NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3008 8.2649 123.5833 50.8552 19.9192 176.3075 2 P 4.3511 0.0000 0.0000 62.9118 31.7346 174.8800 3 Q 4.5878 8.4091 117.2455 55.8253 31.6803 175.7267 4 T 4.7355 7.3333 107.6636 58.9737 73.4059 174.2750 5 I 3.7095 8.1721 120.0536 64.2937 37.9337 177.9470 6 T 3.8575 7.7916 116.4192 66.5482 68.1862 176.3571 7 E 3.9750 7.8828 119.3879 59.2430 29.7639 178.9859 8 L 4.1382 7.7950 119.8227 58.3937 42.1229 178.0770 9 C 4.2261 8.4931 118.7975 59.8858 43.3093 175.5248 10 S 4.0151 8.0265 115.1110 60.6891 62.4454 175.6382 11 E 4.0915 8.1738 120.2654 56.8104 29.5735 175.8897 12 Y 4.6509 6.9467 116.2217 55.9957 40.5381 175.4841 13 R 4.4087 8.5452 120.2160 56.7379 31.5138 175.8974 14 N 4.3805 8.9160 115.0405 54.8794 35.8700 173.7873 15 T 5.2873 7.7004 106.4520 60.2463 72.4297 172.5267 16 Q 4.5771 8.6187 117.2343 55.3667 32.2397 173.1612 17 I 4.6755 8.2293 122.4577 60.5175 38.5018 174.4884 18 Y 4.3481 8.9967 125.8631 56.8632 39.9346 175.3252 19 T 4.6020 8.4940 121.6026 62.5587 67.8360 174.2399 20 I 3.6592 8.2268 126.9793 61.8664 38.0001 175.9182 21 N 4.3520 7.5756 117.6415 52.2558 37.6655 171.6198 22 D 4.5693 6.9739 117.3435 53.0553 44.6262 174.2073 23 K 4.9233 8.3695 121.8342 55.9332 33.5989 176.0293 24 I 3.8604 8.0427 119.7563 60.3474 38.1551 176.0375 25 L 4.3780 8.2344 128.4487 57.7543 42.3981 177.0594 26 S 4.6319 7.6465 112.9785 56.6683 66.8476 171.8254 27 Y 4.8514 7.9910 122.4357 56.0564 41.0323 174.5338 28 T 4.3969 8.3252 123.1586 61.4795 72.3400 172.6290 29 E 4.8810 8.4037 125.4771 54.3615 32.7519 174.3751 30 S 4.8361 8.9152 121.1107 56.4438 65.7468 173.8610 31 M 4.5757 8.5174 121.0856 54.6074 31.9526 175.5621 32 A 4.0627 7.7325 123.6706 51.9531 19.0686 177.9431 33 G 3.9959 8.4387 111.0440 47.0833 0.0000 174.0415 34 K 4.1101 8.8393 121.9541 56.7161 30.6863 176.4869 35 R 4.6962 7.6865 117.2453 55.7320 30.8833 177.1175 36 E 5.2577 8.2035 118.7976 54.8508 29.2423 176.3332 37 M 4.8369 7.9986 120.4159 53.5872 35.8227 173.8990 38 V 4.7814 8.1666 117.5662 61.0798 34.9589 174.1342 39 I 5.0956 8.2705 127.6612 59.3727 40.2854 174.5529 40 I 5.1042 8.6752 120.0009 59.2248 40.9349 174.5245 41 T 4.9306 8.3582 112.8757 60.0306 72.4905 172.5947 42 F 5.0275 8.4065 120.2861 55.4371 42.3228 176.6600 43 K 3.9116 9.2042 120.8202 59.9797 31.9246 178.7955 44 S 4.2894 8.1201 108.4290 59.2025 62.6053 174.1187 45 G 4.0685 8.1562 110.5487 45.9582 0.0000 174.5753 46 E 4.0280 7.9978 118.2560 56.2560 30.2787 175.4465 47 T 4.7864 7.4125 116.5567 61.8959 71.7812 173.4051 48 F 5.2972 9.1381 124.9270 55.5561 43.3975 174.0399 49 Q 5.1429 9.6842 118.5309 54.5350 32.1590 174.5990 50 V 4.5972 8.6113 120.7030 61.0691 32.7717 174.9681 51 E 4.3087 8.9284 127.7013 56.4442 30.2859 177.4141 52 V 4.0257 8.1942 122.4416 61.7695 32.1799 174.1451 53 P 4.3255 0.0000 0.0000 63.4193 32.0336 175.8471 54 G 4.0933 8.3244 109.4875 45.0000 0.0000 172.9673 55 S 4.3406 8.5280 112.9818 59.7210 63.3443 175.0909 56 Q 3.9969 7.7621 118.7283 58.3452 28.9002 175.8072 57 H 4.8658 7.7516 116.4491 54.5429 30.0278 175.1497 58 I 4.2426 8.8691 117.5791 59.8136 39.1843 176.5585 59 D 4.4225 8.8202 120.7664 57.7628 39.4259 179.2293 60 S 4.3430 8.0418 112.8933 60.5370 63.1857 175.7714 61 Q 4.2558 8.1821 121.9861 57.9460 28.3840 178.1148 62 K 3.9109 7.8847 120.1842 59.6379 32.1813 179.3957 63 K 3.9855 8.0659 117.7749 59.1504 31.8842 179.0924 64 A 4.0096 7.5002 118.3979 55.1786 18.2621 179.6473 65 I 3.6326 7.7850 118.1064 64.7341 37.2429 178.3883 66 E 3.9634 7.8603 119.3000 59.5232 29.2999 179.4887 67 R 3.8836 8.0719 118.6042 59.5301 30.1141 178.2435 68 M 4.0076 8.3292 118.1958 58.7258 32.4309 178.2946 69 K 4.0352 8.2456 118.6499 59.4740 32.1814 178.7744 70 D 4.4214 8.0919 119.1559 57.9087 40.7598 179.1693 71 T 3.8760 