NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 L 4.2812 8.1844 120.6275 54.1101 42.3722 176.1734 7 S 4.1690 8.5187 115.5886 55.7542 62.8864 172.3613 8 P 4.1635 0.0000 0.0000 63.8550 33.2749 174.5225 9 L 5.0464 6.9977 123.7489 53.2409 44.1481 175.4799 10 S 4.9243 9.0415 120.1058 57.0868 66.9529 172.5222 11 T 4.9797 8.2588 113.3804 61.2792 70.8839 172.2384 12 H 5.0641 8.5760 124.2175 54.8160 33.6048 171.7161 13 V 4.6229 8.8636 126.2540 61.0226 33.7299 173.8380 14 L 4.7514 8.4963 130.1846 53.0655 44.7028 174.7167 15 N 5.1179 9.2652 126.0668 53.3517 38.7300 175.0133 16 A 4.2922 9.4261 129.5687 54.0186 18.7835 178.5253 17 A 4.2131 8.6853 117.7662 54.4707 17.9020 178.1043 18 Q 4.5084 8.7334 113.4467 54.9604 30.4640 176.5853 19 G 3.8449 8.5792 105.9317 46.6457 0.0000 173.6559 20 V 4.6326 6.9511 108.3160 58.0732 35.5821 173.8777 21 P 4.5197 0.0000 0.0000 62.9978 32.4429 177.3894 22 G 3.7724 9.2858 111.6770 44.7104 0.0000 172.6923 23 A 4.5708 8.3680 127.8394 51.9606 19.8228 176.1931 24 N 4.1502 8.6789 117.0459 54.6996 38.2007 173.4845 25 M 4.5168 8.2841 116.8902 54.3557 33.8467 175.2668 26 T 4.6617 8.4994 122.6530 63.5339 70.3162 173.5673 27 I 4.8429 8.6269 125.7360 59.4185 41.5299 174.4199 28 V 4.6343 8.7306 126.2352 60.8954 34.6479 173.6551 29 L 5.0487 8.8225 130.1508 53.9290 43.8936 174.8367 30 H 5.6031 9.7722 123.0406 54.0237 33.0150 172.5674 31 R 4.8376 8.9258 120.1948 54.1472 33.2960 174.2944 32 L 3.6586 8.7827 128.8394 54.8383 42.9043 175.5790 33 D 4.5378 8.4312 127.0449 52.3433 41.5353 175.1975 34 P 4.1289 0.0000 0.0000 65.7415 31.5712 177.9805 35 V 3.6573 7.9220 118.4413 65.0412 31.4331 176.6926 36 S 4.4652 8.0358 111.0453 57.3220 63.9304 173.6376 37 S 3.3957 7.3623 114.9578 59.3146 62.4355 171.3746 38 A 4.5326 6.9653 119.1508 50.8899 22.4419 176.6208 39 W 4.7802 8.4311 119.1391 56.2082 30.1552 175.8616 40 N 4.9592 9.1997 123.3674 51.4157 40.1715 174.5892 41 I 4.0128 8.4491 125.1985 61.8838 37.1391 175.9164 42 L 4.3014 8.9518 128.4553 57.3218 42.3987 177.2172 43 T 4.4006 7.2080 109.7991 61.4739 70.6963 171.8065 44 T 4.9331 8.6463 116.2349 59.9646 71.5267 172.9671 45 G 4.3194 9.1490 112.6038 44.2352 0.0000 170.9911 46 I 5.3393 8.0134 119.3134 59.1317 40.5064 176.1696 47 T 4.2622 8.8936 118.2066 61.7404 69.9633 174.6114 48 N 4.9577 8.9273 122.8806 52.1446 38.7300 175.3340 49 D 4.2731 8.5816 117.0470 57.4254 40.8419 176.9564 50 D 4.5859 8.2829 116.5622 53.8749 41.2211 176.7975 51 G 3.8686 8.4532 105.7579 45.9202 0.0000 173.9628 52 R 4.9719 7.8676 118.7121 54.8995 32.1101 175.2358 53 C 4.9421 8.0258 118.8869 56.5329 31.5023 171.6313 54 P 4.3637 0.0000 0.0000 63.0226 31.8000 176.6917 55 G 3.9055 8.6222 105.1328 46.5099 0.0000 175.1790 56 L 4.0872 8.1665 121.4646 57.2935 41.7355 177.7943 57 I 4.4987 7.4674 115.9952 59.6907 41.1849 173.9779 58 T 4.2550 8.2636 116.5543 60.8892 69.8016 175.1110 59 K 4.1834 8.6579 123.3023 59.7837 31.9527 178.8400 60 E 4.0339 8.2027 117.6286 59.2234 29.5851 177.8439 61 N 4.8021 8.0226 113.6246 53.2288 40.4594 175.5409 62 F 4.7855 7.6117 123.6322 57.5492 37.8266 174.7913 63 I 4.0885 7.4617 117.4800 58.6492 39.4321 176.4627 64 A 4.0092 8.1580 123.8604 51.5987 18.9822 177.8327 65 G 3.8675 7.7403 107.3696 44.8053 0.0000 171.1471 66 V 4.6521 7.4045 119.3839 61.5959 33.1779 174.6805 67 Y 5.0174 8.5406 125.0463 55.9960 41.6197 174.5666 68 K 4.7519 9.0540 122.4362 54.9723 35.9261 174.6328 69 M 4.9267 9.3008 127.2360 53.5890 34.7045 174.5897 70 R 4.8781 8.8560 125.2344 54.7207 32.4108 174.5200 71 F 5.0074 9.6532 126.1190 56.0700 41.2591 176.1133 72 E 4.9892 9.0373 125.8031 55.6143 26.6685 177.4195 73 T 4.1809 8.1245 114.0682 64.3909 69.4814 177.0507 74 G 3.7569 8.4500 108.7179 47.7775 0.0000 175.8923 75 K 4.0758 8.1621 121.1889 59.0043 31.8583 178.6350 76 Y 4.0424 8.1198 119.8265 60.6532 38.7531 178.3841 77 W 4.0264 8.5161 119.8878 59.5919 29.0846 177.9911 78 D 4.5711 8.7096 119.2281 56.8909 40.4886 178.3410 79 A 3.9962 7.8890 119.5895 54.4516 18.4091 178.5725 80 L 4.2634 7.5583 115.4755 54.8167 41.9451 177.5371 81 G 4.0220 9.0440 107.7081 45.2597 0.0000 173.0045 82 E 4.7402 7.8114 117.2537 54.5579 33.7382 174.2425 83 T 4.3657 8.1511 