NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3375 8.2493 123.5816 52.7118 19.5274 178.6523 2 T 4.5591 8.4132 107.6479 62.7623 70.6132 172.1288 3 K 5.3037 8.2923 122.8581 54.9926 37.4397 176.0413 4 A 5.3903 9.1374 123.6395 50.8778 23.4617 175.1318 5 V 5.0248 8.7889 117.3614 60.8774 35.4705 173.4844 6 C 4.9553 9.1739 121.8601 58.0212 35.4592 172.6505 7 V 4.5907 8.4342 126.0481 61.4804 32.9173 174.2857 8 L 4.7737 8.7998 129.3835 54.1328 43.2114 176.3131 9 K 5.1195 8.7665 122.1652 55.0988 36.9895 175.5829 10 G 4.8961 8.3931 108.9451 46.4975 0.0000 172.3390 11 D 4.7490 8.9643 120.2982 53.2524 41.1081 177.5998 12 G 4.8718 8.1226 122.4117 46.5295 0.0000 170.7824 13 P 4.5423 0.0000 0.0000 61.7104 32.5584 174.9201 14 V 4.7308 8.5232 121.6225 61.7102 33.4232 174.6382 15 Q 5.0472 8.8491 126.1173 54.5984 33.2617 174.1333 16 G 4.4341 8.9440 109.2369 45.3893 0.0000 171.7646 17 I 5.0121 8.2236 121.2594 59.3183 40.4110 174.7376 18 I 4.5562 8.7905 128.2575 59.4506 39.9248 174.5504 19 N 4.9850 8.2938 124.2445 51.4265 41.2303 173.9615 20 F 5.3676 8.8679 119.5972 55.8701 43.4247 173.6385 21 E 5.3024 9.6929 122.8569 54.7880 33.5026 173.8268 22 Q 4.7854 9.2922 127.1242 54.4598 31.6212 175.7701 23 K 4.1655 9.0692 127.2515 59.1054 32.6587 177.0442 24 E 4.7967 7.6925 114.3905 54.5114 32.2957 176.0579 25 S 4.1575 8.6730 114.7044 60.7868 63.2387 174.6069 26 N 4.7009 8.2056 117.0565 52.4016 37.2899 174.2129 27 G 4.1497 7.7518 108.2311 42.9748 0.0000 171.2747 28 P 4.6997 0.0000 0.0000 62.5157 32.8066 175.7585 29 V 4.5508 8.7120 121.1780 61.5274 33.2641 174.8253 30 K 4.8751 9.1831 128.3581 55.8750 33.8074 176.0075 31 V 4.8354 9.1885 125.0176 60.8462 34.2762 174.2129 32 W 6.0131 7.8273 124.0203 55.1118 31.8691 175.6655 33 G 3.8155 7.5831 105.9561 45.9694 0.0000 170.7423 34 S 5.1386 7.7591 113.2952 56.7350 66.6182 174.2180 35 I 4.9224 8.7423 125.7343 59.3465 40.7849 174.6629 36 K 4.7923 9.4332 125.8723 55.4900 35.9719 176.8149 37 G 3.7644 8.9366 107.4812 46.8513 0.0000 173.3527 38 V 4.4371 7.3949 112.2166 58.7415 34.4916 175.4475 39 T 4.3058 8.1636 111.2179 61.0442 69.3885 174.1309 40 E 4.0934 8.5565 124.2121 57.8879 30.3444 175.5137 41 G 3.7534 8.6669 110.5578 43.8887 0.0000 172.1520 42 L 4.8658 8.1472 118.3602 54.7115 42.7692 176.5702 43 H 5.0580 9.3338 119.8033 53.6190 32.7528 173.5033 44 G 4.0375 9.1071 110.5465 46.6820 0.0000 172.6419 45 F 5.4010 8.8676 124.5876 57.2343 42.4593 172.9161 46 H 5.0221 8.8802 122.5966 54.1507 33.9109 172.7220 47 V 4.3760 8.6096 121.2318 62.6965 32.5421 175.1276 48 H 5.1547 9.2962 125.4334 54.3903 30.8380 175.9185 49 E 3.7930 8.8106 122.0610 58.9744 29.7689 177.1685 50 F 5.0585 7.8749 118.2916 55.8345 41.0155 176.3361 51 G 4.2450 8.4682 113.5451 44.8334 0.0000 173.7744 52 D 4.7783 8.0658 118.4591 52.5190 42.9619 174.3127 53 N 5.1189 8.5331 124.5235 53.4741 39.4378 176.1006 54 T 3.8624 8.6370 109.7308 63.6504 68.7319 174.8446 55 A 4.6425 8.0396 124.7193 51.3757 20.1501 177.4410 56 G 4.0853 7.9301 111.1644 46.8372 0.0000 174.4007 57 C 4.3495 8.6202 114.6527 60.0863 34.3899 175.6276 58 T 3.7496 7.9469 114.5570 65.1827 66.7096 175.7714 59 S 4.3465 7.8946 115.2248 60.4976 63.1332 175.6761 60 A 4.5565 7.5575 124.8293 53.9910 18.3436 178.5713 61 G 4.0656 8.2460 105.3131 44.5041 0.0000 170.8517 62 P 4.6628 0.0000 0.0000 61.9667 33.7031 175.4331 63 H 4.3218 8.3725 116.4760 55.7172 29.5313 175.5971 64 F 4.3131 9.1124 125.1431 57.9040 40.1662 175.2745 65 N 4.9238 7.9103 126.3895 51.5884 38.8705 173.1350 66 P 4.1937 0.0000 0.0000 65.3369 32.2450 177.8807 67 L 4.2417 7.6576 116.9647 54.2050 41.9620 176.8600 68 S 3.9718 7.7355 113.7624 59.6142 60.5724 172.1049 69 R 4.3601 7.2522 