NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 5.3382 7.7274 117.5701 56.6446 32.6224 173.1958 1 G 3.7085 8.3676 103.3517 45.0588 0.0000 170.3895 2 Y 4.6147 9.1514 121.2077 60.5065 39.6945 177.8003 3 S 4.0080 8.2022 115.5888 61.5397 62.9057 176.3829 4 F 4.1389 8.1861 122.6610 61.2956 38.7461 176.6236 5 E 3.7593 8.2665 118.2013 59.6824 29.2208 179.5858 6 Q 3.7390 8.0872 117.9171 58.6851 28.7007 178.6181 7 A 3.8527 7.8303 121.7705 55.1762 18.3971 179.7942 8 I 3.3081 7.4909 118.6158 64.5604 37.0262 178.7584 9 T 3.6668 7.6224 116.5685 66.5224 68.2485 176.3590 10 Q 4.1540 8.0888 122.8699 58.5349 28.9796 177.9919 11 L 4.0320 7.9625 121.2508 58.4950 42.1137 179.0239 12 F 4.2806 8.8643 117.9785 60.6640 38.7165 177.7603 13 Q 4.0822 8.1911 117.9391 59.0001 28.3593 178.3314 14 Q 4.3112 8.1421 117.0383 57.3385 28.8795 177.2857 15 L 4.6340 7.3246 118.3749 53.3892 42.3841 176.1428 16 S 3.7906 7.6195 113.2690 59.5143 60.8931 171.5759 17 L 4.5370 7.9260 119.9499 52.6169 42.9197 177.1894 18 S 4.2256 8.4075 117.4905 58.4156 63.5285 173.9092 19 I 4.2403 8.2151 124.0760 59.7795 37.1900 174.3233 20 P 4.4857 0.0000 0.0000 62.6331 31.8057 176.6365 21 D 4.5151 8.6821 120.7384 56.7527 41.1011 177.1313 22 T 4.5081 7.6801 114.6525 61.5879 71.3579 173.1547 23 I 4.2118 8.3071 127.7413 59.4473 37.5541 175.5692 24 E 4.3229 8.4883 123.8591 55.1116 30.4520 176.1639 25 P 3.9506 0.0000 0.0000 64.7992 31.4808 176.3902 26 V 4.4717 7.0553 114.9552 61.0469 32.9911 175.1335 27 I 4.2409 9.1431 130.5722 60.6000 38.5849 175.2980 28 G 4.2353 8.7540 114.3119 44.7221 0.0000 173.0125 29 V 4.3762 8.8190 125.4903 60.9083 34.6509 174.1081 30 K 4.6426 8.7055 130.0895 55.4500 33.2110 176.3517 31 V 4.1709 9.0308 129.6340 61.7266 32.5217 176.8881 32 G 4.0409 8.2769 120.8990 46.5513 0.0000 172.5229 33 E 4.2159 8.8376 121.6716 55.4217 30.0621 175.0592 34 F 4.5729 7.8578 119.6559 55.9500 40.0596 174.5076 35 A 4.6901 8.6213 128.5147 51.4863 19.0777 176.0330 36 C 4.9335 9.0252 120.5009 58.6922 31.7996 173.0351 37 H 5.2558 8.6336 117.9735 53.9907 32.2600 172.7490 38 I 5.1216 8.6347 122.4144 59.9737 40.7011 174.5313 39 T 4.7465 9.0341 119.8998 61.1521 71.8756 171.6794 40 E 4.9135 7.8021 125.2727 55.3967 30.9398 174.4193 41 H 4.7364 8.5784 126.2875 55.0253 33.4019 172.0448 42 P 4.4323 0.0000 0.0000 61.3722 32.9335 175.2251 43 V 3.7445 8.0992 117.4247 65.1405 31.5401 176.4288 44 G 4.0334 10.1939 114.7012 45.3486 0.0000 172.4881 45 Q 5.0135 8.0031 118.1925 54.0115 33.1521 174.2990 46 I 4.7473 9.0312 124.6645 59.8948 39.1675 174.2455 47 L 5.3209 9.0940 130.2419 53.6184 44.4967 175.0111 48 M 5.5531 9.1244 124.9664 53.8417 36.1286 174.3888 49 F 5.6064 8.6007 115.6822 56.7121 42.0128 172.6548 50 T 4.9708 9.1849 113.1760 61.1823 71.4441 172.5942 51 L 5.0244 8.5365 125.9346 52.6003 42.1136 174.9682 52 P 4.6040 0.0000 0.0000 62.2265 32.4546 176.0183 53 S 4.6524 8.5197 115.4759 57.1966 63.4047 174.0415 54 L 4.5571 8.3167 125.6311 53.2394 43.2423 175.8483 55 D 4.6372 8.4591 121.7361 53.4493 41.5929 177.0684 56 N 4.4521 8.7893 124.4587 55.8504 38.7321 175.3030 57 N 4.5807 8.8841 115.4496 53.9881 39.2245 173.9765 58 D 4.7286 7.8153 117.9749 54.0024 42.1536 177.0407 59 E 4.4340 8.4340 123.8981 54.5597 32.3330 177.4295 60 K 3.8405 8.4714 118.9869 60.8202 32.2559 178.5410 61 E 3.9457 8.2473 119.8964 59.2388 29.1504 179.5822 62 T 3.8501 7.7447 113.8548 66.5661 68.7569 176.3799 63 L 4.2840 8.0243 120.9241 57.8901 41.7131 179.6029 64 L 4.0726 8.4193 119.2595 57.7105 41.3387 179.6463 65 S 4.1031 8.0446 115.2286 61.7719 62.4428 176.3034 66 H 4.2312 7.8183 118.0063 58.0540 28.4346 175.8462 67 N 4.6574 7.7354 116.3848 52.8827 38.6929 175.1750 68 I 3.6793 7.0969 119.9703 60.2724 38.5503 175.7964 69 F 4.4875 7.9590 121.8556 57.1020 38.5306 174.7307 70 S 4.6461 8.1336 114.8263 57.5591 65.2579 173.2316 71 Q 4.1115 8.7614 116.4350 57.5652 29.1875 174.7930 72 D 4.7656 8.0847 120.2236 52.3130 41.5688 176.5839 73 I 3.9493 8.3592 120.5040 62.6455 37.7988 176.4482 74 L 4.4056 8.1416 120.6350 54.3198 41.7935 176.5184 75 K 3.9699 7.7506 122.0720 55.5894 32.4186 174.8125 76 P 4.4725 0.0000 0.0000 62.9357 32.4257 175.4163 77 I 4.3080 8.1033 122.5013 59.4798 39.4467 174.2688 78 L 4.9468 9.3892 