NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4620 8.3044 120.6165 55.2233 33.5701 174.4361 1 L 4.1133 8.2362 129.1610 54.1984 43.2415 173.9923 2 K 5.0086 9.5287 127.7174 55.1421 33.8802 175.3684 3 I 4.5917 8.7816 126.6633 59.5921 39.8877 174.8852 4 Q 5.0715 8.4863 123.4036 54.3378 32.0289 174.5313 5 A 4.5098 8.5143 122.8080 51.1111 23.4614 174.8345 6 Y 4.8750 8.3687 116.6981 56.3351 40.1484 175.3501 7 F 4.2358 9.0215 124.7257 60.1303 39.8769 174.4203 8 N 3.8214 7.9549 123.4805 54.1723 38.5911 173.9905 9 E 5.0061 7.6462 116.2781 55.6959 33.3416 175.0128 10 T 5.1653 8.5568 114.4916 60.9398 72.5884 173.6699 11 A 4.5968 8.4761 123.3325 50.3357 22.5899 174.9675 12 D 4.8408 8.6620 122.4516 52.8922 41.8492 176.6392 13 L 4.4502 8.9354 126.5353 53.1371 42.2321 175.2768 14 P 4.9315 0.0000 0.0000 63.1613 31.8075 176.6099 15 C 4.7114 9.0613 120.1952 55.0992 45.6123 173.5499 16 Q 3.3276 8.0582 116.2908 56.8391 25.8540 173.5148 17 F 4.5505 7.8463 117.7750 56.3990 40.7698 175.0359 18 A 3.7432 8.1258 130.7307 52.6186 19.2037 176.2311 19 N 3.1400 5.7700 114.1407 53.4734 37.2818 175.6383 20 S 3.9987 7.6576 112.1647 61.1134 63.1974 175.0866 21 Q 4.1709 7.9340 117.4710 55.1602 29.2746 174.9476 22 N 4.1578 8.2121 115.2846 54.3204 36.3692 173.9469 23 Q 4.5212 7.8644 116.1855 54.7027 30.9919 176.6117 24 S 4.6385 8.1728 113.7868 57.1486 64.6068 175.1624 25 L 4.0631 8.6750 124.3570 58.3753 41.8758 179.0057 26 S 4.4228 7.3718 109.8946 59.6334 63.0055 174.2929 27 E 4.5436 8.3595 120.3248 56.3722 30.7943 175.3148 28 L 5.2568 8.3312 120.2015 52.7140 46.0738 175.6457 29 V 4.4547 8.2691 119.8975 61.2428 34.3471 174.2871 30 V 4.5543 8.0395 128.5592 61.2589 33.3398 174.7269 31 F 5.5458 8.9478 126.6519 55.9280 42.6139 174.9956 32 W 6.2211 8.9491 119.8020 55.4799 33.3702 174.2343 33 Q 5.8755 9.1871 122.1207 53.5431 32.3497 174.7156 34 D 4.8216 8.4957 120.2597 52.1110 41.8890 176.7328 35 Q 4.1263 7.8624 116.7716 58.8731 28.6153 177.8146 36 E 4.3452 8.2226 114.8544 55.7659 29.6781 175.6261 37 N 4.3232 8.3998 115.4403 54.2095 36.6152 174.0053 38 L 4.5302 8.5929 118.5822 53.6184 43.1734 176.4630 39 V 4.4501 8.3358 122.5721 62.8784 32.4646 176.3008 40 L 4.0380 9.4132 128.1254 57.0187 41.9990 176.5358 41 N 5.1177 7.9815 114.7658 52.6092 42.7619 172.7979 42 E 4.8703 8.7337 123.8845 54.9279 33.3985 174.1843 43 V 4.3271 8.3101 128.5598 61.5458 32.1084 172.8675 44 Y 4.0173 9.0344 128.8905 56.1136 39.5420 175.2000 45 L 3.7675 9.1715 129.8622 55.7842 40.0558 176.4092 46 G 3.9782 8.4830 106.5294 44.8666 0.0000 174.1654 47 K 4.6178 7.8734 118.5343 54.0560 34.5801 175.4813 48 E 4.2968 8.4781 121.7459 56.1403 29.9914 176.3479 49 K 4.3637 9.0188 125.4387 54.6728 34.2425 175.6726 50 F 5.3488 8.3035 121.5684 57.3367 40.1979 176.8247 51 D 4.5341 8.4005 121.6527 56.8824 40.6505 177.3280 52 S 4.6802 7.9803 111.0855 57.8475 64.0589 173.9032 53 V 4.1175 7.6045 120.7396 62.4948 31.6375 175.4428 54 H 4.3211 8.9553 127.8373 56.0588 30.2299 176.3094 55 S 4.2228 8.3526 119.1404 60.8469 63.0850 176.2927 56 K 3.9880 8.4178 119.0775 58.7359 32.4411 176.7430 57 Y 4.7860 7.8486 116.3884 58.1073 39.8514 175.4619 58 M 3.9391 7.3454 119.5360 57.2148 32.5167 175.8677 59 G 4.0475 8.8497 114.1186 45.6035 0.0000 174.0942 60 R 4.4187 8.1463 117.1519 56.2692 30.5938 175.5739 61 T 4.9880 7.5849 107.7962 60.0969 71.9332 173.6216 62 S 4.6068 8.7087 117.1918 57.2155 66.1773 172.2575 63 F 5.2804 8.9424 129.5403 56.6880 41.2524 174.3397 64 D 4.4879 8.1906 126.4167 52.0305 41.9920 176.4473 65 S 3.1171 8.1028 121.6472 60.8468 63.1299 175.8227 66 D 4.3475 7.7947 120.3539 56.2946 40.5197 177.0854 67 S 4.6392 7.0587 110.5138 56.7092 64.6127 173.5927 68 W 3.4172 7.6547 120.9931 58.3624 26.6574 173.4751 69 T 5.3138 6.8790 114.1091 61.7603 73.2902 174.2159 70 L 4.8186 8.4247 127.4039 53.2618 44.2074 174.7740 71 R 4.6468 9.1005 127.9425 54.6912 32.0971 174.3191 72 L 4.8145 8.5019 129.2953 54.0693 43.5544 175.5739 73 H 4.7358 9.7760 124.9983 53.7985 30.7387 174.4812 74 N 3.9883 8.4216 115.6513 54.5022 36.9448 174.2442 75 L 4.3394 