NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1649 8.1727 122.0500 56.4784 34.0750 173.9574 2 M 4.8374 8.4378 127.3493 53.3197 33.0623 174.6345 3 F 4.4154 9.8831 127.0709 57.6559 40.5295 174.8001 4 E 4.2665 8.9642 120.7509 55.5004 31.0279 176.6045 5 R 3.4957 9.1050 120.6063 61.0662 29.9317 179.3615 6 C 4.3067 8.0395 115.1753 59.7703 40.4285 175.6797 7 E 3.9113 8.1883 120.6088 59.2779 29.1912 178.5798 8 L 3.5859 8.0447 119.9892 57.8929 42.1107 178.5360 9 A 3.9331 7.9169 120.7326 55.5080 18.2886 179.9279 10 R 3.9271 8.1245 116.3430 59.4697 29.9607 179.3724 11 T 3.8755 7.8561 115.7031 66.5854 68.5445 176.6775 12 L 3.8156 8.1250 121.2652 57.3955 41.5371 179.3590 13 K 3.8643 8.0276 119.4933 59.8123 31.9940 178.8317 14 R 3.9241 8.0997 117.1322 59.2810 30.0525 178.0680 15 L 4.3411 7.3347 115.7293 54.3870 41.7332 177.1658 16 G 3.8512 8.1451 107.3711 46.7202 0.0000 174.9108 17 M 3.9503 7.7072 120.5982 56.1996 32.4226 175.4582 18 D 4.6487 7.9782 117.2422 55.9162 40.4547 175.5145 19 G 3.9312 9.4671 114.8052 45.3178 0.0000 170.7914 20 Y 4.2194 8.2515 121.8928 58.6708 38.9243 176.4976 21 R 3.5770 8.9492 127.1201 57.3277 27.7238 177.2211 22 G 3.8116 8.2227 103.0095 45.8442 0.0000 173.9409 23 I 4.0788 7.4818 121.9483 59.2819 37.9835 176.0045 24 S 4.6822 8.2870 120.7662 57.9346 64.9797 174.9029 25 L 4.2374 8.5510 123.5796 58.3883 41.8460 178.9426 26 A 4.1210 8.1211 120.3189 55.1529 18.3566 179.2425 27 N 4.4103 8.0269 115.3746 56.3174 38.5403 177.6950 28 W 4.2897 7.8730 120.5007 59.9851 29.0408 178.5409 29 M 4.1146 8.5100 118.9685 58.5353 31.4214 177.9260 30 C 3.2154 8.0326 118.7107 59.1105 43.5323 175.3088 31 L 3.9966 8.1173 121.5972 58.2871 41.7755 178.7260 32 A 4.2578 8.3462 122.1302 54.3847 18.2804 179.4047 33 K 3.1103 8.3765 118.2379 59.4886 32.0979 179.1469 34 W 4.2422 7.9181 117.2068 59.1670 29.0413 178.2364 35 E 4.3861 8.4356 118.9482 58.6776 29.2905 177.7808 36 S 4.5146 8.1385 108.7806 56.9901 65.4589 174.5024 37 G 3.3839 8.2779 109.0123 47.0180 0.0000 173.6305 38 Y 3.6849 7.8074 113.5850 58.5205 35.3616 168.4370 39 N 5.2702 7.6530 120.1166 52.1094 39.3756 175.9403 40 T 4.0992 8.9795 117.6490 64.0738 69.0338 175.8766 41 R 4.4427 8.2368 119.3680 55.7909 30.8811 176.3277 42 A 4.3046 7.6683 121.4256 52.8836 19.3555 176.9265 43 T 5.1104 8.2649 110.5701 60.2617 72.3222 172.9339 44 N 4.8796 8.8727 122.3911 52.2527 42.2809 172.3215 45 Y 4.8154 8.7237 127.9510 57.1664 41.0027 173.8670 46 N 4.7213 8.5584 124.5860 51.1560 38.9271 175.2586 47 A 3.5843 8.2416 127.6657 54.7584 18.9856 179.0312 48 G 3.8314 8.1459 104.1691 48.3052 0.0000 173.9098 49 D 4.7830 7.6284 115.4410 51.8971 39.8534 175.5907 50 R 4.1343 7.9818 115.9455 57.1550 28.2086 175.7133 51 S 5.0160 7.7598 110.3013 56.8974 67.0551 172.5110 52 T 5.1337 8.8641 115.4473 62.0158 72.8934 172.8798 53 D 5.5170 9.0253 125.3001 53.2142 43.2560 175.1101 54 Y 5.0477 9.0896 120.5489 57.4773 41.8384 177.3092 55 G 4.4558 8.8581 111.2501 46.1736 0.0000 173.6301 56 I 3.9678 8.0757 116.3733 62.8754 37.9841 177.7226 57 F 4.8817 7.9774 115.7991 56.4432 39.8753 175.1045 58 Q 3.6247 7.8877 119.2010 57.0716 26.7362 174.3543 59 I 4.3168 8.0340 118.4756 61.2517 39.0339 176.8505 60 N 5.3362 9.2067 126.1110 53.4552 39.7338 175.8099 61 S 4.6318 9.0571 120.3851 60.4297 63.3841 175.4608 62 R 3.7565 8.8179 122.4018 58.7804 30.2309 177.8654 63 Y 4.2741 7.7157 113.9615 57.5038 40.7351 177.1318 64 W 4.7111 8.2044 119.2344 57.6854 29.9688 173.6785 65 C 5.5672 7.9261 110.5981 53.4843 45.8043 171.8544 66 N 5.1522 8.8299 119.6084 52.1370 39.4898 174.7868 67 D 4.7711 8.6594 123.5428 52.3032 40.2024 177.2973 68 G 3.9648 8.3420 107.0999 46.2000 0.0000 174.4891 69 K 4.5253 8.2287 116.8736 56.4597 33.1044 175.6814 70 T 4.6114 7.7033 116.8844 61.3248 69.6427 172.1393 71 P 4.1379 0.0000 0.0000 64.1803 