NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 L 4.3946 8.0427 120.5797 54.8936 43.8892 175.3897 10 L 4.3336 8.1322 123.0259 53.7702 45.0505 172.6171 11 G 3.9571 8.7138 115.1965 45.5634 0.0000 171.7617 12 E 5.2299 8.8281 124.0619 54.3671 30.1487 174.1638 13 V 4.2412 8.3258 127.7273 61.9899 33.5696 173.8606 14 L 5.0841 8.2485 129.0680 53.7206 44.5017 175.9400 15 S 4.2304 9.1226 118.1732 58.6013 64.7868 174.1933 16 E 3.8232 10.2307 126.8040 57.3426 27.0378 175.7937 17 G 3.9659 8.3876 106.4464 43.8229 0.0000 173.3108 18 V 4.5015 7.9928 121.4083 61.3371 33.3107 174.4905 19 L 4.8263 8.8964 131.9320 54.0897 43.0898 175.4884 20 T 4.6760 8.7633 125.3414 62.7069 69.7335 174.7010 21 L 4.9428 9.3501 129.4864 53.6422 42.5939 175.6240 22 T 4.7432 8.6205 115.7822 60.2263 70.4785 174.3341 23 L 4.1121 8.7758 128.2030 54.8471 41.6658 177.6331 24 G 3.8443 8.2321 113.0059 45.9545 0.0000 172.6032 25 R 3.6745 8.6090 113.8688 56.8205 28.4517 176.9780 26 A 3.9640 7.8739 118.8130 52.0017 19.2947 176.2722 27 P 4.3116 0.0000 0.0000 64.5136 32.3694 177.5559 28 A 3.8899 7.8984 121.3992 53.3603 19.0736 176.3496 29 H 4.3431 7.3279 110.8695 55.0600 26.6458 173.2241 30 P 4.4110 0.0000 0.0000 62.9784 32.6426 177.9380 31 L 4.4264 8.1622 122.3444 53.5145 40.1319 176.2319 32 S 4.6839 7.6288 116.4975 56.9818 65.0323 175.3614 33 R 3.9261 8.6899 119.9785 59.5561 30.1782 178.3482 34 A 4.0440 7.9201 117.3046 52.9936 18.0577 178.7651 *36 I 4.0747 7.8916 121.6911 62.7922 39.3377 178.1382 37 A 4.0236 8.1275 121.7298 55.0875 18.0309 179.5995 38 A 3.9881 7.9817 118.9925 55.2552 18.5457 179.9221 39 L 3.9449 7.8444 117.1588 58.1174 41.7714 178.9869 40 H 4.3880 8.3331 118.3559 58.9708 29.8099 176.8925 41 D 4.2710 8.2478 119.9143 57.3206 40.9001 178.1540 42 A 4.0626 8.0645 120.2286 54.8334 18.3790 179.0344 43 L 4.1125 7.6200 118.2987 58.0211 42.2181 179.1171 44 R 4.0637 7.8209 117.3714 58.8735 31.4372 178.7043 45 R 4.4270 7.7025 117.2954 53.9069 26.6612 177.2114 46 A 4.3566 7.2022 116.5513 53.6668 21.7186 178.4144 *48 G 3.8084 8.0358 106.9820 45.6905 0.0000 172.8144 49 D 4.6161 7.6043 120.1086 52.6898 41.3757 176.5556 50 D 4.4456 8.6336 126.9383 57.2734 41.6571 176.9832 51 H 4.3880 8.2526 116.1696 57.8734 29.0090 175.3246 52 V 4.3427 7.5220 119.3528 62.3445 32.2327 174.3829 53 H 4.9499 9.4435 123.7927 56.7051 31.0734 174.7932 54 V 4.6732 7.6951 116.5800 60.9897 35.0967 174.1591 55 L 5.2353 8.9495 126.8339 53.1496 44.8026 175.7847 56 V 4.8545 8.5465 121.3797 61.4817 34.8878 174.0347 57 I 4.7555 9.0075 130.1086 60.4016 39.0949 174.4850 58 H 5.1259 9.5086 127.1037 54.6097 33.0749 172.2515 59 G 4.2942 8.6166 111.4683 42.5855 0.0000 170.6623 60 P 4.5816 0.0000 0.0000 63.6051 32.2423 177.5901 61 G 3.8662 9.4985 107.5317 43.9943 0.0000 173.5238 62 R 4.1221 8.6758 113.6934 58.5909 30.3952 176.5121 63 I 4.8755 7.5084 119.5356 59.5762 39.9150 175.3513 64 F 4.7071 9.3716 130.3352 60.0054 40.5386 174.6430 65 C 4.9622 7.7002 114.2802 58.5547 34.0511 173.9644 66 A 3.9644 9.2635 129.2164 52.6798 18.9021 173.6952 67 G 3.4811 8.4722 110.6989 45.6518 0.0000 169.3944 68 H 4.4613 8.6922 129.5579 53.9139 28.4201 174.6528 69 D 4.4624 8.7575 124.3601 54.2470 42.0452 177.0498 70 L 4.3383 8.4025 130.0040 53.3459 40.3363 177.3691 71 K 4.2990 7.5441 117.1100 54.9350 33.2979 176.7838 72 E 4.2133 8.5867 124.8161 55.9146 30.0830 176.4594 73 I 4.1976 7.7304 128.5706 60.2180 38.5644 174.3894 *82 E 4.2462 8.5388 120.9381 56.7870 