NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3979 8.3044 120.3489 54.9223 33.4797 174.5651 2 K 3.9978 8.5064 128.5586 55.8717 33.5036 173.9370 3 K 5.0214 9.2868 127.2986 54.6427 35.9194 174.8705 4 E 4.4973 9.4673 125.3624 54.8156 31.7567 174.9359 5 F 5.3640 8.6371 124.2625 56.0263 41.2689 175.4787 6 S 5.4067 9.1861 119.2701 56.6500 67.2469 172.7532 7 A 4.9667 8.8949 121.3902 50.7308 22.8353 175.6249 8 G 4.4023 9.0670 107.7221 44.8059 0.0000 171.2665 9 G 4.6620 8.9879 106.0508 44.3916 0.0000 173.3524 10 V 4.1635 8.7008 123.0372 60.7062 32.8447 173.2779 11 L 5.2428 8.2070 129.1950 53.4977 44.1335 174.7469 12 F 5.6130 9.2417 124.0708 55.8493 42.9254 174.8752 13 K 4.4109 9.3240 123.6371 54.8856 34.5163 175.6772 14 D 4.3619 9.5957 130.3544 55.4394 38.3650 174.8985 15 G 4.0276 8.0605 104.5781 45.5709 0.0000 171.4075 16 E 5.4487 8.0351 118.8385 54.3219 33.3072 175.2687 17 V 4.7866 8.7745 121.1457 59.7721 34.6787 174.2852 18 L 4.2050 8.5976 126.0036 54.4909 42.5559 175.8249 19 L 5.2846 8.9484 125.7595 52.9203 46.3151 175.4070 20 I 5.0461 8.9142 114.0604 59.1025 41.4384 173.9899 21 K 4.1808 7.9313 125.3610 54.7053 33.6609 176.5515 22 T 4.4974 8.5336 118.4843 60.0706 69.8646 173.8482 23 P 4.4720 0.0000 0.0000 65.2387 31.2367 177.6992 24 S 4.3428 7.8383 113.5090 58.3351 62.9211 175.0885 25 N 4.1958 8.3838 117.2896 53.3291 36.6116 173.8517 26 V 4.0838 6.8531 119.4895 61.4280 33.2287 175.0190 27 W 4.7696 8.5681 127.4694 56.7245 30.1251 175.5569 28 S 4.2166 9.1109 117.9793 57.7337 65.5757 172.2683 29 F 5.2549 8.4317 117.5649 55.6111 40.7627 174.4857 30 P 4.7453 0.0000 0.0000 62.2831 32.2869 175.5340 31 K 4.9571 8.5175 121.7132 56.4717 35.7031 174.4305 32 G 4.3306 8.5344 106.3248 45.9381 0.0000 172.3319 33 N 4.8488 8.8281 119.3333 53.8408 39.7408 174.4962 34 I 4.2684 8.3575 127.0642 59.6315 37.6084 176.0002 35 E 4.1407 8.9227 127.2628 55.1150 30.0467 175.2448 36 P 4.4185 0.0000 0.0000 64.4694 31.6434 177.0770 37 G 3.9125 9.0966 111.1177 45.0980 0.0000 172.2318 38 E 4.6963 7.7447 120.4089 54.1330 31.4000 176.3035 39 K 4.2522 9.0295 125.9036 55.4313 34.1558 176.5126 40 P 4.2940 0.0000 0.0000 66.0528 31.2899 178.8625 41 E 3.0528 7.8165 116.6447 59.2070 29.3377 179.1517 42 E 3.9480 7.8322 118.0928 59.4434 29.0401 179.3681 43 T 3.9837 7.8532 115.7153 66.4647 68.5337 176.4382 44 A 4.0672 8.1485 122.8582 55.3052 18.4753 179.8401 45 V 3.5609 7.6965 116.6312 66.0831 31.5486 178.1701 46 R 4.0381 8.1219 118.3693 59.6708 29.8555 178.3599 47 E 3.9909 8.6606 118.8224 59.3540 29.4230 179.5624 48 V 3.6536 7.9832 118.3921 65.6008 31.5566 177.8324 49 W 4.5991 8.3123 129.3725 60.2290 30.4081 177.7872 50 E 3.6732 8.7128 117.3471 59.3867 28.7921 178.8939 51 E 4.1732 8.5281 118.5166 58.0015 29.6138 178.2167 52 T 4.3874 7.3727 106.5275 59.1985 70.2895 175.7618 53 G 3.4383 8.2386 110.6513 45.0815 0.0000 172.3292 54 V 4.8368 7.6255 120.3556 61.1845 33.7148 174.3933 55 K 4.7215 9.4385 130.0623 55.1837 33.5947 175.4208 56 G 4.5584 8.7300 113.3649 44.3621 0.0000 171.0508 57 E 4.7958 8.7381 121.5540 53.9838 32.1285 175.1195 58 I 4.2987 8.3851 127.9022 61.6662 37.3284 175.5148 59 L 4.2973 8.9688 127.1513 56.4934 43.0255 175.8485 60 D 4.6236 7.6275 115.5837 53.8890 44.9631 173.5319 61 Y 4.7309 8.7468 122.8087 56.9041 39.0589 174.9615 62 I 3.6562 8.4049 128.9481 62.1813 37.5997 176.9239 63 G 3.4262 5.9556 106.8657 45.6303 0.0000 170.3707 64 E 5.4008 8.4231 118.8283 54.4379 33.0190 175.5039 65 I 4.8249 8.8348 118.0053 59.4705 41.0651 173.8717 66 H 5.3271 8.6923 120.3900 54.5304 32.0427 172.3617 67 Y 5.1022 8.1210 118.0003 56.2445 41.4045 173.2551 68 W 5.5844 9.2330 120.2464 55.6701 32.7280 174.2219 69 Y 5.1304 8.8933 118.0829 56.6230 41.2570 173.4077 70 T 5.1295 8.7150 116.9297 61.8482 71.1603 173.9763 71 L 4.6225 8.6818 127.3293 54.3479 44.8899 176.3128 72 K 3.9741 9.8429 126.2894 57.6919 29.5537 176.2556 73 G 3.9692 8.5367 103.9023 45.6372 0.0000 173.6039 74 E 4.7213 7.9592 119.1757 