NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3516 8.2649 123.5834 52.5442 20.1735 176.1270 2 T 4.4405 8.3049 115.3031 63.9787 70.6732 173.4205 3 K 5.3224 8.3684 120.7915 54.6470 36.9488 175.0650 4 A 5.3802 8.9865 123.6412 50.7944 23.2865 175.2931 5 V 5.1051 8.8761 117.4722 60.5058 35.5516 173.8431 6 A 4.9698 9.0704 123.3852 50.5911 22.3673 175.1134 7 V 4.4575 8.4320 122.8793 61.3713 33.4216 174.5823 8 L 4.7797 8.9964 129.6942 54.2658 42.9871 176.3816 9 K 4.8261 8.9394 122.0278 55.6650 37.2306 176.0673 10 G 4.4453 7.9454 108.6209 45.5479 0.0000 172.2904 11 D 4.5009 8.7777 117.9110 55.7922 41.5370 176.7365 12 G 4.2982 7.5845 108.8321 43.8539 0.0000 171.5179 13 P 4.4702 0.0000 0.0000 63.3313 32.0387 176.1093 14 V 4.2184 7.5528 120.6813 63.0376 32.0807 174.9393 15 Q 5.1988 7.8583 123.6785 56.4215 32.4198 173.3140 16 G 4.2235 7.9456 106.4850 46.2268 0.0000 171.7763 17 I 5.1196 8.1570 119.8615 59.4568 40.7787 175.0049 18 I 4.6031 8.7722 128.1724 59.4996 40.0031 174.6737 19 N 4.9866 8.2971 124.4443 51.6152 41.0306 174.0667 20 F 5.2732 9.0462 119.5567 55.9886 43.6228 173.8479 21 E 5.2483 9.1742 122.1566 55.2576 33.5621 173.4881 22 Q 4.9022 9.4390 128.3303 54.2300 30.6657 174.7557 23 K 4.1402 9.0886 128.7247 58.6093 32.8354 176.8038 24 E 4.7755 7.6397 117.4538 54.3338 32.2473 176.7793 25 S 4.0179 8.2675 118.5113 61.2484 63.3032 175.3874 26 N 4.8233 8.0286 116.6671 51.5356 37.3657 174.9854 27 G 3.9770 8.2364 109.6314 44.2819 0.0000 171.9931 28 P 4.6775 0.0000 0.0000 62.7950 32.4633 175.8692 29 V 4.6703 9.1971 121.6128 61.1829 34.3560 174.1298 30 K 5.0061 9.4062 129.6590 55.2316 33.9088 175.0417 31 V 4.7902 9.1058 128.2643 60.8254 34.0103 174.2091 32 W 5.4299 8.2011 123.8023 54.9593 31.9010 175.4510 33 G 3.6917 7.6872 106.6237 46.3971 0.0000 171.0349 34 S 5.1340 7.5872 113.6272 56.9510 66.6979 174.4615 35 I 5.1693 8.6502 125.2724 59.4546 41.4837 174.4808 36 K 4.8730 9.0936 125.0118 55.7063 36.4256 176.9725 37 G 3.9054 8.8612 106.1678 45.7859 0.0000 173.5607 38 L 4.4486 7.6210 119.9215 53.2079 42.9636 176.4355 39 T 4.4207 8.1841 111.4150 60.9043 69.7315 174.4137 40 E 4.0721 8.6150 121.9591 57.6822 30.3293 175.2881 41 G 3.9431 8.3065 105.9829 43.9761 0.0000 172.6361 42 L 4.8101 8.1700 118.6596 54.8510 42.9642 176.6602 43 H 5.0344 9.0501 118.7890 53.7885 33.2703 173.3337 44 G 4.2086 9.2487 111.0519 47.1172 0.0000 172.5226 45 F 5.4848 8.8773 124.5226 57.1092 42.3411 172.9102 46 H 5.1782 8.8994 122.5780 54.2314 34.0618 172.6774 47 V 4.5995 8.5311 120.4775 62.0269 32.9570 174.8772 48 H 5.0853 9.5714 126.5297 54.7822 30.3253 175.8498 49 E 3.5679 8.9685 123.0345 59.2335 29.8046 177.1180 50 F 4.9284 8.0392 118.2472 54.9245 41.3234 176.8021 51 G 4.4678 8.3248 113.1653 44.3116 0.0000 173.8943 52 D 4.7872 7.8986 117.3556 52.5998 42.9254 174.4281 53 N 5.1184 8.6257 124.5963 53.4855 39.5136 175.0611 54 T 3.9343 8.8764 109.0555 63.9900 68.9097 174.5535 55 A 4.5570 8.2292 125.2167 50.2218 18.4727 176.4354 56 G 4.0726 7.6997 112.0295 44.7866 0.0000 172.9671 57 C 4.4422 8.5036 114.4463 59.3389 34.3132 175.8342 58 T 3.8307 7.4315 118.5059 66.6866 67.8114 176.4090 59 S 4.2971 7.7312 115.2636 60.7227 63.0097 176.0330 60 A 4.8308 7.3770 125.2633 54.4954 18.2002 178.4137 61 G 3.9640 8.1859 104.9193 44.4361 0.0000 170.4904 62 P 4.6480 0.0000 0.0000 61.7103 34.1990 174.9302 63 H 4.4048 8.3306 116.8232 55.5944 29.4097 175.2260 64 F 4.1920 9.2141 125.9849 58.7688 40.4156 174.1872 65 N 5.0044 8.2357 125.5045 51.0516 38.5777 172.7890 66 P 4.2416 0.0000 0.0000 64.4801 32.0753 178.0266 67 L 4.3231 7.5957 116.9995 53.6397 42.4538 176.2712 68 S 3.5825 7.3993 113.7315 60.0268 