NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 4.4360 8.3393 109.7407 45.6435 0.0000 172.4428 1 K 4.4488 8.2436 121.8148 54.2381 36.1047 170.0279 2 V 4.9000 8.8983 121.2214 61.2820 33.5950 176.2975 3 F 4.6593 9.1499 126.5130 56.9583 40.2216 175.1042 4 E 4.5223 8.7007 120.4511 54.9253 31.0018 176.9709 5 R 3.3336 8.2741 121.7282 60.5244 29.9921 179.3197 6 C 4.4466 8.0410 115.2256 59.1751 39.0270 175.6165 7 E 3.8857 7.9665 121.2703 59.1806 29.3141 178.3257 8 L 3.9450 8.4287 120.6140 57.8519 42.0954 178.6398 9 A 4.0804 8.0192 120.8906 55.1578 18.2123 179.8927 10 R 3.8888 7.8500 116.4583 59.6346 30.1411 179.4431 11 T 3.8809 7.6276 114.7297 66.6857 68.4303 176.8472 12 L 3.8738 8.3027 121.3128 57.4084 41.5089 179.4463 13 K 3.8882 8.1801 119.6502 59.6249 31.9797 178.5834 14 R 3.9012 7.8848 117.5831 59.3526 29.9298 177.3598 15 L 4.4450 7.5355 115.9283 53.8735 41.8533 176.6519 16 G 3.8729 8.0730 106.7542 47.1942 0.0000 175.2808 17 M 3.9907 8.2251 120.6392 56.1663 32.4705 175.9923 18 D 4.7017 7.9897 117.8951 56.0124 40.3912 175.3628 19 G 3.9262 9.3178 115.2377 45.4756 0.0000 171.2394 20 Y 4.0693 8.1239 122.1848 58.2996 38.9434 175.9173 21 R 3.5486 9.2366 125.3707 56.9847 27.8801 177.2626 22 G 4.0014 8.2615 107.4327 45.5048 0.0000 174.9542 23 I 3.5589 7.4827 121.9192 61.0111 37.5672 175.8382 24 S 4.7606 8.2439 119.5298 57.1717 64.4663 174.5480 25 L 4.1400 8.8535 123.6004 58.9621 41.6080 179.5926 26 A 4.1400 8.1046 119.8294 55.1716 18.4054 179.0349 27 N 4.5246 8.4236 115.0048 55.7536 38.7073 177.8272 28 W 4.3923 8.0145 120.3007 60.0528 29.0193 178.3046 29 M 4.3099 8.3618 118.0794 58.4463 31.7933 177.7183 30 C 3.3795 8.1643 118.8235 58.9879 43.0693 175.1760 31 L 4.0380 8.1664 121.7579 58.3099 41.9620 178.7133 32 A 4.2590 8.7674 119.9104 53.6512 18.1738 178.6184 33 K 3.3312 7.4522 117.1559 58.0476 32.6924 177.9893 34 W 4.2165 7.7666 114.7266 57.7505 28.8549 176.4430 35 E 4.7406 7.9230 118.3605 56.9846 31.0685 176.9935 36 S 4.4496 7.8173 108.1763 57.5235 66.7324 174.7258 37 G 3.1184 8.3617 109.6703 46.8338 0.0000 173.9314 38 Y 3.5913 7.3380 113.6885 58.1513 36.4027 169.0322 39 N 4.8591 7.9602 120.4687 52.7868 38.8207 175.9563 40 T 3.9353 8.6501 117.9651 64.3423 69.0160 175.9792 41 R 4.2722 8.2808 116.2165 55.8300 30.2736 176.2984 42 A 4.1808 7.6190 121.6363 53.4192 19.3920 176.7517 43 T 4.9771 8.2127 113.9785 60.7573 71.1241 172.6574 44 N 4.9323 8.7019 125.4360 52.4090 42.6683 172.4585 45 Y 4.8880 8.6457 127.2280 56.2574 41.0007 173.8173 46 N 5.2132 8.0683 123.5108 50.1921 38.3202 174.7325 47 A 3.9383 8.0911 125.5936 54.8008 19.0134 179.7887 48 G 3.6984 7.9728 104.2510 47.8891 0.0000 174.0013 49 D 4.6991 7.4751 114.9732 51.9251 40.3569 175.9957 50 R 4.3858 8.5223 117.2163 57.0105 28.2749 176.1108 51 S 4.7619 7.5617 114.0654 57.9657 65.6154 172.7570 52 T 5.0787 9.1288 115.2168 62.4045 73.3249 173.0778 53 D 5.1904 9.2346 126.3155 53.7596 42.5543 175.2498 54 Y 5.0546 9.0859 120.8111 57.0369 41.9518 177.6337 55 G 4.9064 8.6861 110.6878 44.8556 0.0000 173.7490 56 I 3.4172 8.2594 116.6575 62.7950 37.6002 176.8036 57 F 4.6638 7.9000 115.1369 56.3129 39.5224 176.0275 58 Q 3.4177 8.1274 117.9283 57.1678 26.3032 173.7676 59 I 4.2297 8.5203 120.2404 61.0338 39.0090 176.4593 60 N 5.2391 9.1840 126.7613 53.5808 39.5501 175.8830 61 S 4.7064 8.8047 120.6573 60.7712 63.5090 175.5951 62 R 3.7880 9.1528 122.4184 58.6776 30.3565 177.8166 63 Y 4.6943 7.3992 113.3871 57.0924 40.3961 176.7519 64 W 4.6635 8.0345 119.7744 57.8887 30.2487 173.5547 65 C 5.5591 7.9427 111.0264 52.4898 39.5473 172.1294 66 N 4.8267 8.8255 120.1220 52.5586 38.9460 174.9367 67 D 4.5915 8.7560 124.1733 52.6054 39.9958 176.8177 68 G 3.9668 9.6362 107.5571 46.3154 0.0000 175.1153 69 K 4.5631 8.2518 113.4247 57.2261 34.6213 175.5580 70 T 4.5236 7.7003 116.3902 