NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 66 K 4.1807 8.3144 121.7861 56.0553 33.3571 174.7276 67 I 3.9804 8.2003 125.9446 60.1134 38.5509 170.2570 68 V 4.2816 9.0448 122.8832 60.4592 34.0106 175.1102 69 K 4.7340 8.1577 120.7916 54.2906 36.1928 175.0649 70 Y 4.0744 8.0008 124.0943 56.4042 39.2100 174.8223 71 P 4.0075 0.0000 0.0000 61.1056 30.9859 175.3705 72 D 3.7420 7.6882 119.2508 54.4210 42.3448 174.9875 73 P 4.3802 0.0000 0.0000 64.2143 31.3943 178.3975 74 I 3.6761 7.8147 118.2164 64.0075 37.7706 177.4761 75 L 4.0723 7.9677 119.1715 56.6563 41.3058 178.4599 76 R 4.4107 7.6204 116.5704 56.3037 30.9283 176.4360 77 R 4.2752 7.6664 117.4429 55.6967 31.4704 175.5735 78 R 4.4623 8.1787 120.6176 55.0603 30.9912 176.2199 79 S 4.5561 8.5795 122.7924 58.6738 63.9520 173.3713 80 E 4.7129 8.7104 121.4781 54.1501 32.1047 175.2546 81 E 4.3422 8.8698 123.5002 56.8501 30.1143 176.9421 82 V 3.7106 9.2747 127.1461 62.9822 32.1427 175.6951 83 T 4.4223 8.2421 114.7925 61.2188 70.7122 173.6093 84 N 4.8450 7.8436 119.2240 51.4392 40.1758 174.3737 85 F 4.6897 8.8987 123.4296 55.7496 39.3903 175.1591 86 D 4.6208 7.8153 132.8129 51.9860 40.1848 177.6769 87 D 4.5300 8.9737 113.8805 56.9601 41.4898 177.5580 88 N 4.1061 8.1137 117.0508 56.8251 38.7826 176.1859 89 L 3.8871 8.1285 121.3176 58.2474 42.3460 179.1400 90 K 3.9835 8.1031 118.3411 59.4675 31.8182 179.6539 91 R 3.9744 7.8918 118.0726 58.9839 29.8888 178.8951 92 V 3.5341 7.3846 116.5523 66.1887 31.6786 177.9829 93 V 3.6251 7.7757 116.5134 65.7719 31.4046 177.8146 94 R 4.2673 7.9673 118.0808 59.4189 30.0183 178.4032 95 K 3.7675 8.0714 118.6348 58.1811 32.5694 177.9880 *97 F 4.4045 7.8242 118.4278 57.7340 40.3106 175.7383 98 D 4.4724 7.9623 119.1662 58.2073 41.2671 178.7248 99 I 3.5982 8.3698 117.5671 63.0266 38.1289 177.5957 *101 Y 4.9537 7.9626 120.3324 58.2878 39.7656 177.0320 102 E 4.0242 8.8536 119.9523 59.6401 29.6604 177.8313 103 S 4.5386 8.2114 111.7227 57.7697 62.7247 174.2886 104 K 3.9783 7.5688 118.2070 57.7888 29.9693 174.9543 105 G 3.9015 7.5175 104.3834 43.5193 0.0000 173.7855 106 I 3.6944 7.8741 119.8812 62.7598 38.4087 175.6386 107 G 4.7202 7.4653 103.8887 44.5952 0.0000 171.3060 108 L 4.9674 9.0403 121.2804 53.2638 46.1340 174.8408 109 S 5.1007 8.3539 116.6146 56.2271 65.8942 174.5151 110 A 3.9383 8.6060 124.0629 55.0118 18.7948 178.2967 111 P 4.1679 0.0000 0.0000 65.4455 31.6392 177.8954 112 Q 4.2520 8.2647 116.3908 56.8106 28.9897 176.9994 113 V 4.5942 7.1569 111.2943 61.0076 32.3587 174.8424 114 N 4.1261 7.9506 114.3852 54.7309 37.5537 173.8168 115 I 4.3045 7.7047 117.5682 58.8940 39.0918 177.1329 116 S 4.5227 8.3701 126.1110 58.4362 60.1946 173.2685 117 K 4.9122 7.5459 118.3950 54.2322 35.6406 179.2934 118 R 4.3843 8.4789 123.2321 55.8667 27.8606 175.4203 119 I 4.9823 7.5022 121.3118 59.5087 41.9048 175.5188 120 I 5.0904 8.2694 124.3254 60.1180 41.7346 174.6629 121 V 5.4997 8.8488 118.9272 58.5248 36.5531 173.9178 122 W 5.1121 8.3034 116.8280 56.7354 31.0347 173.1476 123 N 5.5081 9.6676 119.5896 52.8670 40.2918 174.2184 124 A 4.3036 9.4683 130.5264 54.4691 19.0557 177.5312 125 L 4.7221 8.4165 117.0087 53.7527 41.1283 177.0554 126 Y 4.6006 7.6957 118.4960 59.3469 39.2931 178.5402 127 E 3.8168 7.5169 119.7468 58.8353 29.4857 178.0812 128 K 4.3641 7.2971 115.3997 59.6573 32.7528 177.3992 129 R 2.9785 6.8695 115.5879 54.0840 29.2299 176.2265 130 K 4.1201 8.0503 116.0536 55.7351 35.5166 174.6523 131 E 4.0385 8.2024 124.0573 57.1861 29.8854 177.4818 132 E 3.7027 8.6342 116.2709 57.3663 27.3131 175.0454 133 N 4.8892 7.9734 114.5822 52.9897 