NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.1979 8.0249 114.2692 60.7913 38.9555 174.0924 2 Q 4.7101 8.3878 118.6176 53.7070 32.2568 173.7720 3 R 4.7945 9.8707 123.0721 54.5485 33.8520 175.2343 4 T 4.6763 8.8974 120.1672 62.1490 69.3948 172.6584 5 P 4.8626 0.0000 0.0000 62.9805 32.5921 175.7917 6 K 4.6166 9.3243 122.1172 55.6390 34.1572 175.6970 7 I 5.1724 8.3112 123.1048 59.7243 40.6491 174.7960 8 Q 4.7889 9.3247 125.0021 54.1547 32.3874 174.2905 9 V 4.9502 8.6300 124.0962 61.4399 33.7170 173.9407 10 Y 5.2067 8.0704 124.8493 56.7300 41.7477 173.0169 11 S 5.0642 8.8379 113.9858 56.6245 65.0358 174.4084 12 R 4.1122 8.7959 122.8202 59.5212 30.0643 176.4446 13 H 5.0948 8.3001 113.0268 52.7521 31.5964 172.2701 14 P 4.3290 0.0000 0.0000 62.6499 31.6038 176.5022 15 A 4.1374 8.8454 125.7554 52.5524 18.8731 176.6950 16 E 4.5387 8.6093 122.1133 54.1211 31.7279 175.1232 17 N 4.4977 8.8188 121.4906 55.2379 38.8622 175.9596 18 G 3.9077 8.9754 111.6985 44.9900 0.0000 172.8539 19 K 4.3887 7.9032 121.3867 54.0642 33.5361 176.0092 20 S 4.2134 8.3291 119.9858 58.5124 63.4960 173.1356 21 N 4.7436 8.1911 121.6180 53.6521 43.9657 172.2948 22 F 5.1810 9.2707 115.5149 56.0483 43.7295 173.5683 23 L 3.9257 8.8462 126.3619 53.6290 43.3432 174.8361 24 N 5.3875 8.6236 123.7692 51.4613 41.9654 173.0002 25 C 4.9912 9.4630 122.3417 55.2118 47.7413 171.8784 26 Y 5.4650 9.3707 129.2785 56.2949 40.3829 174.4823 27 V 5.1237 8.5382 120.8379 59.7674 34.4385 175.3082 28 S 4.9954 8.2585 118.2780 57.3203 67.0633 174.4885 29 G 4.2920 8.7079 105.4671 47.1179 0.0000 173.2337 30 F 5.3114 7.0700 114.0202 55.6520 41.1527 173.9616 31 H 5.2454 8.8980 117.2682 54.8480 33.7969 172.0786 32 P 4.9310 0.0000 0.0000 62.3917 32.2264 176.0959 33 S 4.1386 8.4060 113.1754 60.7423 63.2305 174.6509 34 D 4.4033 7.8649 121.1085 54.5252 41.0230 175.1457 35 I 4.4426 7.7562 121.5867 59.9215 41.1400 172.7548 36 E 4.5646 9.0728 129.2875 54.2895 32.0750 174.6648 37 V 4.6084 7.9207 125.9518 61.0743 34.2570 174.1660 38 D 4.8768 8.9044 126.4074 52.5122 45.5046 174.2245 39 L 5.0019 8.3965 121.0821 53.1965 44.2722 175.2343 40 L 5.3122 9.0631 123.8077 52.6871 45.2234 175.6351 41 K 4.2663 9.1113 123.4678 55.0102 34.2551 176.0282 42 N 4.2349 9.7960 125.6331 54.2720 36.2716 176.0977 43 G 3.9852 8.5675 106.7656 45.0856 0.0000 173.7114 44 E 4.5638 7.6175 119.3649 53.9615 31.3710 175.3755 45 R 4.3952 8.4454 123.5851 56.3723 30.4643 176.2557 46 I 4.0130 8.4787 127.4802 61.3878 37.8784 176.0250 47 E 4.2015 8.6350 124.5956 59.2066 29.8668 180.4565 48 K 4.4624 7.6872 116.8538 56.8028 32.4603 177.1243 49 V 3.8388 7.7800 120.1778 64.2334 32.2575 174.7510 50 E 4.7384 8.3154 126.1839 54.8663 33.2819 174.0965 51 H 5.2362 7.7687 114.6851 54.1002 31.3393 173.3692 52 S 4.5492 8.7224 115.1492 58.0494 64.0236 173.6208 53 D 4.5458 8.4943 120.4449 53.5493 41.3290 176.3646 54 L 4.0681 8.3984 125.1991 55.9898 42.7850 175.8311 55 S 4.7556 8.1754 119.8786 57.1982 66.7171 171.7638 56 F 5.2669 7.5444 115.6661 55.4186 41.1909 174.1972 57 S 4.6677 9.1366 116.6375 57.0283 64.0805 175.7566 58 K 3.5909 8.4303 120.4178 59.4954 31.6752 177.8437 59 D 4.4987 7.8457 115.9670 52.7485 39.3500 177.5675 60 W 3.6641 7.7361 119.1627 57.2131 28.5762 174.7960 61 S 4.3217 7.9764 114.0843 58.1565 63.7437 174.1785 62 F 5.0211 8.3328 121.3454 57.3869 39.4434 174.0395 63 Y 5.1557 8.1102 117.2828 55.9762 41.6541 173.9274 64 L 5.1335 9.4711 120.6814 53.3260 47.0351 174.5712 65 L 5.5213 9.5709 124.5973 53.7644 44.6953 174.4712 66 Y 5.1188 9.3133 124.5664 56.5412 40.5719 174.4098 67 Y 5.3693 8.4411 120.4682 56.5449 42.1786 173.4738 