NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 58 P 4.3855 0.0000 0.0000 61.4024 33.9364 176.3145 59 G 4.7403 7.7544 101.7314 46.4854 0.0000 169.0883 60 I 5.0639 8.4013 123.3366 59.5619 39.5052 173.3565 61 W 5.1235 9.6146 126.3080 54.8459 33.8788 173.9162 62 Q 5.2013 9.3061 121.4856 54.4353 31.7709 173.6308 63 L 5.4101 9.2976 128.0537 53.6364 45.0249 175.0092 64 D 4.8007 9.0500 124.2619 53.4579 46.1767 173.6214 65 C 5.2849 8.4629 116.5072 58.4527 31.3489 173.5294 66 T 4.7536 8.7289 115.5203 60.8036 71.2322 171.8840 67 H 5.4537 8.7335 121.3793 53.9946 31.7018 173.6639 68 L 4.4971 8.8415 123.4507 54.9974 45.2136 175.5137 69 E 3.8862 9.8144 125.0536 57.5888 27.0731 175.2470 70 G 3.9543 8.4925 102.2017 46.0686 0.0000 173.9610 71 K 4.6537 8.1263 118.5823 54.1059 35.4769 174.8693 72 V 4.5776 7.7296 120.2707 61.3460 33.7487 174.4475 73 I 4.7393 8.8186 128.9962 59.4344 39.6654 174.5105 74 L 4.4385 8.9196 131.2695 54.1454 43.1804 175.4012 75 V 4.8053 8.8853 127.5644 61.0861 33.9043 173.9149 76 A 5.5329 9.3227 130.5153 50.2704 21.6960 175.1199 77 V 4.8313 9.1497 122.8926 61.3019 34.8266 174.2170 78 H 3.6341 9.0902 128.8521 54.7534 29.2658 175.5219 79 V 3.3840 7.6128 125.1463 65.9198 31.4320 177.5759 80 A 4.0268 7.5294 120.6292 54.2820 18.4501 178.0737 81 S 4.3567 8.0090 108.7735 58.1099 64.3548 175.3447 82 G 3.9321 8.4417 108.2567 44.5354 0.0000 172.7661 83 Y 4.3766 7.8175 121.8766 57.8492 39.7974 174.9217 84 I 5.0467 8.1291 126.1933 59.4586 40.8275 174.6706 85 E 4.7640 9.1871 125.0151 54.6990 32.9112 174.0883 86 A 5.8343 8.6534 126.6778 49.7267 23.2579 174.3591 87 E 4.7411 8.4006 117.8157 55.2035 33.3519 173.7771 88 V 4.7224 8.4872 126.8541 61.7374 32.4673 174.8259 89 I 4.6472 8.6242 121.0571 58.4049 40.6490 174.8828 90 P 4.0586 0.0000 0.0000 65.2733 31.2811 176.4889 91 A 4.3359 7.2175 116.0897 51.0735 21.5102 175.6968 92 E 4.1057 8.7430 119.5636 56.7782 29.1385 177.3633 93 T 4.8803 8.0921 113.9861 58.7857 73.4121 174.7562 94 G 3.6990 8.6221 108.5549 48.0402 0.0000 175.8816 95 Q 4.0651 8.1126 119.8468 59.0139 28.7352 178.8362 96 E 4.1093 8.1325 119.0364 59.7671 29.4395 179.6058 97 T 3.9759 8.0189 115.3114 66.5223 68.5272 176.5476 98 A 4.0503 8.4482 122.9977 55.3879 18.5244 178.9685 99 Y 4.1351 8.3865 118.2488 60.8408 38.7941 178.0797 100 F 3.8224 8.6359 121.6552 61.3246 39.4626 176.9499 101 L 3.9332 8.2964 118.6748 57.8658 41.3913 179.5594 102 L 3.9778 7.8651 118.7955 57.5933 41.2976 179.7280 103 K 3.6359 7.2602 117.1108 59.2314 32.2203 178.6212 104 L 3.8027 7.5236 120.3990 58.1194 41.8682 178.8575 105 A 4.0135 8.1378 120.9327 55.1102 18.1907 179.3857 106 G 3.6098 7.8289 101.2109 46.0382 0.0000 174.6766 107 R 4.0233 6.9894 119.3123 56.2535 31.2144 175.4852 108 W 5.0186 7.4423 115.4779 53.8559 32.6957 174.0930 109 P 4.5084 0.0000 0.0000 62.0831 29.5948 174.4333 110 V 4.4392 8.1407 124.7713 62.2546 32.1987 175.0627 111 K 4.5712 9.3490 127.3034 57.6035 34.8278 176.8044 112 T 5.2413 7.9126 115.1347 61.7046 72.7258 173.2827 113 V 5.0080 8.8331 125.4133 61.7027 34.3752 174.8207 114 H 5.1440 9.6455 125.7986 55.6304 31.0714 173.7736 115 T 4.8661 8.1825 112.4295 62.0272 69.6998 172.7968 116 D 4.6194 9.4102 124.2791 54.4549 41.7458 176.8982 117 N 4.7083 7.6697 117.6632 50.6634 39.4803 174.2561 118 G 3.5406 8.3653 114.3308 48.0630 0.0000 173.5684 119 S 4.1559 7.9561 113.9009 60.7348 63.1359 176.0080 120 N 4.2295 7.8916 118.4835 55.9750 38.2278 175.6169 121 F 5.2372 7.9728 114.8772 57.6508 39.0454 176.8302 122 T 4.2983 7.8223 113.5603 63.6731 69.4559 176.3373 123 S 4.3433 8.0130 117.4297 58.5150 64.9645 175.2968 124 T 3.9922 8.4966 114.2084 64.8806 68.6253 176.9058 125 T 3.9719 7.8741 112.7992 64.5940 68.9247 176.8209 126 V 3.6523 7.8594 120.9112 65.6827 31.5427 178.0952 127 K 3.9918 8.2893 118.0879 59.5570 31.8248 179.1742 128 A 4.1644 8.2820 120.7301 55.0215 18.2231 179.5772 129 A 4.0609 8.2026 119.3011 55.6595 18.5471 179.6277 130 C 4.0902 8.5278 115.6877 62.6350 28.0448 176.2359 131 W 4.0992 8.7006 130.2104 60.2524 30.1602 177.7810 132 W 3.5567 8.6656 126.9805 60.2465 30.3260 177.2372 133 A 4.1174 8.4217 118.1818 52.0194 18.3633 177.2693 134 G 3.5876 7.4608 105.1444 