39.8345 174.4525 134 E 4.7841 7.8876 118.0612 55.3986 31.2707 175.9131 135 R 4.3181 8.9041 121.8301 54.3930 33.5400 174.2739 136 I 4.7363 7.9317 124.7099 59.4254 39.1644 175.1973 137 F 4.7617 9.4068 125.6572 55.9054 42.1180 174.0181 138 I 4.4964 9.1601 125.4398 60.4008 39.0741 175.9739 139 N 4.2603 8.3674 122.5510 53.7913 36.4192 171.8350 140 P 5.3083 0.0000 0.0000 62.7770 33.9239 176.8697 141 S 4.7899 9.2063 113.6408 57.0898 66.4517 173.0048 142 I 3.9398 8.0735 126.2560 60.2162 36.8796 175.9001 143 V 3.9217 8.5460 122.1997 64.0093 32.1669 176.5179 144 E 4.9176 7.8561 117.4863 55.3231 34.3531 174.0819 145 Q 4.9486 8.2438 118.0383 54.7146 31.8579 174.7291 146 S 4.3764 8.7113 116.7907 58.6592 63.9038 173.9354 147 L 4.2418 8.3797 118.6148 56.6605 42.4107 177.7617 148 V 3.5768 7.7095 118.7065 63.8618 31.9952 175.2440 149 K 5.2184 8.6892 126.3434 54.6464 35.4346 175.1536 150 L 4.7506 8.8197 120.9017 54.3393 44.4820 175.7017 151 K 4.8512 8.5349 119.8850 54.8483 32.6330 175.7208 152 L 4.8316 8.2668 124.3671 52.6643 45.7344 175.6292 153 I 4.7836 8.1381 120.3153 60.9387 38.5190 175.6311 154 E 4.6657 9.3088 123.7656 55.0699 34.1616 175.4060 155 G 4.6081 7.8176 111.7983 46.0143 0.0000 171.2342 156 C 4.4333 7.8617 113.8010 58.5701 34.0891 175.7242 157 L 4.2424 8.7353 127.3709 57.5848 41.5957 178.1272 158 S 4.5262 8.0601 113.1818 59.5017 63.6662 173.5250 159 F 5.3214 8.4709 119.7629 53.9667 39.2678 171.5538 160 P 4.4065 0.0000 0.0000 64.2793 32.0338 176.2883 161 G 4.1832 8.5640 108.9418 46.5058 0.0000 172.7205 162 I 4.6145 7.5053 118.5988 59.2772 39.7466 175.0267 163 E 4.9668 8.1622 122.6895 55.6190 32.7062 174.1291 164 G 3.9715 8.4022 111.7119 46.1069 0.0000 171.4397 165 K 5.1776 8.1631 119.0606 54.5593 33.9993 176.7472 166 V 4.3649 8.3938 123.9546 60.9520 34.8829 173.7022 167 E 4.6376 8.8151 128.9189 55.7046 30.2810 175.4704 168 R 4.8068 8.7415 124.9454 53.4001 35.0444 172.7621 169 P 4.4669 0.0000 0.0000 63.5816 31.3588 176.6430 170 S 4.2155 8.9685 118.7178 60.5266 62.7975 174.3921 171 I 4.7769 7.8283 120.4456 59.3881 40.3122 175.2798 172 V 4.6744 8.2607 118.4584 59.5151 35.3444 174.4792 173 S 4.9289 9.4365 120.7410 56.7486 64.1762 172.9617 174 I 5.2209 8.7280 120.5576 59.0582 41.4618 174.1713 175 S 5.2702 8.6980 115.6539 57.3717 66.7198 172.6356 176 Y 5.2929 7.9854 118.1645 57.1707 41.8939 172.0764 177 Y 5.0448 9.6156 116.8520 56.3443 41.6323 176.7641 178 D 5.2111 8.8671 122.4740 52.4272 41.7680 176.5944 179 I 3.8478 8.4846 117.8797 63.8737 37.9414 176.6141 180 N 4.6810 8.9461 115.8909 52.2236 39.1487 175.2279 181 G 2.6558 7.4878 105.3039 44.7001 0.0000 173.7324 182 Y 4.6317 7.5908 118.5222 57.2152 39.2792 174.9367 183 K 3.8583 8.5612 125.2591 56.5826 33.3945 175.4131 184 H 4.8551 8.4071 122.2157 53.9070 33.5796 172.1237 185 L 5.2868 8.3426 118.8551 53.1662 44.6349 176.2637 186 K 4.7784 8.9747 121.1731 55.0983 37.3602 174.9473 187 I 4.7877 8.3543 122.8152 59.7676 39.1155 174.9994 188 L 4.8590 8.6459 127.2300 53.0783 43.7801 175.8324 189 K 4.7857 8.2089 120.5541 55.1599 36.9972 177.0965 190 G 4.2160 8.8174 108.3994 46.6555 0.0000 176.7208 191 I 3.6049 8.3472 120.9459 64.5877 36.9302 177.6732 192 H 4.0760 7.8877 116.1589 58.7901 28.5385 177.7307 193 S 4.0568 7.9236 114.4879 61.0890 62.2331 176.1552 194 R 3.7790 7.5103 121.5946 59.6024 29.9235 178.6648 195 I 3.4498 7.4668 119.6863 63.7884 36.7337 178.3869 196 F 3.7536 7.4739 121.6127 61.4278 39.1005 177.3372 197 Q 3.8765 7.7929 116.0429 59.4773 28.7120 177.8342 198 H 4.1286 7.9946 119.3337 59.1651 29.4854 177.0879 199 E 4.0457 8.6332 120.4920 59.2915 