NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 M 4.4746 8.2893 120.3232 55.5931 33.4250 174.3876 5 S 4.3941 7.9621 114.6669 56.4938 65.6620 172.0943 6 S 4.5775 9.0019 116.7636 56.5895 66.5856 174.0670 7 F 5.3728 8.4732 123.3105 56.2826 40.9269 174.9824 8 L 4.4841 8.8456 123.6491 55.0422 43.4062 175.3374 9 H 5.4558 9.5868 122.1862 53.5556 33.4034 173.2422 10 I 3.9334 8.6901 122.5540 62.9919 37.3140 177.5523 11 G 4.0562 9.1521 114.3054 45.1308 0.0000 173.6922 12 D 4.6447 8.0797 119.8685 54.4849 42.2539 175.2706 13 I 4.9539 8.2952 121.9133 59.9994 38.9790 175.4096 14 V 5.0347 9.3446 119.7409 59.8310 36.8402 174.3512 15 S 5.4047 9.1109 116.0624 56.7893 66.4252 173.2462 16 L 5.2514 8.8227 120.6225 53.4982 44.7785 174.8046 17 Y 4.5496 9.2901 126.9731 56.0182 40.1076 174.5719 18 A 3.7080 8.2901 129.5421 51.2615 20.7269 176.1468 19 E 5.2989 7.5564 119.3785 52.3367 31.7663 175.1798 20 G 4.0188 8.9695 121.3271 44.2582 0.0000 174.7600 21 S 4.1550 9.0190 121.1186 60.7798 62.8299 174.1787 22 V 4.5069 7.2060 112.1315 59.7381 35.7656 173.4277 23 N 4.9436 9.4922 117.5858 50.3838 41.3753 174.8936 24 G 4.0928 6.1938 110.5835 44.6407 0.0000 171.2737 25 F 5.1319 7.9482 117.9979 57.0317 40.5137 175.1346 26 I 4.6862 8.6257 123.4607 61.0992 38.7990 175.0911 27 S 4.8968 9.6132 123.2799 57.6291 66.9138 171.6533 28 T 5.0352 8.1339 109.1529 60.0870 71.6080 174.0250 29 L 4.5391 9.7377 118.5100 53.3997 42.0678 177.1585 30 G 3.9837 6.5900 106.3455 43.9377 0.0000 173.5079 31 L 4.2387 8.1043 119.1438 55.8372 42.2264 178.0092 32 V 4.1343 7.5994 116.3616 62.7670 33.0504 176.1287 33 D 4.3068 8.0634 119.5910 54.4342 41.3870 175.0916 34 D 4.7491 8.6612 124.6931 53.3664 39.8619 175.6583 35 R 4.5540 7.9723 119.0061 56.2720 31.3035 175.5674 36 C 5.0267 8.5777 119.8505 58.3372 31.1142 173.2827 37 V 5.0585 8.8887 115.3336 59.9395 36.7951 174.0650 38 V 4.8368 8.8973 121.0925 60.3069 34.6169 174.0254 39 E 5.0826 9.0546 128.7229 52.2136 29.3594 173.7393 40 P 4.5921 0.0000 0.0000 64.6011 31.4214 179.2573 41 A 3.8966 7.9966 119.6239 54.1171 18.8143 178.2610 42 A 4.1530 8.5489 119.8814 53.7730 18.5410 177.7746 43 G 4.2109 6.5995 103.3256 45.9171 0.0000 170.9799 44 D 5.0630 8.3492 117.9943 51.8569 42.0555 175.9308 45 L 3.7787 7.9561 117.2545 58.0995 41.6904 178.0783 46 D 4.4516 7.4947 115.7375 55.4308 41.4333 175.9483 47 N 4.8388 9.0061 116.5038 50.1319 39.9741 171.5886 48 P 4.5342 0.0000 0.0000 61.5098 32.0214 175.1048 49 P 4.8082 0.0000 0.0000 61.5967 32.1669 176.1363 50 K 4.1553 8.4281 118.3459 57.2905 33.0733 176.9729 51 K 3.8637 8.7272 118.2136 57.5435 29.7469 176.9913 52 F 4.2277 8.1062 120.9145 60.9893 39.7289 176.6965 53 R 3.8120 8.1756 119.4002 58.9742 29.8588 177.0932 54 D 4.4803 7.7770 114.9085 54.8099 41.1506 176.0504 55 C 4.4808 7.6523 114.7105 60.0754 28.9139 173.4424 56 L 4.5340 6.8823 120.5989 54.0930 42.6971 175.9415 57 F 5.1601 9.4499 121.6725 55.4996 43.2860 173.6771 58 K 4.9329 9.1537 123.6021 54.8188 34.4452 175.3862 59 V 4.2011 8.6127 127.8689 62.9535 32.4870 174.6366 60 C 5.2817 9.2068 125.2517 57.2817 32.3490 171.9538 61 P 4.8599 0.0000 0.0000 61.8828 32.6331 175.5410 62 M 4.1120 8.2509 121.0132 55.5794 32.2264 175.5128 63 N 4.6632 9.4505 124.5442 51.9710 40.1679 175.1201 64 R 4.3512 7.5421 119.9183 56.3965 30.8789 176.4446 65 Y 4.9597 8.4987 116.5437 56.7901 40.7043 177.1828 66 S 4.1801 8.5392 117.0528 61.9869 63.0547 176.3305 67 A 4.0968 8.3620 122.5032 55.3594 18.1280 179.5406 68 Q 4.1702 8.7599 116.7400 58.9358 28.6870 178.8500 69 K 4.0758 8.4857 120.9994 59.6356 32.2676 178.9361 70 Q 4.0753 8.2080 118.1846 59.0558 28.6254 178.1864 71 Y 4.2950 8.1543 120.3659 60.3759 38.6649 177.6148 72 W 3.9275 8.3113 128.2770 60.4414 31.1477 177.6210 73 K 3.4065 8.4828 118.2491 59.1873 31.5339 179.0103 74 A 3.9284 7.9411 121.0804 55.0540 18.0317 179.5554 75 K 3.9920 7.7602 115.7977 58.9184 32.4832 178.8351 76 Q 3.8267 7.3261 118.9342 57.8789 28.7591 176.8111 77 T 4.1840 7.0600 111.7910 60.7876 67.9881 174.5328 78 K 3.9256 6.6203 119.9837 57.0384 32.9870 176.2606 *81 K 4.2200 8.5331 125.3663 55.7765 