NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 I 4.2215 8.0093 121.4384 61.5513 38.3420 175.8355 5 N 4.9255 8.6473 122.5472 49.9938 37.8805 172.4575 6 T 4.7097 8.5791 110.2504 60.8447 73.3741 175.7902 7 F 4.3269 8.4747 120.5856 61.1543 38.9477 177.7737 8 D 4.5737 8.3170 118.1171 57.0201 40.7064 178.9063 9 G 3.6334 7.9958 106.0122 47.8810 0.0000 175.9836 10 V 3.5897 7.9940 121.0789 65.3409 31.5506 177.6509 11 A 4.0466 7.9920 120.5015 55.6126 18.1969 179.4179 12 D 4.2491 8.4092 117.3572 57.4689 40.7928 178.2656 13 Y 3.9899 8.2030 120.0867 60.7808 38.8324 178.2032 14 L 3.8000 8.3786 120.0874 58.0729 41.5472 179.7050 15 Q 3.5330 7.5995 116.3006 58.6346 28.5701 178.8035 16 T 3.5691 6.8723 115.5220 65.9161 68.8633 176.0580 17 Y 4.2370 6.7915 114.8408 56.8731 38.6659 175.3545 18 H 3.2343 7.5590 116.1403 55.9225 26.6569 174.4187 19 K 4.4926 7.4277 114.4356 56.2089 34.5024 174.4815 20 L 4.1353 8.4397 119.8304 53.6479 42.3144 175.4724 21 P 3.6112 0.0000 0.0000 62.3320 31.7073 177.4601 22 D 4.4829 8.3689 119.4917 56.7944 40.9098 177.2489 23 N 4.5282 8.0154 115.5742 53.2848 37.5556 173.5853 24 Y 5.0827 7.6813 118.0072 56.6892 40.4695 174.7283 25 I 4.9550 8.6296 115.9224 59.2206 41.5175 175.0561 26 T 4.6468 9.4959 114.8355 60.5626 70.1388 175.5842 27 K 3.8982 9.5208 122.3948 59.9939 32.1049 179.8420 28 S 4.2405 8.1368 113.7321 61.3067 63.1200 176.3012 29 E 3.9617 8.0738 121.8710 59.1358 29.3347 179.0110 30 A 4.0183 8.2729 121.0063 55.3834 18.4770 179.6317 31 Q 4.4256 8.9563 117.8916 58.6966 28.5874 179.0517 32 A 4.0996 7.8763 120.5631 54.9573 18.5276 178.8787 33 L 4.3162 7.6055 114.2976 54.8439 42.0128 177.4784 34 G 4.0264 7.8448 106.3329 44.8717 0.0000 174.1069 35 W 4.4682 8.5446 131.4416 57.1761 31.0347 174.9499 36 V 3.8760 9.3172 126.7295 60.5211 31.8076 175.4313 37 A 3.5046 7.3614 131.2972 55.2730 18.1087 179.6142 38 S 4.3534 7.8404 109.3920 60.6954 62.9706 175.1013 39 K 4.3191 7.8998 118.2273 55.2980 32.6339 176.3131 40 G 3.0996 7.4717 108.1337 46.2210 0.0000 173.8374 41 N 4.9406 7.8114 111.9949 52.3903 38.4483 176.7059 42 L 3.9614 8.3597 122.4132 59.1863 41.9221 178.3209 43 A 4.1672 8.1136 118.3518 54.7023 18.3607 178.8250 44 D 4.4538 7.8694 117.3493 57.1257 41.1436 178.4874 45 V 4.1366 7.7433 109.6477 61.6666 33.7788 176.5817 46 A 4.6823 8.0309 121.4944 49.7278 19.7895 173.7372 47 P 4.4769 0.0000 0.0000 63.8114 32.2559 177.7065 48 G 3.9142 9.0128 111.3270 44.9834 0.0000 173.3051 49 K 4.6395 7.5078 118.3225 55.6007 33.7725 176.2651 50 S 4.5090 8.3506 116.9998 56.5358 67.7412 173.5243 51 I 4.1800 7.9212 122.9758 61.2080 38.2620 175.4059 52 G 4.1967 9.2099 112.1475 47.0443 0.0000 174.2398 53 G 4.4635 9.4678 109.6198 44.4540 0.0000 173.8813 54 D 4.8304 7.9630 119.5104 53.4095 42.6783 175.9890 55 I 4.4105 8.3354 121.7741 61.4938 38.1118 175.1871 56 F 4.8749 8.6753 128.3090 56.3145 40.4877 175.6238 57 S 4.0200 8.3101 121.3096 59.2641 63.4192 173.5902 58 N 3.9258 6.8336 118.0218 54.0335 37.0698 175.8696 59 R 3.8270 7.8144 118.1128 59.0317 30.3280 176.8784 60 E 4.0845 8.0738 114.8040 56.4748 29.7631 176.6266 61 G 3.9003 7.7532 106.8765 46.5034 0.0000 175.5072 62 K 4.1016 8.2823 120.6745 57.7782 32.5951 177.4841 63 L 3.8280 7.2458 118.3554 51.3431 43.0406 174.5754 64 P 4.2174 0.0000 0.0000 63.0859 31.5161 176.3325 65 G 4.2127 8.2862 111.7014 44.2252 0.0000 172.2510 66 K 4.3987 7.8275 117.4418 54.8841 34.8382 174.7163 67 S 4.3332 8.5794 120.1125 59.5774 63.3680 174.7358 68 G 3.7802 8.7690 111.2970 45.5351 0.0000 172.6187 69 R 4.3034 7.7176 121.0474 55.0291 30.9818 175.6297 70 T 4.6288 8.2209 116.5241 59.6599 72.0596 173.0401 71 W 5.0170 8.5435 122.5603 55.2505 32.0137 175.1336 72 R 5.1863 8.7816 121.7368 54.3446 34.3263 173.7799 73 E 5.8716 9.1395 117.2576 54.0094 33.8536 174.2248 74 A 4.9850 8.3006 119.5839 50.6759 22.7388 175.3559 75 D 5.0558 