NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 R 4.2980 8.2393 120.8607 56.2513 32.1778 176.0992 15 V 3.6766 7.9451 117.0310 64.1228 31.3916 175.1635 16 T 4.7877 7.8158 114.1291 60.0343 71.7585 173.6204 17 K 4.9523 8.4139 125.4893 55.3052 34.5132 175.5090 18 H 4.5763 9.0347 123.0837 54.5936 29.6437 173.8917 19 P 4.5589 0.0000 0.0000 61.7635 32.4901 175.8392 20 S 4.3604 8.1304 112.8547 57.6600 63.7056 173.9621 21 L 4.0812 8.2961 122.9444 54.7416 41.8843 177.2287 22 K 4.4807 8.2536 122.2741 54.8788 33.2217 176.2289 23 T 4.2969 8.1721 121.7112 62.2281 66.6919 173.8011 24 L 4.9253 7.7068 123.3731 52.8297 44.8443 177.2285 25 T 4.4246 8.0280 112.5421 60.8125 71.5678 175.2963 26 H 4.1252 8.7051 120.2593 59.5882 30.0359 176.9091 27 K 4.1635 8.0333 119.6223 59.2509 31.9724 179.2619 28 Q 4.3724 7.6117 118.6048 58.4013 28.4084 178.5388 29 I 3.8196 7.7127 120.0225 63.9927 37.1361 177.0865 30 H 4.8835 7.5186 114.0152 55.7537 29.3422 175.2164 31 T 4.7999 8.1799 110.6082 61.3303 70.8066 173.4556 32 T 4.8254 8.0151 118.8532 61.7908 70.8685 173.5842 33 I 4.1876 8.3492 126.4714 59.2886 40.3157 174.4639 34 F 5.0929 8.6231 123.9926 55.7169 41.1076 174.8581 35 V 4.1743 8.8374 125.0814 61.6121 32.2486 175.8120 36 K 4.5383 8.6085 127.4220 55.0391 33.5714 177.9339 37 S 4.1956 8.6811 117.4476 62.0289 62.9007 176.4452 38 T 4.0299 7.8294 109.1185 64.1967 68.9678 175.1012 39 T 3.8457 7.3183 119.1679 63.5448 68.8715 172.8489 40 P 4.6045 0.0000 0.0000 61.8650 33.6233 176.8558 41 Y 4.0393 8.4961 120.4424 61.2095 38.8594 178.7650 42 V 3.5330 7.8665 118.6516 65.7844 31.8407 177.4687 43 S 4.0980 8.2058 112.3863 61.5611 62.1368 176.0421 44 A 3.9979 7.8155 122.9869 54.8341 18.0100 179.4456 45 L 3.9787 7.6240 117.5176 58.0405 41.7414 179.6507 46 K 3.8959 8.4050 118.5871 59.7929 32.1877 179.3575 47 R 4.0309 7.9412 118.2717 59.4180 29.9198 178.6763 48 I 3.6318 7.9234 119.6107 64.3457 37.2210 177.7552 49 N 4.4535 8.5694 117.6702 56.7989 38.5766 177.4274 50 K 4.0041 8.1886 119.3344 59.7024 32.2612 179.4823 51 F 3.9497 8.3503 117.6631 60.2392 38.5420 177.7755 52 L 4.0176 8.0289 118.3743 57.9740 41.4473 178.9838 53 D 4.5891 8.1264 118.5438 57.1157 40.5876 178.3132 54 S 4.1207 8.0456 112.8285 59.9268 62.4832 176.0614 55 V 3.6570 7.5875 121.0993 64.4620 30.9691 178.0172 56 H 4.1461 7.2893 116.8868 58.9630 28.6341 177.4447 57 K 4.1342 7.9006 118.5705 59.4752 32.0473 179.0618 58 Q 4.0981 7.5806 117.4542 56.4208 29.3220 176.0124 59 G 3.6774 8.3508 106.8872 46.2313 0.0000 173.1315 60 S 4.5490 7.3419 110.3363 56.1381 66.1898 173.5206 61 S 4.5232 8.3565 121.3047 60.6971 63.8116 173.4422 62 Y 4.9512 6.8751 115.4000 54.8465 41.4079 175.3367 63 V 4.3473 8.7064 120.8520 61.0615 33.4981 174.6164 64 A 4.5487 8.5220 131.0668 51.7407 19.6775 175.9902 65 V 4.4448 8.8329 123.3963 61.0622 34.1282 174.2040 66 L 5.0980 8.5799 128.6730 53.1936 44.6552 176.0102 67 G 4.5194 8.0463 108.3316 44.6579 0.0000 174.0625 *69 G 4.2851 8.5095 108.2831 44.4102 0.0000 175.9332 70 K 3.7444 9.1484 124.7982 59.1732 31.8617 176.9279 71 A 4.2754 7.9088 119.4937 53.1188 19.4095 178.9341 72 V 3.5869 8.0056 116.4023 66.0650 31.3702 177.4704 73 E 3.9337 8.1685 118.1282 59.3145 29.5350 178.5714 74 K 4.0278 8.0313 119.0351 59.7239 31.8271 178.5255 75 T 3.8744 8.1526 116.2087 66.9222 68.4467 176.5645 76 L 4.0802 8.1548 120.4307 57.6293 41.4939 179.3136 77 A 4.1437 8.4162 121.1745 55.1136 18.3639 179.7955 78 L 4.2475 8.2471 117.8080 58.0624 41.8506 179.8295 79 G 3.8135 8.0425 105.5005 48.0826 0.0000 175.4831 80 C 4.3105 8.2792 118.9635 62.6881 28.1062 175.6258 81 H 4.1697 8.1169 120.1389 59.4684 29.4996 177.4841 82 F 4.0233 8.4043 119.2771 60.4057 38.7388 177.6032 83 Q 4.4383 8.1800 120.2442 58.6163 28.3461 177.0355 84 D 4.6258 7.9633 118.7566 56.6813 41.4074 178.6749 85 Q 4.2346 8.0543 118.2593 57.4781 28.8772 177.1621 86 K 4.4476 7.3702 117.0532 55.0550 34.0047 175.9873 87 N 4.2966 