NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -6 D 4.6828 8.2233 120.5353 53.9963 42.2454 176.3389 -5 S 4.0414 8.6040 117.2959 59.2589 62.9707 173.2215 -4 G 3.9320 7.3006 108.6357 46.2891 0.0000 173.5646 -3 I 3.9707 7.8341 112.4928 60.0830 38.8121 175.5375 -2 S 4.5899 8.2132 117.4995 56.0806 65.1025 173.1450 -1 P 3.7355 0.0000 0.0000 65.3071 30.7981 178.3190 0 R 3.3985 7.6388 114.6326 56.3151 29.9482 176.5936 1 A 4.7364 7.7290 120.0658 51.7759 20.0597 178.0562 2 V 3.8279 7.4361 116.2197 61.9069 33.3789 176.1453 3 W 4.1005 8.8558 135.0000 61.1169 30.6085 178.6982 4 Q 3.9883 8.2360 117.1717 58.5979 28.0151 178.1206 5 F 4.1098 8.0396 120.6743 61.4384 39.1376 177.2155 6 R 3.6805 7.3806 116.7187 59.0819 30.0933 179.0132 7 K 4.0128 7.4788 117.5086 59.7079 32.2695 178.9312 8 M 3.6314 8.0055 118.8001 58.5076 31.9127 178.0291 9 I 3.2934 7.2722 118.7017 63.5135 36.8043 177.6416 10 K 4.3014 7.7020 119.7894 57.9628 31.8674 178.2787 11 C 4.5212 8.3116 117.8548 59.3062 39.8474 175.5686 12 V 4.0273 7.1940 107.9825 60.5984 33.4102 175.5366 13 I 4.3786 7.8131 121.8647 58.4467 38.4502 173.7958 14 P 4.2472 0.0000 0.0000 62.7794 32.0276 174.7632 15 G 3.8955 8.5514 105.1986 44.1375 0.0000 174.5419 16 S 4.2609 8.5666 113.5415 60.8677 63.9142 174.8107 17 D 4.9837 7.5969 119.0092 51.9492 41.3994 174.6556 18 P 4.2807 0.0000 0.0000 65.1833 32.4461 179.1252 19 F 4.4273 8.5932 115.0973 60.3035 36.9995 177.1768 20 L 3.5104 6.6907 119.1828 57.5098 41.0609 179.3384 21 E 3.9538 8.0123 117.5394 58.5525 29.2875 177.3228 22 Y 4.1539 7.6387 114.4593 57.3692 38.2615 174.7744 23 N 5.1213 7.5439 116.8014 51.9393 41.1951 174.5362 24 N 4.2064 8.6984 117.8752 54.0692 35.9693 172.6315 25 Y 4.8790 7.1543 118.6566 56.7252 43.0754 175.6433 26 G 3.9575 8.2960 115.5553 46.4205 0.0000 172.6411 27 C 4.4247 9.4202 115.1926 58.1378 39.2646 174.4848 28 Y 4.5964 8.5360 114.8627 56.6205 39.7429 176.3940 29 C 4.4808 8.4394 117.0272 58.2684 40.7986 174.2431 30 G 3.8029 7.1056 106.1047 44.1368 0.0000 172.5720 31 L 3.9316 8.4970 121.4464 56.1614 42.9872 178.4818 32 G 3.6296 8.3861 112.9990 46.7726 0.0000 172.3237 33 G 3.5317 7.9852 110.4814 45.2873 0.0000 170.2904 34 S 4.3882 7.0409 112.9756 58.3400 65.3904 175.5179 35 G 3.8945 8.8520 110.1255 44.9361 0.0000 172.4426 36 T 4.5865 8.2550 115.0810 61.1597 69.9011 173.1518 37 P 4.7463 0.0000 0.0000 63.2897 31.8611 177.0247 38 V 3.8521 8.7288 115.1389 63.4110 32.2750 175.1367 39 D 4.6486 7.4796 117.2243 51.4465 41.9158 175.5132 40 E 4.0064 8.8762 117.6475 59.5318 29.3484 179.0236 41 L 4.1589 8.0669 119.9599 58.3593 42.1789 178.3064 42 D 4.5642 9.0392 118.3099 57.4403 41.1489 178.2923 43 K 3.8614 8.2309 118.9144 59.7135 32.0319 178.4752 44 C 4.0825 8.2857 116.6367 60.2280 38.5903 175.6312 45 C 4.4111 8.2537 117.8339 60.0439 39.4541 175.8267 46 Q 3.8649 8.2260 121.1513 59.6100 28.4715 178.6237 47 T 3.8061 7.8001 116.6139 66.7531 68.4621 176.0805 48 H 4.2199 8.3249 120.1265 59.4219 29.8833 176.8905 49 D 4.3581 8.4415 120.9921 57.6914 40.7005 178.7058 50 N 4.3892 8.5206 117.1114 56.3166 38.4537 176.6739 51 C 4.4057 8.6704 120.3101 60.1388 37.9854 175.3667 52 Y 3.9135 8.4643 118.2880 61.0551 37.1542 178.1732 53 D 4.4220 8.2762 119.3917 57.4022 41.2340 178.2369 54 Q 4.0435 8.4347 119.9106 59.0833 29.0029 177.9971 55 A 3.2305 8.1272 121.8465 54.9501 18.1159 179.6582 56 K 3.8385 7.5069 115.3336 59.0791 32.1365 179.0644 57 K 4.0619 7.6443 117.4850 57.0116 32.5502 176.8813 58 L 4.3569 7.4179 120.9248 53.3666 42.8642 177.6217 59 D 4.3130 8.6488 123.2124 57.3477 40.9477 178.1253 60 S 4.4860 7.8842 110.6378 59.4148 63.6906 175.0102 61 C 4.5259 8.1062 118.9742 56.7117 40.2199 173.2735 62 K 3.8437 7.2453 121.2158 58.1972 32.0401 176.9545 63 F 4.6185 8.4517 121.7776 58.1332 37.0724 174.5939 64 L 4.1612 7.5323 122.7776 56.7356 42.0399 177.1077 65 L 3.9744 8.9493 123.8881 55.0834 39.5162 