33.6551 175.4650 82 E 4.5280 7.8422 118.5634 54.1588 30.4966 176.4142 83 K 4.1276 8.4001 124.4286 55.9495 33.9137 177.6605 84 I 3.6651 8.5378 124.7463 64.6852 37.1168 178.1057 85 A 4.0049 8.0551 120.6435 55.6691 18.1539 179.3981 86 D 4.3521 8.0768 116.4369 57.1642 40.8634 179.1035 87 V 3.5837 7.7572 119.1551 65.9329 31.5202 178.2601 88 V 3.5808 7.8727 117.9880 65.7757 31.2976 177.6951 89 L 3.9250 8.0077 120.0531 58.2004 41.9129 178.5690 90 L 4.0352 8.3158 120.6760 58.3736 41.9382 178.7617 91 Q 3.9430 8.2185 119.4583 58.9090 29.0990 178.1259 92 K 3.9295 8.1715 120.7798 59.5752 32.2831 178.8782 93 L 4.0475 8.3290 119.6905 57.6847 41.5381 179.2008 94 Q 2.5200 8.2173 119.8720 58.8963 28.8024 177.9006 95 H 4.0328 8.0988 118.9564 59.2483 29.9359 177.0424 96 A 3.8733 7.8877 122.0081 55.0533 18.1567 179.4893 97 A 3.9561 7.9019 119.2893 55.3712 18.4529 179.8932 98 Q 3.9110 7.9022 116.5229 59.4215 28.8045 178.9901 99 M 4.0130 8.1041 119.8766 58.1836 31.8479 178.4314 100 E 3.8970 8.2623 119.5012 59.4455 29.8339 178.9090 101 Q 3.9414 8.1735 118.0754 58.7014 28.7557 178.7818 102 K 4.0291 7.9720 120.7021 59.6148 32.3101 178.6549 103 Q 3.9550 8.5452 120.2005 59.1474 28.8146 177.9619 104 N 4.2521 8.3651 117.7411 56.4937 38.3181 176.9627 105 D 4.3717 8.0570 120.1485 57.6764 41.0037 179.2257 106 T 3.9255 7.8379 115.9361 66.8575 68.3459 176.8641 107 E 4.0938 8.3971 119.3243 59.4225 29.5637 178.9395 108 N 4.5126 8.5450 117.0475 56.0572 38.6900 177.6352 109 K 4.0127 7.7854 118.7857 59.3440 31.8846 179.3954 110 K 4.0088 7.5565 116.6583 58.7982 32.1453 178.6585 111 V 4.4526 7.2980 111.6520 59.1358 31.9390 175.0878 112 H 4.1569 7.3644 119.5124 58.0352 29.9035 175.5093 113 G 3.9297 8.6336 115.4019 45.0941 0.0000 173.3760 114 D 4.7059 8.1608 120.8662 53.9140 41.9804 176.4530 115 V 3.8630 8.3379 121.8465 61.8872 32.6350 175.3632 116 V 4.1241 8.6868 123.8786 61.8048 33.0064 174.7676 117 K 4.9733 8.3164 126.5491 54.3673 35.3241 175.4921 118 Y 4.3691 8.9492 121.6752 59.8640 38.2686 177.8629 119 G 3.9834 9.7213 113.7074 44.9946 0.0000 173.6968 120 S 4.6155 7.9197 114.8845 57.8328 65.1785 173.0390 121 V 4.8610 8.1424 120.2920 61.4281 32.8773 174.5168 122 I 4.9165 8.7389 120.1105 59.5287 41.8535 173.5717 123 Q 5.0308 9.1792 119.8817 54.0982 33.2633 174.8057 124 L 5.1534 8.5962 121.2170 53.1202 44.6852 175.1555 125 L 4.7438 8.9177 127.7633 53.4588 43.7042 175.0884 126 H 3.5153 9.2080 128.4436 56.2633 30.1611 175.5697 127 M 3.7596 8.1100 126.6159 58.5536 32.4051 177.2880 128 K 3.9060 7.4795 118.0358 59.2842 32.3462 177.7305 129 S 4.2058 7.8481 110.6230 58.3429 63.8196 172.9759 130 N 4.0542 7.8719 118.5562 54.7413 37.4912 173.6126 131 K 4.6862 7.3418 114.6976 54.6164 36.8924 176.1905 132 Y 5.0013 8.8983 121.6465 57.1620 39.6576 174.7926 133 L 4.5161 8.9435 126.0874 55.6481 43.5307 175.9005 134 T 4.7452 9.2827 122.3041 61.8775 73.0628 172.7982 135 V 4.5373 8.5513 126.2659 61.2025 33.9459 173.9651 136 N 4.8169 8.8148 128.5145 51.8022 39.0108 175.7982 137 K 4.0095 8.6941 126.7812 59.4346 32.8994 177.9449 138 R 4.3995 8.0498 117.1147 55.8993 30.2365 175.6868 139 L 4.9123 7.6831 118.9099 51.9558 45.0935 174.6033 140 P 4.8683 0.0000 0.0000 62.4024 32.1480 176.1448 141 A 4.1160 8.4095 123.6034 51.9763 18.5809 178.0179 142 L 4.0318 8.6108 119.6779 57.3452 42.1420 178.4364 143 L 4.2870 8.2779 116.5265 56.2311 42.8146 177.2144 144 E 3.3282 7.9598 124.9910 54.0046 28.1443 176.8071 145 K 3.9394 8.3028 124.4012 60.0151 32.5495 178.1458 146 N 4.4139 8.0452 114.3234 53.6052 38.8307 174.8069 147 A 4.6692 8.0153 121.5019 51.1182 21.4880 175.9801 148 M 4.8149 8.8665 118.8181 53.7117 34.6927 176.0177 149 R 4.2525 8.8106 123.5871 56.3424 31.4183 175.1373 150 V 4.8328 8.3436 126.5304 61.5544 33.3552 174.5758 151 T 4.9404 9.2284 117.0108 60.3297 73.0262 172.1720 152 L 5.0664 8.4893 122.1686 53.4473 43.3172 176.0782 153 D 4.6996 9.1001 122.7385 52.4462 44.0252 175.5647 154 A 4.1042 9.1579 129.6921 55.6884 18.5297 178.6672 155 T 4.1306 8.0492 103.8465 62.2049 69.4605 175.8963 156 G 3.8604 10.5031 110.9838 45.1685 0.0000 171.1069 