NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.1554 8.2544 120.8564 56.1698 31.2259 174.7069 2 S 4.3887 8.3100 119.9169 56.3909 63.8017 171.2300 3 E 3.9113 9.4383 130.6943 59.4747 29.7272 178.8893 4 Q 3.1831 7.6225 117.5295 58.8399 28.6867 178.7487 5 I 3.7310 7.8373 120.6886 64.1448 37.0809 178.2669 6 A 3.9181 8.1809 121.5888 55.1460 18.1798 179.5459 7 A 3.7862 8.1864 119.2837 55.2956 18.4319 180.0447 8 V 3.5016 7.9904 116.7453 66.2322 31.5412 178.4751 9 R 3.8956 8.2731 118.0385 59.1958 29.8254 179.3016 10 R 3.7362 7.6719 118.0462 59.1761 29.7821 178.7669 11 M 4.0451 7.3390 118.4908 58.4985 32.0037 178.9979 12 V 3.9055 8.0314 118.3298 66.1613 31.6782 177.5626 13 E 3.9958 8.5200 118.9786 59.2703 29.3134 178.6588 14 A 4.0633 8.2095 120.8576 55.4061 18.2385 179.1752 15 Y 4.0937 7.6698 114.2934 61.2239 37.9869 178.4893 16 N 4.5778 7.9499 116.3109 56.6026 38.8819 177.2514 17 T 4.2151 8.2910 109.7856 62.0690 69.3533 176.0631 18 G 3.7899 8.2161 108.3101 45.3727 0.0000 173.4613 19 K 4.3087 8.0551 120.1684 55.7049 31.7216 176.2604 20 T 4.6630 8.1671 113.2175 61.2689 69.2724 175.8278 21 D 4.3274 8.3154 123.6682 57.3412 41.1529 176.8593 22 D 4.8733 7.8862 117.1069 54.0018 41.3799 178.4995 23 V 2.7628 7.4602 116.1457 63.9003 31.5665 178.4049 24 A 3.8780 7.6672 121.3269 54.4978 18.4428 178.2007 25 D 4.5080 7.8862 115.9636 56.8485 41.0384 176.7863 26 Y 4.7572 7.0165 113.1378 55.8895 39.4583 174.3469 27 I 4.2958 7.0697 122.4151 59.4419 38.6898 175.1447 28 H 4.2657 8.8619 125.8467 55.2677 30.4636 174.2667 29 P 4.1759 0.0000 0.0000 65.3686 31.2934 177.5476 30 E 4.6406 8.3015 114.7307 55.9192 29.8878 174.8893 31 Y 4.3078 7.9440 121.4651 58.9286 39.7519 175.1767 32 M 4.8054 8.0778 124.3347 53.6378 36.6353 173.5673 33 N 5.2374 8.4305 122.0706 49.2713 41.4766 173.0384 34 P 4.4510 0.0000 0.0000 65.3736 31.2027 178.1527 35 G 3.7441 8.2925 105.0026 46.8483 0.0000 174.6625 36 T 4.4203 7.8533 111.0138 62.4717 69.0666 176.6110 37 L 4.1009 7.6528 123.0511 58.0782 41.4000 178.7775 38 E 3.6642 8.2143 117.7725 58.5129 29.5039 177.7657 39 F 4.6129 8.0127 116.4994 57.9533 40.3829 175.5190 40 T 4.4113 6.7552 109.2144 61.8269 70.3576 172.8062 41 S 4.7155 8.5216 120.4005 58.1215 63.4573 174.7416 42 L 4.2299 7.7107 120.9284 54.9632 41.8120 176.1869 43 R 4.7618 7.9132 118.6497 55.3605 34.5477 176.2980 44 G 3.9924 8.8841 106.8146 45.4795 0.0000 172.0644 45 P 4.0730 0.0000 0.0000 65.7569 31.1453 178.2560 46 E 3.9188 8.1425 116.8339 59.2775 29.4285 178.9847 47 L 3.9941 7.8396 119.7304 58.1141 42.2353 178.6749 48 F 4.1945 8.1591 119.8298 61.3797 39.3012 176.6621 49 A 3.6669 8.1353 120.4458 55.1608 18.0592 179.6623 50 I 3.6376 7.7908 118.2569 64.3499 37.1669 178.1320 51 N 4.2137 8.1368 117.8804 56.6527 38.8226 176.9786 52 V 3.4628 7.3592 119.2998 65.9383 31.4714 177.7077 53 A 3.9625 7.9573 120.4019 54.9602 18.1124 179.3860 54 W 3.8708 8.4141 126.9129 60.4655 30.6806 178.2902 55 V 3.6938 8.2189 118.1922 66.1864 30.6717 178.2096 56 K 4.2091 8.1352 118.1858 59.2840 31.6152 179.3718 57 K 3.8404 7.8967 119.2626 59.5601 32.3644 178.5577 58 T 3.7841 7.4938 115.8449 64.6554 68.3887 176.2332 59 F 5.9403 8.3923 117.0543 56.1714 39.9556 176.0715 60 S 4.7553 7.8411 111.8342 58.3429 63.3634 170.0231 61 E 4.0280 8.5751 120.2917 59.5343 29.2885 178.0826 62 E 4.1950 7.8091 115.8399 56.7232 29.8518 176.7489 63 A 4.4016 7.6549 121.8140 52.5950 19.1465 177.4237 64 R 4.8840 9.2072 119.5842 54.3431 34.8281 174.6745 65 L 5.2106 9.4580 122.3646 53.2671 43.8166 175.8907 66 E 4.5261 9.3801 124.8628 55.0988 31.5883 175.3112 67 E 4.4526 8.6730 124.6959 55.9813 30.0243 175.7635 68 V 3.9970 8.7865 127.9798 64.5969 32.5708 176.1636 69 G 4.2031 7.4564 103.8005 45.6764 0.0000 172.1847 70 I 5.3850 8.4504 121.9240 59.3043 40.9083 174.3812 71 E 5.0249 9.3799 123.9392 54.5361 33.4743 174.1070 72 E 5.2497 8.5884 116.6018 54.9721 33.4438 175.3117 73 R 4.4117 9.0895 120.9092 55.9085 33.5675 175.2739 74 A 3.5666 8.2906 130.2159 54.0628 18.0564 176.6479 75 D 4.8013 8.9634 119.1548 56.4986 40.8725 175.0264 76 W 5.4190 8.3684 119.6831 