NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 Y 4.5841 8.1293 118.3887 58.0102 39.5176 174.0804 3 S 4.7696 8.1707 116.0663 55.1055 67.3065 174.0363 4 F 4.1876 9.5741 124.7566 61.6614 39.4836 178.0005 5 E 3.8195 8.3162 117.5322 59.6475 29.3303 179.3244 6 Q 4.0204 8.0782 117.2938 58.6310 28.6568 178.6234 7 A 3.9863 8.0445 121.8073 55.2880 18.4034 179.6924 8 I 3.4248 7.3655 118.2294 64.7544 37.1222 178.8106 9 T 3.7011 7.7365 116.4407 66.6474 67.8243 176.4895 10 Q 4.2621 8.1938 122.7818 58.4025 29.0988 177.8973 11 L 4.3314 8.1178 122.9165 57.9058 42.1883 179.0026 12 F 4.1578 8.8106 117.9713 60.8042 38.8741 177.7760 13 Q 4.1075 8.3022 117.6346 59.0237 28.6129 178.6833 14 Q 4.2379 8.3194 119.1349 58.2252 28.5595 177.4924 15 L 4.5103 7.7930 117.5361 53.6783 42.1547 176.4941 16 S 3.7853 7.6477 113.6761 59.6431 60.8602 171.8085 17 L 4.6438 8.2122 119.2652 52.4389 43.3653 177.2144 18 S 4.2276 8.4832 117.2178 58.4880 63.4205 173.8912 19 I 4.1342 8.3101 125.5022 59.8781 37.4861 174.1526 20 P 4.3619 0.0000 0.0000 62.5449 31.8133 175.9975 21 D 4.4587 8.8557 121.8207 56.8545 41.3676 176.7446 22 T 4.4601 7.5634 114.2657 61.5936 71.3397 173.5237 23 I 4.0263 8.2735 127.8734 59.9355 36.3312 175.6802 24 E 4.2882 8.4469 125.5718 55.1795 30.0283 176.8316 25 P 4.1723 0.0000 0.0000 64.8782 31.4637 176.3154 26 V 4.5301 7.2350 118.5472 61.2340 33.6300 174.8436 27 I 4.5137 9.1765 129.9675 59.9914 39.3707 175.2005 28 G 4.3720 8.6993 112.0302 44.4081 0.0000 172.2341 29 V 4.4935 8.9179 124.6854 60.7486 35.3044 174.0147 30 K 4.7309 8.5761 127.9303 54.7760 33.9189 175.4966 31 V 4.2088 8.7316 128.7769 61.6367 33.5060 175.9953 32 G 3.8234 8.2170 119.2889 47.0917 0.0000 174.3622 33 E 4.1103 8.7872 122.7598 55.8675 30.1701 175.4081 34 F 4.5865 8.0838 120.1571 55.9043 40.2759 174.3433 35 A 4.7508 8.6288 128.0555 51.3194 19.3818 176.0484 36 C 4.8891 9.4460 121.1459 58.7447 31.4208 172.9154 37 H 5.2193 8.6091 118.1222 53.9742 32.0691 172.7034 38 I 5.0198 8.6904 123.0869 60.0950 40.6568 174.4959 39 T 4.5293 8.9361 119.0785 61.5684 71.7078 171.6941 40 E 5.2362 7.8605 125.5225 54.6798 30.1474 174.8250 41 H 4.6540 8.3211 126.9002 54.8548 32.8301 171.9157 42 P 4.4713 0.0000 0.0000 61.7737 33.0343 174.9820 43 V 3.8481 8.0857 118.1882 64.9119 31.7882 176.7630 44 G 4.0317 10.0728 115.5016 45.1380 0.0000 172.1952 45 Q 4.9807 7.9887 117.9821 53.9783 33.0188 174.3464 46 I 4.6257 9.1142 125.4254 60.1532 38.7766 174.3240 47 L 5.2945 9.1947 130.4023 53.6483 44.4644 175.0107 48 M 5.4951 9.0811 124.8849 53.7797 35.9636 174.4451 49 F 5.6148 8.7090 116.2053 56.6527 42.0144 172.6909 50 T 5.0284 9.3326 113.4948 61.2830 71.5116 172.5627 51 L 5.0743 8.5892 125.5362 52.5714 42.4121 174.8756 52 P 4.6947 0.0000 0.0000 61.9736 32.8407 175.6557 53 S 4.6695 8.4433 114.2305 56.8111 63.6395 174.4927 54 L 4.4319 8.4012 125.4312 53.9986 42.7220 175.6923 55 D 4.8993 8.2975 119.7542 52.5409 42.7323 176.8260 56 N 4.3472 9.0393 124.3918 56.6919 38.8191 175.8149 57 N 4.3248 8.4113 114.3227 56.4156 38.8050 175.6326 58 D 4.3598 7.7302 118.0376 54.5074 41.2153 176.9311 59 E 4.4389 8.5366 124.2562 54.6354 32.3559 177.2877 60 K 3.8850 8.4526 118.9851 60.5965 32.3446 178.8190 61 E 3.9237 8.1022 119.1479 59.5100 29.2567 179.3880 62 T 3.8816 7.7663 113.8652 66.5123 68.4677 176.3771 63 L 4.2747 8.1465 121.0719 57.7897 41.7441 179.4332 64 L 4.1095 8.3587 118.8786 57.3472 41.0864 179.5609 65 S 4.1330 7.9624 115.2229 61.5786 62.4398 176.0681 66 H 4.2862 7.6964 117.5501 57.9019 28.4833 176.3553 67 N 4.6065 7.6038 116.4041 52.2277 39.1580 175.1863 68 I 3.6219 6.6943 121.3528 60.3689 38.6488 175.6576 69 F 4.5556 7.7431 121.6793 56.9072 38.7976 174.9546 70 S 4.6424 8.1599 115.0424 57.7053 64.9764 173.3079 71 Q 4.1541 8.7916 116.5183 57.1899 29.2817 174.7700 72 D 4.7140 8.0179 120.3126 52.4332 41.0704 176.5721 73 I 3.9479 8.2940 120.5120 62.5650 37.7450 176.5764 74 L 4.3810 8.1017 120.4983 54.4140 41.9389 176.7237 75 K 3.9068 7.7562 121.8124 55.8066 32.4537 174.7157 76 P 4.5167 0.0000 0.0000 62.8925 32.6626 175.2912 77 I 4.1928 8.2660 122.4594 59.3067 39.4788 174.4821 78 L 4.8232 8.3940 129.3623 54.3453 43.2967 175.5014 79 S 4.9860 9.2955 120.1806 56.8913 67.2777 172.0446 80 W 5.2375 8.7326 128.0803 56.0369 33.7504 174.7360 81 D 4.5861 8.6996 128.0369 52.5048 40.1615 176.1329 