NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1793 8.1727 122.0529 56.3014 34.1350 174.0834 2 V 4.5370 8.1809 127.0101 60.7076 32.2797 174.4892 3 F 4.2807 9.9212 128.8965 57.5194 40.1861 174.9578 4 E 4.2731 8.8605 120.9330 55.6318 30.9815 176.9583 5 R 3.3113 8.9855 121.6303 60.6925 29.9535 179.5273 6 C 4.3360 8.0287 115.2525 59.7525 34.5145 175.6728 7 E 3.8924 8.1219 120.7268 59.1732 29.1930 178.5343 8 L 3.6343 8.0072 120.1806 57.7934 42.0804 178.5442 9 A 3.9395 7.8528 120.7587 55.4953 18.3327 179.9199 10 R 3.9016 7.9973 116.3759 59.5478 30.1412 179.5056 11 T 3.8704 7.7369 115.1648 66.6647 68.4678 176.7775 12 L 3.8698 8.1013 121.2497 57.4124 41.5591 179.4935 13 K 3.8707 8.0114 119.6592 59.6235 31.9878 178.9003 14 R 3.9294 7.8511 117.4506 58.9893 29.9705 177.4033 15 L 4.4018 7.4604 116.4990 53.9619 41.7309 176.7285 16 G 3.8490 7.9075 106.7310 47.0830 0.0000 175.1982 17 M 3.8948 7.8056 121.0444 56.1580 32.4998 175.8182 18 D 4.3737 8.0008 117.9614 55.8062 41.2719 175.6457 19 G 3.9233 9.3650 115.4620 45.6367 0.0000 171.3505 20 Y 4.1856 8.2421 121.8490 58.4745 38.8867 176.3239 21 R 3.6200 9.0284 127.1616 57.3082 27.7542 177.2969 22 G 3.8019 8.0358 103.2070 45.6604 0.0000 174.0182 23 I 4.0644 7.6036 122.0664 59.1012 38.0149 175.8915 24 S 4.6623 8.2943 120.3576 57.6376 64.0063 174.9190 25 L 4.1992 8.8708 123.0782 58.6188 41.7363 179.2791 26 A 4.1399 8.1962 120.0617 55.4168 18.2934 179.2385 27 N 4.4877 8.1045 114.5797 56.2710 38.5500 177.7608 28 W 4.2172 8.0510 119.9885 59.8405 29.2157 178.4209 29 M 4.1655 8.5189 119.0666 58.4868 31.5329 177.8872 30 C 3.1560 8.1631 118.6828 59.0859 44.4361 175.3730 31 L 3.9924 8.1043 121.6097 58.2559 41.7334 178.7175 32 A 4.1010 8.3638 120.8507 54.9910 18.4077 179.3642 33 K 2.7712 8.0155 117.9361 59.3601 32.0131 179.0328 34 W 4.2956 7.4647 116.5779 58.9979 29.1138 178.4036 35 E 4.3379 8.3449 118.7562 58.6376 29.5955 177.7303 36 S 4.5225 8.0375 109.8892 56.4871 64.5274 174.6055 37 G 3.4143 7.9191 108.5516 46.8178 0.0000 173.2848 38 Y 3.6546 7.6754 113.4804 58.5597 35.2125 168.5015 39 N 5.3887 7.5629 118.3461 52.0540 40.1847 175.5264 40 T 4.2388 8.9798 117.1978 63.6881 69.9371 175.8676 41 R 4.7120 8.2584 117.1814 55.7411 30.4738 176.6237 42 A 4.3353 7.7712 122.3512 52.7941 19.3472 177.1249 43 T 5.0143 8.3678 111.0488 60.0322 72.5850 173.0561 44 N 4.8707 8.8279 121.7324 52.3718 42.1550 172.2923 45 Y 4.7951 8.7312 128.0120 57.0812 40.8211 173.8758 46 N 4.6807 8.4946 125.1092 51.3082 38.5086 175.4260 47 A 3.7349 8.3939 127.7301 54.8574 18.9679 179.2214 48 G 3.7387 8.1452 104.1471 48.2441 0.0000 173.9470 49 D 4.7459 7.6229 115.3609 51.8711 39.9902 175.7203 50 R 3.8206 8.0722 116.6338 56.9983 28.1477 175.8609 51 S 4.9682 7.4756 111.2807 56.9806 66.5716 172.7317 52 T 5.1038 8.8143 116.1143 61.9577 72.6693 172.7508 53 D 5.4794 9.0956 125.2890 53.2071 43.1875 175.0769 54 Y 4.9484 9.1033 120.7472 57.4574 41.7072 177.2839 55 G 4.3438 9.0352 111.7463 46.0970 0.0000 173.4355 56 I 3.9602 8.2320 116.7880 62.9302 37.8287 177.1821 57 F 4.7730 8.0077 115.4535 56.3614 39.7741 175.5093 58 Q 3.5713 7.9438 118.8660 57.1191 26.4248 173.6350 59 I 4.4577 8.2351 119.2055 60.7042 39.3743 176.6352 60 N 5.2694 9.2113 126.3014 53.5060 39.7774 175.5949 61 S 4.7923 9.0530 120.3638 59.9166 63.3170 175.2419 62 R 3.8106 8.7276 122.3661 58.4435 30.4491 177.5897 63 Y 4.3486 7.6754 114.6087 57.6857 40.2794 176.8315 64 W 5.0125 8.1415 118.8450 57.5519 31.3631 173.9997 65 C 5.8692 8.0835 112.1939 52.8865 46.6846 172.2956 66 N 5.1050 9.0490 119.1422 51.8961 40.6790 174.6422 67 D 4.8112 8.5827 123.1740 52.2608 40.5332 177.9380 68 G 4.0924 8.4053 109.5457 46.0240 0.0000 174.8843 69 K 4.4089 7.9305 115.7785 56.6591 33.0482 175.9208 70 T 4.5226 7.7805 117.1540 61.7802 69.3004 173.0468 71 P 4.3208 0.0000 0.0000 