NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2358 8.4449 121.4630 56.1621 30.2715 175.0291 3 H 4.2242 8.6621 115.1102 53.8680 29.4218 169.7656 4 V 4.4192 8.4373 123.8411 59.8126 35.3465 174.4008 5 A 4.5548 8.3234 125.8280 50.4456 20.0727 176.3266 6 F 2.9587 8.5720 123.3559 59.7285 39.5725 175.6908 7 G 3.4835 7.4673 114.9881 45.1940 0.0000 173.6118 8 S 4.1232 7.3393 116.4165 58.0914 63.3302 175.2693 9 E 3.9746 8.7739 124.8540 58.4588 29.6965 177.0259 10 D 4.9726 7.7155 117.6750 52.4300 40.2180 177.5888 11 I 3.4573 7.5993 122.7612 65.2170 37.7118 176.8840 12 E 4.0788 8.1011 117.5955 58.9855 29.3317 178.8608 13 N 4.3672 8.0342 117.3893 56.5426 38.8680 177.1548 14 T 4.0061 7.7320 116.5712 66.7492 68.6823 176.6887 15 L 4.0231 8.0113 120.2208 57.1662 41.3065 179.1984 16 A 4.2678 7.7786 119.9388 54.7896 18.3593 178.8536 17 K 4.2271 7.7498 114.1877 56.4896 32.8581 176.6368 18 M 4.5024 7.4682 120.0688 53.8420 33.6232 176.5629 19 D 4.7957 8.2479 122.8004 52.3649 42.9021 176.8483 20 D 4.4885 8.6328 118.1839 57.8045 40.5450 179.1593 21 G 3.6218 8.0557 104.2114 47.8169 0.0000 175.3346 22 Q 4.1062 8.2792 119.9628 58.6910 28.9887 178.2235 23 L 3.9161 8.2935 121.7358 58.4515 41.8527 178.7889 24 D 4.5567 8.4561 118.0564 56.5085 40.7923 177.9033 25 G 3.8433 7.6327 104.1017 43.8905 0.0000 174.0756 26 L 3.8633 6.9484 121.0821 54.3356 42.0606 178.0085 27 A 4.0676 8.0950 123.5259 53.6925 18.7638 177.2415 28 F 5.1340 6.3793 110.2172 54.3232 41.4787 175.3385 29 G 4.2820 9.5348 107.2966 46.0094 0.0000 172.6273 30 A 5.5291 9.5150 124.9180 50.2919 22.7360 175.0211 31 I 5.0250 9.0740 123.4134 59.4431 41.2040 174.3055 32 Q 4.7175 8.9048 127.4378 54.1663 31.2641 174.1997 33 L 5.3307 8.9446 126.1646 52.9290 45.5614 176.3981 34 D 5.5674 8.3275 121.4729 51.5057 41.0500 177.5214 35 G 3.6454 9.2109 107.9845 48.3963 0.0000 174.2525 36 D 4.7101 8.5079 117.4960 54.2714 41.3736 177.1416 37 G 4.0453 8.8862 108.6909 45.5228 0.0000 173.2307 38 N 4.9173 8.4796 117.6978 52.7533 39.3380 174.3312 39 I 4.2938 8.5769 123.9105 61.3649 37.6268 176.5425 40 L 4.2320 9.1384 128.2248 56.6307 42.5874 177.3323 41 Q 4.7335 7.7051 115.3144 54.6761 33.7458 174.0905 42 Y 5.0019 8.4492 121.9617 57.0627 41.7079 173.9805 43 N 5.0125 8.8519 125.1271 51.7167 39.7297 176.2420 44 A 4.0709 9.0513 120.4921 55.2258 18.0567 179.7632 45 A 3.9689 7.9041 118.0612 55.1703 18.8919 179.0417 46 E 4.1344 8.4039 117.5231 59.4635 29.7751 179.1153 47 G 3.9195 8.1386 105.2892 48.0447 0.0000 175.3286 48 D 4.4583 8.1017 120.0959 56.9413 40.8125 178.4057 49 I 4.0987 7.7032 120.2470 63.2750 37.4574 176.7325 50 T 4.4346 8.0098 106.5992 60.6163 70.0719 175.2095 51 G 3.9401 8.4334 110.0267 45.9132 0.0000 173.8469 52 R 4.1331 7.6139 118.2602 55.2029 31.0922 175.8419 53 D 4.5708 8.4000 121.3803 52.9043 41.4234 175.2403 54 P 4.2391 0.0000 0.0000 65.5213 31.5767 178.1059 55 K 4.1515 8.2314 116.8405 58.4843 32.0691 177.7544 56 Q 4.4131 7.6944 115.8618 56.2564 30.0183 176.9599 57 V 3.7336 7.3595 110.2943 62.2940 32.1134 176.1254 58 I 3.9014 7.4406 121.3903 62.8885 37.1912 176.0092 59 G 3.9820 9.0653 114.6633 45.2369 0.0000 173.9769 60 K 4.1864 7.8199 119.0345 55.7349 33.1377 175.2640 61 N 4.9770 8.2951 119.1246 52.2645 39.8976 175.4482 62 F 3.8245 9.0823 129.0698 61.2770 39.5998 177.1948 63 F 3.7340 7.5627 117.2038 59.5103 39.1700 176.8443 64 K 4.0304 8.3561 121.1404 58.4291 32.3695 176.8275 65 D 4.6484 7.8624 116.0027 55.5428 42.7756 177.7462 66 V 3.6585 7.4860 116.6530 64.6797 32.5312 175.9218 67 A 4.3401 7.3068 121.0928 49.6049 18.5158 174.8560 68 P 4.1353 0.0000 0.0000 64.8868 32.0044 