NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3418 8.3044 118.1697 54.9822 32.5726 173.9802 2 V 4.3827 8.0859 120.8728 60.1930 34.0835 172.7517 3 K 4.5071 9.0291 129.4090 54.7905 34.5445 174.3012 4 Q 4.5991 8.6751 129.2517 55.7107 29.7156 174.8665 5 I 4.1708 8.4865 129.1317 60.2030 37.7407 175.6460 6 E 4.6671 8.7189 125.1495 55.2583 31.0737 176.1290 7 S 4.6716 7.5537 113.2114 55.6659 67.1174 174.6635 8 K 3.9754 8.6890 123.9685 60.2684 31.9108 179.1240 9 T 3.8518 7.9837 115.1266 66.6786 68.4075 176.1868 10 A 4.2641 8.1130 123.9294 54.4306 18.3566 179.4933 11 F 4.3168 8.1103 119.0926 61.5765 39.4187 177.0921 12 Q 3.6861 7.9795 119.1045 59.2260 28.7972 178.0169 13 E 3.8961 8.5320 119.6880 59.4187 29.3546 179.3147 14 A 4.0893 8.1603 120.6626 55.2104 18.2558 179.7053 15 L 3.8519 7.6255 116.3385 57.9521 41.4989 179.2441 16 D 4.4317 8.3546 118.9866 57.1808 40.5980 178.5067 17 A 4.0802 8.0908 119.7808 54.2879 18.7462 178.9797 18 A 4.1026 7.9933 119.1626 51.6645 18.6969 179.0916 19 G 3.7104 8.2061 106.1869 47.0429 0.0000 175.0177 20 D 4.8069 8.8032 123.3353 52.4242 39.6983 176.5338 21 K 4.1290 7.8033 120.0802 56.2083 32.7771 176.5345 22 L 4.3257 8.4912 124.6019 55.4867 43.3978 175.5273 23 V 4.9518 8.9529 126.1424 60.9695 34.2966 174.3790 24 V 4.5666 8.7984 127.3031 59.6808 34.3468 174.4814 25 V 4.5755 8.6653 124.5852 61.0574 34.1829 173.6546 26 D 4.2303 8.7072 129.0882 52.6911 42.2652 175.2893 27 F 4.7393 8.6931 127.5258 56.7577 40.1049 175.3551 28 S 4.9211 8.8318 118.1567 56.7085 67.1830 172.3869 29 A 4.5939 7.6230 119.1975 50.2085 21.6387 177.6737 30 T 3.7127 8.3904 110.5519 64.0053 68.9205 175.2830 31 W 4.4639 7.1313 116.4368 56.8081 29.1161 176.8580 32 C 4.7411 7.3942 120.7811 55.3327 41.9274 173.5136 33 G 3.6759 8.7746 115.4992 47.7629 0.0000 172.6686 34 P 4.3187 0.0000 0.0000 65.2767 31.3989 179.3164 35 C 4.2610 8.1123 114.6300 60.0852 39.9272 176.2049 36 K 3.8789 7.8342 118.7877 59.4278 31.6465 178.6796 37 M 4.1676 7.8547 117.7504 58.6927 32.4605 177.6518 38 I 4.2069 7.7268 116.8023 62.0867 38.3717 177.1243 39 K 3.9775 7.9748 121.0039 59.8079 31.8731 176.7624 40 P 4.3648 0.0000 0.0000 65.2717 31.2253 178.4687 41 F 4.4013 8.3248 120.7760 60.7008 39.4389 176.6307 42 F 4.1602 8.8504 120.6973 61.7751 39.0306 176.8791 43 H 3.9416 8.5848 115.9319 58.7108 28.1306 177.9111 44 S 4.0134 8.2807 116.3584 61.4901 62.6784 176.4648 45 L 3.8606 7.8430 123.3376 57.3749 41.0605 179.6945 46 S 2.7900 6.6255 113.0989 60.8316 62.7576 176.1272 47 E 3.9902 7.3998 121.1238 58.4223 29.2491 178.8725 48 K 4.0084 7.4520 118.9808 58.4644 33.7543 177.8415 49 Y 4.4547 7.8820 120.9338 56.2113 36.1898 176.2752 50 S 4.2489 8.3056 118.3332 60.3745 63.7633 175.7440 51 N 4.9522 8.1884 116.9636 52.7537 38.6885 174.0699 52 V 4.6397 7.7472 117.4905 61.1944 34.5506 174.7094 53 I 4.5529 8.6867 128.0183 59.8895 39.3178 174.4945 54 F 5.1288 8.9158 124.9762 55.6464 41.6728 174.3036 55 L 5.3701 9.2957 123.4434 52.9278 45.6930 175.3463 56 E 4.8916 8.9734 120.7564 54.4459 33.3096 174.9935 57 V 4.3196 8.1148 123.7002 60.8816 34.5923 173.5951 58 D 4.9455 8.4453 127.8037 53.4819 41.8920 177.2398 59 V 3.7213 8.8119 120.3038 64.0826 32.1544 178.6173 60 D 4.4754 8.4090 119.8643 57.1324 41.2470 177.4753 61 D 4.4811 8.5101 118.2332 56.8767 41.6687 176.8040 62 C 4.9632 8.0722 115.1689 58.3571 28.5146 174.8931 63 Q 4.4432 7.8806 123.6564 58.8336 28.8378 178.6417 64 D 4.3953 8.0550 119.3326 56.9788 40.9711 178.8262 65 V 3.6465 7.8207 118.2753 65.9364 31.6885 177.7406 66 A 3.8072 8.0789 120.4670 55.1235 18.1572 179.4635 67 S 3.9496 8.3559 111.9858 61.5961 62.2703 175.8563 68 E 3.9471 8.1928 120.7946 59.4734 29.4484 178.3026 69 S 4.4199 8.0012 111.6502 58.1575 63.0290 173.7921 70 E 3.7896 8.1820 120.4277 56.9515 27.4102 175.0168 71 V 3.5336 7.2868 118.2051 62.9960 31.8646 