NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 81 R 4.3035 8.2549 119.7048 55.9890 31.5488 174.8206 82 Q 4.0886 8.3083 120.2901 52.7911 29.6467 173.7181 83 P 4.5527 0.0000 0.0000 61.6035 33.5069 175.4052 84 E 4.0636 8.3712 118.0303 56.6169 30.0816 176.7705 85 V 4.1621 8.7410 123.5661 61.4898 32.9754 176.4569 86 R 4.1169 8.3775 125.2644 57.8586 29.6178 175.4896 87 G 4.0539 9.0772 111.2521 44.6688 0.0000 174.7719 88 G 3.8403 8.0632 107.8596 46.6699 0.0000 174.7592 89 D 4.5138 7.8857 118.5628 55.3487 41.3274 176.0171 90 T 4.5708 7.4955 117.5449 62.3475 69.6091 174.3336 91 L 4.3002 9.4658 129.9664 54.9021 43.5709 175.2580 92 N 5.1900 8.5208 123.1434 51.5208 42.2769 173.6315 93 V 4.5400 8.2819 123.8532 60.9499 35.3637 174.1849 94 F 5.2962 8.7438 124.8863 55.6061 43.7055 173.3237 95 L 4.9906 9.1796 124.2172 53.4573 43.8830 174.9109 96 A 5.2615 8.8510 128.1240 50.2989 22.3419 174.0300 97 Y 5.3945 9.0561 119.7041 56.2647 41.1121 175.1768 98 V 5.0166 9.1382 123.4854 60.2718 35.2210 172.9038 99 P 4.1251 0.0000 0.0000 62.5885 31.4537 176.0320 100 E 4.1271 8.4829 123.6845 58.4374 30.5445 176.2432 101 D 4.4308 8.3256 119.0228 52.0577 42.0431 175.1970 102 A 4.0111 8.3220 129.0029 54.1013 18.6659 178.5118 103 K 4.1794 7.9254 113.3187 57.3880 32.9868 176.4481 104 A 4.5899 7.6392 122.6193 50.9304 21.2744 175.7784 *107 T 4.3559 8.4315 102.9631 61.9512 70.9036 174.8396 108 T 3.9617 7.7751 117.7374 61.3986 68.0970 172.4592 109 P 4.6102 0.0000 0.0000 62.3152 33.8180 174.2992 110 F 5.0419 8.7394 117.5342 55.5331 42.5502 174.3900 111 E 5.1223 9.3723 119.9056 54.5804 32.8688 174.7911 112 A 5.0120 9.0028 126.0282 50.5549 21.4148 175.3618 113 Y 5.0503 8.9300 119.6233 55.9704 42.5464 174.3194 114 L 4.6425 8.5441 124.7740 53.7235 44.0054 175.1927 115 V 4.1789 8.8874 127.4635 61.4581 32.9299 174.0274 116 N 4.9060 8.8944 128.9552 51.6337 37.4079 173.3142 117 D 5.0609 8.3057 130.5143 51.4154 39.7053 174.0636 118 S 4.8448 7.7197 115.6415 57.5614 67.2560 176.6347 119 N 4.4936 8.9755 117.2550 53.8555 38.3078 174.9601 120 Y 4.5697 7.6231 117.8466 56.6428 40.3488 174.8885 121 Y 4.0921 8.5189 120.3305 57.8240 39.4142 174.6721 122 L 5.2643 8.7738 122.0078 53.2831 45.6639 174.9808 123 Y 5.5841 8.8682 120.3837 56.8156 40.4730 174.4382 124 Y 5.6052 8.9945 120.7441 55.7993 42.4346 173.8238 125 T 5.0672 9.1434 109.6100 60.0714 72.9272 172.1316 126 Y 5.5488 9.3838 124.4488 56.1941 41.6203 174.1864 127 L 5.4182 9.1793 126.5316 52.8716 46.3298 175.6996 128 S 5.2033 9.0582 115.4120 56.4013 66.2101 173.1967 129 A 3.3286 8.0492 124.7565 51.4091 19.3904 177.4855 130 E 4.0931 8.7180 122.6641 55.4990 31.9310 175.6950 131 G 3.8937 7.9861 119.0513 46.8436 0.0000 173.5950 132 K 4.1674 8.7080 123.8084 56.2158 32.4027 174.9621 133 A 5.0624 7.5606 120.8242 49.7611 22.7371 174.9709 134 W 5.3924 8.6374 116.5066 55.2909 33.2189 174.9457 135 N 5.0409 9.3960 120.8848 51.4466 40.8827 173.3762 136 N 4.8157 8.7848 122.3597 53.5222 39.1376 174.6199 137 R 4.4408 8.9566 125.6208 57.8390 31.7265 176.6695 138 S 4.8716 7.9113 111.4799 58.1361 66.3014 174.0592 139 H 4.3726 8.0538 119.2202 53.7147 31.5625 174.6921 140 G 3.8797 6.1785 106.9260 46.0816 0.0000 170.5680 141 L 5.3221 8.3350 124.4273 53.4285 44.4237 177.0070 142 V 4.4960 8.7933 125.6458 61.0013 34.0034 175.0507 143 E 4.1830 8.7744 126.9482 55.0866 30.4851 174.8125 144 P 4.2063 0.0000 0.0000 62.6478 32.0680 176.1178 145 N 4.0915 8.3025 118.0982 53.0948 36.6486 173.0430 146 T 4.7316 7.1864 110.5737 60.8343 71.8128 171.8996 147 K 5.0919 8.4101 120.9745 54.8367 36.0521 175.3273 148 L 4.8095 