175.0950 66 D 4.5479 8.4270 120.5346 57.1677 40.8855 175.6792 67 N 4.8134 7.5088 113.1991 51.2642 40.0345 172.3787 68 P 4.3014 0.0000 0.0000 64.1869 31.3445 177.3744 69 Y 4.7781 8.0273 115.5407 57.8025 38.5511 176.7880 70 T 4.1766 8.0252 111.4170 63.9815 69.4414 174.6859 71 H 4.9092 8.1077 117.0677 53.9956 32.3512 171.9451 72 T 4.6680 8.0689 116.5284 60.7049 70.5220 171.2815 73 Y 4.7488 7.5312 119.2815 56.5207 40.2364 172.7425 74 S 5.1194 9.2992 115.5875 56.9365 64.6333 172.3128 75 Y 5.5398 8.2469 123.2986 55.9441 41.2874 173.5426 76 S 4.8062 9.1901 114.2431 57.0199 66.9554 170.2934 77 C 5.3230 8.5091 113.3167 54.7404 39.0750 173.9436 78 S 4.4725 9.0849 116.3052 56.8698 63.2305 174.9153 79 G 4.1554 8.2053 120.0282 47.0829 0.0000 173.2004 80 S 4.2174 8.7533 118.1542 58.8538 63.3857 174.8449 81 A 4.2522 7.8933 125.6049 51.6665 16.7959 175.0810 82 I 4.9617 7.9936 120.9029 60.3320 39.7710 175.1227 83 T 4.6104 9.1746 123.9622 61.8624 71.1156 172.6819 84 C 4.8725 8.8126 124.6292 56.1340 36.3324 173.9360 85 S 4.4630 9.0026 121.0517 58.6625 62.9477 176.1082 86 S 4.2018 8.9165 118.6800 60.9735 62.8940 175.3811 87 K 4.2235 7.9430 118.4780 57.3072 32.3141 176.9206 88 N 4.5642 7.8016 117.3006 53.2694 39.0326 175.7178 89 K 4.3363 8.9310 122.3395 55.4953 34.3517 177.9976 90 E 3.9267 8.6687 119.8149 59.9587 29.3309 179.2340 91 C 4.2347 7.8444 116.7475 59.6769 44.7877 174.9951 92 E 4.0708 8.4157 119.5420 59.7152 29.1265 179.1742 93 A 3.9144 8.6504 120.7186 55.0604 18.3993 179.4917 94 F 3.7607 8.1127 119.2900 61.3940 39.4681 177.5109 95 I 3.5167 8.0935 113.0221 63.7771 37.2530 177.2554 96 C 3.0292 7.9030 120.4307 59.3183 43.4462 175.4278 97 N 4.0787 7.9110 117.9242 56.2083 38.0522 176.7595 98 C 4.2134 8.0645 118.0548 60.2080 36.5638 175.9613 99 D 4.5293 8.5284 120.7580 57.2761 40.4359 178.7520 100 R 3.7728 8.1993 119.5087 59.5955 30.1011 178.2150 101 N 4.2118 8.3027 116.1821 56.2167 38.5275 177.2595 102 A 3.4506 7.9575 121.7222 54.9001 18.4725 179.3920 103 A 4.0617 8.4676 119.6085 55.5438 18.2093 179.9658 104 I 3.6374 7.5550 116.9535 64.5256 37.5911 177.4903 105 C 4.3087 8.1121 119.3225 59.8658 37.6631 175.7808 106 F 4.4720 8.4484 119.8039 60.4463 38.2144 177.6740 107 S 4.3309 8.1215 112.9649 60.2966 62.8524 175.5224 108 K 4.5121 7.8723 119.3424 54.9479 32.9191 175.4913 109 A 4.6838 7.2918 122.8899 49.4715 20.1940 175.3421 110 P 4.3359 0.0000 0.0000 62.9707 32.0006 175.4078 111 Y 4.0958 8.5635 123.2164 56.5749 39.0565 174.8916 112 N 4.7576 8.3952 126.5204 51.0455 38.7119 175.3302 113 K 3.9255 8.7085 125.6877 59.2757 32.4495 178.6874 114 A 3.9623 7.8752 120.2175 54.7840 18.4846 177.4421 115 H 4.3296 7.8075 111.8303 55.4778 29.3037 175.1117 116 K 4.0518 7.5887 122.9666 57.6075 32.6284 176.4416 117 N 4.2809 8.8551 124.4848 53.2580 36.8147 174.4305 118 L 3.7616 6.8694 117.8761 55.5713 42.9410 177.1189 119 D 4.5537 8.6612 123.5304 54.4380 40.8237 176.8338 120 T 3.9482 8.3145 118.7915 64.3917 68.8105 176.4754 121 K 3.9368 7.6836 120.5635 58.8522 32.0439 178.7115 122 K 3.9252 7.9601 118.4874 58.7661 32.5732 177.4331 123 Y 4.6349 7.8297 113.3413 57.8199 38.7569 175.2018 124 C 5.1046 8.0649 117.7842 56.5058 40.8584 174.2011 125 Q 4.3303 8.1170 118.2644 55.7685 29.3336 176.8065 126 S 4.3815 8.5019 116.6842 58.7397 63.3556 174.0496 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 -6 D 8.22 4.68 0.00 2.75 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 -5 S 8.60 4.04 0.00 3.96 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 -4 G 7.30 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 -3 I 7.83 3.97 1.88 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 1.47 0.73 0.93 0.00 0.00 -2 S 8.21 4.59 0.00 3.95 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 -1 P 0.00 3.74 0.00 1.17 0.49 0.00 3.40 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.26 0.00 0 R 7.64 3.40 