NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4926 8.3049 118.1946 55.1075 32.6053 174.1540 1 I 4.3988 8.0603 118.9997 59.0727 40.1300 173.6012 2 Q 5.1330 9.4187 124.8113 54.4357 32.0513 175.0266 3 R 4.8507 9.4120 121.5653 54.4674 34.5774 174.7016 4 T 4.4071 8.9864 114.8132 60.3642 69.4357 172.5838 5 P 4.7669 0.0000 0.0000 62.8551 32.6437 175.6552 6 K 4.4360 9.4971 122.6408 55.7887 33.5486 175.6147 7 I 4.9852 8.4087 125.7685 59.6691 39.3315 174.9784 8 Q 4.7773 9.1179 125.5069 54.1114 31.9084 174.4471 9 V 5.0408 8.3837 124.1871 61.5233 33.8348 173.9707 10 Y 5.1106 7.9989 124.6712 56.9095 41.6903 172.5708 11 S 4.9372 8.8907 113.4783 56.4382 65.4535 174.4341 12 R 4.0621 8.5524 122.0733 59.5287 30.0713 176.4969 13 H 5.0876 8.1669 113.1724 52.8965 31.3451 172.4883 14 P 4.3558 0.0000 0.0000 62.6541 31.5467 176.2261 15 A 4.3513 8.8022 126.6999 51.5798 19.2579 176.2261 16 E 4.6382 8.5900 122.6028 54.1416 31.9251 175.3699 17 N 4.6156 8.8731 121.1213 55.4618 38.8970 175.1920 18 G 3.9798 8.8416 112.1777 44.9344 0.0000 173.4115 19 K 4.4130 7.3761 118.7095 54.6291 33.5179 176.4656 20 S 4.2535 8.2764 117.5113 59.1090 63.4717 172.6219 21 N 4.9029 8.0963 122.2503 53.3031 43.0425 172.2242 22 F 5.2778 9.6682 117.1589 55.8144 43.1865 173.8831 23 L 4.2046 8.7273 126.3321 53.4872 43.6996 174.6615 24 N 5.2833 8.6604 123.7362 51.4096 41.5838 172.4768 25 C 5.2568 9.5899 124.4060 54.9543 46.0014 171.7416 26 Y 5.3465 9.4139 128.4372 56.2672 40.6108 174.2071 27 V 4.9167 8.3254 121.3804 59.9684 33.4438 175.7129 28 S 4.9911 9.0206 119.2480 57.6958 66.7987 174.8003 29 G 4.0596 9.2547 109.1443 45.5542 0.0000 173.1115 30 F 5.3699 7.6650 113.7991 55.5267 41.4518 173.8333 31 H 5.2694 8.8345 118.1641 54.9575 33.7089 171.9391 32 P 4.9261 0.0000 0.0000 62.0539 33.0251 175.7127 33 S 3.9780 8.5241 112.6994 60.1618 63.3553 173.8394 34 D 4.3838 7.9436 121.0921 54.7064 40.5084 175.2571 35 I 4.6950 8.0149 123.7806 59.4599 41.3939 173.1772 36 E 4.5636 9.2350 130.4417 54.4541 31.6893 174.6332 37 V 4.5042 8.0965 125.8896 61.3020 33.7683 173.9440 38 D 5.0339 9.3089 128.0490 52.4459 44.4876 175.1951 39 L 4.7747 8.3166 120.9229 53.3277 44.3043 175.3169 40 L 5.1555 9.1802 122.8342 52.7484 45.4434 175.3745 41 K 4.1286 9.0772 125.2339 54.2589 34.0249 175.8615 42 N 4.2657 9.5338 128.8772 54.3559 36.4496 175.9926 43 G 3.9293 7.9422 102.7312 45.8319 0.0000 172.9462 44 E 4.5233 7.5419 119.3728 54.2739 31.2021 175.4044 45 R 4.3896 8.3367 122.9375 56.2087 30.6102 176.0454 46 I 4.1318 8.6839 127.4381 61.0446 38.0885 175.8755 47 E 4.1389 8.8191 124.9398 59.0994 30.2635 177.8935 48 K 4.2618 7.7207 119.5649 55.3211 30.5711 175.2591 49 V 4.5243 7.3764 119.4216 60.8947 34.3993 174.7783 50 E 4.6067 8.7468 127.3156 54.6638 32.1423 174.6196 51 H 5.2713 7.8639 117.2754 53.2829 31.6211 173.3363 52 S 4.5925 8.5146 114.7295 58.0386 64.0406 173.5808 53 D 4.5954 8.5133 120.1060 53.6088 41.3585 176.3122 54 L 4.1617 8.3165 125.1416 55.6068 42.9624 175.8102 55 S 4.6494 8.2730 118.6141 57.4741 66.4893 171.7198 56 F 5.1175 7.5239 113.9548 56.0822 40.8073 173.4588 57 S 4.8932 8.6341 115.7741 56.2178 65.3872 175.0621 58 K 3.5366 8.5810 121.4547 59.2130 31.7049 176.8548 59 D 4.5718 7.8715 115.9036 52.5592 39.4408 177.0657 60 W 3.6583 7.8616 118.0803 57.0780 27.6472 174.5616 61 S 4.3747 7.7905 114.2348 58.2066 63.9557 173.9137 62 F 5.0732 8.7842 121.1933 57.1446 40.5896 174.1893 63 Y 5.4919 8.4045 117.4911 56.1416 41.7744 173.6403 64 L 4.8647 8.9996 121.4498 54.0978 46.6480 173.5096 65 L 5.4299 9.5653 128.3728 53.8292 44.6417 174.3580 66 Y 5.3481 9.7901 125.1250 56.7408 40.4116 174.5181 67 Y 5.4576 