179.2559 69 C 4.2619 7.8155 112.8610 60.4098 29.8663 174.1380 70 T 4.2655 7.6849 109.6298 61.1320 68.7831 174.1893 71 D 5.2128 7.7654 123.3783 53.0707 39.7089 174.8892 72 S 4.7397 7.9854 117.0809 56.2452 65.4008 175.0848 73 P 4.2117 0.0000 0.0000 65.7417 31.2241 178.7829 74 E 4.0287 8.2550 116.2728 58.1564 29.2010 175.8164 75 F 4.4139 7.3132 117.5637 58.4418 42.2908 175.6559 76 Y 4.1116 8.9874 120.5164 60.8515 38.8425 179.1848 77 G 3.5628 8.3293 108.0417 47.2317 0.0000 175.8578 78 K 4.2772 7.9250 121.9310 58.3061 32.0055 179.0215 79 F 4.1771 8.5709 121.3881 61.3445 39.4040 177.4356 80 K 3.7440 8.3767 118.6484 59.7946 32.1166 178.8703 81 E 3.9523 8.2083 119.9795 59.2497 29.4628 179.5825 82 G 3.6873 8.0394 105.6898 46.4052 0.0000 176.0094 83 V 3.0912 7.2802 119.8304 65.6180 31.4910 177.7249 84 A 4.0725 7.6498 119.4270 55.1736 18.4579 179.5224 85 S 4.2339 8.3074 112.5435 59.3844 63.0545 176.1983 86 G 4.0386 7.9837 109.4957 45.5463 0.0000 172.8452 87 N 4.9857 7.5374 116.2957 52.3971 39.3382 174.5933 88 L 4.0480 7.8617 121.3520 55.7626 43.6551 175.7803 89 N 5.0517 8.6248 121.1181 53.5850 40.4816 172.7400 90 T 4.8946 9.1989 119.6715 60.6084 71.6370 171.9554 91 M 5.4244 8.4926 125.6945 53.8063 35.9525 174.3745 92 F 4.8953 8.3506 115.7277 56.3133 41.7339 172.9731 93 E 4.9257 8.9890 119.1929 56.4675 30.8978 174.8100 94 Y 4.7946 8.6779 121.3945 57.3948 43.2700 172.9895 95 T 4.8100 7.9583 118.7156 61.7634 71.3156 173.5637 96 F 5.4275 9.2463 126.1183 55.9699 40.7948 176.6928 97 D 4.9118 8.8110 120.2289 53.6776 39.7361 173.8599 98 Y 4.5029 8.2119 122.0429 57.6856 39.3682 175.3405 99 Q 3.2056 8.1811 127.4814 56.1367 26.4937 173.0557 100 M 4.6469 7.0647 108.6338 54.3013 34.3618 174.4949 101 T 3.9846 8.3266 116.8653 62.8629 69.1627 172.7218 102 P 4.6340 0.0000 0.0000 63.6869 32.0605 175.8133 103 T 4.6627 9.0247 120.8021 61.5529 72.4109 173.4592 104 K 4.6018 8.6827 126.2212 56.4155 33.6348 176.5368 105 V 4.8472 8.9342 117.0567 59.5901 36.8598 173.8908 106 K 4.8989 8.7847 123.2485 54.6997 34.7101 174.9065 107 V 4.9882 8.6473 126.6162 61.2720 34.8403 173.6132 108 H 5.2399 9.3123 126.5833 54.8003 32.7292 171.6464 109 M 5.1009 9.1191 126.2013 53.7218 34.5695 175.2367 110 K 5.1143 8.9656 123.6381 54.5617 36.3219 175.0436 111 K 4.3660 9.0275 129.1800 56.9897 32.6197 176.3642 112 A 4.6061 8.1810 128.8443 51.4662 19.0130 177.7393 113 L 4.0978 8.6693 119.3453 57.5569 42.0606 178.8100 114 S 4.3157 7.8207 111.6670 57.3369 63.7748 174.0601 115 G 3.4729 8.4186 111.2215 47.0668 0.0000 173.1347 116 D 4.3748 8.6683 122.3601 55.0282 39.8515 172.9771 117 S 4.7868 6.6406 113.1264 57.1332 68.1438 174.4097 118 Y 4.8846 8.6814 120.8832 56.1452 42.1689 174.4160 119 W 4.9224 9.3617 124.4974 55.7229 31.3099 175.5789 120 V 4.5320 8.8021 123.6553 61.2743 33.5198 174.1345 121 F 5.7888 9.1677 127.2808 56.0265 41.8340 175.1489 122 V 5.2487 9.3874 121.7001 61.3281 35.1555 174.1622 123 K 4.9310 8.7230 125.1997 54.9186 36.3010 175.8551 124 R 4.4693 8.5194 120.1626 56.3554 31.0443 177.2858 125 V 3.9325 7.9880 114.3981 61.6356 32.2948 175.6973 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 2 E 8.44 4.24 0.00 1.93 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 2.20 2.33 0.00 3 H 8.66 4.22 0.00 3.28 3.22 0.00 5.70 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 V 8.44 4.42 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 0.76 0.00 0.00 0.87 0.00 0.00 5 A 8.32 4.55 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 6 F 8.57 2.96 0.00 2.62 2.78 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 7 G 7.47 3.48 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 