9.3971 121.9648 54.4342 40.2299 176.1071 76 I 4.3330 8.4132 123.1201 60.1656 40.5133 175.8809 77 N 4.2367 8.8797 121.8465 54.1428 36.5935 173.6951 78 Y 4.3548 7.2992 119.6001 57.3821 39.6918 175.2651 79 T 3.9191 7.0523 114.8897 62.3554 70.6669 173.7721 80 S 4.3361 6.4181 112.0495 58.5044 65.4929 176.0669 81 G 3.8732 8.6712 107.2108 45.4939 0.0000 173.3446 82 F 4.3175 8.7107 118.6353 57.2918 39.6627 175.3526 83 R 4.2910 8.7225 121.9055 56.5089 30.6864 177.0922 84 N 4.9553 8.5416 118.4855 52.2870 40.0265 175.0199 85 S 4.2302 8.5127 113.5372 58.6064 64.2651 172.7584 86 D 5.4797 8.2492 122.1154 53.4720 42.3768 175.7967 87 R 4.9424 8.9726 121.6374 54.5739 35.2607 173.7204 88 I 5.0694 8.7456 122.9210 59.7099 40.2520 174.0543 89 L 5.4127 9.5245 130.0483 53.2327 43.4799 175.0549 90 Y 5.6735 8.9549 122.3428 55.3677 41.7845 175.2471 91 S 4.0995 8.0787 116.7733 56.3056 65.3090 175.1864 92 S 3.4653 7.9380 114.6375 60.0604 62.6243 174.7479 93 D 4.4868 7.1946 119.5603 52.3187 39.3684 175.7942 94 W 3.8563 6.6160 116.6565 58.5327 27.2813 174.8014 95 L 4.6150 7.6680 116.5980 54.7624 43.0088 176.3165 96 A 5.4202 8.9981 121.8138 50.8614 22.7183 174.8711 97 Y 5.1124 9.8200 120.0212 55.8883 42.1323 174.8930 98 K 5.2426 9.3801 121.6603 55.4923 36.1101 174.8076 99 T 5.0079 9.0150 115.7192 60.5082 70.7095 174.0790 100 T 4.8190 8.7749 114.9469 60.1298 70.3044 173.3300 101 D 4.7432 7.0318 121.2772 53.8070 39.9028 174.8073 102 H 3.5515 8.4294 110.4692 58.4436 26.6674 175.3517 103 Y 3.1858 7.1553 110.5780 59.1057 36.2620 171.8425 104 Q 4.1946 7.7375 120.0118 58.2239 29.1200 176.5969 105 T 4.6654 7.6927 105.2063 59.6260 71.7101 172.7306 106 F 5.3616 8.5021 119.9663 56.2832 43.3653 174.3412 107 T 4.7811 8.8639 116.2601 61.5492 72.6420 173.4690 108 K 3.3739 8.7324 127.8929 56.2222 32.2627 176.2371 109 I 4.4655 8.5090 119.7453 60.6378 39.8769 175.8888 110 R 4.1744 7.5159 126.9114 56.6350 31.1149 174.5390 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 4 I 8.01 4.22 1.78 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.03 0.94 0.00 0.00 5 N 8.65 4.93 0.00 2.86 2.83 0.00 0.00 6.38 6.34 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 6 T 8.58 4.71 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 1.21 0.00 0.00 7 F 8.47 4.33 0.00 3.08 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 D 8.32 4.57 0.00 2.75 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 9 G 8.00 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 0.00 0.00 0.00 10 V 7.99 3.59 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 1.06 0.00 0.00 11 A 7.99 4.05 1.50 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 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.41 4.25 0.00 2.78 2.72 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 13 Y 8.20 3.99 0.00 3.17 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 14 L 8.38 3.80 0.00 1.79 1.65 0.38 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 7.60 3.53 0.00 1.87 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.92 0.00 0.00 0.00 0.00 0.00 2.45 2.59 0.00 16 T 6.87 3.57 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 17 Y 6.79 4.24 0.00 2.41 2.64 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 0.00 0.00 0.00 0.00 18 H 7.56 3.23 0.00 3.27 3.44 0.00 5.71 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.43 4.49 0.00 1.93 1.86 0.00 1.75 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.55 7.81 20 L 8.44 4.14 0.00 1.66 1.42 0.89 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 3.61 0.00 2.31 1.33 0.00 3.45 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.47 0.00 22 D 8.37 4.48 0.00 2.61 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 23 N 8.02 4.53 0.00 2.71 2.88 0.00 0.00 6.18 7.57 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 24 Y 7.68 5.08 0.00 3.03 