82 E 4.2746 9.1177 125.8470 59.2064 30.0121 178.4286 83 V 3.7380 8.1017 116.4946 65.8445 31.5018 176.9331 84 G 3.7128 8.0109 105.4448 45.2789 0.0000 173.5383 85 G 4.0021 8.2063 108.1434 47.0336 0.0000 173.2921 86 H 4.4400 6.9712 114.4537 52.4531 33.2119 171.6926 87 P 4.5262 0.0000 0.0000 62.5454 32.6921 175.6674 88 V 4.5782 9.0073 121.3220 61.2520 34.8220 173.6030 89 L 5.3174 9.0751 130.7726 53.2686 43.8684 175.0854 90 W 6.0053 8.7702 122.4826 55.3922 32.2814 173.1352 91 N 5.3231 9.3324 117.5755 51.8698 40.8572 172.8448 92 R 5.7515 8.7601 117.6552 56.3255 33.3235 173.5752 93 Q 4.7592 8.4545 120.5003 54.2481 31.9271 171.9270 94 P 4.8871 0.0000 0.0000 62.4302 32.0468 177.7168 95 L 4.0555 8.9571 125.7906 57.9429 42.1902 178.1609 96 N 4.6931 8.1933 113.8143 54.0536 37.5421 175.2562 97 S 4.7503 7.5746 111.8542 57.9011 63.5696 174.2031 98 L 4.1043 7.6290 121.0160 55.0469 41.8861 175.9606 99 D 5.2766 8.5223 121.4347 51.3170 42.2159 176.0678 100 N 4.5570 8.8641 114.5605 55.6834 38.7357 175.7138 101 N 4.8388 8.6395 113.5311 53.1660 39.5535 176.8035 102 S 4.0923 8.0306 116.6679 61.9050 62.9276 176.6664 103 L 4.0150 7.7910 120.9649 57.7149 41.3538 178.8888 104 Y 3.9246 7.9874 119.1821 61.0019 38.7840 177.9722 105 T 4.0093 8.0516 116.5894 66.7721 68.5563 176.4043 106 Q 3.9498 8.3042 121.5332 59.0525 29.0181 178.1972 107 L 3.8877 7.9541 121.4686 57.8997 42.1137 178.3943 108 E 3.8122 8.1683 119.3432 59.6909 29.6293 178.8028 109 M 4.0318 8.3342 118.9504 58.0527 31.9660 178.5853 110 L 3.8535 7.7707 120.5427 58.2985 42.2711 179.5132 111 V 3.2589 7.7354 112.3503 64.4116 31.5497 178.6468 112 Q 4.1649 8.2297 117.9610 58.7361 28.2229 179.1937 113 G 3.4751 7.6256 105.9532 47.4843 0.0000 175.4138 114 A 3.9970 7.6159 123.1916 54.9343 18.0923 179.5514 115 E 4.2342 7.7200 116.0943 59.7296 29.7743 179.4790 116 R 4.1358 7.8636 117.7898 59.0215 29.8408 179.3900 117 L 4.4393 7.3344 116.7248 54.5842 41.7336 177.2045 118 Q 4.1391 8.6459 124.4978 56.3986 29.9968 174.8077 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 2 Y 8.13 4.58 0.00 2.94 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 3 S 8.17 4.77 0.00 4.16 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 4 F 9.57 4.19 0.00 3.35 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 5 E 8.32 3.82 0.00 2.11 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 2.43 2.51 0.00 6 Q 8.08 4.02 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 7 A 8.04 3.99 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 8 I 7.37 3.42 1.36 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 -0.22 0.25 0.00 0.00 9 T 7.74 3.70 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 1.25 0.00 0.00 10 Q 8.19 4.26 0.00 2.37 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 11 L 8.12 4.33 0.00 1.84 1.97 0.96 1.16 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 12 F 8.81 4.16 0.00 3.22 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 13 Q 8.30 4.11 0.00 2.36 2.20 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 2.43 2.66 0.00 14 Q 8.32 4.24 0.00 2.48 2.29 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 2.40 2.67 0.00 15 L 7.79 4.51 0.00 1.63 1.57 0.73 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 16 S 7.65 3.79 0.00 3.99 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 17 L 8.21 4.64 0.00 1.37 1.29 0.05 0.80 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 18 S 8.48 4.23 0.00 4.02 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 19 I 8.31 4.13 1.90 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 1.50 0.62 0.86 0.00 0.00 20 P 0.00 4.36 0.00 1.96 2.00 0.00 3.48 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 1.92 2.22 0.00 21 D 8.86 4.46 0.00 2.64 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 22 T 7.56 4.46 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 1.25 0.00 0.00 23 I 8.27 4.03 1.84 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.39 0.83 0.00 0.00 24 E 8.45 4.29 0.00 2.05 1.91 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 2.42 2.27 0.00 25 P 0.00 4.17 0.00 2.08 2.13 0.00 3.73 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 1.98 1.94 0.00 26 V 7.23 4.53 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 0.88 0.00 0.00 0.95 0.00 0.00 27 I 9.18 4.51 1.99 