54.9425 32.6193 174.8203 77 V 4.9771 9.4418 122.7153 61.1706 34.6917 173.9751 78 R 5.2000 9.2148 127.6520 54.5302 32.5589 174.0301 79 A 5.1086 9.1081 128.3837 50.2270 21.9076 174.9435 80 R 4.9710 9.3057 122.5782 54.7298 32.1915 175.5712 81 L 5.3909 8.9412 123.2834 52.8194 46.9075 175.7480 82 V 4.7540 8.7740 119.5234 61.1878 34.5826 173.9199 83 L 4.8969 8.8865 130.8271 54.5728 43.5831 174.6741 84 Y 4.6280 9.1579 124.1525 56.3836 41.1674 175.3299 85 G 4.0454 7.2611 109.4743 45.5020 0.0000 171.0406 86 R 5.2005 8.8033 119.3477 54.7616 33.5470 174.7663 87 H 5.0182 9.8226 127.0488 56.7193 28.9630 175.1685 88 V 4.2831 9.1062 117.3465 60.5619 33.4184 175.8135 89 G 4.1306 7.7928 106.3846 43.4124 0.0000 172.6233 90 E 4.1266 8.7154 121.3045 56.7557 30.0827 175.7183 91 M 4.7270 9.1576 125.3785 54.4883 33.8611 176.0546 92 V 3.3500 9.8870 123.4619 62.5816 29.3428 175.0829 93 G 4.1307 8.1775 106.6663 46.7746 0.0000 171.9144 94 M 4.8192 8.1476 120.4179 52.9571 33.4228 175.7944 95 A 4.9325 8.4545 126.2555 50.7188 19.3031 175.1849 96 P 3.8598 0.0000 0.0000 63.3675 31.7221 176.7424 97 T 4.2384 8.3109 111.6580 60.9499 69.8574 175.7045 98 G 3.9327 8.3040 109.8152 46.0175 0.0000 173.4133 99 R 4.5083 7.6144 119.4238 54.8341 31.5787 176.3934 100 L 4.7688 8.5442 123.1824 55.3452 42.6296 176.1022 101 F 5.2202 8.5077 115.5577 56.2287 41.6829 173.0608 102 S 4.6095 8.9810 114.0668 56.9931 65.9694 173.8355 103 G 4.2016 8.9783 109.9456 44.6177 0.0000 172.2820 104 E 4.7135 8.8843 123.7789 56.8981 31.0666 175.8804 105 Q 4.9029 9.4044 119.9153 54.5144 34.0309 173.9572 106 I 5.1066 8.6100 121.6590 59.9662 40.6074 174.2451 107 H 5.2786 9.4620 123.8947 53.8614 32.1635 172.7989 108 L 5.2528 8.9667 122.5473 52.9767 44.6495 175.4364 109 L 5.2751 9.4082 123.9055 53.1179 45.5638 174.8405 110 H 4.5211 8.7877 123.3935 54.1062 31.9230 172.9185 111 F 4.8630 8.8344 125.1406 56.3017 40.4036 175.7075 112 V 4.2226 8.0533 121.6385 62.3304 34.2464 175.0165 113 D 4.4607 9.7986 124.6877 55.4718 38.3010 174.6385 114 G 4.0491 8.6478 104.1717 45.7428 0.0000 174.0052 115 K 4.7515 8.0907 118.1835 53.8448 35.9148 175.4704 116 I 3.2963 8.3235 122.5287 61.8322 37.3455 176.0803 117 H 4.5775 9.1977 127.8528 56.9436 32.3891 173.6707 118 H 4.9898 7.7069 116.6047 54.5391 33.9168 171.8140 119 H 5.1875 8.5163 124.1939 54.7371 33.1289 171.6095 120 R 4.7207 9.1587 126.9315 54.4158 32.7388 173.9437 121 D 4.7205 8.2451 124.4260 52.2734 44.5241 174.6786 122 W 4.8994 8.9307 126.6793 54.2271 30.3673 173.7586 123 P 4.4522 0.0000 0.0000 62.1470 32.0547 177.5144 124 D 4.5789 8.0847 120.5832 53.0162 38.8295 176.2267 125 Y 4.1516 7.8526 122.0226 60.8889 38.3669 177.8985 126 Q 4.2186 8.2663 118.4227 58.9733 28.9017 178.9712 127 G 3.5965 8.5556 106.7913 47.9536 0.0000 175.9892 128 T 3.7812 8.0633 118.1287 66.5071 68.4058 175.8885 129 Y 4.1769 8.3864 121.8543 60.9335 38.6280 178.4897 130 R 3.7567 8.2057 118.7098 59.5902 30.0530 179.2253 131 Q 4.0259 7.8485 115.8398 58.3769 28.7021 177.8369 132 L 4.4274 7.7202 118.1002 54.3757 41.6933 177.3454 133 G 3.6618 7.8801 107.2074 45.2416 0.0000 174.3075 134 E 2.0000 7.5561 116.6262 55.7135 27.0254 173.3283 135 P 4.4125 0.0000 0.0000 62.2678 32.6812 176.9576 136 W 4.4058 8.6963 121.1131 55.5031 29.8585 174.7427 137 P 4.6267 0.0000 0.0000 62.8430 31.3515 176.2363 138 E 4.3964 9.0833 119.9705 57.8536 30.5506 176.0585 139 T 4.6298 7.4759 112.6367 60.9569 70.2397 172.9991 140 E 4.4919 8.5946 122.2710 56.5306 30.1455 176.0381 141 H 4.5507 7.7476 122.3291 56.2630 28.9590 174.4068 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 R 8.25 4.16 0.00 1.77 1.90 0.00 3.17 0.00 0.00 3.39 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 2 S 8.31 4.39 0.00 4.06 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 3 E 9.44 3.91 0.00 1.91 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 2.35 2.31 0.00 4 Q 7.62 3.18 0.00 1.88 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 1.16 1.87 0.00 5 I 7.84 3.73 1.83 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 1.46 0.64 0.90 0.00 0.00 6 A 8.18 3.92 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 7 A 8.19 3.79 1.63 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 8 V 7.99 3.50 2.25 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 1.12 0.00 0.00 1.21 0.00 0.00 9 R 8.27 3.90 0.00 2.05 1.93 0.00 3.16 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 10 R 7.67 3.74 0.00 0.98 1.34 0.00 3.08 0.00 0.00 2.