157 N 3.1400 7.2014 113.6759 51.3132 39.9485 174.6614 158 E 2.5400 7.7945 114.9537 58.9099 29.3490 178.8288 159 G 3.5767 7.9586 107.4459 46.5401 0.0000 175.1353 160 S 4.4903 7.5612 114.9111 58.9725 63.4472 174.5493 161 W 4.6552 7.5912 121.9364 56.6014 29.9000 175.2993 162 L 5.0518 8.8773 124.3251 52.8448 45.0376 175.8042 163 F 4.9277 9.3159 123.0640 57.1900 40.6952 174.5850 164 I 4.6636 8.6884 124.2531 59.9502 38.9988 174.2255 165 Q 5.3446 9.1105 129.5426 53.0741 31.8401 173.9929 166 P 4.1922 0.0000 0.0000 62.9789 32.0960 175.2544 167 F 4.6270 8.6047 121.9753 59.5435 41.2740 175.9985 168 W 4.6288 7.7252 120.0327 55.9104 29.7285 177.3791 169 K 3.8960 8.8012 121.4500 59.5184 31.7092 178.1426 170 L 4.0466 8.1035 119.3805 57.3697 42.1310 177.0300 171 R 4.5881 7.6540 116.2000 54.7730 31.8840 175.6164 172 S 4.6138 8.6308 115.3231 56.4782 67.1931 173.6372 173 N 4.7123 8.5515 119.7892 55.3651 38.7225 174.7019 174 G 4.1196 8.9585 110.3284 45.6003 0.0000 173.9453 175 D 4.7343 8.1703 118.8989 53.8268 42.2737 176.0579 176 N 4.7527 8.4968 118.4413 53.1576 39.5877 175.0282 177 V 3.6379 8.6898 123.5827 62.6923 32.9397 174.8550 178 V 4.8384 8.7950 127.6952 61.1542 33.4086 175.3031 179 V 3.8694 8.8197 128.2254 64.7532 31.7986 176.2260 180 G 4.1733 9.4095 115.8261 45.2023 0.0000 173.6379 181 D 4.7098 8.2817 119.9140 54.4150 42.1778 175.4249 182 K 4.7160 6.4532 120.6877 55.2459 33.5741 176.2641 183 V 4.7002 8.7871 117.1443 59.7790 36.8100 174.1066 184 I 4.8413 8.7779 122.4902 59.8592 39.5095 175.0558 185 L 4.9658 8.7490 126.7708 53.2817 43.6975 174.9963 186 N 5.3197 9.1078 124.7249 50.6568 41.3221 171.8691 187 P 4.5808 0.0000 0.0000 63.4068 31.7214 177.1194 188 V 3.3440 8.4989 125.0034 66.3350 31.3170 176.9600 189 N 4.4416 8.2895 116.7751 56.4200 39.2391 175.7740 190 A 3.9700 7.9385 119.4699 53.9111 18.5134 178.6187 191 G 4.0766 8.5102 101.7901 45.3463 0.0000 173.0074 192 Q 4.7231 7.5218 117.8264 52.9730 33.0072 173.2057 193 P 4.6683 0.0000 0.0000 62.7363 32.8741 175.6022 194 L 4.5704 8.8619 123.5974 55.3334 42.3363 176.0836 195 H 5.0411 10.0325 123.8938 54.3988 33.0971 172.5472 196 A 4.8602 8.3009 128.5105 50.7695 18.9879 176.9088 197 S 4.5073 8.2468 116.2453 58.2720 65.0418 173.6346 198 N 4.8842 8.5060 115.4266 53.5948 39.7035 173.9628 199 Y 4.1207 8.2039 116.6878 56.2843 37.5424 174.8061 200 E 4.4117 8.5462 126.4832 55.8544 30.6636 176.1186 201 L 4.4630 8.5944 126.4423 53.4068 42.0277 177.7886 202 S 4.1572 8.8631 119.9865 61.2548 62.8642 175.1038 203 D 4.6582 7.9739 117.3487 54.1438 40.1205 176.6043 204 N 4.9046 8.0698 117.6042 50.7591 39.7974 172.3264 205 A 4.4007 8.0813 122.2528 54.0447 18.8106 178.2083 206 G 4.0461 10.1243 111.7660 45.0386 0.0000 172.7776 207 C 4.8888 7.9653 117.8385 58.6051 30.0176 172.9626 208 K 5.1776 9.0752 122.6577 54.2400 34.9967 175.3388 209 E 4.3340 9.1022 125.5532 56.4054 30.8460 175.4301 210 V 4.8419 8.2651 127.1672 61.6268 33.2268 174.4910 211 N 5.0317 8.9748 124.1223 51.8602 41.5192 172.1281 212 S 5.2047 8.4322 113.4518 57.1241 64.6439 173.8185 213 V 4.5057 8.2359 124.3641 60.4815 34.5607 172.0825 214 N 4.4764 9.0968 120.5719 54.0928 39.0879 173.5041 215 C 4.6615 8.2648 119.2167 58.4523 31.9524 173.0020 216 N 5.0844 8.5110 114.2573 53.1853 38.7815 175.0282 217 T 4.1344 8.0339 115.5303 63.8872 69.0357 173.8561 218 S 4.6545 8.0876 119.8440 56.1166 66.6371 172.9576 219 W 4.9904 8.9164 120.6121 54.7692 32.3556 174.3943 220 K 4.7785 9.3340 127.6480 55.7317 33.2904 175.3204 221 I 4.9001 8.6043 129.0095 60.3460 38.7726 174.6499 222 N 5.4638 8.9639 123.5995 51.3822 42.7824 174.5438 223 L 4.8486 8.6138 121.7192 54.1948 43.7149 176.9034 224 F 4.6660 8.6981 120.8533 58.6743 39.4297 175.1461 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 4 M 8.29 4.47 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 5 S 7.96 4.39 0.00 3.93 3.75 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 6 S 9.00 4.58 0.00 3.84 3.69 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 0.00 0.00 0.00 7 F 8.47 5.37 0.00 2.94 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 