175.6160 72 K 4.6174 8.3579 122.5263 56.1543 34.2022 175.8021 73 S 4.6004 7.5760 111.1720 56.9388 65.5512 172.3172 74 M 4.4705 8.5442 125.8537 52.9939 33.7405 173.7566 75 P 4.6319 0.0000 0.0000 62.5938 33.9180 174.7254 76 T 4.8030 8.0858 115.9241 61.6828 72.0904 173.1617 77 F 5.0650 8.6157 124.6616 55.8443 41.2117 174.7278 78 Q 5.1937 8.8049 122.6010 54.0546 32.0984 174.5943 79 F 5.2632 8.8395 120.6117 55.7535 42.4520 174.3156 80 F 5.4808 9.6131 121.4836 55.7049 43.3173 174.0877 81 K 4.7540 8.8409 120.6523 55.1775 36.0419 176.7992 82 K 3.8829 9.1234 121.1903 57.5234 30.1851 176.7430 83 G 3.9015 8.5107 105.3285 45.6157 0.0000 174.0130 84 Q 4.5665 8.0610 120.0805 53.6838 30.2268 174.8544 85 K 3.8402 8.7580 124.0932 56.7878 31.9723 176.5209 86 V 4.1831 8.1382 120.1347 61.3030 32.6133 175.9063 87 G 4.0352 7.3741 106.3986 45.9796 0.0000 171.9678 88 E 5.7361 8.8386 117.6470 55.7430 32.3639 174.5609 89 F 5.2157 8.7464 120.2093 56.1510 41.9155 172.7233 90 S 5.1554 9.2543 113.5626 57.2187 65.6118 174.6489 91 G 4.1005 9.2357 106.9455 45.9721 0.0000 174.3344 92 A 4.5573 8.2060 124.3317 50.6362 17.4318 176.9633 93 N 4.8055 7.9903 118.7593 50.8016 40.7143 174.0615 94 K 3.9726 8.4707 128.2278 59.8308 32.2083 179.0337 95 E 4.0338 8.0928 118.0669 59.2336 29.3538 179.1965 96 K 3.7759 8.7618 120.2442 58.9594 32.1404 178.6018 97 L 4.2493 8.0784 120.8435 58.4521 42.1142 178.7484 98 E 3.9926 8.5350 118.9520 58.9933 29.5765 178.4784 99 A 3.9777 8.4525 121.4457 55.5112 18.4265 179.7999 100 T 3.6225 8.0944 114.4739 66.5082 68.2960 176.8289 101 I 3.6224 7.7006 121.7836 64.6712 37.0039 177.8786 102 N 4.5453 7.7746 114.1243 55.0001 38.5255 176.6845 103 E 4.1922 7.8390 119.8660 57.7838 29.9165 177.5558 104 L 4.6151 7.2210 115.6028 54.1287 43.0960 176.8338 105 V 3.8055 7.4602 123.7140 61.8611 31.3597 175.9058 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 8.30 4.34 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.59 0.00 2 V 8.09 4.38 1.89 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 1.03 0.00 0.00 0.55 0.00 0.00 3 K 9.03 4.51 0.00 1.88 1.66 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.36 7.81 4 Q 8.68 4.60 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.66 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 5 I 8.49 4.17 1.61 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 1.14 0.86 0.80 0.00 0.00 6 E 8.72 4.67 0.00 1.88 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.42 0.00 7 S 7.55 4.67 0.00 4.00 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 8 K 8.69 3.98 0.00 1.90 1.89 0.00 1.78 0.00 0.00 1.85 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.55 1.63 7.81 9 T 7.98 3.85 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 1.29 0.00 0.00 10 A 8.11 4.26 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 11 F 8.11 4.32 0.00 2.97 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 12 Q 7.98 3.69 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.55 0.00 0.00 0.00 0.00 0.00 2.29 2.52 0.00 13 E 8.53 3.90 0.00 2.17 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 2.46 0.00 14 A 8.16 4.09 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 15 L 7.63 3.85 0.00 1.54 1.51 -0.14 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.35 4.43 0.00 2.81 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.09 4.08 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 18 A 7.99 4.10 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 19 G 8.21 3.71 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 0.00 0.00 0.00 20 D 8.80 4.81 0.00 2.80 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 21 K 7.80 4.13 0.00 1.94 1.81 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.60 1.46 7.81 22 L 8.49 4.33 0.00 1.80 1.54 1.05 0.83 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 