129.8752 54.0870 43.2619 175.6146 79 S 4.9458 9.4556 120.3801 57.0004 67.1727 172.0496 80 W 5.2092 8.7563 128.0540 55.9182 33.8776 174.4300 81 D 4.6470 8.2601 127.1865 52.6723 40.9480 176.6338 82 E 4.2937 9.0473 126.7989 59.5046 30.0246 179.1224 83 V 3.7115 8.2103 117.4187 65.7680 31.5224 176.9004 84 G 3.7424 8.1259 105.1744 44.7175 0.0000 173.1765 85 G 4.0547 8.0084 107.7513 46.7118 0.0000 173.3403 86 H 4.5098 6.5784 113.8222 52.8998 33.8408 173.0348 87 P 4.2325 0.0000 0.0000 62.4426 32.7975 175.6040 88 V 4.5990 9.0392 120.9827 61.1782 35.1442 173.6008 89 L 5.4153 9.0887 130.1554 53.0968 44.3709 175.0077 90 W 6.0474 8.8714 122.5149 55.3148 32.2322 173.1911 91 N 5.3311 9.4156 117.7769 51.7655 40.8876 172.8094 92 R 5.8673 8.7463 117.7812 55.9818 33.3914 173.6352 93 Q 4.7675 8.5291 120.5613 54.1715 31.8398 171.7668 94 P 4.7524 0.0000 0.0000 62.9616 31.9669 177.4704 95 L 4.0573 8.8350 126.0357 57.4820 42.2393 177.4052 96 N 4.6846 8.0573 113.4397 53.4548 38.2335 175.2091 97 S 4.5814 7.3675 112.4110 56.6453 62.4555 172.1111 98 L 4.4989 7.6273 122.7833 53.0509 42.9858 176.2333 99 D 4.4597 9.2472 123.7882 55.9109 41.3825 176.0255 100 N 4.2719 9.1422 123.1953 54.9245 36.6062 173.8123 101 N 4.1344 8.1232 110.9633 53.4072 36.7080 173.1801 102 S 4.6780 7.3931 109.3557 57.3019 66.5767 176.0845 103 L 4.5069 7.8925 121.4527 54.9922 41.9692 177.9937 104 Y 3.9536 8.0680 120.8725 61.3989 38.6482 178.5108 105 T 4.0462 8.0903 115.7658 66.4435 68.5848 176.4909 106 Q 3.9370 8.0285 121.2512 59.0611 29.2096 177.8482 107 L 3.8717 7.9059 121.4005 58.0987 42.1237 178.5317 108 E 3.7862 8.0453 119.2711 59.5193 29.5519 178.7509 109 M 4.0821 8.2203 118.8229 57.8529 31.9460 178.6214 110 L 3.8346 7.7022 120.7376 58.3037 42.2779 179.4390 111 V 3.2070 7.7018 112.3449 64.3411 31.3713 178.6586 112 Q 3.9721 8.0971 118.0458 58.7395 28.3528 178.9821 113 G 3.5049 7.8928 106.6746 47.5073 0.0000 175.7577 114 A 3.8928 7.6587 123.0446 54.9437 18.1039 179.4864 115 E 4.0461 7.7455 116.3382 59.5429 29.6710 179.3057 116 R 4.0364 7.8903 118.6483 59.5395 29.9631 178.6693 117 L 3.9980 7.4791 117.4673 57.8019 41.6319 179.1045 118 Q 4.1664 8.1520 117.3954 58.2279 29.0539 177.7245 119 T 4.0401 7.1419 116.1120 64.0225 69.2352 174.2837 120 S 5.4327 8.5534 118.2018 59.5682 63.4560 174.1730 121 S 4.0350 8.2060 119.3411 59.9019 64.3492 171.7372 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 M 7.73 5.34 0.00 1.65 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 2.47 2.42 0.00 1 G 8.37 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 2 Y 9.15 4.61 0.00 3.00 3.03 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 3 S 8.20 4.01 0.00 3.96 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 4 F 8.19 4.14 0.00 3.26 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 5 E 8.27 3.76 0.00 2.27 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 6 Q 8.09 3.74 0.00 1.84 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 1.36 1.63 0.00 7 A 7.83 3.85 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 8 I 7.49 3.31 1.36 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 0.28 -0.34 -0.05 0.00 0.00 9 T 7.62 3.67 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 1.17 0.00 0.00 10 Q 8.09 4.15 0.00 2.05 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.22 0.00 11 L 7.96 4.03 0.00 1.84 1.90 1.03 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 12 F 8.86 4.28 0.00 3.19 3.24 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 13 Q 8.19 4.08 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.84 0.00 0.00 0.00 0.00 0.00 2.42 2.71 0.00 14 Q 8.14 4.31 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.88 0.00 0.00 0.00 0.00 0.00 2.38 2.70 0.00 15 L 7.32 4.63 0.00 1.47 1.59 0.85 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 16 S 7.62 3.79 0.00 4.00 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 17 L 7.93 4.54 0.00 1.16 1.15 -0.01 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 18 S 8.41 4.23 0.00 4.01 3.89 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 19 I 8.22 4.24 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.63 0.90 0.00 0.00 20 P 0.00 4.49 0.00 2.16 2.05 0.00 3.66 0.00 0.