NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4360 8.3049 120.3250 54.5829 33.4314 175.0622 1 I 3.5392 8.1924 122.1535 61.7118 37.4674 175.0030 2 Q 5.2027 9.0085 123.5920 53.4167 31.3314 173.3856 3 R 4.5646 8.3672 121.7688 55.1551 32.1797 175.3039 4 T 4.8996 8.7616 118.5573 59.5602 68.4993 172.4685 5 P 4.7580 0.0000 0.0000 63.2316 32.1114 175.6243 6 K 4.4718 9.4999 123.7503 55.5387 33.7855 175.5294 7 I 4.8601 8.3677 125.2769 59.6753 39.4588 175.0573 8 Q 4.7764 9.3675 125.6510 54.1899 32.3811 174.4203 9 V 5.1288 8.7243 124.4073 60.2429 33.4848 174.5209 10 Y 5.3557 8.5534 123.0721 56.4839 41.6779 173.0547 11 S 4.8457 8.9297 113.1013 56.6194 65.4068 174.3395 12 R 4.1498 8.8491 122.9424 59.6846 29.8900 176.4188 13 H 5.0764 8.4202 113.8100 52.8254 31.3371 172.7363 14 P 4.4329 0.0000 0.0000 62.5484 31.7141 176.6144 15 A 4.2540 8.6961 125.4421 52.5503 19.1421 177.3477 16 E 4.4627 8.5216 121.0494 54.7402 32.1348 174.6498 17 N 4.4812 8.8415 121.9114 55.0304 39.0498 173.9109 18 G 4.2107 8.6348 113.0527 46.0588 0.0000 174.5591 19 K 4.1748 7.7394 118.4743 55.1693 32.8585 177.0172 20 S 4.0448 8.2390 117.4091 58.7394 63.2931 172.7386 21 N 4.9517 8.3501 123.0548 53.0711 42.7175 172.0169 22 F 5.2560 8.9404 115.9825 55.8802 43.2742 173.7615 23 L 3.8365 8.9087 126.9095 53.7757 42.9347 175.1030 24 N 5.2680 9.1185 124.8580 51.7504 41.8247 173.6157 25 C 5.1649 9.2783 121.5047 55.5507 47.9219 171.9868 26 Y 5.2740 10.0137 130.3031 56.3623 40.4136 174.4702 27 V 4.9488 8.3054 120.4480 59.7205 34.2220 175.2907 28 S 5.0691 8.9187 118.7787 57.6845 66.8843 174.8049 29 G 4.2451 8.8194 107.5454 46.9801 0.0000 173.7338 30 F 4.9870 7.7807 115.1735 56.1136 40.7527 173.9709 31 H 4.9847 9.0889 114.7216 54.9072 33.9395 172.3601 32 P 5.0425 0.0000 0.0000 62.7701 31.8791 176.0214 33 S 4.0432 8.4587 112.7924 59.8674 63.2669 173.7806 34 D 4.3535 7.9662 121.1492 54.6662 41.0745 174.8165 35 I 4.6539 8.0198 125.5068 59.8857 41.2681 173.1418 36 E 4.5911 9.0433 128.8062 54.7968 31.4440 175.2010 37 V 4.5459 7.9640 123.4011 61.1345 34.5004 174.1206 38 D 4.8911 8.9777 126.4518 52.5677 45.5930 174.1460 39 L 5.0950 8.4821 121.5007 53.1108 44.2251 175.2478 40 L 5.2133 9.5053 124.3803 52.7349 45.2780 175.3715 41 K 4.2769 8.8336 124.3320 54.5974 34.2873 175.7974 42 N 3.8543 10.2779 128.1255 54.1787 36.8186 174.7115 43 G 4.1296 8.4194 106.4508 45.5204 0.0000 174.5047 44 E 4.1373 7.8150 119.9970 55.3345 30.3439 175.8006 45 R 4.2737 8.3139 125.1193 56.1553 30.9187 175.6308 46 I 4.2766 8.1220 125.8000 60.0939 37.6522 175.4462 47 E 4.0662 8.1485 126.4026 58.8012 30.0453 178.2089 48 K 4.2187 7.6066 125.3227 56.7279 29.9636 174.6144 49 V 4.3640 7.5656 119.4814 60.6872 34.5342 174.1738 50 E 4.5319 7.9455 127.5037 55.0285 32.5188 174.3612 51 H 5.8715 8.0564 114.7144 53.6252 31.3655 173.3910 52 S 4.4831 8.8154 115.5847 58.4272 63.9539 173.1549 53 D 4.5363 8.4831 120.0016 53.3542 41.2775 176.2673 54 L 3.9426 8.5037 125.0220 56.2825 42.3871 175.9932 55 S 4.7849 8.3078 119.3596 56.9520 66.5540 171.9865 56 F 5.6420 7.6822 117.3063 55.4644 41.6203 173.7181 57 S 4.8130 8.5973 113.8811 56.4857 65.2655 174.5927 58 K 3.5958 8.5672 118.6985 59.6429 31.6769 177.4307 59 D 4.4688 7.8355 115.5455 52.6341 39.4015 177.2828 60 W 3.6153 7.7048 118.1517 57.0699 27.8461 174.6248 61 S 4.3414 8.3665 114.8515 58.2050 64.0047 174.3844 62 F 5.1203 8.3269 121.8700 57.4987 40.5535 173.9996 63 Y 5.4091 8.3915 114.6982 56.6748 41.3500 173.5765 64 L 5.3186 9.1605 123.1260 52.7662 46.5722 174.9382 65 L 5.3464 9.0977 123.5519 53.7383 44.8320 174.5214 66 Y 5.0776 9.3879 124.5883 56.5220 40.1345 174.4623 67 