NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5316 8.3044 120.2869 55.2950 33.8764 173.9385 3 V 4.2172 8.0680 121.6597 59.8774 33.7375 172.8941 4 W 4.6087 9.1574 135.0000 57.4923 31.6149 174.8722 5 T 4.1571 8.2336 124.0723 61.4685 67.0358 172.5683 6 P 4.5279 0.0000 0.0000 63.1869 32.2357 175.6005 7 V 4.0945 7.4523 119.7699 62.5002 33.0872 175.2172 8 N 4.2776 8.6664 125.2112 54.9932 36.0731 173.7036 9 N 5.0052 7.6588 108.9985 52.9298 40.0789 174.1800 10 K 4.0892 8.3804 116.4032 56.5387 32.7496 176.7205 11 M 4.9585 8.3336 121.3104 54.0376 35.0007 175.5121 12 F 4.5278 8.2483 116.5751 57.0355 41.1812 176.5825 13 E 3.5481 8.4434 121.3976 57.1784 27.5338 175.2545 14 T 3.9137 8.3142 122.3749 66.2958 68.9108 174.3615 15 F 4.5487 9.0380 124.0947 57.5593 36.6928 176.5788 16 S 4.4106 8.2194 115.1091 60.7146 62.9101 174.6096 17 Y 4.3633 8.2957 116.9386 58.1466 38.1567 175.0296 18 L 4.6899 7.6181 120.2815 52.0925 43.6833 174.4774 19 P 4.4191 0.0000 0.0000 61.9397 31.7610 174.9824 20 P 4.2841 0.0000 0.0000 62.8814 31.7546 176.4013 21 L 4.0017 8.3162 122.7679 54.6334 42.1879 177.9534 22 T 4.1938 8.2014 114.0855 61.2402 71.0106 175.1509 23 D 4.3644 8.5939 121.2272 57.6358 40.7886 178.8281 24 E 3.9124 8.0832 119.1997 59.4006 29.7267 178.7965 25 Q 3.9283 7.8537 117.6526 58.7993 28.7385 178.6778 26 I 3.6962 8.1176 121.0395 64.4079 37.1311 178.1831 27 A 4.0445 8.2571 121.4610 55.2811 18.1511 179.5543 28 A 3.9611 8.1373 119.1255 55.4230 18.4320 179.9128 29 Q 4.1198 8.1497 116.6427 59.1013 28.8058 179.1500 30 V 3.7362 8.1760 119.3671 66.1444 31.5317 177.6773 31 D 4.4404 8.4785 118.8870 57.6574 40.5138 178.2894 32 Y 4.1847 8.1198 119.8967 60.6543 38.8153 177.9837 33 I 3.9380 7.9828 120.7912 64.6500 37.3738 178.6223 34 V 3.5401 7.8990 118.6203 65.9465 31.1655 177.8735 35 A 3.9297 8.1126 119.8043 54.5247 18.2501 178.3234 36 N 4.0997 7.0680 112.2170 52.0085 38.7351 175.6016 37 G 3.7420 7.2300 108.1799 46.1342 0.0000 174.0889 38 W 5.0141 7.5956 118.9625 55.9265 30.8326 176.2296 39 I 4.4222 8.7842 122.8039 59.4307 38.0100 174.0842 40 P 4.9088 0.0000 0.0000 62.8930 32.8400 175.1516 41 C 4.9965 8.9874 121.4046 58.4187 35.5913 172.4608 42 L 5.3463 8.7444 123.5094 53.2543 44.4013 175.2235 43 E 5.6604 9.2541 120.8909 55.0062 34.2478 174.4878 44 F 5.6098 9.1709 116.0368 56.0062 42.1671 172.9523 45 A 4.4546 8.3242 120.0180 50.1932 22.5714 176.3025 46 E 4.2931 8.6198 118.9337 55.7307 30.7189 177.7299 47 A 4.2741 8.8236 122.7638 55.8315 18.4147 179.6989 48 D 4.5808 8.1613 113.0588 56.2648 41.0152 177.1084 49 K 4.6096 7.9752 117.2689 56.0064 32.7681 176.7776 50 A 3.8829 7.6876 124.2074 53.8169 18.8453 178.1616 51 Y 4.7368 7.4311 111.2420 55.6467 40.4312 176.0373 52 V 3.9665 8.3042 116.1101 62.3334 32.2232 175.5924 53 S 4.7506 8.8752 116.5146 56.7263 66.3425 173.8495 54 N 5.1964 8.5536 114.4083 52.7179 39.1462 176.1759 55 E 3.9674 8.2246 121.0216 59.7711 29.5663 179.1224 56 S 4.0388 8.8793 115.4572 60.4593 62.8687 175.9946 57 A 2.5800 7.6857 123.3831 53.5159 17.7466 179.0092 58 I 3.5632 6.9825 116.8614 63.6636 38.0191 177.0852 59 R 4.2814 7.4771 116.3455 55.6614 30.5045 176.1592 60 F 5.1113 7.1504 117.9694 55.7987 41.4469 177.1509 61 G 3.9992 8.2206 115.3422 46.1831 0.0000 174.9713 62 S 4.5956 8.4318 113.3504 58.7299 62.1387 174.4909 63 V 4.4514 7.2518 107.2741 61.1084 33.1598 177.8848 64 S 4.4473 8.2303 116.1671 60.1912 63.4396 173.6272 65 C 3.9835 8.1371 118.7218 61.6274 27.9775 173.1725 66 L 3.5954 8.4343 122.9650 55.5975 39.0342 173.1461 67 Y 4.3477 7.7661 119.5493 55.9735 39.8962 174.5680 68 Y 4.8135 7.1427 123.2972 56.2583 42.3520 174.7325 69 D 4.5065 8.8441 123.1625 55.3130 41.7622 177.0300 70 N 4.4972 8.9042 116.6435 54.1395 35.9756 176.0623 71 R 3.9343 7.9701 118.5613 59.3523 30.3517 177.1536 72 Y 4.3491 7.6793 114.6509 57.9981 38.3407 175.3790 73 W 5.0714 8.6987 124.6097 55.5585 32.5257 174.5754 74 T 4.4052 8.0947 116.9021 62.4922 69.7815 174.4776 75 M 4.6659 8.5368 126.2731 55.2756 33.2241 175.1946 76 W 4.7978 9.5103 135.0000 56.1974 31.3332 176.7227 77 K 3.4263 8.5609 128.6097 57.6132 