8 L 8.85 4.48 0.00 1.78 1.49 0.97 1.05 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 9 H 9.59 5.46 0.00 3.27 3.15 0.00 5.87 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 10 I 8.69 3.93 2.00 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 1.41 0.94 0.93 0.00 0.00 11 G 9.15 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 0.00 0.00 0.00 12 D 8.08 4.64 0.00 2.78 2.67 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 13 I 8.30 4.95 1.91 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 1.33 0.58 0.80 0.00 0.00 14 V 9.34 5.03 2.31 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 0.82 0.00 0.00 1.06 0.00 0.00 15 S 9.11 5.40 0.00 4.13 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 0.00 16 L 8.82 5.25 0.00 1.69 1.82 0.23 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17 Y 9.29 4.55 0.00 2.92 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 18 A 8.29 3.71 -0.05 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 0.00 0.00 19 E 7.56 5.30 0.00 1.61 1.68 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 2.16 1.97 0.00 20 G 8.97 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 0.00 0.00 0.00 21 S 9.02 4.15 0.00 3.95 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 22 V 7.21 4.51 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 0.76 0.00 0.00 0.91 0.00 0.00 23 N 9.49 4.94 0.00 2.62 2.45 0.00 0.00 6.61 7.73 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 24 G 6.19 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 25 F 7.95 5.13 0.00 3.23 3.16 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 0.00 0.00 0.00 0.00 26 I 8.63 4.69 2.21 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.88 0.85 0.00 0.00 27 S 9.61 4.90 0.00 4.00 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 28 T 8.13 5.04 4.13 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 0.00 0.00 0.00 0.83 0.00 0.00 29 L 9.74 4.54 0.00 1.62 1.68 1.04 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 30 G 6.59 3.98 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 0.00 0.00 0.00 31 L 8.10 4.24 0.00 1.62 1.70 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 32 V 7.60 4.13 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 0.71 0.00 0.00 0.92 0.00 0.00 33 D 8.06 4.31 0.00 2.64 2.62 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 34 D 8.66 4.75 0.00 3.12 2.83 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 35 R 7.97 4.55 0.00 1.82 1.89 0.00 3.13 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 36 C 8.58 5.03 0.00 2.86 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 37 V 8.89 5.06 2.21 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 0.73 0.00 0.00 0.97 0.00 0.00 38 V 8.90 4.84 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 1.11 0.00 0.00 1.02 0.00 0.00 39 E 9.05 5.08 0.00 2.11 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 2.41 2.31 0.00 40 P 0.00 4.59 0.00 2.25 2.40 0.00 4.17 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 2.09 1.94 0.00 41 A 8.00 3.90 1.34 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 0.00 0.00 0.00 42 A 8.55 4.15 1.53 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 0.00 0.00 43 G 6.60 4.21 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 0.00 44 D 8.35 5.06 0.00 2.74 2.89 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 45 L 7.96 3.78 0.00 1.39 1.60 0.65 0.54 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 D 7.49 4.45 0.00 2.81 2.69 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 0.00 0.00 0.00 47 N 9.01 4.84 0.00 2.68 2.74 0.00 0.00 6.62 7.90 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 48 P 0.00 4.53 0.00 1.87 1.67 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.81 0.00 49 P 0.00 4.81 0.00 2.37 2.31 0.00 3.38 0.00 0.00 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 50 K 8.43 4.16 0.00 1.82 1.83 0.00 1.93 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.51 7.81 51 K 8.73 3.86 0.00 1.96 1.83 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.43 7.81 52 F 8.11 4.23 0.00 3.24 