8.0082 119.4351 55.2675 43.1161 177.2307 76 Q 5.2407 10.2397 121.5882 53.8327 31.5237 176.9138 77 I 3.9823 8.6593 121.0390 64.6317 37.2728 178.4246 78 K 4.2892 8.0232 117.5615 58.3542 32.1598 177.6698 79 D 4.7301 8.4105 118.9052 55.7915 40.9700 176.9955 80 K 4.3357 7.7117 118.3648 55.7859 33.3057 177.7513 81 G 3.8005 7.5738 107.9686 45.4942 0.0000 170.4650 82 L 4.9258 7.5933 121.1656 54.4886 43.9302 176.1302 83 Y 4.8750 9.1496 122.0332 56.4657 42.7903 174.1395 84 Q 5.0791 9.1221 121.0517 55.0397 33.1801 172.2708 85 C 4.4273 9.4191 126.7537 54.7779 43.7000 172.2467 86 I 4.9501 8.0739 126.2363 59.5139 40.5808 174.3053 87 I 4.7941 8.6511 127.7015 59.6765 40.2215 174.3834 88 H 5.3512 8.9451 123.1334 54.2005 32.7958 172.0685 89 H 5.1883 9.0805 121.8564 54.6206 31.2912 174.1645 90 K 4.5792 8.7428 128.1061 55.9689 32.4650 176.0820 91 K 4.6763 8.5148 124.4481 54.1997 35.7278 175.5584 92 P 4.2021 0.0000 0.0000 65.9785 31.3630 176.8128 93 T 4.4499 7.8015 113.3319 61.9640 70.2099 171.8455 94 G 3.8425 8.2967 111.6643 43.9823 0.0000 169.8783 95 M 5.2770 8.2903 117.3871 53.8494 36.9261 174.9510 96 I 4.6068 8.4368 119.8850 59.4546 41.0103 175.1612 97 R 4.3323 8.8304 128.6098 56.3096 30.2977 175.8438 98 I 4.5777 8.3090 118.1083 60.1524 39.1166 174.7083 99 H 4.4369 7.5404 119.9572 56.1425 32.7062 172.5930 100 Q 5.4765 8.1051 121.7508 54.7650 33.2216 173.8813 101 M 4.6626 8.2911 120.4669 54.7500 36.0695 173.2624 102 N 5.5120 8.8635 122.9332 52.2654 41.7904 173.9801 103 S 5.0614 9.0137 115.9717 57.0390 68.0545 172.9057 104 E 5.0336 9.6073 125.1312 54.5346 31.6707 174.1780 105 L 4.9956 9.0433 130.5122 54.2100 44.0737 175.2619 106 S 5.0936 9.0536 122.2133 56.6643 65.8811 173.0793 107 V 4.7072 8.5002 124.2204 61.2588 33.2008 174.4298 108 L 4.7177 8.5920 128.3351 53.2945 43.7578 177.1286 109 A 4.3618 8.5544 124.6810 52.3515 19.1795 176.7612 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 4.46 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.63 0.00 1 L 8.24 4.11 0.00 1.89 1.60 0.97 0.30 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 2 K 9.53 5.01 0.00 1.69 1.75 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.47 7.81 3 I 8.78 4.59 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.07 0.89 0.00 0.00 4 Q 8.49 5.07 0.00 1.81 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.74 0.00 0.00 0.00 0.00 0.00 2.18 2.28 0.00 5 A 8.51 4.51 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 6 Y 8.37 4.87 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 7 F 9.02 4.24 0.00 3.07 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 8 N 7.95 3.82 0.00 1.44 2.36 0.00 0.00 6.97 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 9 E 7.65 5.01 0.00 2.05 1.71 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 2.32 2.53 0.00 10 T 8.56 5.17 4.06 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 1.08 0.00 0.00 11 A 8.48 4.60 1.11 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 0.00 0.00 12 D 8.66 4.84 0.00 2.54 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 13 L 8.94 4.45 0.00 1.30 1.69 0.73 0.40 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 14 P 0.00 4.93 0.00 2.22 2.16 0.00 3.88 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.06 0.00 15 C 9.06 4.71 0.00 3.50 3.53 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 16 Q 8.06 3.33 0.00 2.30 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.51 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 17 F 7.85 4.55 0.00 2.21 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 0.00 0.00 0.00 0.00 18 A 8.13 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 N 5.77 3.14 0.00 1.72 2.36 0.00 0.00 6.96 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 20 S 7.66 4.00 0.00 3.93 3.88 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 21 Q 7.93 4.17 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 22 N 8.21 4.16 0.00 2.78 2.85 0.00 0.00 6.89 8.32 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 23 Q 7.86 4.52 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 