NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.6054 8.4449 116.2973 56.1494 29.3351 172.7195 1D H 4.5194 8.7955 114.3058 56.4501 29.4299 172.7953 1E H 5.0912 7.7038 115.3948 53.5821 33.5532 171.8580 1F H 4.6919 8.8732 116.8312 55.8567 29.0769 174.3318 1G F 4.9047 8.3859 119.4645 57.8465 39.8095 174.0270 2 N 4.6724 8.5217 117.3183 52.2658 39.1609 174.6081 3 L 4.7407 8.1409 123.2534 52.1715 44.0587 174.5183 4 P 4.6101 0.0000 0.0000 60.5006 32.9293 173.7751 5 P 4.0264 0.0000 0.0000 63.2178 31.3791 176.2701 6 G 3.5711 8.2772 112.2109 44.4583 0.0000 172.8525 7 N 4.0025 7.1580 119.2788 53.5783 40.5025 173.2009 8 Y 4.8711 8.2134 124.2017 57.7807 38.9057 177.8793 9 K 4.1184 8.4073 120.4122 58.9182 32.2699 177.2215 10 K 4.6699 7.5384 114.7843 53.5835 35.5778 173.4506 11 P 4.7404 0.0000 0.0000 63.3132 32.6978 175.3153 12 V 4.9775 9.0684 113.1136 60.0258 36.9651 173.9964 13 L 5.0320 8.9212 121.9426 53.3282 44.2704 176.2687 14 L 4.9738 8.6708 123.9727 53.7139 42.3773 174.1693 15 Y 4.6768 8.9339 126.4497 57.0345 40.3659 173.4014 16 C 4.2401 8.3897 128.4218 57.7097 32.4976 174.3145 17 S 4.0725 8.4859 121.7266 60.1599 63.0573 174.9057 18 N 4.3889 7.2854 120.8022 49.7127 37.0158 173.2800 19 G 3.9042 8.8131 109.6012 44.0026 0.0000 172.3096 20 G 3.1245 7.4046 106.7673 46.4105 0.0000 173.2339 21 H 4.5644 7.4197 115.6670 54.5503 31.0569 174.1019 22 F 5.3353 8.9252 119.7868 55.7702 40.7282 175.4144 23 L 4.6227 8.9482 125.5353 55.3351 43.4514 175.6426 24 R 4.9726 9.2350 125.4706 54.6740 33.7571 173.7161 25 I 4.7641 8.2213 126.6657 59.4819 38.8224 175.7241 26 L 4.1265 8.9090 128.2644 53.3331 42.3955 176.6179 27 P 4.2212 0.0000 0.0000 65.9941 31.2535 177.1974 28 D 4.5227 7.9674 114.0849 53.6426 39.7285 177.0232 29 G 4.3690 8.6421 110.1213 45.4011 0.0000 173.9573 30 T 4.3871 8.2606 117.4680 63.2799 69.0956 173.6013 31 V 4.9118 8.0106 124.4253 61.2468 34.5047 174.5374 32 D 4.5898 8.4846 124.9788 53.0703 42.7418 174.1096 33 G 4.5799 8.5944 104.5188 45.4528 0.0000 172.2513 34 T 5.0145 8.7840 115.1027 60.4591 71.0716 174.7069 35 R 4.2205 8.8227 124.1327 56.8090 30.9545 176.5123 36 D 4.5618 8.1737 118.9605 53.5177 40.0135 176.4784 37 R 3.5292 8.6844 127.9143 58.4027 30.2171 177.1685 38 S 4.5010 8.2264 110.6980 57.8736 63.8442 173.8060 39 D 4.3899 7.9901 122.7174 54.7179 41.2758 176.9896 40 Q 4.1427 8.5737 124.6153 58.1032 29.3808 176.3288 41 H 4.8367 9.1797 115.6464 55.4469 28.7931 175.8801 42 I 4.5664 7.0223 110.0759 59.8736 38.3992 175.4151 43 Q 4.2682 7.7751 121.9995 55.7129 29.6534 174.8167 44 L 5.2408 8.8899 124.1289 52.7562 45.9925 175.3623 45 Q 4.8557 9.1910 122.8611 54.4400 31.4817 174.4364 46 L 5.2346 8.7093 126.3791 53.8005 43.8098 176.1283 47 S 4.4534 8.5725 115.0191 56.6674 66.9065 172.5779 48 A 4.5866 7.9148 124.1624 50.7941 19.2975 176.9287 49 E 3.9419 8.6121 123.3725 59.1081 29.9131 177.3189 50 S 4.7309 7.4103 112.2307 55.9222 67.1135 173.3491 51 V 3.7827 8.2872 121.6473 64.5657 31.5386 176.3987 52 G 3.9602 9.1910 114.8651 45.2818 0.0000 171.8660 53 E 5.1536 8.3322 120.0671 54.5941 32.2890 175.6531 54 V 4.8408 8.9821 116.6411 59.9188 36.7287 174.0355 55 Y 5.4168 8.6280 119.5370 56.7154 41.1120 175.3116 56 I 4.5782 8.5673 122.1258 59.5272 40.3631 174.4654 57 K 4.8541 8.7293 126.5147 54.5141 36.1992 175.4681 58 S 4.5874 8.6992 118.1334 58.5903 62.7050 175.0953 59 T 3.8973 8.5091 118.3077 64.5764 68.8061 175.8894 60 E 4.0710 8.3634 122.5578 58.3056 29.8722 176.9872 61 T 4.3471 8.1788 106.3181 60.6664 70.1861 175.3248 62 G 3.8399 8.1695 110.1176 45.2793 0.0000 173.8103 63 Q 4.4176 7.5987 118.9724 56.1087 30.2560 174.6320 64 Y 4.8562 8.9219 120.3643 56.1236 40.2415 175.1617 65 L 4.4123 9.0405 126.3582 55.4032 43.4742 175.5227 66 A 5.0267 8.6005 125.6313 50.8819 23.1705 174.4154 67 M 5.3308 8.7164 120.0589 53.8795 34.6021 175.8171 68 D 5.2766 9.5187 126.4691 52.3873 41.2721 176.9365 69 T 4.0710 8.5800 112.8449 64.6749 67.2296 174.0110 70 D 4.8077 8.6149 118.7475 54.0434 41.4555 176.8464 71 G 3.5439 8.9182 108.4573 45.2017 0.0000 173.1227 72 L 4.7589 8.3790 120.2601 53.1729 42.9888 175.9044 73 L 5.1122 8.3737 122.9793 54.8938 