NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3143 8.1633 120.2084 55.1355 34.0984 173.8088 2 F 4.9054 8.5270 121.6703 55.3445 41.8302 173.0208 3 T 5.3506 9.5819 118.1636 60.6462 71.7813 171.9612 4 A 5.3153 9.1634 128.0754 50.0485 22.9093 174.8793 5 K 5.2464 8.6752 120.7303 53.1587 36.0766 175.3774 6 L 4.2538 9.0404 127.5689 55.2518 41.8706 177.4918 7 I 4.1485 8.2664 117.3789 61.2674 39.4561 176.6783 8 K 4.0696 8.2874 121.9216 57.4796 32.7998 176.2555 9 G 4.3842 7.4204 107.7106 44.3573 0.0000 171.8844 10 K 4.5785 8.5713 113.5467 58.0377 37.2935 176.9645 11 T 5.0917 7.8193 116.2394 62.7723 72.0362 172.9012 12 Y 4.7003 9.7691 128.0810 55.8115 42.7845 173.6047 13 N 5.3417 8.2415 123.2700 51.7931 40.5035 174.8476 14 V 4.1278 9.2275 126.1570 61.9346 30.9279 173.5389 15 M 3.3434 8.3834 127.8497 55.7187 31.7766 176.7558 16 G 4.1462 7.8255 104.6823 45.1383 0.0000 171.5131 17 I 4.2143 8.2353 121.5399 59.4377 39.0633 174.6481 18 T 4.9151 8.0165 120.8828 62.1330 69.9374 173.7201 19 F 5.1338 9.4440 126.0720 55.8935 42.1474 175.3075 20 R 5.2305 8.5842 118.9972 53.9455 34.4929 174.7647 21 A 4.8610 8.1617 125.8138 53.5605 18.6585 178.2122 22 G 3.9290 9.2378 111.9597 44.6872 0.0000 173.0091 23 V 4.3079 8.0490 120.8175 61.3998 32.9279 174.9148 24 S 5.0590 8.7266 124.7152 58.1668 64.1380 173.7020 25 Q 4.7383 9.2419 124.8628 54.2950 32.5716 174.0673 26 T 4.7781 8.7648 116.8945 62.0409 69.4478 173.9949 27 V 4.7251 8.8200 118.7131 58.7353 35.6667 173.8520 28 P 4.6118 0.0000 0.0000 61.7933 32.3938 177.5355 29 K 2.8016 8.4639 119.9357 59.2999 31.7824 178.7209 30 K 3.8630 7.9021 118.1865 59.7427 32.1041 179.1376 31 L 4.1326 7.8207 118.3762 57.4817 41.7452 178.6694 32 Y 3.9611 7.9994 119.8317 60.8684 38.7681 178.0656 33 E 4.0040 8.2098 118.9989 58.8695 29.4352 178.4944 34 Y 4.0129 8.0102 120.0191 60.4454 38.7101 177.4135 35 L 4.2510 8.2227 117.3827 55.8063 42.0461 178.0743 36 N 4.2514 7.4858 117.0019 56.2442 38.8972 176.0368 37 E 4.1942 7.6888 119.8110 57.7083 28.6384 176.2597 38 N 4.6166 7.4590 118.3949 51.5999 38.5092 174.0455 39 P 4.6515 0.0000 0.0000 63.2326 31.4817 176.4680 40 Y 4.2440 7.8208 116.1271 59.1560 39.9004 176.3193 41 F 5.2549 7.6033 116.4467 55.4145 43.2068 174.2072 42 I 4.3641 8.8171 121.5703 59.8351 39.5281 174.2151 43 L 5.2957 8.4938 128.7681 53.4936 43.8853 176.0424 44 T 4.9861 9.0720 119.4366 62.0395 73.2318 172.7569 45 Q 4.9106 8.8571 123.3665 54.4472 31.0060 174.4547 46 E 4.6825 8.8614 121.7464 54.4528 33.8565 175.5897 47 L 4.4187 8.3236 122.5401 52.9767 42.1942 176.3191 48 N 4.3777 8.6082 122.6658 55.2842 37.6779 175.2163 49 N 4.5975 7.7177 117.9513 52.3288 37.7110 174.4225 50 Q 4.1044 8.3781 122.2811 57.6730 29.4067 176.9254 51 K 4.5481 7.7478 115.2634 54.7484 35.7385 175.0453 52 D 5.0026 8.5031 125.8078 53.1336 43.0309 175.1545 53 D 4.6166 8.9715 120.7888 52.6543 40.4127 175.6104 54 P 4.5929 0.0000 0.0000 59.3347 30.0121 175.8503 55 I 4.2634 7.2163 121.9979 60.8101 39.3927 173.7463 56 N 4.6448 7.5977 115.8775 52.0940 38.3421 172.6706 57 Y 4.7511 8.0983 120.0097 55.2041 42.6902 174.5848 58 T 3.9859 8.5058 117.7445 63.6679 69.6448 175.5558 59 E 4.1852 8.9195 124.4391 59.6964 29.3582 179.5425 60 S 4.1431 8.0179 114.9364 61.5287 62.6999 175.9108 61 E 4.1758 8.0118 120.6279 58.8749 29.3062 178.6923 62 L 4.1498 8.4166 119.0162 56.8448 41.5527 179.3357 63 K 4.2246 8.4825 118.7993 58.1682 31.9275 177.8549 64 G 4.1025 7.4243 105.8316 45.2143 0.0000 172.2376 65 M 4.4556 7.3639 119.3986 53.3312 33.8515 176.2093 66 N 4.6935 8.3712 122.9118 52.2859 41.0267 176.0688 67 K 3.8007 8.5719 121.2730 60.1789 32.1355 178.5708 68 A 4.2795 7.9422 120.0407 54.6829 18.3437 179.3544 69 E 3.9032 7.9798 118.4450 59.5303 29.8109 178.7281 70 H 4.0652 8.1523 116.1137 59.0482 28.6879 177.7785 71 E 4.0001 8.1197 119.8654 59.5104 29.5159 179.5221 72 S 4.1300 8.3818 114.6159 61.5681 62.9362 176.1631 73 I 3.8324 7.8794 123.2673 64.7334 36.9744 178.4285 74 I 3.9775 7.9497 119.7778 64.0504 36.8447 178.7999 75 S 4.3698 8.3757 116.8239 61.5888 62.3884 176.2544 76 N 4.4320 7.9324 118.3455 55.8802 38.3230 176.9127 77 L 