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 53 R 8.18 3.81 0.00 1.79 1.81 0.00 3.16 0.00 0.00 3.06 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.59 0.00 54 D 7.78 4.48 0.00 2.56 2.69 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 0.00 0.00 0.00 55 C 7.65 4.48 0.00 1.94 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 56 L 6.88 4.53 0.00 1.33 1.29 -0.08 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 57 F 9.45 5.16 0.00 2.83 2.89 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 58 K 9.15 4.93 0.00 1.77 1.66 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.53 7.81 59 V 8.61 4.20 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 0.85 0.00 0.00 0.97 0.00 0.00 60 C 9.21 5.28 0.00 3.03 2.90 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 61 P 0.00 4.86 0.00 2.03 1.96 0.00 3.71 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 2.03 2.08 0.00 62 M 8.25 4.11 0.00 1.69 1.57 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.80 0.00 63 N 9.45 4.66 0.00 2.46 2.25 0.00 0.00 7.12 7.21 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 64 R 7.54 4.35 0.00 1.81 1.97 0.00 3.05 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.53 0.00 65 Y 8.50 4.96 0.00 2.83 2.72 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 66 S 8.54 4.18 0.00 3.93 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 67 A 8.36 4.10 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 68 Q 8.76 4.17 0.00 2.44 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.75 0.00 0.00 0.00 0.00 0.00 2.50 2.67 0.00 69 K 8.49 4.08 0.00 1.95 2.06 0.00 1.61 0.00 0.00 1.50 0.00 0.00 3.42 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.66 7.81 70 Q 8.21 4.08 0.00 2.45 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.59 0.00 0.00 0.00 0.00 0.00 2.44 2.59 0.00 71 Y 8.15 4.29 0.00 3.22 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 72 W 8.31 3.93 0.00 3.24 3.42 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 K 8.48 3.41 0.00 1.99 1.76 0.00 1.88 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.99 7.81 74 A 7.94 3.93 1.41 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 0.00 0.00 75 K 7.76 3.99 0.00 1.78 1.69 0.00 1.07 0.00 0.00 0.99 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.23 1.12 7.81 76 Q 7.33 3.83 0.00 1.73 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.87 0.00 0.00 0.00 0.00 0.00 1.22 1.16 0.00 77 T 7.06 4.18 4.13 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 0.00 0.00 0.00 1.23 0.00 0.00 78 K 6.62 3.93 0.00 1.72 1.77 0.00 1.85 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.41 1.34 7.81 *81 K 8.53 4.22 0.00 1.77 1.85 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.45 7.81 82 E 7.84 4.53 0.00 1.97 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 2.20 2.28 0.00 83 K 8.40 4.13 0.00 1.96 1.73 0.00 1.68 0.00 0.00 2.01 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.52 7.81 84 I 8.54 3.67 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 1.57 1.18 0.91 0.00 0.00 85 A 8.06 4.00 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 86 D 8.08 4.35 0.00 2.84 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 87 V 7.76 3.58 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 1.00 0.00 0.00 0.99 0.00 0.00 88 V 7.87 3.58 2.24 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 0.94 0.00 0.00 1.01 0.00 0.00 89 L 8.01 3.93 0.00 1.82 1.82 0.94 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.32 4.04 0.00 1.93 1.87 0.99 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.22 3.94 0.00 2.33 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 92 K 8.17 3.93 0.00 1.87 2.01 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.49 7.81 93 L 8.33 4.05 0.00 2.02 1.87 1.00 0.75 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 94 Q 8.22 2.52 0.00 1.74 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.01 1.56 0.00 95 H 8.10 4.03 0.00 3.25 3.43 0.00 5.84 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 7.89 3.87 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 97 A 7.90 