7.4189 113.2283 53.0772 36.5974 174.1075 88 K 4.6914 8.1337 117.4548 54.9756 35.5887 177.6386 89 K 4.6857 8.6128 122.7875 55.4500 33.3690 175.5853 90 I 5.1426 8.3650 118.7285 59.1512 40.2557 174.8172 91 E 4.5841 8.9546 124.8818 55.0585 31.8932 175.1972 92 V 4.8024 7.8849 121.6510 61.4472 34.2819 174.0981 93 Y 4.8804 9.3710 125.7996 56.3149 41.3915 174.5695 94 T 4.8880 8.5553 112.6871 60.2186 70.8340 173.9719 95 K 4.7977 9.3884 124.1895 54.8468 36.3844 174.9748 96 T 5.0252 8.5295 118.9735 61.8842 70.9621 173.6433 97 I 4.5680 8.8915 126.9793 59.4298 40.3388 174.5774 98 E 4.7065 8.8394 126.8162 55.9382 30.5495 176.2608 99 V 4.4718 9.1431 123.7322 61.1169 35.3679 173.9854 100 L 4.9869 8.5138 127.0072 53.8773 43.5052 175.2716 101 D 5.6127 9.1277 122.5560 52.3592 44.8899 174.5096 102 E 5.3459 9.2310 118.0653 53.6873 32.4840 176.4872 103 V 4.5800 8.3508 118.5234 59.8193 33.4916 175.4492 104 I 3.7852 7.8887 115.1828 61.0422 37.5754 177.4259 *125 Q 4.1139 8.7496 117.4508 55.5073 29.9648 172.5721 126 L 4.8464 8.5610 124.2921 53.3228 42.9690 175.7523 127 K 4.6302 8.8450 126.1043 54.3205 34.7138 175.5862 128 K 4.5267 8.5633 125.8527 56.5908 33.2591 176.3754 129 R 4.6995 8.9927 122.6479 54.9456 33.9706 173.2583 130 A 5.1812 8.6246 127.3974 50.4240 21.0290 176.2156 131 V 4.4864 8.8097 121.7477 61.1484 35.2819 174.3867 132 S 5.1203 8.7298 122.2636 57.7287 64.6231 173.7478 133 G 4.2013 9.0459 109.8710 45.3618 0.0000 170.7999 134 V 4.9688 8.9458 118.7972 61.0981 35.1890 174.5430 135 E 4.7218 8.9377 128.8976 54.7348 31.5640 174.2365 136 L 5.1064 8.8148 129.0744 53.3852 44.7623 175.0786 137 R 4.6983 8.6714 126.6351 55.3241 31.6441 175.8490 138 I 4.5339 8.4268 126.1568 59.8593 38.7954 174.9209 139 Y 4.7080 8.7207 125.7547 56.9866 38.9948 176.5808 140 V 3.8400 8.4051 115.3510 61.9067 31.5824 176.1984 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 14 R 8.24 4.30 0.00 1.79 2.03 0.00 3.24 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 15 V 7.95 3.68 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 0.77 0.00 0.00 0.93 0.00 0.00 16 T 7.82 4.79 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 1.22 0.00 0.00 17 K 8.41 4.95 0.00 1.79 1.86 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.71 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.28 1.42 7.81 18 H 9.03 4.58 0.00 3.18 3.27 0.00 5.65 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.56 0.00 2.10 2.03 0.00 3.77 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 1.95 1.90 0.00 20 S 8.13 4.36 0.00 4.00 3.90 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 21 L 8.30 4.08 0.00 1.65 1.64 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.25 4.48 0.00 1.65 1.79 0.00 1.42 0.00 0.00 1.06 0.00 0.00 2.13 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.33 1.51 7.81 23 T 8.17 4.30 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 24 L 7.71 4.93 0.00 1.65 1.60 1.14 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.03 4.42 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 1.22 0.00 0.00 26 H 8.71 4.13 0.00 3.19 3.41 0.00 5.73 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.03 4.16 0.00 1.84 1.82 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.56 1.57 7.81 28 Q 7.61 4.37 0.00 2.42 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.25 0.00 29 I 7.71 3.82 1.95 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 1.55 0.62 0.83 0.00 0.00 30 H 7.52 4.88 0.00 3.32 3.22 0.00 5.59 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 T 8.18 4.80 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 1.15 0.00 0.00 32 T 8.02 4.83 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 0.54 0.00 0.00 33 I 8.35 4.19 1.45 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 0.19 -0.36 0.70 0.00 0.00 34 F 8.62 5.09 0.00 2.85 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 35 V 8.84 4.17 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 