68 T 4.8921 8.7565 113.7696 60.6308 71.3919 172.4224 69 E 3.9079 8.7557 128.7176 56.4220 30.4015 175.5741 70 F 4.7856 8.4753 119.4003 56.4502 41.9451 173.0921 71 T 4.4346 7.9821 115.7354 60.8896 71.1752 172.1352 72 P 4.6462 0.0000 0.0000 63.1425 32.7709 175.6645 73 T 4.9095 8.2681 109.2467 60.8784 71.0878 174.4285 74 E 4.0012 8.7506 121.6007 58.1204 29.8376 178.3637 75 K 4.2358 7.3642 118.0239 58.8136 33.5316 177.0006 76 D 4.5359 8.0313 120.0068 54.1840 41.5081 175.8672 77 E 4.9057 9.4269 123.0708 54.9486 32.1705 174.6945 78 Y 5.3649 8.7520 119.6835 56.6708 42.3940 174.1323 79 A 5.1107 8.9702 122.0873 51.4578 23.8274 174.0764 80 C 5.2815 9.4836 119.5805 54.8401 47.2042 172.4734 81 R 4.9872 9.2877 127.2923 54.7119 31.7368 174.7845 82 V 4.7652 8.7450 126.2583 61.0099 34.8177 173.5361 83 N 5.2757 9.0128 126.0027 52.1698 42.1188 172.4046 84 H 5.0937 8.5489 123.7254 54.5299 33.2901 174.1151 85 V 3.6431 8.2813 122.6494 65.0932 31.0482 177.5858 86 T 4.0686 7.9365 108.8839 62.6840 69.0443 173.3078 87 L 4.7166 7.8693 123.8799 52.9115 43.3462 176.8051 88 S 4.3190 8.7303 118.4202 60.6226 63.5238 174.4635 89 Q 4.6118 7.5593 116.9642 52.7388 32.4548 172.8832 90 P 4.5006 0.0000 0.0000 62.9423 32.2780 175.4685 91 K 4.5139 8.9842 124.8817 54.9616 34.3008 174.9284 92 I 4.8127 8.3673 127.7582 59.6907 39.2799 174.9179 93 V 4.3706 8.5676 128.0892 60.9461 33.3064 174.9888 94 K 4.7400 8.7061 127.7246 55.6705 33.1773 176.6396 95 W 4.5465 9.0894 135.0000 57.5781 31.2100 174.7364 96 D 4.6876 8.6998 127.0191 52.0968 42.3663 177.0830 97 R 3.6136 8.1707 125.5739 58.8872 30.1878 176.8407 98 D 4.9496 7.9041 115.8906 54.3993 41.3002 176.3976 99 M 4.4079 7.7474 125.1368 55.6501 32.8097 175.4617 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 I 8.02 4.20 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.12 0.92 0.00 0.00 2 Q 8.39 4.71 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.67 0.00 0.00 0.00 0.00 0.00 2.31 2.49 0.00 3 R 9.87 4.79 0.00 2.01 1.86 0.00 3.17 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 4 T 8.90 4.68 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 1.25 0.00 0.00 5 P 0.00 4.86 0.00 2.02 1.82 0.00 3.74 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.78 0.00 6 K 9.32 4.62 0.00 1.75 1.82 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.48 7.81 7 I 8.31 5.17 1.93 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 1.34 0.63 0.97 0.00 0.00 8 Q 9.32 4.79 0.00 2.41 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 9 V 8.63 4.95 2.31 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 0.89 0.00 0.00 1.10 0.00 0.00 10 Y 8.07 5.21 0.00 3.20 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 11 S 8.84 5.06 0.00 4.07 3.94 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 12 R 8.80 4.11 0.00 1.82 2.04 0.00 3.01 0.00 0.00 2.96 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.44 0.00 13 H 8.30 5.09 0.00 3.26 3.23 0.00 5.77 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 14 P 0.00 4.33 0.00 2.10 2.07 0.00 3.78 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 2.09 2.17 0.00 15 A 8.85 4.14 1.57 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 16 E 8.61 4.54 0.00 1.99 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 2.31 0.00 17 N 8.82 4.50 0.00 2.72 2.81 0.00 0.00 7.29 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 8.98 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 19 K 7.90 4.39 0.00 1.64 1.75 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.48 1.36 7.81 20 S 8.33 4.21 0.00 3.78 3.68 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 0.00 