8.4107 116.0824 66.8250 68.4519 176.7347 72 L 4.0659 8.1616 120.7912 57.6074 41.4944 179.6779 73 R 3.1350 7.9112 118.2879 59.3517 30.2128 178.4870 74 I 3.6227 7.5302 117.9520 64.2376 37.9097 178.0296 75 T 3.8797 8.1619 116.9371 66.6039 68.3088 175.8951 76 Y 3.9770 8.1494 121.4687 60.9022 38.6717 178.1804 77 L 3.7861 7.9438 118.8517 57.2769 41.8008 178.7500 78 T 4.2319 7.4706 106.5631 60.6861 69.4032 174.7485 79 E 3.7090 7.7859 119.9590 57.5723 27.6162 174.4738 80 T 4.1030 7.6236 115.7702 63.5677 69.6064 174.1131 81 K 4.2258 8.6340 125.2132 56.4383 33.3952 176.3167 82 I 4.0036 8.4792 125.4773 60.4946 38.6785 175.0520 83 D 4.5761 9.6171 128.3041 54.7056 41.3272 175.7696 84 K 5.1695 8.6383 116.0757 54.5208 36.5495 174.6921 85 L 4.9851 8.6474 121.1624 53.2072 45.6563 174.9490 86 C 4.8727 9.1456 125.2993 55.6695 45.4014 172.7087 87 V 4.7519 8.8009 119.8778 59.1568 35.4261 174.8340 88 W 5.1510 9.0931 123.3606 55.6623 30.3754 176.5938 89 N 4.8843 9.4583 122.6060 52.3516 37.6528 174.9653 90 N 4.9809 8.2859 114.4351 52.8631 37.6605 174.2682 91 K 4.7403 7.7247 116.7006 55.8040 36.3219 175.5426 92 T 4.7222 8.1740 116.6578 61.3758 71.6262 172.4900 93 P 4.6167 0.0000 0.0000 62.1083 32.7101 175.9056 94 N 4.9593 8.7963 117.3168 53.4077 40.0113 173.7353 95 S 5.3738 8.8668 116.6322 56.5428 64.8184 173.3628 96 I 4.0306 9.1701 128.7419 61.6389 36.8084 175.5684 97 A 4.4171 8.4338 127.9559 52.8319 21.0354 176.3380 98 A 4.6567 7.2378 114.3705 50.9564 22.6605 175.3526 99 I 5.1553 8.1251 112.3042 59.3636 41.4787 174.4197 100 S 4.7977 8.7963 115.9249 57.2287 66.5931 172.8528 101 M 5.2222 8.4818 119.8308 53.7827 35.8146 174.7068 102 K 4.5589 8.4398 122.0985 54.6158 35.6570 175.5763 103 N 4.5152 8.8282 121.7412 53.7707 38.4021 174.8305 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 1 A 8.26 4.30 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 2 P 0.00 4.35 0.00 2.14 2.05 0.00 3.65 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.38 0.00 3 Q 8.41 4.59 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.71 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 4 T 7.33 4.74 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 1.20 0.00 0.00 5 I 8.17 3.71 1.83 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 1.57 1.52 0.87 0.00 0.00 6 T 7.79 3.86 4.22 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 1.18 0.00 0.00 7 E 7.88 3.97 0.00 1.96 2.01 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 2.34 2.31 0.00 8 L 7.80 4.14 0.00 1.76 1.81 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 9 C 8.49 4.23 0.00 3.09 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 10 S 8.03 4.02 0.00 4.05 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 11 E 8.17 4.09 0.00 1.87 1.58 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 2.25 2.45 0.00 12 Y 6.95 4.65 0.00 2.91 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 13 R 8.55 4.41 0.00 1.91 1.95 0.00 3.43 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 14 N 8.92 4.38 0.00 3.23 3.10 0.00 0.00 6.42 7.05 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 15 T 7.70 5.29 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 0.83 0.00 0.00 16 Q 8.62 4.58 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.88 0.00 0.00 0.00 0.00 0.00 2.36 2.18 0.00 17 I 8.23 4.68 1.79 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 1.28 0.80 0.85 0.00 0.00 18 Y 9.00 4.35 0.00 2.78 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 19 T 8.49 4.60 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 1.18 0.00 0.00 20 I 8.23 3.66 1.48 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.05 -0.02 0.00 0.00 21 N 7.58 4.35 0.00 2.75 2.75 0.00 0.00 6.89 8.63 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 22 D 6.97 4.57 0.00 2.90 