NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6060 8.1476 120.6105 55.0436 34.7809 174.8066 2 V 4.7692 7.5279 116.4800 59.3282 35.0327 172.7435 3 I 4.9263 8.6113 123.6318 59.5627 40.8228 175.6479 4 V 4.7001 8.8652 127.3825 61.1946 33.9967 174.2261 5 I 4.6517 8.7092 129.6577 59.7914 38.4753 174.3751 6 N 4.9530 9.4379 127.9536 53.4985 39.1606 175.5704 7 Y 4.3474 9.3708 123.8506 58.3181 39.9882 178.1796 8 K 3.7477 7.9147 117.1206 57.6619 32.0016 175.9881 9 T 4.6991 8.0301 113.2603 62.2603 69.0597 173.4751 10 Y 4.3334 7.6107 118.7078 58.7694 38.9497 177.0503 11 N 4.4882 8.7642 119.1063 56.2186 38.8937 176.7710 12 E 4.3602 8.2344 115.4424 57.0847 29.7413 176.8888 13 S 4.6467 7.7945 111.9874 57.6812 63.5246 173.9815 14 I 4.3456 7.6069 122.6798 61.8870 38.7983 175.8680 15 G 4.1084 9.0865 113.2344 46.7932 0.0000 175.8219 16 N 4.5361 8.6755 118.0605 55.5360 38.2380 177.0396 17 R 4.0614 7.7931 119.6778 59.1291 29.8388 178.9119 18 G 3.9771 8.1775 104.6164 46.9882 0.0000 175.6073 19 L 4.0965 7.7914 122.5816 58.1702 42.0881 178.5424 20 E 4.0726 8.4353 118.6328 59.2717 29.4917 179.2823 21 I 3.8163 7.6015 118.4049 63.7307 37.0328 178.4013 22 A 4.0815 7.7594 121.9300 55.1021 18.3978 179.8582 23 K 4.1571 7.9891 116.5249 59.7788 32.5147 179.4400 24 I 3.7903 7.6405 121.4692 64.1760 36.8381 178.0120 25 A 4.0834 7.7142 120.3459 54.7206 18.2943 178.9916 26 E 4.0359 8.3344 118.4792 59.0142 29.5252 178.9141 27 K 3.9652 8.1301 120.2113 59.6214 32.3581 178.9349 28 V 4.5372 7.2953 108.8710 62.5763 31.9289 177.5459 29 S 4.2547 7.9147 115.6294 60.5281 62.9162 174.1733 30 E 4.7862 7.1208 120.7179 53.7955 28.4261 175.2185 31 E 4.8209 7.2461 114.4181 57.0088 33.0491 177.3170 32 S 3.9725 7.7991 111.9576 56.9359 64.3277 174.6475 33 G 3.8236 7.9625 106.9332 45.4211 0.0000 172.4071 34 I 4.3908 7.1598 118.8499 59.0892 40.1335 175.2316 35 T 4.1808 8.0057 125.9630 63.5422 69.5586 173.5428 36 I 4.6934 8.5061 126.9377 59.6733 39.8566 175.1991 37 G 4.4096 9.5471 114.7652 44.7045 0.0000 171.9304 38 V 5.1275 8.9681 112.1959 59.4366 36.4398 174.9291 39 A 5.1306 8.6995 124.2399 48.5831 18.6907 173.8810 40 P 4.0821 0.0000 0.0000 61.0791 33.1562 176.2328 41 Q 3.9259 8.3474 119.1825 55.3837 29.4789 177.4348 42 F 4.2167 8.1530 118.8488 61.1210 39.0333 178.2803 43 V 3.7317 7.8872 111.5010 63.1955 31.5997 176.8716 44 D 4.7974 8.0740 118.7163 54.6093 41.1693 177.5533 45 L 3.8853 7.5255 119.6626 58.6675 41.4995 178.8866 46 R 4.0530 7.7700 115.9190 58.5424 29.7724 178.5269 47 M 4.0187 7.8492 119.6082 58.9866 32.4335 177.8783 48 I 3.9130 7.4801 119.6826 64.0033 37.0274 178.5842 49 V 3.5674 7.3046 118.8390 66.0134 31.4309 177.6600 50 E 4.1325 7.8740 117.3397 58.4202 29.3997 177.3999 51 N 4.6759 7.6644 113.7363 53.6434 40.0630 175.3498 52 V 4.3293 8.0237 116.7313 61.1524 33.8152 175.6253 53 N 4.7879 8.4001 125.7850 51.7113 37.2865 173.6491 54 I 4.6382 6.9617 112.3004 57.9702 41.4567 173.8078 55 P 4.0675 0.0000 0.0000 63.1816 32.2870 175.2683 56 V 4.5863 8.0456 124.8597 61.2644 33.8594 173.9049 57 Y 5.2205 8.9926 125.1323 56.0253 41.5224 175.1397 58 A 4.5450 8.6416 123.9043 51.7918 19.8748 178.6187 59 Q 3.8522 8.1933 117.5555 57.1224 29.4587 175.7690 60 H 4.7245 7.6253 113.8176 56.3659 32.3641 173.3685 61 I 4.4010 7.7933 124.7347 59.7135 40.1956 175.0248 62 D 4.4814 8.0344 126.3387 54.1914 41.2252 177.0348 63 N 4.6585 8.3887 122.0404 52.3715 37.3976 173.8519 64 I 4.6045 7.3890 114.2101 58.6586 41.0792 174.8725 65 N 4.8199 8.3472 118.6599 50.6270 40.2777 172.7936 66 P 4.2755 0.0000 0.0000 64.0066 32.3935 175.3039 67 G 3.9598 7.7007 117.7820 46.4408 0.0000 176.3622 68 S 4.4971 8.6519 121.0785 57.1284 61.3840 172.4053 69 H 4.7292 7.8330 120.1798 