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.71 0.00 11 M 7.34 4.05 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.85 0.00 12 V 8.03 3.91 2.25 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 1.06 0.00 0.00 1.04 0.00 0.00 13 E 8.52 4.00 0.00 2.20 2.12 0.00 0.00 0.00 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 2.41 0.00 14 A 8.21 4.06 1.56 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 15 Y 7.67 4.09 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 16 N 7.95 4.58 0.00 2.93 2.92 0.00 0.00 7.07 8.19 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 17 T 8.29 4.22 4.26 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 1.26 0.00 0.00 18 G 8.22 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 0.00 0.00 0.00 19 K 8.06 4.31 0.00 1.78 1.81 0.00 1.66 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.54 7.81 20 T 8.17 4.66 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 1.05 0.00 0.00 21 D 8.32 4.33 0.00 2.69 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 22 D 7.89 4.87 0.00 2.78 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 23 V 7.46 2.76 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 0.91 0.00 0.00 0.97 0.00 0.00 24 A 7.67 3.88 1.18 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 25 D 7.89 4.51 0.00 2.88 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 26 Y 7.02 4.76 0.00 3.07 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 27 I 7.07 4.30 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 0.40 0.21 0.29 0.00 0.00 28 H 8.86 4.27 0.00 3.22 3.23 0.00 5.61 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.18 0.00 2.18 2.07 0.00 3.03 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.03 0.00 30 E 8.30 4.64 0.00 2.03 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 2.35 2.31 0.00 31 Y 7.94 4.31 0.00 3.21 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 32 M 8.08 4.81 0.00 1.95 1.68 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 33 N 8.43 5.24 0.00 2.46 2.53 0.00 0.00 7.43 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 34 P 0.00 4.45 0.00 2.32 2.31 0.00 3.77 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 35 G 8.29 3.74 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 0.00 0.00 0.00 36 T 7.85 4.42 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 1.22 0.00 0.00 37 L 7.65 4.10 0.00 1.75 1.76 0.96 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.21 3.66 0.00 1.71 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 1.47 2.00 0.00 39 F 8.01 4.61 0.00 3.01 3.03 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 40 T 6.76 4.41 4.32 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 1.34 0.00 0.00 41 S 8.52 4.72 0.00 3.89 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 42 L 7.71 4.23 0.00 1.70 1.65 0.95 0.88 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 43 R 7.91 4.76 0.00 1.77 1.84 0.00 3.28 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 44 G 8.88 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.07 0.00 2.08 1.96 0.00 3.58 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.23 0.00 46 E 8.14 3.92 0.00 2.22 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 2.40 2.42 0.00 47 L 7.84 3.99 0.00 1.79 2.12 0.98 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 48 F 8.16 4.19 0.00 2.33 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 49 A 8.14 3.67 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 50 I 7.79 3.64 2.09 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 1.53 0.84 0.93 0.00 0.00 51 N 8.14 4.21 0.00 2.82 2.92 0.00 0.00 6.85 7.14 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 52 V 7.36 