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 98 Q 7.90 3.91 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 99 M 8.10 4.01 0.00 1.95 2.12 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 2.45 2.47 0.00 100 E 8.26 3.90 0.00 2.09 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 0.00 2.25 2.31 0.00 101 Q 8.17 3.94 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 102 K 7.97 4.03 0.00 1.92 2.00 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.43 7.81 103 Q 8.55 3.95 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.65 0.00 104 N 8.37 4.25 0.00 2.96 2.92 0.00 0.00 7.00 8.92 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 0.00 105 D 8.06 4.37 0.00 2.86 2.72 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 0.00 106 T 7.84 3.93 4.51 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 1.20 0.00 0.00 107 E 8.40 4.09 0.00 1.85 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 2.32 2.51 0.00 108 N 8.54 4.51 0.00 2.77 2.88 0.00 0.00 6.95 7.42 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 0.00 109 K 7.79 4.01 0.00 1.97 1.85 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.74 7.81 110 K 7.56 4.01 0.00 2.01 1.88 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.61 7.81 111 V 7.30 4.45 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 0.96 0.00 0.00 0.95 0.00 0.00 112 H 7.36 4.16 0.00 3.13 3.36 0.00 5.95 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 0.00 113 G 8.63 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 0.00 114 D 8.16 4.71 0.00 2.68 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.34 3.86 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 0.55 0.00 0.00 0.73 0.00 0.00 116 V 8.69 4.12 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 0.83 0.00 0.00 0.93 0.00 0.00 117 K 8.32 4.97 0.00 1.70 1.67 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.80 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.35 7.81 118 Y 8.95 4.37 0.00 3.21 2.87 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 0.00 119 G 9.72 3.98 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 0.00 0.00 0.00 120 S 7.92 4.62 0.00 3.92 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 0.00 121 V 8.14 4.86 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 0.50 0.00 0.00 0.66 0.00 0.00 122 I 8.74 4.92 1.95 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 1.33 0.55 0.88 0.00 0.00 123 Q 9.18 5.03 0.00 1.99 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.78 0.00 0.00 0.00 0.00 0.00 2.53 2.46 0.00 124 L 8.60 5.15 0.00 1.49 1.53 0.55 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.92 4.74 0.00 1.67 1.53 0.10 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 126 H 9.21 3.52 0.00 3.01 3.09 0.00 5.84 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 M 8.11 3.76 0.00 1.69 1.83 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.29 0.00 128 K 7.48 3.91 0.00 1.51 1.65 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.33 7.81 129 S 7.85 4.21 0.00 3.97 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 0.00 130 N 7.87 4.05 0.00 2.76 2.81 0.00 0.00 6.94 6.00 0.00 0.00 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 K 7.34 4.69 0.00 1.64 1.61 0.00 1.66 0.00 0.00 1.78 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.49 7.81 132 Y 8.90 5.00 0.00 2.97 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 0.00 133 L 8.94 4.52 0.00 1.80 1.53 0.82 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 134 T 9.28 4.75 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 1.04 0.00 0.00 135 V 8.55 4.54 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 0.88 0.00 0.00 0.86 0.00 0.00 136 N 8.81 4.82 0.00 2.68 2.61 0.00 0.00 6.51 5.52 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 0.00 137 K 8.69 4.01 0.00 1.87 1.89 0.00 1.60 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.43 7.81 138 R 8.05 4.40 0.00 1.94 1.98 0.00 3.25 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 139 L 7.68 4.91 0.00 1.50 1.48 0.88 1.14 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 