60.5136 170.4879 69 R 4.6309 8.2345 117.7163 53.9131 33.5759 176.3252 70 K 4.4229 8.9366 118.7666 56.1743 33.4858 176.7200 71 H 4.2457 8.8226 122.1112 56.7274 30.6735 175.0322 72 G 4.3511 7.4143 106.9408 46.5193 0.0000 172.9362 73 G 4.1734 8.4621 109.1057 43.2062 0.0000 173.2866 74 P 4.2728 0.0000 0.0000 65.2487 31.1265 177.5886 75 K 4.2294 7.8810 116.2322 57.3757 32.6005 176.6272 76 D 4.5946 7.8817 119.8888 53.5011 41.6107 176.1513 77 E 3.8817 8.8368 124.7930 59.2335 29.7912 177.0290 78 E 4.1781 7.9516 123.0057 55.7872 28.6021 175.0815 79 R 5.1549 7.5523 119.8253 56.2799 32.0974 174.4229 80 H 4.6520 9.1709 116.5614 55.2889 29.3688 177.2007 81 V 3.4657 8.2380 122.5189 65.9627 31.4653 177.0592 82 G 3.9048 8.1208 106.8053 45.6367 0.0000 172.8428 83 D 4.8587 8.0135 120.6653 54.1845 39.8413 175.7935 84 L 4.7738 8.2995 124.8531 54.0066 43.3365 178.9780 85 G 3.8247 7.9767 109.4744 47.1654 0.0000 174.5776 86 N 5.6993 8.7272 120.6010 51.3540 42.2113 173.3819 87 V 4.4223 8.4220 113.8753 59.8789 35.5015 174.8006 88 T 5.0941 8.2221 118.2785 61.8523 71.4997 172.8806 89 A 4.7961 8.8721 129.2909 50.6319 21.0764 177.1187 90 D 4.9423 9.0983 122.4383 51.8391 41.0512 176.8678 91 K 4.3739 8.5184 118.8407 58.8094 31.8400 176.6036 92 D 4.6559 8.3074 115.9812 53.8645 41.0040 176.8072 93 G 4.3462 8.6996 107.7575 44.9981 0.0000 172.9346 94 V 4.8340 8.1134 119.8782 60.7159 33.9173 174.2641 95 A 5.2207 9.0343 129.9527 49.3838 21.2601 174.6095 96 D 4.7814 8.6887 123.3515 53.5806 42.2280 175.6003 97 V 4.0823 8.6834 127.4896 61.6823 33.3335 174.9797 98 S 4.9552 8.4545 122.8525 57.5784 64.1635 172.7163 99 I 4.8291 9.5982 128.6210 59.3466 41.6433 174.3345 100 E 5.1245 8.7906 124.6442 54.6237 32.1344 174.2604 101 D 5.0433 9.2236 126.2454 52.6167 44.8027 175.7484 102 S 4.7669 8.9446 117.8852 58.2100 64.0604 174.7794 103 V 3.9484 8.4548 121.9014 64.9701 31.8469 176.4506 104 I 4.1836 7.7730 111.2068 60.8491 38.6603 174.2610 105 S 4.6527 8.2175 113.7404 57.7642 65.0723 173.8795 106 L 4.6253 8.7236 122.6133 53.8647 41.6753 176.6875 107 S 4.4248 7.9043 110.5343 58.7143 65.9441 176.1077 108 G 3.8594 8.4507 109.2209 44.6359 0.0000 173.4744 109 D 4.5002 8.5521 117.0439 57.0917 40.8328 177.1834 110 H 5.0940 8.0646 114.1948 55.3824 29.0694 174.4871 111 S 4.4176 8.0706 115.5163 58.4870 62.7463 174.0105 112 I 3.9864 8.2745 119.5072 60.3629 37.9905 175.5207 113 I 3.7330 7.1122 123.1160 63.0691 37.4150 176.5216 114 G 3.8329 9.3522 114.0898 45.2459 0.0000 172.9059 115 R 5.0174 7.5182 119.3130 54.8219 33.6028 174.5771 116 T 5.0013 8.0078 114.8940 62.2345 71.7491 173.3012 117 L 4.8082 8.7721 128.3181 53.6432 44.1164 175.2735 118 V 5.0043 8.8211 126.0581 60.9106 35.3243 174.1911 119 V 5.0675 8.4573 126.5225 60.4508 33.5374 175.0579 120 H 5.1949 9.2736 123.0073 54.5650 29.8588 175.1784 121 E 4.2044 9.1829 121.7690 58.9684 30.1439 176.2552 122 K 4.8308 8.6585 117.3010 53.8737 36.4167 175.5393 123 A 4.5419 8.4146 121.8398 52.3649 19.6894 176.1336 124 D 5.2004 9.8211 122.4192 52.9216 41.9866 176.2859 125 D 4.5197 9.3941 124.9153 53.4694 39.6721 176.8950 126 L 3.6861 9.8274 119.2124 55.9247 39.7249 175.9928 127 G 4.0770 9.4187 105.9989 45.5463 0.0000 174.5757 128 K 4.5886 7.6821 117.9706 55.9759 32.4902 178.0574 129 G 3.7974 7.8642 110.9440 46.5300 0.0000 175.8579 130 G 3.9041 9.2729 107.0307 45.6694 0.0000 172.5458 131 N 5.0483 7.5063 115.5888 49.8387 42.2498 174.3381 132 E 4.0319 8.6177 120.2359 59.3724 29.7198 177.9173 133 E 3.8819 8.2243 118.8693 59.6079 29.3009 178.5200 134 S 4.2267 9.5250 114.3450 61.5219 62.3978 175.5302 135 T 4.2491 7.8607 110.1536 62.5556 68.5300 175.4700 136 K 