31.4907 177.0262 83 G 3.9442 8.4049 106.6530 45.9592 0.0000 175.6685 84 R 3.7363 8.6113 120.4892 59.2362 29.9362 176.0153 85 A 4.2407 8.0541 123.9002 53.3316 18.0089 176.9709 86 F 5.3824 8.3257 132.4479 60.1124 37.7937 176.3891 87 V 2.8366 6.9394 119.6755 65.7886 31.1476 178.3557 88 T 3.8561 7.6938 115.6936 66.6034 68.3906 176.3998 89 D 4.2563 7.7078 119.4723 56.9114 41.1821 177.8220 90 L 3.5246 7.7459 121.2821 58.1674 42.0370 179.1211 91 F 4.5512 7.5514 117.5067 60.3474 38.7096 177.7039 92 E 4.0138 8.2699 118.5473 59.2042 29.4247 179.0400 93 A 4.0621 7.9914 120.9110 55.0016 18.2070 179.3226 94 C 4.1107 8.1565 116.8083 62.8649 31.7930 175.7624 95 S 4.2642 8.1993 115.5173 61.3611 62.6255 176.2352 96 A 4.1972 7.8744 123.5065 54.7801 18.0762 179.3887 97 L 3.3797 7.4690 114.9449 55.8855 41.7922 178.1928 *99 L 4.1510 7.8203 120.9521 54.7806 43.7057 178.6017 100 D 4.4136 7.9877 117.2030 57.2137 41.1415 177.6694 101 L 4.0697 8.2392 120.9379 57.9752 42.2633 178.8799 102 A 4.2018 7.8616 119.3291 54.4506 18.5184 177.4835 103 H 4.7928 7.9541 111.0751 55.7605 27.8477 174.4870 104 C 4.3667 7.7285 122.4277 58.1917 31.6130 172.8753 105 P 4.4582 0.0000 0.0000 64.9422 31.3264 176.1842 106 K 4.5418 7.1886 117.9229 54.5798 33.2159 175.4655 107 P 4.6732 0.0000 0.0000 63.1251 32.6314 175.1063 108 T 5.1284 8.9505 114.6065 59.9349 71.5420 173.1290 109 I 5.1482 8.7090 125.1527 59.4663 41.0742 174.0875 110 A 5.1563 9.0668 128.5410 50.4552 20.3691 175.7246 111 L 4.9093 8.9403 124.5533 53.3737 44.1059 174.9599 112 V 4.4058 8.7594 127.4585 61.1753 32.5056 175.1311 113 E 4.4908 8.4809 124.9320 55.4633 30.4169 176.1604 114 G 4.0276 7.3670 107.4272 45.8632 0.0000 171.0175 115 I 4.2167 8.3919 121.7652 60.4998 39.4715 176.1995 116 A 5.1237 8.7014 132.1445 50.8019 20.1744 174.7176 117 T 4.7765 8.5177 115.3074 61.4380 70.7761 175.0343 118 A 3.7480 9.0031 130.7235 53.3917 18.6568 180.6957 119 A 4.3161 8.8876 126.6760 55.8958 18.0719 179.9046 120 G 3.6611 8.2605 104.6638 47.4844 0.0000 175.5877 121 L 4.2773 7.7535 121.5552 57.7748 42.3014 178.4506 122 Q 4.1703 8.0048 119.3287 58.9461 28.8356 177.9406 123 L 4.0957 7.5016 115.4661 56.5967 41.4438 177.1381 *125 A 4.2676 7.9702 121.8121 51.9661 20.4084 178.8732 126 A 4.0405 8.2525 117.5171 53.6856 18.8746 177.2347 127 C 4.5849 7.2134 114.2887 59.0047 29.1201 173.6038 128 D 4.6017 8.6876 123.2018 57.0627 40.9266 176.9274 129 L 4.8860 8.2377 116.1800 52.9107 46.6475 175.8221 130 A 4.9760 7.7313 121.5546 50.7380 22.7444 174.6688 131 Y 5.0900 8.9267 119.0961 56.1991 42.0726 174.6395 132 A 5.9400 9.1596 123.3410 49.8307 23.5329 175.2290 133 S 5.6016 8.7692 113.4540 55.6857 65.1438 173.7885 134 P 4.4120 0.0000 0.0000 65.3270 31.2600 177.3694 135 A 4.1104 7.3455 118.0577 53.5216 18.6402 177.3572 136 A 4.1810 7.5771 118.4690 51.4556 18.8255 177.4034 137 R 4.7930 8.2244 120.9011 54.3188 33.8769 174.9904 138 F 5.3760 9.0505 120.3386 56.0683 42.9902 173.8008 139 C 4.9700 8.5950 116.1485 57.6715 33.6181 172.8379 140 L 5.2093 8.3229 120.0942 51.9678 42.4821 174.6580 141 P 4.5373 0.0000 0.0000 62.7245 31.8549 179.1107 142 G 3.7582 8.2365 108.5432 48.9572 0.0000 176.3969 143 V 3.8534 7.5929 112.6034 63.8494 31.6667 178.0883 144 Q 4.2016 7.8841 117.2553 58.0021 28.6975 176.4418 145 N 4.6435 8.0016 114.7979 52.9836 38.8421 175.1808 146 G 4.0319 9.0608 105.9885 45.9850 0.0000 173.8730 147 G 4.1160 7.8524 113.3144 43.8248 0.0000 172.1460 148 F 4.1669 8.3297 129.4839 