NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 H 4.7303 8.4293 120.3950 55.5546 30.8911 175.4186 6 E 4.5601 8.6320 112.2594 51.8017 31.9954 173.3061 7 T 4.1931 9.2070 111.9303 61.3467 71.8371 176.4957 8 D 4.3386 8.4995 120.7810 57.8017 40.9566 178.7372 9 E 4.0199 8.3292 118.4516 59.7573 29.5472 179.3268 10 E 4.0498 8.1046 118.6566 59.1443 29.4576 179.1894 11 F 4.3132 8.2241 120.3220 61.4102 39.5192 176.6183 12 D 4.3991 8.5759 118.5013 57.5436 40.6762 178.6535 13 A 4.0128 8.0218 120.7691 55.5322 18.4736 179.5839 14 R 3.7562 7.7213 115.8306 59.5406 30.1369 179.3582 15 W 3.7032 7.7429 117.9459 59.2353 29.0188 178.9072 16 V 3.7527 8.0758 118.2906 66.6113 30.8695 178.1637 17 T 3.9111 8.0911 114.3559 66.7197 68.6103 175.7058 18 Y 3.8978 7.6357 120.8576 60.7339 38.6908 177.8779 19 F 4.6997 8.0765 115.7909 59.1258 39.3186 176.5265 20 N 4.8835 7.9108 115.0684 52.2848 38.9914 174.7731 21 K 3.9075 7.3262 122.1243 55.9634 32.4095 175.0343 22 P 4.2110 0.0000 0.0000 65.9359 31.2323 177.3386 23 D 4.7316 7.8606 114.2789 53.1119 39.5648 175.9017 24 I 3.5574 7.5133 120.9558 62.0384 38.1725 176.2547 25 D 4.7883 8.5242 127.9056 52.1488 42.6008 176.6587 26 A 4.0772 8.5137 119.9881 55.3033 18.2539 179.2202 27 W 4.1130 8.4049 126.2185 61.0252 30.8572 177.8972 28 E 4.2902 9.2719 118.2384 58.9339 28.7919 179.3075 29 L 4.3082 7.7546 121.0265 58.2827 42.2258 178.9669 30 R 3.8930 8.0133 117.8611 59.1259 29.9895 178.7487 31 K 3.6323 7.8378 119.7271 59.5445 32.0002 178.7385 32 G 3.7693 8.1338 105.5732 48.2379 0.0000 175.4759 33 M 4.2278 8.3981 120.9631 58.4414 31.9377 178.4324 34 N 4.2813 8.7355 116.0875 56.8158 38.9493 177.3576 35 T 4.0462 8.2072 117.1142 66.4141 68.6923 176.7314 36 L 3.8290 7.9374 122.1910 57.9324 41.7399 178.5563 37 V 4.1696 7.4413 109.2886 61.8348 31.8122 176.9702 38 G 3.6113 7.6698 107.6464 46.6182 0.0000 174.1359 39 Y 4.3209 6.9689 116.1562 57.5811 39.0541 175.7119 40 D 4.6152 8.3004 122.7184 51.1265 39.7285 174.6608 41 L 4.2874 6.8770 119.8240 55.3318 42.8234 174.3358 42 V 4.2855 8.1975 119.1715 60.1228 32.8843 173.6926 43 P 4.3360 0.0000 0.0000 62.7778 31.9666 176.1205 44 E 4.2279 8.7145 121.1965 55.8327 30.4317 176.1955 45 P 4.2630 0.0000 0.0000 65.8128 31.2363 179.0443 46 K 4.1105 8.1844 116.9285 60.1790 32.2779 179.0101 47 I 3.9633 7.9361 120.9190 64.0553 37.0410 178.3362 48 I 3.6158 7.5922 120.2981 64.3080 36.9869 177.2222 49 D 4.2880 8.6410 118.8871 57.7218 40.9139 178.2565 50 A 4.0159 7.9104 120.5207 55.4879 18.5476 179.5495 51 A 3.3941 7.6817 118.4307 54.8847 18.2430 179.9510 52 L 3.8772 8.1327 118.0296 58.0314 41.7098 179.9278 53 R 3.9814 8.2130 117.8078 59.0323 29.6759 178.9846 54 A 4.0751 8.1321 120.8743 55.1812 18.2999 179.5104 55 C 4.1335 7.8682 115.1009 62.6779 28.1015 176.1525 56 R 3.8963 7.9717 120.3382 59.6854 29.6076 178.8222 57 R 3.9605 7.9724 116.1469 58.4129 30.0998 177.9039 58 L 4.4950 7.2879 116.3595 53.0994 43.0051 175.7508 59 N 4.1617 8.7240 116.0783 54.6252 36.3538 175.8431 60 D 4.7055 8.2010 115.7759 51.6263 42.6292 175.0959 61 F 4.2900 8.8657 127.0152 60.8515 39.7240 175.8609 62 A 3.8854 8.2461 120.0369 55.8116 18.0751 179.5638 63 S 4.0247 8.2129 112.3240 61.7788 62.6536 177.0069 64 A 3.9053 7.4888 122.5734 54.7266 18.2893 179.7485 65 V 3.4403 7.0690 116.4410 66.0673 31.6845 177.8014 66 R 3.9978 7.7202 118.4851 59.8094 29.8529 178.2186 67 I 3.6389 7.7203 119.2162 64.5083 36.9705 178.3812 68 L 4.0689 7.8239 119.6616 57.7541 41.3891 179.3987 69 E 3.9138 8.0375 118.2877 59.4386 29.4757 179.6416 70 V 3.5909 8.0992 119.4406 64.6717 31.0304 178.6219 71 V 3.5912 7.4587 117.8046 65.7355 31.7985 177.5721 72 K 4.0924 7.9329 119.1446 59.4553 31.9346 178.2297 73 D 4.2663 8.2259 118.3872 57.3172 41.0427 178.1790 74 K 4.1083 8.3014 116.8368 58.1981 32.3268 178.0937 75 A 4.3888 8.0925 120.8078 50.6225 19.1881 