NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 P 4.3118 0.0000 0.0000 62.8765 32.5120 176.4962 14 Q 4.2047 7.4757 118.1135 57.6616 31.6564 175.3351 15 K 3.9770 8.3386 118.5499 60.5874 32.9276 179.2236 16 Q 4.1453 8.1956 121.9821 60.7715 28.2916 182.0178 17 I 4.1996 8.4641 124.8401 65.9167 35.5755 180.7378 18 Q 4.4491 8.4200 124.8434 60.9016 27.5898 180.9466 19 E 4.4520 7.9281 117.5955 60.2197 30.1167 181.1472 20 M 4.7066 8.6325 120.4788 59.7437 31.9069 179.1164 21 K 3.5002 8.7381 125.8596 60.7213 31.4129 180.9438 22 E 4.0787 7.9349 118.6882 60.8827 29.3687 180.2684 23 A 4.6177 8.3880 118.7958 53.3715 19.0218 178.2802 24 F 4.2894 9.2128 120.4576 59.3679 39.6357 177.9676 25 S 3.8401 7.9492 115.4987 62.1887 63.1589 176.4231 26 M 4.1444 7.2800 121.8184 59.2612 31.1467 180.0263 27 I 3.9872 7.4149 119.4257 63.6503 38.9767 176.9593 28 D 4.9174 7.3521 121.7667 52.7711 38.6182 176.5191 29 V 3.4348 7.0733 118.2640 64.9277 32.3859 178.4562 30 D 4.4213 7.9906 122.1232 54.2682 39.7968 177.0128 31 R 4.6629 7.9717 117.7290 56.3450 27.2378 182.2853 32 D 4.5978 8.2135 113.8528 54.3587 39.1471 177.0150 33 G 3.7594 8.3584 114.7869 45.7679 0.0000 174.7405 34 F 5.1761 6.8879 118.9875 55.6597 41.7446 177.5606 35 V 4.0466 7.7215 119.1758 59.3057 29.9163 172.3885 36 S 4.4134 8.0754 119.9788 57.3058 63.9128 176.2041 37 K 3.6193 8.8841 123.2202 60.1071 30.7866 178.5156 38 E 4.0802 7.9184 117.4742 58.9790 29.0416 178.7298 39 D 4.5588 8.8021 119.6382 57.1977 40.6551 178.4743 40 I 3.7227 7.5678 122.9397 64.4802 37.3550 178.8217 41 K 3.8873 7.7602 124.3148 59.6849 31.6471 179.7897 42 A 4.4007 8.3964 120.7404 54.7828 17.7091 179.3102 43 I 3.6918 6.6963 120.8115 63.3366 38.1624 178.2041 44 S 4.3523 8.2154 117.0327 62.2289 62.7017 177.0277 45 E 4.1468 8.1214 124.1844 61.2809 29.4128 181.1736 46 Q 4.4743 8.1621 118.3122 58.3057 28.0233 178.4721 47 L 4.9917 7.8791 116.7131 56.5110 46.9766 176.6973 48 G 3.6804 12.0000 109.0442 45.2526 0.0000 174.9197 49 R 4.1591 8.4877 123.4371 54.0452 28.9966 175.1956 50 A 4.0233 8.7413 125.7388 50.7022 18.6725 175.8933 51 P 4.4218 0.0000 0.0000 62.4295 31.9814 176.4362 52 D 4.5791 8.4176 119.4823 54.8363 42.6728 175.6715 53 D 4.2309 8.8844 117.7758 57.7341 40.8189 177.8807 54 K 3.7734 8.0629 118.4478 59.9701 32.2477 178.4857 55 E 3.9832 7.4465 117.4589 59.8497 29.6752 179.3645 56 L 4.1310 8.1978 118.8507 58.1271 41.7610 179.0327 57 T 3.8866 8.0518 114.4670 67.3045 68.2596 175.6168 58 A 4.3425 8.4314 119.0044 53.5144 18.3452 178.0470 59 M 4.4586 8.3021 119.0405 56.0402 32.9046 177.2145 60 L 4.3907 7.9794 118.7783 56.7649 42.3749 178.4163 61 K 4.0959 8.1061 118.4217 59.0265 32.5163 177.2881 62 E 4.0292 8.3624 117.4909 58.0714 29.6153 176.0580 63 A 4.7481 8.0790 121.8517 49.3321 21.2804 173.8710 64 P 4.2892 0.0000 0.0000 65.2258 31.5743 176.4868 65 G 4.1808 7.3937 103.4002 42.6909 0.0000 169.3511 66 P 4.1126 0.0000 0.0000 63.4167 31.4011 177.3110 67 L 3.8778 8.4984 127.7031 56.5580 41.6106 172.1337 68 N 5.0263 9.0860 124.3635 52.7690 36.9201 175.7699 69 F 4.5343 9.0356 117.9458 58.1677 43.1252 175.8963 70 T 3.4843 7.9509 116.9540 66.5984 68.3508 176.0088 71 M 4.0930 8.1181 119.5186 57.8054 30.6479 178.1088 72 F 4.3676 7.8948 120.8577 61.1700 39.5588 176.4053 73 L 3.4664 8.0577 116.6291 56.4666 41.7332 178.4410 74 S 4.1926 7.5666 114.4572 60.1696 62.1888 175.1380 75 I 3.9063 7.8075 119.0417 62.6262 37.5241 177.2157 *76 F 4.4237 7.0845 117.4053 56.8324 38.7313 182.1341 77 S 4.4625 8.2819 113.2068 60.7134 63.5068 175.7912 78 D 4.4299 8.0629 121.2152 57.4530 40.8566 178.4850 79 K 4.1367 7.6776 116.8996 56.0035 31.8159 178.1010 80 L 4.3465 7.5365 113.1281 55.6941 45.1987 176.4601 81 S 3.9211 7.6747 113.2686 61.5313 62.2976 176.2278 82 G 3.9346 8.1746 110.2420 45.7658 0.0000 173.4015 83 T 4.3719 7.3001 117.3918 59.5638 66.9108 172.2724 84 D 4.3652 8.2288 122.8341 54.1677 41.9713 177.4969 85 S 4.1380 8.6980 118.2062 58.6526 64.3277 175.2430 86 E 3.9465 8.8298 123.5484 59.6302 28.6945 179.0550 87 E 4.0335 8.1618 118.2511 59.7591 29.4791 179.0436 88 T 4.3409 7.5213 108.2240 65.0963 68.7545 176.1062 89 I 3.7783 7.8077 122.5577 64.2813 37.0738 