30.4751 177.9221 78 L 4.9275 8.2397 125.5350 52.6862 45.1616 174.0189 79 P 4.3731 0.0000 0.0000 63.4095 32.2570 177.4764 80 M 4.3023 8.6349 122.9535 53.7275 30.4696 175.9645 81 F 4.4985 7.2698 118.2348 58.9333 40.0206 176.6503 82 G 4.0020 9.1386 112.9457 45.4931 0.0000 173.0289 83 C 4.2824 7.9364 120.9444 59.6836 31.7066 173.1326 84 R 4.5390 8.6468 124.2916 55.5588 31.2526 174.5417 85 D 4.8274 7.8231 118.8608 51.4338 42.2408 174.5880 86 P 4.3526 0.0000 0.0000 66.3033 31.1394 178.1851 87 M 4.1279 8.3043 118.4101 58.2516 31.8071 178.6530 88 Q 4.0405 8.0234 117.9723 58.7927 28.8560 178.9635 89 V 3.5981 7.7530 118.7429 66.1003 31.7398 177.8774 90 L 4.0260 7.9359 118.7067 57.9690 41.4212 179.7922 91 R 3.9719 8.2107 117.9769 59.3274 29.9446 179.0105 92 E 4.1301 8.3148 118.4228 59.1717 29.4481 179.2660 93 I 3.5259 7.8583 120.0868 64.3574 37.1873 178.4931 94 V 3.4826 7.6730 118.5658 65.9308 31.3488 177.9091 95 A 3.9397 8.0313 120.4721 55.1720 18.2701 179.2003 96 C 2.0000 7.6858 117.6894 62.0949 30.9808 175.9885 97 T 3.7352 7.5290 111.2789 64.4523 68.0078 176.4034 98 K 3.8487 7.7796 121.7405 59.2118 32.2835 178.4362 99 A 3.9853 7.6232 120.2510 53.4702 19.9934 177.6500 100 F 4.7246 7.7573 115.4934 55.1814 39.0422 174.0514 101 P 4.4648 0.0000 0.0000 64.0958 31.9266 177.7979 102 D 4.6466 8.0456 116.7381 53.9416 41.4084 175.5613 103 A 4.7607 7.4061 120.9158 50.5126 21.0651 177.0423 104 Y 4.1922 8.5296 117.8464 57.9299 39.4682 175.3095 105 V 5.2128 8.9165 122.9146 61.1872 35.2762 174.2460 106 R 5.0051 9.5241 123.9491 54.2690 33.0168 173.8554 107 L 4.8018 8.1445 123.5661 53.9576 43.7506 175.7093 108 V 4.8164 8.7451 118.3904 59.5480 36.4674 174.1238 109 A 4.8683 8.0462 121.3638 50.4981 22.8692 175.1747 110 F 5.2081 8.9020 118.9433 55.6987 42.7081 174.1826 111 D 5.3287 8.8364 122.6767 52.7019 42.3608 176.5889 112 N 4.7454 9.1816 123.1539 54.2749 38.3587 176.3219 113 Q 4.2151 8.7707 118.8998 58.8667 29.0917 177.6693 114 K 4.0060 8.3309 114.9991 57.2247 32.9034 176.6109 115 Q 3.4857 8.0330 118.5485 55.8973 26.9512 172.5373 116 V 4.5048 7.7715 117.2619 60.0599 35.0150 174.0929 117 Q 4.2559 8.7413 123.1691 56.5485 29.2645 175.5858 118 I 4.2225 8.1521 124.8020 61.1519 39.7911 174.4233 119 M 4.6030 6.7204 117.4244 54.5001 34.4445 173.7101 120 G 4.2925 8.2564 106.0782 46.1907 0.0000 172.3485 121 F 5.0477 7.5716 116.7130 55.2950 41.7229 172.9759 122 L 4.5624 8.8238 122.6220 55.5023 42.0549 176.7641 123 V 4.5465 8.9968 118.0089 61.4294 34.1358 175.6526 124 Q 4.6114 7.8258 121.2616 54.4382 32.3956 173.2632 125 R 4.2572 8.0871 121.3793 53.0756 32.8260 173.6659 126 P 4.1931 0.0000 0.0000 62.4277 31.9169 178.0380 127 K 4.0568 8.4911 121.3331 59.4614 32.1321 178.3411 128 T 4.1031 7.7962 106.7477 62.5872 69.3332 174.7969 129 A 4.2685 7.7560 126.4065 52.9045 18.7050 177.3198 130 R 4.6468 8.7781 120.1281 55.9189 31.7366 175.3653 131 D 4.9529 8.5134 116.4664 52.7761 39.6900 175.3998 132 F 5.4107 7.6395 112.2761 54.5042 41.1216 173.5169 133 Q 4.4281 8.3489 119.7504 52.9171 31.4025 174.2386 134 P 4.4633 0.0000 0.0000 62.4015 32.2417 176.9008 135 A 3.9612 8.8859 123.0130 55.6584 18.1542 179.2738 136 N 4.6417 8.0808 109.3515 54.0005 37.7178 175.4676 137 K 4.4552 7.8737 117.7236 56.3298 33.0834 177.3429 138 R 3.5641 7.6890 121.3519 57.8475 30.1070 176.6899 139 S 5.0647 7.4674 110.0189 56.3450 66.1084 174.2292 140 V 3.9929 8.5991 114.4224 61.7638 32.2625 175.6233 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 2 M 8.30 4.53 0.00 1.98 2.16 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.58 0.00 3 V 8.07 4.22 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 1.07 0.00 0.00 0.97 0.00 0.00 4 W 9.16 4.61 0.00 3.50 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 5 T 8.23 4.16 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 0.99 0.00 0.00 6 P 0.00 4.53 0.00 2.23 2.19 0.00 3.77 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 1.96 1.96 0.00 7 V 7.45 4.09 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 0.77 0.00 0.00 0.91 0.00 0.00 8 N 8.67 4.28 0.00 2.95 2.87 0.00 0.00 6.52 6.92 