58.4195 42.4678 175.0259 *150 T 4.6537 8.6177 111.7705 63.6736 70.2480 176.1457 151 T 4.1358 7.6800 111.1347 63.9357 69.3163 174.6644 152 P 4.2836 0.0000 0.0000 64.9577 31.5117 177.9280 153 A 4.1102 7.5142 120.4356 54.0810 17.9571 179.7678 154 V 3.4763 7.3176 116.7064 66.1320 31.5370 177.7164 155 A 4.1161 7.8772 120.0836 55.1523 18.3212 179.6304 156 V 3.5875 7.9992 117.0981 65.9202 31.3824 178.2968 157 S 4.2596 8.0529 112.9699 60.4788 62.9584 175.5850 158 R 4.3424 7.4138 119.1774 56.3416 30.3284 176.6354 159 V 4.1771 7.6179 117.8777 62.4403 33.4717 174.7562 160 I 4.6784 7.3040 110.7575 57.6661 40.9233 175.4252 161 G 3.7374 8.0669 106.8171 44.0939 0.0000 174.4271 162 R 3.9004 8.4847 120.8689 59.7304 30.0985 179.0899 163 R 3.9777 8.0255 116.8262 59.1127 29.8379 178.8205 164 A 4.2381 7.8739 119.4558 55.2660 18.5688 179.4104 165 V 3.7232 7.5728 115.4972 66.2999 31.9095 178.0388 166 T 4.1453 7.9341 115.5906 66.4322 68.4017 176.0795 167 E 4.3066 8.2614 119.7359 56.6350 29.6980 178.2813 *169 A 3.9797 7.9504 121.5146 51.5822 20.4556 179.1032 170 L 4.3129 8.0872 114.8865 57.4937 42.0035 178.4407 171 T 4.0934 7.9146 107.5502 62.0922 69.4891 176.0330 172 G 4.0638 8.2409 107.2754 45.0988 0.0000 173.0965 173 A 4.1317 7.5223 122.6208 51.5546 19.0985 177.4613 174 T 4.6857 7.8379 109.7588 60.5869 70.2906 173.8156 175 Y 4.7254 9.0963 124.2128 56.0043 41.2163 175.4994 176 D 5.1978 8.7421 122.5627 52.3839 41.7091 176.9909 177 A 4.3257 8.9654 119.6533 55.6111 18.2987 179.4108 178 D 4.3481 8.3271 116.9199 57.2742 40.9551 178.7107 179 W 4.0451 8.4566 128.8292 60.3966 30.6902 177.9794 180 A 3.7519 8.3213 120.8464 54.7940 17.5126 179.4809 181 L 3.6976 8.1919 119.0880 58.2670 42.0576 179.0449 182 A 3.8733 7.5821 118.3793 54.1212 18.3573 178.5902 183 A 3.8359 7.3085 118.0192 52.0420 18.9568 178.2490 184 G 3.6525 7.1211 105.1192 45.7319 0.0000 174.6113 185 L 3.8997 7.8211 124.3611 56.3680 42.1878 176.9023 186 I 4.4333 6.9654 109.0647 58.7960 40.4260 174.5886 187 N 4.4929 8.5174 118.6368 55.5508 39.3723 175.7301 188 R 4.5677 7.4477 115.5431 55.4652 33.7064 173.4315 189 I 5.0376 8.4277 125.1330 59.7650 39.0660 175.0144 190 L 4.9346 8.8139 126.2350 51.9043 46.0873 174.7525 191 P 4.5524 0.0000 0.0000 62.5271 32.1464 177.2378 192 E 3.9427 9.0958 121.5506 60.0697 29.4874 179.7748 193 A 4.1422 8.0154 117.6576 54.1853 18.9911 178.4793 194 A 4.3158 7.7516 118.2064 53.3238 18.9691 178.9018 195 L 3.8598 7.9595 119.3663 58.3397 42.1569 178.9488 196 A 4.0019 7.9639 120.1143 55.5540 18.3812 179.6288 197 T 3.8564 7.8398 107.7538 65.1138 68.9449 176.0403 198 H 4.0306 8.1222 120.6854 58.8840 29.7292 177.4325 199 V 3.4305 7.5050 119.4521 65.6008 31.4295 177.9541 200 A 3.9644 7.9267 120.5787 55.0658 18.1568 179.4579 201 D 4.2147 8.3992 117.9577 57.3802 41.0297 178.7450 202 L 3.8404 7.6974 120.5765 58.0727 42.0967 178.8975 203 A 4.1494 8.3102 121.1071 54.9181 18.2944 179.9236 204 G 3.5015 8.1056 104.2584 47.8716 0.0000 175.9168 205 A 4.0475 7.7908 122.3117 54.8722 18.7955 179.4562 206 L 4.0750 7.9477 117.2053 57.7403 41.4836 179.4001 207 A 4.2254 7.8503 119.5885 54.3098 18.4886 178.6618 208 A 4.2892 7.6153 116.9005 52.3503 19.2416 177.8905 209 R 4.0421 6.7388 115.0957 54.9591 31.2741 175.9735 210 N 4.3105 8.4534 117.8154 53.8762 38.8918 175.4114 211 Q 4.0006 8.7743 126.1458 58.8780 28.9077 178.6752 212 A 3.9707 7.8773 121.1396 54.9397 18.5672 177.8569 213 P 4.2373 0.0000 0.0000 64.8518 31.4889 178.7338 