NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.9095 8.2833 118.2143 52.2204 38.8418 174.9645 2 L 4.1027 8.3073 118.2258 56.8115 41.1837 175.0191 3 V 3.6211 8.8268 119.3638 66.0536 32.1358 176.9166 4 N 4.5250 8.3945 116.3874 56.8332 38.3524 176.9872 5 F 4.5021 8.3882 121.4707 61.7625 39.6626 176.6649 6 H 3.9370 8.5635 118.0808 58.9460 29.6265 177.3345 7 R 3.9525 8.5263 120.9627 59.8737 29.9753 178.1316 8 M 4.0533 8.4754 118.9001 58.7056 31.8725 179.0464 9 I 3.6288 7.8402 119.7164 64.2876 37.2751 178.4020 10 K 4.0111 7.8002 118.9137 59.7832 31.6656 179.3408 11 L 4.0519 7.8562 117.9025 57.3125 41.5690 178.6813 12 T 4.4648 7.6268 114.1948 63.8402 70.1692 175.7769 13 T 4.4940 8.4097 110.2846 60.6709 69.9011 175.9371 14 G 4.1362 8.2658 112.1406 45.7985 0.0000 174.7718 15 K 3.9713 7.8169 118.9557 56.4195 32.1735 177.5780 16 E 4.1809 9.1229 123.3679 55.4993 28.4273 178.6513 17 A 3.9471 7.4955 126.0062 54.7198 20.1477 179.8256 18 A 4.0335 8.3013 118.1614 54.3820 18.7453 178.7516 19 L 4.7070 7.5316 115.2054 56.4160 43.7795 177.7891 20 S 4.2840 7.9401 111.3495 59.6202 63.3965 174.1855 21 Y 4.6592 8.1372 117.0121 57.7127 39.6392 177.7306 22 G 3.6992 8.1368 107.2422 47.1654 0.0000 174.0276 23 F 4.8997 7.8458 114.8030 56.7469 40.9045 173.8629 24 Y 3.9639 7.4809 122.7483 58.3910 39.7954 176.0320 25 G 3.4963 7.6072 115.5776 47.3017 0.0000 176.2835 26 C 5.0422 8.9682 119.7875 56.3199 41.7468 174.3077 27 H 4.7390 8.6881 113.3867 55.1586 30.2075 172.6373 28 C 4.7015 7.7735 117.1101 56.3425 41.2043 172.7682 29 G 3.5893 8.8512 109.5044 43.8283 0.0000 172.9601 30 V 3.5594 8.0114 118.5445 64.0769 32.0510 177.2881 31 G 3.8460 8.5910 115.1542 46.6181 0.0000 172.0700 32 G 5.1546 7.5063 114.1061 45.8430 0.0000 172.2561 33 R 4.6186 8.0121 122.3574 55.2154 34.5614 177.5269 34 G 3.9592 8.4394 107.8033 47.0797 0.0000 173.0758 35 S 4.3720 8.5240 121.6931 57.3438 63.5195 172.2135 36 P 4.6045 0.0000 0.0000 62.2865 31.7593 176.0187 37 K 3.6917 8.2973 124.3106 59.1808 32.4370 175.8603 38 D 4.4882 7.3384 115.3549 52.0851 41.4958 175.0219 39 A 4.1392 8.5797 118.4284 55.4260 18.5553 180.0748 40 T 3.9201 7.8545 113.5539 66.6140 68.8472 176.1067 41 D 4.5367 8.6107 120.1512 57.4409 40.8653 178.3205 42 R 3.9879 8.3787 119.2395 59.3101 29.8232 177.7848 43 C 4.3750 8.2744 116.7137 60.1477 39.1571 175.1393 44 C 4.2267 8.4718 117.9584 59.2735 37.0104 176.2253 45 V 3.4437 7.4259 119.5121 66.2373 31.1230 178.0364 46 T 3.7852 7.8009 114.8979 66.9858 68.3577 175.9528 47 H 4.0140 7.8920 120.0825 59.1814 29.7730 176.8023 48 D 4.2546 8.0027 120.7476 57.6239 40.5551 178.3466 49 C 4.2444 8.0866 116.7261 60.0897 40.6285 175.1414 50 C 4.1314 8.0626 119.9205 60.1623 42.7545 175.2209 51 Y 3.9423 8.0577 118.0840 60.9330 37.4101 178.6542 52 K 3.9344 8.4159 120.8723 59.5841 32.0874 179.0850 53 R 3.9068 8.0276 117.3613 59.2943 30.3154 178.8049 54 L 4.0752 8.1341 118.9919 57.5459 41.5770 179.0641 55 E 4.1834 8.2761 120.9053 58.6599 29.3289 179.2403 56 K 4.5670 8.1903 116.4693 57.3805 31.8245 178.5160 57 R 4.5103 7.3356 113.3991 55.8514 31.9103 179.2222 58 G 3.9743 8.8237 105.6595 47.0376 0.0000 173.7215 59 C 4.5263 8.0083 117.5354 56.0193 41.1072 173.6134 60 G 4.2300 8.2310 111.2363 44.9763 0.0000 173.4507 61 T 4.1037 8.1331 107.0872 61.2842 69.4967 175.7397 62 K 3.5944 8.5775 123.6989 58.4980 32.9652 177.8518 63 F 4.7329 7.6748 113.6578 56.6577 40.2309 173.7792 64 L 4.5573 7.9412 124.2089 53.1291 42.5469 176.6086 65 S 4.3982 8.7525 120.6727 57.9489 63.7672 172.5768 66 Y 4.9956 7.5856 118.8407 55.8543 41.3126 173.7450 67 