0.77 0.00 0.00 0.88 0.00 0.00 36 K 8.61 4.54 0.00 1.90 1.71 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.42 7.81 37 S 8.68 4.20 0.00 3.87 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 38 T 7.83 4.03 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 39 T 7.32 3.85 4.35 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 1.22 0.00 0.00 40 P 0.00 4.60 0.00 2.20 2.00 0.00 3.62 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 41 Y 8.50 4.04 0.00 3.05 2.98 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 42 V 7.87 3.53 2.12 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 1.00 0.00 0.00 1.05 0.00 0.00 43 S 8.21 4.10 0.00 3.94 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 44 A 7.82 4.00 1.30 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 0.00 0.00 45 L 7.62 3.98 0.00 1.81 1.64 0.68 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.41 3.90 0.00 1.92 1.91 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.62 7.81 47 R 7.94 4.03 0.00 2.11 1.93 0.00 3.07 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.84 0.00 48 I 7.92 3.63 1.96 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.52 0.26 0.00 0.00 49 N 8.57 4.45 0.00 3.02 2.99 0.00 0.00 7.08 7.76 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 50 K 8.19 4.00 0.00 2.02 1.85 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.80 1.68 7.81 51 F 8.35 3.95 0.00 3.24 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 52 L 8.03 4.02 0.00 1.87 1.79 1.14 1.29 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 53 D 8.13 4.59 0.00 2.74 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 54 S 8.05 4.12 0.00 3.82 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 55 V 7.59 3.66 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 0.68 0.00 0.00 0.85 0.00 0.00 56 H 7.29 4.15 0.00 3.05 3.38 0.00 5.66 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 57 K 7.90 4.13 0.00 1.77 1.83 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.51 7.81 58 Q 7.58 4.10 0.00 1.93 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.30 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 59 G 8.35 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 60 S 7.34 4.55 0.00 3.53 3.40 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 61 S 8.36 4.52 0.00 3.97 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 0.00 62 Y 6.88 4.95 0.00 2.44 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 63 V 8.71 4.35 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 0.80 0.00 0.00 0.93 0.00 0.00 64 A 8.52 4.55 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 65 V 8.83 4.44 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 0.91 0.00 0.00 0.68 0.00 0.00 66 L 8.58 5.10 0.00 1.15 1.48 0.62 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.05 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 0.00 0.00 0.00 0.00 *69 G 8.51 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 0.00 0.00 0.00 0.00 70 K 9.15 3.74 0.00 1.73 1.90 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.48 7.81 71 A 7.91 4.28 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 72 V 8.01 3.59 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 1.00 0.00 0.00 0.98 0.00 0.00 73 E 8.17 3.93 0.00 2.09 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 2.40 2.39 0.00 74 K 8.03 4.03 0.00 1.92 1.99 0.00 1.97 0.00 0.00 1.90 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.62 1.73 7.81 75 T 8.15 3.87 4.41 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 1.20 0.00 0.00 76 L 8.15 4.08 0.00 1.89 1.75 0.94 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.42 4.14 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.25 4.25 0.00 1.99 1.82 0.93 0.43 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 79 G 8.04 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 C 8.28 4.31 0.00 3.29 