116.6468 54.9837 31.2500 176.4029 70 K 4.3484 8.0956 117.7975 56.2269 33.5424 176.4430 71 H 3.9931 8.6666 123.3595 56.6866 30.4665 174.7900 72 G 4.1693 7.4801 110.3448 44.7799 0.0000 171.9965 73 G 4.1047 8.9176 109.1647 43.5709 0.0000 173.3365 74 P 4.4060 0.0000 0.0000 65.4347 31.3223 177.9617 75 K 4.1624 7.9242 116.5741 57.9883 32.4172 176.8227 76 D 4.6728 7.6967 118.9478 53.2942 41.6964 176.3103 77 E 3.9211 8.7143 123.1308 58.9698 29.8871 176.7379 78 E 4.3191 7.9723 120.1415 55.3995 28.6563 175.1909 79 R 4.8920 7.6140 117.9633 55.2574 32.5657 174.7549 80 H 4.4643 8.9305 116.2976 55.2716 29.4147 177.0680 81 V 3.4442 8.2630 122.3739 66.3768 31.4009 177.1663 82 G 3.9224 8.3450 104.5755 47.0749 0.0000 173.4630 83 D 5.0508 8.2041 121.5380 53.3065 40.1371 175.6561 84 L 4.5764 8.3798 121.8494 53.0438 42.7352 178.2421 85 G 4.0042 8.4667 110.0226 46.8704 0.0000 174.6736 86 N 5.6975 8.7254 120.5901 51.3162 42.0392 173.2237 87 V 4.4122 8.5471 114.0210 59.8979 35.3565 174.7903 88 T 5.0630 8.2442 118.5001 61.8774 71.3183 173.0326 89 A 4.8808 9.0147 129.0829 50.6225 21.5064 176.9967 90 D 4.6625 8.5485 120.6936 51.8490 41.6720 177.0490 91 K 3.8700 8.5238 119.0515 59.8004 32.1018 177.4099 92 D 4.4896 8.1713 115.8304 54.5852 41.3335 176.7621 93 G 4.3077 8.6495 108.5471 44.7033 0.0000 172.5272 94 V 4.8518 7.9302 119.0352 60.6552 34.1705 173.9677 95 A 5.2440 8.8843 129.9687 49.6611 21.1294 175.0697 96 D 4.9788 8.6410 123.2685 53.2423 42.1565 176.2051 97 V 3.9945 8.6584 125.1697 61.7567 33.2656 175.1314 98 S 4.7300 8.4697 122.9034 57.6611 64.0254 172.7089 99 I 4.8063 9.2240 128.2464 59.2520 41.2388 174.2444 100 E 5.2117 8.8394 125.3610 54.5158 32.3254 174.4023 101 D 4.9181 9.1988 125.5235 52.9553 44.5616 175.8568 102 S 4.5942 9.0476 120.0948 58.8590 63.8954 174.8288 103 V 4.1136 7.9393 119.6002 64.2260 32.3782 176.2319 104 I 4.0506 7.8153 111.4854 61.1727 38.1716 174.6289 105 S 4.6697 8.4583 114.6375 57.4252 65.4708 174.1794 106 L 4.4567 8.9737 122.9072 54.3502 41.5839 176.1594 107 S 4.4257 7.8575 113.0739 58.0424 66.4593 174.6192 108 G 3.8674 8.4965 108.8285 44.7763 0.0000 173.4389 109 D 4.4302 8.6242 116.8283 57.0956 41.4721 177.1431 110 H 5.0901 8.0972 115.4048 55.6831 28.8786 174.0285 111 C 4.4229 7.9803 120.9982 59.6834 31.7958 173.5014 112 I 3.8955 8.2322 119.1973 60.3955 38.1674 175.6906 113 I 3.5828 7.4161 122.6036 63.3214 37.4708 176.2040 114 G 3.7987 9.3984 113.2025 45.4068 0.0000 172.9090 115 R 4.8353 7.4453 119.1163 54.8542 33.5262 174.6534 116 T 4.9523 7.9502 116.1934 61.9831 71.0498 173.8943 117 L 4.6635 8.5480 128.6653 54.1737 44.0091 175.4097 118 V 4.9761 8.6892 125.5879 61.0053 35.0432 174.1803 119 V 5.1291 8.5986 127.0139 60.5221 33.7436 174.8289 120 H 5.2863 8.9654 121.2284 54.1655 30.8064 174.8193 121 E 4.1796 9.2984 121.6053 59.3189 29.6885 177.1454 122 K 4.7064 8.2197 117.6032 54.0340 35.4016 175.8468 123 A 4.4034 8.2896 124.0417 52.1467 18.9885 176.3858 124 D 4.7368 9.3108 121.9020 53.8655 41.4367 176.1430 125 D 4.5862 9.2161 125.6544 53.1398 39.4899 176.9590 126 L 3.5523 9.8533 119.3684 56.0471 39.5423 176.0385 127 G 4.1345 8.6754 105.2892 45.6874 0.0000 174.7159 128 K 4.5876 7.9678 117.8646 55.9926 32.4709 177.6552 129 G 3.7828 7.6346 108.8690 46.6214 0.0000 175.8864 130 G 3.9326 8.0454 107.5238 45.2857 0.0000 172.6328 131 N 5.1469 7.3229 116.3473 50.1438 40.2722 174.5306 132 E 4.1073 8.5864 116.2801 59.2869 30.0759 179.0809 133 E 4.0790 8.1405 118.7124 58.7624 29.2638 178.7641 134 S 4.2227 8.3450 114.0863 61.1815 62.2218 175.2003 135 T 4.5425 7.4416 109.5871 61.5114 68.7908 175.3965 136 K 4.2758 7.8038 118.7840 58.4329 34.6172 177.2154 137 T 4.0571 8.0904 106.6612 60.1478 