K 5.0042 9.5428 119.7753 54.8938 35.0229 175.6882 68 F 5.4853 8.3348 116.5795 55.8202 41.2780 173.4387 69 S 4.7592 9.4682 117.2078 57.1358 64.9308 172.6441 70 N 5.1462 8.7020 122.6503 52.4913 40.7102 175.1600 71 S 4.5606 8.8002 121.1269 57.2218 65.4775 176.8054 72 G 3.9172 8.3855 118.3902 46.7076 0.0000 173.9147 73 S 4.3864 9.1472 119.7904 58.4303 64.0274 173.7543 74 R 4.3749 8.1749 123.4955 55.1594 30.5509 174.9029 75 I 5.0088 8.1463 125.7528 60.3353 39.7636 175.1972 76 T 4.7221 9.0819 120.7409 61.9810 72.3109 172.7708 77 C 4.9437 8.9542 123.7061 56.5063 41.0041 173.5992 78 A 4.3381 8.4769 125.1487 51.6305 19.2495 177.3205 79 K 4.2083 8.4758 119.0061 56.1168 32.2962 176.6159 80 Q 4.5020 8.1045 123.6078 53.7599 32.5590 174.9848 81 D 4.6308 8.4426 117.6975 53.5746 41.6164 176.8562 82 S 4.0833 8.6433 116.8352 62.2584 62.7330 177.7840 83 C 4.1828 8.1320 118.1830 60.1491 34.4903 175.9884 84 R 3.8595 7.9542 120.3520 59.3930 29.6423 178.7112 85 S 4.0689 8.3438 114.2093 61.5786 63.4503 176.5088 86 Q 3.9841 8.2005 121.6294 57.7983 28.3036 178.3858 87 L 3.8723 8.0174 122.2186 57.6108 42.1059 177.9195 88 C 3.0600 7.3771 118.2000 59.2455 41.8008 175.2552 89 E 3.7574 7.9262 120.0396 59.5435 28.5509 178.2517 90 C 3.8670 7.7203 117.9485 60.0789 38.5419 175.7625 91 D 3.9950 7.7811 119.8799 57.2383 40.5991 178.7632 92 K 3.9185 8.3226 120.0939 59.2264 32.0589 178.5665 93 A 3.9467 8.3608 121.4351 54.5052 18.2622 179.2874 94 A 3.5210 7.4107 118.1480 54.4551 18.5977 179.5021 95 A 3.7269 8.2960 119.6206 55.5841 18.4056 179.9351 96 T 3.7400 7.5884 113.7432 67.0059 68.6514 175.9738 97 C 4.2181 7.9504 120.2289 59.8452 43.3799 175.6767 98 F 4.3001 7.8157 118.0567 60.1355 38.5667 177.4174 99 A 4.1439 7.7740 120.8727 55.1787 18.0744 179.5015 100 R 3.9256 8.1445 115.7865 59.4805 30.4007 178.1169 101 N 4.7976 7.9872 113.5886 53.2450 38.5794 176.8306 102 K 3.9932 8.5460 125.0165 59.6961 31.8932 178.6486 103 T 3.8771 7.9697 108.4118 64.9952 68.5090 175.0316 104 T 4.1175 7.5572 116.1440 63.9316 68.6709 173.8275 105 Y 3.9040 8.2003 124.3827 58.0453 38.9887 174.3710 106 N 4.9755 8.7629 126.7573 51.7308 40.1651 176.0457 107 K 4.1273 8.6824 125.2260 59.2217 32.5651 179.0331 108 K 3.6753 8.0799 118.1437 59.4182 32.1032 177.1346 109 Y 4.5515 7.2914 114.3165 58.0693 38.4864 177.0964 110 Q 3.6260 7.9114 122.4809 58.8800 29.0013 178.4644 111 Y 4.7106 7.4715 113.2232 57.3477 38.6860 175.3506 112 Y 4.0443 8.1661 122.2471 57.6437 39.2820 175.5692 113 S 4.0916 8.2573 123.8845 58.7193 62.5226 174.7672 114 N 4.6098 8.6921 123.2571 54.2474 38.8335 177.0253 115 K 3.7041 7.9874 119.8010 59.8461 31.9703 176.6869 116 H 4.7666 7.4245 112.4490 55.7573 28.5407 174.2185 117 C 4.7244 8.0742 118.7843 56.1977 39.6839 173.1589 118 R 4.7418 8.4148 124.3887 54.9401 33.3124 173.4819 119 G 3.8454 8.6801 105.5105 44.1024 0.0000 173.2363 120 S 4.0893 7.9970 115.7020 57.7317 62.5048 175.0433 121 T 3.7506 8.6549 120.8136 65.6278 65.3713 171.8773 122 P 3.7502 0.0000 0.0000 65.0912 32.0790 175.4149 123 R 4.0957 7.4769 118.5064 56.8534 31.6323 175.1587 124 C 4.4572 8.5716 120.6591 57.3351 41.3180 173.3980 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 N 8.28 4.91 0.00 3.22 3.20 0.00 0.00 6.14 5.79 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 0.00 2 L 8.31 4.10 0.00 1.78 1.88 0.87 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 3 V 8.83 3.62 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 1.21 0.00 0.00 0.99 0.00 0.00 4 N 8.39 4.52 0.00 2.90 2.72 0.00 0.00 6.73 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 