114.9264 61.3742 68.1959 173.4530 84 C 4.4619 8.0836 126.9062 56.9992 34.0744 174.5549 85 F 4.1176 7.9879 128.0383 60.3282 39.4143 174.6815 86 Y 4.4344 7.0060 116.2577 55.2064 38.7981 174.5796 87 P 4.6497 0.0000 0.0000 65.6852 32.5616 175.4277 88 Y 5.4174 6.9210 115.5987 56.5995 41.0673 174.0852 89 V 4.2809 8.8643 119.4502 61.0831 34.6264 173.7503 90 E 5.1709 8.9947 126.8961 54.7444 31.7001 175.1701 91 I 4.5448 9.2476 125.8968 59.6874 39.6190 174.6098 92 V 4.8379 8.5885 127.7960 61.1852 32.8668 174.7834 93 F 5.1877 8.6799 121.9223 55.8428 41.8723 173.1859 94 T 4.7564 8.7648 116.9849 62.2904 70.1950 174.0157 95 I 4.3013 9.0363 128.7013 60.1713 38.1141 176.3947 96 T 4.3872 8.8030 117.0415 61.3186 71.1165 173.4516 97 N 4.8193 7.8235 121.2812 52.0624 39.4852 174.5197 98 T 4.3928 8.5325 120.2192 62.8572 67.8418 174.9426 99 S 4.6154 8.8845 114.6490 59.2848 63.6729 174.1464 100 Q 4.4306 7.5706 119.1628 55.0937 30.0175 174.4307 101 H 4.7661 8.2209 119.6112 55.8388 31.2776 173.9788 102 Y 4.8060 8.5940 121.8405 56.4301 41.7822 173.6357 103 H 5.1519 9.1326 124.1204 54.4934 32.4792 172.9944 104 V 4.4566 8.4296 126.1168 60.3844 31.1146 172.9147 105 P 4.7728 0.0000 0.0000 61.3691 33.5599 175.3308 106 L 4.6843 8.4359 121.6129 52.9978 45.1499 174.5455 107 L 5.0535 8.6437 127.9862 53.2101 44.5809 174.7424 108 L 5.3094 8.9486 127.6941 53.7782 45.9054 175.3039 109 S 5.3569 8.7017 121.0127 56.8360 65.5776 173.8943 110 R 3.2247 8.4025 116.8400 58.6340 29.8094 178.0502 111 F 4.7102 8.0258 114.1919 56.4162 40.5299 174.4023 112 S 4.8677 8.4058 113.3889 58.8295 65.0691 172.8515 113 Y 5.5135 7.8538 118.4962 56.5643 40.7059 173.4460 114 S 4.7224 9.1684 114.2553 57.7124 67.0064 172.5141 115 T 5.1871 8.2485 113.9510 61.2474 70.5538 172.8833 116 T 4.6101 8.0777 114.1873 60.1344 71.5948 173.0610 117 R 4.3142 8.6116 125.6347 56.1787 31.1580 175.2969 118 G 4.3227 9.1312 113.1714 44.3906 0.0000 172.6868 119 S 4.4839 8.4084 113.3524 58.2727 62.3535 173.9127 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 L 8.18 4.28 0.00 1.64 1.66 0.89 0.54 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 7 S 8.52 4.17 0.00 3.89 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 8 P 0.00 4.16 0.00 1.28 2.15 0.00 3.74 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.86 0.00 9 L 7.00 5.05 0.00 1.24 1.25 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 10 S 9.04 4.92 0.00 3.95 3.97 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 11 T 8.26 4.98 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 1.24 0.00 0.00 12 H 8.58 5.06 0.00 3.30 3.11 0.00 5.71 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 13 V 8.86 4.62 1.90 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 0.58 0.00 0.00 0.96 0.00 0.00 14 L 8.50 4.75 0.00 1.72 1.43 1.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 15 N 9.27 5.12 0.00 2.79 2.89 0.00 0.00 6.68 8.23 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 16 A 9.43 4.29 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 17 A 8.69 4.21 1.55 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 0.00 0.00 18 Q 8.73 4.51 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.06 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 19 G 8.58 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 20 V 6.95 4.63 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 0.79 0.00 0.00 0.95 0.00 0.00 21 P 0.00 4.52 0.00 2.08 2.15 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 2.14 2.14 0.00 22 G 9.29 3.77 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 0.00 0.00 0.00 23 A 8.37 4.57 1.25 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 0.00 0.00 24 N 8.68 4.15 0.00 2.86 2.95 0.00 0.00 7.06 8.42 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 25 M 8.28 4.52 0.00 2.03 1.64 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 26 T 8.50 4.66 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 1.18 0.00 0.00 27 I 8.63 4.84 1.72 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.71 0.50 0.00 0.00 28 V 8.73 4.63 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 0.76 0.00 0.00 0.85 0.00 0.00 29 L 8.82 5.05 0.00 1.75 1.49 1.10 0.82 