46.4964 0.0000 173.4481 135 I 4.5949 7.9997 119.8541 59.2413 39.0065 175.5784 136 K 4.7509 9.1469 127.0027 54.6751 35.6606 174.2949 137 Q 4.9080 8.4791 123.4099 54.2919 32.6011 174.2344 138 E 4.4606 8.0199 123.0142 54.3281 30.2098 175.5505 139 F 3.9334 8.8351 130.4747 60.7876 39.2403 174.8492 140 G 3.7095 8.1672 117.2477 46.4465 0.0000 171.9196 *153 S 4.4050 7.8613 118.1905 58.3656 64.9234 175.6331 154 M 3.8426 8.0092 119.0148 58.7222 31.7547 178.6966 155 N 4.2853 8.0721 115.6495 56.3274 38.7852 177.3657 156 K 3.9919 7.9453 120.5150 59.2087 32.2690 178.4133 157 E 3.9081 8.7722 120.1835 59.0887 29.5298 178.4038 158 L 3.9157 8.3256 120.8195 58.1853 42.1124 179.0813 159 K 3.9386 7.8780 118.0087 59.1951 31.9561 179.1558 160 K 3.8789 7.7740 119.4495 59.7243 32.1741 178.8864 161 I 3.9159 7.9646 120.1386 64.5783 37.0035 178.5312 162 I 3.8701 8.2613 121.1226 64.1192 36.6157 178.8101 163 G 3.5701 7.7604 105.9637 48.0254 0.0000 175.5970 164 Q 4.1425 7.9203 119.5993 57.9471 28.9547 178.1449 165 V 4.1889 7.7695 117.4850 62.8269 31.7732 177.3484 166 R 3.8727 7.8063 119.6013 60.1800 29.8244 177.6106 167 D 4.5853 8.0612 113.2114 54.8736 39.4697 176.2772 168 Q 4.4361 8.1778 118.6216 55.6826 29.0368 175.0808 169 A 4.6836 7.5117 120.3869 50.3242 22.4725 176.5928 170 E 3.9643 8.9542 122.4636 59.0732 30.2921 177.3741 171 H 5.0437 7.6200 114.9541 53.5606 32.5598 175.0915 172 L 3.9721 8.4846 124.7471 58.3921 41.8598 179.2028 173 K 3.8450 8.2140 117.7586 60.2499 32.0229 178.8070 174 T 3.8725 8.0024 114.5555 66.8019 68.3745 176.3198 175 A 4.0088 7.8884 122.0162 55.0658 18.3351 179.8261 176 V 3.5394 8.1418 117.1383 66.4250 31.5820 178.3923 177 Q 4.0857 8.1936 117.7313 59.0826 28.3979 178.6710 178 M 4.0185 8.2780 119.6675 58.3840 31.9776 178.6386 179 A 4.0421 8.3572 121.2133 55.0644 18.4225 179.8913 180 V 3.5378 8.0213 116.9263 65.9784 31.6573 177.9288 181 F 4.0719 8.5410 120.5570 61.5081 39.2937 177.0041 182 I 3.8848 8.3749 119.6533 64.7336 36.7054 177.8692 183 H 4.0674 8.2212 117.6708 59.5530 30.1297 176.9994 184 N 4.4404 8.5463 118.1206 55.5228 38.0820 176.9703 185 K 4.1177 7.5754 118.4339 56.2513 32.8288 177.0395 186 K 3.9095 7.4592 121.3667 57.1267 33.1952 175.5857 187 R 4.6545 8.5342 128.2621 54.9561 31.8788 177.4407 188 K 4.0979 8.2262 128.4364 54.6462 30.6805 173.2066 189 G 3.9156 8.7567 115.2743 44.8350 0.0000 173.3689 190 G 4.1306 7.7858 122.4984 46.4098 0.0000 171.7371 191 I 3.8066 8.1553 123.6591 61.2036 35.4018 173.0060 192 G 4.1851 8.3408 122.2705 42.4065 0.0000 174.2297 193 G 3.7626 7.7728 110.6640 46.5539 0.0000 173.2001 *194 Y 4.7260 7.4048 115.3061 53.9357 41.4762 176.6385 195 S 5.1296 8.4526 115.7368 56.7922 66.3611 175.2573 196 A 4.0457 8.4016 124.0504 55.4969 18.2503 180.2622 197 G 3.7229 8.2463 104.0615 47.9435 0.0000 175.8007 198 E 4.1254 7.8159 119.6789 59.1006 29.5347 179.4146 199 R 3.8551 8.2379 118.5123 59.1467 30.1021 178.9161 200 I 3.3281 7.5817 118.3549 64.0109 37.8769 178.0997 201 V 3.6433 7.2185 118.0153 65.8529 31.1941 177.5282 202 D 4.2557 8.1432 117.8363 57.4468 41.1690 178.1005 203 I 3.6569 8.0044 120.6763 64.6427 37.1398 178.5836 204 I 3.7503 7.9358 120.2598 64.1857 36.9435 178.3635 205 A 4.0192 8.1817 121.7151 55.4293 18.2250 179.8009 206 T 3.7942 8.1817 114.5287 66.8132 68.4486 176.2400 207 D 4.3396 8.0347 119.8612 57.4539 41.3194 178.4112 208 I 3.7518 7.9737 122.5970 65.1378 36.9156 178.8967 209 Q 4.0685 7.9476 120.3922 60.6452 27.9727 180.5704 210 T 4.2362 7.9450 110.5976 63.9648 68.9604 176.0840 211 K 4.2851 7.6144 118.8887 56.9430 32.5859 177.0360 212 E 4.2559 7.8708 123.4413 56.7693 29.5958 176.4581 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 58 P 0.00 4.39 0.00 2.06 2.08 0.00 3.53 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.05 0.00 59 G 7.75 4.74 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 60 I 8.40 5.06 1.79 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 1.39 1.13 0.96 0.00 0.00 61 W 9.61 5.12 0.00 3.29 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Q 9.31 5.20 0.00 2.20 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.46 0.00 63 L 9.30 5.41 0.00 1.86 1.82 0.94 1.37 