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 81 H 8.12 4.17 0.00 3.31 3.61 0.00 5.58 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 82 F 8.40 4.02 0.00 3.25 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 83 Q 8.18 4.44 0.00 2.36 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.66 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 84 D 7.96 4.63 0.00 2.92 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 85 Q 8.05 4.23 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 7.21 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 86 K 7.37 4.45 0.00 1.65 1.74 0.00 1.29 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.22 1.13 7.81 87 N 7.42 4.30 0.00 2.82 2.85 0.00 0.00 6.90 7.49 0.00 0.00 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 K 8.13 4.69 0.00 1.88 1.98 0.00 1.97 0.00 0.00 1.76 0.00 0.00 3.33 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.85 1.86 7.81 89 K 8.61 4.69 0.00 1.65 1.65 0.00 1.60 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.45 7.81 90 I 8.37 5.14 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.69 1.00 0.00 0.00 91 E 8.95 4.58 0.00 2.15 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 2.18 2.23 0.00 92 V 7.88 4.80 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 0.80 0.00 0.00 0.91 0.00 0.00 93 Y 9.37 4.88 0.00 2.89 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 94 T 8.56 4.89 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 95 K 9.39 4.80 0.00 1.64 1.71 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.38 1.53 7.81 96 T 8.53 5.03 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 97 I 8.89 4.57 1.89 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 1.27 0.77 0.93 0.00 0.00 98 E 8.84 4.71 0.00 1.85 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 2.30 2.31 0.00 99 V 9.14 4.47 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 1.12 0.00 0.00 0.94 0.00 0.00 100 L 8.51 4.99 0.00 1.58 1.48 0.87 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 101 D 9.13 5.61 0.00 2.58 2.52 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 0.00 102 E 9.23 5.35 0.00 2.02 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 2.08 0.00 103 V 8.35 4.58 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.93 0.00 0.00 104 I 7.89 3.79 1.96 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 1.41 0.81 0.91 0.00 0.00 *125 Q 8.75 4.11 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 126 L 8.56 4.85 0.00 1.49 1.57 0.83 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 127 K 8.84 4.63 0.00 1.79 1.62 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.38 7.81 128 K 8.56 4.53 0.00 1.68 1.72 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.43 1.43 7.81 129 R 8.99 4.70 0.00 1.84 1.82 0.00 3.07 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 130 A 8.62 5.18 1.22 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 0.00 0.00 131 V 8.81 4.49 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 0.90 0.00 0.00 0.94 0.00 0.00 132 S 8.73 5.12 0.00 3.80 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.05 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 0.00 0.00 0.00 0.00 134 V 8.95 4.97 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 1.01 0.00 0.00 0.95 0.00 0.00 135 E 8.94 4.72 0.00 2.07 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 2.14 2.13 0.00 136 L 8.81 5.11 0.00 1.71 1.61 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 137 R 8.67 4.70 0.00 1.85 1.46 0.00 3.03 0.00 0.00 2.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.41 0.00 138 I 8.43 4.53 1.68 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.48 0.83 0.00 0.00 139 Y 8.72 4.71 0.00 3.10 2.98 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 0.00 140 V 8.41 3.84 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 0.58 0.00 0.00 1.07 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.