63.3187 31.9729 176.1433 72 G 4.2943 8.5624 106.5249 46.3689 0.0000 173.3705 73 A 4.4477 7.1302 119.1956 51.2732 19.8958 177.3415 74 V 4.2939 8.3936 118.6666 61.8954 35.5724 175.0594 75 N 4.9329 8.2838 119.7840 51.7319 38.7222 174.0271 76 A 4.0368 9.4123 125.1573 54.6170 18.5137 178.9351 77 A 4.1467 8.3741 115.0670 52.6905 19.4828 178.8368 78 H 4.4404 7.7491 110.7435 56.4763 27.1715 174.6769 79 L 4.6076 7.2717 119.3569 53.2009 43.5021 175.7860 80 S 4.7035 8.2042 115.0332 57.8083 63.3324 176.0099 81 C 4.1368 8.6751 124.7157 59.7252 36.8669 176.3564 82 S 3.9083 7.7006 115.0299 61.2969 61.6820 175.9344 83 A 4.1095 7.7376 122.2768 54.5281 17.9269 177.9539 84 L 4.4705 7.6780 116.2124 55.0075 41.7860 177.5758 85 L 5.0129 7.7876 117.2398 54.5701 42.2805 176.6660 86 Q 4.4083 7.7615 117.8494 55.2569 29.6369 175.8693 87 D 4.4181 8.4900 119.3353 56.8130 41.1877 176.5849 88 N 4.6245 8.0228 118.1511 52.9187 39.1165 174.6178 89 I 4.2150 8.4667 119.0465 61.1221 37.9158 176.9918 90 A 3.9426 8.3574 124.8205 56.0928 18.1712 180.1806 91 D 4.3173 8.0922 116.4189 57.3834 40.8997 178.7281 92 A 4.1361 7.9840 120.9699 55.0314 18.4271 179.7627 93 V 3.3277 8.1039 116.8359 66.0395 31.4851 178.1876 94 A 3.8415 7.9818 120.3500 54.8710 18.1556 179.5918 95 A 3.9105 8.0789 119.2145 55.2955 18.5672 179.6119 96 A 4.0555 8.0507 119.4403 55.3629 18.0687 180.0327 97 K 3.7667 7.5969 116.0310 59.3546 32.3559 179.2697 98 R 4.0564 7.6902 119.0696 59.3857 30.0499 178.7016 99 V 2.2468 7.3806 117.7385 65.5385 31.2145 177.8073 100 A 4.1765 8.2367 119.8797 54.3543 18.0669 178.6627 101 R 4.2208 7.5600 115.0700 56.6652 30.7076 175.7068 102 D 4.7907 7.2857 117.8405 52.8887 42.5104 174.9002 103 P 4.2762 0.0000 0.0000 66.1077 31.2191 177.8412 104 Q 4.0318 8.1505 117.3712 56.5190 30.0532 177.1649 105 G 3.6858 7.9027 107.0152 47.0018 0.0000 176.6887 106 I 3.4807 7.8393 121.3137 63.5672 37.8439 177.6374 107 R 4.3068 7.3620 117.1797 57.5945 29.9151 177.5026 108 A 3.9129 7.8047 121.2053 54.0166 18.6471 177.5159 109 W 4.7101 8.1777 116.7228 55.3593 29.5820 177.3822 110 V 3.7489 8.7038 124.0551 65.9738 30.8127 177.5532 111 A 4.0758 8.3060 120.2229 54.8134 18.1889 179.2352 112 W 3.9530 8.5041 127.0076 60.6096 30.5818 178.4353 113 R 3.7561 8.1813 116.4957 59.3488 29.6628 178.3926 114 N 4.3698 7.9228 114.9742 55.6531 38.7227 176.8820 115 R 4.1072 7.7875 116.1773 55.9259 31.4254 176.0593 116 C 4.5275 7.8112 115.6783 57.7577 42.6180 174.3979 117 Q 3.0400 6.5052 118.7434 57.3763 28.6787 175.4017 118 N 4.1836 8.6497 120.1284 54.3183 36.2515 173.7196 119 R 4.5315 7.3052 115.2484 54.0080 33.5520 175.0709 120 D 4.5788 8.4930 118.6249 54.0740 40.8148 175.8267 121 V 4.6084 8.2318 119.1806 61.3983 32.4013 178.2701 122 R 4.0702 8.1256 122.4489 59.2315 29.4945 178.6782 123 Q 3.9782 8.0755 116.3958 59.6136 28.3320 178.1785 124 Y 4.3736 7.7916 117.2684 59.7886 38.0765 176.7544 125 V 4.4095 7.7762 110.9423 60.5509 33.1990 175.1667 126 Q 3.9691 7.9691 122.1513 57.2152 29.2959 176.3487 127 G 3.9805 8.9085 112.6913 45.9591 0.0000 174.5100 128 C 4.4088 7.8642 116.1994 56.9175 40.6169 174.2536 129 G 3.8806 8.2046 107.2039 46.4452 0.0000 174.1015 130 V 4.0022 7.8385 118.0860 61.0881 32.0290 175.7734 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 K 8.17 4.18 0.00 1.81 1.74 0.00 1.31 0.00 0.00 1.14 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.99 1.13 7.81 2 V 8.18 4.54 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 9.92 4.28 0.00 2.85 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 4 E 8.86 4.27 0.00 1.89 1.86 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 2.28 2.38 0.00 5 R 8.99 3.31 0.00 1.93 1.92 0.00 3.47 0.00 0.00 3.48 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.75 0.00 6 C 8.03 4.34 0.00 3.00 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 