178.8416 76 G 3.7280 8.4060 106.0365 46.2005 0.0000 174.8063 77 P 4.3205 0.0000 0.0000 64.1736 31.4819 176.4450 78 H 4.5688 8.0686 118.0689 54.3139 27.1553 175.8041 79 K 4.0577 8.3087 124.0688 58.7954 32.0179 178.3139 80 E 4.2321 8.1493 115.6421 57.8858 30.1837 178.6121 81 I 3.7411 7.5529 122.2338 64.1986 37.1346 176.9375 82 Y 4.2395 8.1298 119.5960 60.9153 38.5895 176.7437 83 P 4.1733 0.0000 0.0000 65.8181 31.4234 178.0285 84 Y 4.0039 7.6708 117.9567 60.4839 38.5091 177.7785 85 V 3.4628 7.7289 118.0953 66.1069 31.9078 177.6884 86 I 3.5706 7.6465 119.6532 64.2666 36.7753 177.8828 87 Q 3.8336 8.0592 120.6713 59.5598 28.6124 178.7420 88 E 3.8427 7.9489 117.5675 58.3109 29.6192 178.2404 89 L 4.3416 7.4864 117.6772 54.4485 42.0434 178.0700 90 R 3.8152 7.4774 120.3681 59.2040 29.9712 176.0625 91 P 4.2100 0.0000 0.0000 66.3198 31.3644 178.7743 92 T 3.9807 7.8057 113.4743 66.3221 68.3166 176.8544 93 L 4.0681 8.0983 121.5201 57.6197 41.6295 179.0773 94 N 4.3126 8.6344 117.0320 56.1109 38.3625 176.6481 95 E 3.8968 7.9700 120.1399 59.5567 29.6264 178.3769 96 L 4.1951 7.8995 115.1709 54.7363 42.0389 176.9576 97 G 3.8745 7.7752 106.7673 46.5665 0.0000 173.9373 98 I 4.6918 8.0427 120.6216 59.8938 38.2594 176.0882 99 S 4.8831 9.0057 122.0707 57.3909 64.3930 174.9784 100 T 4.1473 8.6270 115.6456 61.0826 70.6111 173.9870 101 P 4.3251 0.0000 0.0000 65.6676 31.2913 178.9791 102 E 4.1590 8.1581 117.2665 59.5003 29.3905 178.8577 103 E 4.0852 7.8749 116.8336 58.6701 29.5684 178.3761 104 L 4.5491 7.6718 116.3467 53.4574 42.2559 176.5173 105 G 3.9150 7.8678 106.9330 46.8504 0.0000 174.6973 106 L 4.4385 8.5100 119.2743 54.5721 42.2701 177.5007 107 D 4.5292 7.9473 117.5471 53.7566 40.1306 176.2710 108 K 4.4570 7.6054 119.5138 55.3973 34.3083 176.8580 109 V 3.7919 8.2273 113.7093 61.8259 31.5216 176.0900 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 5 H 8.43 4.73 0.00 3.12 2.50 0.00 5.70 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.63 4.56 0.00 2.35 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 2.27 2.48 0.00 7 T 9.21 4.19 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 1.23 0.00 0.00 8 D 8.50 4.34 0.00 2.73 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 9 E 8.33 4.02 0.00 2.09 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 2.43 2.52 0.00 10 E 8.10 4.05 0.00 2.19 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 0.00 2.36 2.35 0.00 11 F 8.22 4.31 0.00 3.16 3.26 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 12 D 8.58 4.40 0.00 3.03 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 13 A 8.02 4.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.72 3.76 0.00 1.83 1.65 0.00 2.99 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.89 0.00 15 W 7.74 3.70 0.00 3.19 3.19 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 16 V 8.08 3.75 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 1.11 0.00 0.00 1.16 0.00 0.00 17 T 8.09 3.91 4.43 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 1.17 0.00 0.00 18 Y 7.64 3.90 0.00 2.71 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 19 F 8.08 4.70 0.00 3.23 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 20 N 7.91 4.88 0.00 2.87 2.88 0.00 0.00 6.89 7.45 0.00 0.00 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 K 7.33 3.91 0.00 1.68 1.57 0.00 1.65 0.00 0.00 1.73 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.32 7.81 22 P 0.00 4.21 0.00 2.06 2.13 0.00 3.69 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 23 D 7.86 4.73 0.00 2.77 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 24 I 7.51 3.56 1.87 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 1.40 0.87 1.01 0.00 0.00 25 D 8.52 4.79 0.00 3.06 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 26 A 8.51 4.08 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 0.00 