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.58 1.09 0.00 0.00 28 G 8.70 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 29 V 8.92 4.49 1.99 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 0.74 0.00 0.00 0.84 0.00 0.00 30 K 8.58 4.73 0.00 1.71 1.62 0.00 1.80 0.00 0.00 1.60 0.00 0.00 3.04 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.28 1.42 7.81 31 V 8.73 4.21 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 0.90 0.00 0.00 0.85 0.00 0.00 32 G 8.22 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 0.00 0.00 0.00 33 E 8.79 4.11 0.00 1.72 1.79 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 1.47 1.47 0.00 34 F 8.08 4.59 0.00 3.16 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 35 A 8.63 4.75 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 36 C 9.45 4.89 0.00 2.74 2.74 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 37 H 8.61 5.22 0.00 1.46 2.73 0.00 5.75 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 I 8.69 5.02 1.99 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.80 1.05 0.00 0.00 39 T 8.94 4.53 4.28 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 1.33 0.00 0.00 40 E 7.86 5.24 0.00 1.65 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 2.31 2.28 0.00 41 H 8.32 4.65 0.00 3.06 3.12 0.00 5.98 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.47 0.00 2.20 2.08 0.00 3.67 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.88 0.00 43 V 8.09 3.85 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 0.83 0.00 0.00 0.92 0.00 0.00 44 G 10.07 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 0.00 0.00 0.00 45 Q 7.99 4.98 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.66 6.78 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 46 I 9.11 4.63 1.94 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.52 1.03 0.00 0.00 47 L 9.19 5.29 0.00 1.79 1.76 1.02 0.78 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 48 M 9.08 5.50 0.00 2.01 2.22 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.49 0.00 49 F 8.71 5.61 0.00 3.30 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 50 T 9.33 5.03 4.31 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 1.27 0.00 0.00 51 L 8.59 5.07 0.00 1.57 1.61 1.01 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 52 P 0.00 4.69 0.00 2.26 2.16 0.00 3.96 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 53 S 8.44 4.67 0.00 3.91 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 54 L 8.40 4.43 0.00 1.79 1.70 1.19 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.30 4.90 0.00 2.70 2.86 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 0.00 0.00 0.00 56 N 9.04 4.35 0.00 2.77 2.89 0.00 0.00 7.07 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 8.41 4.32 0.00 2.81 2.93 0.00 0.00 7.14 8.33 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 58 D 7.73 4.36 0.00 2.84 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 59 E 8.54 4.44 0.00 2.00 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 0.00 2.35 2.52 0.00 60 K 8.45 3.89 0.00 1.95 2.05 0.00 1.49 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.53 7.81 61 E 8.10 3.92 0.00 2.06 2.02 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 2.38 2.45 0.00 62 T 7.77 3.88 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 1.31 0.00 0.00 63 L 8.15 4.27 0.00 1.87 1.77 0.95 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 64 L 8.36 4.11 0.00 1.70 1.70 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.96 4.13 0.00 3.93 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 66 H 7.70 4.29 0.00 3.24 3.32 0.00 5.64 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 N 7.60 4.61 0.00 2.83 2.81 0.00 0.00 6.92 7.47 0.00 0.00 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 I 6.69 3.62 1.68 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 -0.09 0.82 0.00 0.00 69 F 7.74 4.56 0.00 3.13 3.06 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 70 S 8.16 4.64 0.00 3.96 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 71 Q 8.79 4.15 0.00 2.20 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.93 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 72 D 8.02 4.71 0.00 2.71 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.29 3.95 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.72 0.92 