61.4975 69.8552 172.8690 71 P 4.2916 0.0000 0.0000 63.7785 31.9096 176.2452 72 G 3.9741 8.7695 109.8115 46.1874 0.0000 173.1252 73 A 4.2615 8.0149 120.2706 51.6177 19.0536 178.0302 74 V 4.1086 8.6129 123.1422 61.1187 33.2579 175.9044 75 N 4.5679 8.3144 125.9009 51.5055 37.2622 173.8231 76 A 3.9969 8.7442 123.6790 55.8275 19.3468 178.4992 77 C 4.3915 8.8731 114.4676 57.6650 41.0578 173.5023 78 H 4.1139 7.9324 119.1987 56.2645 28.4697 173.4928 79 L 4.6233 7.2841 116.6755 53.9745 43.7515 175.2540 80 S 4.6222 8.3544 114.4910 58.3169 63.1655 175.9850 81 C 4.1668 8.4988 124.3627 59.3425 38.6876 176.5535 82 S 3.9176 7.5912 116.3267 61.3194 62.2440 176.3124 83 A 4.1025 7.4982 123.3585 54.3510 18.3169 177.7980 84 L 4.5171 7.6703 116.8979 54.9424 41.9926 177.1857 85 L 5.2416 7.8402 116.8221 54.7261 42.2495 175.4987 86 Q 4.8006 7.6902 115.6285 53.7816 32.8449 176.3092 87 D 4.4258 8.5422 118.7087 57.2150 41.0698 176.3661 88 N 4.7809 8.0485 118.2303 53.0503 39.0705 174.8163 89 I 4.1501 8.4716 118.9820 60.9406 38.2766 176.8912 90 A 3.9347 8.4960 124.8177 56.0848 17.6744 179.7006 91 D 4.3087 8.1104 116.2310 57.4543 40.9250 178.7946 92 A 4.0942 7.8453 120.9085 55.0270 18.4971 179.6543 93 V 3.3013 8.2632 117.1117 65.9888 31.5251 178.1860 94 A 3.9001 7.8189 120.1697 55.2897 18.2167 179.0401 95 C 4.2367 7.9738 114.2594 59.7922 35.8322 176.1057 96 A 4.0906 8.0051 122.5279 55.0672 17.6290 179.7776 97 K 3.7785 7.8084 116.1721 59.4471 32.2504 179.1645 98 R 4.0630 7.9029 118.8901 59.5976 30.0419 178.4849 99 V 2.5944 7.8096 118.2107 65.6351 31.0800 177.4905 100 V 4.1780 7.3754 108.9810 62.0001 31.8912 177.7860 101 R 4.1818 8.0753 118.2216 57.3163 30.2995 176.3838 102 D 4.7664 7.2686 117.9390 52.5971 42.0119 175.4316 103 P 4.2594 0.0000 0.0000 66.1341 31.5689 178.4619 104 Q 4.0397 8.2278 116.5051 56.6704 30.0319 177.2750 105 G 3.6752 7.8091 107.7245 45.9239 0.0000 175.3884 106 I 3.5351 7.9315 118.6665 63.9078 37.8903 177.8326 107 R 4.4459 7.3787 115.9691 57.0036 29.7979 177.2778 108 A 4.0544 7.7843 121.9439 54.1198 18.9320 178.0766 109 W 4.6136 8.2055 117.2963 55.9406 29.0448 177.2240 110 V 3.7299 8.9337 123.9864 66.2973 30.8758 177.7082 111 A 4.1956 8.2660 119.8048 54.5038 18.2596 179.3859 112 W 3.9858 8.4045 127.1145 60.8379 30.6950 178.5673 113 R 4.5169 8.2999 117.2822 58.2618 29.5081 177.8787 114 N 4.4733 7.5174 113.8732 54.6134 39.2667 176.6470 115 R 3.9546 7.5305 116.7872 55.9053 31.3017 176.1547 116 C 4.4587 7.1169 114.7506 57.9342 37.7064 174.0490 117 Q 3.0482 6.6087 120.6381 57.2804 28.7343 176.1110 118 N 4.1120 8.6535 119.9091 54.1230 35.9680 173.9022 119 R 4.6248 7.3236 114.3857 54.5731 34.5271 174.0606 120 D 4.7173 8.4476 118.7564 53.7717 42.2696 176.3079 121 V 4.7330 8.2385 117.4987 61.1815 32.9590 177.7342 122 R 4.1953 8.1122 121.9865 58.6995 29.7078 178.6142 123 Q 3.9210 8.0827 117.6479 59.8359 28.2523 178.2285 124 Y 4.3225 6.8813 116.3758 59.8331 38.2221 177.8062 125 V 4.4005 7.7808 110.3552 61.0077 33.8389 175.8553 126 Q 4.1722 7.7946 119.2841 57.5382 28.8864 177.3454 127 G 4.0474 8.9073 109.8297 45.8867 0.0000 175.1266 128 C 4.3483 8.0221 116.1930 57.5911 40.5033 174.4083 129 G 3.8846 8.2601 106.4843 46.4667 0.0000 173.8864 130 V 4.0006 7.8671 118.1002 61.0816 31.9602 175.8328 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 0 G 8.34 4.44 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 1 K 8.24 4.45 0.00 1.71 1.85 0.00 0.97 0.00 0.00 1.38 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.20 1.23 7.81 2 V 8.90 4.90 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 0.97 0.00 0.00 0.95 0.00 0.00 3 F 9.15 4.66 0.00 2.85 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 4 E 8.70 4.52 0.00 2.02 1.83 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 2.26 2.33 0.00 5 R 8.27 3.33 0.00 1.85 