70.2818 175.4601 138 G 3.8240 8.2240 110.1010 45.6268 0.0000 173.6603 139 N 4.3187 8.1305 114.7867 54.0889 36.7061 175.7679 140 A 4.2013 7.0760 118.8231 51.7941 19.2788 180.1338 141 G 4.1302 7.3781 105.0595 44.9379 0.0000 173.6523 142 S 4.3931 8.7305 114.1838 58.6331 64.8113 173.9699 143 R 4.4926 8.3281 119.9240 55.0560 30.0094 176.5083 144 L 4.2841 8.9609 126.0269 57.5931 42.9623 177.2241 145 A 5.0632 7.7625 117.5858 51.5215 22.7539 173.9812 146 C 5.5465 8.0911 113.2196 55.6955 46.5067 172.6604 147 G 4.5782 8.0879 104.0250 46.3601 0.0000 172.4654 148 V 4.5844 8.2857 120.6426 61.9554 32.9494 175.4527 149 I 4.1275 8.7440 129.4008 60.9763 37.9948 175.2783 150 G 4.4117 8.9737 114.6923 43.8601 0.0000 172.2940 151 I 4.2219 8.3473 122.0222 61.2280 37.6018 175.4278 152 A 4.9281 8.5427 128.1607 49.5941 22.1869 176.3959 153 Q 4.1062 8.4918 115.7721 56.5361 28.9623 176.1687 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 8.25 4.34 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 0.00 0.00 0.00 0.00 0.00 2 T 8.41 4.56 4.38 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 1.24 0.00 0.00 3 K 8.29 5.30 0.00 1.72 1.75 0.00 1.92 0.00 0.00 1.96 0.00 0.00 3.10 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.55 1.51 7.81 4 A 9.14 5.39 1.07 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 5 V 8.79 5.02 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 0.89 0.00 0.00 0.92 0.00 0.00 6 C 9.17 4.96 0.00 3.12 2.91 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 7 V 8.43 4.59 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 0.89 0.00 0.00 0.92 0.00 0.00 8 L 8.80 4.77 0.00 1.73 1.59 1.05 0.92 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 9 K 8.77 5.12 0.00 1.66 1.62 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.37 7.81 10 G 8.39 4.90 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 11 D 8.96 4.75 0.00 2.68 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.12 4.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.54 0.00 2.23 2.18 0.00 3.68 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.94 0.00 14 V 8.52 4.73 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 0.94 0.00 0.00 1.03 0.00 0.00 15 Q 8.85 5.05 0.00 2.01 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.37 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 16 G 8.94 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 0.00 0.00 0.00 0.00 17 I 8.22 5.01 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.47 0.82 0.00 0.00 18 I 8.79 4.56 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.18 0.45 0.00 0.00 19 N 8.29 4.99 0.00 1.44 1.48 0.00 0.00 6.38 8.13 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 20 F 8.87 5.37 0.00 2.91 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 21 E 9.69 5.30 0.00 2.46 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 0.00 2.31 2.55 0.00 22 Q 9.29 4.79 0.00 2.20 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.62 0.00 0.00 0.00 0.00 0.00 2.47 2.57 0.00 23 K 9.07 4.17 0.00 1.81 1.88 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.45 7.81 24 E 7.69 4.80 0.00 2.18 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 2.28 2.56 0.00 25 S 8.67 4.16 0.00 4.01 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 26 N 8.21 4.70 0.00 2.86 2.95 0.00 0.00 5.83 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 27 G 7.75 4.15 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 0.00 0.00 0.00 28 P 0.00 4.70 0.00 2.14 2.10 0.00 3.78 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 29 V 8.71 4.55 2.24 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 1.26 0.00 0.00 1.07 0.00 0.00 30 K 9.18 4.88 0.00 1.91 