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 23 K 8.37 4.92 0.00 1.94 2.01 0.00 1.22 0.00 0.00 0.61 0.00 0.00 2.82 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.46 1.50 7.81 24 I 8.04 3.86 2.09 0.00 0.00 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 1.15 0.75 0.92 0.00 0.00 25 L 8.23 4.38 0.00 1.69 1.68 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 26 S 7.65 4.63 0.00 3.94 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 27 Y 7.99 4.85 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.33 4.40 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 1.06 0.00 0.00 29 E 8.40 4.88 0.00 1.62 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 2.15 2.27 0.00 30 S 8.92 4.84 0.00 3.85 3.64 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 0.00 0.00 0.00 31 M 8.52 4.58 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 32 A 7.73 4.06 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 33 G 8.44 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 34 K 8.84 4.11 0.00 2.01 2.02 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.53 7.81 35 R 7.69 4.70 0.00 1.74 1.83 0.00 3.30 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 36 E 8.20 5.26 0.00 1.96 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 2.36 2.32 0.00 37 M 8.00 4.84 0.00 2.01 2.21 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.64 0.00 38 V 8.17 4.78 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 0.96 0.00 0.00 0.90 0.00 0.00 39 I 8.27 5.10 1.72 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.55 0.81 0.00 0.00 40 I 8.68 5.10 1.66 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 1.39 1.33 0.96 0.00 0.00 41 T 8.36 4.93 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 1.08 0.00 0.00 42 F 8.41 5.03 0.00 3.08 3.07 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 43 K 9.20 3.91 0.00 1.96 1.95 0.00 1.81 0.00 0.00 1.80 0.00 0.00 3.39 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.54 7.81 44 S 8.12 4.29 0.00 4.04 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 45 G 8.16 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 0.00 0.00 0.00 46 E 8.00 4.03 0.00 1.95 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 2.19 2.34 0.00 47 T 7.41 4.79 4.04 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 1.13 0.00 0.00 48 F 9.14 5.30 0.00 3.02 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 49 Q 9.68 5.14 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 50 V 8.61 4.60 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 0.99 0.00 0.00 0.99 0.00 0.00 51 E 8.93 4.31 0.00 1.97 1.93 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 2.45 2.41 0.00 52 V 8.19 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 1.11 0.00 0.00 1.03 0.00 0.00 53 P 0.00 4.33 0.00 2.08 2.00 0.00 3.75 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 2.03 2.09 0.00 54 G 8.32 4.09 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 0.00 0.00 0.00 55 S 8.53 4.34 0.00 3.97 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 56 Q 7.76 4.00 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.88 0.00 0.00 0.00 0.00 0.00 1.73 1.94 0.00 57 H 7.75 4.87 0.00 3.27 3.24 0.00 5.84 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 8.87 4.24 1.90 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 1.52 0.87 0.93 0.00 0.00 59 D 8.82 4.42 0.00 2.72 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 60 S 8.04 4.34 0.00 4.07 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 61 Q 8.18 4.26 0.00 2.34 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.82 0.00 0.00 0.00 0.00 0.00 2.44 2.46 0.00 62 K 7.88 3.91 0.00 1.79 1.86 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.66 1.64 7.81 63 K 8.07 3.99 0.00 1.81 1.87 