1.90 0.00 3.39 0.00 0.00 3.49 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.81 0.00 6 C 8.04 4.45 0.00 3.00 3.12 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 7 E 7.97 3.89 0.00 2.00 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 2.38 2.31 0.00 8 L 8.43 3.94 0.00 1.62 1.60 0.04 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.02 4.08 1.35 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 10 R 7.85 3.89 0.00 2.13 2.01 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 11 T 7.63 3.88 4.33 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 nan 0.00 0.00 12 L 8.30 3.87 0.00 1.60 1.60 1.02 0.76 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 8.18 3.89 0.00 2.04 2.00 0.00 1.61 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.51 7.81 14 R 7.88 3.90 0.00 2.07 2.20 0.00 3.31 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 15 L 7.54 4.44 0.00 1.66 1.53 0.85 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.07 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 17 M 8.23 3.99 0.00 1.38 2.00 0.00 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.19 0.00 18 D 7.99 4.70 0.00 2.71 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 19 G 9.32 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 20 Y 8.12 4.07 0.00 3.32 3.21 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 21 R 9.24 3.55 0.00 1.96 1.88 0.00 3.35 0.00 0.00 3.06 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.47 0.00 22 G 8.26 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 23 I 7.48 3.56 0.86 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.15 -0.12 0.00 0.00 24 S 8.24 4.76 0.00 4.04 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 25 L 8.85 4.14 0.00 2.25 1.84 1.06 1.24 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 26 A 8.10 4.14 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 27 N 8.42 4.52 0.00 2.72 2.80 0.00 0.00 6.96 7.30 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 28 W 8.01 4.39 0.00 3.54 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 29 M 8.36 4.31 0.00 2.12 2.39 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 3.06 0.00 30 C 8.16 3.38 0.00 2.56 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.17 4.04 0.00 1.98 1.99 0.46 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.77 4.26 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 33 K 7.45 3.33 0.00 1.78 1.75 0.00 1.65 0.00 0.00 1.77 0.00 0.00 2.61 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.65 0.78 7.81 34 W 7.77 4.22 0.00 3.48 3.29 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 35 E 7.92 4.74 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.18 0.00 36 S 7.82 4.45 0.00 4.06 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 37 G 8.36 3.12 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 0.00 38 Y 7.34 3.59 0.00 3.40 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 39 N 7.96 4.86 0.00 2.72 2.84 0.00 0.00 6.96 6.68 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 40 T 8.65 3.94 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 1.49 0.00 0.00 41 R 8.28 4.27 0.00 1.98 2.16 0.00 3.10 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.59 0.00 42 A 7.62 4.18 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 43 T 8.21 4.98 4.18 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 1.19 0.00 0.00 44 N 8.70 4.93 0.00 2.89 2.60 0.00 0.00 6.80 7.35 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 45 Y 8.65 4.89 0.00 3.01 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 46 N 8.07 5.21 0.00 2.55 2.55 0.00 0.00 6.75 7.81 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 47 A 8.09 3.94 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 48 G 7.97 3.70 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 