8.6847 122.7656 52.9851 45.3436 175.1379 149 L 4.0381 8.7634 128.6668 55.3682 41.9223 176.2652 150 L 4.3855 8.8277 127.6523 57.2972 42.6169 177.1317 151 E 4.8587 7.6570 115.5266 55.3939 32.9767 174.0452 152 E 5.3353 9.0442 125.4125 54.6479 31.9610 175.2426 153 F 5.2096 8.8995 118.6242 55.7113 42.0060 174.2454 154 T 4.6967 8.6137 110.5144 60.4950 70.4726 175.8936 155 K 4.0254 8.6018 121.0872 59.1506 32.0304 179.0771 156 D 4.4442 8.2430 119.3565 56.3472 39.0855 178.3586 157 V 3.7667 8.1589 118.9940 64.8510 31.2863 177.6793 158 L 3.6860 7.5764 118.1250 58.0058 41.4265 178.7361 159 N 4.4200 7.5451 114.3480 55.3100 38.8405 174.8325 160 E 4.2026 7.9396 120.5892 56.4889 30.1107 176.9353 *162 E 4.3695 8.1897 121.1366 55.6491 32.6634 175.5457 163 R 5.0360 7.5397 118.7980 54.7372 33.5850 174.3642 164 V 5.3539 9.0751 118.3416 59.7928 36.4602 174.0906 165 A 5.2597 9.3911 122.1809 50.6723 23.0333 175.3055 166 V 4.9900 8.8653 119.8115 61.2375 34.5811 174.4731 167 Q 5.3071 8.9263 126.3571 54.3174 32.1078 174.4724 168 L 5.2443 8.8424 121.7357 54.9664 44.4699 173.8811 169 I 5.0781 8.8969 112.5609 59.1215 41.1579 174.0047 170 A 5.4961 8.5228 124.4965 50.5026 21.8212 175.0729 171 F 5.0521 8.8589 114.9119 56.1762 41.8250 173.0040 172 K 5.0573 8.9507 118.1375 54.6848 35.4261 175.7649 173 D 4.6425 8.8447 120.4452 55.0383 42.4483 175.4903 174 G 4.0443 9.6568 114.7373 45.0874 0.0000 171.9835 175 K 4.6617 7.4570 117.1661 53.4630 35.8110 174.5951 176 P 4.4622 0.0000 0.0000 62.9456 31.9621 175.5003 177 A 4.6903 8.0469 121.5568 50.5486 22.0885 176.2748 178 A 4.1888 8.4677 122.9222 51.9403 19.1369 177.6298 179 I 3.9486 8.1999 121.4399 60.6860 38.7831 175.5375 180 K 4.5779 8.1392 126.2988 53.4173 34.5648 174.3394 181 P 4.3082 0.0000 0.0000 62.8191 31.8169 175.5525 182 A 4.4194 8.3253 122.1783 51.4093 19.7037 176.7658 183 V 4.4093 8.8208 122.7379 61.0153 34.4720 174.3669 184 S 4.9800 8.6155 121.2952 56.5640 65.3487 172.9023 185 V 4.4570 8.8938 126.6895 61.2603 34.2634 173.7425 186 E 5.1798 8.9644 127.3121 55.0289 31.3166 175.5036 187 L 5.0914 9.1842 123.1873 53.1060 46.2006 175.7465 188 R 5.0999 9.2657 123.2880 54.2099 30.8612 176.5006 189 I 3.7290 8.2123 125.6237 61.0702 38.2760 177.7233 190 D 4.8058 9.2435 128.0569 53.5555 38.3924 177.5266 191 T 4.0903 7.9785 114.1468 64.5245 69.1566 176.9200 192 V 3.8652 8.0456 115.0513 64.3827 31.4920 178.2393 193 K 4.2746 8.3855 117.7496 58.9142 31.6848 178.8024 194 F 4.0198 8.4544 116.6210 59.1404 38.8386 175.8468 195 Y 4.7749 7.8438 115.1045 57.0131 39.1480 176.0813 196 K 4.5258 8.0659 120.2088 53.7465 33.5567 176.2587 197 L 3.4955 8.2778 126.3549 57.8639 42.2929 178.7004 198 H 4.4601 8.1413 112.5089 57.5156 28.6796 176.0341 199 T 4.1560 7.7577 109.9518 63.1408 69.2406 175.0493 200 F 4.5487 7.9663 121.0076 57.5067 39.9783 174.8289 201 S 4.9375 8.9383 115.7025 56.2927 66.8186 173.8404 202 A 4.5529 8.5799 124.2134 52.4053 18.7831 177.0520 203 S 4.3991 8.2212 114.1224 56.7221 66.0648 174.1308 204 D 4.2855 7.7464 120.0053 56.1034 40.7298 177.5640 205 F 4.4500 7.1574 116.9161 58.4549 39.4451 175.6164 206 F 4.8243 7.4021 116.9290 55.7170 42.9634 174.0750 207 E 4.1115 8.9442 123.6339 59.1820 29.7901 177.5759 208 E 4.2165 8.0033 116.2318 55.4015 30.1807 174.7929 209 P 4.7968 0.0000 0.0000 63.2538 32.2666 175.5642 210 A 4.9512 9.2041 123.1880 50.2587 23.3953 174.9721 211 L 4.2066 8.1717 122.7071 53.5565 43.2970 175.2927 212 I 4.9388 7.9403 127.2962 59.6832 39.6853 174.6271 213 Y 4.4247 8.9946 125.1662 55.8784 40.3631 175.0352 214 D 5.0084 9.4953 125.1334 55.1185 41.2989 175.8381 215 I 