0.00 140 P 0.00 4.87 0.00 2.03 2.02 0.00 3.75 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 1.96 1.95 0.00 141 A 8.41 4.12 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 0.00 142 L 8.61 4.03 0.00 1.62 1.73 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 143 L 8.28 4.29 0.00 1.75 1.73 1.05 1.06 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 0.00 144 E 7.96 3.33 0.00 1.16 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.92 0.00 145 K 8.30 3.94 0.00 1.88 1.92 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.51 7.81 146 N 8.05 4.41 0.00 2.71 2.90 0.00 0.00 6.80 7.35 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 0.00 147 A 8.02 4.67 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 0.00 148 M 8.87 4.81 0.00 1.90 2.05 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 2.53 2.44 0.00 149 R 8.81 4.25 0.00 2.13 1.75 0.00 3.02 0.00 0.00 3.06 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 150 V 8.34 4.83 2.25 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 0.83 0.00 0.00 0.89 0.00 0.00 151 T 9.23 4.94 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 1.16 0.00 0.00 152 L 8.49 5.07 0.00 1.52 1.61 0.82 0.83 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 0.00 153 D 9.10 4.70 0.00 2.58 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 0.00 154 A 9.16 4.10 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 0.00 155 T 8.05 4.13 4.38 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 1.28 0.00 0.00 156 G 10.50 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 0.00 157 N 7.20 3.14 0.00 2.27 2.29 0.00 0.00 7.16 7.75 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 0.00 158 E 7.79 2.54 0.00 1.16 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 1.90 1.89 0.00 159 G 7.96 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.56 4.49 0.00 3.67 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 0.00 161 W 7.59 4.66 0.00 3.13 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.88 5.05 0.00 1.48 1.46 0.78 1.06 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 0.00 163 F 9.32 4.93 0.00 3.09 2.87 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 0.00 164 I 8.69 4.66 1.86 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 1.13 1.43 0.85 0.00 0.00 165 Q 9.11 5.34 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.76 0.00 0.00 0.00 0.00 0.00 2.33 2.58 0.00 166 P 0.00 4.19 0.00 2.02 1.42 0.00 3.76 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.83 0.00 167 F 8.60 4.63 0.00 2.81 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 0.00 168 W 7.73 4.63 0.00 3.57 2.89 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 0.00 169 K 8.80 3.90 0.00 1.73 1.87 0.00 1.73 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.36 7.81 170 L 8.10 4.05 0.00 1.59 1.83 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 171 R 7.65 4.59 0.00 1.37 0.98 0.00 3.61 0.00 0.00 3.37 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 172 S 8.63 4.61 0.00 3.91 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 0.00 173 N 8.55 4.71 0.00 2.70 2.78 0.00 0.00 7.24 7.65 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 0.00 174 G 8.96 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 0.00 175 D 8.17 4.73 0.00 2.91 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 0.00 176 N 8.50 4.75 0.00 2.00 2.19 0.00 0.00 6.92 7.68 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 0.00 177 V 8.69 3.64 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 0.80 0.00 0.00 0.08 0.00 0.00 178 V 8.79 4.84 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 1.07 0.00 0.00 1.26 0.00 0.00 179 V 8.82 3.87 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 0.92 0.00 0.00 1.01 0.00 0.00 180 G 9.41 4.17 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 0.00 0.00 0.00 181 D 8.28 4.71 0.00 2.93 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 0.00 182 K 6.45 4.72 0.00 0.79 1.05 0.00 2.00 0.00 0.00 1.56 0.00 0.00 3.23 0.00 0.00 3.38 0.00 0.00 0.00 0.00 1.26 1.33 7.81 183 V 8.79 4.70 2.37 