31.6118 176.1962 72 G 3.9458 8.7953 110.6196 46.3100 0.0000 173.0230 73 A 4.3542 7.4505 119.9248 51.4016 19.6176 177.9362 74 V 4.2728 8.1792 112.8961 59.3594 35.1602 176.1692 75 N 4.9371 8.0033 116.9477 52.0226 37.6978 174.5244 76 A 4.0101 8.9203 125.0919 54.8074 19.1039 178.4720 77 C 4.5766 8.5434 111.1369 57.1972 41.2267 173.0415 78 H 4.0125 7.7852 116.4321 56.4808 26.3266 174.4523 79 L 4.7948 8.4078 117.9647 52.8333 46.4216 176.7246 80 S 4.5830 8.4327 116.2807 58.0913 63.1920 175.9553 81 C 4.0113 8.6729 124.4797 59.7544 40.6344 176.3896 82 S 3.8563 7.7377 114.7897 61.2541 61.9292 175.9743 83 A 4.0384 8.1386 123.5228 54.5709 17.6807 178.5087 84 L 4.3471 7.9330 116.1387 55.2424 41.7775 177.6844 85 L 5.0774 7.8738 117.4661 54.5109 42.3616 176.7354 86 Q 4.3543 7.4211 117.4603 55.4193 29.4006 176.1876 87 D 4.4021 8.5459 120.1722 57.1027 41.1482 176.6726 88 N 4.5846 8.0224 118.2285 53.1244 39.1554 174.7116 89 I 4.1754 8.4615 118.9042 61.0978 37.9196 177.0377 90 A 3.9279 8.2122 124.6141 55.9949 18.1731 179.9836 91 D 4.2681 8.0893 116.4654 57.3571 40.8965 178.7168 92 A 4.0832 7.9680 120.9765 55.1068 18.3748 179.7343 93 V 3.4269 8.2144 117.0708 65.9531 31.6153 178.0849 94 A 3.8441 8.1395 120.7917 55.2996 18.1461 178.8622 95 C 4.2237 8.4500 116.8318 59.7196 37.9506 175.5923 96 A 3.9191 8.3516 122.8458 54.9845 17.5726 179.8077 97 K 3.8353 7.8592 116.6640 59.5195 32.2300 179.0900 98 R 4.0847 7.7685 118.9309 59.3925 30.0487 178.6093 99 V 2.4217 7.5221 117.9136 65.7746 31.1465 178.1991 100 V 3.8492 7.6590 110.1265 63.0988 31.2610 177.9990 101 R 4.1848 7.6158 117.2894 56.9563 30.5438 176.3157 102 D 4.7462 7.5912 119.7148 52.4475 41.8801 175.2194 103 P 4.2296 0.0000 0.0000 66.3869 30.9069 177.7663 104 Q 4.0397 8.1469 116.8301 56.1181 30.0839 177.1030 105 G 3.7266 7.8541 107.0115 46.6004 0.0000 175.7479 106 I 3.4619 7.8178 119.2926 63.6773 37.8944 177.9647 107 R 4.3004 7.2404 117.3441 57.4960 29.9336 177.3624 108 A 4.0781 7.7375 121.5623 54.2915 18.6301 177.8495 109 W 4.6914 8.1424 117.0271 55.4549 29.9258 177.5882 110 V 3.7546 8.7401 123.5964 65.9937 30.9768 177.6750 111 A 4.1782 8.3013 120.1982 54.6990 18.1248 179.2908 112 W 3.9750 8.4145 127.2085 60.6392 30.5917 178.5192 113 R 3.7417 8.1999 116.5032 59.2371 29.6702 178.3538 114 N 4.4142 8.3979 115.5277 55.6448 38.6744 176.2809 115 R 4.2386 7.8937 114.9742 55.7235 31.2855 175.4701 116 C 4.5179 7.2315 114.6385 57.7386 43.1258 174.3735 117 Q 3.1871 6.6683 120.0055 57.1520 28.8693 175.5324 118 N 4.1717 8.5274 121.0733 54.6634 36.3564 173.9721 119 R 4.5384 7.2889 113.5694 54.1426 33.8146 175.7091 120 D 4.5861 8.5411 119.6099 54.0077 40.6832 175.9043 121 V 4.6590 8.2040 119.4026 61.2958 32.3901 178.3308 122 R 4.0180 8.3135 122.5537 59.4269 30.0139 178.9225 123 Q 4.0038 8.2093 114.2524 59.4105 28.3452 177.8016 124 Y 4.2407 7.9422 115.5420 60.1670 38.1641 176.9302 125 V 4.3644 7.7786 110.1788 60.6654 32.7607 175.5565 126 Q 4.1307 8.1234 119.9485 57.4286 28.8158 176.7809 127 G 3.9283 8.8169 109.5236 46.4959 0.0000 174.6992 128 C 4.4254 8.2109 115.9409 56.6115 40.5725 174.3845 129 G 3.8899 8.1184 107.2261 46.4025 0.0000 174.1766 130 V 3.9758 7.8106 118.0739 61.0963 31.8583 175.9147 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 K 8.17 4.16 0.00 1.98 1.65 0.00 1.29 0.00 0.00 1.10 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.86 1.09 7.81 2 M 8.44 4.84 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 2.61 2.76 0.00 3 F 9.88 4.42 0.00 2.88 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 4 E 8.96 4.27 0.00 1.96 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 2.29 2.40 0.00 5 R 9.10 3.50 0.00 2.02 1.93 0.00 3.37 0.00 0.00 3.43 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.88 0.00 6 C 8.04 4.31 0.00 3.01 3.13 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 