54.0492 30.0674 172.3204 70 T 3.9596 8.1326 119.7390 64.3743 69.0464 175.0724 71 G 3.8506 8.9695 113.5667 46.2654 0.0000 172.4081 72 H 4.9916 7.9537 114.7764 53.6486 32.0282 173.9398 73 I 4.0508 8.7790 122.2453 60.1078 38.4907 174.7440 74 L 4.3620 8.3301 129.7658 53.9917 43.2022 177.0511 75 A 4.0110 8.8648 128.2380 55.6270 18.3375 179.7408 76 E 4.0272 8.1784 115.6129 58.8583 29.3194 179.0963 77 A 4.0667 7.5970 120.3275 54.7387 18.8048 179.4393 78 I 3.8496 7.5483 118.1327 64.4958 37.2240 178.4130 79 K 4.0156 7.9246 120.0573 59.2459 31.7453 178.3274 80 D 4.3459 7.5923 117.8823 57.1688 41.1519 177.5780 81 C 4.3611 7.6525 116.3953 60.8773 28.1263 174.5942 82 G 4.0714 7.4371 108.2240 45.4218 0.0000 173.4451 83 C 4.2768 7.6476 116.2461 59.2163 28.9616 173.7720 84 K 3.9333 8.5710 124.8296 59.2642 32.8078 175.8258 85 G 4.2367 7.2519 108.4334 46.5560 0.0000 172.1500 86 T 5.2115 9.0967 116.3889 61.4855 71.2813 172.9468 87 L 5.3762 9.2578 126.9397 53.1986 44.0485 175.7964 88 I 4.5984 8.0450 115.3178 59.2243 41.6831 174.1228 89 N 4.2621 8.7881 118.2893 54.9322 37.3714 173.8916 90 H 4.4711 7.9810 115.4496 55.2057 30.9804 175.5973 91 S 4.2047 8.1364 119.2031 61.2399 62.7521 175.6738 92 E 4.2602 8.4223 119.2360 58.0552 29.9172 176.7259 93 K 4.5669 7.7121 118.7553 54.6832 32.3528 175.4068 94 R 4.1865 7.8928 120.2196 55.7909 31.2101 175.8855 95 M 4.7584 8.1279 119.7893 53.1632 35.4551 175.9481 96 L 4.3471 8.0215 118.8133 54.1650 43.4324 178.1059 97 L 3.9245 8.3333 121.7589 58.5376 41.6997 179.2116 98 A 4.0864 7.9518 119.7502 54.6876 18.3642 179.2685 99 D 4.3413 7.8929 117.8509 57.4948 41.1181 178.7055 100 I 3.8404 7.6851 113.1155 63.7441 37.5077 177.8958 101 E 3.9237 7.9771 120.5862 59.0026 29.3965 178.5361 102 A 4.0801 7.7780 119.8307 54.6742 18.3892 179.8607 103 V 3.5281 7.6599 117.0262 66.2340 31.5660 178.3517 104 I 3.7179 7.9358 119.6400 64.3686 36.7559 178.2282 105 N 4.3324 7.9939 117.2057 56.3206 38.3940 177.6635 106 K 4.0046 8.2598 119.9938 59.6731 32.0800 179.3062 107 C 4.2323 8.4632 117.6408 62.4403 27.8845 175.8765 108 K 4.2157 8.1908 118.7874 58.9084 32.4170 178.1147 109 N 4.6295 7.6713 116.9774 54.4317 39.0347 176.0668 110 L 4.5809 7.5531 117.6263 53.6703 42.3708 177.0549 111 G 3.8734 7.9329 106.5383 45.8845 0.0000 172.9760 112 L 4.6151 8.2012 119.9062 53.2948 42.6891 176.5138 113 E 4.4762 9.5650 126.2617 56.4239 31.1795 175.2849 114 T 4.6678 9.6520 117.6842 60.3957 71.1849 173.6221 115 I 4.5037 8.4972 128.6615 59.1084 37.9401 173.0974 116 V 4.4491 8.3904 124.8979 60.9997 32.7895 176.0534 117 C 4.8887 9.0898 124.3033 59.8283 29.0590 172.8943 118 T 4.7689 9.6320 116.9551 60.7324 70.6060 173.7923 119 N 4.8973 8.9213 121.0840 53.0679 39.2982 174.6769 120 N 5.0566 8.1899 115.4470 50.8587 43.0216 175.2876 121 I 3.9661 7.9429 115.9138 63.1848 38.0467 177.9332 122 N 4.4144 8.0792 118.3442 56.0654 38.3659 176.8319 123 T 4.1535 7.7985 109.9887 63.6761 68.7471 177.1386 124 S 4.1271 7.6193 119.1207 61.3989 62.8374 176.1076 125 K 4.1849 7.8348 118.3910 58.3394 32.6194 178.6157 126 A 4.1311 7.4024 122.4049 55.3674 18.6055 179.7252 127 V 3.5965 7.6376 116.2344 65.4753 31.0635 177.9219 128 A 3.9990 7.8922 120.0592 54.7845 17.8678 179.2055 129 A 4.0811 7.5461 118.6712 54.7598 18.6611 179.2037 130 L 4.0462 7.9036 116.0158 54.9342 43.1093 176.7938 131 S 3.6327 7.2935 113.8344 58.7823 60.0387 168.7830 132 P 4.6910 0.0000 0.0000 61.8728 34.0033 176.3477 133 D 4.6371 9.0935 117.5542 57.2251 42.0065 176.8028 134 C 5.1644 8.6964 114.3203 58.4659 33.6989 173.3521 135 I 5.5334 8.6943 119.7095 59.1746 41.1272 173.3312 136 A 5.0032 8.6473 131.3838 50.6063 21.0608 175.4712 137 V 4.5202 8.7195 123.5921 61.0012 33.3769 