0.00 0.00 0.00 49 D 7.48 4.70 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 50 R 8.52 4.39 0.00 2.01 2.25 0.00 3.15 0.00 0.00 3.20 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.55 0.00 51 S 7.56 4.76 0.00 3.82 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 52 T 9.13 5.08 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 0.68 0.00 0.00 53 D 9.23 5.19 0.00 2.62 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 54 Y 9.09 5.05 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 55 G 8.69 4.91 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 56 I 8.26 3.42 1.61 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.13 0.14 0.00 0.00 57 F 7.90 4.66 0.00 3.06 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 58 Q 8.13 3.42 0.00 2.54 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.39 6.84 0.00 0.00 0.00 0.00 0.00 2.41 2.65 0.00 59 I 8.52 4.23 2.08 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.05 1.07 0.00 0.00 60 N 9.18 5.24 0.00 3.09 3.11 0.00 0.00 6.96 7.53 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 61 S 8.80 4.71 0.00 4.09 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 0.00 62 R 9.15 3.79 0.00 1.46 0.86 0.00 3.01 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.09 0.00 63 Y 7.40 4.69 0.00 1.75 2.33 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 64 W 8.03 4.66 0.00 3.71 3.29 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 65 C 7.94 5.56 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 66 N 8.83 4.83 0.00 2.80 2.70 0.00 0.00 7.11 8.03 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 67 D 8.76 4.59 0.00 2.92 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 68 G 9.64 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 69 K 8.25 4.56 0.00 1.83 1.87 0.00 1.72 0.00 0.00 2.02 0.00 0.00 3.33 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.58 7.81 70 T 7.70 4.52 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 1.14 0.00 0.00 71 P 0.00 4.29 0.00 2.02 1.98 0.00 3.98 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 72 G 8.77 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 73 A 8.01 4.26 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 74 V 8.61 4.11 1.99 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 0.68 0.00 0.00 0.90 0.00 0.00 75 N 8.31 4.57 0.00 2.87 2.70 0.00 0.00 7.04 8.15 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 76 A 8.74 4.00 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 77 C 8.87 4.39 0.00 3.12 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 78 H 7.93 4.11 0.00 3.23 3.34 0.00 5.94 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.28 4.62 0.00 1.83 1.68 0.95 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.35 4.62 0.00 3.83 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 81 C 8.50 4.17 0.00 2.13 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 82 S 7.59 3.92 0.00 4.00 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 83 A 7.50 4.10 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.67 4.52 0.00 1.92 1.76 1.03 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.84 5.24 0.00 1.76 1.65 1.12 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 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 5.33 7.08 0.00 0.00 0.00 0.00 0.00 2.25 2.46 0.00 87 D 8.54 4.43 0.00 2.78 2.68 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 88 N 8.05 4.78 0.00 2.70 2.76 0.00 0.00 6.96 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 8.47 4.15 1.77 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.01 0.89 0.00 0.00 90 A 8.50 3.93 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 0.00 0.00 0.00 0.00 0.00 91 D 8.11 4.31 0.00 2.74 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 7.85 4.09 1.37 