5 F 8.39 4.50 0.00 3.37 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 H 8.56 3.94 0.00 3.33 3.54 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 R 8.53 3.95 0.00 2.30 2.48 0.00 3.22 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.80 0.00 8 M 8.48 4.05 0.00 1.96 2.20 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.05 0.00 9 I 7.84 3.63 1.78 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.33 0.81 0.00 0.00 10 K 7.80 4.01 0.00 1.99 1.89 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.14 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.44 7.81 11 L 7.86 4.05 0.00 1.88 1.80 1.13 0.92 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 12 T 7.63 4.46 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 1.20 0.00 0.00 13 T 8.41 4.49 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 1.28 0.00 0.00 14 G 8.27 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 7.82 3.97 0.00 1.82 1.61 0.00 1.46 0.00 0.00 0.94 0.00 0.00 2.50 0.00 0.00 2.35 0.00 0.00 0.00 0.00 1.22 1.27 7.81 16 E 9.12 4.18 0.00 2.04 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 17 A 7.50 3.95 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.30 4.03 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 19 L 7.53 4.71 0.00 1.74 1.75 1.34 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 20 S 7.94 4.28 0.00 3.35 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 21 Y 8.14 4.66 0.00 3.07 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 22 G 8.14 3.70 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 0.00 0.00 0.00 23 F 7.85 4.90 0.00 3.25 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 24 Y 7.48 3.96 0.00 2.93 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 25 G 7.61 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 26 C 8.97 5.04 0.00 2.87 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 H 8.69 4.74 0.00 3.28 3.31 0.00 5.64 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 28 C 7.77 4.70 0.00 3.37 3.34 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 29 G 8.85 3.59 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 0.00 0.00 0.00 30 V 8.01 3.56 2.13 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 0.86 0.00 0.00 0.98 0.00 0.00 31 G 8.59 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 32 G 7.51 5.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.01 4.62 0.00 1.75 1.80 0.00 3.49 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 34 G 8.44 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 35 S 8.52 4.37 0.00 4.03 3.81 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 36 P 0.00 4.60 0.00 2.18 2.13 0.00 3.81 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 1.98 1.97 0.00 37 K 8.30 3.69 0.00 1.14 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.67 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.96 0.23 7.81 38 D 7.34 4.49 0.00 2.95 2.95 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 39 A 8.58 4.14 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 40 T 7.85 3.92 3.70 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 0.83 0.00 0.00 41 D 8.61 4.54 0.00 3.05 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 42 R 8.38 3.99 0.00 1.94 2.16 0.00 3.19 0.00 0.00 3.16 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 43 C 8.27 4.37 0.00 3.47 3.06 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 44 C 8.47 4.23 0.00 3.25 3.40 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 45 V 7.43 3.44 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 