1.81 0.00 1.53 0.00 0.00 1.43 0.00 0.00 2.74 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.46 1.42 7.81 31 V 9.19 4.84 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 0.74 0.00 0.00 1.08 0.00 0.00 32 W 7.83 6.01 0.00 3.48 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 33 G 7.58 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 34 S 7.76 5.14 0.00 3.84 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 8.74 4.92 1.80 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.49 0.88 0.00 0.00 36 K 9.43 4.79 0.00 1.74 1.86 0.00 1.30 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.45 1.34 7.81 37 G 8.94 3.76 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 0.00 0.00 0.00 38 V 7.39 4.44 1.81 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 0.76 0.00 0.00 0.87 0.00 0.00 39 T 8.16 4.31 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 1.24 0.00 0.00 40 E 8.56 4.09 0.00 1.95 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 2.30 2.46 0.00 41 G 8.67 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.15 4.87 0.00 1.50 1.59 0.91 0.94 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 43 H 9.33 5.06 0.00 2.99 3.32 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 9.11 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 0.00 0.00 0.00 45 F 8.87 5.40 0.00 2.98 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 46 H 8.88 5.02 0.00 3.07 3.12 0.00 5.85 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.61 4.38 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 0.88 0.00 0.00 0.91 0.00 0.00 48 H 9.30 5.15 0.00 3.04 3.39 0.00 5.69 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 49 E 8.81 3.79 0.00 1.65 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 1.79 2.23 0.00 50 F 7.87 5.06 0.00 3.14 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 51 G 8.47 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 0.00 0.00 0.00 0.00 52 D 8.07 4.78 0.00 2.61 2.80 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 53 N 8.53 5.12 0.00 2.80 2.70 0.00 0.00 6.90 7.22 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 54 T 8.64 3.86 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 55 A 8.04 4.64 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 56 G 7.93 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 57 C 8.62 4.35 0.00 2.96 3.10 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 0.00 0.00 0.00 58 T 7.95 3.75 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 1.28 0.00 0.00 59 S 7.89 4.35 0.00 4.21 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 60 A 7.56 4.56 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 61 G 8.25 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 62 P 0.00 4.66 0.00 2.02 2.17 0.00 3.35 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.93 0.00 63 H 8.37 4.32 0.00 2.81 3.19 0.00 5.72 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 64 F 9.11 4.31 0.00 2.91 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 65 N 7.91 4.92 0.00 2.53 2.42 0.00 0.00 6.79 7.93 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 66 P 0.00 4.19 0.00 2.11 2.02 0.00 3.03 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 1.55 1.21 0.00 67 L 7.66 4.24 0.00 1.65 1.68 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.74 3.97 0.00 4.02 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 69 R 7.25 4.36 0.00 1.97 1.85 0.00 3.12 0.00 0.00 3.39 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 70 K 8.10 4.35 0.00 1.68 1.69 0.00 1.66 0.00 0.00 1.73 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.52 1.42 7.81 71 H 8.67 3.99 0.00 3.19 3.18 0.00 5.93 