178.6119 90 R 4.4026 8.7552 117.1972 59.3501 29.1153 178.0463 91 N 4.5503 9.4509 115.5796 54.8640 38.9900 176.6462 92 A 4.1250 7.8694 122.8383 54.8266 18.2682 179.2709 93 F 4.2489 7.9227 116.1306 60.1857 38.6538 177.3633 94 A 3.8177 7.5800 120.4590 55.1425 18.1362 178.6832 95 M 4.0880 7.4827 114.5733 57.1830 32.2855 176.3479 96 F 4.7128 9.0732 116.8294 58.8808 41.4203 175.9453 97 D 4.8708 7.7358 120.5716 53.6187 38.9783 175.9877 98 E 4.6343 8.1715 124.3766 56.0274 30.0326 178.5746 99 Q 4.4111 8.4925 114.6401 56.1760 32.8627 174.8196 100 E 3.9278 7.9206 116.1744 57.9429 26.8274 174.5072 101 T 4.4257 10.5320 107.8190 60.8744 70.4956 175.7287 102 K 4.2987 8.4888 123.8299 54.3540 29.1789 180.5602 103 K 4.8755 7.6802 119.4609 55.0068 36.1125 177.7369 104 L 4.9449 8.5319 120.6870 52.9340 45.1825 176.0948 105 N 4.4674 9.2312 120.5872 54.4424 39.2090 175.6860 106 I 3.6250 9.6492 129.0399 64.7997 38.3390 178.1431 107 E 4.0168 8.2563 118.6376 61.1826 29.2422 179.1044 108 Y 4.7436 9.3260 119.6072 60.3097 38.9636 176.6450 109 I 2.7379 7.6066 122.0662 64.3745 38.0789 179.0687 110 K 3.8942 7.9180 124.5882 59.8951 31.4845 182.7299 111 D 4.5815 7.7112 119.3552 56.3100 40.9573 177.2214 112 L 4.0783 8.0638 119.5162 55.9165 42.2934 176.1679 113 L 4.2617 7.1468 115.0464 57.0337 43.6966 178.5166 114 E 4.3464 8.0584 117.4230 58.5731 29.5653 176.8832 115 N 4.9920 7.8962 112.5990 52.7435 40.3314 173.7132 116 M 4.6342 7.9305 117.4875 53.4437 36.1714 179.3716 117 G 3.8880 9.1124 110.5584 46.5353 0.0000 174.7081 118 D 4.8026 9.2667 117.2375 52.5100 43.6440 175.1192 119 N 4.3948 8.9305 123.5251 52.9608 37.8913 171.0846 120 F 4.1760 8.7912 127.8630 57.8730 40.0382 174.8293 121 N 4.5864 8.8374 125.8651 53.1187 38.7873 176.4704 122 K 3.9121 9.0398 125.5792 60.6937 31.6723 178.8107 123 D 4.5297 8.2118 118.2518 57.6728 40.8807 178.2461 124 E 4.0111 8.8088 119.0326 59.5216 29.4423 179.4865 125 M 4.6083 8.0920 118.9338 58.5047 32.1285 178.4386 126 R 4.1182 8.1618 121.0257 60.5810 30.1753 178.9636 127 M 4.1748 7.8814 118.7778 60.6702 31.3604 179.3759 128 T 4.4115 7.9932 114.8734 65.7773 68.5412 176.2668 129 F 4.2121 8.1105 121.4961 59.8168 39.1864 177.4190 130 K 3.8315 7.9269 120.5772 59.7795 31.9449 177.9610 131 E 4.4900 7.7062 110.4633 55.3660 31.0262 177.4159 132 A 3.7027 7.9902 121.3974 52.1547 18.2877 177.1794 133 P 4.5924 0.0000 0.0000 62.7419 30.9670 177.0213 134 V 3.6313 7.5226 118.5995 64.0750 32.1949 174.8793 135 E 4.5777 8.7441 119.3424 56.7483 33.2077 176.4456 136 G 4.1194 9.8662 115.3213 46.7112 0.0000 174.9911 137 G 3.9629 8.3890 109.7382 46.2313 0.0000 175.4996 138 K 4.3042 7.6623 121.0272 55.1003 33.4908 180.8445 139 F 4.5250 8.0482 112.1718 58.4868 40.4849 172.7598 140 D 4.6714 7.8316 129.3835 53.1784 39.8565 175.4429 141 Y 4.3121 7.7975 124.3231 59.0001 38.0059 178.0558 142 V 3.8327 7.4468 123.1058 66.7654 31.8713 178.5315 143 K 4.0020 8.5752 123.3884 59.4623 31.4998 181.0807 144 F 4.4527 8.2188 120.1222 61.8294 38.9821 177.5254 145 T 3.6766 8.3155 115.3342 66.3667 68.1571 176.6929 146 A 4.1802 8.0636 123.1413 54.2400 18.3341 178.4908 147 M 4.1345 7.3409 114.8577 57.4207 32.9122 177.4706 148 I 3.6788 7.5506 118.5274 61.7535 38.0624 175.1558 149 K 4.6504 6.9824 121.0416 58.1955 35.6736 174.1540 150 G 3.8263 8.4931 117.3698 45.2549 0.0000 170.3968 151 S 4.1103 8.3099 118.3100 58.6354 62.7118 171.0927 152 G 3.5956 7.7905 111.7564 42.9655 0.0000 173.5850 153 E 4.8038 7.1136 123.6334 55.9545 32.8394 177.2570 154 E 4.3166 8.6563 117.1823 56.0489 30.8981 176.2765 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 13 P 0.00 4.31 0.00 2.16 2.18 0.00 3.68 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.93 0.00 14 Q 7.48 4.20 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.32 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 15 K 8.34 3.98 0.00 1.81 1.90 0.00 1.76 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.49 7.81 16 Q 8.20 4.15 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 7.04 0.00 0.00 0.00 0.00 0.00 2.28 2.00 0.00 17 I 8.46 4.20 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 0.54 0.91 0.00 0.00 18 Q 8.42 4.45 