4.3372 8.9172 124.0790 62.5555 39.4053 175.8653 216 V 4.7789 7.3416 120.8440 60.7652 34.8537 173.6913 217 K 4.7891 8.8257 128.7099 54.8173 34.8606 175.7963 218 D 4.3745 10.3536 129.5962 55.7371 38.7799 174.5870 219 D 4.4716 8.3933 115.4710 54.4608 40.1848 174.7273 220 V 4.1839 7.6078 120.5948 60.0949 32.1950 173.3011 221 P 4.6396 0.0000 0.0000 63.0987 31.5321 176.2903 222 A 4.4326 9.0477 128.5448 52.1978 18.7604 178.5929 223 K 4.0347 8.0723 121.9377 57.4369 32.2880 178.6194 224 Q 3.6408 8.7686 120.4476 56.2109 26.5754 175.1672 225 V 3.7366 7.6073 118.0537 65.0852 32.1567 176.9410 226 Y 4.9547 7.7871 116.8202 57.5301 38.3522 175.8896 227 V 4.0917 7.6163 123.7427 63.1943 32.0081 174.4815 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 81 R 8.25 4.30 0.00 1.81 1.92 0.00 3.17 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 82 Q 8.31 4.09 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.03 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 83 P 0.00 4.55 0.00 2.14 2.04 0.00 3.74 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 1.95 1.96 0.00 84 E 8.37 4.06 0.00 1.91 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 2.19 2.23 0.00 85 V 8.74 4.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.92 0.00 0.00 86 R 8.38 4.12 0.00 1.87 1.72 0.00 3.34 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.21 0.00 87 G 9.08 4.05 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 0.00 88 G 8.06 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 0.00 0.00 0.00 89 D 7.89 4.51 0.00 2.70 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 90 T 7.50 4.57 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 91 L 9.47 4.30 0.00 1.64 1.54 0.85 0.27 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 92 N 8.52 5.19 0.00 3.00 2.71 0.00 0.00 5.95 7.56 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 93 V 8.28 4.54 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.79 0.00 0.00 94 F 8.74 5.30 0.00 2.93 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 95 L 9.18 4.99 0.00 1.64 1.55 0.36 1.05 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 96 A 8.85 5.26 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 97 Y 9.06 5.39 0.00 2.78 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 98 V 9.14 5.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 -0.07 0.00 0.00 99 P 0.00 4.13 0.00 1.82 1.55 0.00 4.03 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.80 0.00 100 E 8.48 4.13 0.00 1.84 1.84 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 2.41 2.18 0.00 101 D 8.33 4.43 0.00 2.56 2.36 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 0.00 102 A 8.32 4.01 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 0.00 103 K 7.93 4.18 0.00 1.93 1.84 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.35 7.81 104 A 7.64 4.59 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 *107 T 8.43 4.36 4.21 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 1.20 0.00 0.00 108 T 7.78 3.96 4.25 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 0.75 0.00 0.00 109 P 0.00 4.61 0.00 2.06 2.12 0.00 3.51 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.92 0.00 110 F 8.74 5.04 0.00 1.93 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 0.00 111 E 9.37 5.12 0.00 1.89 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 2.13 2.15 0.00 112 A 9.00 5.01 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Y 8.93 5.05 0.00 2.90 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 0.00 114 L 8.54 4.64 0.00 1.31 1.16 0.75 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 