NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8284 8.1676 115.8738 56.5562 40.6290 178.9680 11 H 3.9986 5.2900 121.1139 54.5229 28.5533 170.7474 12 E 4.3964 9.5790 123.9862 57.8287 29.8695 177.1840 13 M 4.5392 7.1318 113.7996 55.0798 32.0291 176.6696 14 R 4.5944 7.6907 115.6867 55.1508 32.6022 175.0431 15 E 4.1606 8.0322 117.6502 54.7950 30.4586 174.3639 16 P 4.1981 0.0000 0.0000 62.0070 32.4853 174.9926 17 R 4.2337 7.1356 113.7790 55.7578 32.8684 173.6175 18 I 4.2967 8.5744 121.6364 60.6782 38.4953 175.1940 19 E 4.4835 8.4954 127.5274 54.5023 31.4534 171.5688 20 K 4.6270 8.7591 132.6040 55.5053 34.1676 174.8882 21 V 4.5896 7.7625 119.6321 60.0623 34.7003 174.0702 22 V 4.4092 8.2111 128.9790 61.9650 32.9325 174.9579 23 V 4.9144 8.5010 122.7788 59.3211 33.2558 174.3068 24 H 5.0898 8.5311 125.0352 54.4292 33.4233 172.2312 25 M 4.0921 8.5972 124.5312 53.3758 33.4002 175.1586 26 G 4.0875 8.0135 112.3743 46.0952 0.0000 171.7113 27 I 4.1645 7.6363 126.7121 60.3168 39.7462 176.3141 28 G 4.0724 7.6759 112.2313 45.5315 0.0000 172.5193 29 H 4.4371 7.8493 117.1221 55.4814 30.7572 173.9911 *35 A 4.2483 7.1016 122.9631 51.9858 18.9454 176.3226 36 N 4.2240 8.8857 110.5042 56.4534 36.7491 176.7167 37 A 3.7335 7.9974 122.5085 54.6241 18.4113 178.8784 38 E 3.8761 8.3409 117.9260 59.9706 29.4445 178.9427 39 D 4.4214 7.5514 118.4841 57.7106 40.8942 179.4906 40 I 3.7227 7.7257 112.5283 64.0783 37.6988 177.8761 41 L 4.0778 7.7950 121.0691 57.4820 41.4873 179.5817 42 G 3.7388 8.5287 105.9607 47.8779 0.0000 175.5430 43 E 4.0114 7.7530 119.7645 59.1866 29.8578 178.7962 44 I 3.8769 8.0476 117.6602 63.3614 37.9235 176.3787 45 T 4.6520 7.6206 107.5108 64.3597 70.2040 174.9528 46 G 4.0922 7.4340 108.5799 44.3419 0.0000 173.1854 47 Q 4.5818 7.7149 115.5881 54.4294 31.1378 173.9541 48 M 3.8912 8.5635 118.5995 56.0060 32.3615 174.9063 49 P 4.8415 0.0000 0.0000 61.7391 33.5906 175.0686 50 V 4.5210 8.4876 119.4451 60.9905 34.8408 175.2104 51 R 4.3958 8.7012 125.0896 56.9388 31.2064 176.8160 52 T 4.4841 8.8037 119.1586 61.4226 69.9575 173.9954 53 K 5.2737 8.7466 124.8266 55.7134 33.3406 175.4603 54 A 4.8896 8.7522 122.6654 50.2234 22.2168 175.6914 55 K 4.5035 8.3606 117.3576 55.5868 35.1149 175.0251 56 R 4.1839 8.4692 122.7317 56.3046 29.6562 175.9757 57 T 4.5103 8.2627 117.4113 62.6188 69.7241 174.5191 58 V 4.5630 8.9278 125.2464 60.6011 35.1520 176.0369 59 G 3.7571 8.8786 112.2885 48.6784 0.0000 175.3564 60 E 4.2433 8.1445 118.7380 58.5859 28.0387 176.2330 61 F 4.1739 7.6702 112.7559 60.6071 38.8884 174.9644 62 D 4.9549 7.8852 117.4634 51.9579 40.5676 175.3267 63 I 4.2289 7.6642 114.3846 61.3217 39.4325 177.4883 64 R 3.8210 7.9537 121.3213 56.4515 29.4409 174.8990 65 E 3.9719 8.2217 128.4548 58.4473 30.3691 176.1246 66 G 3.9144 7.8207 111.0905 46.4645 0.0000 171.8255 67 D 4.5335 8.2858 121.6261 51.5185 42.3813 173.6013 68 P 4.5379 0.0000 0.0000 62.5798 31.0430 176.5307 69 I 4.6008 9.1596 126.8917 60.0229 39.1651 174.6292 70 G 4.3114 8.0028 105.8761 44.0921 0.0000 172.5534 71 A 5.8868 8.2999 120.7747 49.4044 23.3665 174.6307 72 K 5.1716 8.1760 116.1353 56.1576 36.5622 175.3032 73 V 4.5851 8.0883 119.9530 61.7137 35.0443 173.2257 74 T 4.5970 8.5684 118.5669 60.2022 69.8048 173.4298 75 L 4.6327 8.1808 126.9784 53.3866 43.6543 176.2852 76 R 4.6818 8.0056 120.7098 54.3017 34.2302 176.4333 77 D 4.2920 8.9473 120.9830 55.6843 39.5834 176.0557 78 E 3.9304 9.0801 125.9541 61.0694 28.7992 178.1475 79 M 3.8877 8.2471 117.7715 58.6519 31.9536 178.8475 80 A 3.9075 7.8169 120.0200 55.4283 18.8317 178.9672 81 E 3.9207 8.1483 116.9936 59.6582 29.4179 179.3463 82 E 4.1152 8.3554 118.7938 58.8275 30.0029 178.7710 83 F 4.4741 7.5707 120.1448 60.4410 40.0662 177.5070 84 L 4.2241 8.5512 118.8664 57.8529 41.0794 179.4847 85 Q 4.1881 8.1203 113.9704 56.7203 28.2673 176.2766 86 T 4.5258 7.9374 109.7855 62.6705 74.5739 174.4612 87 A 3.9637 7.4077 126.2279 53.9028 19.1814 179.2876 88 L 3.5879 7.9493 113.4609 57.2491 42.2346 178.1452 89 P 4.1335 0.0000 0.0000 65.8921 31.2307 177.4369 90 L 4.1952 8.2430 115.0075 55.4383 41.6866 176.3834 91 A 4.8707 8.1969 121.7885 