23 V 8.95 4.95 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 1.05 0.00 0.00 0.95 0.00 0.00 24 V 8.80 4.57 1.70 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 0.01 0.00 0.00 0.46 0.00 0.00 25 V 8.67 4.58 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 -0.07 0.00 0.00 1.15 0.00 0.00 26 D 8.71 4.23 0.00 1.58 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 0.00 0.00 0.00 27 F 8.69 4.74 0.00 2.83 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 28 S 8.83 4.92 0.00 3.56 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 29 A 7.62 4.59 -0.19 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 30 T 8.39 3.71 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 31 W 7.13 4.46 0.00 3.51 3.23 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 32 C 7.39 4.74 0.00 2.11 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 33 G 8.77 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.32 0.00 2.21 2.18 0.00 3.65 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 35 C 8.11 4.26 0.00 2.97 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 36 K 7.83 3.88 0.00 1.90 1.88 0.00 1.72 0.00 0.00 1.63 0.00 0.00 3.15 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.40 7.81 37 M 7.85 4.17 0.00 2.22 2.13 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 2.63 2.72 0.00 38 I 7.73 4.21 2.04 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.76 1.21 0.00 0.00 39 K 7.97 3.98 0.00 2.07 1.85 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.59 7.81 40 P 0.00 4.36 0.00 2.29 2.12 0.00 3.90 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 2.17 2.17 0.00 41 F 8.32 4.40 0.00 3.11 3.35 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 42 F 8.85 4.16 0.00 3.32 3.37 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 43 H 8.58 3.94 0.00 3.43 3.32 0.00 5.87 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.28 4.01 0.00 3.99 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 45 L 7.84 3.86 0.00 1.39 1.73 0.73 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 46 S 6.63 2.79 0.00 3.53 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.40 3.99 0.00 1.93 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 2.35 2.37 0.00 48 K 7.45 4.01 0.00 1.68 1.78 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.76 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.41 1.10 7.81 49 Y 7.88 4.45 0.00 3.29 3.04 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 50 S 8.31 4.25 0.00 3.99 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 51 N 8.19 4.95 0.00 2.78 2.89 0.00 0.00 6.62 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 7.75 4.64 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.98 0.00 0.00 53 I 8.69 4.55 1.87 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 1.25 0.80 0.94 0.00 0.00 54 F 8.92 5.13 0.00 2.72 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 9.30 5.37 0.00 1.47 1.41 0.99 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.97 4.89 0.00 1.92 1.66 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 2.09 2.37 0.00 57 V 8.11 4.32 1.15 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 0.92 0.00 0.00 0.14 0.00 0.00 58 D 8.45 4.95 0.00 2.68 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.81 3.72 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 0.97 0.00 0.00 1.02 0.00 0.00 60 D 8.41 4.48 0.00 2.91 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 61 D 8.51 4.48 0.00 2.81 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 C 8.07 4.96 0.00 3.07 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 63 Q 7.88 4.44 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.92 0.00 0.00 0.00 0.00 0.00 2.49 2.61 0.00 64 D 8.05 4.40 0.00 2.74 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 65 V 7.82 3.65 2.26 