0.00 0.00 0.00 0.00 27 W 8.40 4.11 0.00 3.47 3.40 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 28 E 9.27 4.29 0.00 2.12 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 2.74 2.85 0.00 29 L 7.75 4.31 0.00 1.87 2.01 1.02 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.01 3.89 0.00 1.69 1.85 0.00 3.17 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 31 K 7.84 3.63 0.00 0.79 1.43 0.00 1.27 0.00 0.00 1.40 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.41 7.81 32 G 8.13 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 0.00 0.00 0.00 0.00 33 M 8.40 4.23 0.00 2.09 2.30 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 2.61 2.96 0.00 34 N 8.74 4.28 0.00 2.64 2.85 0.00 0.00 7.21 6.57 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 35 T 8.21 4.05 4.68 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 1.52 0.00 0.00 36 L 7.94 3.83 0.00 1.23 1.62 -0.51 0.76 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 37 V 7.44 4.17 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 0.75 0.00 0.00 0.98 0.00 0.00 38 G 7.67 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 0.00 0.00 0.00 39 Y 6.97 4.32 0.00 3.11 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 40 D 8.30 4.62 0.00 2.63 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 41 L 6.88 4.29 0.00 1.66 1.50 0.93 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 42 V 8.20 4.29 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 0.90 0.00 0.00 0.96 0.00 0.00 43 P 0.00 4.34 0.00 2.08 1.97 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 44 E 8.71 4.23 0.00 2.07 1.94 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 2.48 2.65 0.00 45 P 0.00 4.26 0.00 2.16 2.05 0.00 3.71 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 46 K 8.18 4.11 0.00 2.02 2.12 0.00 1.56 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.61 7.81 47 I 7.94 3.96 2.05 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 1.64 0.97 1.12 0.00 0.00 48 I 7.59 3.62 1.94 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 1.76 0.98 0.85 0.00 0.00 49 D 8.64 4.29 0.00 2.73 2.91 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 50 A 7.91 4.02 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 7.68 3.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.13 3.88 0.00 1.82 1.68 0.86 0.84 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 53 R 8.21 3.98 0.00 2.03 1.99 0.00 3.14 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 54 A 8.13 4.08 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 55 C 7.87 4.13 0.00 3.18 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 56 R 7.97 3.90 0.00 1.97 2.15 0.00 3.20 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 57 R 7.97 3.96 0.00 1.99 2.02 0.00 3.21 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.97 0.00 58 L 7.29 4.49 0.00 1.87 1.72 1.03 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.72 4.16 0.00 2.83 2.88 0.00 0.00 6.59 8.70 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 60 D 8.20 4.71 0.00 2.61 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.87 4.29 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 62 A 8.25 3.89 1.42 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 0.00 0.00 0.00 63 S 8.21 4.02 0.00 3.89 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 64 A 7.49 3.91 1.17 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 65 V 7.07 3.44 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 0.95 0.00 0.00 0.34 0.00 0.00 66 R 7.72 4.00 0.00 1.92 2.03 0.00 3.18 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 67 I 7.72 3.64 1.95 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.95 0.82 0.00 0.00 68 L 7.82 4.07 0.00 1.96 1.85 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.04 3.91 0.00 2.19 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 