176.2437 138 E 4.9111 8.5878 128.4865 55.9420 27.8545 177.2726 *156 V 4.0818 7.7845 112.4350 61.0370 34.3624 178.0965 157 V 3.9631 7.5583 118.0981 64.8667 31.8059 177.3702 158 E 4.2165 8.1192 118.9403 59.1150 29.1734 178.8227 159 G 3.6597 8.0333 105.2550 47.6615 0.0000 175.6765 160 T 4.0273 7.7981 117.6397 66.1826 68.6642 177.1211 161 V 3.6026 7.8654 120.6517 65.9288 31.3192 178.3594 162 R 3.9985 8.1721 115.5098 58.8756 28.9299 178.6854 163 A 3.9922 7.7104 121.5244 54.9903 18.3334 179.7326 164 V 3.4920 7.6808 116.4816 65.7736 31.4194 178.2055 165 K 4.1278 8.0326 118.4504 59.0466 32.0345 178.1311 166 E 4.2091 7.7004 117.8628 58.5243 29.6064 178.5782 167 I 4.1565 7.0873 118.9651 62.3090 37.5718 176.0027 168 N 4.7877 8.2141 119.4798 51.9899 41.1253 174.3150 169 K 4.1263 8.7480 126.0458 57.3506 32.6381 176.5273 170 D 4.6161 7.8551 116.2869 55.3958 41.6543 176.1022 171 V 4.2064 7.0985 120.3096 61.5740 32.4575 175.6293 172 K 4.4134 8.3246 126.8020 56.2728 34.7034 175.6542 173 V 4.7345 8.2424 121.9201 61.4109 33.6641 174.2301 174 L 5.1691 9.2017 127.5020 53.0737 45.3174 174.7504 175 C 4.7523 8.6817 123.2695 57.3820 33.2961 173.9861 176 G 4.9031 8.6866 115.5850 44.9049 0.0000 173.0511 177 A 4.4342 7.8667 122.7507 51.1711 21.9107 177.0087 178 G 3.6397 8.8570 112.8322 47.1974 0.0000 174.2363 179 I 4.4845 7.4843 117.2099 59.6049 39.7820 175.4488 180 S 4.3898 9.0233 120.1746 60.1407 65.9427 175.4866 181 K 4.4307 8.4120 122.8713 52.6701 32.3026 179.4568 182 G 4.3155 8.2111 104.3171 46.5095 0.0000 175.5571 183 E 4.2412 8.0426 120.1394 58.5383 29.4683 178.1891 184 D 4.4215 7.8769 119.0055 56.9103 40.8884 178.7258 185 V 3.6577 7.6574 118.5773 65.5750 31.5443 177.8840 186 K 3.9724 7.8254 118.3832 59.3216 31.8359 178.6659 187 A 4.1543 7.9328 119.9269 54.3964 18.4732 179.2636 188 A 4.1099 7.6072 119.7960 55.1169 18.1904 179.5319 189 L 4.3862 7.7803 118.5483 57.3572 40.5668 178.2791 190 D 4.5275 7.6093 117.1664 55.6945 41.0698 176.7546 191 L 4.4306 7.3810 118.0154 54.0069 42.0006 176.7966 192 G 3.9646 7.5649 105.2047 45.2442 0.0000 174.6659 193 A 4.3385 8.0166 123.3557 52.3780 18.9427 177.3075 194 E 4.6926 8.7351 119.5714 55.3089 31.5314 175.6193 195 G 3.9533 7.3080 106.7941 46.1830 0.0000 172.5719 196 V 5.0123 8.3818 119.1941 60.8969 35.6327 173.6847 197 L 5.3409 8.8314 128.7458 53.2339 45.0865 175.1541 198 L 4.8292 8.8229 125.0047 55.7583 44.5657 175.2814 199 A 4.8621 8.9736 119.0020 51.1363 20.9701 178.0354 200 S 3.5207 8.8779 110.8530 60.5863 63.7226 178.4781 201 G 3.9914 7.4577 109.9909 47.0363 0.0000 174.1720 202 V 4.0128 7.4421 118.3034 64.0948 32.7545 177.1615 203 V 3.4964 7.4794 118.5037 65.4422 31.3835 177.0284 204 K 3.8693 8.4845 118.9733 59.8076 32.8718 176.5101 205 A 3.6471 6.7963 122.1370 48.3273 19.7057 177.0448 206 K 3.9651 8.3069 122.7659 59.0123 32.8562 178.6948 207 N 4.6136 7.6404 123.2122 52.1366 37.8442 175.2671 208 V 3.5823 8.0100 126.2066 65.4491 31.6890 176.8271 209 E 3.9385 8.1415 118.7405 59.3070 29.7024 178.4263 210 E 4.0846 8.5831 118.1613 58.8271 29.6446 179.0675 211 A 4.0208 7.8115 121.0783 55.0809 18.4906 179.6731 212 I 3.8934 7.5816 118.5315 64.3404 37.0423 178.7527 213 R 4.0720 7.6985 117.8362 58.7301 30.1537 178.2984 214 E 4.1060 8.1335 119.5289 58.9724 29.4639 178.7988 215 L 3.9491 7.7096 118.0427 56.9620 41.8479 177.2153 216 I 3.6102 6.5582 111.0118 60.5032 37.6989 174.2078 217 K 4.0636 7.8991 120.8422 55.1391 33.0941 176.2347 218 F 4.2864 7.9665 126.0869 58.3757 39.8389 174.5371 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 1 M 8.15 4.61 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 2 V 7.53 4.77 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.01 0.00 