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 1.14 0.00 0.00 1.00 0.00 0.00 66 A 8.08 3.81 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 67 S 8.36 3.95 0.00 3.94 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 68 E 8.19 3.95 0.00 2.11 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 0.00 2.39 2.40 0.00 69 S 8.00 4.42 0.00 3.72 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 70 E 8.18 3.79 0.00 2.06 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 2.42 2.36 0.00 71 V 7.29 3.53 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 -0.09 0.00 0.00 72 K 8.36 4.62 0.00 1.83 1.79 0.00 1.59 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.26 1.39 7.81 73 S 7.58 4.60 0.00 3.77 3.71 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 74 M 8.54 4.47 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.92 0.00 75 P 0.00 4.63 0.00 1.51 1.88 0.00 3.73 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.04 0.00 76 T 8.09 4.80 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 1.18 0.00 0.00 77 F 8.62 5.07 0.00 2.15 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 8.80 5.19 0.00 2.34 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.76 0.00 0.00 0.00 0.00 0.00 2.29 2.45 0.00 79 F 8.84 5.26 0.00 3.14 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 80 F 9.61 5.48 0.00 2.96 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 K 8.84 4.75 0.00 1.67 1.69 0.00 1.86 0.00 0.00 1.88 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.57 7.81 82 K 9.12 3.88 0.00 1.98 1.89 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.40 1.38 7.81 83 G 8.51 3.90 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 84 Q 8.06 4.57 0.00 2.21 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.93 0.00 0.00 0.00 0.00 0.00 2.61 2.45 0.00 85 K 8.76 3.84 0.00 1.50 1.67 0.00 1.72 0.00 0.00 1.57 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.25 1.07 7.81 86 V 8.14 4.18 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 0.78 0.00 0.00 1.00 0.00 0.00 87 G 7.37 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 0.00 0.00 0.00 88 E 8.84 5.74 0.00 1.97 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.36 0.00 89 F 8.75 5.22 0.00 3.28 3.22 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 90 S 9.25 5.16 0.00 4.02 3.90 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 91 G 9.24 4.10 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 0.00 0.00 0.00 92 A 8.21 4.56 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 93 N 7.99 4.81 0.00 2.80 2.72 0.00 0.00 7.05 6.88 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 94 K 8.47 3.97 0.00 1.54 0.97 0.00 1.51 0.00 0.00 1.57 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.11 1.40 7.81 95 E 8.09 4.03 0.00 2.01 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 2.38 2.42 0.00 96 K 8.76 3.78 0.00 1.56 1.41 0.00 1.30 0.00 0.00 0.81 0.00 0.00 2.37 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.30 0.94 7.81 97 L 8.08 4.25 0.00 1.90 2.04 0.79 0.88 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 98 E 8.53 3.99 0.00 2.37 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 2.44 2.43 0.00 99 A 8.45 3.98 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 0.00 100 T 8.09 3.62 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 0.28 0.00 0.00 101 I 7.70 3.62 1.75 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.29 0.00 0.00 102 N 7.77 4.55 0.00 2.80 2.88 0.00 0.00 7.13 7.34 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 0.00 103 E 7.84 4.19 0.00 1.95 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 2.26 2.50 0.00 104 L 7.22 4.62 0.00 1.51 1.62 0.55 1.18 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 0.00 105 V 7.46 3.81 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 0.66 0.00 0.00 0.97 0.00 0.00