NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 V 4.1410 8.0129 120.6568 62.8826 32.2004 173.8287 16 S 4.9655 8.2665 122.6434 55.5856 65.4948 171.2724 17 L 4.7803 8.5327 124.4770 53.0924 45.7864 175.0611 18 I 4.3574 8.6457 120.4693 61.1132 38.3916 174.9098 19 W 5.1414 9.5850 134.3918 55.9173 34.7238 173.7202 20 G 3.6171 6.6704 107.4608 45.7713 0.0000 172.2501 21 C 4.2756 7.4239 115.1780 56.2015 33.4577 172.1454 22 E 5.0592 8.3641 120.2090 54.3771 31.7654 174.8459 23 L 5.1656 8.7119 126.3655 53.2851 45.3336 175.2028 24 N 4.9605 8.5964 118.7837 51.9664 40.2020 173.7979 25 E 3.9857 9.2301 122.6845 60.1182 29.5074 178.6810 26 Q 4.3397 8.0612 114.5236 56.3709 29.2242 177.4824 27 N 5.1393 8.6038 113.6162 51.9090 39.1122 174.9752 28 K 4.3577 8.0670 119.8282 58.4962 33.6673 177.3004 29 T 5.3404 7.8882 115.4155 61.7211 72.3232 173.2979 30 F 4.7915 9.3084 126.1901 56.7486 43.1242 172.5596 31 E 5.0638 8.0928 126.5337 54.4965 32.0259 175.2352 32 F 4.9351 9.9235 132.8925 57.7024 40.0138 174.7634 33 K 4.3346 8.3159 131.8906 53.7161 32.4981 173.9608 *42 E 4.1298 8.4331 121.7697 55.1917 31.3124 171.9863 43 H 5.3048 8.5287 117.3988 54.5982 30.9678 174.3781 44 Q 4.8405 8.9060 121.6401 54.4449 33.2289 173.1776 45 L 4.7941 9.1728 127.6806 53.1762 44.6627 174.6419 46 A 5.0787 8.6569 129.3708 50.2769 20.6954 176.0340 47 L 4.5474 8.5670 123.4164 55.2607 42.4665 176.4389 48 R 4.6548 9.2678 119.7277 57.6098 32.8958 175.7619 49 T 5.1774 8.0098 107.0870 60.2596 72.9846 172.4033 50 V 5.0492 8.7058 121.9886 61.3811 34.8802 174.0154 51 C 5.2138 9.0237 121.1123 57.0650 33.2363 173.0776 52 L 4.7208 8.5019 120.8325 53.6303 42.9751 177.0078 53 G 4.1123 8.5505 109.3088 45.8709 0.0000 174.6957 54 D 4.5914 8.9155 120.4239 55.1108 39.6644 177.1693 55 K 4.3399 7.8310 117.4137 55.8699 32.6233 176.2952 56 A 4.6458 7.4492 122.5485 50.9568 18.8150 177.8453 57 K 3.8948 8.1665 123.1548 57.0474 32.9516 177.5889 58 D 4.8291 8.3708 126.5456 53.4497 38.4596 173.7068 59 E 4.5908 7.6367 120.0163 54.1713 34.3135 175.2892 60 F 4.7169 8.5273 118.7660 57.9342 39.8552 174.8539 61 H 5.1196 9.9791 120.8841 54.0522 31.9983 172.9672 62 I 5.2482 8.7218 123.3511 59.4609 40.7214 174.6035 63 V 5.0687 8.6354 127.0406 59.8734 33.9427 174.6772 64 E 5.2357 9.2866 121.2406 54.7290 33.5461 174.2300 65 I 4.7952 8.4998 121.8044 59.9879 39.6277 174.7951 66 V 4.9279 8.8309 126.8290 61.3065 34.1294 174.4355 67 T 4.9472 9.1385 119.6006 60.6547 72.4242 173.5253 68 Q 4.7213 8.4586 120.5629 53.2100 31.6476 175.0557 *73 E 4.1950 8.5251 122.1311 56.9815 30.7805 176.3980 74 K 4.4195 8.2661 116.8155 55.1261 35.5785 170.6395 75 S 5.1687 8.6888 121.3933 56.1133 65.1407 174.1022 76 V 4.3115 9.0504 123.6977 60.1979 33.7720 172.7425 77 P 4.8894 0.0000 0.0000 63.0195 31.2739 176.4632 78 I 4.6314 8.6672 116.0543 60.6417 39.4876 175.3723 79 A 4.6667 7.6550 123.0473 51.2881 22.5947 175.2368 80 T 4.9712 8.6030 117.3745 61.9619 71.4844 173.3192 81 L 5.0985 9.1475 126.1139 53.0942 46.5215 175.8502 82 K 4.5757 8.8746 119.5322 56.3598 35.4657 174.0772 83 P 4.1330 0.0000 0.0000 65.8969 31.2710 177.4574 84 S 4.4151 7.8071 108.8371 59.1124 63.6147 173.9627 85 I 4.2358 7.4980 119.3720 62.4490 39.1073 176.4229 86 L 4.4494 8.3608 127.9983 53.1125 42.8395 174.0717 87 P 4.3955 0.0000 0.0000 64.6896 31.7356 175.8312 88 M 5.2342 7.5464 114.3968 54.8516 34.2568 173.5350 89 A 4.7049 9.0508 119.8609 50.9787 23.2344 175.3854 90 T 4.7677 8.4618 118.1749 62.7635 69.6653 174.3525 91 M 4.4900 9.0486 127.4180 54.3357 33.0075 176.2462 92 V 4.2701 7.9442 121.8339 62.0987 34.5613 175.5832 93 G 3.9137 8.8618 113.6511 46.4878 0.0000 173.2480 94 I 4.2961 7.1420 122.0129 59.7134 38.1278 174.3513 95 E 5.1440 8.6751 126.5426 54.3308 31.9544 175.7357 96 L 4.8604 9.0348 124.2512 53.1967 45.5232 175.5067 97 T 5.1299 8.3608 118.9354 61.2367 69.6175 173.0931 98 P 4.6235 0.0000 0.0000 62.3702 32.0114 174.1403 99 P 5.3372 0.0000 0.0000 61.9908 32.8523 175.6943 100 V 4.4633 8.1949 113.5493 60.1065 36.3417 174.0420 101 T 4.9802 8.0085 120.4101 61.7937 71.4416 173.1196 102 F 5.3799 9.4307 125.1731 55.8397 41.4753 174.6638 103 R 5.1167 9.3282 124.2663 54.5221 33.1690 174.5225 104 L 4.6861 9.1323 129.3324 53.8558 40.5334 175.7550 105 K 4.2390 8.9880 127.1776 58.9770 33.0079 176.3076 106 A 4.5881 8.0549 119.1317 51.4770 22.6463 176.5187 107 G 3.8585 8.8916 106.7458 45.3198 0.0000 174.3708 108 S 4.0597 8.7143 116.2037 58.8916 63.8846 175.5680 109 G 3.7287 8.3150 108.7843 43.3179 0.0000 170.0960 110 P 4.6730 0.0000 0.0000 62.5759 32.8390 