7 E 8.19 3.91 0.00 2.06 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 0.00 2.57 2.43 0.00 8 L 8.04 3.59 0.00 1.38 1.38 -0.15 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.92 3.93 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 10 R 8.12 3.93 0.00 1.88 1.98 0.00 3.14 0.00 0.00 3.31 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.86 3.88 4.19 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 1.19 0.00 0.00 12 L 8.13 3.82 0.00 1.74 1.56 0.90 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.03 3.86 0.00 1.93 1.91 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 8.10 3.92 0.00 1.90 1.98 0.00 3.20 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 15 L 7.33 4.34 0.00 1.56 1.56 0.86 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.15 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 17 M 7.71 3.95 0.00 1.33 1.97 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.18 0.00 18 D 7.98 4.65 0.00 2.68 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 19 G 9.47 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 0.00 0.00 0.00 20 Y 8.25 4.22 0.00 3.37 3.20 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 21 R 8.95 3.58 0.00 1.83 1.82 0.00 3.32 0.00 0.00 2.93 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.32 0.00 22 G 8.22 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 0.00 0.00 0.00 23 I 7.48 4.08 1.79 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.68 -0.25 0.00 0.00 24 S 8.29 4.68 0.00 4.10 4.03 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 25 L 8.55 4.24 0.00 1.89 1.80 1.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.12 4.12 1.53 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 0.00 0.00 27 N 8.03 4.41 0.00 2.73 2.71 0.00 0.00 6.95 7.53 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 28 W 7.87 4.29 0.00 3.51 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 29 M 8.51 4.11 0.00 2.16 2.31 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.93 0.00 30 C 8.03 3.22 0.00 2.54 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 31 L 8.12 4.00 0.00 1.82 1.90 0.62 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.35 4.26 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 0.00 0.00 0.00 0.00 0.00 33 K 8.38 3.11 0.00 1.88 1.78 0.00 0.61 0.00 0.00 1.03 0.00 0.00 2.74 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.28 0.60 7.81 34 W 7.92 4.24 0.00 3.35 3.29 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 35 E 8.44 4.39 0.00 2.15 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 0.00 2.57 2.44 0.00 36 S 8.14 4.51 0.00 4.09 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 37 G 8.28 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.81 3.68 0.00 3.28 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 39 N 7.65 5.27 0.00 2.77 2.88 0.00 0.00 6.99 7.07 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 40 T 8.98 4.10 4.46 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 1.51 0.00 0.00 41 R 8.24 4.44 0.00 2.00 2.03 0.00 3.19 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 1.64 1.58 0.00 42 A 7.67 4.30 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 43 T 8.26 5.11 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 1.25 0.00 0.00 44 N 8.87 4.88 0.00 2.85 2.88 0.00 0.00 6.71 7.38 0.00 0.00 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 Y 8.72 4.82 0.00 2.99 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 46 N 8.56 4.72 0.00 2.59 2.59 0.00 0.00 6.62 8.16 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 47 A 8.24 3.58 1.29 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 48 G 8.15 3.83 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 0.00 0.00 0.00 49 D 7.63 4.78 0.00 2.70 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 