NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4411 8.3049 118.1947 54.4342 32.6217 174.5704 1 I 3.5250 8.1373 119.4573 61.7122 37.3248 174.6063 2 Q 4.7362 9.3235 124.2673 54.7608 33.0919 173.9671 3 R 4.7534 9.1935 124.3361 54.4211 33.0281 175.5186 4 T 4.8695 8.8265 118.6808 60.2221 68.3224 172.3026 5 P 4.9054 0.0000 0.0000 62.8782 32.3675 175.9960 6 K 4.5079 9.3354 122.8681 56.0069 33.9081 175.8665 7 I 5.1518 8.2619 122.8974 59.7669 40.7211 174.7823 8 Q 4.7301 9.1771 125.0666 54.1930 32.4253 174.2267 9 V 4.9864 8.6815 124.3419 61.5117 33.3538 174.0551 10 Y 5.3446 8.5189 124.8473 56.6850 41.7487 173.1597 11 S 4.9220 8.9604 114.2548 56.7131 64.8304 174.3704 12 R 4.1371 9.0270 122.8875 59.1507 30.2861 176.2070 13 H 5.1224 8.5191 113.4540 52.6181 32.1576 171.6666 14 P 4.3417 0.0000 0.0000 62.6796 31.5657 176.4635 15 A 4.2188 8.8086 126.1138 52.2232 18.9357 176.5846 16 E 4.6182 8.5966 122.2594 54.1669 32.2452 175.2887 17 N 4.7048 8.8100 121.8089 55.1554 38.9938 175.4641 18 G 3.9755 8.8585 111.7213 44.8615 0.0000 173.3870 19 K 4.4966 7.4170 119.1268 54.1837 33.7230 176.6507 20 S 4.2173 8.2427 117.3164 58.2494 63.9354 173.1092 21 N 4.9836 8.8408 119.6491 53.2231 42.4564 172.1485 22 F 5.1886 8.9938 115.2857 55.8501 43.3230 173.6702 23 L 4.0685 8.8538 125.7966 53.4393 43.4532 174.9142 24 N 5.4477 9.0900 124.3118 51.5496 42.4193 173.1128 25 C 5.2768 9.1849 121.1307 55.3962 42.6459 171.9109 26 Y 5.5387 9.4081 129.1432 56.2837 40.3594 174.5333 27 V 5.4419 8.7785 120.2707 59.0386 34.8096 175.1147 28 S 5.5290 7.9925 117.6200 58.0134 66.7150 174.4518 29 G 4.4778 8.8839 105.6068 47.0913 0.0000 173.1958 30 F 5.2070 7.3870 114.2522 55.6189 41.2539 173.8959 31 H 5.0513 8.9386 115.9584 55.0196 33.8159 172.4102 32 P 4.7641 0.0000 0.0000 62.3812 32.7175 175.8133 33 S 4.0647 8.3846 112.5680 59.9245 63.3629 174.0741 34 D 4.4742 7.8917 122.1577 54.3617 41.0973 175.2708 35 I 4.4916 7.9779 122.1488 60.0548 41.1771 172.9641 36 E 4.6198 8.8369 128.7850 54.7046 31.6582 175.1342 37 V 4.4889 7.9060 123.2374 61.1079 34.3429 174.1497 38 D 4.8938 8.9494 126.5982 52.5001 45.3768 174.3391 39 L 5.1279 8.3834 120.6929 53.1186 44.6554 175.3513 40 L 5.2850 9.3413 122.3730 52.8946 45.8912 175.5749 41 K 4.1597 8.8992 124.3868 54.3992 34.2163 175.7606 42 N 4.3703 9.7865 128.6732 54.5055 36.3059 175.9559 43 G 3.8958 8.3723 103.7739 45.4711 0.0000 173.1334 44 E 4.5999 7.4535 120.1465 53.5922 31.7532 175.0324 45 R 4.3247 8.3758 125.4910 56.2608 30.6222 175.8528 46 I 4.1356 8.4645 127.8142 60.5892 37.6868 176.0544 47 E 4.1020 8.8109 124.0312 58.3566 30.1334 177.3272 48 K 4.2564 7.7041 121.5477 54.3788 30.6702 173.5135 49 V 4.4912 7.6700 120.0487 60.5641 34.2927 174.1859 50 E 4.6392 8.2860 126.8723 54.9730 32.7278 174.2301 51 H 5.2341 7.6933 114.8013 54.0118 31.3893 173.3063 52 S 4.5324 8.8334 115.7232 58.2224 64.0085 173.4332 53 D 4.5474 8.4689 120.1817 53.4208 41.3303 176.4027 54 L 4.0252 8.4008 125.2208 56.0836 42.7070 175.8444 55 S 4.6090 8.1817 119.5235 57.3037 66.6304 171.8101 56 F 5.3231 7.3025 115.0555 55.6344 41.0394 174.4902 57 S 4.6446 9.0941 116.7118 57.2230 64.3471 175.2433 58 K 3.6879 8.4403 121.4566 59.4462 31.8688 177.0594 59 D 4.4885 7.8660 116.0886 52.7195 39.4067 177.2352 60 W 3.6195 7.6277 118.7762 56.9146 28.0350 174.6942 61 S 4.2994 8.1402 114.2194 58.1904 63.9866 174.0500 62 F 5.0772 8.5159 121.2290 57.4626 40.3092 174.1563 63 Y 5.5637 8.4197 117.8557 56.0884 41.6206 173.8412 64 L 5.1421 9.5004 121.2347 53.2328 47.1140 174.8367 65 L 5.4632 9.3403 124.5145 53.9412 44.4432 174.7284 66 Y 5.0849 9.1176 124.8456 