Y 5.6111 7.9609 121.6109 54.5828 42.4839 173.9263 68 T 4.3822 8.1244 110.3788 61.3681 70.6175 171.6947 69 E 4.2311 8.8715 126.7461 56.2017 30.4862 175.7744 70 F 4.7238 8.6959 117.2860 56.4936 42.0546 173.0752 71 T 4.1458 7.9054 114.7935 60.7321 71.0843 172.4396 72 P 4.5222 0.0000 0.0000 63.5202 32.9253 175.9201 73 T 4.9662 8.5290 117.0403 61.8414 72.7991 174.6287 74 E 4.0610 9.0498 125.8431 59.4454 29.7555 178.5193 75 K 4.1181 7.9997 117.5529 58.8244 32.5973 176.6451 76 D 4.8027 7.5315 116.9531 53.8146 41.6872 175.2940 77 E 4.9646 8.6342 121.0820 54.8579 32.9306 174.6340 78 Y 5.7824 9.2324 120.2506 55.8418 42.0117 174.2595 79 A 5.1156 8.4183 121.8136 51.3146 23.5413 175.1605 80 C 5.4261 9.4528 119.6238 54.8498 47.1379 172.4747 81 R 5.1429 9.0092 127.0585 54.6357 32.1395 174.8088 82 V 4.8945 8.8146 125.3406 61.2516 35.5671 173.5005 83 N 5.3119 8.9833 123.5602 52.6116 42.9299 172.4241 84 H 4.9929 8.3700 122.6059 55.3746 33.2401 174.6400 85 V 3.6543 8.1616 114.4360 64.4540 31.1139 177.9850 86 T 4.0634 7.8449 108.3311 62.7235 68.9132 173.2999 87 L 5.0033 7.4303 123.4933 52.7619 43.5461 176.6791 88 S 4.3098 8.8296 119.3259 60.6149 63.3803 174.4115 89 Q 4.5393 7.5297 115.9284 52.9245 31.4339 172.4088 90 P 4.6623 0.0000 0.0000 62.6728 31.9587 175.5306 91 K 4.3163 8.9191 126.4595 55.7433 33.6016 175.2735 92 I 4.9507 8.3767 127.7398 59.4822 39.7732 174.8899 93 V 4.4707 8.8387 127.2212 60.9646 34.0366 174.7776 94 K 4.7153 8.7135 126.9564 55.5552 33.3134 176.2351 95 W 4.7023 9.0745 134.3878 57.1033 31.7959 175.2124 96 D 4.3754 8.3616 125.3798 52.0332 42.5923 177.2298 97 R 4.1170 7.4500 124.3593 56.0543 28.5314 177.0150 98 D 4.7871 8.8156 114.9054 55.4335 43.5761 175.6446 99 M 4.3857 7.8719 124.7811 55.6866 33.1092 174.9146 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 8.30 4.44 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.55 0.00 1 I 8.19 3.54 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.54 0.87 0.00 0.00 2 Q 9.01 5.20 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.52 0.00 3 R 8.37 4.56 0.00 1.90 2.21 0.00 3.18 0.00 0.00 3.31 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 4 T 8.76 4.90 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 1.27 0.00 0.00 5 P 0.00 4.76 0.00 1.91 1.69 0.00 3.86 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 1.92 1.80 0.00 6 K 9.50 4.47 0.00 1.72 1.80 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.46 7.81 7 I 8.37 4.86 1.89 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.54 0.94 0.00 0.00 8 Q 9.37 4.78 0.00 2.43 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 9 V 8.72 5.13 2.19 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 0.98 0.00 0.00 1.05 0.00 0.00 10 Y 8.55 5.36 0.00 3.20 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 11 S 8.93 4.85 0.00 4.24 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 12 R 8.85 4.15 0.00 1.92 2.15 0.00 3.37 0.00 0.00 3.16 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.52 0.00 13 H 8.42 5.08 0.00 3.35 3.25 0.00 5.72 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.43 0.00 2.11 2.07 0.00 3.79 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 15 A 8.70 4.25 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 0.00 0.00 16 E 8.52 4.46 0.00 1.99 1.85 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 2.33 2.58 0.00 17 N 8.84 4.48 0.00 2.73 2.83 0.00 0.00 7.39 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 18 G 8.63 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 19 K 7.74 4.17 0.00 1.79 1.70 0.00 2.06 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.47 7.81 