42.7931 175.5379 74 Y 5.0299 9.0104 120.0794 55.8885 42.1781 173.5257 75 G 4.2595 8.7958 107.9403 45.0451 0.0000 173.1281 76 S 5.1005 8.9172 120.7450 56.6354 64.0963 175.3057 77 Q 4.1907 9.0702 125.8369 58.1612 28.9529 176.3410 78 T 4.6521 7.4762 106.0091 58.5012 71.8118 171.5484 79 P 3.5567 0.0000 0.0000 62.2467 32.0973 175.1975 80 N 4.9743 8.0328 117.8911 51.1121 40.4142 174.4948 81 E 3.9213 8.7318 115.1374 59.4080 29.7009 177.7594 82 E 4.1287 8.7862 118.1781 57.7336 29.7352 177.4092 83 C 4.9388 7.8540 115.0771 58.9070 29.1655 173.3250 84 L 4.6385 7.3543 121.0527 53.5895 43.0688 175.5864 85 F 5.2209 8.9646 121.3853 55.5365 43.3314 174.1447 86 L 4.7805 9.2321 123.1053 54.0704 42.7960 175.4471 87 E 4.7592 9.0365 126.8415 55.1908 30.3838 175.5640 88 R 4.8538 8.6989 125.7364 54.0185 34.5594 174.9061 89 L 4.6537 8.7157 124.6136 55.3397 43.1516 175.7910 90 E 4.6995 9.0700 124.3850 55.2501 33.6230 174.8720 91 E 4.0041 9.7276 123.3391 57.6069 27.3144 174.3238 92 N 4.3170 8.5249 110.9151 54.1539 36.5413 173.7868 93 H 4.8524 8.4683 116.8900 57.6710 37.3866 173.6130 94 Y 4.6137 7.6969 116.1587 57.5080 39.9018 174.1874 95 V 4.9123 9.1693 120.6481 61.4011 34.4749 174.3534 96 T 5.1458 8.9679 117.5477 60.0969 72.2722 172.6234 97 Y 5.0959 8.6353 120.1588 56.5991 41.0784 174.3506 98 I 4.5500 8.6803 126.2660 59.3495 39.3255 175.4638 99 S 3.9709 9.0361 122.7719 58.6730 62.4091 174.1004 100 K 3.9690 8.6596 129.2063 59.3191 32.3164 178.6639 101 K 3.7567 7.9208 118.3770 59.0796 32.3730 176.7701 102 H 4.4866 7.7274 115.3292 55.0044 29.4626 176.5141 103 A 3.9384 7.6630 125.0432 55.1156 18.4279 180.6332 104 E 3.7023 7.8696 115.4528 58.5216 29.7745 177.3184 105 K 4.2371 7.4900 115.5296 55.3859 32.7886 175.8948 106 N 3.9109 7.6108 115.6972 53.9911 36.5012 174.5779 107 W 5.1659 7.5970 117.4444 55.6980 31.2180 177.4757 108 F 5.4885 9.1967 123.4902 55.4118 41.9606 175.3285 109 V 4.0300 8.9933 121.3231 62.9365 32.4486 175.2065 110 G 4.5775 8.6616 112.9064 45.1994 0.0000 171.3849 111 L 5.2886 8.5072 121.7137 52.5355 45.1805 177.0638 112 K 4.1489 8.9551 123.1546 55.2877 33.0557 178.3572 113 K 4.0752 8.4215 119.6435 59.3879 31.9559 177.9275 114 N 4.5564 8.0607 113.8929 52.7248 37.7136 175.8464 115 G 3.5481 8.1892 108.3234 45.1821 0.0000 173.1023 116 S 5.0068 7.9671 114.7963 56.6786 65.2863 174.3825 117 V 4.3075 8.2223 115.1675 61.4375 32.2172 175.9553 118 K 4.3526 8.6727 123.6794 55.5908 33.2948 176.9618 119 R 4.1511 8.5052 123.5826 55.5444 31.0773 177.0320 120 G 3.4423 8.6269 115.2053 48.3684 0.0000 174.0767 121 P 3.9644 0.0000 0.0000 64.3730 31.3517 177.5733 122 R 4.2271 7.7799 115.5477 56.6474 30.3596 176.3451 123 T 5.0261 7.6440 108.4753 59.8239 70.8871 173.4367 124 H 4.7775 7.9637 114.7997 54.9692 30.4555 173.1187 125 Y 4.0932 8.8571 118.4573 60.1868 38.0879 177.2707 126 G 4.0551 9.0441 111.5156 45.3996 0.0000 173.9062 127 Q 4.2071 7.4504 118.6153 55.2861 29.7031 177.1990 128 K 3.8580 8.3225 119.3592 58.5757 32.8337 179.3723 129 A 4.0184 8.0374 121.2227 53.9621 18.3574 178.4986 130 I 4.3407 7.2121 106.1371 60.6104 38.4075 175.4061 131 L 4.3786 7.4059 123.2005 53.9676 42.4316 175.7534 132 F 5.2787 9.2513 123.0054 55.7414 42.7236 175.4044 133 L 5.0939 9.3673 120.4370 52.3365 44.5298 174.0186 134 P 4.8267 0.0000 0.0000 62.5248 32.2621 175.9278 135 L 4.8401 9.3372 125.2231 51.9631 43.9298 174.2550 136 P 4.5481 0.0000 0.0000 62.8350 32.0064 176.5822 137 V 3.8564 8.1934 122.7338 63.1406 31.0727 175.5471 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 1C H 8.44 4.61 0.00 3.20 3.32 0.00 5.68 0.00 0.00 0.00 0.00 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.80 4.52 0.00 3.27 3.31 0.00 5.64 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.70 5.09 0.00 3.15 3.30 0.00 5.71 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 1F H 8.87 4.69 0.00 3.34 3.42 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.39 4.90 0.00 2.90 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 2 N 8.52 4.67 0.00 2.96 2.79 0.00 0.00 6.86 6.74 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 3 L 8.14 4.74 0.00 1.47 1.41 0.55 