4.2668 7.6809 119.6112 57.9135 34.0944 176.7637 137 T 4.0723 8.2148 106.6562 60.2605 70.3287 175.4518 138 G 3.9672 7.9347 110.4997 45.2671 0.0000 173.3932 139 N 4.3271 7.8389 114.7025 54.0246 36.7708 175.8056 140 A 4.2097 6.9593 119.4156 52.1632 19.2612 179.8966 141 G 3.5921 7.3472 104.5970 44.4592 0.0000 172.9821 142 S 4.4272 8.3899 114.6646 58.6701 64.8601 173.7161 143 R 4.5100 8.2820 118.9550 54.6274 30.0705 176.5404 144 L 4.2693 8.5968 125.3394 57.5328 42.8360 177.3350 145 A 4.9951 7.7700 117.9529 51.3400 22.8986 173.8323 146 C 5.5448 8.4080 113.1039 55.8255 44.7957 172.8800 147 G 4.5306 8.0466 103.4062 45.9467 0.0000 172.8227 148 V 4.2942 8.3301 123.0391 62.4468 32.7867 175.8484 149 I 4.0540 8.8858 129.4706 60.9950 37.4884 175.3046 150 G 4.3217 8.8833 115.5234 44.2446 0.0000 171.9428 151 I 4.2501 8.2844 122.1805 61.1804 37.5880 175.4482 152 A 4.8250 8.5314 128.3916 49.5732 22.0521 176.2279 153 Q 4.0724 8.5339 118.8539 56.4589 29.1802 176.1458 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 4.35 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 2 T 8.30 4.44 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 1.27 0.00 0.00 3 K 8.37 5.32 0.00 1.87 1.73 0.00 1.89 0.00 0.00 1.94 0.00 0.00 3.27 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.49 7.81 4 A 8.99 5.38 1.11 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 0.00 0.00 5 V 8.88 5.11 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 0.84 0.00 0.00 0.95 0.00 0.00 6 A 9.07 4.97 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.43 4.46 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 0.98 0.00 0.00 0.92 0.00 0.00 8 L 9.00 4.78 0.00 1.70 1.59 1.06 0.49 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 9 K 8.94 4.83 0.00 1.67 1.63 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.39 7.81 10 G 7.95 4.45 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.78 4.50 0.00 2.68 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 12 G 7.58 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 4.47 0.00 2.19 2.17 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 14 V 7.55 4.22 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 0.80 0.00 0.00 0.93 0.00 0.00 15 Q 7.86 5.20 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.42 0.00 0.00 0.00 0.00 0.00 2.41 2.14 0.00 16 G 7.95 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 0.00 0.00 0.00 0.00 17 I 8.16 5.12 1.82 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 1.21 1.21 0.84 0.00 0.00 18 I 8.77 4.60 1.90 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 1.23 0.53 0.00 0.00 19 N 8.30 4.99 0.00 1.44 1.56 0.00 0.00 6.37 8.17 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 20 F 9.05 5.27 0.00 3.00 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 9.17 5.25 0.00 2.46 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 2.33 2.40 0.00 22 Q 9.44 4.90 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.73 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 23 K 9.09 4.14 0.00 1.78 1.85 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.48 7.81 24 E 7.64 4.78 0.00 2.05 1.80 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 2.29 2.26 0.00 25 S 8.27 4.02 0.00 3.99 4.01 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 0.00 0.00 0.00 26 N 8.03 4.82 0.00 2.84 2.92 0.00 0.00 5.98 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 8.24 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 28 P 0.00 4.68 0.00 2.13 2.10 0.00 3.76 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 9.20 4.67 2.23 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 1.19 0.00 0.00 