0.00 8 S 7.34 4.12 0.00 3.74 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 9 E 8.77 3.97 0.00 1.88 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 0.00 2.27 2.23 0.00 10 D 7.72 4.97 0.00 2.80 2.79 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 11 I 7.60 3.46 1.65 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 0.89 0.92 0.77 0.00 0.00 12 E 8.10 4.08 0.00 2.45 2.36 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 2.43 2.44 0.00 13 N 8.03 4.37 0.00 2.95 2.92 0.00 0.00 7.02 7.48 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 14 T 7.73 4.01 4.28 0.00 0.00 0.00 0.00 0.00 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 15 L 8.01 4.02 0.00 1.39 1.33 0.26 0.58 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 16 A 7.78 4.27 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 0.00 0.00 0.00 0.00 0.00 17 K 7.75 4.23 0.00 1.84 1.88 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.69 7.81 18 M 7.47 4.50 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.44 0.00 19 D 8.25 4.80 0.00 2.92 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 20 D 8.63 4.49 0.00 2.77 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 21 G 8.06 3.62 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 0.00 0.00 0.00 22 Q 8.28 4.11 0.00 2.41 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.53 0.00 23 L 8.29 3.92 0.00 1.94 1.86 1.01 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.46 4.56 0.00 2.87 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 25 G 7.63 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 0.00 0.00 0.00 26 L 6.95 3.86 0.00 1.22 0.44 0.57 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.09 4.07 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 28 F 6.38 5.13 0.00 3.45 3.09 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 0.00 0.00 0.00 0.00 29 G 9.53 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.51 5.53 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 31 I 9.07 5.02 1.66 0.00 0.00 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 0.65 0.43 0.81 0.00 0.00 32 Q 8.90 4.72 0.00 1.17 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.72 0.00 0.00 0.00 0.00 0.00 1.74 1.16 0.00 33 L 8.94 5.33 0.00 1.78 1.60 0.25 0.63 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 34 D 8.33 5.57 0.00 3.23 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 35 G 9.21 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 36 D 8.51 4.71 0.00 2.91 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 37 G 8.89 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 38 N 8.48 4.92 0.00 3.10 2.75 0.00 0.00 7.03 6.91 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 39 I 8.58 4.29 2.02 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 1.27 0.86 1.03 0.00 0.00 40 L 9.14 4.23 0.00 1.44 1.63 0.81 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 7.71 4.73 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.27 0.00 42 Y 8.45 5.00 0.00 2.95 2.78 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 43 N 8.85 5.01 0.00 3.03 3.00 0.00 0.00 6.43 7.38 0.00 0.00 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 A 9.05 4.07 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 45 A 7.90 3.97 1.30 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 0.00 0.00 0.00 46 E 8.40 4.13 0.00 1.95 1.54 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 0.00 1.47 2.20 0.00 47 G 8.14 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 0.00 0.00 0.00 48 D 8.10 4.46 0.00 2.89 2.78 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 