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 30 H 9.77 5.60 0.00 3.09 3.49 0.00 5.80 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 31 R 8.93 4.84 0.00 1.64 1.57 0.00 2.90 0.00 0.00 2.81 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.50 0.00 32 L 8.78 3.66 0.00 0.54 1.17 -0.12 0.92 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 33 D 8.43 4.54 0.00 2.62 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 0.00 0.00 0.00 0.00 34 P 0.00 4.13 0.00 2.12 2.06 0.00 3.68 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.86 0.00 35 V 7.92 3.66 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 0.75 0.00 0.00 0.88 0.00 0.00 36 S 8.04 4.47 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 37 S 7.36 3.40 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 38 A 6.97 4.53 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 39 W 8.43 4.78 0.00 3.18 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 40 N 9.20 4.96 0.00 2.61 2.74 0.00 0.00 6.59 6.76 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 41 I 8.45 4.01 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.50 0.88 0.00 0.00 42 L 8.95 4.30 0.00 1.73 1.77 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 43 T 7.21 4.40 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 1.34 0.00 0.00 44 T 8.65 4.93 4.18 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 0.00 0.00 0.00 1.17 0.00 0.00 45 G 9.15 4.32 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 0.00 0.00 0.00 46 I 8.01 5.34 1.86 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 0.70 0.94 0.00 0.00 47 T 8.89 4.26 4.13 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 1.20 0.00 0.00 48 N 8.93 4.96 0.00 2.97 3.03 0.00 0.00 6.76 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 49 D 8.58 4.27 0.00 2.67 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 50 D 8.28 4.59 0.00 2.62 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 51 G 8.45 3.87 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 0.00 0.00 0.00 52 R 7.87 4.97 0.00 1.94 1.88 0.00 3.07 0.00 0.00 3.10 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 53 C 8.03 4.94 0.00 2.85 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 54 P 0.00 4.36 0.00 2.21 2.03 0.00 3.93 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 1.96 0.00 55 G 8.62 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 0.00 0.00 0.00 56 L 8.17 4.09 0.00 1.74 1.73 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 57 I 7.47 4.50 1.91 0.00 0.00 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 1.47 1.26 0.78 0.00 0.00 58 T 8.26 4.25 4.27 0.00 0.00 0.00 0.00 0.00 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 59 K 8.66 4.18 0.00 1.94 1.90 0.00 1.80 0.00 0.00 1.96 0.00 0.00 3.11 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.57 1.67 7.81 60 E 8.20 4.03 0.00 2.02 2.04 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 2.35 2.41 0.00 61 N 8.02 4.80 0.00 2.78 2.91 0.00 0.00 7.16 7.15 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 62 F 7.61 4.79 0.00 3.01 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 63 I 7.46 4.09 1.83 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 1.36 0.69 0.92 0.00 0.00 64 A 8.16 4.01 1.25 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 0.00 0.00 65 G 7.74 3.87 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 0.00 0.00 0.00 66 V 7.40 4.65 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 1.14 0.00 0.00 0.88 0.00 0.00 67 Y 8.54 5.02 0.00 1.67 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 0.00 0.00 0.00 0.00 68 K 9.05 4.75 0.00 0.79 0.79 0.00 1.19 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.89 1.03 7.81 69 M 9.30 4.93 0.00 1.62 2.15 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.43 0.00 70 R 8.86 4.88 0.00 1.84 1.70 0.00 3.07 0.00 0.00 3.