54.1958 32.1745 175.1018 75 R 4.8113 8.5073 121.5536 55.7613 31.3713 175.7984 76 I 4.4603 8.9103 125.0559 59.3320 40.4210 174.1888 77 F 4.1407 8.3366 128.7405 56.2575 40.9154 174.3326 78 K 4.8209 7.9215 127.0868 54.5746 35.6344 174.8046 79 T 4.6829 8.2734 115.4615 59.7629 72.7300 172.7999 80 V 4.7061 8.5785 122.7503 61.2321 34.9137 174.1466 81 K 4.9612 8.7300 127.5489 55.3941 34.1443 175.1492 82 Y 5.1651 8.8550 121.9148 56.3533 41.3675 174.2542 83 Y 5.1092 8.7355 120.3975 55.9757 41.8259 174.6074 84 L 4.8300 9.0360 126.1692 55.2090 43.5059 175.5409 85 M 5.5467 9.2485 125.0124 53.3439 36.7331 174.2944 86 K 5.1865 8.7450 119.8199 54.8964 35.7521 175.0233 87 Y 4.5716 9.1044 124.5828 58.7526 39.4516 176.2207 88 K 4.1820 7.4758 122.9150 56.9442 35.1267 175.7603 89 E 4.4923 6.5271 115.0219 56.5108 32.0497 176.4128 90 G 4.4978 9.5153 104.6723 46.5077 0.0000 172.1254 91 E 4.8339 8.2485 119.3837 53.1593 32.3314 173.2478 92 P 4.4239 0.0000 0.0000 63.5750 32.3247 176.1549 93 R 4.5801 9.5055 125.3645 53.7072 34.1258 173.4933 94 P 4.9858 0.0000 0.0000 62.4412 32.0225 176.1866 95 S 4.4181 8.2442 116.1633 56.6942 65.1400 174.8711 96 W 4.3576 8.6581 119.0442 59.6633 29.0525 178.0638 97 E 4.1242 8.1151 117.9351 58.9042 29.0018 177.6041 98 V 4.3728 6.8939 108.7366 59.3897 33.7606 176.2630 99 K 4.1252 8.3665 121.5522 59.4961 32.6697 176.3779 100 D 4.5206 7.5935 117.0879 53.8162 44.9236 174.3129 101 A 5.0995 8.4072 122.3951 50.7636 21.7531 175.5225 102 K 4.3371 9.2566 123.1234 55.2498 36.3168 174.4905 103 F 4.8595 8.2322 123.3120 56.5692 40.3107 175.3093 104 F 5.0565 9.1142 121.0587 54.8121 43.1500 173.0252 105 P 4.6500 0.0000 0.0000 62.5685 32.2831 177.1803 106 I 4.0564 8.2854 123.2436 64.9060 36.5043 178.3989 107 K 3.9018 8.2541 119.4991 59.8545 31.9337 178.1470 108 E 4.1177 8.1938 118.5843 58.8582 29.6488 178.2758 109 A 3.6394 8.2587 121.3578 55.0921 18.2279 179.6870 110 K 4.0004 8.0684 115.6661 59.4414 32.1151 179.1576 111 K 4.0447 7.1222 119.7492 59.2569 32.2201 178.6666 112 L 3.8950 7.3385 118.2491 56.5986 41.9398 178.0764 113 L 3.7846 6.9814 117.3656 55.2980 42.2565 176.1038 114 K 4.1720 8.1441 121.6609 57.8754 34.2529 176.8374 115 Y 4.3119 6.9670 116.6827 57.6776 39.2285 176.8825 116 K 4.0318 9.0344 125.3921 59.6791 32.1913 179.1926 117 G 3.6475 8.0789 105.4861 47.8938 0.0000 175.2696 118 D 4.5143 8.1971 121.1098 56.9640 40.8462 178.9194 119 K 4.1123 8.1849 118.9277 59.6007 32.1344 179.2097 120 E 4.0022 8.2920 118.7361 59.5942 29.3538 179.5938 121 I 3.6411 7.9805 119.8706 64.1979 37.0967 178.2953 122 F 4.4702 8.7818 121.9649 61.4228 39.1535 176.9681 123 E 3.8405 8.4755 118.2662 59.4809 29.3112 179.5789 124 K 3.9297 8.0533 118.1551 59.3304 32.0707 179.3112 125 A 4.0422 8.1169 121.2562 55.1295 18.0731 179.7204 126 L 3.7645 7.6690 116.7014 57.6178 41.3789 179.6294 127 K 4.0785 7.7401 118.7493 59.3411 31.8825 179.2666 128 L 4.0728 8.0121 120.5146 57.7464 41.9655 178.8514 129 K 4.0002 8.1332 119.9803 59.4308 31.8065 178.4834 130 E 3.9533 7.6577 117.4679 59.1633 29.3908 178.0253 131 K 3.6922 7.5179 119.2664 58.7287 32.2163 175.9173 132 F 4.8554 8.5376 115.8891 55.2356 41.5416 175.7339 133 K 4.0374 8.6363 119.6058 58.1869 31.7261 174.3533 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 M 8.30 4.40 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.55 0.00 2 K 8.51 4.00 0.00 1.98 1.62 0.00 1.54 0.00 0.00 1.79 0.00 0.00 2.92 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.46 1.54 7.81 3 K 9.29 5.02 0.00 1.19 1.45 0.00 1.55 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.58 7.81 4 E 9.47 4.50 0.00 1.82 1.87 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 2.21 2.24 0.00 5 F 8.64 5.36 0.00 2.85 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 6 S 9.19 5.41 0.00 3.63 3.80 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 7 A 8.89 4.97 1.29 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 0.00 0.00 8 G 9.07 