2.35 2.34 0.00 70 V 8.10 3.59 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 0.98 0.00 0.00 0.91 0.00 0.00 71 V 7.46 3.59 2.39 0.00 0.00 0.00 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 1.06 0.00 0.00 72 K 7.93 4.09 0.00 1.25 1.69 0.00 0.61 0.00 0.00 1.16 0.00 0.00 2.66 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.15 0.78 7.81 73 D 8.23 4.27 0.00 2.78 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 74 K 8.30 4.11 0.00 1.93 1.86 0.00 1.75 0.00 0.00 1.81 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.59 1.60 7.81 75 A 8.09 4.39 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 76 G 8.41 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 0.00 0.00 0.00 77 P 0.00 4.32 0.00 2.05 2.12 0.00 3.88 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.92 0.00 78 H 8.07 4.57 0.00 3.37 3.32 0.00 5.62 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 79 K 8.31 4.06 0.00 1.76 1.91 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.37 7.81 80 E 8.15 4.23 0.00 2.14 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 0.00 2.39 2.28 0.00 81 I 7.55 3.74 2.07 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 1.40 0.93 0.98 0.00 0.00 82 Y 8.13 4.24 0.00 2.97 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 83 P 0.00 4.17 0.00 2.27 2.15 0.00 3.86 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 2.23 2.35 0.00 84 Y 7.67 4.00 0.00 2.99 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 85 V 7.73 3.46 2.11 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 0.83 0.00 0.00 1.11 0.00 0.00 86 I 7.65 3.57 1.70 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.30 0.77 0.00 0.00 87 Q 8.06 3.83 0.00 1.97 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.81 0.00 0.00 0.00 0.00 0.00 2.07 2.25 0.00 88 E 7.95 3.84 0.00 1.66 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 0.00 1.47 1.47 0.00 89 L 7.49 4.34 0.00 1.71 1.60 0.84 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 90 R 7.48 3.82 0.00 1.99 1.89 0.00 3.10 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 91 P 0.00 4.21 0.00 2.16 2.08 0.00 3.66 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 92 T 7.81 3.98 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 1.21 0.00 0.00 93 L 8.10 4.07 0.00 1.85 1.85 0.86 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 94 N 8.63 4.31 0.00 2.88 2.85 0.00 0.00 6.57 7.41 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 95 E 7.97 3.90 0.00 1.98 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 0.00 2.34 2.32 0.00 96 L 7.90 4.20 0.00 1.74 1.74 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 97 G 7.78 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 0.00 0.00 0.00 98 I 8.04 4.69 1.91 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 1.44 0.73 0.82 0.00 0.00 99 S 9.01 4.88 0.00 4.09 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 0.00 100 T 8.63 4.15 4.49 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 1.21 0.00 0.00 101 P 0.00 4.33 0.00 2.19 2.15 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.18 0.00 102 E 8.16 4.16 0.00 2.12 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 2.48 2.69 0.00 103 E 7.87 4.09 0.00 2.16 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 2.38 2.39 0.00 104 L 7.67 4.55 0.00 1.70 1.76 1.09 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 105 G 7.87 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 0.00 106 L 8.51 4.44 0.00 1.71 1.71 0.94 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 107 D 7.95 4.53 0.00 2.73 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 0.00 108 K 7.61 4.46 0.00 1.87 1.83 0.00 1.57 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.44 7.81 109 V 8.23 3.79 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 0.66 0.00 0.00 0.92 0.00 0.00