7 E 8.12 3.89 0.00 2.06 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 2.55 2.41 0.00 8 L 8.01 3.63 0.00 1.41 1.39 -0.14 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.85 3.94 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 10 R 8.00 3.90 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 11 T 7.74 3.87 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 1.21 0.00 0.00 12 L 8.10 3.87 0.00 1.73 1.58 0.95 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.01 3.87 0.00 1.94 1.94 0.00 1.65 0.00 0.00 1.58 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.85 3.93 0.00 1.95 2.08 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.46 4.40 0.00 1.55 1.55 0.84 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.91 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 0.00 0.00 0.00 17 M 7.81 3.89 0.00 1.32 1.96 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.19 0.00 18 D 8.00 4.37 0.00 2.67 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 G 9.36 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 20 Y 8.24 4.19 0.00 3.18 3.18 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 21 R 9.03 3.62 0.00 1.83 1.83 0.00 3.28 0.00 0.00 3.03 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.27 0.00 22 G 8.04 3.80 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 0.00 0.00 0.00 23 I 7.60 4.06 1.87 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 0.88 0.70 -0.31 0.00 0.00 24 S 8.29 4.66 0.00 4.07 4.03 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 25 L 8.87 4.20 0.00 2.05 1.81 0.98 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.20 4.14 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 0.00 0.00 0.00 0.00 0.00 27 N 8.10 4.49 0.00 2.84 2.72 0.00 0.00 6.96 7.54 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 28 W 8.05 4.22 0.00 3.52 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 29 M 8.52 4.17 0.00 2.17 2.37 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.90 0.00 30 C 8.16 3.16 0.00 2.66 3.18 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 31 L 8.10 3.99 0.00 1.89 1.85 0.64 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.36 4.10 1.44 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 0.00 0.00 0.00 33 K 8.02 2.77 0.00 1.59 1.66 0.00 0.62 0.00 0.00 1.09 0.00 0.00 2.64 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.98 0.21 7.81 34 W 7.46 4.30 0.00 3.38 3.28 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 35 E 8.34 4.34 0.00 2.04 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 0.00 2.60 2.49 0.00 36 S 8.04 4.52 0.00 4.05 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 37 G 7.92 3.41 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 0.00 0.00 0.00 0.00 38 Y 7.68 3.65 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 39 N 7.56 5.39 0.00 2.92 2.82 0.00 0.00 7.01 7.10 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 40 T 8.98 4.24 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 1.44 0.00 0.00 41 R 8.26 4.71 0.00 1.89 2.10 0.00 3.09 0.00 0.00 3.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 42 A 7.77 4.34 1.36 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 0.00 0.00 43 T 8.37 5.01 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 1.35 0.00 0.00 44 N 8.83 4.87 0.00 3.04 2.66 0.00 0.00 6.85 7.15 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 45 Y 8.73 4.80 0.00 3.05 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 46 N 8.49 4.68 0.00 2.62 2.61 0.00 0.00 6.51 6.84 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 47 A 8.39 3.73 1.31 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 0.00 0.00 0.00 48 G 8.15 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 49 D 7.62 4.75 0.00 2.70 2.68 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 0.00 50 R 8.07 3.82 0.00 2.02 2.18 0.00 3.10 0.00 0.00 3.18 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.52 0.00 51 S 7.48 4.97 0.00 3.82 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 52 T 8.81 5.10 4.11 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 0.63 0.00 0.00 53 D 9.10 5.48 0.00 2.72 2.62 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 54 Y 9.10 4.95 0.00 3.00 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 55 G 9.04 4.