NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 35 Q 4.3438 8.3029 119.1206 55.0172 31.2050 177.6371 36 E 3.9233 8.2189 115.6433 60.9774 30.3821 179.8284 37 R 4.1752 8.7625 120.0735 59.2928 30.4908 178.9393 38 T 3.9097 7.8864 114.9701 66.5430 68.5324 176.5323 39 A 3.9888 7.9210 122.4662 55.0858 18.3093 179.7303 40 R 3.8484 8.4045 117.5625 59.4838 30.1783 178.3239 41 L 3.9511 8.1178 120.1955 58.4697 42.0496 178.8233 42 N 4.3374 8.4693 116.4611 56.1183 38.4884 176.9632 43 E 3.9430 8.5229 121.1419 59.2318 29.7250 178.6561 44 L 3.9720 8.1457 120.3468 58.1956 42.1509 178.6718 45 Q 4.0012 8.2166 118.1015 59.2532 28.4894 179.4285 46 R 3.8932 7.8501 116.9872 59.1749 30.2060 178.4371 47 A 4.2491 7.8368 119.1658 55.5310 18.4450 179.4360 48 L 4.2008 7.8905 115.8901 57.2359 43.3315 179.4819 49 V 3.9171 7.5904 119.1334 63.2553 27.2916 175.5522 *52 D 4.7830 7.7889 122.9932 54.1773 43.2761 178.5428 53 S 4.2108 8.1659 112.2278 61.3174 63.4443 175.4553 54 D 4.5805 8.2162 120.3245 56.9530 41.0658 178.6794 55 F 3.8629 7.7561 115.4671 59.8785 38.9301 176.6040 56 R 4.3445 7.6633 117.4410 57.2144 30.2666 176.4046 57 Q 4.7625 7.7783 118.1028 55.3568 30.2656 175.3957 58 I 4.2848 8.0948 119.5515 61.5949 37.7943 175.4676 59 A 4.5680 8.6660 129.0838 50.0835 20.6561 177.9421 60 L 4.2289 8.4550 124.9007 53.5781 40.3311 174.5138 61 R 4.4835 7.5661 119.5141 54.5198 33.1875 174.4450 62 Q 4.5890 8.6977 125.1382 56.2132 29.6449 175.4414 63 T 4.7280 9.1853 112.5914 59.9595 72.6305 172.6925 64 R 4.7625 8.2763 121.2186 54.1140 31.5972 176.4854 65 T 4.7592 8.2737 121.6828 62.0058 69.9782 172.3037 *72 K 4.2296 7.8582 119.9590 57.2992 33.7772 174.8155 73 K 4.7261 8.5036 119.4530 54.5008 36.1461 177.6754 74 L 4.0703 8.6041 120.1727 57.2143 41.8553 177.8009 75 L 4.9621 7.7614 116.8391 53.2358 44.9608 175.7608 76 H 4.9440 9.1484 121.1701 54.0774 30.7899 174.0045 77 W 5.8967 8.7972 133.3344 56.6191 33.1398 173.6234 78 A 4.2231 8.3087 127.0167 50.5344 22.4110 175.1981 79 D 3.9545 8.2160 119.9940 56.2674 41.3625 177.1750 80 Y 4.4915 8.9765 119.7340 57.7778 36.5323 169.4886 81 L 4.1663 7.2399 121.4968 56.6613 42.4848 177.0582 82 L 3.9117 9.3036 123.0113 55.6643 39.1424 173.8367 83 D 4.4942 8.2751 114.8046 55.0996 40.3739 173.8817 84 S 4.4842 8.0590 111.4742 57.8924 62.9640 174.9018 85 D 4.7115 9.0311 126.8624 56.5826 42.3702 177.0149 86 N 5.0128 7.9818 111.9079 52.9620 39.3488 178.0981 87 K 4.0918 9.2476 112.5826 55.8478 32.9897 175.4709 88 G 4.4662 8.6649 109.8904 44.6273 0.0000 171.2424 89 I 6.3000 8.9577 120.8283 57.9441 42.5557 173.6836 *91 F 5.0227 8.3848 117.4115 56.3668 39.6163 173.9483 92 A 4.7765 8.5240 121.1761 51.7768 19.7786 176.7084 93 R 5.2045 8.8961 117.5031 53.9439 33.6953 174.5843 94 L 4.1057 8.8939 121.5164 55.4484 41.4252 177.5240 95 G 3.5292 8.9176 113.3153 47.6418 0.0000 173.0138 96 W 5.0334 6.7451 116.2703 55.0491 31.2027 172.6702 97 H 4.9268 9.0322 118.5366 56.0306 29.0220 175.1850 98 N 5.0276 9.2201 120.3871 51.6130 40.1243 173.2865 99 P 4.4914 0.0000 0.0000 62.3369 32.2277 177.5395 100 Q 4.0252 8.8929 121.4907 59.4914 28.8484 178.3540 101 Q 4.1395 8.0824 113.8302 58.5388 28.9235 176.2480 102 Q 4.3710 8.0613 119.5902 55.0524 29.9118 174.3648 103 F 4.7754 8.5088 125.8762 55.3451 41.8149 173.2167 104 P 3.1804 0.0000 0.0000 62.1661 31.9851 176.3858 105 R 4.2364 8.1375 116.7858 58.0508 31.0117 176.5317 106 G 4.3976 7.7047 104.2589 44.7030 0.0000 172.0088 107 E 4.4915 8.6998 121.4614 54.1905 31.5560 175.3910 108 V 4.2715 8.1671 125.6484 62.3958 32.7388 175.2558 109 T 4.6510 8.5096 118.9393 58.9724 72.3926 172.4756 110 K 4.9008 8.1409 121.1549 55.1352 35.4055 176.0488 111 V 5.0564 8.5184 119.7104 59.7305 35.5860 174.9869 112 G 4.4184 9.0200 108.8360 45.0476 0.0000 170.9460 113 Y 5.4813 9.1207 117.9106 56.1406 41.7310 175.1312 114 R 5.0744 9.1254 118.2214 