8.9222 120.8795 56.1236 42.0370 173.6947 68 T 4.9314 8.9547 115.2086 60.5117 71.5581 171.9618 69 E 4.2707 8.7097 128.3247 55.3645 30.8466 175.0545 70 F 4.9441 8.7825 120.5642 56.0729 42.4213 173.2931 71 T 4.0930 8.1761 114.3852 60.7041 70.9919 172.4446 72 P 4.7200 0.0000 0.0000 62.9596 32.9238 175.8557 73 T 5.0800 8.3297 111.1854 59.8060 71.8886 173.2362 74 E 4.1563 8.9436 119.9433 58.6980 29.5819 178.1080 75 K 4.3986 7.8533 115.6627 57.3552 34.4669 176.2972 76 D 4.4690 8.3248 120.2250 54.7619 41.1510 175.2753 77 E 4.7242 9.6603 124.7787 55.2468 31.4421 174.8981 78 Y 5.2839 8.9070 121.1495 56.5355 41.6326 174.4424 79 A 5.1230 8.9191 122.5268 51.1150 23.6829 174.0968 80 C 5.2841 9.1276 119.2212 54.6743 45.2124 172.6768 81 R 5.1055 9.7109 127.0661 54.5400 32.3695 174.2005 82 V 4.7189 8.7897 126.6502 60.9854 34.5208 173.5756 83 N 5.2598 8.7944 126.3638 52.3082 42.1927 172.3934 84 H 4.9585 8.2906 122.6633 55.2676 32.8911 174.8199 85 V 3.7147 8.1305 122.1229 64.3121 31.3624 177.4316 86 T 4.0798 7.9676 110.1429 62.9047 69.0870 173.7391 87 L 4.7103 7.7222 123.9137 52.9071 42.2724 177.5543 88 S 3.9792 8.6766 119.3912 61.0758 63.0524 174.1953 89 Q 4.5972 7.2575 117.3114 53.6207 32.7888 172.3584 90 P 4.5647 0.0000 0.0000 62.6944 32.4461 175.6062 91 K 4.5298 8.8986 124.0020 54.8777 34.2865 174.7820 92 I 4.8257 8.3683 128.0635 59.6671 39.1989 174.9959 93 V 4.3957 8.5297 127.1060 60.9053 33.6868 174.7980 94 K 4.7188 8.7410 127.7345 55.6429 33.1641 176.8611 95 W 4.5239 9.3265 134.9329 57.5816 30.8058 175.0241 96 D 4.3676 8.6836 127.8671 53.7983 41.2056 176.5879 97 R 3.1055 8.0983 125.8984 57.8159 30.5756 176.5670 98 D 4.9485 7.5018 117.6409 52.2257 39.8584 176.2041 99 M 4.3028 7.7933 123.5995 57.1578 32.9333 175.0821 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 0 M 8.30 4.49 0.00 2.17 2.21 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.58 0.00 1 I 8.06 4.40 1.81 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 1.39 0.54 0.89 0.00 0.00 2 Q 9.42 5.13 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.70 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 3 R 9.41 4.85 0.00 1.91 2.04 0.00 3.34 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 4 T 8.99 4.41 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 1.25 0.00 0.00 5 P 0.00 4.77 0.00 1.96 1.80 0.00 3.71 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 1.87 1.67 0.00 6 K 9.50 4.44 0.00 1.88 1.82 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.46 7.81 7 I 8.41 4.99 1.90 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 1.31 0.54 0.96 0.00 0.00 8 Q 9.12 4.78 0.00 2.30 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 9 V 8.38 5.04 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 0.91 0.00 0.00 1.07 0.00 0.00 10 Y 8.00 5.11 0.00 3.16 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 11 S 8.89 4.94 0.00 3.94 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 12 R 8.55 4.06 0.00 1.76 2.05 0.00 3.01 0.00 0.00 3.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.44 0.00 13 H 8.17 5.09 0.00 3.25 3.22 0.00 5.76 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.36 0.00 2.10 2.07 0.00 3.75 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 15 A 8.80 4.35 1.60 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 0.00 0.00 16 E 8.59 4.64 0.00 2.00 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 2.30 2.46 0.00 17 N 8.87 4.62 0.00 2.71 2.81 0.00 0.00 7.37 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 8.84 3.98 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 0.00 0.00 0.00 19 K 7.38 4.41 0.00 1.93 1.70 