57.1279 40.3635 174.4855 67 Y 5.3237 8.5129 119.2082 56.8725 41.9213 173.1633 68 T 4.9901 8.7368 114.3639 60.6860 71.4074 172.7532 69 E 3.8713 8.6060 126.6265 56.5045 30.2675 176.0387 70 F 4.6816 8.8005 116.5682 56.5425 41.7253 173.2688 71 T 4.4928 8.0599 116.7715 60.5086 70.4807 171.7265 72 P 4.3383 0.0000 0.0000 63.5954 32.4223 175.3952 73 T 4.9589 8.3595 115.8617 61.8877 72.8300 173.9314 74 E 4.1319 8.8827 123.2843 58.8535 29.7711 177.6783 75 K 4.3937 7.8742 115.7870 57.1017 33.2558 176.7043 76 D 4.5852 8.1464 118.7825 54.2086 41.4713 174.7625 77 E 4.8812 9.0315 124.3689 54.7675 31.9593 174.2563 78 Y 5.8225 9.0507 122.4858 55.6450 42.5399 174.0086 79 A 5.0598 8.4319 121.2464 51.3895 23.2928 175.2928 80 C 5.2869 9.1300 119.4653 54.7289 47.3161 172.5822 81 R 5.1595 9.0947 126.4693 54.5006 32.4917 174.3707 82 V 4.7974 8.8917 126.0092 61.0858 35.0937 173.6368 83 N 5.3068 8.8271 124.6339 52.5016 42.8064 172.2864 84 H 4.9419 8.3708 121.7937 55.2897 33.0152 174.7863 85 V 3.6981 8.2350 115.6097 63.9182 31.5219 177.2599 86 T 4.4080 8.0076 108.8987 61.3482 69.2409 173.7023 87 L 4.8671 7.6351 122.5912 53.0199 44.1548 176.7885 88 S 4.2615 8.8897 119.7313 61.1450 63.0016 174.0700 89 Q 4.6388 7.5137 115.6671 52.8388 32.6661 172.7222 90 P 4.4400 0.0000 0.0000 63.0569 31.9553 176.0550 91 K 4.3692 9.1979 126.8323 55.4361 33.6370 175.0795 92 I 5.1055 8.4139 128.3539 59.4471 39.5070 175.2721 93 V 4.5198 8.4797 126.4058 59.6451 34.0126 175.5917 94 K 4.7165 8.8102 124.2309 55.8984 33.0972 176.2272 95 W 4.7500 9.1767 133.9589 57.0076 31.8147 175.2307 96 D 4.3882 8.3423 125.6165 51.8456 42.6575 176.2087 97 R 3.5584 7.6862 123.7749 58.6669 29.3472 176.9017 98 D 4.8101 8.4756 117.8389 54.1911 40.9030 176.3385 99 M 4.3853 8.1039 125.4563 55.6779 33.0657 175.0005 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 0 M 8.30 4.44 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.58 0.00 1 I 8.14 3.53 1.81 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 1.40 0.63 0.88 0.00 0.00 2 Q 9.32 4.74 0.00 1.91 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.69 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 3 R 9.19 4.75 0.00 1.90 2.08 0.00 3.18 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 4 T 8.83 4.87 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 1.25 0.00 0.00 5 P 0.00 4.91 0.00 1.91 1.66 0.00 3.76 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.69 0.00 6 K 9.34 4.51 0.00 1.75 1.82 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.48 7.81 7 I 8.26 5.15 1.91 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.73 0.95 0.00 0.00 8 Q 9.18 4.73 0.00 2.34 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 9 V 8.68 4.99 2.36 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 0.92 0.00 0.00 1.10 0.00 0.00 10 Y 8.52 5.34 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 11 S 8.96 4.92 0.00 4.27 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 12 R 9.03 4.14 0.00 1.80 2.22 0.00 3.14 0.00 0.00 3.03 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.46 0.00 13 H 8.52 5.12 0.00 3.24 3.21 0.00 5.72 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 14 P 0.00 4.34 0.00 2.10 2.07 0.00 3.78 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 15 A 8.81 4.22 1.62 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 0.00 0.00 16 E 8.60 4.62 0.00 1.98 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 2.30 2.48 0.00 17 N 8.81 4.70 0.00 2.72 2.80 0.00 0.00 7.40 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 18 G 8.86 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.42 