49 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 15 F 8.57 4.62 0.00 3.20 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 16 I 7.42 4.42 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 1.52 0.65 0.91 0.00 0.00 *18 N 7.83 4.79 0.00 2.84 2.93 0.00 0.00 7.49 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 19 G 8.04 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 0.00 0.00 0.00 20 Y 8.47 4.12 0.00 2.50 3.06 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 0.00 0.00 0.00 21 N 8.42 4.36 0.00 2.83 2.88 0.00 0.00 7.06 6.75 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 22 A 8.10 4.10 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 23 T 7.26 4.20 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 1.11 0.00 0.00 24 T 7.77 4.46 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 1.15 0.00 0.00 25 T 8.65 3.95 4.24 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 1.24 0.00 0.00 26 G 8.02 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.30 3.98 0.00 2.08 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 2.36 2.35 0.00 28 I 7.90 3.81 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 1.38 0.62 0.91 0.00 0.00 29 V 7.38 4.35 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 0.73 0.00 0.00 0.93 0.00 0.00 30 K 8.20 4.25 0.00 1.83 1.76 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.39 1.33 7.81 31 L 7.48 4.60 0.00 1.69 1.52 0.92 0.89 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 32 S 8.40 5.51 0.00 3.84 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 33 E 8.71 3.68 0.00 2.12 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 2.24 2.28 0.00 34 S 7.89 4.60 0.00 3.58 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 35 S 8.68 4.37 0.00 3.65 3.78 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 36 K 8.80 3.92 0.00 1.77 1.76 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.02 7.81 37 G 8.31 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 38 N 8.51 4.28 0.00 2.75 2.79 0.00 0.00 6.55 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 39 L 7.17 4.33 0.00 1.54 1.52 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 40 Y 7.25 4.95 0.00 2.86 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 *43 F 8.06 4.64 0.00 3.30 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 44 K 7.99 3.80 0.00 1.80 1.63 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 0.99 7.81 45 T 7.48 4.45 4.36 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 1.30 0.00 0.00 46 K 8.56 4.08 0.00 1.91 1.93 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.13 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.53 1.57 7.81 47 E 8.36 4.23 0.00 2.67 2.61 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 0.00 2.55 2.55 0.00 48 N 7.94 4.52 0.00 2.85 3.08 0.00 0.00 6.68 6.55 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 1.68 1.09 0.73 0.00 0.00 125 D 7.89 4.40 0.00 3.01 2.79 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 0.00 126 A 7.96 3.84 0.56 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 0.00 127 Y 7.98 3.70 0.00 3.05 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 H 8.19 4.23 0.00 3.28 3.35 0.00 5.68 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 0.00 129 V 7.89 3.69 2.25 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 1.13 0.00 0.00 1.02 0.00 0.00 130 I 7.40 3.78 1.73 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 0.62 1.05 0.00 0.00 131 F 8.35 5.05 0.00 3.16 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 0.00 132 K 8.39 4.01 0.00 2.06 2.08 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.59 7.81 133 E 8.65 4.15 0.00 2.39 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 2.34 2.46 0.00 134 G 8.27 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 N 7.90 4.63 0.00 2.85 2.76 0.00 0.00 7.02 7.94 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 0.00 136 L 8.00 4.37 0.00 1.90 1.70 0.96 0.64 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 0.00 137 N 8.54 4.38 0.00 2.78 2.72 0.00 0.00 7.25 5.42 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 0.00 138 G 7.31 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 0.00 0.00 0.00 139 E 7.75 4.09 0.00 1.16 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.91 0.00 140 W 6.68 4.71 0.00 3.41 3.38 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 0.00 141 S 8.52 4.78 0.00 3.84 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 0.00 142 I 8.38 4.08 1.88 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.56 0.75 0.00 0.00 143 N 8.61 4.61 0.00 2.77 2.90 0.00 0.00 5.79 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 0.00 144 D 7.49 4.68 0.00 2.73 2.50 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 0.00 145 V 8.01 3.44 2.05 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 1.03 0.00 0.00 0.96 0.00 0.00 146 N 8.34 4.56 0.00 3.01 3.20 0.00 0.00 6.06 7.46 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 0.00 147 A 8.05 3.99 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 0.00 148 V 7.71 3.54 1.81 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 0.43 0.00 0.00 0.80 0.00 0.00 149 S 8.58 4.29 0.00 3.95 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 0.00 150 K 7.73 3.78 0.00 1.92 1.87 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.65 7.81 151 I 7.73 3.68 2.12 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.92 1.08 0.00 0.00 152 A 7.88 3.45 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 A 7.45 3.43 0.80 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 0.00 0.00 154 N 7.95 4.49 0.00 2.84 2.96 0.00 0.00 7.12 6.80 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 0.00 155 A 8.53 4.01 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 0.00 156 V 7.89 3.15 2.38 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 0.97 0.00 0.00 1.09 0.00 0.00 157 N 8.89 4.41 0.00 3.17 3.08 0.00 0.00 7.18 7.91 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 0.00 158 G 8.03 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 0.00 159 I 7.51 3.65 1.75 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 1.23 0.39 0.81 0.00 0.00 160 V 7.30 3.54 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 0.53 0.00 0.00 0.52 0.00 0.00 161 T 7.44 3.88 3.45 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 0.65 0.00 0.00 162 F 7.53 4.95 0.00 3.16 2.96 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 0.00 163 T 7.49 4.73 4.23 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 1.23 0.00 0.00 164 H 8.44 4.54 0.00 3.03 3.30 0.00 5.96 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 E 7.35 4.71 0.00 2.11 1.73 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 2.15 2.09 0.00 166 Q 7.96 4.53 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.74 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 167 N 8.62 4.07 0.00 2.76 2.77 0.00 0.00 6.51 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 I 8.52 3.82 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.03 0.90 0.00 0.00 169 N 8.20 4.39 0.00 2.77 2.81 0.00 0.00 6.56 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 0.00 170 E 8.31 4.11 0.00 2.06 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 2.31 2.36 0.00 171 R 7.73 3.90 0.00 2.04 1.95 0.00 3.31 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.81 0.00 172 I 7.73 3.79 2.03 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 1.37 0.79 0.94 0.00 0.00 173 K 7.77 4.05 0.00 1.71 1.82 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.36 7.81 174 L 8.14 4.23 0.00 1.82 1.76 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 175 M 8.15 4.03 0.00 2.25 2.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.66 0.00 176 N 8.47 4.27 0.00 3.07 3.01 0.00 0.00 6.71 7.31 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 0.00 177 K 8.29 3.95 0.00 2.01 2.04 0.00 1.59 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.56 7.81 178 F 8.37 4.12 0.00 3.20 3.21 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 0.00 179 S 8.62 4.05 0.00 3.35 3.06 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 0.00 0.00 0.00 180 Q 7.94 4.30 0.00 2.40 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 181 I 7.67 3.62 1.92 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 1.42 0.86 0.90 0.00 0.00 182 F 8.12 3.94 0.00 2.17 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 0.00 183 L 7.85 3.63 0.00 2.07 1.72 0.99 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 184 N 8.20 4.48 0.00 2.97 2.93 0.00 0.00 7.07 8.30 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 0.00 185 G 7.57 3.64 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 0.00 0.00 0.00 186 L 7.11 4.18 0.00 1.45 1.41 0.08 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 187 S 7.42 4.33 0.00 3.96 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 * Residues marked with a * may have inaccurate shift predictions.