0.00 3 I 8.61 4.93 1.88 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 1.10 1.17 0.91 0.00 0.00 4 V 8.87 4.70 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 0.84 0.00 0.00 0.74 0.00 0.00 5 I 8.71 4.65 2.08 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 1.14 0.64 0.94 0.00 0.00 6 N 9.44 4.95 0.00 2.86 2.77 0.00 0.00 6.81 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 7 Y 9.37 4.35 0.00 3.34 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 8 K 7.91 3.75 0.00 1.81 0.74 0.00 1.94 0.00 0.00 1.82 0.00 0.00 3.10 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.34 1.47 7.81 9 T 8.03 4.70 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 1.17 0.00 0.00 10 Y 7.61 4.33 0.00 3.09 3.12 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 11 N 8.76 4.49 0.00 2.83 2.89 0.00 0.00 6.91 7.66 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 12 E 8.23 4.36 0.00 1.86 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 0.00 2.25 2.33 0.00 13 S 7.79 4.65 0.00 4.03 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 14 I 7.61 4.35 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.33 0.95 0.00 0.00 15 G 9.09 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 16 N 8.68 4.54 0.00 2.84 2.90 0.00 0.00 6.87 7.66 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 17 R 7.79 4.06 0.00 2.16 2.22 0.00 3.32 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 1.65 1.65 0.00 18 G 8.18 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 19 L 7.79 4.10 0.00 1.77 1.89 0.94 1.02 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 20 E 8.44 4.07 0.00 2.20 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 2.53 2.50 0.00 21 I 7.60 3.82 1.99 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.19 0.81 0.00 0.00 22 A 7.76 4.08 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 23 K 7.99 4.16 0.00 2.04 2.10 0.00 1.33 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.69 1.49 7.81 24 I 7.64 3.79 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.44 0.91 0.00 0.00 25 A 7.71 4.08 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.33 4.04 0.00 2.19 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 0.00 2.31 2.31 0.00 27 K 8.13 3.97 0.00 1.96 1.98 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.61 1.43 7.81 28 V 7.30 4.54 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.98 0.00 0.00 29 S 7.91 4.25 0.00 4.05 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 30 E 7.12 4.79 0.00 2.06 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 2.24 2.22 0.00 31 E 7.25 4.82 0.00 2.18 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 0.00 2.36 2.30 0.00 32 S 7.80 3.97 0.00 3.62 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 33 G 7.96 3.82 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 0.00 34 I 7.16 4.39 1.72 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.01 0.81 0.00 0.00 35 T 8.01 4.18 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 1.24 0.00 0.00 36 I 8.51 4.69 1.89 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 1.45 0.88 0.94 0.00 0.00 37 G 9.55 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 8.97 5.13 1.91 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 0.88 0.00 0.00 0.88 0.00 0.00 39 A 8.70 5.13 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 40 P 0.00 4.08 0.00 1.69 1.60 0.00 3.56 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.20 0.00 41 Q 8.35 3.93 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.82 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 42 F 8.15 4.22 0.00 3.21 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 7.89 3.73 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 