NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1767 8.1727 122.0499 56.3052 34.2146 174.1202 2 V 4.5077 8.1035 125.8809 60.7469 32.2925 174.6534 3 F 4.4122 9.9410 128.8164 57.4806 40.3045 174.8885 4 E 4.3193 8.8755 120.1968 55.6307 31.0215 177.1148 5 R 3.3256 8.9394 121.7008 60.5189 29.9563 179.5976 6 C 4.3203 8.0247 115.2689 59.7484 39.8233 175.5826 7 E 3.8872 8.1686 120.6677 59.2698 29.2681 178.5550 8 L 3.5474 8.0610 120.0965 57.7651 42.0725 178.6611 9 A 3.9348 7.8002 120.7692 55.3785 18.3520 179.8945 10 R 3.9015 8.1286 116.5160 59.4810 30.1386 179.4411 11 T 3.8265 7.8335 115.5197 66.7476 68.5382 176.5778 12 L 3.8508 8.2243 121.1137 57.5764 41.6052 179.5401 13 K 3.8592 8.0443 119.4721 59.6584 31.9590 178.8495 14 R 3.9518 7.7935 117.4410 59.0408 30.0052 177.4498 15 L 4.3739 7.4833 116.2319 54.0415 41.7687 176.7970 16 G 3.8483 7.8448 106.8311 47.0505 0.0000 175.0912 17 M 3.9585 7.7847 120.6885 56.0893 32.4664 175.7908 18 D 4.4264 7.9695 118.0336 56.0843 41.1709 175.7552 19 G 3.9573 9.4580 115.7977 45.3927 0.0000 171.4598 20 Y 4.2200 8.2847 121.9856 58.9385 39.0111 176.4828 21 R 3.5885 8.9267 126.5161 57.2446 27.8874 177.1544 22 G 3.8098 8.1523 103.0743 45.6485 0.0000 173.9207 23 I 4.1390 7.7850 122.2565 58.9690 38.1476 175.8532 24 S 4.7229 8.3394 120.3579 57.7090 63.9646 174.7572 25 L 4.1888 9.4874 124.0949 58.8219 41.6495 179.4672 26 A 4.1416 8.2013 119.8015 55.1891 18.1747 179.3236 27 N 4.4121 8.2393 115.2092 56.3574 38.5932 177.6177 28 W 4.2478 8.0358 119.8422 59.9681 29.1040 178.2288 29 M 4.1379 8.4687 118.7265 58.6504 31.4765 177.7942 30 C 3.0998 8.0816 118.5507 59.2890 42.6111 175.3673 31 L 3.9563 8.2272 121.6019 58.3065 41.7491 178.8078 32 A 4.1411 8.4132 120.8885 54.8952 18.2645 179.4595 33 K 2.8343 8.2234 118.2714 59.3425 32.0497 179.1017 34 W 4.2367 7.7169 117.2748 59.0710 29.0837 178.4209 35 E 4.3396 8.4730 118.9237 58.5962 29.2107 177.7229 36 S 4.5289 7.6288 108.2268 56.7635 64.3472 173.8977 37 G 3.4408 8.1790 108.5640 47.0236 0.0000 173.4078 38 Y 3.6514 7.5681 113.4286 58.6762 35.0923 168.8161 39 N 5.2747 7.7423 118.7438 52.0756 40.1105 175.5842 40 T 4.2078 8.9500 117.2355 63.6241 69.2644 175.9727 41 R 4.4262 8.0156 117.0784 55.7994 30.2873 176.4031 42 A 4.3105 7.5638 121.4058 52.9621 19.3761 176.8318 43 T 4.9935 8.3173 110.5476 60.0783 72.4667 173.0228 44 N 4.8767 8.7775 122.0960 52.3549 42.2775 172.5412 45 Y 4.6476 8.7464 127.7346 57.2344 41.0173 173.9073 46 N 4.7866 8.1056 124.0351 50.6270 39.1529 173.4202 47 P 3.9955 0.0000 0.0000 65.2346 31.9399 178.3574 48 G 3.8699 8.1543 106.3075 48.1401 0.0000 173.6044 49 D 4.7058 7.4190 114.7074 51.9207 40.2306 175.7741 50 R 4.0410 8.2087 116.0824 56.9708 28.1482 175.9287 51 S 4.8790 7.6389 113.0010 57.3544 66.0836 172.8140 52 T 5.0866 8.7407 115.5103 61.9420 72.7777 172.9100 53 D 5.4215 8.9972 125.1830 53.2847 43.1066 175.1509 54 Y 5.0440 9.0642 120.6742 57.4816 41.9130 177.3453 55 G 4.4945 9.0917 111.5195 46.2183 0.0000 173.5746 56 I 3.6655 8.3460 117.4813 63.4248 37.9796 177.5199 57 F 4.7209 8.0247 115.7808 56.3517 39.8091 175.3075 58 Q 3.5327 7.8898 119.1863 57.1212 26.5767 174.2560 59 I 4.3654 8.1386 118.9508 61.2059 39.1434 176.9024 60 N 5.3299 9.2168 126.1343 53.3471 39.7457 175.7937 61 S 4.5508 9.1756 120.8180 60.8863 63.3719 175.4907 62 R 3.7244 8.8982 122.4183 58.6356 30.3580 177.7854 63 Y 4.3340 7.5638 114.4163 57.5111 40.6283 176.8453 64 W 5.0521 8.0811 119.0110 57.6249 31.1713 174.0271 65 C 5.6182 8.1413 111.5463 53.6645 45.1269 172.9076 66 N 5.0312 9.1979 119.3540 52.2491 40.1651 174.8764 67 D 4.8283 8.6698 123.2736 52.1320 40.6611 178.1526 68 G 4.0957 8.4416 109.9945 46.2360 0.0000 174.8205 69 K 4.3780 8.0611 116.2160 56.7718 33.1456 176.1294 70 T 4.4624 7.7028 117.4328 61.5404 68.9478 172.7678 71 P 