0.00 1.73 1.93 0.00 3.39 0.00 0.00 3.49 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.05 0.00 1 A 7.73 4.74 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 2 V 7.44 3.83 2.37 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 1.25 0.00 0.00 1.03 0.00 0.00 3 W 8.86 4.10 0.00 3.71 3.10 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 4 Q 8.24 3.99 0.00 1.61 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.65 0.00 0.00 0.00 0.00 0.00 2.33 1.64 0.00 5 F 8.04 4.11 0.00 3.50 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 6 R 7.38 3.68 0.00 1.25 1.34 0.00 2.21 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.39 0.00 7 K 7.48 4.01 0.00 2.01 1.99 0.00 1.96 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.43 1.31 7.81 8 M 8.01 3.63 0.00 1.70 1.37 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 2.00 2.27 0.00 9 I 7.27 3.29 0.58 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.95 0.67 0.00 0.00 10 K 7.70 4.30 0.00 1.99 1.81 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.44 7.81 11 C 8.31 4.52 0.00 2.98 3.36 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 12 V 7.19 4.03 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 0.70 0.00 0.00 0.96 0.00 0.00 13 I 7.81 4.38 1.80 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 1.32 1.08 0.96 0.00 0.00 14 P 0.00 4.25 0.00 2.16 2.04 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 15 G 8.55 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 16 S 8.57 4.26 0.00 3.99 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 17 D 7.60 4.98 0.00 2.62 2.54 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 18 P 0.00 4.28 0.00 2.23 2.31 0.00 3.74 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.08 0.00 19 F 8.59 4.43 0.00 3.71 3.32 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 0.00 0.00 0.00 0.00 20 L 6.69 3.51 0.00 1.42 1.49 0.65 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.01 3.95 0.00 1.80 1.44 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 2.17 2.21 0.00 22 Y 7.64 4.15 0.00 3.14 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 23 N 7.54 5.12 0.00 2.71 2.75 0.00 0.00 7.03 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 24 N 8.70 4.21 0.00 2.98 2.84 0.00 0.00 6.49 7.48 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 25 Y 7.15 4.88 0.00 2.90 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.30 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 27 C 9.42 4.42 0.00 3.11 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 28 Y 8.54 4.60 0.00 3.43 3.02 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 0.00 0.00 0.00 0.00 29 C 8.44 4.48 0.00 3.43 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 30 G 7.11 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 31 L 8.50 3.93 0.00 1.75 1.60 0.99 1.01 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 32 G 8.39 3.63 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 0.00 0.00 0.00 33 G 7.99 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 0.00 0.00 0.00 34 S 7.04 4.39 0.00 3.91 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 35 G 8.85 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 0.00 0.00 0.00 36 T 8.25 4.59 4.30 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 1.25 0.00 0.00 37 P 0.00 4.75 0.00 2.05 2.04 0.00 3.68 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.81 0.00 38 V 8.73 3.85 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 0.61 0.00 0.00 0.67 0.00 0.00 39 D 7.48 4.65 0.00 2.93 2.84 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 40 E 8.88 4.01 0.00 2.06 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 2.43 2.34 0.00 41 L 8.07 4.16 0.00 1.76 1.86 0.31 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 42 D 9.04 4.56 0.00 3.19 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 43 K 8.23 3.86 