4.1974 7.5421 121.1342 56.7697 42.1523 177.7383 78 G 4.1663 7.6962 106.2627 45.3160 0.0000 173.0465 79 R 4.6263 7.8069 117.1980 54.0126 32.5671 175.7000 80 N 4.7096 8.4191 117.5994 51.6754 37.8488 173.6115 81 P 5.0257 0.0000 0.0000 62.9243 31.6183 178.2670 82 S 4.3796 7.5678 114.5369 61.1611 63.4078 175.1892 83 D 4.1347 7.8528 119.9803 56.5389 41.1121 175.8548 84 F 4.7452 7.1761 119.0775 57.0118 38.4131 174.9590 85 K 4.3939 8.8742 125.4578 57.1840 33.8875 177.6009 86 N 4.7942 8.7625 116.1195 51.9263 41.0489 176.0210 87 A 3.9338 8.4102 124.7223 55.2507 18.5170 179.5552 88 D 4.2863 8.1252 116.0571 57.6500 41.2766 178.2271 89 E 4.0106 8.1999 118.2385 59.7464 29.6668 179.5754 90 R 3.8426 7.8072 117.4153 59.1879 30.0731 179.3227 91 I 3.8035 8.2812 119.9042 64.2762 37.2376 178.3135 92 A 3.9821 8.1506 121.7193 55.3407 17.9885 179.0678 93 Y 3.7661 7.7599 116.9496 60.8612 39.1672 178.0323 94 I 4.0099 7.7712 120.3137 64.2916 37.2503 178.3931 95 L 4.0829 8.0866 119.7405 57.3185 41.1385 179.5589 96 K 3.9296 7.4740 117.5815 59.0969 32.2725 178.6209 97 Q 4.1445 7.7770 117.7391 57.7890 28.7084 177.8585 98 I 3.7292 7.5919 118.4134 63.4404 38.1440 176.6433 99 D 4.4496 7.5915 117.5945 56.6537 41.1726 177.4024 100 N 4.6270 7.6473 115.4353 54.3446 39.7193 176.0413 101 K 4.2593 7.7355 120.4233 55.3769 30.7515 176.1086 102 G 3.8369 8.1679 111.1910 46.4704 0.0000 171.4651 103 E 4.7979 7.7560 114.9790 54.3030 32.7770 173.8824 104 L 4.5463 8.4229 116.7498 56.4857 44.2497 178.1208 105 E 4.3590 7.8029 119.1195 55.5363 27.8358 175.5255 106 H 4.5542 7.7277 116.3812 56.3030 30.6663 174.5040 107 H 4.6752 7.5517 115.2080 55.3826 30.0422 174.7385 108 H 4.4769 8.3087 118.2999 56.0224 29.5816 175.2166 109 H 4.2349 9.3971 115.8538 57.0840 28.6213 174.7054 110 H 5.0179 7.7101 114.3323 55.1888 30.5122 172.6934 111 H 4.3712 7.7801 123.3959 56.6231 29.7110 172.5288 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 8.16 4.31 0.00 1.89 2.06 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.45 0.00 2 F 8.53 4.91 0.00 3.31 2.86 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 0.00 0.00 0.00 0.00 3 T 9.58 5.35 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 1.34 0.00 0.00 4 A 9.16 5.32 0.81 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 0.00 0.00 5 K 8.68 5.25 0.00 1.94 1.70 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.47 7.81 6 L 9.04 4.25 0.00 1.88 1.57 1.06 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.27 4.15 1.83 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.52 1.01 0.00 0.00 8 K 8.29 4.07 0.00 1.53 1.80 0.00 1.57 0.00 0.00 1.55 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.16 1.37 7.81 9 G 7.42 4.38 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.57 4.58 0.00 1.66 1.80 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.42 7.81 11 T 7.82 5.09 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 12 Y 9.77 4.70 0.00 2.95 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 13 N 8.24 5.34 0.00 2.45 2.68 0.00 0.00 6.81 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 14 V 9.23 4.13 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 1.04 0.00 0.00 1.45 0.00 0.00 15 M 8.38 3.34 0.00 2.12 1.85 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 16 G 7.83 4.15 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 0.00 0.00 0.00 17 I 8.24 4.21 1.76 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 1.38 0.91 0.28 0.00 0.00 18 T 8.02 4.92 4.15 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 1.21 0.00 0.00 19 F 9.44 5.13 0.00 3.34 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 20 R 8.58 5.23 0.00 1.79 1.92 0.00 3.17 0.00 0.00 3.38 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 21 A 8.16 4.86 1.33 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 22 G 9.24 3.93 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 0.00 0.00 0.00 23 V 8.05 4.31 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 1.03 0.00 0.00 0.99 0.00 0.00 24 S 8.73 5.06 0.00 3.87 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 25 Q 9.24 4.74 