NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3309 8.2493 123.5823 51.0051 19.9459 176.7038 2 P 4.9723 0.0000 0.0000 62.4486 31.6892 174.6277 3 Q 4.5386 8.9869 117.4649 55.9198 30.7736 177.0271 4 S 4.6523 7.3480 111.5382 55.6739 67.0255 174.1210 5 I 3.7336 8.2013 125.2015 64.1642 37.9042 178.4730 6 T 3.7943 7.7552 116.5611 66.5604 68.3231 176.3104 7 E 3.9377 8.1050 120.7590 59.1512 29.7761 178.4859 8 L 4.0124 7.9565 120.5166 58.2433 42.1860 178.1216 9 C 4.3264 8.4212 118.5722 59.6531 43.3152 175.6194 10 S 3.9935 7.8393 115.5258 60.9291 62.4342 175.6272 11 E 4.0972 7.9645 119.2817 56.5837 29.6842 175.8641 12 Y 4.7120 7.1878 116.1571 56.2667 40.5418 174.8540 13 H 4.8498 8.6572 118.6458 56.1945 30.4097 175.5989 14 N 4.7756 8.9304 118.1746 54.4026 35.9515 173.8567 15 T 4.9912 7.1580 107.9118 60.8347 71.3656 173.9661 16 Q 4.4154 8.3616 119.1318 54.9164 33.8374 173.6503 17 I 4.3065 8.0395 124.6886 60.7055 38.5707 174.6843 18 Y 4.8314 8.5809 124.6503 56.5379 40.7257 175.3109 19 T 4.4793 8.7244 121.9087 63.1674 67.8075 174.9606 20 I 3.4663 8.3433 127.3568 63.1930 37.6223 177.0056 21 N 4.0351 7.8452 118.1353 53.4567 37.7560 171.9615 22 D 4.5285 7.8115 116.0944 53.5602 45.1978 174.2502 23 K 4.9074 8.4429 121.7522 55.3795 34.1237 176.6339 24 I 3.3037 8.2103 121.2411 61.5080 37.5984 176.0868 25 L 4.4054 8.4816 128.8004 57.5695 42.6820 177.1304 26 S 4.6966 7.6021 111.2813 56.5329 66.7869 172.1630 27 Y 4.7702 7.9488 122.5588 56.0443 40.9341 174.5477 28 T 4.4408 8.3339 123.3159 61.5037 72.0982 172.6671 29 E 4.8231 8.4504 125.7452 54.3155 32.9817 174.3870 30 S 4.8497 9.1184 121.1639 56.5206 65.7180 173.8768 31 M 4.6355 8.5766 121.0268 54.5444 32.0068 175.5283 32 A 4.0426 7.9928 124.1777 51.8906 19.0511 177.7416 33 G 3.8844 8.6052 110.8743 47.3661 0.0000 173.9722 34 K 4.0719 9.2850 121.6905 56.8916 30.0045 176.1629 35 R 4.6857 7.9303 117.8512 55.9102 31.2787 176.5057 36 E 4.9372 8.4040 119.0667 55.6634 28.9510 175.8647 37 M 4.8716 8.0108 121.3543 53.7657 36.0069 173.6265 38 V 4.6802 8.1900 116.0587 61.1172 35.1607 174.1549 39 I 5.1924 8.7457 128.0184 59.3756 40.6034 174.4485 40 I 5.5160 9.0603 119.7543 58.2494 40.7847 174.5111 41 T 5.1811 7.8454 110.4513 60.0997 72.5349 172.4968 42 F 5.3066 8.8597 120.5637 55.1681 42.5931 176.7491 43 K 4.0833 8.3131 118.8316 59.2571 32.3799 178.4005 44 S 4.2199 8.0884 113.5002 59.5829 63.2592 174.6579 45 G 3.9505 8.4335 109.7546 45.0261 0.0000 174.0020 46 A 3.8782 7.7353 121.5650 52.7744 19.3786 176.7518 47 T 4.9648 7.7275 117.6819 61.7247 71.9629 173.2935 48 F 5.4119 9.4093 123.9660 55.9371 43.9691 173.4400 49 Q 5.0478 9.3156 116.9686 55.0727 32.7466 174.2388 50 V 4.6304 8.5366 120.5283 60.5561 32.7082 174.5396 51 E 4.6258 8.7638 125.0164 55.3465 30.3547 177.0717 52 V 3.9019 8.3281 120.8375 62.0880 31.9663 174.1283 53 P 4.5179 0.0000 0.0000 63.1835 32.5405 176.3228 54 G 3.9015 8.2195 110.8999 45.8208 0.0000 174.7489 55 S 4.2232 8.6923 116.6848 60.8149 63.1997 175.3571 56 Q 3.9883 7.8331 118.1204 57.5933 28.7747 175.5674 57 H 5.7139 7.6323 114.4812 53.1384 30.9858 174.2263 58 I 4.3370 8.1000 115.7946 59.4879 39.8467 176.4627 59 D 4.3824 8.6886 119.7605 57.6590 39.0228 179.2344 60 S 4.1584 8.1396 113.8851 61.3726 62.8711 175.9759 61 Q 4.0786 7.9636 121.2004 57.4938 28.1160 178.0122 62 K 3.8877 8.0551 121.7263 59.6446 32.1836 178.8763 63 K 4.0200 8.0305 117.9331 59.2274 31.9822 179.0746 64 A 4.0071 7.5472 120.7270 55.1378 18.2688 179.8026 65 I 3.6582 7.8702 118.2528 64.6196 37.1892 178.5121 66 E 3.9939 7.8712 119.0332 59.4171 29.2087 179.4252 67 R 3.8939 8.3502 119.0954 59.5986 30.1546 178.2290 68 M 4.0563 8.2804 118.2789 58.6762 32.1863 178.4141 69 K 4.1639 8.2386 118.6126 59.2833 32.1842 179.2097 70 D 4.4039 8.2583 119.5933 57.5982 40.6645 178.8608 71 T 3.9073 8.3299 116.6807 66.6443 68.3783 176.8035 72 L 4.0685 8.1463 120.9567 57.6330 41.5425 179.6033 73 R 3.1592 7.8892 118.3420 59.3522 