29.2800 179.3522 200 F 4.0120 8.7087 121.8149 61.3046 39.3157 176.9510 201 D 4.2012 8.0195 118.5093 57.3386 40.5532 178.3192 202 H 4.1318 7.6158 116.4692 58.8575 28.7596 177.4777 203 L 4.1257 7.6141 119.8967 56.4053 41.1109 177.9604 204 N 4.8043 7.6635 114.9336 52.0770 39.3267 174.9151 205 G 4.1084 7.7459 107.4445 46.4994 0.0000 173.4404 206 T 4.5911 7.6914 115.7217 61.6894 69.9223 174.2960 207 L 4.8111 8.8837 126.6091 52.6118 43.8830 177.5584 208 F 4.3137 8.7846 115.4182 58.6499 37.9774 176.8313 209 I 3.4251 7.3221 113.9889 62.3708 37.9881 176.6958 210 D 4.3938 8.0890 121.4820 56.5109 41.3686 177.4579 211 K 4.2212 7.2122 120.1557 54.8532 30.9056 176.2052 *213 T 4.0373 7.3089 109.5227 61.5463 70.7237 176.2118 214 Q 3.6745 8.3484 126.0231 59.0643 30.1586 179.6214 215 V 3.6522 7.8301 117.1613 66.2107 31.5491 177.7574 216 D 4.3559 7.4337 115.9522 56.7565 40.8367 178.2885 217 K 3.9022 8.0761 120.6373 59.2659 32.1298 178.6876 218 K 3.9014 7.5741 118.5454 59.3481 32.0482 178.3541 219 K 4.1953 7.7480 117.0369 57.8023 32.3705 176.9396 220 V 4.3960 7.7336 115.7716 60.9570 33.0314 177.3668 221 R 3.8770 7.7750 121.2218 59.3451 29.7866 175.8405 222 P 4.2177 0.0000 0.0000 66.2422 31.3767 178.4120 223 K 4.0037 8.0609 116.1514 59.5310 32.1028 179.3688 224 L 4.1103 7.9788 119.2972 58.0230 41.5739 179.3278 225 N 4.5020 8.6318 116.7481 55.9360 38.5630 177.1737 226 E 3.9581 8.4108 121.0294 59.3942 29.6381 178.9255 227 L 4.1153 7.9166 118.4856 57.9275 41.6766 179.6194 228 I 3.7818 7.8527 119.6286 64.0588 36.9789 178.4626 229 R 3.9678 8.0067 120.0180 59.4848 29.7001 178.2950 230 D 4.4297 7.9076 117.4956 57.1740 41.0408 177.8648 231 Y 4.1108 7.8883 120.4245 60.4001 38.5951 177.4071 232 K 3.8146 7.9605 118.1978 59.3323 32.9188 179.9531 233 A 4.2304 7.8895 121.4526 51.3303 17.1631 178.7056 234 T 3.9496 7.2773 112.5828 64.3931 72.6336 172.9344 235 H 4.2397 8.8609 124.9419 55.9093 32.9073 173.1164 236 S 4.0428 8.2416 117.3533 58.5600 63.1395 171.8607 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 66 K 8.31 4.18 0.00 1.70 1.76 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.49 7.81 67 I 8.20 3.98 1.84 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 1.38 1.01 0.90 0.00 0.00 68 V 9.04 4.28 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 0.73 0.00 0.00 0.86 0.00 0.00 69 K 8.16 4.73 0.00 1.63 1.57 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.76 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.35 7.81 70 Y 8.00 4.07 0.00 1.99 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 0.00 0.00 0.00 71 P 0.00 4.01 0.00 1.51 0.49 0.00 3.21 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.39 0.00 72 D 7.69 3.74 0.00 2.63 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 0.00 0.00 0.00 0.00 73 P 0.00 4.38 0.00 2.18 2.03 0.00 3.63 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.03 0.00 74 I 7.81 3.68 1.84 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 1.48 1.19 0.94 0.00 0.00 75 L 7.97 4.07 0.00 2.00 1.73 0.85 0.81 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 76 R 7.62 4.41 0.00 2.00 1.94 0.00 3.38 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 77 R 7.67 4.28 0.00 1.84 1.85 0.00 3.13 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 78 R 8.18 4.46 0.00 1.78 1.80 0.00 3.21 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 79 S 8.58 4.56 0.00 3.90 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 80 E 8.71 4.71 0.00 1.87 1.80 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 2.22 2.20 0.00 81 E 8.87 4.34 0.00 1.98 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 