0.77 0.00 0.00 0.98 0.00 0.00 44 D 8.07 4.80 0.00 2.77 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 45 L 7.53 3.89 0.00 1.81 1.62 1.02 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 46 R 7.77 4.05 0.00 2.02 2.18 0.00 2.97 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 47 M 7.85 4.02 0.00 2.29 2.10 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.63 0.00 48 I 7.48 3.91 1.80 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.73 0.87 0.00 0.00 49 V 7.30 3.57 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 0.87 0.00 0.00 0.90 0.00 0.00 50 E 7.87 4.13 0.00 1.93 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 2.33 2.59 0.00 51 N 7.66 4.68 0.00 2.75 2.85 0.00 0.00 6.80 7.56 0.00 0.00 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 V 8.02 4.33 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 0.85 0.00 0.00 0.94 0.00 0.00 53 N 8.40 4.79 0.00 2.71 2.86 0.00 0.00 6.93 7.55 0.00 0.00 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 I 6.96 4.64 2.06 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 1.43 0.61 0.92 0.00 0.00 55 P 0.00 4.07 0.00 2.22 1.94 0.00 3.77 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 2.16 2.07 0.00 56 V 8.05 4.59 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 0.96 0.00 0.00 0.92 0.00 0.00 57 Y 8.99 5.22 0.00 2.89 2.78 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 58 A 8.64 4.54 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Q 8.19 3.85 0.00 1.52 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.85 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 60 H 7.63 4.72 0.00 3.18 3.64 0.00 5.71 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 I 7.79 4.40 1.85 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 1.46 0.75 0.89 0.00 0.00 62 D 8.03 4.48 0.00 2.77 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 63 N 8.39 4.66 0.00 2.80 2.74 0.00 0.00 6.80 7.94 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 64 I 7.39 4.60 1.52 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.70 0.59 0.00 0.00 65 N 8.35 4.82 0.00 2.74 2.77 0.00 0.00 6.94 8.02 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 66 P 0.00 4.28 0.00 2.03 2.06 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.12 0.00 67 G 7.70 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 0.00 0.00 0.00 68 S 8.65 4.50 0.00 3.74 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 69 H 7.83 4.73 0.00 3.03 2.95 0.00 5.70 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.13 3.96 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 1.21 0.00 0.00 71 G 8.97 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 0.00 0.00 0.00 72 H 7.95 4.99 0.00 3.09 3.16 0.00 5.89 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 I 8.78 4.05 1.68 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 -0.16 0.92 0.00 0.00 74 L 8.33 4.36 0.00 1.67 1.51 1.05 1.29 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 75 A 8.86 4.01 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 76 E 8.18 4.03 0.00 2.06 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 2.40 2.43 0.00 77 A 7.60 4.07 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 I 7.55 3.85 2.03 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 1.63 1.37 0.94 0.00 0.00 79 K 7.92 4.02 0.00 1.76 1.80 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.42 1.69 7.81 80 D 7.59 4.35 0.00 2.82 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 81 C 7.65 4.36 0.00 3.11 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 82 G 7.44 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 83 C 7.65 4.28 0.00 2.93 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 