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 9 N 7.66 5.01 0.00 2.65 2.68 0.00 0.00 7.29 6.68 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 10 K 8.38 4.09 0.00 1.95 1.53 0.00 1.34 0.00 0.00 0.61 0.00 0.00 2.54 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.22 1.27 7.81 11 M 8.33 4.96 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.65 0.00 12 F 8.25 4.53 0.00 3.15 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 13 E 8.44 3.55 0.00 2.13 1.74 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 2.18 2.12 0.00 14 T 8.31 3.91 4.15 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 0.21 0.00 0.00 15 F 9.04 4.55 0.00 3.28 3.14 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 16 S 8.22 4.41 0.00 4.12 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Y 8.30 4.36 0.00 3.03 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 18 L 7.62 4.69 0.00 1.83 1.60 0.84 1.09 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 19 P 0.00 4.42 0.00 2.02 2.00 0.00 3.70 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 2.02 2.13 0.00 20 P 0.00 4.28 0.00 2.04 2.02 0.00 3.70 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 2.07 2.17 0.00 21 L 8.32 4.00 0.00 1.57 1.47 0.34 0.42 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 22 T 8.20 4.19 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 1.18 0.00 0.00 23 D 8.59 4.36 0.00 2.70 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 24 E 8.08 3.91 0.00 2.01 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 2.35 2.39 0.00 25 Q 7.85 3.93 0.00 2.29 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 26 I 8.12 3.70 2.05 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.94 1.09 0.00 0.00 27 A 8.26 4.04 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 28 A 8.14 3.96 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 29 Q 8.15 4.12 0.00 2.52 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.45 2.05 0.00 30 V 8.18 3.74 2.30 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 1.10 0.00 0.00 1.12 0.00 0.00 31 D 8.48 4.44 0.00 3.00 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 32 Y 8.12 4.18 0.00 3.22 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 33 I 7.98 3.94 2.16 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.87 1.07 0.00 0.00 34 V 7.90 3.54 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 1.03 0.00 0.00 1.02 0.00 0.00 35 A 8.11 3.93 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 36 N 7.07 4.10 0.00 1.44 1.42 0.00 0.00 7.04 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 37 G 7.23 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 0.00 0.00 0.00 38 W 7.60 5.01 0.00 3.38 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 39 I 8.78 4.42 2.12 0.00 0.00 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 1.48 1.01 0.70 0.00 0.00 40 P 0.00 4.91 0.00 2.10 1.99 0.00 3.78 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 41 C 8.99 5.00 0.00 3.11 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.74 5.35 0.00 1.85 1.62 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.25 5.66 0.00 2.08 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 0.00 2.38 2.34 0.00 44 F 9.17 5.61 0.00 3.08 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 45 A 8.32 4.45 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.62 4.29 0.00 2.18 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 2.29 2.28 0.00 47 A 8.82 4.27 1.51 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 0.00 0.00 0.00 48 D 8.16 4.58 0.00 2.70 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 49 K 7.98 4.61 0.00 1.59 1.66 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.41 7.81 50 A 7.69 3.88 0.56 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 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 7.43 4.74 0.00 2.89 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 52 V 8.30 3.97 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 0.54 0.00 0.00 0.76 0.00 0.00 53 S 8.88 4.75 0.00 4.06 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 