2.30 2.56 0.00 82 V 9.27 3.71 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 0.14 0.00 0.00 0.79 0.00 0.00 83 T 8.24 4.42 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 1.18 0.00 0.00 84 N 7.84 4.85 0.00 2.61 2.87 0.00 0.00 6.82 7.45 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 85 F 8.90 4.69 0.00 2.87 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.82 4.62 0.00 2.72 2.38 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 87 D 8.97 4.53 0.00 2.74 2.74 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 88 N 8.11 4.11 0.00 2.81 2.96 0.00 0.00 6.75 6.66 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 89 L 8.13 3.89 0.00 1.91 1.62 0.76 0.81 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 90 K 8.10 3.98 0.00 1.95 1.88 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.72 7.81 91 R 7.89 3.97 0.00 2.12 1.98 0.00 3.14 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 92 V 7.38 3.53 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 0.75 0.00 0.00 0.93 0.00 0.00 93 V 7.78 3.63 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 0.96 0.00 0.00 1.01 0.00 0.00 94 R 7.97 4.27 0.00 2.22 2.06 0.00 3.32 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.82 0.00 95 K 8.07 3.77 0.00 1.98 1.84 0.00 1.78 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.67 7.81 *97 F 7.82 4.40 0.00 3.18 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 98 D 7.96 4.47 0.00 3.00 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 99 I 8.37 3.60 1.83 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 1.31 0.78 0.89 0.00 0.00 *101 Y 7.96 4.95 0.00 3.34 3.02 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 0.00 102 E 8.85 4.02 0.00 2.07 2.27 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 2.36 2.34 0.00 103 S 8.21 4.54 0.00 3.88 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 0.00 104 K 7.57 3.98 0.00 1.92 2.06 0.00 1.73 0.00 0.00 1.82 0.00 0.00 3.12 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.62 1.43 7.81 105 G 7.52 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 0.00 0.00 0.00 106 I 7.87 3.69 1.83 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 1.28 1.56 0.77 0.00 0.00 107 G 7.47 4.72 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 0.00 108 L 9.04 4.97 0.00 1.59 1.26 0.88 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.35 5.10 0.00 3.90 4.05 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 0.00 110 A 8.61 3.94 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 0.00 111 P 0.00 4.17 0.00 2.11 2.08 0.00 3.44 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 112 Q 8.26 4.25 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.90 0.00 0.00 0.00 0.00 0.00 2.18 2.00 0.00 113 V 7.16 4.59 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 0.65 0.00 0.00 0.94 0.00 0.00 114 N 7.95 4.13 0.00 2.86 2.87 0.00 0.00 6.82 7.22 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 0.00 115 I 7.70 4.30 1.96 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 1.15 0.91 0.89 0.00 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1.68 0.84 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 158 S 8.06 4.53 0.00 3.97 3.65 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 0.00 159 F 8.47 5.32 0.00 3.09 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 0.00 160 P 0.00 4.41 0.00 2.08 2.06 0.00 3.85 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.15 0.00 161 G 8.56 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 0.00 162 I 7.51 4.61 2.23 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 