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.23 3.96 1.67 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.83 0.11 0.00 0.00 57 F 8.01 4.77 0.00 3.25 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 58 Q 7.94 3.57 0.00 2.53 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 6.79 0.00 0.00 0.00 0.00 0.00 2.53 2.80 0.00 59 I 8.24 4.46 2.14 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.05 1.18 0.00 0.00 60 N 9.21 5.27 0.00 3.08 3.06 0.00 0.00 6.97 7.63 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 61 S 9.05 4.79 0.00 4.07 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 62 R 8.73 3.81 0.00 1.55 1.34 0.00 2.43 0.00 0.00 2.84 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.12 0.00 63 Y 7.68 4.35 0.00 1.44 1.80 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 64 W 8.14 5.01 0.00 3.53 3.28 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 65 C 8.08 5.87 0.00 3.06 3.21 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 0.00 66 N 9.05 5.11 0.00 2.82 2.68 0.00 0.00 7.06 9.28 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 67 D 8.58 4.81 0.00 2.87 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 68 G 8.41 4.09 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 0.00 0.00 0.00 69 K 7.93 4.41 0.00 1.93 1.92 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.46 7.81 70 T 7.78 4.52 4.23 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 1.15 0.00 0.00 71 P 0.00 4.32 0.00 2.15 1.95 0.00 3.73 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 72 G 8.56 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 0.00 0.00 0.00 0.00 73 A 7.13 4.45 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 74 V 8.39 4.29 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 0.64 0.00 0.00 0.85 0.00 0.00 75 N 8.28 4.93 0.00 2.76 2.50 0.00 0.00 6.76 7.67 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 76 A 9.41 4.04 1.25 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 0.00 0.00 77 A 8.37 4.15 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 78 H 7.75 4.44 0.00 3.28 3.45 0.00 5.84 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.27 4.61 0.00 1.64 1.60 1.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.20 4.70 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 81 C 8.68 4.14 0.00 2.35 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 82 S 7.70 3.91 0.00 3.79 3.82 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.74 4.11 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 84 L 7.68 4.47 0.00 1.92 1.81 1.05 0.62 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 85 L 7.79 5.01 0.00 1.79 1.71 1.10 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.76 4.41 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 7.12 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 87 D 8.49 4.42 0.00 2.66 2.68 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 0.00 88 N 8.02 4.62 0.00 2.70 2.76 0.00 0.00 6.99 7.94 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 89 I 8.47 4.21 1.81 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.38 0.92 0.00 0.00 90 A 8.36 3.94 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 91 D 8.09 4.32 0.00 2.72 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 92 A 7.98 4.14 1.41 