55.2965 33.8951 173.4212 115 I 5.0234 8.6070 120.6713 59.6192 39.6619 175.2442 116 K 4.6501 8.8681 127.5761 55.4796 34.5043 175.7957 117 D 4.5436 9.7941 129.2361 56.7798 38.6779 173.5081 118 E 4.4851 7.8184 110.0502 56.1892 28.0244 174.5338 119 R 5.1279 7.7609 116.4554 54.1971 33.2831 175.2382 120 L 4.7411 9.0638 126.5655 55.0058 43.3041 175.3592 121 E 5.1873 9.5747 126.0117 54.4935 33.4597 174.7626 122 R 4.4761 8.7263 123.1556 54.3336 32.8042 174.5179 123 V 4.5339 8.4153 126.2152 60.6703 34.4023 173.9373 124 W 5.0991 8.3018 135.0000 55.2573 34.1002 173.8653 125 W 4.5806 8.3715 125.9780 54.4334 31.7822 176.5665 126 R 2.7859 7.8321 124.2931 58.1252 29.8149 175.6882 127 Y 4.7694 7.1322 114.2150 55.0218 40.2855 174.0061 128 P 4.1328 0.0000 0.0000 64.9569 31.6536 175.9995 129 D 4.6686 7.8949 118.7524 52.6324 41.4744 175.5867 130 T 4.6156 7.9957 118.5001 59.3711 70.3563 171.7700 131 P 4.1680 0.0000 0.0000 66.1923 31.6905 177.3731 *134 Q 4.2342 7.6640 114.8289 54.3987 29.5120 176.4274 135 E 4.4768 8.7245 119.6704 55.8406 30.5283 176.6634 136 G 2.9975 7.9961 109.2722 44.3673 0.0000 173.1851 137 V 3.9450 8.3991 120.7536 62.1627 32.3228 174.8497 138 V 4.5132 8.2104 128.6968 61.8930 32.8030 174.8787 139 T 4.5795 8.9133 125.5571 60.9560 70.6151 171.9466 140 P 4.5227 0.0000 0.0000 63.0052 31.4315 175.5086 141 L 4.4557 9.1744 127.6544 56.4103 43.3710 176.6604 142 L 4.9366 7.5766 120.3937 53.7409 45.3747 175.4309 143 S 4.6388 9.5910 121.7857 58.4770 64.5884 172.9742 144 D 4.2607 8.4668 117.3675 55.8120 38.1335 174.5164 145 V 4.6280 7.7719 119.6675 61.5216 33.0246 176.4435 146 E 4.1308 9.1465 129.3493 58.9908 30.5574 176.9966 147 E 4.8874 8.0873 118.5921 54.3001 33.6982 173.5055 148 L 5.2162 8.7083 127.2492 53.3494 44.4170 174.8488 149 N 5.4213 9.3828 124.5889 51.8671 42.5917 172.9490 150 V 4.3954 7.9216 124.1063 60.9248 34.4038 174.4718 151 R 4.4390 8.2813 125.4516 54.1778 34.5665 174.4517 152 F 5.2119 9.0748 118.1542 56.1361 43.5689 173.4602 153 Y 4.3347 8.7731 125.8479 56.0381 39.3888 175.1086 154 D 4.8540 7.9567 126.3661 53.2079 39.9475 176.2266 155 G 4.0362 6.8975 109.6772 45.4499 0.0000 174.9881 156 K 4.2949 7.5135 116.6445 57.2839 34.7708 175.6084 157 Q 4.4890 7.7228 115.4820 54.1308 31.6726 173.3452 158 W 4.9084 8.6732 119.1115 56.4156 29.9322 175.9631 159 I 4.8767 9.2817 115.7919 59.3646 40.0962 175.6189 160 N 4.9557 8.9028 116.5021 53.7916 39.3412 174.9280 161 E 5.1377 8.2809 115.8448 54.2759 33.4616 175.1959 162 W 4.5372 8.2773 129.1427 55.9953 31.7380 174.5539 163 S 4.3419 7.6675 119.5660 57.8460 63.6860 173.9086 164 N 4.1508 6.6457 119.9743 53.7580 38.1224 173.8475 165 E 4.5022 8.6014 124.6516 56.4869 30.1608 176.9220 166 L 4.4858 7.9517 119.8842 55.5282 42.8300 176.1897 167 T 4.8444 7.5360 110.6833 60.0618 70.5471 172.9840 168 L 4.2958 8.2797 125.6952 53.1701 42.6499 175.2993 169 P 3.6399 0.0000 0.0000 62.0960 31.9285 176.4612 170 A 4.1998 8.0684 121.3924 54.7030 19.4456 177.2633 171 A 5.1228 7.7518 114.9703 50.3985 23.2775 175.1926 172 I 4.9763 8.9401 120.3842 59.4846 41.2092 174.5483 173 S 4.7302 8.7063 120.9680 56.3433 64.7114 172.5861 174 V 4.3241 8.2839 127.9524 61.0294 33.3030 173.7024 175 E 4.9323 9.3503 129.7742 54.2837 32.1670 174.3241 176 L 5.1972 8.8875 126.6905 53.2784 45.2399 175.4831 177 T 4.8414 8.7787 120.2118 62.1528 70.4009 173.4839 178 L 5.1353 8.7203 127.5877 52.9330 43.4995 178.2126 179 K 4.1315 9.0742 122.5930 58.9268 32.1581 177.9831 180 D 4.4095 8.1974 118.4008 55.6922 40.1844 177.2579 181 Y 4.2497 7.7061 117.8006 57.5280 39.3831 178.2152 182 G 3.8728 8.0579 108.5478 45.8511 0.0000 172.7384 183 K 4.9776 8.5602 122.8710 55.7053 33.1473 176.6129 184 I 4.7253 8.7991 117.7630 59.0724 40.9320 174.2503 185 A 5.0672 8.3083 124.0409 50.3991 22.5722 175.4433 186 R 4.2638 8.6073 118.3942 54.5043 33.9767 174.5577 187 T 