1.07 0.00 0.00 30 K 9.41 5.01 0.00 1.90 1.87 0.00 1.42 0.00 0.00 1.18 0.00 0.00 2.13 0.00 0.00 2.44 0.00 0.00 0.00 0.00 1.70 1.41 7.81 31 V 9.11 4.79 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 0.64 0.00 0.00 0.97 0.00 0.00 32 W 8.20 5.43 0.00 3.54 3.19 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 0.00 33 G 7.69 3.69 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 0.00 0.00 0.00 34 S 7.59 5.13 0.00 3.85 3.63 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 35 I 8.65 5.17 1.81 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 1.28 0.42 0.95 0.00 0.00 36 K 9.09 4.87 0.00 1.73 1.87 0.00 1.35 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.34 7.81 37 G 8.86 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 38 L 7.62 4.45 0.00 1.79 1.43 0.82 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.18 4.42 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 1.24 0.00 0.00 40 E 8.62 4.07 0.00 2.18 2.21 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 2.37 2.33 0.00 41 G 8.31 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 0.00 0.00 0.00 42 L 8.17 4.81 0.00 1.52 1.59 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.05 5.03 0.00 3.04 3.31 0.00 5.64 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 9.25 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 0.00 0.00 0.00 0.00 45 F 8.88 5.48 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 8.90 5.18 0.00 3.09 3.18 0.00 5.84 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.53 4.60 2.15 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 0.99 0.00 0.00 0.91 0.00 0.00 48 H 9.57 5.09 0.00 3.03 3.41 0.00 5.71 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 49 E 8.97 3.57 0.00 1.60 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 1.47 1.98 0.00 50 F 8.04 4.93 0.00 3.24 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 51 G 8.32 4.47 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 0.00 0.00 0.00 52 D 7.90 4.79 0.00 2.61 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 53 N 8.63 5.12 0.00 2.68 2.73 0.00 0.00 7.23 7.70 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 54 T 8.88 3.93 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 55 A 8.23 4.56 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 7.70 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 57 C 8.50 4.44 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 7.43 3.83 4.40 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 1.24 0.00 0.00 59 S 7.73 4.30 0.00 4.13 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 60 A 7.38 4.83 1.41 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 61 G 8.19 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 0.00 0.00 0.00 62 P 0.00 4.65 0.00 2.01 2.17 0.00 3.61 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 1.92 1.96 0.00 63 H 8.33 4.40 0.00 2.93 3.27 0.00 5.74 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 64 F 9.21 4.19 0.00 2.94 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 8.24 5.00 0.00 2.52 2.42 0.00 0.00 6.90 7.71 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 66 P 0.00 4.24 0.00 2.04 1.90 0.00 2.97 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 1.40 0.90 0.00 67 L 7.60 4.32 0.00 1.55 1.67 0.89 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.40 3.58 0.00 3.97 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 69 R 8.23 4.63 0.00 1.88 1.97 0.00 3.12 0.00 0.00 3.36 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.69 0.00 70 K 8.94 4.42 0.00 1.64 1.72 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.52 7.81 71 H 8.82 4.25 0.00 3.17 