0.89 0.00 0.00 0.85 0.00 0.00 46 T 7.80 3.79 4.37 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 1.15 0.00 0.00 47 H 7.89 4.01 0.00 2.85 3.09 0.00 5.60 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 48 D 8.00 4.25 0.00 2.95 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 49 C 8.09 4.24 0.00 3.15 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 50 C 8.06 4.13 0.00 2.94 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 51 Y 8.06 3.94 0.00 3.04 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 52 K 8.42 3.93 0.00 1.98 1.98 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.50 7.81 53 R 8.03 3.91 0.00 2.09 1.95 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 1.65 1.65 0.00 54 L 8.13 4.08 0.00 1.68 1.59 0.71 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.28 4.18 0.00 2.07 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 0.00 2.31 2.21 0.00 56 K 8.19 4.57 0.00 1.82 1.80 0.00 1.60 0.00 0.00 2.06 0.00 0.00 3.16 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.49 7.81 57 R 7.34 4.51 0.00 1.76 1.72 0.00 3.34 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.18 0.00 58 G 8.82 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 59 C 8.01 4.53 0.00 3.03 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 60 G 8.23 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 0.00 0.00 0.00 0.00 61 T 8.13 4.10 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 0.77 0.00 0.00 62 K 8.58 3.59 0.00 0.79 0.90 0.00 1.49 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.54 1.39 7.81 63 F 7.67 4.73 0.00 3.00 2.97 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 64 L 7.94 4.56 0.00 1.48 1.59 0.94 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.75 4.40 0.00 3.97 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 66 Y 7.59 5.00 0.00 3.17 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 67 K 9.54 5.00 0.00 1.79 1.79 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.40 7.81 68 F 8.33 5.49 0.00 3.19 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 69 S 9.47 4.76 0.00 3.78 3.81 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 70 N 8.70 5.15 0.00 2.83 2.73 0.00 0.00 6.87 7.63 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 71 S 8.80 4.56 0.00 3.88 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.39 3.92 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 0.00 0.00 0.00 73 S 9.15 4.39 0.00 4.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 R 8.17 4.37 0.00 1.87 1.96 0.00 3.08 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 75 I 8.15 5.01 1.91 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 1.35 0.96 1.25 0.00 0.00 76 T 9.08 4.72 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 1.25 0.00 0.00 77 C 8.95 4.94 0.00 3.01 2.99 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 78 A 8.48 4.34 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 79 K 8.48 4.21 0.00 1.77 1.79 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.46 7.81 80 Q 8.10 4.50 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.05 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 81 D 8.44 4.63 0.00 2.87 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 82 S 8.64 4.08 0.00 3.86 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 83 C 8.13 4.18 0.00 2.94 3.09 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 84 R 7.95 3.86 0.00 2.31 2.04 0.00 3.57 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.91 0.00 85 S 8.34 4.07 0.00 4.03 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 