4.6874 7.9561 119.7968 62.0855 70.3554 173.6449 188 Y 4.8818 8.8870 123.3465 56.1522 41.9021 174.7558 189 L 4.9681 8.6828 122.7644 54.2746 43.1281 176.3216 190 T 4.6560 8.1184 112.9935 59.2487 70.9880 172.8345 191 P 4.3950 0.0000 0.0000 62.7117 32.0883 176.2048 192 E 4.2193 8.5141 120.4885 56.0844 30.4179 175.1777 193 G 4.3133 7.6903 105.5654 43.5520 0.0000 172.7093 194 N 5.3509 8.1464 118.0107 51.2701 42.1359 174.2047 195 L 4.6194 9.4393 125.4425 54.5508 43.6255 176.7128 196 Q 4.6202 8.4808 122.9338 54.5374 30.1819 177.3716 197 K 4.1738 8.4452 120.7372 55.0908 31.8228 177.8016 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 35 Q 8.30 4.34 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.86 0.00 0.00 0.00 0.00 0.00 2.26 1.93 0.00 36 E 8.22 3.92 0.00 2.05 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 2.31 2.03 0.00 37 R 8.76 4.18 0.00 1.87 2.05 0.00 3.09 0.00 0.00 3.35 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.72 0.00 38 T 7.89 3.91 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 39 A 7.92 3.99 1.39 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 0.00 0.00 0.00 40 R 8.40 3.85 0.00 2.03 2.23 0.00 3.27 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.92 0.00 41 L 8.12 3.95 0.00 2.07 1.79 0.91 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.47 4.34 0.00 2.93 2.86 0.00 0.00 6.68 8.00 0.00 0.00 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 E 8.52 3.94 0.00 2.13 2.17 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 2.35 2.35 0.00 44 L 8.15 3.97 0.00 1.81 1.79 0.92 0.54 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 45 Q 8.22 4.00 0.00 2.40 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 46 R 7.85 3.89 0.00 1.98 2.02 0.00 3.19 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 47 A 7.84 4.25 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 48 L 7.89 4.20 0.00 1.83 1.78 0.88 0.81 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 49 V 7.59 3.92 2.24 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 1.07 0.00 0.00 0.98 0.00 0.00 *52 D 7.79 4.78 0.00 3.16 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 53 S 8.17 4.21 0.00 4.05 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 54 D 8.22 4.58 0.00 2.75 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 55 F 7.76 3.86 0.00 1.51 1.85 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 56 R 7.66 4.34 0.00 2.02 2.03 0.00 3.20 0.00 0.00 3.32 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.87 0.00 57 Q 7.78 4.76 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.46 0.00 58 I 8.09 4.28 1.73 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.27 0.83 0.00 0.00 59 A 8.67 4.57 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 60 L 8.45 4.23 0.00 1.60 1.62 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 61 R 7.57 4.48 0.00 1.75 1.74 0.00 3.26 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 62 Q 8.70 4.59 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 63 T 9.19 4.73 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 1.15 0.00 0.00 64 R 8.28 4.76 0.00 1.63 1.83 0.00 3.28 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 65 T 8.27 4.76 4.20 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 1.11 0.00 0.00 *72 K 7.86 4.23 0.00 2.09 1.89 0.00 1.50 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.47 7.81 73 K 8.50 4.73 0.00 1.42 1.61 0.00 1.65 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.31 1.35 7.81 74 L 8.60 4.07 0.00 1.74 1.79 1.09 0.93 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 75 L 7.76 4.96 0.00 1.57 1.68 0.77 1.16 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 76 H 9.15 4.94 0.00 3.18 3.32 0.00 5.57 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 W 8.80 5.90 0.00 3.56 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 