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.93 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 26 T 8.76 4.78 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 27 V 8.82 4.73 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 1.06 0.00 0.00 1.11 0.00 0.00 28 P 0.00 4.61 0.00 2.16 2.00 0.00 3.65 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 29 K 8.46 2.80 0.00 1.55 1.67 0.00 1.76 0.00 0.00 1.79 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.13 7.81 30 K 7.90 3.86 0.00 1.80 1.82 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.51 7.81 31 L 7.82 4.13 0.00 1.73 1.76 0.97 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 8.00 3.96 0.00 2.84 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 33 E 8.21 4.00 0.00 2.10 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 2.39 2.42 0.00 34 Y 8.01 4.01 0.00 3.19 3.11 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 0.00 35 L 8.22 4.25 0.00 1.37 1.45 -0.22 1.05 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 36 N 7.49 4.25 0.00 2.55 2.84 0.00 0.00 7.03 6.88 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 37 E 7.69 4.19 0.00 1.90 1.93 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 2.18 2.25 0.00 38 N 7.46 4.62 0.00 2.85 3.20 0.00 0.00 6.51 7.21 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 39 P 0.00 4.65 0.00 1.93 1.96 0.00 3.35 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.74 0.00 40 Y 7.82 4.24 0.00 1.87 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 0.00 0.00 0.00 41 F 7.60 5.25 0.00 2.82 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 42 I 8.82 4.36 1.90 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 1.27 1.43 1.03 0.00 0.00 43 L 8.49 5.30 0.00 1.46 1.41 0.58 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 44 T 9.07 4.99 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 1.26 0.00 0.00 45 Q 8.86 4.91 0.00 1.55 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.86 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 46 E 8.86 4.68 0.00 1.77 1.79 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 2.21 2.24 0.00 47 L 8.32 4.42 0.00 1.55 1.55 0.87 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 48 N 8.61 4.38 0.00 2.80 2.91 0.00 0.00 6.19 8.02 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 49 N 7.72 4.60 0.00 2.68 2.77 0.00 0.00 6.99 7.19 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 50 Q 8.38 4.10 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.48 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 51 K 7.75 4.55 0.00 1.67 1.67 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.34 7.81 52 D 8.50 5.00 0.00 2.58 2.49 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 53 D 8.97 4.62 0.00 2.53 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 54 P 0.00 4.59 0.00 2.33 2.17 0.00 3.47 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 55 I 7.22 4.26 1.93 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 1.54 0.47 0.92 0.00 0.00 56 N 7.60 4.64 0.00 2.67 2.62 0.00 0.00 5.88 7.62 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 57 Y 8.10 4.75 0.00 3.00 2.84 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 58 T 8.51 3.99 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 1.26 0.00 0.00 59 E 8.92 4.19 0.00 2.25 2.24 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 2.37 2.48 0.00 60 S 8.02 4.14 0.00 3.88 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 61 E 8.01 4.18 0.00 2.24 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 2.43 2.46 0.00 62 L 8.42 4.15 0.00 1.80 1.77 1.02 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.48 4.22 0.00 1.91 1.89 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.70 1.61 7.81 64 G 7.42 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 0.00 0.00 0.00 65 M 7.36 4.46 0.00 1.88 2.07 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.24 0.00 66 N 8.37 4.69 0.00 2.85 2.74 0.00 0.00 6.76 7.02 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 67 K 8.57 3.80 0.00 1.78 1.82 0.00 1.74 0.00 0.00 2.04 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.47 