4.3149 0.0000 0.0000 63.6908 32.1025 176.4423 72 G 4.0297 8.6436 107.9211 46.4482 0.0000 173.3636 73 A 4.3457 7.1371 121.6244 51.0257 19.6001 177.6092 74 V 4.4672 8.1642 112.8006 59.6779 35.4819 176.1489 75 N 4.9355 8.0494 115.9230 51.6767 38.4864 174.1891 76 A 3.9342 8.7607 124.3887 55.3448 19.0617 178.5760 77 C 4.4576 8.5446 110.9369 57.5134 40.9716 173.0110 78 H 4.1190 8.2387 116.5841 56.5779 26.3051 174.0178 79 L 4.8142 8.4940 117.8322 52.9199 46.5174 176.5079 80 S 4.6472 8.3589 115.0049 58.0287 63.2452 176.0076 81 C 4.0557 8.8064 124.5262 59.8303 40.4596 176.3000 82 S 3.8802 7.9070 114.7831 61.4425 61.5916 176.0592 83 A 4.0886 7.7596 122.3998 54.5544 18.1884 178.5145 84 L 4.5027 7.9129 116.1077 54.9199 41.6466 177.5870 85 L 5.0665 7.5435 117.7267 54.5140 42.3549 176.7247 86 Q 4.3526 7.7769 117.7783 55.4332 29.4927 176.0030 87 D 4.4309 8.5385 119.8382 57.1114 41.1471 176.8754 88 N 4.5972 8.0401 118.1238 53.2118 39.5031 174.6565 89 I 4.2926 8.4319 118.5726 61.0036 38.0210 177.0627 90 A 3.9541 8.3977 125.1095 56.0042 18.1649 180.2072 91 D 4.2713 8.0754 116.4697 57.3703 40.9358 178.6290 92 A 4.0986 7.9941 120.8689 55.1642 18.3576 179.7187 93 V 3.3777 8.3161 116.9237 66.0929 31.7287 178.1054 94 A 3.8021 8.0603 120.5798 55.1812 18.0479 178.8818 95 C 4.1868 8.2958 116.8265 59.7252 39.2277 175.5231 96 A 3.8793 8.2362 122.7999 55.1416 17.5738 179.7694 97 K 3.7388 7.7193 116.3189 59.3892 32.2983 179.1993 98 R 4.0603 7.7090 118.7717 59.3795 30.0204 178.5560 99 V 2.3171 7.5146 118.1531 65.7469 30.8584 177.8846 100 V 3.9278 7.7197 109.7617 62.6048 31.3433 177.9389 101 R 4.2088 7.7429 117.7032 57.1057 30.5397 176.4564 102 D 4.7311 7.3409 118.9088 52.7844 41.8582 175.3858 103 P 4.2531 0.0000 0.0000 66.0873 31.6563 178.3398 104 Q 4.0119 8.1747 116.3945 56.6562 30.0325 177.4484 105 G 3.7071 8.0149 107.4290 46.9225 0.0000 175.8857 106 I 3.6400 7.7608 119.6454 63.4340 38.0078 178.0164 107 R 4.1875 7.3967 117.7360 57.9563 29.9381 177.5652 108 A 4.0491 7.5784 120.4236 53.9412 18.6450 177.4287 109 W 4.7711 8.0108 117.4009 55.1999 29.9815 177.7814 110 V 3.8197 8.6489 124.5904 64.6860 30.8208 178.1187 111 A 4.0035 8.3029 121.1330 54.6085 18.1228 179.1849 112 W 4.0226 8.3465 127.1929 60.7040 30.5818 178.4510 113 R 3.7344 8.1662 116.3172 59.2947 29.6941 178.3728 114 N 4.3429 8.1390 115.0779 55.7927 38.6895 176.8870 115 R 4.0447 7.7885 116.3701 56.0656 31.3959 176.3043 116 C 4.5620 7.7444 115.2641 57.2901 42.8119 174.3707 117 Q 3.2230 6.6204 119.7698 56.9684 28.7967 175.1408 118 N 4.1877 8.5966 120.7499 54.3616 36.2326 173.9453 119 R 4.5031 7.2647 115.1803 54.0352 32.9519 175.9818 120 D 4.5294 8.4270 119.1352 54.2392 40.3355 175.9541 121 V 4.5167 8.1966 118.9689 61.3751 32.3611 178.4379 122 R 4.0504 8.1676 121.7927 59.2710 29.2223 178.4361 123 Q 3.9108 8.1932 117.0348 59.9978 27.9313 178.9032 124 Y 4.2880 7.6655 116.5589 59.7012 38.2970 177.2331 125 V 4.4007 7.8043 111.1815 60.4757 32.9351 175.4457 126 Q 4.1587 7.6979 118.9052 57.4811 28.6023 176.7729 127 G 3.9106 8.8094 108.9276 46.5718 0.0000 174.7094 128 C 4.4313 8.1163 115.6037 56.5781 40.5732 174.2906 129 G 3.8607 8.1504 107.2549 46.5610 0.0000 174.1311 130 V 3.9948 7.8634 118.0918 61.0726 31.9585 175.8609 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 K 8.17 4.18 0.00 1.72 1.82 0.00 1.30 0.00 0.00 1.26 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.98 1.04 7.81 2 V 8.10 4.51 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 0.90 0.00 0.00 0.94 0.00 0.00 3 F 9.94 4.41 0.00 2.88 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 4 E 8.88 4.32 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 2.41 2.39 0.00 5 R 8.94 3.33 0.00 1.92 1.92 0.00 3.43 0.00 0.00 3.46 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 6 C 8.02 