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 0.00 0.00 0.00 9 G 8.99 4.66 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 0.00 10 V 8.70 4.16 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 0.79 0.00 0.00 0.08 0.00 0.00 11 L 8.21 5.24 0.00 1.86 1.58 1.10 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 12 F 9.24 5.61 0.00 3.08 2.98 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 13 K 9.32 4.41 0.00 1.40 0.74 0.00 0.68 0.00 0.00 0.91 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.94 0.94 7.81 14 D 9.60 4.36 0.00 2.71 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 15 G 8.06 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 16 E 8.04 5.45 0.00 2.05 1.98 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 2.27 2.21 0.00 17 V 8.77 4.79 1.96 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 0.94 0.00 0.00 0.76 0.00 0.00 18 L 8.60 4.21 0.00 1.02 1.48 0.36 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.95 5.28 0.00 1.89 1.78 0.69 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 20 I 8.91 5.05 1.82 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.34 0.91 0.00 0.00 21 K 7.93 4.18 0.00 0.79 1.07 0.00 0.97 0.00 0.00 1.32 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.85 0.40 7.81 22 T 8.53 4.50 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 1.23 0.00 0.00 23 P 0.00 4.47 0.00 2.03 2.13 0.00 3.63 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.20 0.00 24 S 7.84 4.34 0.00 3.85 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 25 N 8.38 4.20 0.00 2.76 2.89 0.00 0.00 6.80 7.63 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 26 V 6.85 4.08 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 0.56 0.00 0.00 0.82 0.00 0.00 27 W 8.57 4.77 0.00 2.99 2.95 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 0.00 0.00 0.00 28 S 9.11 4.22 0.00 3.90 3.73 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 29 F 8.43 5.25 0.00 3.20 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 30 P 0.00 4.75 0.00 2.18 2.12 0.00 4.31 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 2.18 1.99 0.00 31 K 8.52 4.96 0.00 1.78 1.85 0.00 1.68 0.00 0.00 1.92 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.50 7.81 32 G 8.53 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 0.00 0.00 0.00 0.00 33 N 8.83 4.85 0.00 2.74 2.74 0.00 0.00 7.01 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 34 I 8.36 4.27 2.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.34 0.94 0.00 0.00 35 E 8.92 4.14 0.00 2.15 1.87 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 2.34 2.43 0.00 36 P 0.00 4.42 0.00 2.02 1.99 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 37 G 9.10 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 38 E 7.74 4.70 0.00 1.98 1.92 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 2.22 2.24 0.00 39 K 9.03 4.25 0.00 1.76 1.84 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.56 7.81 40 P 0.00 4.29 0.00 2.33 2.26 0.00 3.59 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.24 0.00 41 E 7.82 3.05 0.00 1.79 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 2.13 1.58 0.00 42 E 7.83 3.95 0.00 2.07 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 2.33 2.32 0.00 43 T 7.85 3.98 4.42 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 1.32 0.00 0.00 44 A 8.15 4.07 1.48 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 0.00 0.00 45 V 7.70 3.56 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 0.95 0.00 0.00 0.93 0.00 0.00 46 R 8.12 4.04 0.00 2.04 2.16 0.00 3.33 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 1.79 1.81 0.00 47 E 8.66 3.99 0.00 2.12 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 2.48 2.59 0.00 48 V 7.98 3.65 2.34 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 1.13 0.00 0.00 1.08 0.00 0.00 49 W 8.31 4.60 0.00 3.47 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 50 E 8.71 3.67 0.00 2.01 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 