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.61 0.00 2.15 2.05 0.00 3.74 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 1.95 1.95 0.00 5 P 0.00 4.03 0.00 2.01 2.02 0.00 3.63 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 6 G 8.28 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 N 7.16 4.00 0.00 2.47 2.54 0.00 0.00 7.06 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 8 Y 8.21 4.87 0.00 3.04 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 9 K 8.41 4.12 0.00 1.75 1.89 0.00 1.73 0.00 0.00 1.79 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.40 7.81 10 K 7.54 4.67 0.00 1.82 1.78 0.00 1.58 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.38 7.81 11 P 0.00 4.74 0.00 2.12 2.21 0.00 3.64 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 2.06 1.99 0.00 12 V 9.07 4.98 2.21 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 0.80 0.00 0.00 1.02 0.00 0.00 13 L 8.92 5.03 0.00 1.74 1.64 0.52 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.67 4.97 0.00 1.64 1.68 0.26 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 8.93 4.68 0.00 3.23 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 16 C 8.39 4.24 0.00 2.40 2.35 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 0.00 0.00 0.00 0.00 17 S 8.49 4.07 0.00 3.93 4.11 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 18 N 7.29 4.39 0.00 2.54 2.53 0.00 0.00 7.22 7.98 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 19 G 8.81 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 20 G 7.40 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 0.00 0.00 0.00 21 H 7.42 4.56 0.00 3.01 3.24 0.00 5.80 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.93 5.34 0.00 3.12 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 23 L 8.95 4.62 0.00 1.87 1.53 0.97 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 24 R 9.23 4.97 0.00 1.93 2.04 0.00 3.29 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 1.54 1.81 0.00 25 I 8.22 4.76 1.84 0.00 0.00 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 1.18 0.73 0.89 0.00 0.00 26 L 8.91 4.13 0.00 1.75 1.52 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.22 0.00 1.99 2.12 0.00 3.51 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 28 D 7.97 4.52 0.00 2.79 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 29 G 8.64 4.37 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 0.00 30 T 8.26 4.39 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 1.22 0.00 0.00 31 V 8.01 4.91 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 0.90 0.00 0.00 0.94 0.00 0.00 32 D 8.48 4.59 0.00 2.89 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 33 G 8.59 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.78 5.01 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 1.35 0.00 0.00 35 R 8.82 4.22 0.00 1.85 1.97 0.00 3.04 0.00 0.00 3.06 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.28 0.00 36 D 8.17 4.56 0.00 2.83 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 37 R 8.68 3.53 0.00 1.84 2.00 0.00 3.07 0.00 0.00 3.04 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 38 S 8.23 4.50 0.00 3.98 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 39 D 7.99 4.39 0.00 2.81 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.57 4.14 0.00 1.86 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.02 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 41 H 9.18 4.84 0.00 3.35 3.48 0.00 5.78 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.02 4.57 1.90 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.02 1.03 0.00 0.00 43 Q 7.78 4.27 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.84 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 44 L 8.89 5.24 0.00 1.50 1.43 0.81 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 9.19 4.86 0.00 2.06 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 46 L 8.71 5.23 0.00 1.81 1.73 0.88 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.57 4.45 0.00 3.86 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 48 A 7.91 4.59 1.01 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 0.00 0.00 49 E 