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 0.00 0.00 0.00 93 V 8.10 3.33 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 0.70 0.00 0.00 0.87 0.00 0.00 94 A 7.98 3.84 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.08 3.91 1.48 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 96 A 8.05 4.06 0.71 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 0.00 0.00 97 K 7.60 3.77 0.00 1.60 1.44 0.00 1.28 0.00 0.00 0.80 0.00 0.00 2.24 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.30 0.89 7.81 98 R 7.69 4.06 0.00 1.91 2.09 0.00 3.28 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.91 0.00 99 V 7.38 2.25 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 -0.41 0.00 0.00 -0.65 0.00 0.00 100 A 8.24 4.18 1.68 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 0.00 0.00 0.00 101 R 7.56 4.22 0.00 2.22 2.02 0.00 3.34 0.00 0.00 3.23 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 102 D 7.29 4.79 0.00 3.05 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 0.00 103 P 0.00 4.28 0.00 2.20 2.18 0.00 3.84 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 1.98 2.01 0.00 104 Q 8.15 4.03 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.87 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 105 G 7.90 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 0.00 106 I 7.84 3.48 0.99 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.66 0.00 0.00 107 R 7.36 4.31 0.00 2.03 2.05 0.00 3.22 0.00 0.00 3.29 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.59 0.00 108 A 7.80 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.18 4.71 0.00 3.47 3.24 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 0.00 110 V 8.70 3.75 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 1.10 0.00 0.00 1.00 0.00 0.00 111 A 8.31 4.08 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 0.00 0.00 0.00 0.00 0.00 112 W 8.50 3.95 0.00 3.47 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 0.00 113 R 8.18 3.76 0.00 2.08 1.99 0.00 3.60 0.00 0.00 3.59 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.08 0.00 114 N 7.92 4.37 0.00 2.59 2.73 0.00 0.00 6.96 7.69 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 0.00 115 R 7.79 4.11 0.00 0.95 0.89 0.00 2.89 0.00 0.00 2.94 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.12 0.00 116 C 7.81 4.53 0.00 1.51 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 0.00 117 Q 6.51 3.04 0.00 0.93 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.87 0.00 0.00 0.00 0.00 0.00 2.16 2.27 0.00 118 N 8.65 4.18 0.00 2.79 2.81 0.00 0.00 6.81 7.66 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 0.00 119 R 7.31 4.53 0.00 1.76 1.79 0.00 3.21 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.54 0.00 120 D 8.49 4.58 0.00 2.64 2.61 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 0.00 121 V 8.23 4.61 2.40 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 1.02 0.00 0.00 1.06 0.00 0.00 122 R 8.13 4.07 0.00 1.82 2.01 0.00 3.16 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.82 0.00 123 Q 8.08 3.98 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.11 0.00 0.00 0.00 0.00 0.00 2.01 1.43 0.00 124 Y 7.79 4.37 0.00 3.24 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 0.00 125 V 7.78 4.41 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 0.84 0.00 0.00 1.07 0.00 0.00 126 Q 7.97 3.97 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.75 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 127 G 8.91 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 0.00 128 C 7.86 4.41 0.00 3.04 3.14 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 0.00 0.00 0.00 129 G 8.20 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 0.00 130 V 7.84 4.00 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 0.74 0.00 0.00 0.96 0.00 0.00