84 K 8.57 3.93 0.00 1.57 1.10 0.00 1.51 0.00 0.00 1.86 0.00 0.00 2.70 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.31 7.81 85 G 7.25 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 0.00 0.00 0.00 0.00 86 T 9.10 5.21 4.32 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 1.27 0.00 0.00 87 L 9.26 5.38 0.00 1.78 1.57 0.86 0.21 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 88 I 8.04 4.60 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.04 0.95 0.00 0.00 89 N 8.79 4.26 0.00 2.87 3.04 0.00 0.00 6.98 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 90 H 7.98 4.47 0.00 3.22 3.14 0.00 5.74 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 S 8.14 4.20 0.00 3.96 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 0.00 92 E 8.42 4.26 0.00 1.98 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 2.29 2.33 0.00 93 K 7.71 4.57 0.00 1.65 1.64 0.00 1.75 0.00 0.00 1.52 0.00 0.00 2.66 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.23 1.33 7.81 94 R 7.89 4.19 0.00 1.85 1.85 0.00 3.21 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 95 M 8.13 4.76 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.58 0.00 96 L 8.02 4.35 0.00 1.88 1.59 0.95 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 97 L 8.33 3.92 0.00 1.71 1.66 0.92 1.02 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 98 A 7.95 4.09 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 99 D 7.89 4.34 0.00 3.05 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 0.00 100 I 7.69 3.84 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.80 0.96 0.00 0.00 101 E 7.98 3.92 0.00 2.04 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 2.31 2.47 0.00 102 A 7.78 4.08 1.44 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 0.00 0.00 103 V 7.66 3.53 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.00 0.00 0.00 104 I 7.94 3.72 1.95 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.31 0.92 0.00 0.00 105 N 7.99 4.33 0.00 2.88 2.86 0.00 0.00 7.02 8.36 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 0.00 106 K 8.26 4.00 0.00 1.94 1.86 0.00 1.65 0.00 0.00 1.64 0.00 0.00 3.13 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.69 7.81 107 C 8.46 4.23 0.00 3.11 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.19 4.22 0.00 1.91 2.00 0.00 1.60 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.63 1.47 7.81 109 N 7.67 4.63 0.00 2.85 2.91 0.00 0.00 6.88 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 0.00 110 L 7.55 4.58 0.00 1.60 1.69 0.92 1.24 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 0.00 111 G 7.93 3.87 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 0.00 0.00 0.00 112 L 8.20 4.62 0.00 1.52 1.64 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 113 E 9.57 4.48 0.00 2.12 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 2.42 2.34 0.00 114 T 9.65 4.67 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 0.00 115 I 8.50 4.50 1.82 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.02 0.78 0.00 0.00 116 V 8.39 4.45 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.94 0.00 0.00 117 C 9.09 4.89 0.00 2.92 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 0.00 118 T 9.63 4.77 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 1.26 0.00 0.00 119 N 8.92 4.90 0.00 2.80 2.87 0.00 0.00 5.88 8.04 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 0.00 120 N 8.19 5.06 0.00 2.73 2.74 0.00 0.00 6.70 8.15 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 0.00 121 I 7.94 3.97 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 1.65 1.53 0.91 0.00 0.00 122 N 8.08 4.41 0.00 2.75 2.90 0.00 0.00 6.93 7.05 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 0.00 123 T 7.80 4.15 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 0.00 124 S 7.62 4.13 0.00 4.00 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 0.00 125 K 7.83 4.18 0.00 1.93 1.93 0.00 1.60 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.65 1.49 7.81 126 A 7.40 4.13 1.42 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 0.00 0.00 127 V 7.64 3.60 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 1.00 0.00 0.00 0.97 0.00 0.00 128 A 7.89 4.