2.42 2.29 0.00 24 S 8.17 4.64 0.00 4.08 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 25 L 8.68 4.06 0.00 1.75 1.73 0.93 0.85 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 26 S 7.37 4.42 0.00 4.02 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 27 E 8.36 4.54 0.00 2.04 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 2.27 2.29 0.00 28 L 8.33 5.26 0.00 1.65 1.57 1.18 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 29 V 8.27 4.45 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.53 0.00 0.00 30 V 8.04 4.55 1.76 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 0.70 0.00 0.00 0.96 0.00 0.00 31 F 8.95 5.55 0.00 2.95 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 32 W 8.95 6.22 0.00 3.22 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 33 Q 9.19 5.88 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.19 0.00 34 D 8.50 4.82 0.00 2.53 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 35 Q 7.86 4.13 0.00 1.98 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 7.04 0.00 0.00 0.00 0.00 0.00 2.35 2.25 0.00 36 E 8.22 4.35 0.00 2.08 1.97 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 2.25 2.30 0.00 37 N 8.40 4.32 0.00 2.84 2.93 0.00 0.00 6.89 7.79 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 38 L 8.59 4.53 0.00 2.15 1.77 0.88 0.95 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 39 V 8.34 4.45 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 1.31 0.00 0.00 0.95 0.00 0.00 40 L 9.41 4.04 0.00 1.51 1.45 -0.22 0.83 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 41 N 7.98 5.12 0.00 2.82 2.65 0.00 0.00 6.52 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 42 E 8.73 4.87 0.00 2.27 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 2.20 1.81 0.00 43 V 8.31 4.33 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 0.82 0.00 0.00 0.53 0.00 0.00 44 Y 9.03 4.02 0.00 3.04 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 45 L 9.17 3.77 0.00 1.72 1.65 0.79 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.48 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 47 K 7.87 4.62 0.00 1.80 1.64 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.37 7.81 48 E 8.48 4.30 0.00 1.59 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 2.27 2.25 0.00 49 K 9.02 4.36 0.00 1.55 1.63 0.00 1.43 0.00 0.00 2.03 0.00 0.00 2.77 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.28 1.22 7.81 50 F 8.30 5.35 0.00 3.15 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 51 D 8.40 4.53 0.00 2.68 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 52 S 7.98 4.68 0.00 3.96 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 53 V 7.60 4.12 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 0.95 0.00 0.00 1.33 0.00 0.00 54 H 8.96 4.32 0.00 3.36 3.26 0.00 5.64 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.35 4.22 0.00 4.01 4.06 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 56 K 8.42 3.99 0.00 1.62 1.75 0.00 0.61 0.00 0.00 1.24 0.00 0.00 2.65 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.53 0.21 7.81 57 Y 7.85 4.79 0.00 3.16 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 58 M 7.35 3.94 0.00 1.86 1.93 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 59 G 8.85 4.05 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 0.00 0.00 0.00 60 R 8.15 4.42 0.00 2.10 2.16 0.00 3.37 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 61 T 7.58 4.99 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 1.18 0.00 0.00 62 S 8.71 4.61 0.00 3.98 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 63 F 8.94 5.28 0.00 2.96 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 64 D 8.19 4.49 0.00 2.56 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 0.00 0.00 0.00 0.00 65 S 8.10 3.12 0.00 3.55 3.69 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 66 D 7.79 4.35 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 67 S 7.06 4.64 0.00 4.17 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 68 W 7.65 3.42 0.00 3.78 3.62 