214 L 3.9031 7.3944 118.8538 58.2430 42.0136 179.2377 215 R 4.4127 7.9702 119.3652 58.8762 30.0166 179.2816 216 R 4.1580 8.0653 117.5812 58.8518 30.0743 179.3280 217 G 3.6315 8.2640 105.9586 47.6441 0.0000 175.5733 218 L 4.0801 7.9504 122.4887 57.3995 41.9484 178.6276 219 E 3.9306 8.0115 119.2962 59.5179 29.5101 178.9396 220 T 3.9067 8.0992 115.9152 66.2285 67.9541 176.5536 221 L 3.6032 7.8201 122.2579 58.3135 41.9577 178.8412 222 N 4.3188 7.6971 114.5324 56.2927 38.5652 177.4568 223 R 4.0431 7.7236 119.7482 59.3877 30.1685 178.5406 224 H 4.4015 8.3977 114.3496 57.7038 28.4442 177.1232 225 L 4.1973 7.4092 120.1811 56.4440 41.4434 177.2330 226 E 4.6495 7.5498 117.5001 55.7222 29.7596 175.3675 227 L 4.8882 7.3819 117.8046 51.5335 45.7532 175.3638 228 P 4.4992 0.0000 0.0000 61.9499 33.3972 177.3078 229 L 3.8312 8.5087 121.2434 58.4802 41.7012 179.0416 230 E 3.9777 8.1217 118.4198 59.6752 29.8792 178.7381 231 Q 4.0824 8.0801 116.7457 58.2378 28.8947 178.2385 232 A 3.9945 8.0500 122.5669 55.2667 18.3327 179.2388 233 Y 4.1463 8.0405 115.0031 60.9033 37.7177 178.1995 234 A 4.0386 7.6648 121.4421 54.6412 18.4910 178.9948 235 L 4.1269 7.6429 117.5669 57.9639 42.1457 178.5355 236 A 4.1672 8.1582 120.7744 55.1626 18.0707 179.6389 237 T 3.8864 7.9536 113.7050 66.6095 68.9373 174.8897 238 P 4.4609 0.0000 0.0000 64.7451 31.3476 178.0110 239 V 3.6746 7.2836 116.3121 63.2714 30.8787 177.8974 *241 V 4.0386 7.9292 119.6190 62.3752 33.0587 176.9244 242 E 4.0589 8.2136 119.3534 59.5033 29.6771 177.5725 243 H 4.4494 8.0309 114.8156 58.9183 28.8198 175.8627 244 F 4.2267 7.8378 116.1119 57.7803 38.9741 175.0089 *246 D 4.3942 7.9501 118.5029 53.5228 41.9834 174.5006 247 P 4.5977 0.0000 0.0000 61.1529 28.9487 176.7324 248 G 3.7256 7.7991 110.1233 46.1108 0.0000 170.9689 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 9 L 8.04 4.39 0.00 1.62 1.65 0.92 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.13 4.33 0.00 1.69 1.50 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 11 G 8.71 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 12 E 8.83 5.23 0.00 1.94 1.96 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 2.15 2.26 0.00 13 V 8.33 4.24 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 0.98 0.00 0.00 0.94 0.00 0.00 14 L 8.25 5.08 0.00 1.65 1.50 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 15 S 9.12 4.23 0.00 3.86 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 16 E 10.23 3.82 0.00 2.12 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 0.00 2.21 2.27 0.00 17 G 8.39 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 18 V 7.99 4.50 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 0.92 0.00 0.00 0.94 0.00 0.00 19 L 8.90 4.83 0.00 1.80 1.57 0.98 0.75 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 20 T 8.76 4.68 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 1.25 0.00 0.00 21 L 9.35 4.94 0.00 1.68 1.64 0.94 0.69 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 22 T 8.62 4.74 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 23 L 8.78 4.11 0.00 1.27 1.30 0.79 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.23 3.84 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 0.00 0.00 0.00 25 R 8.61 3.67 0.00 1.99 1.92 0.00 3.20 0.00 0.00 3.34 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 26 A 7.87 3.96 1.24 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 27 P 0.00 4.31 0.00 2.12 2.13 