20 S 8.24 4.04 0.00 3.73 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 21 N 8.35 4.95 0.00 2.44 2.59 0.00 0.00 6.99 8.52 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 22 F 8.94 5.26 0.00 3.12 2.87 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 23 L 8.91 3.84 0.00 0.27 0.61 -0.66 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 24 N 9.12 5.27 0.00 1.44 2.04 0.00 0.00 5.93 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 25 C 9.28 5.16 0.00 2.89 2.94 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 26 Y 10.01 5.27 0.00 3.40 3.20 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 27 V 8.31 4.95 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 0.69 0.00 0.00 1.07 0.00 0.00 28 S 8.92 5.07 0.00 3.82 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 29 G 8.82 4.25 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 0.00 30 F 7.78 4.99 0.00 3.05 3.15 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 31 H 9.09 4.98 0.00 3.25 3.20 0.00 5.59 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 5.04 0.00 2.19 2.22 0.00 3.88 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 2.09 2.03 0.00 33 S 8.46 4.04 0.00 3.19 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 34 D 7.97 4.35 0.00 2.67 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 35 I 8.02 4.65 1.48 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.64 0.79 0.00 0.00 36 E 9.04 4.59 0.00 1.86 1.75 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 2.21 2.19 0.00 37 V 7.96 4.55 0.67 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 0.06 0.00 0.00 0.30 0.00 0.00 38 D 8.98 4.89 0.00 2.50 2.44 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 39 L 8.48 5.09 0.00 1.56 1.50 0.86 0.53 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 40 L 9.51 5.21 0.00 1.49 1.59 0.92 0.64 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 41 K 8.83 4.28 0.00 1.90 1.63 0.00 2.03 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.09 0.59 7.81 42 N 10.28 3.85 0.00 2.74 2.79 0.00 0.00 7.26 5.13 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 43 G 8.42 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 0.00 0.00 0.00 0.00 44 E 7.82 4.14 0.00 2.02 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 0.00 2.30 2.24 0.00 45 R 8.31 4.27 0.00 1.80 1.80 0.00 3.60 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 46 I 8.12 4.28 1.94 0.00 0.00 1.00 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 0.90 0.93 0.00 0.00 47 E 8.15 4.07 0.00 1.95 1.89 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 2.31 2.30 0.00 48 K 7.61 4.22 0.00 1.70 1.73 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.37 7.81 49 V 7.57 4.36 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 0.95 0.00 0.00 1.00 0.00 0.00 50 E 7.95 4.53 0.00 1.16 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 2.09 2.03 0.00 51 H 8.06 5.87 0.00 2.18 1.68 0.00 5.34 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.82 4.48 0.00 3.96 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 53 D 8.48 4.54 0.00 2.69 2.65 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 0.00 54 L 8.50 3.94 0.00 1.60 1.64 0.77 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.31 4.78 0.00 3.47 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 56 F 7.68 5.64 0.00 2.95 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 57 S 8.60 4.81 0.00 4.01 4.06 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 58 K 8.57 3.60 0.00 1.65 1.77 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.30 1.33 7.81 59 D 7.84 4.47 0.00 2.78 