175.1013 111 L 4.7202 8.6295 123.8547 53.4848 45.0790 174.6070 112 Y 5.2105 8.8832 123.8462 56.4345 40.9419 174.6909 113 I 5.0688 8.3746 123.1303 59.4966 40.6396 174.7984 114 S 5.1081 8.8497 121.7267 56.9107 66.4424 173.2039 115 G 4.4335 8.5014 107.0080 46.4350 0.0000 171.7854 116 Q 5.0773 9.0195 118.9333 54.2982 31.7000 174.8392 117 H 5.0406 9.5455 125.8745 55.1861 31.3001 174.4256 118 V 4.9502 8.4637 118.7817 60.0035 35.4349 176.0633 119 A 4.5617 8.4947 122.7820 53.4118 18.9591 176.3978 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 15 V 8.01 4.14 2.42 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 0.98 0.00 0.00 0.93 0.00 0.00 16 S 8.27 4.97 0.00 3.49 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 17 L 8.53 4.78 0.00 1.82 1.73 0.98 1.04 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 18 I 8.65 4.36 1.91 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 1.26 0.73 0.94 0.00 0.00 19 W 9.59 5.14 0.00 3.38 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 20 G 6.67 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 21 C 7.42 4.28 0.00 1.53 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 22 E 8.36 5.06 0.00 2.09 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 2.09 2.01 0.00 23 L 8.71 5.17 0.00 1.53 1.53 1.03 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.60 4.96 0.00 2.76 2.71 0.00 0.00 6.86 7.78 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 25 E 9.23 3.99 0.00 2.09 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 2.33 2.28 0.00 26 Q 8.06 4.34 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 7.08 0.00 0.00 0.00 0.00 0.00 2.25 1.94 0.00 27 N 8.60 5.14 0.00 2.78 2.79 0.00 0.00 6.84 6.80 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 28 K 8.07 4.36 0.00 1.75 1.90 0.00 1.62 0.00 0.00 1.84 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.64 1.59 7.81 29 T 7.89 5.34 4.30 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 1.27 0.00 0.00 30 F 9.31 4.79 0.00 3.29 3.15 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 31 E 8.09 5.06 0.00 1.92 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 2.09 2.39 0.00 32 F 9.92 4.94 0.00 3.36 3.15 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 33 K 8.32 4.33 0.00 1.56 1.61 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.26 0.98 7.81 *42 E 8.43 4.13 0.00 1.91 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 2.21 1.91 0.00 43 H 8.53 5.30 0.00 3.05 3.49 0.00 5.82 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 Q 8.91 4.84 0.00 2.14 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 45 L 9.17 4.79 0.00 0.59 0.89 -0.98 0.21 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 46 A 8.66 5.08 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 47 L 8.57 4.55 0.00 1.57 1.62 1.04 0.66 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 48 R 9.27 4.65 0.00 1.70 1.91 0.00 3.27 0.00 0.00 3.23 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.69 0.00 49 T 8.01 5.18 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 1.21 0.00 0.00 50 V 8.71 5.05 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 1.09 0.00 0.00 0.92 0.00 0.00 51 C 9.02 5.21 0.00 3.04 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 52 L 8.50 4.72 0.00 1.48 1.47 0.79 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 53 G 8.55 4.11 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 0.00 54 D 8.92 4.59 0.00 2.80 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 55 K 7.83 4.34 0.00 1.76 1.86 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.36 7.81 56 A 7.45 4.65 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 57 K 8.17 3.89 0.00 1.77 1.86 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.38 7.81 58 D 8.37 4.83 0.00 2.69 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 59 E 7.64 4.59 0.00 1.99 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 2.32 2.24 0.00 60 F 8.53 4.72 0.00 3.00 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 61 H 9.98 5.12 0.00 3.07 3.20 0.00 5.75 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 I 8.72 5.25 1.91 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 1.32 0.81 0.97 0.00 0.00 63 V 8.64 5.07 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 0.81 0.00 0.00 1.08 0.00 0.00 64 E 9.29 5.24 0.00 2.05 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 0.00 2.43 2.31 0.00 65 I 8.50 4.80 1.88 0.00 0.00 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 1.10 1.10 0.77 0.00 0.00 66 V 8.83 4.93 