115 V 8.89 4.18 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 -0.09 0.00 0.00 0.82 0.00 0.00 116 N 8.89 4.91 0.00 2.73 2.70 0.00 0.00 6.38 8.68 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 0.00 117 D 8.31 5.06 0.00 2.96 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 0.00 118 S 7.72 4.84 0.00 4.22 3.94 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 0.00 0.00 0.00 119 N 8.98 4.49 0.00 2.27 2.70 0.00 0.00 6.93 7.34 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 0.00 120 Y 7.62 4.57 0.00 2.88 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 0.00 121 Y 8.52 4.09 0.00 1.43 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 0.00 0.00 0.00 122 L 8.77 5.26 0.00 1.61 1.61 0.86 1.03 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 0.00 123 Y 8.87 5.58 0.00 3.06 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 Y 8.99 5.61 0.00 3.14 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 0.00 125 T 9.14 5.07 4.25 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 1.13 0.00 0.00 126 Y 9.38 5.55 0.00 3.18 3.17 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 0.00 127 L 9.18 5.42 0.00 1.81 1.84 0.62 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 128 S 9.06 5.20 0.00 3.82 3.70 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 0.00 129 A 8.05 3.33 0.08 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 0.00 0.00 130 E 8.72 4.09 0.00 1.76 1.65 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 0.00 2.10 2.14 0.00 131 G 7.99 3.89 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 0.00 0.00 0.00 132 K 8.71 4.17 0.00 2.00 1.87 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.40 0.99 7.81 133 A 7.56 5.06 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 0.00 134 W 8.64 5.39 0.00 3.07 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 0.00 135 N 9.40 5.04 0.00 2.53 2.68 0.00 0.00 6.58 6.79 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 0.00 136 N 8.78 4.82 0.00 2.75 2.74 0.00 0.00 7.06 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 0.00 137 R 8.96 4.44 0.00 1.58 1.95 0.00 2.89 0.00 0.00 2.42 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.27 0.00 138 S 7.91 4.87 0.00 4.29 4.08 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 0.00 139 H 8.05 4.37 0.00 3.09 3.07 0.00 5.89 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 6.18 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 0.00 0.00 0.00 141 L 8.33 5.32 0.00 1.88 1.72 0.82 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 142 V 8.79 4.50 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 0.93 0.00 0.00 0.86 0.00 0.00 143 E 8.77 4.18 0.00 1.80 1.65 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 0.00 2.46 2.40 0.00 144 P 0.00 4.21 0.00 1.61 1.67 0.00 3.15 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.99 0.00 145 N 8.30 4.09 0.00 2.75 2.79 0.00 0.00 6.65 6.82 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 0.00 146 T 7.19 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 1.18 0.00 0.00 147 K 8.41 5.09 0.00 1.80 1.52 0.00 1.32 0.00 0.00 1.21 0.00 0.00 2.20 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.22 1.46 7.81 148 L 8.68 4.81 0.00 1.71 1.38 0.98 0.68 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 0.00 149 L 8.76 4.04 0.00 1.67 1.57 0.43 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 150 L 8.83 4.39 0.00 1.50 1.79 0.26 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 151 E 7.66 4.86 0.00 2.22 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 2.52 2.43 