50.4007 21.6214 174.8221 92 E 4.4424 8.0317 115.6821 58.6292 31.9239 176.4125 93 L 3.6740 6.5663 116.7709 51.8877 43.9428 175.7107 94 A 4.4924 8.5557 122.5143 52.5049 21.5061 174.3832 95 T 3.1729 8.6771 112.5002 62.4803 69.7340 173.7115 96 S 3.8686 8.7042 120.7089 60.4278 63.1310 173.3820 97 Q 4.2658 7.9191 119.7625 55.8484 28.6689 174.4803 98 F 5.1259 7.8785 114.0192 54.8061 41.9766 175.0846 99 D 4.6584 10.2255 122.6256 54.3451 41.5977 176.8384 100 D 4.6986 8.6012 121.4479 55.9063 41.2054 177.3650 101 T 4.5065 7.8802 114.9696 63.0412 68.7633 174.5852 102 G 3.9454 8.0807 108.6737 46.6111 0.0000 173.1749 103 N 5.4494 7.8334 116.2146 51.3850 42.6769 173.2990 104 F 4.7409 7.7320 110.4000 56.1817 41.2702 173.0949 105 S 5.0926 8.2236 116.0276 56.5257 65.0649 172.8859 106 F 4.9454 8.8722 120.9059 55.2728 41.5491 173.0036 107 G 4.2645 8.9579 102.2211 44.5255 0.0000 173.4260 *128 L 4.0125 8.4783 123.3353 55.1370 43.6122 176.2234 129 D 4.8181 8.4183 125.4583 53.0750 43.8722 176.3316 130 V 4.2642 7.8794 120.9943 62.2193 34.2043 173.6823 131 T 4.6946 8.5044 125.2682 61.8171 71.1456 174.5336 132 V 4.2614 7.8089 123.6148 61.0805 34.4556 173.6720 133 N 4.8521 8.5316 128.1690 52.6730 40.0467 173.7151 134 L 5.3585 8.1117 125.7402 53.2192 44.6380 175.7383 135 V 4.1976 7.8382 120.5864 61.2483 34.8726 171.5864 136 R 4.5742 8.2243 117.0409 54.9852 31.2831 177.1317 137 P 4.0835 0.0000 0.0000 65.4437 31.5334 177.1752 138 G 4.1416 7.8564 105.6606 45.9353 0.0000 175.4302 139 Y 4.3170 8.1994 123.8391 60.0030 39.3402 177.3560 140 R 4.0086 8.2952 119.3943 59.5060 29.9281 178.0219 141 V 3.4990 7.4592 116.6431 65.7244 31.1879 176.9224 142 A 4.8036 7.8334 118.7342 51.3994 19.1161 177.4014 143 K 4.2623 7.7337 115.6694 55.6414 33.9145 176.5553 144 R 4.2851 7.5907 115.3400 55.5474 31.0068 175.9449 145 D 4.5178 8.4536 116.5482 56.5692 41.1207 177.5205 146 K 4.0543 7.8634 118.3375 57.1765 32.7563 176.8198 147 A 3.7663 8.8691 124.4455 52.7038 16.2892 176.8208 148 S 4.4755 7.0637 111.5875 60.8796 63.7196 173.4900 149 R 4.4883 8.1952 117.3495 55.4942 33.8075 173.5621 150 S 4.5747 8.6153 118.8505 57.6938 63.5106 173.7760 151 I 3.9335 8.3224 127.5226 60.3702 37.2491 174.2847 152 P 4.3645 0.0000 0.0000 62.8705 31.9094 177.3977 153 T 3.9121 8.6889 111.3428 64.8882 68.8530 176.6247 154 K 3.9267 8.1542 120.4865 59.7638 32.0871 177.4437 155 H 4.4458 7.8048 114.9041 57.0562 29.9095 175.3799 156 R 4.2403 7.3714 117.3539 56.2816 30.7419 175.4322 157 L 4.3638 8.1358 121.8730 54.2788 43.1972 176.7310 158 N 4.8098 8.3000 122.1796 51.6113 41.0545 174.3774 159 P 4.3244 0.0000 0.0000 66.1932 31.5810 178.4252 160 A 3.8795 8.0034 118.5633 55.5272 17.9514 179.1502 161 D 4.4223 8.1509 115.8271 56.7634 40.8802 179.0928 162 A 4.1392 7.9493 121.7662 55.0362 18.7246 179.3171 163 V 3.1683 7.8065 116.9355 66.3371 31.3314 177.6544 164 A 3.9247 7.7811 119.5790 55.2994 17.9684 178.8875 165 F 4.1469 7.7402 116.4248 61.8801 39.7675 177.4744 166 I 3.5724 7.9807 118.7890 64.3424 36.7858 177.8390 167 E 4.2244 8.3585 120.4242 58.4328 29.4459 177.6514 168 S 4.5369 8.0214 111.8962 57.9263 64.8212 174.9723 169 T 4.7752 7.8026 112.0358 62.6630 70.4794 173.3603 170 Y 3.4914 7.8701 113.4748 57.9184 35.0373 169.3331 171 D 4.4078 6.9376 117.2240 54.0211 43.5842 175.2054 172 V 4.5210 7.9361 117.0346 61.1815 35.7533 178.6324 173 E 4.3824 8.5303 122.3440 56.1940 28.7923 177.3279 174 V 4.1551 7.8275 116.7379 63.7113 31.7352 175.0479 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 10 F 8.17 4.83 0.00 3.34 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 11 H 5.29 4.00 0.00 3.12 2.48 0.00 5.62 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 9.58 4.40 0.00 1.66 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 2.07 2.17 0.00 13 M 7.13 4.54 0.00 2.16 2.17 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 2.53 2.57 0.00 14 R 7.69 4.59 0.00 1.78 1.95 0.00 3.41 0.00 0.00 3.39 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 15 E 8.03 4.16 0.00 2.17 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 0.00 2.35 2.30 0.00 16 P 0.00 4.20 0.00 0.76 1.45 0.00 3.67 