86 Q 8.20 3.98 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.86 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 87 L 8.02 3.87 0.00 1.77 1.36 1.05 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 88 C 7.38 3.06 0.00 2.50 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 89 E 7.93 3.76 0.00 1.92 1.90 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 2.43 2.40 0.00 90 C 7.72 3.87 0.00 3.16 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 91 D 7.78 3.99 0.00 2.77 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 92 K 8.32 3.92 0.00 1.69 1.94 0.00 1.60 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.37 1.40 7.81 93 A 8.36 3.95 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 94 A 7.41 3.52 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.30 3.73 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 96 T 7.59 3.74 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 1.17 0.00 0.00 97 C 7.95 4.22 0.00 3.02 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 98 F 7.82 4.30 0.00 2.86 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.77 4.14 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 0.00 100 R 8.14 3.93 0.00 1.89 2.05 0.00 3.15 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 101 N 7.99 4.80 0.00 2.84 2.86 0.00 0.00 6.66 6.98 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 0.00 102 K 8.55 3.99 0.00 2.08 1.85 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.52 7.81 103 T 7.97 3.88 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 0.00 104 T 7.56 4.12 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 1.26 0.00 0.00 105 Y 8.20 3.90 0.00 2.98 2.86 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 0.00 106 N 8.76 4.98 0.00 2.64 2.27 0.00 0.00 6.80 5.72 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 0.00 107 K 8.68 4.13 0.00 1.90 1.87 0.00 1.81 0.00 0.00 1.87 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.84 1.66 7.81 108 K 8.08 3.68 0.00 1.02 1.58 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.37 7.81 109 Y 7.29 4.55 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 0.00 0.00 0.00 110 Q 7.91 3.63 0.00 2.02 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.93 0.00 0.00 0.00 0.00 0.00 1.34 2.36 0.00 111 Y 7.47 4.71 0.00 2.94 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 0.00 112 Y 8.17 4.04 0.00 2.93 2.99 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 0.00 113 S 8.26 4.09 0.00 3.46 3.60 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 0.00 114 N 8.69 4.61 0.00 2.84 2.86 0.00 0.00 6.67 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 0.00 115 K 7.99 3.70 0.00 1.38 1.41 0.00 1.56 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.48 7.81 116 H 7.42 4.77 0.00 2.87 3.31 0.00 5.72 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 C 8.07 4.72 0.00 3.21 3.07 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 0.00 118 R 8.41 4.74 0.00 1.89 1.76 0.00 3.23 0.00 0.00 3.36 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 119 G 8.68 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 0.00 120 S 8.00 4.09 0.00 3.87 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 0.00 121 T 8.65 3.75 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 0.00 122 P 0.00 3.75 0.00 2.01 2.02 0.00 3.62 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 1.96 2.11 0.00 123 R 7.48 4.10 0.00 1.71 2.15 0.00 3.25 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 124 C 8.57 4.46 0.00 2.99 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