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.48 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 0.00 0.00 0.00 0.00 73 G 8.92 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.41 0.00 2.23 2.36 0.00 3.79 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.04 0.00 75 K 7.92 4.16 0.00 1.77 1.91 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.47 7.81 76 D 7.70 4.67 0.00 2.76 2.56 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 0.00 0.00 0.00 0.00 77 E 8.71 3.92 0.00 1.90 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 2.28 2.38 0.00 78 E 7.97 4.32 0.00 2.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.21 0.00 79 R 7.61 4.89 0.00 1.91 1.89 0.00 2.81 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 80 H 8.93 4.46 0.00 3.49 3.37 0.00 5.65 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 81 V 8.26 3.44 1.42 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 0.72 0.00 0.00 0.43 0.00 0.00 82 G 8.35 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 0.00 0.00 0.00 83 D 8.20 5.05 0.00 2.70 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 84 L 8.38 4.58 0.00 1.85 1.90 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.47 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 N 8.73 5.70 0.00 2.59 2.70 0.00 0.00 6.62 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 87 V 8.55 4.41 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 -0.02 0.00 0.00 0.74 0.00 0.00 88 T 8.24 5.06 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 1.20 0.00 0.00 89 A 9.01 4.88 1.27 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 0.00 0.00 0.00 90 D 8.55 4.66 0.00 2.91 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 91 K 8.52 3.87 0.00 1.82 1.88 0.00 1.71 0.00 0.00 1.87 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.53 7.81 92 D 8.17 4.49 0.00 2.85 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 93 G 8.65 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 0.00 0.00 0.00 0.00 94 V 7.93 4.85 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 0.96 0.00 0.00 0.92 0.00 0.00 95 A 8.88 5.24 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.64 4.98 0.00 2.55 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 97 V 8.66 3.99 1.98 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 0.68 0.00 0.00 0.61 0.00 0.00 98 S 8.47 4.73 0.00 3.90 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 99 I 9.22 4.81 1.98 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 1.17 0.61 1.02 0.00 0.00 100 E 8.84 5.21 0.00 1.96 1.81 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 2.21 2.31 0.00 101 D 9.20 4.92 0.00 2.87 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 S 9.05 4.59 0.00 3.92 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 0.00 103 V 7.94 4.11 2.24 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 0.77 0.00 0.00 0.95 0.00 0.00 104 I 7.82 4.05 1.96 0.00 0.00 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 1.49 0.82 1.04 0.00 0.00 105 S 8.46 4.67 0.00 3.83 3.86 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 0.00 106 L 8.97 4.46 0.00 1.89 1.65 1.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.86 4.43 0.00 3.88 3.81 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 0.00 108 G 8.50 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.62 4.43 0.00 2.66 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 0.00 110 H 8.10 5.09 0.00 3.28 3.44 0.00 5.69 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.98 4.42 0.00 3.15 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 0.00 112 I 8.23 3.90 1.65 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.16 0.98 0.00 0.00 113 I 7.42 3.58 1.78 