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 17 R 7.14 4.23 0.00 1.76 1.83 0.00 2.75 0.00 0.00 3.13 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.42 0.00 18 I 8.57 4.30 1.99 0.00 0.00 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 1.45 0.92 0.97 0.00 0.00 19 E 8.50 4.48 0.00 1.88 1.74 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 2.22 2.25 0.00 20 K 8.76 4.63 0.00 2.10 1.98 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.32 7.81 21 V 7.76 4.59 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 1.32 0.00 0.00 0.96 0.00 0.00 22 V 8.21 4.41 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 0.84 0.00 0.00 0.85 0.00 0.00 23 V 8.50 4.91 1.92 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 0.59 0.00 0.00 0.69 0.00 0.00 24 H 8.53 5.09 0.00 3.17 3.00 0.00 5.62 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 8.60 4.09 0.00 1.90 1.89 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 26 G 8.01 4.09 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 0.00 0.00 0.00 27 I 7.64 4.16 1.78 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 1.11 0.72 0.75 0.00 0.00 28 G 7.68 4.07 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 0.00 0.00 0.00 29 H 7.85 4.44 0.00 3.14 3.33 0.00 5.76 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 *35 A 7.10 4.25 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 36 N 8.89 4.22 0.00 2.92 3.12 0.00 0.00 5.88 7.46 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 37 A 8.00 3.73 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 38 E 8.34 3.88 0.00 2.00 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 2.32 2.49 0.00 39 D 7.55 4.42 0.00 2.61 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 40 I 7.73 3.72 1.88 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 1.82 1.17 0.92 0.00 0.00 41 L 7.80 4.08 0.00 1.82 1.73 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.53 3.74 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 43 E 7.75 4.01 0.00 1.92 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 2.49 0.00 44 I 8.05 3.88 1.96 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.82 1.12 0.00 0.00 45 T 7.62 4.65 4.14 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 0.95 0.00 0.00 46 G 7.43 4.09 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 0.00 0.00 0.00 47 Q 7.71 4.58 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 6.77 0.00 0.00 0.00 0.00 0.00 2.19 2.34 0.00 48 M 8.56 3.89 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.58 0.00 49 P 0.00 4.84 0.00 1.91 1.97 0.00 3.60 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 50 V 8.49 4.52 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 1.02 0.00 0.00 0.91 0.00 0.00 51 R 8.70 4.40 0.00 1.72 1.84 0.00 3.35 0.00 0.00 3.21 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 52 T 8.80 4.48 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 1.20 0.00 0.00 53 K 8.75 5.27 0.00 1.63 1.74 0.00 1.72 0.00 0.00 2.36 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.28 7.81 54 A 8.75 4.89 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 55 K 8.36 4.50 0.00 1.71 1.69 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.40 7.81 56 R 8.47 4.18 0.00 1.99 2.00 0.00 3.20 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 57 T 8.26 4.51 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 1.24 0.00 0.00 58 V 8.93 4.56 2.11 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 1.00 0.00 0.00 0.94 0.00 0.00 59 G 8.88 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 60 E 8.14 4.24 0.00 2.14 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 2.31 2.34 0.00 61 F 7.67 4.17 0.00 3.06 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 62 D 7.89 4.95 0.00 2.89 2.54 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 63 I 7.66 4.23 1.93 0.00 0.00 1.00 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 0.84 1.05 0.00 0.00 64 R 7.95 3.82 0.00 1.76 2.09 0.00 3.20 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 65 E 8.22 3.97 0.00 1.97 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 2.29 2.30 0.00 66 G 7.82 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 