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 60 W 7.70 3.62 0.00 3.34 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 61 S 8.37 4.34 0.00 3.87 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 62 F 8.33 5.12 0.00 1.56 2.51 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 63 Y 8.39 5.41 0.00 3.04 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 64 L 9.16 5.32 0.00 2.00 1.77 1.17 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 65 L 9.10 5.35 0.00 2.04 1.67 1.22 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 9.39 5.08 0.00 3.14 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 67 Y 7.96 5.61 0.00 3.04 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 68 T 8.12 4.38 4.16 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 1.04 0.00 0.00 69 E 8.87 4.23 0.00 1.72 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 1.47 1.47 0.00 70 F 8.70 4.72 0.00 2.79 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.91 4.15 4.11 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 1.14 0.00 0.00 72 P 0.00 4.52 0.00 2.07 2.27 0.00 3.35 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.46 0.00 73 T 8.53 4.97 4.50 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 1.38 0.00 0.00 74 E 9.05 4.06 0.00 1.96 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 0.00 2.32 2.33 0.00 75 K 8.00 4.12 0.00 1.78 1.85 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.42 7.81 76 D 7.53 4.80 0.00 2.95 2.44 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 77 E 8.63 4.96 0.00 1.83 1.85 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 2.26 2.26 0.00 78 Y 9.23 5.78 0.00 2.89 2.69 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 79 A 8.42 5.12 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 80 C 9.45 5.43 0.00 2.94 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 81 R 9.01 5.14 0.00 1.85 1.69 0.00 3.06 0.00 0.00 3.07 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 82 V 8.81 4.89 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 0.67 0.00 0.00 0.77 0.00 0.00 83 N 8.98 5.31 0.00 2.74 2.51 0.00 0.00 6.73 7.86 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 84 H 8.37 4.99 0.00 3.09 3.07 0.00 5.75 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.16 3.65 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 0.74 0.00 0.00 0.85 0.00 0.00 86 T 7.84 4.06 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 1.37 0.00 0.00 87 L 7.43 5.00 0.00 1.75 1.77 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.83 4.31 0.00 3.97 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 89 Q 7.53 4.54 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.85 0.00 0.00 0.00 0.00 0.00 2.21 2.35 0.00 90 P 0.00 4.66 0.00 1.93 2.04 0.00 3.70 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.28 0.00 91 K 8.92 4.32 0.00 1.88 1.64 0.00 1.46 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.45 7.81 92 I 8.38 4.95 1.88 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 0.78 0.92 0.00 0.00 93 V 8.84 4.47 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 1.02 0.00 0.00 0.96 0.00 0.00 94 K 8.71 4.72 0.00 1.74 1.80 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.47 7.81 95 W 9.07 4.70 0.00 3.28 3.43 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 0.00 96 D 8.36 4.38 0.00 2.58 2.39 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 97 R 7.45 4.12 0.00 1.84 1.07 0.00 2.97 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.49 0.00 98 D 8.82 4.79 0.00 2.58 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 99 M 7.87 4.39 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00