54 N 8.55 5.20 0.00 2.75 2.85 0.00 0.00 6.57 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 55 E 8.22 3.97 0.00 2.15 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 0.00 2.39 2.37 0.00 56 S 8.88 4.04 0.00 4.06 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 57 A 7.69 2.58 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 58 I 6.98 3.56 1.78 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 1.47 0.81 0.89 0.00 0.00 59 R 7.48 4.28 0.00 1.85 1.99 0.00 3.18 0.00 0.00 3.20 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 60 F 7.15 5.11 0.00 3.01 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 61 G 8.22 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 0.00 0.00 0.00 62 S 8.43 4.60 0.00 3.86 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 63 V 7.25 4.45 1.84 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 0.66 0.00 0.00 0.45 0.00 0.00 64 S 8.23 4.45 0.00 4.10 4.28 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 65 C 8.14 3.98 0.00 2.96 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 66 L 8.43 3.60 0.00 1.77 1.75 0.95 1.03 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 67 Y 7.77 4.35 0.00 2.92 3.05 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 68 Y 7.14 4.81 0.00 2.80 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 69 D 8.84 4.51 0.00 2.78 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 70 N 8.90 4.50 0.00 3.06 3.23 0.00 0.00 6.99 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 71 R 7.97 3.93 0.00 1.51 1.70 0.00 3.07 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 72 Y 7.68 4.35 0.00 3.05 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 73 W 8.70 5.07 0.00 3.08 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 74 T 8.09 4.41 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 0.96 0.00 0.00 75 M 8.54 4.67 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.81 0.00 76 W 9.51 4.80 0.00 3.65 3.30 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 77 K 8.56 3.43 0.00 1.67 0.84 0.00 1.71 0.00 0.00 1.55 0.00 0.00 2.73 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.87 0.21 7.81 78 L 8.24 4.93 0.00 1.60 1.58 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.37 0.00 0.75 1.84 0.00 3.62 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 1.91 2.14 0.00 80 M 8.63 4.30 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 81 F 7.27 4.50 0.00 3.11 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 82 G 9.14 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 0.00 0.00 0.00 83 C 7.94 4.28 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 84 R 8.65 4.54 0.00 1.80 1.86 0.00 3.22 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.74 0.00 85 D 7.82 4.83 0.00 2.65 2.55 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 0.00 0.00 0.00 0.00 86 P 0.00 4.35 0.00 2.33 2.34 0.00 3.77 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 2.09 2.08 0.00 87 M 8.30 4.13 0.00 2.13 2.35 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 2.64 2.60 0.00 88 Q 8.02 4.04 0.00 2.32 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 89 V 7.75 3.60 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 1.10 0.00 0.00 0.97 0.00 0.00 90 L 7.94 4.03 0.00 1.91 1.72 0.95 1.06 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 91 R 8.21 3.97 0.00 2.04 2.02 0.00 3.15 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 92 E 8.31 4.13 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.66 0.00 93 I 7.86 3.53 2.00 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 1.35 1.01 0.85 0.00 0.00 94 V 7.67 3.48 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 0.97 0.00 0.00 0.97 0.00 0.00 95 A 8.03 3.94 1.54 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 0.00 0.00 0.00 0.00 0.00 0.00 96 C 7.69 2.00 0.00 1.23 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 0.00 0.00 0.00 0.00 97 T 7.53 3.74 4.33 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 1.11 0.00 0.00 98 K 7.78 3.85 0.00 1.77 1.95 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.39 