67 D 8.29 4.53 0.00 2.72 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 68 P 0.00 4.54 0.00 1.94 2.03 0.00 3.61 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 2.11 0.00 69 I 9.16 4.60 1.98 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 1.14 1.15 0.93 0.00 0.00 70 G 8.00 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 0.00 0.00 0.00 0.00 71 A 8.30 5.89 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 72 K 8.18 5.17 0.00 1.76 1.87 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.23 7.81 73 V 8.09 4.59 1.93 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 0.97 0.00 0.00 0.86 0.00 0.00 74 T 8.57 4.60 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 1.16 0.00 0.00 75 L 8.18 4.63 0.00 1.49 1.54 0.43 0.91 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 76 R 8.01 4.68 0.00 1.63 1.78 0.00 3.34 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 77 D 8.95 4.29 0.00 2.88 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 78 E 9.08 3.93 0.00 2.02 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 2.42 2.42 0.00 79 M 8.25 3.89 0.00 2.02 2.32 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.61 0.00 80 A 7.82 3.91 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 81 E 8.15 3.92 0.00 2.18 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 2.38 2.59 0.00 82 E 8.36 4.12 0.00 2.03 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 2.52 0.00 83 F 7.57 4.47 0.00 3.10 3.27 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 84 L 8.55 4.22 0.00 1.88 1.81 1.09 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.12 4.19 0.00 1.90 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.71 0.00 0.00 0.00 0.00 0.00 2.20 2.45 0.00 86 T 7.94 4.53 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 1.13 0.00 0.00 87 A 7.41 3.96 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 88 L 7.95 3.59 0.00 1.75 1.69 0.97 1.12 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 89 P 0.00 4.13 0.00 2.00 2.14 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.14 0.00 90 L 8.24 4.20 0.00 1.78 1.75 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 91 A 8.20 4.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.03 4.44 0.00 1.93 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 2.29 0.00 93 L 6.57 3.67 0.00 1.71 1.83 1.02 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.56 4.49 1.31 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 0.00 0.00 0.00 95 T 8.68 3.17 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 1.11 0.00 0.00 96 S 8.70 3.87 0.00 4.24 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 0.00 97 Q 7.92 4.27 0.00 2.22 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 6.85 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 98 F 7.88 5.13 0.00 3.04 3.01 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 0.00 99 D 10.23 4.66 0.00 2.96 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 0.00 100 D 8.60 4.70 0.00 2.73 2.73 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 0.00 101 T 7.88 4.51 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 1.22 0.00 0.00 102 G 8.08 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 0.00 103 N 7.83 5.45 0.00 2.86 2.80 0.00 0.00 6.57 8.13 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 0.00 104 F 7.73 4.74 0.00 2.54 1.63 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 0.00 105 S 8.22 5.09 0.00 3.77 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 0.00 106 F 8.87 4.95 0.00 3.15 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 0.00 107 G 8.96 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 0.00 0.00 0.00 *128 L 8.48 4.01 0.00 1.75 1.59 0.94 1.15 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 0.00 129 D 8.42 4.82 0.00 2.64 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.88 4.26 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 0.00 0.00 0.83 0.00 0.00 0.93 0.00 0.00 131 T 8.50 4.69 4.07 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 1.05 0.00 0.00 132 V 7.81 4.26 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 