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.55 4.08 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 0.00 130 L 7.90 4.05 0.00 1.81 1.74 0.96 0.74 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 0.00 131 S 7.29 3.63 0.00 4.05 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 0.00 132 P 0.00 4.69 0.00 2.18 2.09 0.00 3.76 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 1.96 1.98 0.00 133 D 9.09 4.64 0.00 2.88 2.77 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 0.00 0.00 0.00 0.00 134 C 8.70 5.16 0.00 2.73 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 0.00 135 I 8.69 5.53 1.86 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 1.10 1.39 0.95 0.00 0.00 136 A 8.65 5.00 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 0.00 137 V 8.72 4.52 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 0.93 0.00 0.00 0.97 0.00 0.00 138 E 8.59 4.91 0.00 1.84 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 2.17 2.27 0.00 *156 V 7.78 4.08 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 0.66 0.00 0.00 0.93 0.00 0.00 157 V 7.56 3.96 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 1.04 0.00 0.00 0.93 0.00 0.00 158 E 8.12 4.22 0.00 2.07 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 0.00 2.37 2.51 0.00 159 G 8.03 3.66 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 0.00 160 T 7.80 4.03 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 1.20 0.00 0.00 161 V 7.87 3.60 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.99 0.00 0.00 162 R 8.17 4.00 0.00 2.09 2.17 0.00 2.82 0.00 0.00 3.17 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.64 0.00 163 A 7.71 3.99 1.42 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 0.00 0.00 164 V 7.68 3.49 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 1.06 0.00 0.00 0.96 0.00 0.00 165 K 8.03 4.13 0.00 2.01 1.99 0.00 1.84 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.48 7.81 166 E 7.70 4.21 0.00 2.13 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 2.49 0.00 167 I 7.09 4.16 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 1.61 0.75 0.93 0.00 0.00 168 N 8.21 4.79 0.00 2.85 2.61 0.00 0.00 6.92 6.34 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 0.00 169 K 8.75 4.13 0.00 1.73 1.80 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.51 7.81 170 D 7.86 4.62 0.00 2.70 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 0.00 171 V 7.10 4.21 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 0.76 0.00 0.00 1.01 0.00 0.00 172 K 8.32 4.41 0.00 1.98 2.08 0.00 1.33 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.59 1.36 7.81 173 V 8.24 4.73 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 1.07 0.00 0.00 0.92 0.00 0.00 174 L 9.20 5.17 0.00 1.52 1.48 0.85 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 175 C 8.68 4.75 0.00 3.01 2.78 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 0.00 176 G 8.69 4.90 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 0.00 177 A 7.87 4.43 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 G 8.86 3.64 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 0.00 0.00 0.00 179 I 7.48 4.48 