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.86 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.01 0.00 19 E 7.93 4.45 0.00 2.10 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 0.00 2.25 2.21 0.00 20 M 8.63 4.71 0.00 2.33 2.60 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 3.09 0.00 21 K 8.74 3.50 0.00 1.76 1.84 0.00 1.81 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.10 7.81 22 E 7.93 4.08 0.00 2.10 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 2.25 2.21 0.00 23 A 8.39 4.62 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 0.00 0.00 0.00 0.00 0.00 24 F 9.21 4.29 0.00 2.78 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 S 7.95 3.84 0.00 3.95 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 26 M 7.28 4.14 0.00 2.18 2.03 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 27 I 7.41 3.99 1.62 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 1.67 1.17 0.84 0.00 0.00 28 D 7.35 4.92 0.00 2.02 2.19 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 29 V 7.07 3.43 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 30 D 7.99 4.42 0.00 2.72 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 31 R 7.97 4.66 0.00 1.90 1.97 0.00 3.25 0.00 0.00 3.31 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.38 0.00 32 D 8.21 4.60 0.00 2.69 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 33 G 8.36 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 34 F 6.89 5.18 0.00 3.13 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 35 V 7.72 4.05 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 0.74 0.00 0.00 0.93 0.00 0.00 36 S 8.08 4.41 0.00 4.07 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 0.00 37 K 8.88 3.62 0.00 1.83 1.90 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.91 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.53 1.52 7.81 38 E 7.92 4.08 0.00 2.24 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 39 D 8.80 4.56 0.00 2.79 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 40 I 7.57 3.72 2.04 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 1.43 0.50 0.94 0.00 0.00 41 K 7.76 3.89 0.00 1.89 1.85 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.36 7.81 42 A 8.40 4.40 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 43 I 6.70 3.69 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 1.63 0.42 0.93 0.00 0.00 44 S 8.22 4.35 0.00 4.05 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 0.00 45 E 8.12 4.15 0.00 2.02 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 2.24 2.19 0.00 46 Q 8.16 4.47 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 47 L 7.88 4.99 0.00 2.04 1.58 0.93 0.74 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 48 G 12.00 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 R 8.49 4.16 0.00 1.78 1.89 0.00 3.28 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 50 A 8.74 4.02 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 P 0.00 4.42 0.00 2.20 2.08 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 52 D 8.42 4.58 0.00 2.79 2.65 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 0.00 0.00 0.00 53 D 8.88 4.23 0.00 2.74 2.56 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 54 K 8.06 3.77 0.00 1.90 1.82 0.00 1.69 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.63 7.81 55 E 7.45 3.98 0.00 2.18 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 56 L 8.20 4.13 0.00 1.87 1.71 1.03 0.95 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 57 T 8.05 3.89 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 1.22 0.00 0.00 58 A 8.43 4.34 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 M 8.30 4.46 0.00 2.13 2.31 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.47 0.00 60 L 7.98 4.39 0.00 1.73 1.70 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 61 K 8.11 4.10 0.00 1.69 1.86 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.54 7.81 62 E 8.36 4.03 0.00 2.20 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 2.40 2.49 0.00 63 A 8.08 4.75 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 64 P 0.00 4.29 0.00 2.02 2.14 0.00 3.60 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 