78 A 8.31 4.22 1.11 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 0.00 0.00 79 D 8.22 3.95 0.00 2.26 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 80 Y 8.98 4.49 0.00 3.20 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 81 L 7.24 4.17 0.00 1.90 1.61 0.96 0.81 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 82 L 9.30 3.91 0.00 1.96 1.89 1.12 1.21 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 83 D 8.28 4.49 0.00 2.86 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 84 S 8.06 4.48 0.00 4.12 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 85 D 9.03 4.71 0.00 2.77 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 86 N 7.98 5.01 0.00 2.68 2.20 0.00 0.00 6.31 7.20 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 87 K 9.25 4.09 0.00 1.66 0.92 0.00 0.61 0.00 0.00 1.14 0.00 0.00 2.76 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.21 1.25 7.81 88 G 8.66 4.47 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 89 I 8.96 6.30 2.52 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 2.12 1.46 0.00 0.00 *91 F 8.38 5.02 0.00 3.19 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 92 A 8.52 4.78 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 93 R 8.90 5.20 0.00 2.07 2.20 0.00 2.89 0.00 0.00 3.33 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.59 0.00 94 L 8.89 4.11 0.00 1.49 1.60 0.92 0.75 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 95 G 8.92 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 W 6.75 5.03 0.00 3.41 3.37 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 97 H 9.03 4.93 0.00 3.14 3.36 0.00 5.89 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 N 9.22 5.03 0.00 2.84 3.00 0.00 0.00 7.01 8.59 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 99 P 0.00 4.49 0.00 2.22 2.00 0.00 3.91 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.10 0.00 100 Q 8.89 4.03 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.10 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 101 Q 8.08 4.14 0.00 2.24 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.70 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 102 Q 8.06 4.37 0.00 2.10 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.61 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 103 F 8.51 4.78 0.00 3.07 2.99 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 0.00 0.00 0.00 104 P 0.00 3.18 0.00 2.05 1.42 0.00 3.71 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 1.81 1.74 0.00 105 R 8.14 4.24 0.00 1.76 2.06 0.00 3.60 0.00 0.00 3.45 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.66 0.00 106 G 7.70 4.40 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 0.00 107 E 8.70 4.49 0.00 1.24 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 2.29 2.11 0.00 108 V 8.17 4.27 1.98 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 0.72 0.00 0.00 0.83 0.00 0.00 109 T 8.51 4.65 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 1.02 0.00 0.00 110 K 8.14 4.90 0.00 1.65 1.50 0.00 1.17 0.00 0.00 1.48 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.07 1.35 7.81 111 V 8.52 5.06 1.88 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 0.79 0.00 0.00 0.39 0.00 0.00 112 G 9.02 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 0.00 0.00 0.00 0.00 113 Y 9.12 5.48 0.00 3.22 3.05 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 0.00 0.00 0.00 0.00 114 R 9.13 5.07 0.00 1.95 2.10 0.00 2.81 0.00 0.00 3.44 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 115 I 8.61 5.02 1.96 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.13 1.02 0.00 0.00 116 K 8.87 4.65 0.00 1.79 1.65 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.15 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.45 7.81 117 D 9.79 4.54 0.00 2.84 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.82 