0.00 1.82 0.00 0.00 1.62 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.33 7.81 20 S 8.28 4.25 0.00 3.80 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 21 N 8.10 4.90 0.00 2.62 2.38 0.00 0.00 7.01 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 22 F 9.67 5.28 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 23 L 8.73 4.20 0.00 0.27 0.66 -0.46 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.66 5.28 0.00 1.44 1.92 0.00 0.00 6.08 7.60 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 25 C 9.59 5.26 0.00 2.93 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 26 Y 9.41 5.35 0.00 3.34 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 27 V 8.33 4.92 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 1.00 0.00 0.00 28 S 9.02 4.99 0.00 3.81 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 29 G 9.25 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 30 F 7.67 5.37 0.00 3.08 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 31 H 8.83 5.27 0.00 3.22 3.38 0.00 5.58 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.93 0.00 2.32 2.16 0.00 3.64 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.15 0.00 33 S 8.52 3.98 0.00 3.36 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 34 D 7.94 4.38 0.00 2.67 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 35 I 8.01 4.69 1.68 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.52 0.92 0.00 0.00 36 E 9.23 4.56 0.00 1.97 1.69 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 2.16 2.18 0.00 37 V 8.10 4.50 0.67 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 0.25 0.00 0.00 0.50 0.00 0.00 38 D 9.31 5.03 0.00 2.49 2.46 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 39 L 8.32 4.77 0.00 1.59 1.55 0.88 0.53 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 40 L 9.18 5.16 0.00 1.62 1.50 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 41 K 9.08 4.13 0.00 1.77 1.61 0.00 1.94 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.10 0.70 7.81 42 N 9.53 4.27 0.00 2.73 2.76 0.00 0.00 7.05 7.55 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 43 G 7.94 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 44 E 7.54 4.52 0.00 2.05 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 2.24 2.21 0.00 45 R 8.34 4.39 0.00 1.76 1.84 0.00 3.22 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 46 I 8.68 4.13 1.89 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.82 0.93 0.00 0.00 47 E 8.82 4.14 0.00 1.96 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 0.00 2.29 2.29 0.00 48 K 7.72 4.26 0.00 1.71 1.73 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.41 7.81 49 V 7.38 4.52 2.13 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 1.03 0.00 0.00 0.97 0.00 0.00 50 E 8.75 4.61 0.00 1.16 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 1.98 1.82 0.00 51 H 7.86 5.27 0.00 2.31 1.50 0.00 5.72 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.51 4.59 0.00 4.04 4.07 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 53 D 8.51 4.60 0.00 2.72 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 54 L 8.32 4.16 0.00 1.63 1.59 0.80 0.51 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 55 S 8.27 4.65 0.00 3.74 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 56 F 7.52 5.12 0.00 2.85 2.48 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 57 S 8.63 4.89 0.00 4.11 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 58 K 8.58 3.54 0.00 1.62 1.76 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.25 1.29 7.81 59 D 7.87 4.57 0.00 2.82 2.70 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 