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 1.90 1.91 0.00 28 A 7.90 3.89 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 29 H 7.33 4.34 0.00 3.17 3.15 0.00 5.63 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.41 0.00 2.05 2.01 0.00 3.66 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 31 L 8.16 4.43 0.00 1.75 1.61 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 32 S 7.63 4.68 0.00 4.04 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 33 R 8.69 3.93 0.00 1.98 2.09 0.00 3.17 0.00 0.00 3.18 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.73 0.00 34 A 7.92 4.04 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 *36 I 7.89 4.07 1.95 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 1.37 0.71 0.92 0.00 0.00 37 A 8.13 4.02 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 38 A 7.98 3.99 1.40 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 0.00 0.00 0.00 39 L 7.84 3.94 0.00 1.86 1.74 0.90 1.02 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 40 H 8.33 4.39 0.00 3.37 3.27 0.00 5.61 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 D 8.25 4.27 0.00 2.98 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 3.49 3.27 0.00 5.66 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 7.52 4.34 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 0.78 0.00 0.00 1.01 0.00 0.00 53 H 9.44 4.95 0.00 3.08 3.43 0.00 5.67 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 54 V 7.70 4.67 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 1.02 0.00 0.00 55 L 8.95 5.24 0.00 1.68 1.57 0.95 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 56 V 8.55 4.85 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 1.04 0.00 0.00 0.97 0.00 0.00 57 I 9.01 4.76 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 1.18 0.56 1.00 0.00 0.00 58 H 9.51 5.13 0.00 3.24 3.15 0.00 5.74 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 59 G 8.62 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 110 A 9.07 5.16 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.94 4.91 0.00 1.89 1.75 0.97 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.76 4.41 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 0.64 0.00 0.00 0.14 0.00 0.00 113 E 8.48 4.49 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 114 G 7.37 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 0.00 0.00 0.00 115 I 8.39 4.22 1.79 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 1.12 1.69 0.95 0.00 0.00 116 A 8.70 5.12 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.52 4.78 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 1.26 0.00 0.00 118 A 9.00 3.75 1.08 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 8.69 4.60 0.00 2.78 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 0.00 129 L 8.24 4.89 0.00 1.63 1.36 1.07 0.90 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 0.00 130 A 7.73 4.98 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Y 8.93 5.09 0.00 2.96 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 0.00 132 A 9.16 5.94 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 0.00 133 S 8.77 5.60 0.00 4.06 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 0.00 134 P 0.00 4.41 0.00 2.24 2.27 0.00 3.90 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.99 0.00 135 A 7.35 4.11 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 0.00 136 A 7.58 4.18 1.16 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 