4.50 0.00 1.71 1.69 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.49 7.81 20 S 8.24 4.22 0.00 3.86 3.79 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 21 N 8.84 4.98 0.00 2.50 2.55 0.00 0.00 7.03 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 22 F 8.99 5.19 0.00 3.00 2.85 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 23 L 8.85 4.07 0.00 0.27 0.63 -0.12 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 24 N 9.09 5.45 0.00 1.44 2.17 0.00 0.00 5.98 7.54 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 25 C 9.18 5.28 0.00 2.92 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 26 Y 9.41 5.54 0.00 3.39 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 27 V 8.78 5.44 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.99 0.00 0.00 28 S 7.99 5.53 0.00 3.89 3.55 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 29 G 8.88 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.39 5.21 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 31 H 8.94 5.05 0.00 3.30 3.22 0.00 5.58 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.76 0.00 2.13 2.19 0.00 3.91 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 33 S 8.38 4.06 0.00 3.30 2.63 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 34 D 7.89 4.47 0.00 2.64 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 35 I 7.98 4.49 1.69 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.45 0.87 0.00 0.00 36 E 8.84 4.62 0.00 1.87 1.75 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 2.19 2.17 0.00 37 V 7.91 4.49 0.67 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 0.24 0.00 0.00 0.48 0.00 0.00 38 D 8.95 4.89 0.00 2.49 2.42 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 39 L 8.38 5.13 0.00 1.55 1.50 0.85 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.34 5.28 0.00 1.51 1.57 0.91 0.85 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 41 K 8.90 4.16 0.00 1.79 1.60 0.00 1.92 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.07 0.69 7.81 42 N 9.79 4.37 0.00 2.76 2.81 0.00 0.00 7.09 5.76 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 43 G 8.37 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 44 E 7.45 4.60 0.00 1.96 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 2.19 2.19 0.00 45 R 8.38 4.32 0.00 1.79 1.82 0.00 3.52 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 46 I 8.46 4.14 1.87 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.83 0.92 0.00 0.00 47 E 8.81 4.10 0.00 2.07 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 2.27 2.29 0.00 48 K 7.70 4.26 0.00 1.73 1.76 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.35 7.81 49 V 7.67 4.49 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 0.99 0.00 0.00 0.96 0.00 0.00 50 E 8.29 4.64 0.00 1.16 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 51 H 7.69 5.23 0.00 2.07 1.81 0.00 5.73 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.83 4.53 0.00 3.97 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 53 D 8.47 4.55 0.00 2.69 2.63 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 54 L 8.40 4.03 0.00 1.66 1.63 0.93 0.85 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 55 S 8.18 4.61 0.00 3.45 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 56 F 7.30 5.32 0.00 2.94 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 S 9.09 4.64 0.00 4.11 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 58 K 8.44 3.69 0.00 1.60 1.72 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.17 1.27 7.81 59 D 7.87 4.49 0.00 2.81 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 