8.61 3.94 0.00 1.68 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 0.00 1.51 1.88 0.00 50 S 7.41 4.73 0.00 3.93 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 51 V 8.29 3.78 2.29 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 0.95 0.00 0.00 1.02 0.00 0.00 52 G 9.19 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 53 E 8.33 5.15 0.00 1.89 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 0.00 2.20 2.27 0.00 54 V 8.98 4.84 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 0.67 0.00 0.00 1.19 0.00 0.00 55 Y 8.63 5.42 0.00 3.00 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 56 I 8.57 4.58 1.70 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.54 0.65 0.00 0.00 57 K 8.73 4.85 0.00 1.40 1.23 0.00 0.61 0.00 0.00 1.38 0.00 0.00 2.51 0.00 0.00 2.14 0.00 0.00 0.00 0.00 1.11 1.24 7.81 58 S 8.70 4.59 0.00 3.86 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.51 3.90 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 60 E 8.36 4.07 0.00 2.00 2.03 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 2.20 2.38 0.00 61 T 8.18 4.35 4.23 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 1.23 0.00 0.00 62 G 8.17 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 63 Q 7.60 4.42 0.00 1.96 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.74 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 64 Y 8.92 4.86 0.00 2.81 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 65 L 9.04 4.41 0.00 1.59 1.48 0.81 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.60 5.03 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.72 5.33 0.00 2.27 2.27 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 2.74 2.76 0.00 68 D 9.52 5.28 0.00 2.93 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 69 T 8.58 4.07 4.33 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 1.27 0.00 0.00 70 D 8.61 4.81 0.00 2.70 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 71 G 8.92 3.54 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 0.00 0.00 0.00 72 L 8.38 4.76 0.00 2.10 1.64 0.92 0.87 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 73 L 8.37 5.11 0.00 1.58 1.62 0.92 0.97 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 74 Y 9.01 5.03 0.00 3.01 3.03 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 75 G 8.80 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 0.00 0.00 0.00 0.00 76 S 8.92 5.10 0.00 3.76 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.07 4.19 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.56 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 78 T 7.48 4.65 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 1.20 0.00 0.00 79 P 0.00 3.56 0.00 1.56 0.49 0.00 3.45 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 80 N 8.03 4.97 0.00 2.90 2.90 0.00 0.00 6.01 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 81 E 8.73 3.92 0.00 2.04 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 2.26 2.28 0.00 82 E 8.79 4.13 0.00 2.33 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 2.39 2.34 0.00 83 C 7.85 4.94 0.00 3.22 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 84 L 7.35 4.64 0.00 1.40 1.38 0.78 0.43 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 85 F 8.96 5.22 0.00 3.13 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 86 L 9.23 4.78 0.00 1.54 1.60 0.87 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 87 E 9.04 4.76 0.00 2.18 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 2.27 2.30 0.00 88 R 8.70 4.85 0.00 1.80 1.84 0.00 3.18 0.00 0.00 2.92 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 89 L 8.72 4.65 0.00 1.64 1.61 0.94 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.07 4.70 0.00 2.23 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 0.00 2.29 2.44 0.00 91 E 9.73 4.00 0.00 2.46 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 0.00 2.30 2.41 0.00 92 N 8.52 4.32 0.00 2.84 2.88 0.00 0.00 6.86 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 93 H 8.47 4.85 0.00 2.83 2.89 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.70 4.61 0.00 2.98 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 