0.00 0.00 74 L 8.10 4.38 0.00 1.78 1.74 0.96 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 75 K 7.76 3.91 0.00 1.80 1.70 0.00 1.78 0.00 0.00 1.83 0.00 0.00 3.21 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.35 7.81 76 P 0.00 4.52 0.00 2.00 1.96 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.05 0.00 77 I 8.27 4.19 0.56 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.05 0.73 0.00 0.00 78 L 8.39 4.82 0.00 1.62 1.59 0.99 0.99 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 79 S 9.30 4.99 0.00 4.09 4.28 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 80 W 8.73 5.24 0.00 3.48 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 81 D 8.70 4.59 0.00 2.62 2.43 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 82 E 9.12 4.27 0.00 2.14 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 2.38 2.45 0.00 83 V 8.10 3.74 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 0.83 0.00 0.00 0.93 0.00 0.00 84 G 8.01 3.71 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 0.00 0.00 0.00 85 G 8.21 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 0.00 0.00 0.00 86 H 6.97 4.44 0.00 2.75 2.84 0.00 5.62 0.00 0.00 0.00 0.00 6.57 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 4.53 0.00 2.13 2.19 0.00 3.40 0.00 0.00 2.78 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 88 V 9.01 4.58 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 1.05 0.00 0.00 0.85 0.00 0.00 89 L 9.08 5.32 0.00 1.84 1.57 0.87 0.86 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 90 W 8.77 6.01 0.00 3.73 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 91 N 9.33 5.32 0.00 2.82 2.84 0.00 0.00 6.70 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 92 R 8.76 5.75 0.00 2.19 2.14 0.00 3.11 0.00 0.00 4.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 93 Q 8.45 4.76 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.87 0.00 0.00 0.00 0.00 0.00 2.52 2.42 0.00 94 P 0.00 4.89 0.00 2.22 2.04 0.00 3.62 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 95 L 8.96 4.06 0.00 1.76 1.81 1.01 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 96 N 8.19 4.69 0.00 2.89 2.96 0.00 0.00 5.80 7.64 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 97 S 7.57 4.75 0.00 4.00 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 98 L 7.63 4.10 0.00 1.34 1.25 0.67 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 99 D 8.52 5.28 0.00 2.88 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 0.00 100 N 8.86 4.56 0.00 2.74 3.10 0.00 0.00 7.18 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.64 4.84 0.00 2.73 2.76 0.00 0.00 6.93 7.95 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 0.00 102 S 8.03 4.09 0.00 3.72 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 0.00 103 L 7.79 4.02 0.00 1.68 1.72 0.86 0.74 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 0.00 104 Y 7.99 3.92 0.00 3.19 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 0.00 105 T 8.05 4.01 4.43 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 1.25 0.00 0.00 106 Q 8.30 3.95 0.00 2.24 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.82 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 107 L 7.95 3.89 0.00 1.80 1.61 0.84 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 108 E 8.17 3.81 0.00 2.11 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 0.00 2.31 2.34 0.00 109 M 8.33 4.03 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.83 0.00 110 L 7.77 3.85 0.00 1.83 1.77 1.00 1.05 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 0.00 111 V 7.74 3.26 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 0.72 0.00 0.00 0.91 0.00 0.00 112 Q 8.23 4.16 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.62 0.00 113 G 7.63 3.48 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 0.00 114 A 7.62 4.00 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 0.00 115 E 7.72 4.23 0.00 2.00 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 2.59 2.28 0.00 116 R 7.86 4.14 0.00 2.02 1.98 0.00 3.13 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 117 L 7.33 4.44 0.00 1.76 1.70 0.89 0.54 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 0.00 118 Q 8.65 4.14 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.55 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00