65 G 7.39 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 0.00 0.00 0.00 66 P 0.00 4.11 0.00 1.63 1.87 0.00 3.58 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.05 0.00 67 L 8.50 3.88 0.00 1.34 1.58 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 68 N 9.09 5.03 0.00 2.91 3.15 0.00 0.00 5.97 7.43 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 69 F 9.04 4.53 0.00 2.11 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 70 T 7.95 3.48 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 1.15 0.00 0.00 71 M 8.12 4.09 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.72 0.00 72 F 7.89 4.37 0.00 3.13 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 73 L 8.06 3.47 0.00 1.26 1.41 0.34 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 74 S 7.57 4.19 0.00 3.98 3.85 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 75 I 7.81 3.91 1.83 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.42 0.89 0.00 0.00 *76 F 7.08 4.42 0.00 2.33 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 0.00 0.00 0.00 0.00 77 S 8.28 4.46 0.00 3.85 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 0.00 78 D 8.06 4.43 0.00 2.68 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 7.68 4.14 0.00 1.68 1.78 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.49 7.81 80 L 7.54 4.35 0.00 1.53 1.57 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 81 S 7.67 3.92 0.00 3.94 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 82 G 8.17 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 T 7.30 4.37 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 1.33 0.00 0.00 84 D 8.23 4.37 0.00 2.66 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 0.00 0.00 0.00 85 S 8.70 4.14 0.00 4.04 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 86 E 8.83 3.95 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 87 E 8.16 4.03 0.00 2.03 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 2.42 2.33 0.00 88 T 7.52 4.34 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 1.20 0.00 0.00 89 I 7.81 3.78 2.10 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.13 0.92 0.00 0.00 90 R 8.76 4.40 0.00 2.32 2.41 0.00 2.90 0.00 0.00 3.32 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.08 0.00 91 N 9.45 4.55 0.00 2.89 2.92 0.00 0.00 7.00 7.23 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 92 A 7.87 4.13 1.25 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 0.00 0.00 93 F 7.92 4.25 0.00 2.34 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.58 3.82 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 M 7.48 4.09 0.00 1.88 2.04 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.09 0.00 96 F 9.07 4.71 0.00 2.93 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 97 D 7.74 4.87 0.00 3.08 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.17 4.63 0.00 2.14 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 0.00 2.33 2.35 0.00 99 Q 8.49 4.41 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.55 6.66 0.00 0.00 0.00 0.00 0.00 2.31 2.49 0.00 100 E 7.92 3.93 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 101 T 10.53 4.43 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 1.38 0.00 0.00 102 K 8.49 4.30 0.00 1.92 1.76 0.00 1.74 0.00 0.00 2.40 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.27 0.94 7.81 103 K 7.68 4.88 0.00 1.46 1.54 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.30 1.28 7.81 104 L 8.53 4.94 0.00 1.36 1.60 0.73 1.26 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 0.00 105 N 9.23 4.47 0.00 2.77 2.81 0.00 0.00 6.75 7.32 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 0.00 106 I 9.65 3.62 2.11 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 1.05 1.26 0.99 0.00 0.00 107 E 8.26 4.02 0.00 2.01 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 2.32 1.94 0.00 108 Y 9.33 4.74 0.00 2.87 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 0.00 109 I 7.61 2.74 1.30 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.71 0.39 0.00 0.00 110 K 7.92 3.89 0.00 1.81 1.80 0.00 1.86 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.37 1.32 7.81 111 