NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3054 8.1233 122.4649 51.8086 20.5925 175.2391 2 D 5.3151 8.3518 120.2144 52.1160 43.5540 174.4998 3 F 4.9129 10.0115 121.8068 55.6831 44.0693 173.2911 4 E 5.0686 8.8102 118.4229 54.6385 33.1835 175.6689 5 V 4.4395 8.5587 122.7750 61.5164 34.6661 173.9707 6 H 5.2438 9.4470 125.4475 55.0214 31.2007 174.1548 7 M 4.6882 9.0253 122.3681 53.8383 33.7084 175.0740 8 L 5.1372 8.4701 123.6258 52.7610 45.7652 177.8104 9 N 4.5960 9.5946 119.6926 55.9487 39.6696 175.7254 10 K 4.9613 7.7894 115.6181 55.6884 35.6733 175.2940 11 G 4.3791 8.6794 108.9240 43.9630 0.0000 172.3833 12 K 3.7934 9.0424 119.2743 59.6971 32.0921 177.7882 13 D 4.5868 7.9701 114.8141 54.3304 41.5844 174.8123 14 G 3.8011 8.0945 103.7361 44.2571 0.0000 173.2785 15 A 4.5757 8.3738 121.8580 52.9940 19.6078 177.2134 16 M 3.1755 8.7768 119.8839 56.0235 29.4302 176.2854 17 V 4.8020 8.1255 113.6651 59.3114 36.7740 174.3401 18 F 5.0091 8.8349 120.6240 56.1658 41.0933 175.3666 19 E 4.8402 9.3358 122.5082 53.9266 32.5337 173.8671 20 P 4.9152 0.0000 0.0000 62.6365 32.6047 176.1781 21 A 4.6240 8.7280 121.0027 52.8212 20.5578 176.9326 22 S 4.9917 7.7891 111.7376 56.5881 67.3370 172.8856 23 L 4.7309 8.5581 125.5379 53.3921 45.8846 174.0239 24 K 4.8905 8.4384 126.4870 54.7532 34.3412 175.1334 25 V 4.3819 8.5886 119.4637 59.4556 36.2810 174.2277 26 A 4.9151 9.6354 123.4305 49.6747 21.3974 175.2732 27 P 4.3295 0.0000 0.0000 64.4792 31.7042 177.1837 28 G 4.0391 8.9293 112.2677 45.2112 0.0000 173.4458 29 D 4.8404 8.3042 119.6599 54.7541 42.4144 175.3757 30 T 5.2129 8.7799 116.5799 61.9121 72.0176 173.6117 31 V 4.8518 8.7663 124.3446 61.5118 34.9395 174.0796 32 T 4.9121 8.6744 124.5653 62.0210 70.8938 173.4877 33 F 5.0703 9.4412 126.0751 56.3590 40.7775 174.7628 34 I 4.7315 8.9504 126.2253 58.7757 39.1405 174.4375 35 P 4.7022 0.0000 0.0000 62.2593 28.6995 175.7981 36 T 4.1189 8.2227 123.1736 67.0242 69.2735 174.7189 37 D 4.9849 7.8861 119.0125 52.2813 43.1060 176.4601 38 K 4.3146 8.3115 121.0823 56.9613 33.0177 177.3684 39 G 3.8815 9.8157 109.0827 45.5448 0.0000 172.8138 40 H 5.1994 7.8447 115.6051 53.9559 33.0549 172.4599 41 N 5.3175 8.3103 115.9278 51.9343 41.1515 172.8905 42 V 4.8612 8.5169 116.8180 60.4802 34.9694 174.2818 43 E 4.9882 8.9626 123.2698 54.7690 33.3837 174.3142 44 T 4.2146 7.7223 116.3558 61.4965 70.0542 174.0357 45 I 3.9302 8.3356 125.2420 60.2192 38.5726 175.8744 46 K 3.9380 8.5450 126.4693 58.1038 32.2831 177.4036 47 G 3.9843 8.9371 110.7269 46.0990 0.0000 173.2282 48 M 4.8107 8.0946 119.7573 54.7369 33.0515 175.1326 49 I 4.4649 7.4684 110.3562 57.9759 40.9232 173.1251 50 P 4.4137 0.0000 0.0000 61.8598 32.2236 175.1763 51 D 4.4585 8.2181 118.8328 55.7701 40.9992 177.5251 52 G 3.8931 8.9675 110.9059 45.3599 0.0000 173.1031 53 A 4.7388 7.4551 121.8167 50.6392 20.7349 176.1355 54 E 4.7473 8.4145 116.6283 54.0138 32.1523 176.0642 55 A 4.1985 8.3165 123.1219 52.3754 19.3876 176.6315 56 F 5.1649 7.9046 113.6294 55.5923 42.1507 173.8133 57 K 4.8626 8.4845 120.8672 55.5800 34.5756 175.6819 58 S 4.0956 8.7184 123.4853 57.2749 65.0194 173.6088 59 K 4.4673 9.3172 119.5220 54.8343 33.8812 177.0693 60 I 3.9471 8.1546 123.2024 63.2735 37.3831 176.5236 61 N 4.4885 8.8400 121.0330 53.3169 37.0185 174.2824 62 E 4.4068 7.7205 115.9830 55.2553 30.9807 175.8571 63 N 4.8327 8.6754 118.7774 53.2987 39.3715 173.8499 64 Y 4.6452 8.9750 126.6341 55.7213 40.9445 174.0790 65 K 4.7575 8.2063 128.4835 54.9263 33.8579 175.5117 66 V 3.8798 8.3701 126.8158 