3.46 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 0.82 0.00 0.00 -0.44 0.00 0.00 53 A 7.96 3.96 1.38 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 54 W 8.41 3.87 0.00 3.39 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 55 V 8.22 3.69 2.54 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 1.39 0.00 0.00 1.39 0.00 0.00 56 K 8.14 4.21 0.00 2.06 1.83 0.00 1.68 0.00 0.00 1.62 0.00 0.00 3.25 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.56 7.81 57 K 7.90 3.84 0.00 1.70 1.67 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.22 1.35 7.81 58 T 7.49 3.78 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 0.34 0.00 0.00 59 F 8.39 5.94 0.00 3.31 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 60 S 7.84 4.76 0.00 4.28 4.32 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 61 E 8.58 4.03 0.00 1.99 2.07 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 2.31 2.28 0.00 62 E 7.81 4.19 0.00 1.92 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 2.34 2.29 0.00 63 A 7.65 4.40 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 64 R 9.21 4.88 0.00 1.61 1.83 0.00 3.23 0.00 0.00 3.27 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 65 L 9.46 5.21 0.00 1.51 1.63 0.61 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 66 E 9.38 4.53 0.00 1.98 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 2.33 2.34 0.00 67 E 8.67 4.45 0.00 1.99 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 2.28 2.32 0.00 68 V 8.79 4.00 2.25 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 0.81 0.00 0.00 0.97 0.00 0.00 69 G 7.46 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 70 I 8.45 5.39 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.73 1.00 0.00 0.00 71 E 9.38 5.02 0.00 1.97 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 0.00 2.22 2.40 0.00 72 E 8.59 5.25 0.00 2.05 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 0.00 2.16 2.29 0.00 73 R 9.09 4.41 0.00 1.86 1.86 0.00 3.26 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 74 A 8.29 3.57 1.16 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 0.00 0.00 75 D 8.96 4.80 0.00 2.74 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 76 W 8.37 5.42 0.00 3.49 3.17 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 77 V 9.44 4.98 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 1.14 0.00 0.00 1.04 0.00 0.00 78 R 9.21 5.20 0.00 1.97 1.93 0.00 3.44 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 79 A 9.11 5.11 1.24 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 0.00 0.00 80 R 9.31 4.97 0.00 1.83 1.91 0.00 3.11 0.00 0.00 3.21 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 81 L 8.94 5.39 0.00 1.55 1.61 0.68 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 82 V 8.77 4.75 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 0.65 0.00 0.00 0.96 0.00 0.00 83 L 8.89 4.90 0.00 1.81 1.64 1.08 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 84 Y 9.16 4.63 0.00 2.65 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 85 G 7.26 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 86 R 8.80 5.20 0.00 1.88 1.80 0.00 3.13 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 87 H 9.82 5.02 0.00 3.41 3.34 0.00 5.61 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 9.11 4.28 2.08 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 0.76 0.00 0.00 1.01 0.00 0.00 89 G 7.79 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 90 E 8.72 4.13 0.00 2.07 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 2.46 2.47 0.00 91 M 9.16 4.73 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.74 0.00 92 V 9.89 3.35 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.05 0.00 0.00 93 G 8.18 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 94 M 8.15 4.82 0.00 2.22 2.29 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.60 0.00 95 A 8.45 4.93 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 96 P 0.00 3.86 0.00 2.00 1.94 0.00 3.66 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 97 T 8.31 4.24 