3.26 0.00 5.99 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 7.41 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.46 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 74 P 0.00 4.27 0.00 2.22 2.41 0.00 3.78 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 2.02 2.05 0.00 75 K 7.88 4.23 0.00 1.77 1.90 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.47 7.81 76 D 7.88 4.59 0.00 2.78 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 8.84 3.88 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 2.35 0.00 78 E 7.95 4.18 0.00 1.93 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 2.27 2.32 0.00 79 R 7.55 5.15 0.00 1.98 1.77 0.00 2.72 0.00 0.00 3.86 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.59 0.00 80 H 9.17 4.65 0.00 3.50 3.39 0.00 5.65 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.24 3.47 1.48 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 0.73 0.00 0.00 0.47 0.00 0.00 82 G 8.12 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 0.00 0.00 0.00 83 D 8.01 4.86 0.00 2.79 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 84 L 8.30 4.77 0.00 1.93 1.91 1.01 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 85 G 7.98 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 86 N 8.73 5.70 0.00 2.58 2.70 0.00 0.00 6.58 7.68 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 87 V 8.42 4.42 1.82 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 -0.03 0.00 0.00 0.82 0.00 0.00 88 T 8.22 5.09 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 1.20 0.00 0.00 89 A 8.87 4.80 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 90 D 9.10 4.94 0.00 2.82 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 4.37 0.00 1.73 1.91 0.00 1.58 0.00 0.00 1.18 0.00 0.00 2.98 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.43 1.46 7.81 92 D 8.31 4.66 0.00 2.82 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 93 G 8.70 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.11 4.83 2.34 0.00 0.00 0.00 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 95 A 9.03 5.22 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 8.69 4.78 0.00 2.69 2.58 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 97 V 8.68 4.08 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 0.62 0.00 0.00 0.61 0.00 0.00 98 S 8.45 4.96 0.00 3.89 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 9.60 4.83 1.96 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.58 1.00 0.00 0.00 100 E 8.79 5.12 0.00 1.93 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 2.20 2.37 0.00 101 D 9.22 5.04 0.00 2.81 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 8.94 4.77 0.00 4.02 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 0.00 103 V 8.45 3.95 2.26 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 0.80 0.00 0.00 0.95 0.00 0.00 104 I 7.77 4.18 1.97 0.00 0.00 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 1.59 0.83 1.07 0.00 0.00 105 S 8.22 4.65 0.00 3.89 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 0.00 106 L 8.72 4.63 0.00 1.89 1.63 1.05 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.90 4.42 0.00 3.91 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 0.00 108 G 8.45 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 0.00 0.00 0.00 109 D 8.55 4.50 0.00 2.71 2.85 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 0.00 0.00 0.00 110 H 8.06 5.09 0.00 3.14 3.33 0.00 5.72 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 S 8.07 4.42 0.00 3.89 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 0.00 112 I 8.27 3.99 1.67 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.34 