4.32 0.00 3.00 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 7 E 8.17 3.89 0.00 2.07 2.27 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 2.58 2.42 0.00 8 L 8.06 3.55 0.00 1.32 1.34 -0.17 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.80 3.93 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 10 R 8.13 3.90 0.00 1.87 1.99 0.00 3.14 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 11 T 7.83 3.83 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 12 L 8.22 3.85 0.00 1.70 1.61 0.95 0.48 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 13 K 8.04 3.86 0.00 1.93 1.91 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.79 3.95 0.00 2.06 2.00 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 15 L 7.48 4.37 0.00 1.69 1.55 0.85 0.88 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 16 G 7.84 3.85 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 0.00 0.00 0.00 17 M 7.78 3.96 0.00 1.28 1.95 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.24 0.00 18 D 7.97 4.43 0.00 2.68 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 19 G 9.46 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 20 Y 8.28 4.22 0.00 3.34 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 21 R 8.93 3.59 0.00 1.88 1.84 0.00 3.26 0.00 0.00 3.03 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.45 0.00 22 G 8.15 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 0.00 0.00 0.00 23 I 7.78 4.14 1.78 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.65 -0.23 0.00 0.00 24 S 8.34 4.72 0.00 4.07 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 25 L 9.49 4.19 0.00 1.97 1.82 0.99 1.04 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 26 A 8.20 4.14 1.52 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 0.00 0.00 27 N 8.24 4.41 0.00 2.81 2.77 0.00 0.00 6.91 7.33 0.00 0.00 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 W 8.04 4.25 0.00 3.57 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 29 M 8.47 4.14 0.00 2.17 2.38 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.95 0.00 30 C 8.08 3.10 0.00 2.62 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 31 L 8.23 3.96 0.00 1.79 1.87 0.57 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.41 4.14 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.22 2.83 0.00 1.71 1.51 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.30 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.60 1.43 7.81 34 W 7.72 4.24 0.00 3.34 3.25 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 35 E 8.47 4.34 0.00 2.00 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 2.54 2.41 0.00 36 S 7.63 4.53 0.00 4.03 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 37 G 8.18 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.57 3.65 0.00 3.26 3.01 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 39 N 7.74 5.27 0.00 2.84 2.79 0.00 0.00 7.02 7.07 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 40 T 8.95 4.21 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 1.45 0.00 0.00 41 R 8.02 4.43 0.00 2.00 2.10 0.00 3.09 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.58 0.00 42 A 7.56 4.31 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 0.00 0.00 0.00 0.00 0.00 43 T 8.32 4.99 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 1.29 0.00 0.00 44 N 8.78 4.88 0.00 2.84 2.78 0.00 0.00 6.78 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 45 Y 8.75 4.65 0.00 3.01 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 46 N 8.11 4.79 0.00 2.62 2.58 0.00 0.00 6.92 8.04 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 47 P 0.00 4.00 0.00 2.01 2.20 0.00 3.56 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 2.05 2.21 0.00 48 G 8.15 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 