1.22 0.79 0.86 0.00 0.00 163 E 8.16 4.97 0.00 1.97 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 2.38 2.35 0.00 164 G 8.40 3.97 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 0.00 0.00 0.00 165 K 8.16 5.18 0.00 1.68 1.69 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.68 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.32 7.81 166 V 8.39 4.36 2.34 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 0.94 0.00 0.00 0.91 0.00 0.00 167 E 8.82 4.64 0.00 2.00 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 2.25 2.33 0.00 168 R 8.74 4.81 0.00 1.76 1.95 0.00 3.22 0.00 0.00 3.19 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 169 P 0.00 4.47 0.00 2.02 2.01 0.00 3.84 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.12 0.00 170 S 8.97 4.22 0.00 3.82 3.99 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 0.00 171 I 7.83 4.78 1.85 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 1.22 0.58 0.93 0.00 0.00 172 V 8.26 4.67 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 0.60 0.00 0.00 0.69 0.00 0.00 173 S 9.44 4.93 0.00 3.75 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 0.00 174 I 8.73 5.22 1.81 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 1.13 0.69 -0.04 0.00 0.00 175 S 8.70 5.27 0.00 3.84 3.94 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 0.00 176 Y 7.99 5.29 0.00 3.50 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 0.00 177 Y 9.62 5.04 0.00 3.26 2.93 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 0.00 178 D 8.87 5.21 0.00 2.98 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 0.00 179 I 8.48 3.85 1.93 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.75 0.96 0.00 0.00 180 N 8.95 4.68 0.00 2.38 2.51 0.00 0.00 7.19 7.77 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 0.00 181 G 7.49 2.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 7.59 4.63 0.00 3.17 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 0.00 183 K 8.56 3.86 0.00 1.37 1.46 0.00 1.13 0.00 0.00 1.51 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.14 1.04 7.81 184 H 8.41 4.86 0.00 1.83 2.90 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.34 5.29 0.00 1.45 1.53 0.87 0.76 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 0.00 186 K 8.97 4.78 0.00 1.95 1.73 0.00 2.02 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.54 7.81 187 I 8.35 4.79 1.87 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 1.34 0.83 0.90 0.00 0.00 188 L 8.65 4.86 0.00 1.45 1.64 0.93 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 189 K 8.21 4.79 0.00 1.67 1.65 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.84 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.42 7.81 190 G 8.82 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 0.00 0.00 0.00 0.00 191 I 8.35 3.60 1.68 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 1.60 0.46 0.84 0.00 0.00 192 H 7.89 4.08 0.00 3.48 3.64 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 S 7.92 4.06 0.00 4.03 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 0.00 194 R 7.51 3.78 0.00 1.95 1.93 0.00 3.16 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 195 I 7.47 3.45 0.56 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.09 0.41 0.00 0.00 196 F 7.47 3.75 0.00 3.07 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 0.00 197 Q 7.79 3.88 0.00 2.06 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 2.52 2.59 0.00 198 H 7.99 4.13 0.00 3.16 3.26 0.00 5.79 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 E 8.63 4.05 0.00 1.99 