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 I 8.63 4.96 1.85 0.00 0.00 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 1.18 0.82 0.90 0.00 0.00 26 T 9.50 4.65 4.48 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 1.37 0.00 0.00 27 K 9.52 3.90 0.00 2.01 2.20 0.00 1.91 0.00 0.00 1.94 0.00 0.00 3.26 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.63 1.63 7.81 28 S 8.14 4.24 0.00 4.10 4.19 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 29 E 8.07 3.96 0.00 2.15 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 30 A 8.27 4.02 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 Q 8.96 4.43 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.41 2.92 0.00 32 A 7.88 4.10 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.61 4.32 0.00 1.94 1.76 0.93 1.08 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 34 G 7.84 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 35 W 8.54 4.47 0.00 3.33 3.26 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 36 V 9.32 3.88 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.89 0.00 0.00 37 A 7.36 3.50 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 38 S 7.84 4.35 0.00 3.83 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 39 K 7.90 4.32 0.00 1.75 1.79 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.31 7.81 40 G 7.47 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 0.00 0.00 0.00 41 N 7.81 4.94 0.00 2.90 3.00 0.00 0.00 5.74 6.67 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 42 L 8.36 3.96 0.00 1.48 1.64 0.37 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.11 4.17 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 44 D 7.87 4.45 0.00 2.91 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 V 7.74 4.14 2.29 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 0.82 0.00 0.00 1.08 0.00 0.00 46 A 8.03 4.68 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 47 P 0.00 4.48 0.00 2.03 2.02 0.00 3.68 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 2.03 2.25 0.00 48 G 9.01 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 49 K 7.51 4.64 0.00 1.62 1.59 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.68 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.49 7.81 50 S 8.35 4.51 0.00 2.96 3.52 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 51 I 7.92 4.18 1.68 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.02 0.83 0.00 0.00 52 G 9.21 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 G 9.47 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 D 7.96 4.83 0.00 2.71 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 55 I 8.34 4.41 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.48 0.91 0.00 0.00 56 F 8.68 4.87 0.00 2.98 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 57 S 8.31 4.02 0.00 3.85 3.79 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 58 N 6.83 3.93 0.00 2.90 2.80 0.00 0.00 6.87 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 R 7.81 3.83 0.00 1.90 1.79 0.00 3.40 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.23 0.00 60 E 8.07 4.08 0.00 2.03 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 2.30 2.28 0.00 61 G 7.75 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 62 K 8.28 4.10 0.00 1.95 2.08 0.00 2.02 0.00 0.00 1.94 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.56 7.81 63 L 7.25 3.83 0.00 0.58 0.13 -0.52 -0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 4.22 0.00 2.31 2.11 0.00 2.80 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.04 0.00 65 G 8.29 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 66 K 7.83 4.40 0.00 1.75 1.56 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.33 1.36 7.81 67 S 8.58 4.33 0.00 3.99 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 68 G 8.77 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 