30.0852 178.5291 74 I 3.6537 7.7469 118.4052 64.1478 37.9266 178.0377 75 T 3.8745 8.1915 117.0829 66.5755 68.2845 175.9678 76 Y 4.0238 8.1970 121.5412 60.8405 38.6654 178.0783 77 L 3.7601 7.9493 118.9504 57.5624 41.7972 178.7476 78 T 4.2241 7.7444 106.5742 60.6253 69.2188 174.2276 79 E 3.7148 7.6924 119.5451 57.7687 27.8385 174.8026 80 T 4.1985 7.6813 114.3244 63.1148 69.4004 174.9519 81 K 4.2149 8.6121 127.7060 56.4487 33.1615 175.9189 82 I 3.9048 8.7807 129.1824 60.7736 38.4302 175.0912 83 D 4.5721 9.1746 128.1976 54.8165 41.2015 175.8255 84 K 5.1126 8.2848 115.5917 54.4932 37.1493 174.9997 85 L 4.8638 8.4740 120.7061 53.3246 45.7260 174.9601 86 C 4.7423 8.8708 125.7314 55.7164 45.8617 172.8026 87 V 4.7407 8.4195 119.2200 59.1512 36.0358 175.1023 88 W 5.1311 9.2270 123.9723 55.9906 29.5943 176.7235 89 N 4.8248 9.1844 122.7085 53.4959 37.4002 175.3432 90 N 4.9245 8.2044 116.5696 53.2403 38.6347 174.6222 91 K 4.7056 7.8520 117.1576 54.8323 35.9154 175.4044 92 T 4.6321 8.3249 118.0728 60.9975 70.6619 172.3899 93 P 4.6121 0.0000 0.0000 61.7937 33.1048 175.7556 94 N 4.7743 8.7190 116.6831 53.5713 39.6682 174.2713 95 S 5.0675 8.9185 118.7027 57.9233 63.9968 173.0517 96 I 4.2217 8.9929 128.9535 61.4146 36.8606 175.4919 97 A 4.1984 8.6167 128.7099 52.9488 20.6533 176.5387 98 A 4.5141 7.1446 114.0729 51.0318 22.6936 175.2981 99 I 5.0054 8.1462 119.1242 59.2027 41.5132 174.5652 100 S 4.8540 8.8890 122.2024 56.8511 66.3473 172.7175 101 M 5.1345 8.5327 120.3673 53.6480 35.7764 174.4158 102 E 4.3628 8.5979 122.1888 54.3240 32.5272 174.9233 103 K 4.0436 8.4479 126.0767 55.2108 32.0516 176.7644 104 L 4.2440 7.7831 129.7290 53.4889 40.3727 175.3383 105 Y 4.8562 6.8989 114.6967 56.1052 39.8535 175.5997 106 A 4.7215 7.2932 129.2688 51.9244 24.1129 178.1444 107 G 4.1179 8.6392 113.3051 47.4768 0.0000 172.4139 108 A 4.0763 9.0819 126.3670 52.8770 19.0320 177.4125 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 A 8.25 4.33 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 2 P 0.00 4.97 0.00 2.43 2.22 0.00 3.35 0.00 0.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 3 Q 8.99 4.54 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 4 S 7.35 4.65 0.00 3.80 3.61 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 5 I 8.20 3.73 1.81 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.09 0.85 0.00 0.00 6 T 7.76 3.79 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 1.17 0.00 0.00 7 E 8.11 3.94 0.00 2.01 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 2.37 2.36 0.00 8 L 7.96 4.01 0.00 1.88 1.85 0.94 0.53 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 9 C 8.42 4.33 0.00 3.15 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.84 3.99 0.00 4.10 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 11 E 7.96 4.10 0.00 1.83 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 2.25 2.49 0.00 12 Y 7.19 4.71 0.00 2.96 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 13 H 8.66 4.85 0.00 3.30 3.26 0.00 5.74 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 N 8.93 4.78 0.00 3.20 3.08 0.00 0.00 6.67 7.05 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 15 T 7.16 4.99 3.96 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 0.82 0.00 0.00 16 Q 8.36 4.42 0.00 1.75 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.97 0.00 0.00 0.00 0.00 0.00 2.17 2.36 0.00 17 I 8.04 4.31 1.73 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 1.21 0.67 0.82 0.00 0.00 18 Y 8.58 4.83 0.00 2.80 2.74 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 19 T 8.72 4.48 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 1.18 0.00 0.00 20 I 8.34 3.47 1.83 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.15 -0.06 0.00 0.00 21 N 7.85 4.04 0.00 2.66 2.74 0.00 0.00 7.08 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 22 D 7.81 4.53 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 23 K 8.44 4.91 0.00 