0.00 0.00 1.05 0.00 0.00 0.71 0.00 0.00 133 N 8.53 4.85 0.00 2.73 2.88 0.00 0.00 6.66 7.46 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 0.00 134 L 8.11 5.36 0.00 1.72 1.51 1.32 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.84 4.20 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 0.29 0.00 0.00 0.55 0.00 0.00 136 R 8.22 4.57 0.00 1.78 1.96 0.00 2.97 0.00 0.00 2.96 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 137 P 0.00 4.08 0.00 2.10 2.08 0.00 3.62 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 2.13 2.11 0.00 138 G 7.86 4.14 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 0.00 0.00 0.00 139 Y 8.20 4.32 0.00 3.09 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.30 4.01 0.00 1.92 1.94 0.00 3.25 0.00 0.00 3.26 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 141 V 7.46 3.50 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 0.97 0.00 0.00 0.98 0.00 0.00 142 A 7.83 4.80 1.07 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 0.00 0.00 143 K 7.73 4.26 0.00 1.54 1.71 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.75 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.63 1.25 7.81 144 R 7.59 4.29 0.00 1.89 1.93 0.00 3.10 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.60 0.00 145 D 8.45 4.52 0.00 2.67 2.73 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 0.00 146 K 7.86 4.05 0.00 1.80 1.71 0.00 1.80 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.42 7.81 147 A 8.87 3.77 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 0.00 148 S 7.06 4.48 0.00 3.86 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 0.00 149 R 8.20 4.49 0.00 1.88 1.72 0.00 3.07 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.51 0.00 150 S 8.62 4.57 0.00 3.92 3.74 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 0.00 151 I 8.32 3.93 2.01 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.23 1.05 0.00 0.00 152 P 0.00 4.36 0.00 2.21 2.02 0.00 3.67 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 153 T 8.69 3.91 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 1.23 0.00 0.00 154 K 8.15 3.93 0.00 1.79 1.95 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.51 7.81 155 H 7.80 4.45 0.00 3.08 3.37 0.00 5.94 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.37 4.24 0.00 1.98 1.86 0.00 3.41 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.75 0.00 157 L 8.14 4.36 0.00 1.51 1.72 0.88 0.92 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 0.00 158 N 8.30 4.81 0.00 3.16 2.72 0.00 0.00 6.59 7.91 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 0.00 159 P 0.00 4.32 0.00 2.14 2.19 0.00 3.62 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 2.16 2.45 0.00 160 A 8.00 3.88 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 0.00 161 D 8.15 4.42 0.00 2.71 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 0.00 162 A 7.95 4.14 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 0.00 0.00 0.00 0.00 0.00 163 V 7.81 3.17 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 0.75 0.00 0.00 0.29 0.00 0.00 164 A 7.78 3.92 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 0.00 165 F 7.74 4.15 0.00 3.03 3.37 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 0.00 166 I 7.98 3.57 1.86 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.23 0.90 0.00 0.00 167 E 8.36 4.22 0.00 1.91 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 2.27 2.14 0.00 168 S 8.02 4.54 0.00 3.87 4.02 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 0.00 0.00 0.00 169 T 7.80 4.78 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 1.19 0.00 0.00 170 Y 7.87 3.49 0.00 3.03 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 0.00 171 D 6.94 4.41 0.00 2.89 2.84 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 0.00 172 V 7.94 4.52 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 0.84 0.00 0.00 0.89 0.00 0.00 173 E 8.53 4.38 0.00 2.01 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 2.39 2.19 0.00 174 V 7.83 4.16 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 1.12 0.00 0.00 0.89 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.