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.29 0.00 21 D 8.68 4.52 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 22 T 7.68 4.51 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 1.24 0.00 0.00 23 I 8.31 4.21 1.89 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.47 0.85 0.00 0.00 24 E 8.49 4.32 0.00 2.19 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 0.00 2.42 2.42 0.00 25 P 0.00 3.95 0.00 2.01 2.05 0.00 3.63 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 2.01 2.06 0.00 26 V 7.06 4.47 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 0.82 0.00 0.00 0.93 0.00 0.00 27 I 9.14 4.24 1.98 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.67 1.11 0.00 0.00 28 G 8.75 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 0.00 0.00 0.00 0.00 29 V 8.82 4.38 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 0.91 0.00 0.00 1.01 0.00 0.00 30 K 8.71 4.64 0.00 1.75 1.67 0.00 1.80 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.57 7.81 31 V 9.03 4.17 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 0.91 0.00 0.00 0.87 0.00 0.00 32 G 8.28 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 33 E 8.84 4.22 0.00 1.77 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 1.47 1.47 0.00 34 F 7.86 4.57 0.00 3.19 2.99 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 35 A 8.62 4.69 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 36 C 9.03 4.93 0.00 2.88 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 H 8.63 5.26 0.00 1.50 2.64 0.00 5.75 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 I 8.63 5.12 1.97 0.00 0.00 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 1.13 0.81 1.05 0.00 0.00 39 T 9.03 4.75 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 1.29 0.00 0.00 40 E 7.80 4.91 0.00 1.90 1.49 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 2.25 2.46 0.00 41 H 8.58 4.74 0.00 3.08 3.13 0.00 6.00 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.43 0.00 2.19 2.05 0.00 3.70 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.88 0.00 43 V 8.10 3.74 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 0.86 0.00 0.00 0.92 0.00 0.00 44 G 10.19 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 45 Q 8.00 5.01 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.73 0.00 0.00 0.00 0.00 0.00 2.27 2.46 0.00 46 I 9.03 4.75 1.96 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.16 1.07 0.00 0.00 47 L 9.09 5.32 0.00 1.82 1.62 1.03 0.66 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 48 M 9.12 5.55 0.00 2.00 2.20 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 2.57 2.48 0.00 49 F 8.60 5.61 0.00 3.31 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 50 T 9.18 4.97 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 51 L 8.54 5.02 0.00 1.57 1.62 0.99 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 52 P 0.00 4.60 0.00 2.24 2.10 0.00 3.90 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 53 S 8.52 4.65 0.00 3.95 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 54 L 8.32 4.56 0.00 1.76 1.68 1.15 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.46 4.64 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 56 N 8.79 4.45 0.00 2.77 2.89 0.00 0.00 7.11 8.00 0.00 0.00 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 N 8.88 4.58 0.00 2.62 2.91 0.00 0.00 7.13 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 58 D 7.82 4.73 0.00 2.89 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 59 E 8.43 4.43 0.00 2.00 1.88 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 2.36 2.35 0.00 60 K 8.47 3.84 0.00 1.96 2.06 0.00 1.51 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.54 7.81 61 E 8.25 3.95 0.00 2.06 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 2.39 2.47 0.00 62 T 7.74 3.85 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 1.21 0.00 0.00 63 L 8.02 4.28 0.00 1.88 1.78 0.97 0.56 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 64 L 8.42 4.07 0.00 1.65 1.72 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.04 4.10 0.00 3.98 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 66 H 7.82 4.23 0.00 3.19 3.32 0.00 5.64 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 N 7.74 4.66 0.00 2.85 2.82 