4.49 0.00 2.16 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 2.35 2.30 0.00 119 R 7.76 5.13 0.00 1.89 1.84 0.00 3.14 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 120 L 9.06 4.74 0.00 1.86 1.66 1.15 0.91 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 0.00 121 E 9.57 5.19 0.00 1.89 1.75 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 2.21 2.24 0.00 122 R 8.73 4.48 0.00 1.35 1.51 0.00 3.06 0.00 0.00 2.93 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.17 0.00 123 V 8.42 4.53 1.69 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 0.01 0.00 0.00 0.82 0.00 0.00 124 W 8.30 5.10 0.00 3.24 2.78 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 0.00 125 W 8.37 4.58 0.00 2.88 2.58 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 0.00 126 R 7.83 2.79 0.00 1.58 1.44 0.00 2.98 0.00 0.00 3.63 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.50 0.00 127 Y 7.13 4.77 0.00 2.96 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 0.00 128 P 0.00 4.13 0.00 2.11 2.10 0.00 3.83 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 129 D 7.89 4.67 0.00 2.62 2.59 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 0.00 0.00 0.00 0.00 130 T 8.00 4.62 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 0.89 0.00 0.00 131 P 0.00 4.17 0.00 2.22 2.15 0.00 3.88 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.97 0.00 *134 Q 7.66 4.23 0.00 2.12 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.98 0.00 0.00 0.00 0.00 0.00 2.18 1.96 0.00 135 E 8.72 4.48 0.00 1.97 1.91 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 2.35 2.34 0.00 136 G 8.00 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 0.00 0.00 0.00 137 V 8.40 3.95 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 0.79 0.00 0.00 1.09 0.00 0.00 138 V 8.21 4.51 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 0.79 0.00 0.00 0.81 0.00 0.00 139 T 8.91 4.58 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 1.17 0.00 0.00 140 P 0.00 4.52 0.00 2.08 2.08 0.00 3.72 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 141 L 9.17 4.46 0.00 1.66 1.92 0.97 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 142 L 7.58 4.94 0.00 1.83 1.52 0.98 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 143 S 9.59 4.64 0.00 4.00 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 0.00 144 D 8.47 4.26 0.00 2.91 2.78 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 0.00 145 V 7.77 4.63 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 1.09 0.00 0.00 1.10 0.00 0.00 146 E 9.15 4.13 0.00 2.01 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 2.35 2.28 0.00 147 E 8.09 4.89 0.00 2.02 1.75 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 2.34 2.35 0.00 148 L 8.71 5.22 0.00 1.78 1.69 1.00 1.21 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 0.00 149 N 9.38 5.42 0.00 3.08 2.56 0.00 0.00 6.17 7.99 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 0.00 150 V 7.92 4.40 0.67 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 0.15 0.00 0.00 0.55 0.00 0.00 151 R 8.28 4.44 0.00 1.31 1.79 0.00 2.97 0.00 0.00 2.87 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.27 0.00 152 F 9.07 5.21 0.00 3.34 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 0.00 153 Y 8.77 4.33 0.00 1.43 2.45 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 0.00 154 D 7.96 4.85 0.00 2.98 2.99 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 0.00 0.00 0.00 155 G 6.90 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 0.00 0.00 0.00 156 K 7.51 4.29 0.00 1.76 1.80 0.00 1.53 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.23 1.25 7.81 157 Q 7.72 4.49 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 7.05 0.00 0.00 0.00 0.00 0.00 2.18 2.34 0.00 158 W 8.67 4.91 0.00 3.39 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 