61.1406 34.5018 174.0125 67 T 4.6933 8.0184 124.3157 62.0976 69.9384 174.1974 68 F 3.9858 8.8849 126.7259 57.3517 39.6815 175.5495 69 T 4.2443 8.8848 114.3379 63.1925 70.2474 174.5608 70 A 4.2161 7.8783 126.8317 50.2644 19.2902 175.6200 71 P 4.5668 0.0000 0.0000 62.7659 32.3972 176.1748 72 G 4.0102 7.6482 106.1073 43.7035 0.0000 171.8302 73 V 4.7072 8.4202 120.9945 61.6231 32.8625 175.0213 74 Y 4.7638 9.2222 125.6901 56.1818 40.7313 174.7207 75 G 4.3303 9.0622 112.2299 44.8605 0.0000 172.9900 76 V 4.9964 8.6831 117.4280 59.1877 35.7829 174.7052 77 K 5.2581 9.2121 121.8319 55.4818 37.1026 174.3592 78 C 5.0492 8.9624 121.1567 57.7139 32.6015 173.8965 79 T 3.8695 9.3117 124.8866 66.4226 68.2784 174.8514 80 P 4.3687 0.0000 0.0000 65.1609 31.8562 176.5952 81 H 4.9882 7.9243 114.7843 55.6077 29.3371 175.8154 82 Y 4.3895 7.9726 123.1992 60.8058 38.6819 178.6525 83 G 3.5491 8.1387 107.0435 48.1048 0.0000 173.7382 84 M 4.2246 8.0137 117.3779 55.2516 32.3563 176.6492 85 G 3.8340 8.1644 107.2119 45.8060 0.0000 174.1562 86 M 4.8157 8.0481 121.2492 54.1635 31.6733 175.3885 87 V 5.2570 8.3261 116.9386 60.0810 36.7297 173.7705 88 G 4.1705 8.7709 108.3169 45.6391 0.0000 172.0315 89 V 4.9122 8.7955 119.0381 60.8950 35.2951 174.2266 90 V 4.4849 8.7783 127.2225 61.1491 34.0387 173.7497 91 Q 4.6079 9.0311 130.7472 54.8388 30.7989 174.3139 92 V 4.3826 9.1033 127.9142 62.6694 32.9877 176.4433 93 G 4.2075 9.0772 114.7170 45.1438 0.0000 171.6213 94 D 4.4625 8.3142 117.8615 54.0039 42.1997 176.5129 95 A 3.7268 8.5188 121.7352 52.4172 15.5222 175.4848 96 P 4.2524 0.0000 0.0000 62.2296 32.1874 178.4130 97 A 4.1207 8.6651 126.2982 54.0065 18.8974 177.3585 98 N 4.7701 7.9032 111.9118 52.5973 38.3296 176.3178 99 L 3.9049 7.6456 121.4984 58.8663 41.8067 178.8936 100 E 3.9593 8.0872 116.3731 59.3495 29.7968 178.7125 101 A 4.1570 7.8969 120.1044 54.5811 18.6416 179.6829 102 V 3.6392 7.9293 117.3080 66.0574 31.3527 178.4011 103 K 4.1357 7.9170 117.3884 58.9814 31.9548 178.7837 104 G 3.7730 7.5877 102.2623 44.6502 0.0000 174.0601 105 A 4.1297 7.1174 123.7393 52.1335 19.0145 177.0031 106 K 4.4318 8.4092 120.6350 55.4766 33.1871 176.2853 107 N 5.1365 8.2826 119.6569 49.8178 43.0146 173.0621 108 P 4.2745 0.0000 0.0000 61.9969 33.3285 177.3479 109 K 3.7875 8.6103 122.3049 60.1567 31.9131 179.1827 110 K 3.9950 7.9857 117.5122 59.1756 31.9327 179.2028 111 A 4.0320 7.7850 120.8416 55.1421 18.3849 179.2558 112 Q 3.9596 8.5122 118.5604 59.2335 28.9323 178.2280 113 E 3.9546 8.3136 119.6954 59.6825 29.4969 179.6759 114 R 4.0150 7.8251 118.0449 58.9919 30.1557 179.0408 115 L 4.0109 8.3817 119.3105 57.9459 41.6748 179.2012 116 D 4.3600 8.3672 118.6951 57.3485 40.7497 178.8379 117 A 3.9872 7.8670 120.9560 55.1317 18.1900 179.5972 118 A 4.3294 7.8911 119.5644 54.8267 18.6165 179.5695 119 L 4.0616 8.6252 117.6780 57.8958 41.8229 179.6412 120 A 4.0240 8.2322 120.4808 54.8480 18.0622 179.4660 121 A 4.0550 7.8974 118.5515 54.4628 18.4871 178.7198 122 L 4.4429 7.4586 115.5222 54.4517 42.1117 177.1162 123 G 3.8884 7.6966 107.4233 45.5491 0.0000 173.4548 124 N 4.6618 8.1887 123.1584 53.6261 39.7142 173.6540 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 8.12 4.31 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 2 D 8.35 5.32 0.00 2.49 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 3 F 10.01 4.91 0.00 2.88 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 4 E 8.81 5.07 0.00 1.81 1.72 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 2.15 2.24 0.00 5 V 8.56 4.44 