0.00 0.00 6.93 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 68 I 7.10 3.68 1.69 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 -0.12 0.76 0.00 0.00 69 F 7.96 4.49 0.00 3.13 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 70 S 8.13 4.65 0.00 3.95 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 71 Q 8.76 4.11 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 72 D 8.08 4.77 0.00 2.70 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 73 I 8.36 3.95 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.73 0.92 0.00 0.00 74 L 8.14 4.41 0.00 1.77 1.73 0.99 0.82 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 75 K 7.75 3.97 0.00 1.84 1.68 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.17 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.34 7.81 76 P 0.00 4.47 0.00 2.00 1.95 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.05 0.00 77 I 8.10 4.31 0.56 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.07 0.83 0.00 0.00 78 L 9.39 4.95 0.00 1.58 1.70 0.99 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 79 S 9.46 4.95 0.00 4.04 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 0.00 80 W 8.76 5.21 0.00 3.47 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 D 8.26 4.65 0.00 2.64 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 E 9.05 4.29 0.00 2.09 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 0.00 2.52 2.33 0.00 83 V 8.21 3.71 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.93 0.00 0.00 84 G 8.13 3.74 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 0.00 0.00 0.00 85 G 8.01 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 86 H 6.58 4.51 0.00 2.72 2.81 0.00 5.62 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.23 0.00 2.12 2.19 0.00 3.43 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.00 0.00 88 V 9.04 4.60 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 0.83 0.00 0.00 0.81 0.00 0.00 89 L 9.09 5.42 0.00 1.82 1.55 0.87 0.84 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 90 W 8.87 6.05 0.00 3.68 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 91 N 9.42 5.33 0.00 2.81 2.84 0.00 0.00 6.63 7.09 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 92 R 8.75 5.87 0.00 2.20 2.09 0.00 3.13 0.00 0.00 4.01 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.71 0.00 93 Q 8.53 4.77 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 2.52 2.44 0.00 94 P 0.00 4.75 0.00 2.12 2.04 0.00 3.62 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 95 L 8.84 4.06 0.00 1.62 1.73 0.97 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 96 N 8.06 4.68 0.00 2.88 2.93 0.00 0.00 5.70 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 S 7.37 4.58 0.00 3.81 3.77 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 98 L 7.63 4.50 0.00 1.76 1.75 0.92 1.04 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 99 D 9.25 4.46 0.00 2.76 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 N 9.14 4.27 0.00 2.92 2.88 0.00 0.00 7.37 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.12 4.13 0.00 2.78 2.81 0.00 0.00 6.63 7.80 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 0.00 102 S 7.39 4.68 0.00 3.73 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 0.00 103 L 7.89 4.51 0.00 1.75 1.69 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 104 Y 8.07 3.95 0.00 3.25 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 T 8.09 4.05 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 106 Q 8.03 3.94 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.91 0.00 0.00 0.00 0.00 0.00 2.53 2.44 0.00 107 L 7.91 3.87 0.00 1.73 1.60 0.85 0.56 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 0.00 108 E 8.05 3.79 0.00 1.90 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 2.28 0.00 109 M 8.22 4.08 0.00 2.03 2.24 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.83 0.00 110 L 7.70 3.83 0.00 1.85 1.76 1.00 0.97 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 0.00 111 V 7.70 3.21 1.82 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 120 S 8.55 5.43 0.00 4.04 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 0.00 121 S 8.21 4.04 0.00 4.08 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