0.00 152 E 9.04 5.34 0.00 1.91 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.26 0.00 153 F 8.90 5.21 0.00 3.06 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 0.00 154 T 8.61 4.70 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 1.24 0.00 0.00 155 K 8.60 4.03 0.00 1.84 1.84 0.00 0.65 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.64 7.81 156 D 8.24 4.44 0.00 2.89 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 0.00 157 V 8.16 3.77 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 0.89 0.00 0.00 1.01 0.00 0.00 158 L 7.58 3.69 0.00 1.67 1.52 0.57 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 159 N 7.55 4.42 0.00 2.74 2.84 0.00 0.00 7.02 7.54 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 0.00 160 E 7.94 4.20 0.00 1.94 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 2.22 2.15 0.00 *162 E 8.19 4.37 0.00 1.99 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 163 R 7.54 5.04 0.00 1.78 1.46 0.00 3.17 0.00 0.00 3.33 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.72 0.00 164 V 9.08 5.35 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 0.64 0.00 0.00 1.09 0.00 0.00 165 A 9.39 5.26 0.97 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 0.00 0.00 166 V 8.87 4.99 2.14 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 1.16 0.00 0.00 1.04 0.00 0.00 167 Q 8.93 5.31 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.37 0.00 0.00 0.00 0.00 0.00 2.18 2.18 0.00 168 L 8.84 5.24 0.00 1.96 1.86 0.92 0.98 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 0.00 169 I 8.90 5.08 2.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.14 0.96 0.00 0.00 170 A 8.52 5.50 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 F 8.86 5.05 0.00 3.16 3.18 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 0.00 172 K 8.95 5.06 0.00 1.85 1.80 0.00 1.65 0.00 0.00 1.54 0.00 0.00 2.25 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.23 1.48 7.81 173 D 8.84 4.64 0.00 2.54 2.46 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 0.00 174 G 9.66 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 0.00 175 K 7.46 4.66 0.00 1.72 1.67 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.77 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.46 7.81 176 P 0.00 4.46 0.00 2.06 2.01 0.00 3.70 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 2.04 2.10 0.00 177 A 8.05 4.69 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 0.00 178 A 8.47 4.19 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 0.00 179 I 8.20 3.95 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.87 0.92 0.00 0.00 180 K 8.14 4.58 0.00 1.57 1.48 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.92 0.44 7.81 181 P 0.00 4.31 0.00 2.15 2.03 0.00 3.66 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.93 0.00 182 A 8.33 4.42 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 0.00 183 V 8.82 4.41 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 1.02 0.00 0.00 0.94 0.00 0.00 184 S 8.62 4.98 0.00 3.80 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 0.00 185 V 8.89 4.46 2.14 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 1.20 0.00 0.00 1.02 0.00 0.00 186 E 8.96 5.18 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 2.17 2.28 0.00 187 L 9.18 5.09 0.00 1.44 1.30 1.01 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 188 R 9.27 5.10 0.00 1.81 1.92 0.00 3.17 0.00 0.00 3.13 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.51 0.00 189 I 8.21 3.73 1.75 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.61 0.82 0.00 0.00 190 D 