95 V 9.17 4.91 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 0.56 0.00 0.00 0.96 0.00 0.00 96 T 8.97 5.15 4.55 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 1.34 0.00 0.00 97 Y 8.64 5.10 0.00 2.84 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 98 I 8.68 4.55 1.72 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.73 0.54 0.00 0.00 99 S 9.04 3.97 0.00 4.05 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 0.00 100 K 8.66 3.97 0.00 1.71 1.68 0.00 1.73 0.00 0.00 1.46 0.00 0.00 2.79 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.30 7.81 101 K 7.92 3.76 0.00 1.72 1.64 0.00 1.49 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.24 0.95 7.81 102 H 7.73 4.49 0.00 2.91 1.98 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.66 3.94 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 0.00 104 E 7.87 3.70 0.00 1.54 1.77 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 2.16 2.11 0.00 105 K 7.49 4.24 0.00 1.13 1.76 0.00 1.87 0.00 0.00 1.57 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.11 7.81 106 N 7.61 3.91 0.00 3.02 3.02 0.00 0.00 6.87 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 0.00 107 W 7.60 5.17 0.00 3.23 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 0.00 108 F 9.20 5.49 0.00 2.86 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 0.00 109 V 8.99 4.03 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 0.65 0.00 0.00 0.59 0.00 0.00 110 G 8.66 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.51 5.29 0.00 1.46 1.44 1.02 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 112 K 8.96 4.15 0.00 1.93 1.67 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.44 7.81 113 K 8.42 4.08 0.00 1.70 1.84 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.43 7.81 114 N 8.06 4.56 0.00 2.78 2.89 0.00 0.00 6.19 7.00 0.00 0.00 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 G 8.19 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 0.00 0.00 0.00 116 S 7.97 5.01 0.00 3.89 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 0.00 117 V 8.22 4.31 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 0.72 0.00 0.00 1.00 0.00 0.00 118 K 8.67 4.35 0.00 1.62 1.69 0.00 1.62 0.00 0.00 1.57 0.00 0.00 3.06 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.34 7.81 119 R 8.51 4.15 0.00 1.74 1.62 0.00 3.20 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.48 0.00 120 G 8.63 3.44 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 0.00 0.00 0.00 0.00 0.00 0.00 121 P 0.00 3.96 0.00 1.85 2.07 0.00 2.90 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 1.62 1.43 0.00 122 R 7.78 4.23 0.00 1.84 1.92 0.00 3.28 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 123 T 7.64 5.03 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 1.27 0.00 0.00 124 H 7.96 4.78 0.00 3.47 3.54 0.00 5.68 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.86 4.09 0.00 3.16 2.94 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 0.00 0.00 0.00 0.00 126 G 9.04 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 0.00 0.00 0.00 127 Q 7.45 4.21 0.00 1.91 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.76 0.00 0.00 0.00 0.00 0.00 2.17 1.98 0.00 128 K 8.32 3.86 0.00 1.75 1.65 0.00 1.51 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.27 7.81 129 A 8.04 4.02 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 7.21 4.34 1.54 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.78 0.54 0.00 0.00 131 L 7.41 4.38 0.00 1.07 0.81 0.29 0.87 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 0.00 132 F 9.25 5.28 0.00 3.47 3.21 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 0.00 133 L 9.37 5.09 0.00 1.81 1.67 1.12 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 4.83 0.00 2.04 2.13 0.00 3.75 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.40 0.00 135 L 9.34 4.84 0.00 1.64 1.62 1.03 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.55 0.00 2.07 2.07 0.00 3.77 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 137 V 8.19 3.86 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 0.72 0.00 0.00 0.90 0.00 0.00