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 64 D 9.05 4.80 0.00 2.58 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 65 C 8.46 5.28 0.00 2.78 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 66 T 8.73 4.75 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 1.17 0.00 0.00 67 H 8.73 5.45 0.00 2.99 3.17 0.00 5.94 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 68 L 8.84 4.50 0.00 1.62 1.45 0.92 0.81 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 69 E 9.81 3.89 0.00 2.13 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 2.23 2.29 0.00 70 G 8.49 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 71 K 8.13 4.65 0.00 1.93 1.67 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.50 7.81 72 V 7.73 4.58 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 0.91 0.00 0.00 0.91 0.00 0.00 73 I 8.82 4.74 1.82 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.50 0.88 0.00 0.00 74 L 8.92 4.44 0.00 1.45 1.04 0.77 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 75 V 8.89 4.81 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 0.89 0.00 0.00 0.94 0.00 0.00 76 A 9.32 5.53 1.70 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 0.00 0.00 77 V 9.15 4.83 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.96 0.00 0.00 78 H 9.09 3.63 0.00 1.69 2.70 0.00 5.68 0.00 0.00 0.00 0.00 6.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.61 3.38 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.84 0.00 0.00 80 A 7.53 4.03 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 81 S 8.01 4.36 0.00 3.89 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.44 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 7.82 4.38 0.00 3.13 2.53 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 84 I 8.13 5.05 1.71 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.87 0.85 0.00 0.00 85 E 9.19 4.76 0.00 2.31 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 0.00 2.35 2.46 0.00 86 A 8.65 5.83 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 87 E 8.40 4.74 0.00 2.48 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 2.54 2.50 0.00 88 V 8.49 4.72 2.10 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 0.87 0.00 0.00 0.94 0.00 0.00 89 I 8.62 4.65 1.89 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.78 1.00 0.00 0.00 90 P 0.00 4.06 0.00 2.06 2.16 0.00 3.72 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 2.03 2.09 0.00 91 A 7.22 4.34 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 92 E 8.74 4.11 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 93 T 8.09 4.88 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 1.28 0.00 0.00 94 G 8.62 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 0.00 0.00 0.00 95 Q 8.11 4.07 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.85 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 96 E 8.13 4.11 0.00 2.21 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 2.36 2.53 0.00 97 T 8.02 3.98 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 98 A 8.45 4.05 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.39 4.14 0.00 3.13 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.64 3.82 0.00 3.37 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 8.30 3.93 0.00 1.93 1.69 0.87 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 102 L 7.87 3.98 0.00 1.75 1.61 0.75 0.83 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 0.00 103 K 7.26 3.64 0.00 1.39 1.48 0.00 1.45 0.00 0.00 1.20 0.00 0.00 2.49 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.06 0.79 7.81 104 L 7.52 3.80 0.00 1.34 1.51 0.38 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 105 A 8.14 4.01 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 0.00 106 G 7.83 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 107 R 6.99 4.02 0.00 1.71 1.77 0.00 3.23 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.86 0.00 108 W 7.44 5.02 0.00 3.39 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 0.00 109 P 0.00 4.51 0.00 2.33 2.32 0.00 4.10 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.09 0.00 110 V 8.14 4.44 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 0.74 0.00 0.00 0.65 0.00 