0.00 0.00 137 R 8.22 4.79 0.00 1.63 1.76 0.00 3.04 0.00 0.00 3.31 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.56 0.00 138 F 9.05 5.38 0.00 3.04 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 C 8.60 4.97 0.00 3.07 3.08 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 0.00 140 L 8.32 5.21 0.00 1.48 1.46 0.84 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 141 P 0.00 4.54 0.00 2.20 2.24 0.00 3.71 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.96 0.00 142 G 8.24 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 V 7.59 3.85 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 0.96 0.00 0.00 0.99 0.00 0.00 144 Q 7.88 4.20 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.02 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 145 N 8.00 4.64 0.00 2.84 2.86 0.00 0.00 7.00 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 0.00 146 G 9.06 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 0.00 0.00 0.00 147 G 7.85 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 0.00 148 F 8.33 4.17 0.00 2.94 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 *150 T 8.62 4.65 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 151 T 7.68 4.14 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 152 P 0.00 4.28 0.00 2.28 2.40 0.00 3.63 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 153 A 7.51 4.11 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 0.00 154 V 7.32 3.48 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 0.84 0.00 0.00 0.99 0.00 0.00 155 A 7.88 4.12 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 0.00 156 V 8.00 3.59 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 0.97 0.00 0.00 157 S 8.05 4.26 0.00 4.08 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 0.00 158 R 7.41 4.34 0.00 1.80 1.98 0.00 3.26 0.00 0.00 3.14 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.75 0.00 159 V 7.62 4.18 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 0.74 0.00 0.00 0.94 0.00 0.00 160 I 7.30 4.68 1.66 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 1.51 0.80 0.72 0.00 0.00 161 G 8.07 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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2.74 0.00 0.00 6.71 7.60 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 0.00 188 R 7.45 4.57 0.00 2.04 2.02 0.00 3.27 0.00 0.00 3.36 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 189 I 8.43 5.04 1.90 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 1.40 0.77 0.96 0.00 0.00 190 L 8.81 4.93 0.00 1.58 1.46 0.85 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 191 P 0.00 4.55 0.00 2.18 1.98 0.00 3.62 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 2.11 2.11 0.00 192 E 9.10 3.94 0.00 1.92 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.51 0.00 193 A 8.02 4.14 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 A 7.75 4.32 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 0.00 195 L 7.96 3.86 0.00 1.93 1.86 1.02 0.97 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 G 8.11 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.79 4.05 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 0.00 206 L 7.95 4.08 0.00 1.95 1.74 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 207 A 7.85 4.23 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 0.00 208 A 7.62 4.29 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 R 6.74 4.04 0.00 1.96 1.84 0.00 3.31 