1.95 1.94 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.50 7.81 24 I 8.21 3.30 2.11 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.66 0.87 0.00 0.00 25 L 8.48 4.41 0.00 1.66 1.74 0.96 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 26 S 7.60 4.70 0.00 3.82 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 27 Y 7.95 4.77 0.00 1.99 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 28 T 8.33 4.44 4.12 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 0.00 0.00 1.08 0.00 0.00 29 E 8.45 4.82 0.00 1.52 1.70 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 2.15 2.25 0.00 30 S 9.12 4.85 0.00 3.83 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 31 M 8.58 4.64 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 32 A 7.99 4.04 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 33 G 8.61 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 0.00 0.00 0.00 34 K 9.29 4.07 0.00 1.93 1.99 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.38 7.81 35 R 7.93 4.69 0.00 1.82 1.84 0.00 3.31 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 36 E 8.40 4.94 0.00 1.97 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 2.20 0.00 37 M 8.01 4.87 0.00 2.02 2.23 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.68 0.00 38 V 8.19 4.68 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 0.85 0.00 0.00 0.89 0.00 0.00 39 I 8.75 5.19 1.74 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 1.24 0.59 0.91 0.00 0.00 40 I 9.06 5.52 1.72 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 2.46 0.95 0.00 0.00 41 T 7.85 5.18 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 1.13 0.00 0.00 42 F 8.86 5.31 0.00 3.13 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 43 K 8.31 4.08 0.00 1.95 2.01 0.00 1.64 0.00 0.00 1.80 0.00 0.00 3.20 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.72 1.45 7.81 44 S 8.09 4.22 0.00 4.01 4.07 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 45 G 8.43 3.95 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 0.00 0.00 0.00 46 A 7.74 3.88 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 47 T 7.73 4.96 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 1.13 0.00 0.00 48 F 9.41 5.41 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 49 Q 9.32 5.05 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.75 0.00 0.00 0.00 0.00 0.00 2.63 2.41 0.00 50 V 8.54 4.63 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 1.03 0.00 0.00 1.00 0.00 0.00 51 E 8.76 4.63 0.00 2.04 2.18 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 2.39 2.26 0.00 52 V 8.33 3.90 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 0.97 0.00 0.00 1.03 0.00 0.00 53 P 0.00 4.52 0.00 2.09 1.98 0.00 3.78 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 2.03 2.07 0.00 54 G 8.22 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.69 4.22 0.00 3.83 3.90 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.83 3.99 0.00 1.55 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.77 0.00 0.00 0.00 0.00 0.00 2.19 2.29 0.00 57 H 7.63 5.71 0.00 3.08 3.17 0.00 5.60 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 58 I 8.10 4.34 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.17 0.93 0.00 0.00 59 D 8.69 4.38 0.00 2.72 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 60 S 8.14 4.16 0.00 4.07 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 0.00 61 Q 7.96 4.08 0.00 2.36 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.83 0.00 0.00 0.00 0.00 0.00 2.45 2.43 0.00 62 K 8.06 3.89 0.00 2.08 1.81 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.49 7.81 63 K 8.03 4.02 0.00 1.85 1.85 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.51 7.81 64 A 7.55 4.01 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 65 I 7.87 3.66 1.99 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 1.46 0.88 0.90 0.00 0.00 66 E 7.87 3.99 0.00 2.14 