7.72 4.30 0.00 1.67 1.86 0.00 3.21 0.00 0.00 2.47 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.03 0.00 70 T 8.22 4.63 4.14 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 1.13 0.00 0.00 71 W 8.54 5.02 0.00 3.55 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 72 R 8.78 5.19 0.00 0.67 1.45 0.00 3.08 0.00 0.00 3.44 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.36 0.00 73 E 9.14 5.87 0.00 2.15 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 2.47 2.21 0.00 74 A 8.30 4.99 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 75 D 9.40 5.06 0.00 2.63 2.64 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 0.00 0.00 0.00 0.00 76 I 8.41 4.33 1.15 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.82 -0.22 0.00 0.00 77 N 8.88 4.24 0.00 2.79 2.89 0.00 0.00 6.93 7.27 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 78 Y 7.30 4.35 0.00 3.03 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 79 T 7.05 3.92 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 1.07 0.00 0.00 80 S 6.42 4.34 0.00 3.85 3.66 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 81 G 8.67 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 82 F 8.71 4.32 0.00 3.18 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 83 R 8.72 4.29 0.00 2.00 1.96 0.00 3.17 0.00 0.00 3.52 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 84 N 8.54 4.96 0.00 2.85 2.96 0.00 0.00 5.96 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 85 S 8.51 4.23 0.00 3.81 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 86 D 8.25 5.48 0.00 2.76 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 87 R 8.97 4.94 0.00 1.71 1.84 0.00 3.57 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.13 0.00 88 I 8.75 5.07 2.17 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 1.07 0.00 0.00 89 L 9.52 5.41 0.00 1.59 1.55 0.51 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 90 Y 8.95 5.67 0.00 3.15 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 91 S 8.08 4.10 0.00 2.93 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 92 S 7.94 3.47 0.00 3.67 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 93 D 7.19 4.49 0.00 2.68 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 94 W 6.62 3.86 0.00 3.56 3.36 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 95 L 7.67 4.61 0.00 1.63 1.98 1.16 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 96 A 9.00 5.42 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 97 Y 9.82 5.11 0.00 2.81 2.93 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 98 K 9.38 5.24 0.00 0.85 1.51 0.00 0.61 0.00 0.00 0.82 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.03 0.96 7.81 99 T 9.02 5.01 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 100 T 8.77 4.82 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 1.29 0.00 0.00 101 D 7.03 4.74 0.00 2.81 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 0.00 102 H 8.43 3.55 0.00 3.34 3.46 0.00 5.78 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 7.16 3.19 0.00 3.32 3.31 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 0.00 104 Q 7.74 4.19 0.00 2.44 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.67 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 105 T 7.69 4.67 4.20 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 0.00 0.00 0.00 1.18 0.00 0.00 106 F 8.50 5.36 0.00 2.93 3.05 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 0.00 107 T 8.86 4.78 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 1.16 0.00 0.00 108 K 8.73 3.37 0.00 1.33 1.53 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.18 0.96 7.81 109 I 8.51 4.47 1.82 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.87 0.81 0.00 0.00 110 R 7.52 4.17 0.00 1.87 1.83 0.00 3.33 0.00 0.00 3.38 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00