0.98 0.00 0.00 113 I 7.11 3.73 1.79 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.82 0.84 0.00 0.00 114 G 9.35 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 0.00 0.00 0.00 115 R 7.52 5.02 0.00 1.65 1.90 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 1.37 1.24 0.00 116 T 8.01 5.00 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 0.00 117 L 8.77 4.81 0.00 1.73 1.50 0.35 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.82 5.00 1.92 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 0.72 0.00 0.00 0.68 0.00 0.00 119 V 8.46 5.07 2.30 0.00 0.00 0.00 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 1.00 0.00 0.00 120 H 9.27 5.19 0.00 3.20 3.61 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 9.18 4.20 0.00 2.03 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 0.00 2.37 2.35 0.00 122 K 8.66 4.83 0.00 1.80 1.68 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.38 7.81 123 A 8.41 4.54 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 0.00 124 D 9.82 5.20 0.00 2.75 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 9.39 4.52 0.00 2.89 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 0.00 126 L 9.83 3.69 0.00 1.87 1.76 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 127 G 9.42 4.08 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 0.00 0.00 0.00 128 K 7.68 4.59 0.00 1.87 1.80 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.39 7.81 129 G 7.86 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 0.00 130 G 9.27 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 0.00 0.00 0.00 131 N 7.51 5.05 0.00 2.80 2.76 0.00 0.00 6.13 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 0.00 132 E 8.62 4.03 0.00 2.05 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 0.00 2.37 2.36 0.00 133 E 8.22 3.88 0.00 2.11 2.17 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 2.47 2.44 0.00 134 S 9.52 4.23 0.00 3.95 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 0.00 135 T 7.86 4.25 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 1.26 0.00 0.00 136 K 7.68 4.27 0.00 1.83 1.80 0.00 1.66 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.32 1.59 7.81 137 T 8.21 4.07 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 1.15 0.00 0.00 138 G 7.93 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 0.00 0.00 0.00 139 N 7.84 4.33 0.00 2.87 2.89 0.00 0.00 6.92 8.86 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 0.00 140 A 6.96 4.21 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.35 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 S 8.39 4.43 0.00 3.97 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 0.00 143 R 8.28 4.51 0.00 1.67 1.84 0.00 3.22 0.00 0.00 3.17 7.12 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 8.60 4.27 0.00 1.70 1.71 0.98 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.77 5.00 1.19 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 0.00 0.00 0.00 146 C 8.41 5.54 0.00 2.99 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 0.00 147 G 8.05 4.53 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 0.00 0.00 0.00 148 V 8.33 4.29 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 0.82 0.00 0.00 0.96 0.00 0.00 149 I 8.89 4.05 1.77 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.39 0.28 0.00 0.00 150 G 8.88 4.32 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 8.28 4.25 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 0.54 0.91 0.00 0.00 152 A 8.53 4.82 1.23 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 0.00 0.00 153 Q 8.53 4.07 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00