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.69 0.00 210 N 8.45 4.31 0.00 2.74 2.66 0.00 0.00 6.89 7.12 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 0.00 211 Q 8.77 4.00 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.34 1.93 0.00 212 A 7.88 3.97 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 0.00 213 P 0.00 4.24 0.00 2.00 1.75 0.00 3.77 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 2.01 2.08 0.00 214 L 7.39 3.90 0.00 1.95 1.83 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 215 R 7.97 4.41 0.00 1.90 1.96 0.00 3.17 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 216 R 8.07 4.16 0.00 1.97 2.03 0.00 3.20 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 217 G 8.26 3.63 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 0.00 0.00 0.00 218 L 7.95 4.08 0.00 1.92 1.67 0.96 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 0.00 219 E 8.01 3.93 0.00 2.31 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 0.00 2.29 2.34 0.00 220 T 8.10 3.91 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 1.26 0.00 0.00 221 L 7.82 3.60 0.00 1.85 1.77 0.84 0.67 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 0.00 222 N 7.70 4.32 0.00 2.72 2.83 0.00 0.00 7.17 7.20 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 0.00 223 R 7.72 4.04 0.00 1.99 1.94 0.00 3.19 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 224 H 8.40 4.40 0.00 3.29 3.53 0.00 5.46 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 L 7.41 4.20 0.00 1.77 1.74 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 226 E 7.55 4.65 0.00 1.87 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 227 L 7.38 4.89 0.00 1.68 1.51 0.92 1.07 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 0.00 228 P 0.00 4.50 0.00 2.16 1.96 0.00 3.62 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 2.11 2.13 0.00 229 L 8.51 3.83 0.00 1.68 1.72 1.13 0.60 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 0.00 230 E 8.12 3.98 0.00 2.07 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 0.00 2.41 2.37 0.00 231 Q 8.08 4.08 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 232 A 8.05 3.99 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 0.00 233 Y 8.04 4.15 0.00 3.30 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 0.00 234 A 7.66 4.04 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 0.00 235 L 7.64 4.13 0.00 1.67 1.86 0.93 1.04 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 0.00 236 A 8.16 4.17 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 0.00 237 T 7.95 3.89 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 238 P 0.00 4.46 0.00 2.16 2.10 0.00 3.83 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 2.12 2.14 0.00 239 V 7.28 3.67 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 0.88 0.00 0.00 0.99 0.00 0.00 *241 V 7.93 4.04 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 0.92 0.00 0.00 1.00 0.00 0.00 242 E 8.21 4.06 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 243 H 8.03 4.45 0.00 3.35 3.27 0.00 5.70 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 F 7.84 4.23 0.00 3.20 3.13 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 0.00 *246 D 7.95 4.39 0.00 2.84 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 0.00 247 P 0.00 4.60 0.00 2.07 2.00 0.00 3.77 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 2.02 2.08 0.00 248 G 7.80 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.