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 0.00 0.00 93 V 8.26 3.30 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 0.63 0.00 0.00 0.89 0.00 0.00 94 A 7.82 3.90 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 7.97 4.24 0.00 3.03 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 96 A 8.01 4.09 0.63 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 0.00 0.00 97 K 7.81 3.78 0.00 1.57 1.46 0.00 1.25 0.00 0.00 0.61 0.00 0.00 2.36 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.30 0.99 7.81 98 R 7.90 4.06 0.00 2.02 2.08 0.00 3.29 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.82 0.00 99 V 7.81 2.59 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 -0.16 0.00 0.00 -0.36 0.00 0.00 100 V 7.38 4.18 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 1.14 0.00 0.00 1.37 0.00 0.00 101 R 8.08 4.18 0.00 2.10 2.05 0.00 3.25 0.00 0.00 3.31 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 2.04 0.00 102 D 7.27 4.77 0.00 3.08 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 0.00 103 P 0.00 4.26 0.00 2.02 2.12 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 104 Q 8.23 4.04 0.00 2.08 2.12 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 2.44 2.33 0.00 105 G 7.81 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 0.00 0.00 0.00 106 I 7.93 3.54 1.05 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.24 -0.45 0.00 0.00 107 R 7.38 4.45 0.00 1.98 2.10 0.00 3.55 0.00 0.00 3.41 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 108 A 7.78 4.05 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 0.00 109 W 8.21 4.61 0.00 3.47 3.29 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 0.00 110 V 8.93 3.73 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 1.12 0.00 0.00 1.03 0.00 0.00 111 A 8.27 4.20 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.40 3.99 0.00 3.50 3.51 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 0.00 113 R 8.30 4.52 0.00 2.04 2.10 0.00 3.41 0.00 0.00 4.01 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.10 0.00 114 N 7.52 4.47 0.00 2.61 2.70 0.00 0.00 6.86 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 0.00 115 R 7.53 3.95 0.00 0.71 0.66 0.00 2.82 0.00 0.00 2.93 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.72 0.00 116 C 7.12 4.46 0.00 1.70 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 0.00 117 Q 6.61 3.05 0.00 0.93 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 6.22 0.00 0.00 0.00 0.00 0.00 2.11 2.03 0.00 118 N 8.65 4.11 0.00 2.77 2.81 0.00 0.00 6.77 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 7.32 4.62 0.00 1.78 1.73 0.00 3.13 0.00 0.00 3.03 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.62 0.00 120 D 8.45 4.72 0.00 2.61 2.57 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 0.00 121 V 8.24 4.73 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 1.14 0.00 0.00 1.15 0.00 0.00 122 R 8.11 4.20 0.00 1.88 2.02 0.00 3.28 0.00 0.00 3.41 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.94 0.00 123 Q 8.08 3.92 0.00 2.02 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.77 0.00 0.00 0.00 0.00 0.00 1.87 1.81 0.00 124 Y 6.88 4.32 0.00 3.27 3.21 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 0.00 125 V 7.78 4.40 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 0.89 0.00 0.00 1.04 0.00 0.00 126 Q 7.79 4.17 0.00 2.17 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.60 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 127 G 8.91 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 0.00 0.00 0.00 128 C 8.02 4.35 0.00 3.13 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 0.00 129 G 8.26 3.88 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 0.00 0.00 0.00 130 V 7.87 4.00 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 0.75 0.00 0.00 0.96 0.00 0.00