50 R 7.98 4.13 0.00 2.06 2.19 0.00 3.09 0.00 0.00 3.17 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.53 0.00 51 S 7.76 5.02 0.00 3.85 3.89 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 T 8.86 5.13 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 0.69 0.00 0.00 53 D 9.03 5.52 0.00 2.71 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 54 Y 9.09 5.05 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 55 G 8.86 4.46 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 0.00 0.00 0.00 56 I 8.08 3.97 1.70 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 2.30 0.17 0.00 0.00 57 F 7.98 4.88 0.00 3.23 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 58 Q 7.89 3.62 0.00 2.56 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.83 0.00 0.00 0.00 0.00 0.00 2.42 2.79 0.00 59 I 8.03 4.32 2.14 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.06 1.12 0.00 0.00 60 N 9.21 5.34 0.00 3.10 3.06 0.00 0.00 6.98 7.50 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 61 S 9.06 4.63 0.00 4.07 4.38 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.82 3.76 0.00 1.53 1.14 0.00 2.63 0.00 0.00 2.87 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.05 0.00 63 Y 7.72 4.27 0.00 1.56 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 0.00 0.00 0.00 64 W 8.20 4.71 0.00 3.67 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 65 C 7.93 5.57 0.00 3.17 3.20 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 66 N 8.83 5.15 0.00 2.79 2.69 0.00 0.00 7.09 8.01 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 67 D 8.66 4.77 0.00 2.84 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.34 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 69 K 8.23 4.53 0.00 1.89 1.87 0.00 1.57 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.62 1.44 7.81 70 T 7.70 4.61 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 1.20 0.00 0.00 71 P 0.00 4.14 0.00 2.02 2.01 0.00 3.83 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 72 G 8.80 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 0.00 0.00 0.00 73 A 7.45 4.35 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 74 V 8.18 4.27 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 0.63 0.00 0.00 0.89 0.00 0.00 75 N 8.00 4.94 0.00 2.74 2.54 0.00 0.00 6.78 8.54 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 76 A 8.92 4.01 1.26 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 0.00 0.00 0.00 77 C 8.54 4.58 0.00 3.27 3.24 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 78 H 7.79 4.01 0.00 3.32 3.38 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.41 4.79 0.00 1.67 1.50 1.00 0.79 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 80 S 8.43 4.58 0.00 3.83 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 81 C 8.67 4.01 0.00 2.24 1.23 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 82 S 7.74 3.86 0.00 3.80 3.83 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 83 A 8.14 4.04 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 84 L 7.93 4.35 0.00 1.94 1.83 1.08 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.87 5.08 0.00 1.78 1.72 1.13 1.01 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 86 Q 7.42 4.35 0.00 2.35 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.57 6.99 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 87 D 8.55 4.40 0.00 2.63 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 88 N 8.02 4.58 0.00 2.70 2.75 0.00 0.00 6.97 7.94 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 89 I 8.46 4.18 1.74 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.95 0.93 0.00 0.00 90 A 8.21 3.93 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 91 D 8.09 4.27 0.00 2.75 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 92 A 7.97 4.08 