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 69 T 6.88 5.31 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 1.21 0.00 0.00 70 L 8.42 4.82 0.00 0.27 0.13 0.69 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 71 R 9.10 4.65 0.00 1.87 1.76 0.00 3.01 0.00 0.00 2.90 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.39 0.00 72 L 8.50 4.81 0.00 1.50 1.29 1.02 1.04 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 73 H 9.78 4.74 0.00 2.87 3.20 0.00 6.05 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 N 8.42 3.99 0.00 2.77 2.78 0.00 0.00 7.00 7.78 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 75 L 8.01 4.34 0.00 1.71 1.61 0.98 0.81 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 76 Q 10.24 5.24 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.75 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 77 I 8.66 3.98 1.90 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 1.36 1.29 0.93 0.00 0.00 78 K 8.02 4.29 0.00 1.79 1.90 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.50 7.81 79 D 8.41 4.73 0.00 2.88 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 80 K 7.71 4.34 0.00 2.11 1.90 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.70 1.44 7.81 81 G 7.57 3.80 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 0.00 0.00 0.00 82 L 7.59 4.93 0.00 1.76 1.45 1.02 0.78 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 83 Y 9.15 4.87 0.00 3.12 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 84 Q 9.12 5.08 0.00 2.23 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.79 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 85 C 9.42 4.43 0.00 2.24 2.56 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 86 I 8.07 4.95 1.97 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.52 0.92 0.00 0.00 87 I 8.65 4.79 1.28 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.46 0.38 0.00 0.00 88 H 8.95 5.35 0.00 3.03 3.15 0.00 5.79 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 H 9.08 5.19 0.00 3.14 3.14 0.00 5.60 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 K 8.74 4.58 0.00 1.64 1.59 0.00 1.63 0.00 0.00 1.52 0.00 0.00 3.25 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.37 7.81 91 K 8.51 4.68 0.00 1.89 1.76 0.00 1.39 0.00 0.00 1.63 0.00 0.00 3.09 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.33 1.38 7.81 92 P 0.00 4.20 0.00 2.06 2.18 0.00 3.61 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 2.03 2.15 0.00 93 T 7.80 4.45 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 1.22 0.00 0.00 94 G 8.30 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 95 M 8.29 5.28 0.00 1.87 1.92 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 96 I 8.44 4.61 1.89 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 1.12 0.72 0.93 0.00 0.00 97 R 8.83 4.33 0.00 1.75 1.79 0.00 3.08 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.44 0.00 98 I 8.31 4.58 1.88 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 1.07 0.63 0.98 0.00 0.00 99 H 7.54 4.44 0.00 3.07 2.66 0.00 5.65 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 Q 8.11 5.48 0.00 1.80 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.40 0.00 0.00 0.00 0.00 0.00 2.16 2.08 0.00 101 M 8.29 4.66 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.80 0.00 102 N 8.86 5.51 0.00 2.71 2.74 0.00 0.00 6.89 7.57 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 0.00 103 S 9.01 5.06 0.00 3.96 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 0.00 104 E 9.61 5.03 0.00 2.01 1.86 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 2.24 2.25 0.00 105 L 9.04 5.00 0.00 1.92 1.82 0.97 0.63 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 0.00 106 S 9.05 5.09 0.00 3.76 3.72 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 0.00 107 V 8.50 4.71 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 0.97 0.00 0.00 1.06 0.00 0.00 108 L 8.59 4.72 0.00 1.83 1.68 0.89 0.55 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 0.00 109 A 8.55 4.36 1.13 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 0.00 0.00