2.37 2.60 0.00 51 E 8.53 4.17 0.00 2.06 1.96 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 2.31 2.61 0.00 52 T 7.37 4.39 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 1.17 0.00 0.00 53 G 8.24 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 54 V 7.63 4.84 2.23 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 1.34 0.00 0.00 1.12 0.00 0.00 55 K 9.44 4.72 0.00 1.75 1.54 0.00 1.35 0.00 0.00 1.00 0.00 0.00 2.79 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.10 1.28 7.81 56 G 8.73 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.74 4.80 0.00 2.01 1.77 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 2.18 2.23 0.00 58 I 8.39 4.30 1.83 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.61 1.00 0.00 0.00 59 L 8.97 4.30 0.00 0.97 0.30 0.46 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 60 D 7.63 4.62 0.00 2.93 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 61 Y 8.75 4.73 0.00 3.10 2.95 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 0.00 0.00 0.00 62 I 8.40 3.66 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.65 0.81 0.00 0.00 63 G 5.96 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 0.00 0.00 0.00 64 E 8.42 5.40 0.00 2.09 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 2.23 2.36 0.00 65 I 8.83 4.82 2.07 0.00 0.00 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 1.73 0.86 1.03 0.00 0.00 66 H 8.69 5.33 0.00 3.13 3.24 0.00 5.76 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 67 Y 8.12 5.10 0.00 3.14 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 68 W 9.23 5.58 0.00 3.24 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 69 Y 8.89 5.13 0.00 3.16 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 0.00 70 T 8.71 5.13 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 1.31 0.00 0.00 71 L 8.68 4.62 0.00 1.79 1.42 1.03 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 72 K 9.84 3.97 0.00 1.93 1.87 0.00 1.88 0.00 0.00 1.73 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.45 7.81 73 G 8.54 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 74 E 7.96 4.72 0.00 2.11 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 0.00 2.22 2.41 0.00 75 R 8.51 4.81 0.00 1.84 2.17 0.00 3.20 0.00 0.00 2.97 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 76 I 8.91 4.46 0.74 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.52 0.78 0.00 0.00 77 F 8.34 4.14 0.00 1.51 2.41 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 78 K 7.92 4.82 0.00 1.63 0.90 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.70 1.34 7.81 79 T 8.27 4.68 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 0.06 0.00 0.00 80 V 8.58 4.71 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 0.41 0.00 0.00 0.96 0.00 0.00 81 K 8.73 4.96 0.00 1.77 1.70 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.49 1.36 7.81 82 Y 8.86 5.17 0.00 2.70 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 83 Y 8.74 5.11 0.00 2.98 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 84 L 9.04 4.83 0.00 1.81 1.67 1.20 0.81 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 85 M 9.25 5.55 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.52 0.00 86 K 8.74 5.19 0.00 1.86 1.88 0.00 1.36 0.00 0.00 1.58 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.38 7.81 87 Y 9.10 4.57 0.00 3.29 2.95 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 0.00 0.00 0.00 88 K 7.48 4.18 0.00 1.59 1.58 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.28 1.40 7.81 89 E 6.53 4.49 0.00 1.96 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 1.95 1.94 0.00 90 G 9.52 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 0.00 0.00 0.00 0.00 91 E 8.25 4.83 0.00 2.01 1.84 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 2.20 2.40 0.00 92 P 0.00 4.42 0.00 1.96 1.90 0.00 3.80 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.16 0.00 93 R 9.51 4.58 0.00 1.47 1.64 