49 D 7.42 4.71 0.00 2.70 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 50 R 8.21 4.04 0.00 2.04 2.20 0.00 3.14 0.00 0.00 3.20 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.55 0.00 51 S 7.64 4.88 0.00 3.90 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 52 T 8.74 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 0.59 0.00 0.00 53 D 9.00 5.42 0.00 2.69 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 54 Y 9.06 5.04 0.00 2.96 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 55 G 9.09 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.35 3.67 1.69 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.72 0.12 0.00 0.00 57 F 8.02 4.72 0.00 3.19 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 58 Q 7.89 3.53 0.00 2.52 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.84 0.00 0.00 0.00 0.00 0.00 2.51 2.79 0.00 59 I 8.14 4.37 2.15 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.08 1.13 0.00 0.00 60 N 9.22 5.33 0.00 3.08 3.03 0.00 0.00 6.97 7.67 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 61 S 9.18 4.55 0.00 4.05 4.37 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 62 R 8.90 3.72 0.00 1.53 1.13 0.00 2.70 0.00 0.00 2.94 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.13 0.00 63 Y 7.56 4.33 0.00 1.43 1.66 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 64 W 8.08 5.05 0.00 3.55 3.28 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 65 C 8.14 5.62 0.00 3.05 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 66 N 9.20 5.03 0.00 2.82 2.70 0.00 0.00 7.07 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 67 D 8.67 4.83 0.00 2.99 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 68 G 8.44 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 69 K 8.06 4.38 0.00 1.92 1.95 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.48 7.81 70 T 7.70 4.46 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 1.16 0.00 0.00 71 P 0.00 4.31 0.00 2.20 2.17 0.00 3.84 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 72 G 8.64 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 A 7.14 4.35 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 74 V 8.16 4.47 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 0.66 0.00 0.00 0.88 0.00 0.00 75 N 8.05 4.94 0.00 2.73 2.64 0.00 0.00 6.75 8.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.76 3.93 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 77 C 8.54 4.46 0.00 3.25 3.22 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 78 H 8.24 4.12 0.00 3.31 3.36 0.00 5.63 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.49 4.81 0.00 1.65 1.49 0.96 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.36 4.65 0.00 3.83 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 81 C 8.81 4.06 0.00 2.25 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 82 S 7.91 3.88 0.00 3.88 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 83 A 7.76 4.09 1.40 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 0.00 0.00 84 L 7.91 4.50 0.00 1.90 1.83 1.05 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.54 5.07 0.00 1.68 1.72 1.12 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.78 4.35 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.57 7.09 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 87 D 8.54 4.43 0.00 2.65 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 88 N 8.04 4.60 0.00 2.70 2.74 0.00 0.00 6.93 7.94 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 89 I 8.43 4.29 1.80 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 1.59 0.96 0.99 0.00 0.00 90 A 8.40 3.95 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 0.00 0.00 0.00 0.00 0.00 91 D 8.08 4.27 0.00 2.75 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 92 