49 I 7.70 4.10 2.15 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 1.64 0.70 1.08 0.00 0.00 50 T 8.01 4.43 4.36 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 1.50 0.00 0.00 51 G 8.43 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 0.00 0.00 0.00 52 R 7.61 4.13 0.00 1.86 1.64 0.00 3.27 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 53 D 8.40 4.57 0.00 2.69 2.50 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 54 P 0.00 4.24 0.00 2.18 2.61 0.00 3.78 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.41 0.00 55 K 8.23 4.15 0.00 1.76 1.87 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.56 7.81 56 Q 7.69 4.41 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.95 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 57 V 7.36 3.73 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 0.54 0.00 0.00 0.04 0.00 0.00 58 I 7.44 3.90 1.85 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 1.47 0.75 0.96 0.00 0.00 59 G 9.07 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 0.00 0.00 0.00 60 K 7.82 4.19 0.00 1.90 1.67 0.00 1.56 0.00 0.00 1.50 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.39 7.81 61 N 8.30 4.98 0.00 2.79 2.63 0.00 0.00 6.51 7.71 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 62 F 9.08 3.82 0.00 2.72 2.26 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 63 F 7.56 3.73 0.00 2.46 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 0.00 0.00 0.00 0.00 64 K 8.36 4.03 0.00 1.66 1.74 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.35 7.81 65 D 7.86 4.65 0.00 2.69 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 66 V 7.49 3.66 1.76 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 0.66 0.00 0.00 0.81 0.00 0.00 67 A 7.31 4.34 -0.18 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 0.00 0.00 0.00 68 P 0.00 4.14 0.00 1.87 1.92 0.00 3.35 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.57 0.00 69 C 7.82 4.26 0.00 3.23 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 70 T 7.68 4.27 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 0.58 0.00 0.00 71 D 7.77 5.21 0.00 2.75 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 72 S 7.99 4.74 0.00 4.28 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 73 P 0.00 4.21 0.00 2.21 2.13 0.00 3.65 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 74 E 8.25 4.03 0.00 2.24 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 0.00 2.40 2.38 0.00 75 F 7.31 4.41 0.00 2.66 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 76 Y 8.99 4.11 0.00 2.89 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 77 G 8.33 3.56 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 78 K 7.92 4.28 0.00 1.91 1.88 0.00 1.47 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.45 1.36 7.81 79 F 8.57 4.18 0.00 3.41 3.32 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 80 K 8.38 3.74 0.00 1.83 1.85 0.00 1.20 0.00 0.00 1.38 0.00 0.00 2.79 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.12 1.48 7.81 81 E 8.21 3.95 0.00 2.14 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 2.26 2.41 0.00 82 G 8.04 3.69 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 0.00 0.00 0.00 83 V 7.28 3.09 1.67 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 0.53 0.00 0.00 -0.78 0.00 0.00 84 A 7.65 4.07 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.31 4.23 0.00 4.04 4.10 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 86 G 7.98 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 87 N 7.54 4.99 0.00 2.63 2.73 0.00 0.00 7.03 7.78 