0.00 2.06 1.81 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.67 7.81 44 C 8.29 4.08 0.00 3.09 2.32 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 0.00 0.00 0.00 0.00 45 C 8.25 4.41 0.00 3.41 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 46 Q 8.23 3.86 0.00 1.41 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.08 1.73 0.00 47 T 7.80 3.81 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 1.16 0.00 0.00 48 H 8.32 4.22 0.00 3.24 3.41 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 8.44 4.36 0.00 2.95 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 50 N 8.52 4.39 0.00 2.87 2.90 0.00 0.00 6.71 8.08 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 51 C 8.67 4.41 0.00 3.20 3.45 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.46 3.91 0.00 3.03 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 53 D 8.28 4.42 0.00 2.89 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 54 Q 8.43 4.04 0.00 2.30 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 55 A 8.13 3.23 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 56 K 7.51 3.84 0.00 1.88 1.85 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.74 7.81 57 K 7.64 4.06 0.00 1.72 1.77 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.40 7.81 58 L 7.42 4.36 0.00 1.60 1.45 0.47 0.96 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 59 D 8.65 4.31 0.00 2.67 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 60 S 7.88 4.49 0.00 4.02 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 61 C 8.11 4.53 0.00 3.14 3.02 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 0.00 0.00 0.00 0.00 62 K 7.25 3.84 0.00 1.58 1.34 0.00 1.55 0.00 0.00 1.19 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.30 0.85 7.81 63 F 8.45 4.62 0.00 3.42 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 64 L 7.53 4.16 0.00 1.71 1.64 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.95 3.97 0.00 1.94 1.90 0.99 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 66 D 8.43 4.55 0.00 2.91 2.80 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 67 N 7.51 4.81 0.00 2.67 2.80 0.00 0.00 6.05 7.75 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 68 P 0.00 4.30 0.00 1.36 2.21 0.00 2.59 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.94 0.00 69 Y 8.03 4.78 0.00 2.93 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 70 T 8.03 4.18 4.39 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 1.40 0.00 0.00 71 H 8.11 4.91 0.00 3.21 3.35 0.00 5.83 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 T 8.07 4.67 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 1.24 0.00 0.00 73 Y 7.53 4.75 0.00 3.23 2.99 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 74 S 9.30 5.12 0.00 3.98 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 75 Y 8.25 5.54 0.00 3.17 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 76 S 9.19 4.81 0.00 3.83 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 77 C 8.51 5.32 0.00 3.19 3.25 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 78 S 9.08 4.47 0.00 3.82 3.76 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 79 G 8.21 4.16 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 0.00 0.00 0.00 80 S 8.75 4.22 0.00 3.98 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 81 A 7.89 4.25 1.33 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 0.00 0.00 0.00 82 I 7.99 4.96 1.86 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 1.37 0.80 0.93 0.00 0.00 83 T 9.17 4.61 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 1.23 0.00 0.00 84 C 8.81 4.87 0.00 2.81 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 85 S 9.00 4.46 0.00 3.89 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 86 S 8.92 4.20 0.00 3.98 4.02 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 0.00 0.00 0.00 0.00 87 K 7.94 4.22 0.00 1.80 