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 2.55 2.47 0.00 67 R 8.35 3.89 0.00 1.92 2.17 0.00 3.11 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 68 M 8.28 4.06 0.00 2.32 2.14 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 2.64 2.66 0.00 69 K 8.24 4.16 0.00 2.05 1.92 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.65 7.81 70 D 8.26 4.40 0.00 2.90 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 8.33 3.91 4.44 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 1.23 0.00 0.00 72 L 8.15 4.07 0.00 1.89 1.91 1.01 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 73 R 7.89 3.16 0.00 1.71 1.99 0.00 3.02 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.01 0.00 74 I 7.75 3.65 1.85 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 1.51 1.04 1.00 0.00 0.00 75 T 8.19 3.87 4.48 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 1.31 0.00 0.00 76 Y 8.20 4.02 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.95 3.76 0.00 1.56 1.64 0.87 1.05 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 78 T 7.74 4.22 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 1.19 0.00 0.00 79 E 7.69 3.71 0.00 2.06 1.99 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 2.05 2.09 0.00 80 T 7.68 4.20 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 1.21 0.00 0.00 81 K 8.61 4.21 0.00 1.77 1.71 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.49 7.81 82 I 8.78 3.90 2.12 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.57 0.93 0.00 0.00 83 D 9.17 4.57 0.00 2.77 2.60 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 84 K 8.28 5.11 0.00 1.58 1.55 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.76 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.28 1.31 7.81 85 L 8.47 4.86 0.00 1.21 1.15 0.15 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 86 C 8.87 4.74 0.00 2.81 2.70 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 87 V 8.42 4.74 2.38 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 0.59 0.00 0.00 1.22 0.00 0.00 88 W 9.23 5.13 0.00 3.42 3.04 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 89 N 9.18 4.82 0.00 2.85 3.10 0.00 0.00 7.03 7.60 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 90 N 8.20 4.92 0.00 2.80 2.91 0.00 0.00 6.77 7.61 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 91 K 7.85 4.71 0.00 1.85 1.70 0.00 1.61 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.40 7.81 92 T 8.32 4.63 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 1.20 0.00 0.00 93 P 0.00 4.61 0.00 2.18 2.01 0.00 3.80 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 94 N 8.72 4.77 0.00 3.03 3.20 0.00 0.00 7.25 7.57 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 95 S 8.92 5.07 0.00 4.08 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 0.00 96 I 8.99 4.22 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.92 0.84 0.00 0.00 97 A 8.62 4.20 -0.27 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 98 A 7.14 4.51 1.04 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 99 I 8.15 5.01 1.83 0.00 0.00 0.90 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 0.95 0.89 0.00 0.00 100 S 8.89 4.85 0.00 3.85 3.83 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 0.00 101 M 8.53 5.13 0.00 1.84 1.93 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 102 E 8.60 4.36 0.00 1.80 1.70 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 2.07 2.23 0.00 103 K 8.45 4.04 0.00 1.50 0.97 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.26 1.31 7.81 104 L 7.78 4.24 0.00 1.46 1.50 0.92 0.88 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 0.00 105 Y 6.90 4.86 0.00 2.99 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 0.00 106 A 7.29 4.72 1.06 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 0.00 0.00 107 G 8.64 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 108 A 9.08 4.08 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