0.00 111 K 9.35 4.57 0.00 1.75 1.84 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.57 7.81 112 T 7.91 5.24 4.34 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 1.25 0.00 0.00 113 V 8.83 5.01 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 1.25 0.00 0.00 0.96 0.00 0.00 114 H 9.65 5.14 0.00 3.29 3.30 0.00 5.90 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 T 8.18 4.87 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 116 D 9.41 4.62 0.00 2.78 2.64 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 0.00 117 N 7.67 4.71 0.00 2.59 2.48 0.00 0.00 6.93 8.61 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 0.00 118 G 8.37 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 S 7.96 4.16 0.00 4.00 4.12 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 0.00 120 N 7.89 4.23 0.00 2.08 2.59 0.00 0.00 6.93 7.06 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 0.00 121 F 7.97 5.24 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 0.00 122 T 7.82 4.30 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 1.33 0.00 0.00 123 S 8.01 4.34 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 0.00 124 T 8.50 3.99 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 1.22 0.00 0.00 125 T 7.87 3.97 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 1.23 0.00 0.00 126 V 7.86 3.65 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 1.18 0.00 0.00 1.09 0.00 0.00 127 K 8.29 3.99 0.00 2.04 1.90 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.69 7.81 128 A 8.28 4.16 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 0.00 129 A 8.20 4.06 1.48 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 0.00 130 C 8.53 4.09 0.00 3.17 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 W 8.70 4.10 0.00 3.49 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 0.00 132 W 8.67 3.56 0.00 3.60 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 0.00 133 A 8.42 4.12 1.48 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 0.00 134 G 7.46 3.59 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 0.00 0.00 0.00 135 I 8.00 4.59 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.64 0.93 0.00 0.00 136 K 9.15 4.75 0.00 1.77 1.63 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.37 7.81 137 Q 8.48 4.91 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.70 0.00 0.00 0.00 0.00 0.00 2.45 2.63 0.00 138 E 8.02 4.46 0.00 1.93 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 139 F 8.84 3.93 0.00 3.12 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 0.00 140 G 8.17 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 *153 S 7.86 4.40 0.00 3.89 3.86 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 0.00 154 M 8.01 3.84 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.72 0.00 155 N 8.07 4.29 0.00 2.71 2.85 0.00 0.00 6.68 6.94 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 0.00 156 K 7.95 3.99 0.00 1.81 1.91 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.49 7.81 157 E 8.77 3.91 0.00 2.13 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 0.00 2.36 2.39 0.00 158 L 8.33 3.92 0.00 1.81 1.77 0.90 0.67 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 0.00 159 K 7.88 3.94 0.00 1.95 1.84 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.59 7.81 160 K 7.77 3.88 0.00 1.80 2.04 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.49 7.81 161 I 7.96 3.92 2.01 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 1.55 0.59 0.95 0.00 0.00 162 I 8.26 3.87 2.02 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 1.47 0.80 0.92 0.00 0.00 163 G 7.76 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 0.00 164 Q 7.92 4.14 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.57 0.00 165 V 7.77 4.19 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 1.10 0.00 0.00 0.95 0.00 0.00 166 R 7.81 3.87 0.00 2.15 1.94 0.00 3.20 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 167 D 8.06 4.59 0.00 2.82 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 0.00 168 Q 8.18 4.44 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.66 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 169 A 7.51 4.68 1.16 