7.81 68 A 7.94 4.28 1.33 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 69 E 7.98 3.90 0.00 2.08 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 2.38 2.20 0.00 70 H 8.15 4.07 0.00 3.35 3.37 0.00 5.62 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 71 E 8.12 4.00 0.00 2.19 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 2.36 2.55 0.00 72 S 8.38 4.13 0.00 4.03 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 73 I 7.88 3.83 2.12 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.11 1.13 0.00 0.00 74 I 7.95 3.98 1.91 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.28 0.96 0.00 0.00 75 S 8.38 4.37 0.00 4.05 3.93 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 76 N 7.93 4.43 0.00 2.97 2.92 0.00 0.00 7.32 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 77 L 7.54 4.20 0.00 1.70 1.96 0.95 1.54 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 78 G 7.70 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 0.00 0.00 0.00 79 R 7.81 4.63 0.00 1.89 1.86 0.00 3.45 0.00 0.00 3.42 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 80 N 8.42 4.71 0.00 2.72 2.75 0.00 0.00 6.57 8.03 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 81 P 0.00 5.03 0.00 2.28 2.31 0.00 3.71 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 82 S 7.57 4.38 0.00 4.01 4.02 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 83 D 7.85 4.13 0.00 2.36 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 0.00 0.00 0.00 84 F 7.18 4.75 0.00 3.23 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 85 K 8.87 4.39 0.00 1.73 1.84 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.61 7.81 86 N 8.76 4.79 0.00 2.83 2.74 0.00 0.00 6.80 7.49 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 87 A 8.41 3.93 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 88 D 8.13 4.29 0.00 2.81 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 89 E 8.20 4.01 0.00 2.33 2.28 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 2.55 2.50 0.00 90 R 7.81 3.84 0.00 1.90 2.00 0.00 3.07 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 91 I 8.28 3.80 1.90 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 1.58 0.83 0.95 0.00 0.00 92 A 8.15 3.98 1.40 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 93 Y 7.76 3.77 0.00 2.65 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 94 I 7.77 4.01 2.07 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 1.64 1.14 1.08 0.00 0.00 95 L 8.09 4.08 0.00 1.86 1.69 0.93 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.47 3.93 0.00 1.64 1.60 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.43 7.81 97 Q 7.78 4.14 0.00 2.46 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.22 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 98 I 7.59 3.73 1.82 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 1.49 0.57 0.95 0.00 0.00 99 D 7.59 4.45 0.00 2.66 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 0.00 100 N 7.65 4.63 0.00 2.84 2.80 0.00 0.00 7.19 6.99 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 0.00 101 K 7.74 4.26 0.00 1.69 1.72 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.36 7.81 102 G 8.17 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 0.00 103 E 7.76 4.80 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 2.07 2.30 0.00 104 L 8.42 4.55 0.00 1.60 1.69 0.90 0.88 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 0.00 105 E 7.80 4.36 0.00 1.96 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 2.25 0.00 106 H 7.73 4.55 0.00 3.16 3.16 0.00 5.91 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 0.00 107 H 7.55 4.68 0.00 3.15 3.14 0.00 5.95 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 H 8.31 4.48 0.00 3.31 3.44 0.00 5.57 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 H 9.40 4.23 0.00 3.34 3.44 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 0.00 110 H 7.71 5.02 0.00 3.13 3.15 0.00 5.82 0.00 0.00 0.00 0.00 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 H 7.78 4.37 0.00 3.07 3.11 0.00 6.01 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00