0.00 0.00 21 N 8.19 4.74 0.00 2.60 2.47 0.00 0.00 7.15 8.45 0.00 0.00 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 9.27 5.18 0.00 2.98 2.90 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 23 L 8.85 3.93 0.00 0.27 0.74 -0.37 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.62 5.39 0.00 1.58 1.92 0.00 0.00 5.98 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 25 C 9.46 4.99 0.00 2.87 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 26 Y 9.37 5.46 0.00 3.37 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 27 V 8.54 5.12 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 1.16 0.00 0.00 28 S 8.26 5.00 0.00 3.86 3.37 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 29 G 8.71 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 0.00 0.00 0.00 0.00 30 F 7.07 5.31 0.00 3.11 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 31 H 8.90 5.25 0.00 3.31 3.23 0.00 5.58 0.00 0.00 0.00 0.00 6.68 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 2.14 2.17 0.00 3.93 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 2.01 1.99 0.00 33 S 8.41 4.14 0.00 3.37 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 7.86 4.40 0.00 2.64 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 7.76 4.44 1.38 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.36 0.75 0.00 0.00 36 E 9.07 4.56 0.00 1.93 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 2.07 2.13 0.00 37 V 7.92 4.61 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 0.38 0.00 0.00 0.46 0.00 0.00 38 D 8.90 4.88 0.00 2.49 2.42 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 0.00 39 L 8.40 5.00 0.00 1.60 1.54 0.86 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.06 5.31 0.00 1.54 1.52 0.92 0.51 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 9.11 4.27 0.00 1.53 2.01 0.00 1.49 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.34 7.81 42 N 9.80 4.23 0.00 2.77 2.90 0.00 0.00 7.19 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 43 G 8.57 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 0.00 0.00 0.00 44 E 7.62 4.56 0.00 2.17 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 2.22 2.19 0.00 45 R 8.45 4.40 0.00 1.75 1.84 0.00 3.21 0.00 0.00 3.21 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 8.48 4.01 1.88 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.70 0.93 0.00 0.00 47 E 8.64 4.20 0.00 2.03 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 2.38 2.29 0.00 48 K 7.69 4.46 0.00 1.85 1.90 0.00 1.59 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.37 7.81 49 V 7.78 3.84 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 0.82 0.00 0.00 0.96 0.00 0.00 50 E 8.32 4.74 0.00 1.22 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 51 H 7.77 5.24 0.00 2.19 1.86 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 8.72 4.55 0.00 3.98 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 0.00 53 D 8.49 4.55 0.00 2.70 2.65 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 0.00 0.00 0.00 0.00 54 L 8.40 4.07 0.00 1.64 1.62 0.83 0.69 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 55 S 8.18 4.76 0.00 3.85 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 56 F 7.54 5.27 0.00 2.82 2.38 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 57 S 9.14 4.67 0.00 4.10 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 58 K 8.43 3.59 0.00 1.62 1.71 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.29 1.33 7.81 59 D 7.85 4.50 0.00 2.78 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 60 W 7.74 3.66 0.00 3.30 3.05 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 61 