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.21 3.43 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 0.89 0.00 0.00 94 A 8.14 3.84 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 95 C 8.45 4.22 0.00 3.14 3.29 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 96 A 8.35 3.92 0.78 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 0.00 0.00 97 K 7.86 3.84 0.00 1.65 1.55 0.00 1.30 0.00 0.00 0.78 0.00 0.00 2.18 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.30 0.94 7.81 98 R 7.77 4.08 0.00 2.00 2.16 0.00 3.29 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.00 0.00 99 V 7.52 2.42 1.72 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 -0.35 0.00 0.00 -0.48 0.00 0.00 100 V 7.66 3.85 2.14 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 1.10 0.00 0.00 1.44 0.00 0.00 101 R 7.62 4.18 0.00 1.97 2.04 0.00 3.23 0.00 0.00 3.39 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.10 0.00 102 D 7.59 4.75 0.00 3.08 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.23 0.00 2.15 2.20 0.00 3.77 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 1.98 2.01 0.00 104 Q 8.15 4.04 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.85 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.85 3.73 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 0.00 0.00 0.00 106 I 7.82 3.46 0.99 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.33 -0.76 0.00 0.00 107 R 7.24 4.30 0.00 1.99 2.04 0.00 3.22 0.00 0.00 3.28 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.51 0.00 108 A 7.74 4.08 0.82 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 0.00 0.00 109 W 8.14 4.69 0.00 3.51 3.26 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 0.00 110 V 8.74 3.75 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 1.14 0.00 0.00 1.01 0.00 0.00 111 A 8.30 4.18 1.53 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 0.00 0.00 112 W 8.41 3.97 0.00 3.50 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 0.00 113 R 8.20 3.74 0.00 2.02 2.00 0.00 3.35 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.01 0.00 114 N 8.40 4.41 0.00 2.69 2.72 0.00 0.00 6.87 7.42 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 0.00 115 R 7.89 4.24 0.00 1.14 0.73 0.00 2.21 0.00 0.00 2.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.08 0.00 116 C 7.23 4.52 0.00 1.59 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 0.00 117 Q 6.67 3.19 0.00 0.93 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.73 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 118 N 8.53 4.17 0.00 2.77 2.80 0.00 0.00 6.81 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 0.00 119 R 7.29 4.54 0.00 1.79 1.76 0.00 3.23 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 120 D 8.54 4.59 0.00 2.65 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 0.00 121 V 8.20 4.66 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 0.94 0.00 0.00 1.04 0.00 0.00 122 R 8.31 4.02 0.00 2.04 2.02 0.00 3.17 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 123 Q 8.21 4.00 0.00 1.93 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 7.10 0.00 0.00 0.00 0.00 0.00 2.20 1.60 0.00 124 Y 7.94 4.24 0.00 3.27 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 0.00 125 V 7.78 4.36 2.14 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 0.93 0.00 0.00 1.05 0.00 0.00 126 Q 8.12 4.13 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.34 0.00 0.00 0.00 0.00 0.00 2.50 2.31 0.00 127 G 8.82 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 0.00 0.00 0.00 128 C 8.21 4.43 0.00 3.08 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 0.00 129 G 8.12 3.89 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 0.00 0.00 0.00 130 V 7.81 3.98 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 0.73 0.00 0.00 0.96 0.00 0.00