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.51 7.81 64 A 7.50 4.01 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 65 I 7.79 3.63 2.08 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.56 0.89 0.00 0.00 66 E 7.86 3.96 0.00 1.95 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 2.51 2.48 0.00 67 R 8.07 3.88 0.00 2.00 2.12 0.00 3.11 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 68 M 8.33 4.01 0.00 2.29 2.06 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.66 0.00 69 K 8.25 4.04 0.00 1.88 1.93 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.65 7.81 70 D 8.09 4.42 0.00 2.88 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 71 T 8.41 3.88 4.42 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 0.00 0.00 0.00 1.23 0.00 0.00 72 L 8.16 4.07 0.00 1.85 1.90 1.01 0.80 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 73 R 7.91 3.13 0.00 1.73 1.96 0.00 3.02 0.00 0.00 3.04 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.11 0.00 74 I 7.53 3.62 1.85 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 1.50 1.04 0.99 0.00 0.00 75 T 8.16 3.88 4.54 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 1.29 0.00 0.00 76 Y 8.15 3.98 0.00 3.05 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 77 L 7.94 3.79 0.00 1.58 1.66 0.87 1.05 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 78 T 7.47 4.23 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 1.22 0.00 0.00 79 E 7.79 3.71 0.00 2.10 2.05 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 2.02 2.11 0.00 80 T 7.62 4.10 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 1.22 0.00 0.00 81 K 8.63 4.23 0.00 1.66 1.76 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.49 7.81 82 I 8.48 4.00 1.96 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 1.22 1.41 0.90 0.00 0.00 83 D 9.62 4.58 0.00 2.73 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.64 5.17 0.00 1.68 1.60 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.78 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.30 1.34 7.81 85 L 8.65 4.99 0.00 1.21 1.13 0.72 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 86 C 9.15 4.87 0.00 2.81 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 87 V 8.80 4.75 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 -0.04 0.00 0.00 1.14 0.00 0.00 88 W 9.09 5.15 0.00 3.37 3.23 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 0.00 89 N 9.46 4.88 0.00 2.78 3.05 0.00 0.00 6.95 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 90 N 8.29 4.98 0.00 2.88 3.01 0.00 0.00 5.95 7.13 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 91 K 7.72 4.74 0.00 1.84 1.72 0.00 1.63 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.54 7.81 92 T 8.17 4.72 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 1.22 0.00 0.00 93 P 0.00 4.62 0.00 2.13 1.98 0.00 3.79 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 94 N 8.80 4.96 0.00 3.12 3.08 0.00 0.00 7.11 7.57 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 95 S 8.87 5.37 0.00 4.06 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 96 I 9.17 4.03 1.92 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.91 0.85 0.00 0.00 97 A 8.43 4.42 -0.14 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 0.00 0.00 98 A 7.24 4.66 1.06 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 99 I 8.13 5.16 1.87 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 1.39 0.77 0.90 0.00 0.00 100 S 8.80 4.80 0.00 3.86 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 0.00 101 M 8.48 5.22 0.00 1.87 1.95 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.67 0.00 102 K 8.44 4.56 0.00 1.64 1.61 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.45 7.81 103 N 8.83 4.52 0.00 2.73 2.72 0.00 0.00 6.87 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00