60 W 7.86 3.66 0.00 3.29 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 61 S 7.79 4.37 0.00 3.80 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 62 F 8.78 5.07 0.00 1.51 2.40 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 63 Y 8.40 5.49 0.00 2.91 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.00 4.86 0.00 2.19 1.88 1.03 0.84 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 65 L 9.57 5.43 0.00 2.11 1.71 1.03 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 9.79 5.35 0.00 3.11 2.89 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 67 Y 8.92 5.46 0.00 3.07 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 68 T 8.95 4.93 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 1.06 0.00 0.00 69 E 8.71 4.27 0.00 1.59 1.64 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 1.92 1.47 0.00 70 F 8.78 4.94 0.00 2.92 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 71 T 8.18 4.09 4.17 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 1.16 0.00 0.00 72 P 0.00 4.72 0.00 2.28 2.33 0.00 3.34 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.66 0.00 73 T 8.33 5.08 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 1.38 0.00 0.00 74 E 8.94 4.16 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 2.32 2.31 0.00 75 K 7.85 4.40 0.00 1.83 1.92 0.00 1.48 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.50 7.81 76 D 8.32 4.47 0.00 2.92 2.73 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 77 E 9.66 4.72 0.00 1.84 1.89 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 2.46 2.25 0.00 78 Y 8.91 5.28 0.00 3.15 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 79 A 8.92 5.12 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 80 C 9.13 5.28 0.00 2.99 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 81 R 9.71 5.11 0.00 1.70 1.68 0.00 3.05 0.00 0.00 3.05 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.50 0.00 82 V 8.79 4.72 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 0.79 0.00 0.00 0.80 0.00 0.00 83 N 8.79 5.26 0.00 2.77 2.62 0.00 0.00 6.26 7.69 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 84 H 8.29 4.96 0.00 3.05 3.01 0.00 5.73 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.13 3.71 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 0.66 0.00 0.00 0.91 0.00 0.00 86 T 7.97 4.08 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 1.36 0.00 0.00 87 L 7.72 4.71 0.00 1.91 1.83 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.68 3.98 0.00 3.97 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 89 Q 7.26 4.60 0.00 1.83 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.94 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 90 P 0.00 4.56 0.00 1.91 1.95 0.00 3.63 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 91 K 8.90 4.53 0.00 1.78 1.62 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.39 7.81 92 I 8.37 4.83 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.01 0.97 0.00 0.00 93 V 8.53 4.40 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 1.06 0.00 0.00 0.96 0.00 0.00 94 K 8.74 4.72 0.00 1.74 1.80 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.50 1.48 7.81 95 W 9.33 4.52 0.00 3.23 3.40 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 96 D 8.68 4.37 0.00 2.67 2.57 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 97 R 8.10 3.11 0.00 1.45 1.54 0.00 2.94 0.00 0.00 3.02 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.77 0.00 98 D 7.50 4.95 0.00 2.73 2.70 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 99 M 7.79 4.30 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.48 0.00