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 1.03 0.00 0.00 0.95 0.00 0.00 67 T 9.14 4.95 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 1.17 0.00 0.00 68 Q 8.46 4.72 0.00 2.04 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.61 0.00 0.00 0.00 0.00 0.00 2.16 1.90 0.00 *73 E 8.53 4.19 0.00 1.97 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 2.20 2.31 0.00 74 K 8.27 4.42 0.00 1.39 1.65 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.16 1.14 7.81 75 S 8.69 5.17 0.00 4.03 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 76 V 9.05 4.31 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 1.06 0.00 0.00 0.94 0.00 0.00 77 P 0.00 4.89 0.00 1.99 2.00 0.00 3.68 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 78 I 8.67 4.63 1.93 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.75 1.05 0.00 0.00 79 A 7.65 4.67 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 80 T 8.60 4.97 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 1.26 0.00 0.00 81 L 9.15 5.10 0.00 1.52 1.65 0.96 0.67 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 82 K 8.87 4.58 0.00 1.49 1.44 0.00 0.61 0.00 0.00 1.02 0.00 0.00 2.67 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.08 0.99 7.81 83 P 0.00 4.13 0.00 2.16 2.09 0.00 3.63 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 2.17 2.03 0.00 84 S 7.81 4.42 0.00 3.89 4.03 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 85 I 7.50 4.24 1.88 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 1.16 0.87 0.98 0.00 0.00 86 L 8.36 4.45 0.00 1.61 1.54 0.97 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.40 0.00 2.25 2.27 0.00 3.78 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.94 0.00 88 M 7.55 5.23 0.00 2.01 2.16 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 2.48 2.54 0.00 89 A 9.05 4.70 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 90 T 8.46 4.77 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 1.27 0.00 0.00 91 M 9.05 4.49 0.00 1.87 1.90 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.64 0.00 92 V 7.94 4.27 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 1.02 0.00 0.00 0.94 0.00 0.00 93 G 8.86 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 I 7.14 4.30 1.89 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 1.25 0.90 0.95 0.00 0.00 95 E 8.68 5.14 0.00 1.80 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 2.18 2.28 0.00 96 L 9.03 4.86 0.00 1.45 1.52 1.00 0.54 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 97 T 8.36 5.13 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 1.24 0.00 0.00 98 P 0.00 4.62 0.00 1.62 0.87 0.00 4.05 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.84 0.00 99 P 0.00 5.34 0.00 2.16 1.95 0.00 3.01 0.00 0.00 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.87 0.00 100 V 8.19 4.46 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 1.13 0.00 0.00 101 T 8.01 4.98 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 1.24 0.00 0.00 102 F 9.43 5.38 0.00 3.26 3.07 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 0.00 103 R 9.33 5.12 0.00 1.87 1.79 0.00 3.11 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 104 L 9.13 4.69 0.00 1.67 1.63 1.04 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.99 4.24 0.00 1.85 1.95 0.00 1.98 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.43 7.81 106 A 8.05 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 G 8.89 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 0.00 0.00 0.00 108 S 8.71 4.06 0.00 4.03 4.23 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 0.00 109 G 8.31 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.67 0.00 1.43 2.23 0.00 3.56 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 1.87 1.90 0.00 111 L 8.63 4.72 0.00 1.56 1.40 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 112 Y 8.88 5.21 0.00 2.88 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 0.00 113 I 8.37 5.07 1.52 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.70 0.79 0.00 0.00 114 S 8.85 5.11 0.00 3.80 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 0.00 115 G 8.50 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 9.02 5.08 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.78 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 117 H 9.55 5.04 0.00 3.11 3.44 0.00 5.73 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.46 4.95 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 0.86 0.00 0.00 0.92 0.00 0.00 119 A 8.49 4.56 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.