0.00 159 I 9.28 4.88 2.05 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.41 1.00 0.00 0.00 160 N 8.90 4.96 0.00 2.92 3.15 0.00 0.00 6.68 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 0.00 161 E 8.28 5.14 0.00 2.00 1.92 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 2.40 2.31 0.00 162 W 8.28 4.54 0.00 1.97 2.35 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 0.00 163 S 7.67 4.34 0.00 3.85 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 0.00 164 N 6.65 4.15 0.00 1.99 2.25 0.00 0.00 7.00 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 0.00 165 E 8.60 4.50 0.00 1.97 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 2.25 2.42 0.00 166 L 7.95 4.49 0.00 1.66 1.87 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 167 T 7.54 4.84 4.32 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 1.43 0.00 0.00 168 L 8.28 4.30 0.00 1.61 1.40 0.88 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 169 P 0.00 3.64 0.00 1.76 0.49 0.00 3.22 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.32 0.00 170 A 8.07 4.20 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 0.00 171 A 7.75 5.12 1.05 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 0.00 0.00 0.00 0.00 0.00 0.00 172 I 8.94 4.98 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.73 0.77 0.00 0.00 173 S 8.71 4.73 0.00 2.72 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 0.00 174 V 8.28 4.32 1.69 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 0.66 0.00 0.00 -0.16 0.00 0.00 175 E 9.35 4.93 0.00 1.81 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.24 0.00 176 L 8.89 5.20 0.00 1.58 1.54 0.95 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 177 T 8.78 4.84 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 1.27 0.00 0.00 178 L 8.72 5.14 0.00 1.66 1.77 1.12 0.52 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 0.00 179 K 9.07 4.13 0.00 1.65 1.87 0.00 1.66 0.00 0.00 1.61 0.00 0.00 3.19 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.73 1.26 7.81 180 D 8.20 4.41 0.00 2.36 2.58 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 0.00 181 Y 7.71 4.25 0.00 3.03 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 0.00 182 G 8.06 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 0.00 183 K 8.56 4.98 0.00 1.62 1.71 0.00 1.66 0.00 0.00 2.05 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.42 7.81 184 I 8.80 4.73 1.79 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 1.14 1.28 0.85 0.00 0.00 185 A 8.31 5.07 0.95 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 0.00 186 R 8.61 4.26 0.00 1.33 0.86 0.00 3.02 0.00 0.00 3.03 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.61 0.00 187 T 7.96 4.69 4.06 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 1.32 0.00 0.00 188 Y 8.89 4.88 0.00 2.78 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 0.00 189 L 8.68 4.97 0.00 1.54 1.58 0.90 0.86 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 0.00 190 T 8.12 4.66 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 1.17 0.00 0.00 191 P 0.00 4.39 0.00 2.20 2.09 0.00 3.72 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 1.97 2.16 0.00 192 E 8.51 4.22 0.00 1.99 1.92 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 2.31 2.30 0.00 193 G 7.69 4.31 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 0.00 194 N 8.15 5.35 0.00 2.58 2.70 0.00 0.00 6.92 7.85 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 0.00 195 L 9.44 4.62 0.00 1.45 1.60 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 196 Q 8.48 4.62 0.00 1.83 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 7.08 0.00 0.00 0.00 0.00 0.00 2.21 1.92 0.00 197 K 8.45 4.17 0.00 1.77 1.61 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.36 1.00 7.81 * Residues marked with a * may have inaccurate shift predictions.