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 1.36 0.00 0.00 98 G 8.30 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 99 R 7.61 4.51 0.00 1.82 1.92 0.00 3.22 0.00 0.00 3.37 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 100 L 8.54 4.77 0.00 1.55 1.59 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 101 F 8.51 5.22 0.00 3.05 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 0.00 102 S 8.98 4.61 0.00 2.84 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 0.00 103 G 8.98 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 0.00 104 E 8.88 4.71 0.00 1.94 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 0.00 2.40 2.32 0.00 105 Q 9.40 4.90 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 106 I 8.61 5.11 2.32 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.23 1.11 0.00 0.00 107 H 9.46 5.28 0.00 3.05 3.22 0.00 5.57 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.97 5.25 0.00 1.35 1.66 0.97 0.34 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 0.00 109 L 9.41 5.28 0.00 1.59 1.39 0.74 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 110 H 8.79 4.52 0.00 1.40 2.50 0.00 5.77 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 F 8.83 4.86 0.00 2.82 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 0.00 112 V 8.05 4.22 1.71 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 0.85 0.00 0.00 0.53 0.00 0.00 113 D 9.80 4.46 0.00 2.94 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 0.00 114 G 8.65 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 0.00 115 K 8.09 4.75 0.00 1.85 1.81 0.00 1.61 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.38 1.41 7.81 116 I 8.32 3.30 1.64 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 -0.36 0.81 0.00 0.00 117 H 9.20 4.58 0.00 2.91 3.16 0.00 5.53 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 0.00 118 H 7.71 4.99 0.00 3.10 2.93 0.00 5.67 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 H 8.52 5.19 0.00 3.21 2.81 0.00 5.60 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 R 9.16 4.72 0.00 1.83 1.44 0.00 2.89 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.36 0.00 121 D 8.25 4.72 0.00 2.32 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 0.00 0.00 0.00 122 W 8.93 4.90 0.00 3.37 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 0.00 123 P 0.00 4.45 0.00 0.85 1.69 0.00 3.34 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.91 0.00 124 D 8.08 4.58 0.00 2.87 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 0.00 125 Y 7.85 4.15 0.00 3.11 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 0.00 126 Q 8.27 4.22 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 127 G 8.56 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 T 8.06 3.78 4.32 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 0.48 0.00 0.00 129 Y 8.39 4.18 0.00 3.08 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 0.00 130 R 8.21 3.76 0.00 2.07 1.94 0.00 3.18 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.89 0.00 131 Q 7.85 4.03 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.10 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 132 L 7.72 4.43 0.00 1.63 1.67 0.68 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 133 G 7.88 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 0.00 0.00 0.00 134 E 7.56 2.00 0.00 1.73 1.43 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 1.58 1.90 0.00 135 P 0.00 4.41 0.00 2.28 2.10 0.00 3.14 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.02 0.00 136 W 8.70 4.41 0.00 3.35 3.25 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 0.00 137 P 0.00 4.63 0.00 2.14 2.06 0.00 3.95 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 138 E 9.08 4.40 0.00 2.08 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 0.00 2.55 2.29 0.00 139 T 7.48 4.63 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 1.30 0.00 0.00 140 E 8.59 4.49 0.00 2.03 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 2.07 1.90 0.00 141 H 7.75 4.55 0.00 3.15 3.23 0.00 5.88 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