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.57 0.00 71 F 9.65 5.01 0.00 2.82 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 72 E 9.04 4.99 0.00 2.03 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 2.45 2.47 0.00 73 T 8.12 4.18 4.49 0.00 0.00 0.00 0.00 0.00 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 74 G 8.45 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 0.00 0.00 0.00 75 K 8.16 4.08 0.00 1.89 1.93 0.00 1.71 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.59 1.57 7.81 76 Y 8.12 4.04 0.00 3.03 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 77 W 8.52 4.03 0.00 3.61 3.34 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 78 D 8.71 4.57 0.00 2.92 2.92 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 79 A 7.89 4.00 1.28 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 0.00 0.00 80 L 7.56 4.26 0.00 1.67 1.65 -0.15 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 81 G 9.04 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 0.00 0.00 0.00 82 E 7.81 4.74 0.00 2.18 1.68 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 2.31 2.37 0.00 83 T 8.15 4.37 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 1.08 0.00 0.00 84 C 8.08 4.46 0.00 3.00 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 85 F 7.99 4.12 0.00 2.30 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 0.00 0.00 0.00 0.00 86 Y 7.01 4.43 0.00 3.05 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 87 P 0.00 4.65 0.00 2.23 2.31 0.00 3.45 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 1.55 1.82 0.00 88 Y 6.92 5.42 0.00 3.08 2.98 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 89 V 8.86 4.28 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 0.21 0.00 0.00 -0.13 0.00 0.00 90 E 8.99 5.17 0.00 1.91 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 2.50 0.00 91 I 9.25 4.54 2.19 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.01 1.11 0.00 0.00 92 V 8.59 4.84 2.16 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 0.96 0.00 0.00 0.82 0.00 0.00 93 F 8.68 5.19 0.00 3.18 3.17 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 0.00 0.00 0.00 0.00 94 T 8.76 4.76 4.34 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 1.25 0.00 0.00 95 I 9.04 4.30 1.83 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 1.41 0.70 0.46 0.00 0.00 96 T 8.80 4.39 4.27 0.00 0.00 0.00 0.00 0.00 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 97 N 7.82 4.82 0.00 2.78 2.91 0.00 0.00 6.69 7.10 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 98 T 8.53 4.39 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 99 S 8.88 4.62 0.00 4.02 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 0.00 100 Q 7.57 4.43 0.00 1.98 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.24 2.27 0.00 101 H 8.22 4.77 0.00 3.12 3.10 0.00 5.67 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 8.59 4.81 0.00 2.72 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 0.00 103 H 9.13 5.15 0.00 3.19 3.13 0.00 5.52 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.43 4.46 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 0.73 0.00 0.00 0.16 0.00 0.00 105 P 0.00 4.77 0.00 2.08 1.96 0.00 3.80 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.94 0.00 106 L 8.44 4.68 0.00 0.69 0.83 0.53 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.64 5.05 0.00 1.78 1.62 0.94 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.95 5.31 0.00 1.73 1.42 1.09 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.70 5.36 0.00 4.03 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 0.00 110 R 8.40 3.22 0.00 1.36 1.01 0.00 2.73 0.00 0.00 2.54 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.59 0.00 111 F 8.03 4.71 0.00 2.95 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 0.00 112 S 8.41 4.87 0.00 4.03 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 0.00 113 Y 7.85 5.51 0.00 2.85 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 0.00 114 S 9.17 4.72 0.00 3.83 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 0.00 115 T 8.25 5.19 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 1.25 0.00 0.00 116 T 8.08 4.61 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 1.21 0.00 0.00 117 R 8.61 4.31 0.00 1.87 1.91 0.00 3.37 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 118 G 9.13 4.32 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 0.00 0.00 0.00 119 S 8.41 4.48 0.00 3.78 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