7.81 99 A 7.62 3.99 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 0.00 100 F 7.76 4.72 0.00 2.91 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 0.00 0.00 0.00 0.00 0.00 101 P 0.00 4.46 0.00 2.12 2.11 0.00 3.26 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.05 4.65 0.00 2.69 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 0.00 103 A 7.41 4.76 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 0.00 104 Y 8.53 4.19 0.00 2.55 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 0.00 105 V 8.92 5.21 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 0.85 0.00 0.00 0.87 0.00 0.00 106 R 9.52 5.01 0.00 1.82 1.92 0.00 2.34 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.38 0.00 107 L 8.14 4.80 0.00 1.49 0.72 0.84 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.75 4.82 1.63 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 0.51 0.00 0.00 0.51 0.00 0.00 109 A 8.05 4.87 1.17 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 0.00 110 F 8.90 5.21 0.00 3.02 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 0.00 111 D 8.84 5.33 0.00 2.34 2.44 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 0.00 112 N 9.18 4.75 0.00 2.94 3.05 0.00 0.00 6.32 7.39 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 0.00 113 Q 8.77 4.22 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.05 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 114 K 8.33 4.01 0.00 1.75 1.87 0.00 1.87 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.47 7.81 115 Q 8.03 3.49 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.71 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 116 V 7.77 4.50 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 0.48 0.00 0.00 0.91 0.00 0.00 117 Q 8.74 4.26 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.87 0.00 0.00 0.00 0.00 0.00 2.15 1.94 0.00 118 I 8.15 4.22 1.22 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.23 0.30 -0.54 0.00 0.00 119 M 6.72 4.60 0.00 2.16 2.23 0.00 0.00 0.00 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.76 0.00 120 G 8.26 4.29 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 0.00 121 F 7.57 5.05 0.00 3.23 3.28 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 0.00 122 L 8.82 4.56 0.00 1.61 1.62 0.71 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 123 V 9.00 4.55 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 0.77 0.00 0.00 0.92 0.00 0.00 124 Q 7.83 4.61 0.00 1.99 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 125 R 8.09 4.26 0.00 1.22 1.50 0.00 2.21 0.00 0.00 2.42 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.28 0.00 126 P 0.00 4.19 0.00 2.05 1.98 0.00 2.33 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.88 0.00 127 K 8.49 4.06 0.00 1.72 1.88 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.39 7.81 128 T 7.80 4.10 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 1.22 0.00 0.00 129 A 7.76 4.27 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 0.00 0.00 0.00 0.00 0.00 130 R 8.78 4.65 0.00 1.80 1.88 0.00 3.21 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 131 D 8.51 4.95 0.00 2.91 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 0.00 132 F 7.64 5.41 0.00 3.22 3.15 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 0.00 133 Q 8.35 4.43 0.00 1.87 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.05 0.00 0.00 0.00 0.00 0.00 2.29 2.04 0.00 134 P 0.00 4.46 0.00 2.34 2.19 0.00 3.54 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.88 0.00 135 A 8.89 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 0.00 136 N 8.08 4.64 0.00 2.83 2.94 0.00 0.00 5.83 7.13 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 0.00 137 K 7.87 4.46 0.00 1.60 1.71 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.29 1.29 7.81 138 R 7.69 3.56 0.00 1.48 0.66 0.00 3.06 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 1.29 1.53 0.00 139 S 7.47 5.06 0.00 4.09 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 0.00 140 V 8.60 3.99 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 0.61 0.00 0.00 0.91 0.00 0.00