D 7.71 4.58 0.00 2.72 2.94 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 0.00 112 L 8.06 4.08 0.00 1.04 1.16 0.79 -0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 113 L 7.15 4.26 0.00 1.50 0.59 0.50 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.06 4.35 0.00 2.01 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 2.37 2.36 0.00 115 N 7.90 4.99 0.00 2.94 2.78 0.00 0.00 6.87 7.52 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 0.00 116 M 7.93 4.63 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.57 0.00 117 G 9.11 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 0.00 118 D 9.27 4.80 0.00 2.70 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 0.00 0.00 0.00 119 N 8.93 4.39 0.00 2.50 2.71 0.00 0.00 6.78 7.43 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 0.00 120 F 8.79 4.18 0.00 3.26 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 0.00 121 N 8.84 4.59 0.00 2.79 2.88 0.00 0.00 6.32 6.72 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 0.00 122 K 9.04 3.91 0.00 1.78 1.90 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.11 7.81 123 D 8.21 4.53 0.00 2.78 2.68 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 0.00 0.00 0.00 0.00 124 E 8.81 4.01 0.00 1.91 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 0.00 2.24 2.31 0.00 125 M 8.09 4.61 0.00 2.23 2.47 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 3.07 0.00 126 R 8.16 4.12 0.00 1.98 2.14 0.00 3.15 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 127 M 7.88 4.17 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.48 0.00 128 T 7.99 4.41 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 1.00 0.00 0.00 129 F 8.11 4.21 0.00 3.12 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 0.00 130 K 7.93 3.83 0.00 1.82 1.96 0.00 1.71 0.00 0.00 1.79 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.75 7.81 131 E 7.71 4.49 0.00 1.92 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 0.00 2.16 2.09 0.00 132 A 7.99 3.70 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 0.00 133 P 0.00 4.59 0.00 2.03 2.07 0.00 3.28 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.82 0.00 134 V 7.52 3.63 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 0.84 0.00 0.00 1.04 0.00 0.00 135 E 8.74 4.58 0.00 2.04 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 0.00 2.07 2.25 0.00 136 G 9.87 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 0.00 0.00 0.00 137 G 8.39 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 K 7.66 4.30 0.00 1.71 1.75 0.00 1.85 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.37 1.24 7.81 139 F 8.05 4.53 0.00 2.98 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 0.00 140 D 7.83 4.67 0.00 2.63 2.41 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 0.00 141 Y 7.80 4.31 0.00 1.44 2.47 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 0.00 142 V 7.45 3.83 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 1.12 0.00 0.00 0.79 0.00 0.00 143 K 8.58 4.00 0.00 1.81 1.81 0.00 1.86 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.32 7.81 144 F 8.22 4.45 0.00 2.83 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 0.00 145 T 8.32 3.68 4.54 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 1.28 0.00 0.00 146 A 8.06 4.18 1.38 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 0.00 0.00 147 M 7.34 4.13 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 148 I 7.55 3.68 1.09 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 1.27 0.71 0.78 0.00 0.00 149 K 6.98 4.65 0.00 1.69 1.67 0.00 1.95 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.17 1.12 7.81 150 G 8.49 3.83 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 0.00 0.00 0.00 151 S 8.31 4.11 0.00 3.99 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 0.00 152 G 7.79 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 0.00 153 E 7.11 4.80 0.00 1.88 1.79 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 2.04 2.18 0.00 154 E 8.66 4.32 0.00 1.97 1.62 0.00 0.00 0.00 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 1.83 0.00 * Residues marked with a * may have inaccurate shift predictions.