S 7.98 4.32 0.00 3.94 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 62 F 8.33 5.02 0.00 1.88 2.64 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 63 Y 8.11 5.16 0.00 3.00 2.95 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 64 L 9.47 5.13 0.00 1.90 1.69 1.16 0.77 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 65 L 9.57 5.52 0.00 2.01 1.70 1.13 0.79 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 66 Y 9.31 5.12 0.00 3.14 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 67 Y 8.44 5.37 0.00 3.06 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 68 T 8.76 4.89 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 69 E 8.76 3.91 0.00 1.75 1.70 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 1.81 2.00 0.00 70 F 8.48 4.79 0.00 2.89 2.64 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 71 T 7.98 4.43 4.16 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 1.12 0.00 0.00 72 P 0.00 4.65 0.00 2.11 2.32 0.00 3.43 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.04 0.00 73 T 8.27 4.91 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 1.36 0.00 0.00 74 E 8.75 4.00 0.00 2.00 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 0.00 2.33 2.25 0.00 75 K 7.36 4.24 0.00 1.78 1.93 0.00 1.64 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.44 7.81 76 D 8.03 4.54 0.00 2.88 2.47 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 0.00 0.00 0.00 0.00 77 E 9.43 4.91 0.00 1.82 1.86 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 2.26 2.26 0.00 78 Y 8.75 5.36 0.00 3.26 2.82 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 79 A 8.97 5.11 1.31 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 0.00 0.00 0.00 80 C 9.48 5.28 0.00 2.93 2.93 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 81 R 9.29 4.99 0.00 1.84 1.70 0.00 3.05 0.00 0.00 3.06 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 82 V 8.74 4.77 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 0.81 0.00 0.00 0.82 0.00 0.00 83 N 9.01 5.28 0.00 2.72 2.52 0.00 0.00 6.25 8.75 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 84 H 8.55 5.09 0.00 3.04 3.01 0.00 5.75 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 8.28 3.64 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 0.74 0.00 0.00 0.90 0.00 0.00 86 T 7.94 4.07 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 1.29 0.00 0.00 87 L 7.87 4.72 0.00 1.71 1.79 0.95 0.83 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 88 S 8.73 4.32 0.00 3.97 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 89 Q 7.56 4.61 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.97 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 90 P 0.00 4.50 0.00 1.91 1.95 0.00 3.64 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.26 0.00 91 K 8.98 4.51 0.00 1.80 1.64 0.00 1.60 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.40 7.81 92 I 8.37 4.81 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 1.23 1.03 0.93 0.00 0.00 93 V 8.57 4.37 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 0.92 0.00 0.00 0.97 0.00 0.00 94 K 8.71 4.74 0.00 1.75 1.81 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.50 1.48 7.81 95 W 9.09 4.55 0.00 3.31 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 8.70 4.69 0.00 2.69 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 97 R 8.17 3.61 0.00 1.62 1.84 0.00 3.07 0.00 0.00 3.10 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.96 0.00 98 D 7.90 4.95 0.00 2.68 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 99 M 7.75 4.41 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.72 0.00