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.73 0.84 0.00 0.00 114 G 9.40 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 0.00 0.00 0.00 115 R 7.45 4.84 0.00 1.62 1.86 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.24 0.00 116 T 7.95 4.95 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 1.23 0.00 0.00 117 L 8.55 4.66 0.00 1.78 1.51 0.39 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.69 4.98 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 0.71 0.00 0.00 0.71 0.00 0.00 119 V 8.60 5.13 2.18 0.00 0.00 0.00 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 1.04 0.00 0.00 120 H 8.97 5.29 0.00 3.22 3.58 0.00 5.66 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.30 4.18 0.00 2.08 2.09 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 2.36 2.34 0.00 122 K 8.22 4.71 0.00 1.79 1.70 0.00 1.88 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.40 7.81 123 A 8.29 4.40 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 0.00 124 D 9.31 4.74 0.00 2.70 2.78 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 0.00 0.00 0.00 0.00 125 D 9.22 4.59 0.00 2.94 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 0.00 126 L 9.85 3.55 0.00 1.85 1.87 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.68 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 0.00 0.00 0.00 0.00 128 K 7.97 4.59 0.00 1.74 1.79 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.48 7.81 129 G 7.63 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 G 8.05 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 0.00 131 N 7.32 5.15 0.00 2.83 2.77 0.00 0.00 6.90 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 0.00 132 E 8.59 4.11 0.00 2.21 2.25 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 2.36 2.39 0.00 133 E 8.14 4.08 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 2.39 2.41 0.00 134 S 8.35 4.22 0.00 4.12 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 0.00 135 T 7.44 4.54 4.24 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 1.21 0.00 0.00 136 K 7.80 4.28 0.00 1.79 1.78 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.31 1.49 7.81 137 T 8.09 4.06 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 1.13 0.00 0.00 138 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 0.00 139 N 8.13 4.32 0.00 3.13 2.90 0.00 0.00 6.91 6.81 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 0.00 140 A 7.08 4.20 1.26 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 0.00 141 G 7.38 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 0.00 0.00 0.00 0.00 142 S 8.73 4.39 0.00 3.94 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 0.00 143 R 8.33 4.49 0.00 1.68 1.85 0.00 3.19 0.00 0.00 3.13 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.66 0.00 144 L 8.96 4.28 0.00 1.74 1.70 0.96 0.58 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 0.00 145 A 7.76 5.06 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 0.00 146 C 8.09 5.55 0.00 3.05 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 0.00 147 G 8.09 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 0.00 148 V 8.29 4.58 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 0.77 0.00 0.00 0.91 0.00 0.00 149 I 8.74 4.13 1.79 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.24 0.39 0.00 0.00 150 G 8.97 4.41 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 0.00 0.00 0.00 151 I 8.35 4.22 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.53 0.91 0.00 0.00 152 A 8.54 4.93 1.21 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 0.00 0.00 153 Q 8.49 4.11 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.60 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00