60 W 7.63 3.62 0.00 3.30 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 S 8.14 4.30 0.00 3.81 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 F 8.52 5.08 0.00 1.64 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 63 Y 8.42 5.56 0.00 3.03 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 64 L 9.50 5.14 0.00 1.88 1.71 1.14 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 65 L 9.34 5.46 0.00 2.08 1.75 1.17 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 9.12 5.08 0.00 3.01 2.85 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 67 Y 8.51 5.32 0.00 3.13 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.74 4.99 4.20 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 1.07 0.00 0.00 69 E 8.61 3.87 0.00 1.69 1.56 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 1.49 1.66 0.00 70 F 8.80 4.68 0.00 2.80 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 71 T 8.06 4.49 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 1.16 0.00 0.00 72 P 0.00 4.34 0.00 2.20 2.21 0.00 3.19 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.72 0.00 73 T 8.36 4.96 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 74 E 8.88 4.13 0.00 1.95 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 75 K 7.87 4.39 0.00 1.81 1.86 0.00 1.84 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.40 7.81 76 D 8.15 4.59 0.00 2.92 2.60 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 77 E 9.03 4.88 0.00 2.10 1.73 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 2.27 2.30 0.00 78 Y 9.05 5.82 0.00 3.14 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 79 A 8.43 5.06 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 80 C 9.13 5.29 0.00 2.99 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 81 R 9.09 5.16 0.00 1.82 1.67 0.00 3.05 0.00 0.00 3.07 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.50 0.00 82 V 8.89 4.80 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 0.76 0.00 0.00 0.81 0.00 0.00 83 N 8.83 5.31 0.00 2.77 2.52 0.00 0.00 6.51 8.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 H 8.37 4.94 0.00 3.07 3.01 0.00 5.73 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.24 3.70 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 0.71 0.00 0.00 0.80 0.00 0.00 86 T 8.01 4.41 4.31 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 1.35 0.00 0.00 87 L 7.64 4.87 0.00 1.74 1.79 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.89 4.26 0.00 3.86 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 89 Q 7.51 4.64 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.90 0.00 0.00 0.00 0.00 0.00 2.24 2.40 0.00 90 P 0.00 4.44 0.00 1.91 1.97 0.00 3.65 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 91 K 9.20 4.37 0.00 1.78 1.65 0.00 1.58 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.41 7.81 92 I 8.41 5.11 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.76 0.93 0.00 0.00 93 V 8.48 4.52 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 0.78 0.00 0.00 1.02 0.00 0.00 94 K 8.81 4.72 0.00 1.73 1.87 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.48 7.81 95 W 9.18 4.75 0.00 3.27 3.43 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 96 D 8.34 4.39 0.00 2.58 2.39 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 97 R 7.69 3.56 0.00 1.81 1.23 0.00 2.99 0.00 0.00 3.16 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.51 0.00 98 D 8.48 4.81 0.00 2.59 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 M 8.10 4.39 0.00 1.98 1.89 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00