0.00 3.21 0.00 0.00 3.16 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 94 P 0.00 4.99 0.00 2.11 1.84 0.00 3.25 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.71 0.00 95 S 8.24 4.42 0.00 3.88 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 0.00 96 W 8.66 4.36 0.00 3.27 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 97 E 8.12 4.12 0.00 1.93 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 2.40 2.45 0.00 98 V 6.89 4.37 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 0.65 0.00 0.00 0.93 0.00 0.00 99 K 8.37 4.13 0.00 1.55 1.69 0.00 1.78 0.00 0.00 1.50 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.28 7.81 100 D 7.59 4.52 0.00 2.51 2.22 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 0.00 101 A 8.41 5.10 1.13 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 0.00 102 K 9.26 4.34 0.00 1.71 1.18 0.00 1.47 0.00 0.00 1.11 0.00 0.00 2.35 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.30 1.04 7.81 103 F 8.23 4.86 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 0.00 104 F 9.11 5.06 0.00 2.78 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 0.00 105 P 0.00 4.65 0.00 2.24 2.03 0.00 3.97 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 106 I 8.29 4.06 2.02 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.39 1.06 0.00 0.00 107 K 8.25 3.90 0.00 1.85 1.85 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.53 7.81 108 E 8.19 4.12 0.00 2.03 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 1.90 2.12 0.00 109 A 8.26 3.64 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 0.00 110 K 8.07 4.00 0.00 1.97 2.00 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.91 2.04 7.81 111 K 7.12 4.04 0.00 1.86 1.73 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.44 7.81 112 L 7.34 3.90 0.00 1.34 1.36 -0.98 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 113 L 6.98 3.78 0.00 1.51 1.47 0.64 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 114 K 8.14 4.17 0.00 1.37 1.13 0.00 1.54 0.00 0.00 1.16 0.00 0.00 2.88 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.83 1.18 7.81 115 Y 6.97 4.31 0.00 3.16 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 0.00 116 K 9.03 4.03 0.00 1.86 1.86 0.00 1.76 0.00 0.00 1.85 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.56 7.81 117 G 8.08 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 0.00 0.00 0.00 0.00 118 D 8.20 4.51 0.00 2.89 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 0.00 119 K 8.18 4.11 0.00 2.03 1.92 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.67 7.81 120 E 8.29 4.00 0.00 2.18 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 2.36 2.72 0.00 121 I 7.98 3.64 1.82 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 1.48 0.35 0.31 0.00 0.00 122 F 8.78 4.47 0.00 3.43 3.34 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 0.00 123 E 8.48 3.84 0.00 2.19 1.96 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 2.58 2.52 0.00 124 K 8.05 3.93 0.00 1.94 1.79 0.00 1.60 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.58 7.81 125 A 8.12 4.04 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 0.00 126 L 7.67 3.76 0.00 1.58 1.55 0.38 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 127 K 7.74 4.08 0.00 1.86 1.82 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.55 7.81 128 L 8.01 4.07 0.00 1.93 1.71 0.99 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 129 K 8.13 4.00 0.00 1.77 1.79 0.00 0.61 0.00 0.00 0.91 0.00 0.00 2.46 0.00 0.00 2.25 0.00 0.00 0.00 0.00 1.21 1.17 7.81 130 E 7.66 3.95 0.00 2.09 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 2.29 2.45 0.00 131 K 7.52 3.69 0.00 1.71 1.23 0.00 1.16 0.00 0.00 1.50 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.07 1.26 7.81 132 F 8.54 4.86 0.00 2.98 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 0.00 133 K 8.64 4.04 0.00 1.97 1.85 0.00 1.60 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.19 1.18 7.81