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 88 L 7.86 4.05 0.00 1.85 1.67 0.94 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 89 N 8.62 5.05 0.00 2.75 2.71 0.00 0.00 6.93 7.70 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 90 T 9.20 4.89 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 1.41 0.00 0.00 91 M 8.49 5.42 0.00 1.87 1.90 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 92 F 8.35 4.90 0.00 3.11 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 93 E 8.99 4.93 0.00 1.97 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 2.30 2.35 0.00 94 Y 8.68 4.79 0.00 3.41 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 95 T 7.96 4.81 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 1.26 0.00 0.00 96 F 9.25 5.43 0.00 3.03 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 97 D 8.81 4.91 0.00 2.78 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 98 Y 8.21 4.50 0.00 2.95 2.83 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 0.00 0.00 0.00 99 Q 8.18 3.21 0.00 1.81 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.52 0.00 0.00 0.00 0.00 0.00 1.68 1.16 0.00 100 M 7.06 4.65 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.75 0.00 101 T 8.33 3.98 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 1.23 0.00 0.00 102 P 0.00 4.63 0.00 1.96 2.06 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.17 0.00 103 T 9.02 4.66 4.36 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 1.25 0.00 0.00 104 K 8.68 4.60 0.00 1.69 1.70 0.00 1.60 0.00 0.00 1.81 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.47 7.81 105 V 8.93 4.85 1.91 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 0.55 0.00 0.00 0.16 0.00 0.00 106 K 8.78 4.90 0.00 1.66 1.33 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.35 7.81 107 V 8.65 4.99 0.74 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 0.40 0.00 0.00 0.89 0.00 0.00 108 H 9.31 5.24 0.00 2.79 2.80 0.00 5.63 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 M 9.12 5.10 0.00 2.15 2.08 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 2.52 2.56 0.00 110 K 8.97 5.11 0.00 1.72 1.76 0.00 1.72 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.62 7.81 111 K 9.03 4.37 0.00 1.94 1.78 0.00 2.05 0.00 0.00 1.72 0.00 0.00 2.71 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.26 7.81 112 A 8.18 4.61 0.96 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 0.00 0.00 113 L 8.67 4.10 0.00 1.70 1.77 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 114 S 7.82 4.32 0.00 3.93 3.85 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 0.00 115 G 8.42 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.67 4.37 0.00 2.86 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 0.00 117 S 6.64 4.79 0.00 3.51 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 0.00 118 Y 8.68 4.88 0.00 3.21 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 0.00 119 W 9.36 4.92 0.00 2.87 1.74 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 0.00 120 V 8.80 4.53 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 1.22 0.00 0.00 0.90 0.00 0.00 121 F 9.17 5.79 0.00 2.87 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 0.00 122 V 9.39 5.25 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 1.24 0.00 0.00 1.31 0.00 0.00 123 K 8.72 4.93 0.00 1.58 1.45 0.00 1.00 0.00 0.00 0.83 0.00 0.00 2.22 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 0.87 7.81 124 R 8.52 4.47 0.00 1.68 1.87 0.00 3.15 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 125 V 7.99 3.93 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 0.57 0.00 0.00 0.90 0.00 0.00