9.24 4.81 0.00 2.88 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 0.00 191 T 7.98 4.09 4.22 0.00 0.00 0.00 0.00 0.00 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 0.00 192 V 8.05 3.87 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 1.10 0.00 0.00 1.03 0.00 0.00 193 K 8.39 4.27 0.00 2.12 2.08 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.60 7.81 194 F 8.45 4.02 0.00 2.84 2.48 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 0.00 195 Y 7.84 4.77 0.00 2.91 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 0.00 196 K 8.07 4.53 0.00 1.78 1.65 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.48 7.81 197 L 8.28 3.50 0.00 1.56 1.61 0.63 0.93 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 0.00 198 H 8.14 4.46 0.00 3.33 3.43 0.00 5.57 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 T 7.76 4.16 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 200 F 7.97 4.55 0.00 2.98 3.09 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 0.00 201 S 8.94 4.94 0.00 3.63 3.67 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 0.00 0.00 0.00 0.00 202 A 8.58 4.55 1.19 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 0.00 0.00 203 S 8.22 4.40 0.00 3.57 3.72 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 0.00 204 D 7.75 4.29 0.00 2.01 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 0.00 205 F 7.16 4.45 0.00 2.67 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 0.00 0.00 0.00 0.00 206 F 7.40 4.82 0.00 3.15 2.90 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 0.00 0.00 0.00 207 E 8.94 4.11 0.00 1.95 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 2.31 2.34 0.00 208 E 8.00 4.22 0.00 2.02 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 2.29 2.39 0.00 209 P 0.00 4.80 0.00 2.07 2.10 0.00 3.64 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 2.04 2.14 0.00 210 A 9.20 4.95 1.19 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 0.00 0.00 211 L 8.17 4.21 0.00 0.27 0.93 0.52 0.69 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 0.00 212 I 7.94 4.94 1.77 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.74 0.92 0.00 0.00 213 Y 8.99 4.42 0.00 2.73 2.37 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 0.00 214 D 9.50 5.01 0.00 2.94 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 0.00 215 I 8.92 4.34 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.95 0.91 0.00 0.00 216 V 7.34 4.78 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 1.10 0.00 0.00 0.86 0.00 0.00 217 K 8.83 4.79 0.00 1.97 1.67 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.45 1.52 7.81 218 D 10.35 4.37 0.00 2.81 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 0.00 219 D 8.39 4.47 0.00 2.84 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 V 7.61 4.18 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 1.01 0.00 0.00 221 P 0.00 4.64 0.00 2.08 1.98 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 222 A 9.05 4.43 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 0.00 223 K 8.07 4.03 0.00 1.79 1.64 0.00 1.96 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.05 7.81 224 Q 8.77 3.64 0.00 2.45 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.98 0.00 0.00 0.00 0.00 0.00 2.27 1.89 0.00 225 V 7.61 3.74 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 -0.06 0.00 0.00 0.94 0.00 0.00 226 Y 7.79 4.95 0.00 3.10 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.62 4.09 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 0.85 0.00 0.00 1.09 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.