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 1.46 0.59 0.91 0.00 0.00 180 S 9.02 4.39 0.00 3.89 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 0.00 181 K 8.41 4.43 0.00 1.70 1.72 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.25 7.81 182 G 8.21 4.32 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 0.00 183 E 8.04 4.24 0.00 2.03 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 0.00 2.39 2.39 0.00 184 D 7.88 4.42 0.00 2.87 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 V 7.66 3.66 2.17 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 1.03 0.00 0.00 0.98 0.00 0.00 186 K 7.83 3.97 0.00 2.01 1.79 0.00 1.70 0.00 0.00 1.93 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.61 7.81 187 A 7.93 4.15 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 0.00 188 A 7.61 4.11 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 L 7.78 4.39 0.00 2.04 1.93 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 190 D 7.61 4.53 0.00 2.74 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 0.00 191 L 7.38 4.43 0.00 1.72 1.68 0.92 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 192 G 7.56 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 0.00 0.00 0.00 193 A 8.02 4.34 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 0.00 194 E 8.74 4.69 0.00 1.88 1.91 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 2.21 2.22 0.00 195 G 7.31 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 0.00 196 V 8.38 5.01 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 1.00 0.00 0.00 0.92 0.00 0.00 197 L 8.83 5.34 0.00 1.70 1.44 0.88 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 198 L 8.82 4.83 0.00 1.76 1.71 0.92 0.62 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 0.00 199 A 8.97 4.86 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 S 8.88 3.52 0.00 3.83 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 0.00 201 G 7.46 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 0.00 0.00 0.00 202 V 7.44 4.01 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 0.72 0.00 0.00 0.90 0.00 0.00 203 V 7.48 3.50 1.60 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 0.61 0.00 0.00 0.62 0.00 0.00 204 K 8.48 3.87 0.00 1.76 1.71 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.33 1.27 7.81 205 A 6.80 3.65 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 K 8.31 3.97 0.00 1.74 1.82 0.00 1.73 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.41 7.81 207 N 7.64 4.61 0.00 2.74 2.70 0.00 0.00 6.62 7.71 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 0.00 208 V 8.01 3.58 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 0.99 0.00 0.00 0.92 0.00 0.00 209 E 8.14 3.94 0.00 2.07 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 0.00 2.39 2.41 0.00 210 E 8.58 4.08 0.00 2.33 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 2.33 2.37 0.00 211 A 7.81 4.02 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 0.00 212 I 7.58 3.89 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 1.51 1.28 0.91 0.00 0.00 213 R 7.70 4.07 0.00 1.77 2.04 0.00 3.19 0.00 0.00 3.20 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.87 0.00 214 E 8.13 4.11 0.00 2.25 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 2.30 2.39 0.00 215 L 7.71 3.95 0.00 1.94 1.69 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 216 I 6.56 3.61 1.82 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.67 0.86 0.00 0.00 217 K 7.90 4.06 0.00 1.74 1.79 0.00 1.84 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.38 7.81 218 F 7.97 4.29 0.00 3.12 3.19 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 * Residues marked with a * may have inaccurate shift predictions.