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 2.54 2.55 0.00 200 F 8.71 4.01 0.00 2.38 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 0.00 201 D 8.02 4.20 0.00 2.90 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 0.00 202 H 7.62 4.13 0.00 3.35 3.26 0.00 5.62 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 0.00 203 L 7.61 4.13 0.00 1.35 1.56 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 204 N 7.66 4.80 0.00 2.55 2.68 0.00 0.00 6.99 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 0.00 205 G 7.75 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 0.00 206 T 7.69 4.59 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 1.32 0.00 0.00 207 L 8.88 4.81 0.00 1.80 1.78 1.07 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 208 F 8.78 4.31 0.00 3.08 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 0.00 209 I 7.32 3.43 1.54 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.51 -0.01 0.00 0.00 210 D 8.09 4.39 0.00 2.69 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 0.00 211 K 7.21 4.22 0.00 1.71 1.75 0.00 1.83 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.34 7.81 *213 T 7.31 4.04 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 1.17 0.00 0.00 214 Q 8.35 3.67 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.97 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 215 V 7.83 3.65 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 0.99 0.00 0.00 0.90 0.00 0.00 216 D 7.43 4.36 0.00 2.67 2.60 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 0.00 217 K 8.08 3.90 0.00 1.86 1.75 0.00 1.60 0.00 0.00 1.49 0.00 0.00 2.80 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.29 1.51 7.81 218 K 7.57 3.90 0.00 1.92 1.98 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.43 7.81 219 K 7.75 4.20 0.00 1.91 1.77 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.43 7.81 220 V 7.73 4.40 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 0.66 0.00 0.00 0.88 0.00 0.00 221 R 7.77 3.88 0.00 2.02 1.98 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 222 P 0.00 4.22 0.00 2.20 2.11 0.00 3.57 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 223 K 8.06 4.00 0.00 2.02 1.92 0.00 1.57 0.00 0.00 1.83 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.56 1.63 7.81 224 L 7.98 4.11 0.00 1.98 1.82 0.94 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 225 N 8.63 4.50 0.00 2.90 2.90 0.00 0.00 6.69 7.89 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 0.00 226 E 8.41 3.96 0.00 2.28 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 2.34 2.43 0.00 227 L 7.92 4.12 0.00 2.23 1.89 0.98 1.05 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 0.00 228 I 7.85 3.78 2.08 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.88 0.94 0.00 0.00 229 R 8.01 3.97 0.00 2.04 2.18 0.00 3.15 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.73 0.00 230 D 7.91 4.43 0.00 2.76 2.74 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 0.00 231 Y 7.89 4.11 0.00 2.89 2.91 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 0.00 232 K 7.96 3.81 0.00 1.97 1.89 0.00 1.71 0.00 0.00 1.94 0.00 0.00 3.16 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.52 1.55 7.81 233 A 7.89 4.23 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 0.00 234 T 7.28 3.95 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 1.10 0.00 0.00 235 H 8.86 4.24 0.00 2.94 3.02 0.00 5.72 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 0.00 236 S 8.24 4.04 0.00 3.98 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 * Residues marked with a * may have inaccurate shift predictions.