A 7.99 4.10 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 93 V 8.32 3.38 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 0.81 0.00 0.00 0.95 0.00 0.00 94 A 8.06 3.80 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.30 4.19 0.00 3.13 3.27 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 96 A 8.24 3.88 0.77 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 0.00 0.00 97 K 7.72 3.74 0.00 1.58 1.35 0.00 1.29 0.00 0.00 0.87 0.00 0.00 2.29 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.30 0.93 7.81 98 R 7.71 4.06 0.00 1.99 2.12 0.00 3.27 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.95 0.00 99 V 7.51 2.32 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 -0.27 0.00 0.00 -0.53 0.00 0.00 100 V 7.72 3.93 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 1.14 0.00 0.00 1.43 0.00 0.00 101 R 7.74 4.21 0.00 2.04 2.04 0.00 3.23 0.00 0.00 3.39 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.10 0.00 102 D 7.34 4.73 0.00 3.03 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 0.00 103 P 0.00 4.25 0.00 2.01 2.11 0.00 3.68 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 2.01 2.12 0.00 104 Q 8.17 4.01 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.93 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 8.01 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 0.00 0.00 0.00 106 I 7.76 3.64 1.07 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.20 -0.42 0.00 0.00 107 R 7.40 4.19 0.00 2.05 2.02 0.00 3.21 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.48 0.00 108 A 7.58 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.01 4.77 0.00 3.51 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 0.00 110 V 8.65 3.82 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 0.98 0.00 0.00 111 A 8.30 4.00 1.51 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 0.00 0.00 112 W 8.35 4.02 0.00 3.49 3.48 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 0.00 113 R 8.17 3.73 0.00 2.02 1.99 0.00 3.34 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.00 0.00 114 N 8.14 4.34 0.00 2.53 2.71 0.00 0.00 6.98 7.51 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 0.00 115 R 7.79 4.04 0.00 1.20 0.66 0.00 2.21 0.00 0.00 2.30 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.27 0.00 116 C 7.74 4.56 0.00 1.59 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 0.00 117 Q 6.62 3.22 0.00 0.93 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.89 0.00 0.00 0.00 0.00 0.00 2.17 2.31 0.00 118 N 8.60 4.19 0.00 2.80 2.82 0.00 0.00 6.88 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 0.00 119 R 7.26 4.50 0.00 1.71 1.80 0.00 3.24 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 120 D 8.43 4.53 0.00 2.62 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 0.00 121 V 8.20 4.52 2.35 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 0.93 0.00 0.00 1.05 0.00 0.00 122 R 8.17 4.05 0.00 1.90 2.02 0.00 3.18 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.82 0.00 123 Q 8.19 3.91 0.00 2.01 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.90 0.00 0.00 0.00 0.00 0.00 2.28 1.36 0.00 124 Y 7.67 4.29 0.00 3.13 3.18 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 0.00 0.00 0.00 0.00 125 V 7.80 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 1.00 0.00 0.00 1.06 0.00 0.00 126 Q 7.70 4.16 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.33 0.00 0.00 0.00 0.00 0.00 2.59 2.31 0.00 127 G 8.81 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 0.00 128 C 8.12 4.43 0.00 3.02 3.14 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 0.00 129 G 8.15 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 0.00 130 V 7.86 3.99 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 0.75 0.00 0.00 0.96 0.00 0.00