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 0.81 0.00 0.00 1.02 0.00 0.00 184 I 8.78 4.84 2.02 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 1.42 1.04 1.04 0.00 0.00 185 L 8.75 4.97 0.00 1.33 1.40 0.19 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 186 N 9.11 5.32 0.00 2.98 2.94 0.00 0.00 6.54 8.37 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 0.00 187 P 0.00 4.58 0.00 2.12 2.14 0.00 3.91 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 2.12 1.98 0.00 188 V 8.50 3.34 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 0.78 0.00 0.00 -0.16 0.00 0.00 189 N 8.29 4.44 0.00 2.58 2.70 0.00 0.00 6.92 7.96 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 0.00 190 A 7.94 3.97 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 0.00 191 G 8.51 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 0.00 0.00 0.00 0.00 192 Q 7.52 4.72 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 193 P 0.00 4.67 0.00 2.17 2.10 0.00 3.80 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.22 0.00 194 L 8.86 4.57 0.00 1.52 1.60 0.45 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 195 H 10.03 5.04 0.00 3.21 3.49 0.00 5.77 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 0.00 196 A 8.30 4.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 S 8.25 4.51 0.00 4.24 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 0.00 198 N 8.51 4.88 0.00 2.67 2.70 0.00 0.00 6.97 7.54 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 0.00 199 Y 8.20 4.12 0.00 3.07 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 0.00 200 E 8.55 4.41 0.00 1.91 1.85 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 2.30 2.41 0.00 201 L 8.59 4.46 0.00 1.83 1.79 1.06 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 202 S 8.86 4.16 0.00 3.99 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 0.00 203 D 7.97 4.66 0.00 2.81 2.83 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 0.00 204 N 8.07 4.90 0.00 2.82 2.74 0.00 0.00 6.76 7.26 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 0.00 205 A 8.08 4.40 1.26 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 0.00 206 G 10.12 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 0.00 0.00 0.00 207 C 7.97 4.89 0.00 3.06 2.88 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 0.00 208 K 9.08 5.18 0.00 1.61 1.85 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.77 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.48 7.81 209 E 9.10 4.33 0.00 2.09 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 2.26 0.00 210 V 8.27 4.84 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 0.96 0.00 0.00 1.09 0.00 0.00 211 N 8.97 5.03 0.00 2.99 2.86 0.00 0.00 6.01 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 S 8.43 5.20 0.00 3.88 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 0.00 213 V 8.24 4.51 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 0.58 0.00 0.00 0.91 0.00 0.00 214 N 9.10 4.48 0.00 2.83 2.80 0.00 0.00 7.18 7.65 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 0.00 215 C 8.26 4.66 0.00 3.03 2.72 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 0.00 216 N 8.51 5.08 0.00 2.75 2.95 0.00 0.00 6.88 7.54 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 0.00 217 T 8.03 4.13 4.40 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 0.46 0.00 0.00 218 S 8.09 4.65 0.00 2.77 2.63 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 0.00 219 W 8.92 4.99 0.00 3.15 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 0.00 220 K 9.33 4.78 0.00 1.86 1.85 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.65 1.67 7.81 221 I 8.60 4.90 1.95 0.00 0.00 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 1.44 0.87 0.99 0.00 0.00 222 N 8.96 5.46 0.00 2.96 2.83 0.00 0.00 6.59 6.27 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 0.00 223 L 8.61 4.85 0.00 1.62 1.74 0.99 0.89 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 0.00 224 F 8.70 4.67 0.00 2.97 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 * Residues marked with a * may have inaccurate shift predictions.