1.92 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.42 7.81 88 N 7.80 4.56 0.00 2.88 2.91 0.00 0.00 6.98 7.40 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 89 K 8.93 4.34 0.00 1.87 1.80 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.48 7.81 90 E 8.67 3.93 0.00 2.05 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 2.39 2.40 0.00 91 C 7.84 4.23 0.00 3.07 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 92 E 8.42 4.07 0.00 2.32 2.19 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 2.84 2.53 0.00 93 A 8.65 3.91 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 94 F 8.11 3.76 0.00 3.32 3.08 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 0.00 95 I 8.09 3.52 1.58 0.00 0.00 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 1.70 1.14 0.51 0.00 0.00 96 C 7.90 3.03 0.00 1.98 2.87 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 0.00 0.00 0.00 0.00 97 N 7.91 4.08 0.00 2.74 2.58 0.00 0.00 7.06 6.94 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 98 C 8.06 4.21 0.00 3.26 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 99 D 8.53 4.53 0.00 2.92 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 0.00 100 R 8.20 3.77 0.00 1.82 2.00 0.00 3.14 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 101 N 8.30 4.21 0.00 2.79 2.76 0.00 0.00 6.99 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 0.00 102 A 7.96 3.45 1.02 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 0.00 0.00 0.00 0.00 0.00 0.00 103 A 8.47 4.06 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 0.00 104 I 7.56 3.64 1.93 0.00 0.00 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 1.38 0.64 0.88 0.00 0.00 105 C 8.11 4.31 0.00 2.94 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 0.00 106 F 8.45 4.47 0.00 3.08 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 0.00 107 S 8.12 4.33 0.00 4.06 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 0.00 108 K 7.87 4.51 0.00 1.92 1.89 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.20 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.56 7.81 109 A 7.29 4.68 1.48 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 0.00 110 P 0.00 4.34 0.00 2.11 2.06 0.00 3.73 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.13 0.00 111 Y 8.56 4.10 0.00 2.93 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 0.00 112 N 8.40 4.76 0.00 2.82 2.53 0.00 0.00 6.19 7.36 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 0.00 113 K 8.71 3.93 0.00 1.98 1.86 0.00 1.83 0.00 0.00 1.95 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.54 7.81 114 A 7.88 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 H 7.81 4.33 0.00 2.24 2.37 0.00 5.64 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 0.00 116 K 7.59 4.05 0.00 1.95 1.76 0.00 1.97 0.00 0.00 1.90 0.00 0.00 3.19 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.51 1.48 7.81 117 N 8.86 4.28 0.00 2.78 2.80 0.00 0.00 6.95 8.30 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 0.00 118 L 6.87 3.76 0.00 1.59 1.48 0.38 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 119 D 8.66 4.55 0.00 2.83 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 0.00 120 T 8.31 3.95 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 1.22 0.00 0.00 121 K 7.68 3.94 0.00 1.87 1.88 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.43 7.81 122 K 7.96 3.93 0.00 1.62 1.61 0.00 1.51 0.00 0.00 1.40 0.00 0.00 2.61 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.30 0.99 7.81 123 Y 7.83 4.63 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 0.00 124 C 8.06 5.10 0.00 3.04 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 0.00 125 Q 8.12 4.33 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.15 6.84 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 126 S 8.50 4.38 0.00 3.83 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