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 0.00 170 E 8.95 3.96 0.00 1.81 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 2.06 2.07 0.00 171 H 7.62 5.04 0.00 3.27 3.17 0.00 5.88 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 L 8.48 3.97 0.00 1.92 1.70 0.93 0.64 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 0.00 173 K 8.21 3.84 0.00 1.87 1.90 0.00 1.76 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.56 1.58 7.81 174 T 8.00 3.87 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 1.21 0.00 0.00 175 A 7.89 4.01 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 0.00 176 V 8.14 3.54 2.29 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 1.05 0.00 0.00 0.98 0.00 0.00 177 Q 8.19 4.09 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.62 2.60 0.00 178 M 8.28 4.02 0.00 2.04 2.27 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.46 0.00 179 A 8.36 4.04 1.42 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 0.00 180 V 8.02 3.54 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 1.11 0.00 0.00 0.97 0.00 0.00 181 F 8.54 4.07 0.00 3.24 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 0.00 182 I 8.37 3.88 2.12 0.00 0.00 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 1.80 1.05 0.98 0.00 0.00 183 H 8.22 4.07 0.00 3.19 3.52 0.00 5.95 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 0.00 184 N 8.55 4.44 0.00 2.71 2.91 0.00 0.00 7.06 7.81 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 0.00 185 K 7.58 4.12 0.00 1.65 1.74 0.00 1.26 0.00 0.00 1.05 0.00 0.00 2.57 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.78 1.19 7.81 186 K 7.46 3.91 0.00 2.01 1.65 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.45 7.81 187 R 8.53 4.65 0.00 1.71 1.82 0.00 3.25 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 188 K 8.23 4.10 0.00 1.40 1.65 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.27 7.81 189 G 8.76 3.92 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 0.00 0.00 0.00 190 G 7.79 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 I 8.16 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 1.35 0.73 0.91 0.00 0.00 192 G 8.34 4.19 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 0.00 193 G 7.77 3.76 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 0.00 0.00 0.00 *194 Y 7.40 4.73 0.00 2.18 2.09 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 0.00 195 S 8.45 5.13 0.00 4.18 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 0.00 196 A 8.40 4.05 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 0.00 197 G 8.25 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 0.00 0.00 0.00 198 E 7.82 4.13 0.00 2.19 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 0.00 2.32 2.33 0.00 199 R 8.24 3.86 0.00 1.92 1.91 0.00 3.08 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 200 I 7.58 3.33 1.30 0.00 0.00 -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 0.53 0.32 0.27 0.00 0.00 201 V 7.22 3.64 2.22 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 0.98 0.00 0.00 1.07 0.00 0.00 202 D 8.14 4.26 0.00 2.90 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 0.00 203 I 8.00 3.66 1.92 0.00 0.00 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 1.48 0.55 0.88 0.00 0.00 204 I 7.94 3.75 1.94 0.00 0.00 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 1.50 0.95 1.01 0.00 0.00 205 A 8.18 4.02 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 0.00 206 T 8.18 3.79 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 207 D 8.03 4.34 0.00 2.91 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 0.00 208 I 7.97 3.75 2.02 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.06 0.91 0.00 0.00 209 Q 7.95 4.07 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.01 0.00 0.00 0.00 0.00 0.00 2.32 2.25 0.00 210 T 7.94 4.24 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 1.28 0.00 0.00 211 K 7.61 4.29 0.00 1.71 1.89 0.00 1.87 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.46 7.81 212 E 7.87 4.26 0.00 2.10 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 0.00 2.34 2.56 0.00 * Residues marked with a * may have inaccurate shift predictions.