1.73 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 1.37 0.00 0.00 0.75 0.00 0.00 6 H 9.45 5.24 0.00 3.14 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 M 9.03 4.69 0.00 1.71 1.99 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.54 0.00 8 L 8.47 5.14 0.00 1.45 1.47 0.98 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 9 N 9.59 4.60 0.00 2.66 2.85 0.00 0.00 6.72 7.56 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 10 K 7.79 4.96 0.00 1.80 1.72 0.00 1.54 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.43 7.81 11 G 8.68 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 12 K 9.04 3.79 0.00 1.73 1.87 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.74 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.45 7.81 13 D 7.97 4.59 0.00 2.69 2.67 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 0.00 0.00 0.00 0.00 14 G 8.09 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 15 A 8.37 4.58 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 16 M 8.78 3.18 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 17 V 8.13 4.80 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 0.81 0.00 0.00 0.92 0.00 0.00 18 F 8.83 5.01 0.00 3.06 3.12 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 19 E 9.34 4.84 0.00 1.92 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 2.26 2.26 0.00 20 P 0.00 4.92 0.00 2.28 2.08 0.00 3.81 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 21 A 8.73 4.62 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 22 S 7.79 4.99 0.00 3.72 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 23 L 8.56 4.73 0.00 1.55 1.24 0.71 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.44 4.89 0.00 1.69 1.56 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.69 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.23 1.35 7.81 25 V 8.59 4.38 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 -0.29 0.00 0.00 0.75 0.00 0.00 26 A 9.64 4.92 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 27 P 0.00 4.33 0.00 2.09 2.08 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 28 G 8.93 4.04 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 0.00 29 D 8.30 4.84 0.00 2.83 2.95 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 30 T 8.78 5.21 4.45 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 0.00 0.00 0.00 1.16 0.00 0.00 31 V 8.77 4.85 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 0.28 0.00 0.00 0.99 0.00 0.00 32 T 8.67 4.91 4.19 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 1.22 0.00 0.00 33 F 9.44 5.07 0.00 3.19 3.23 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 34 I 8.95 4.73 1.76 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.78 0.98 0.00 0.00 35 P 0.00 4.70 0.00 2.13 2.16 0.00 4.01 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.19 0.00 36 T 8.22 4.12 4.46 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 37 D 7.89 4.98 0.00 2.75 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 38 K 8.31 4.31 0.00 1.74 1.82 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.38 7.81 39 G 9.82 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 0.00 0.00 0.00 40 H 7.84 5.20 0.00 3.06 3.11 0.00 5.58 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.31 5.32 0.00 2.73 2.88 0.00 0.00 5.44 7.68 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 42 V 8.52 4.86 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 0.56 0.00 0.00 0.39 0.00 0.00 43 E 8.96 4.99 0.00 1.88 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.26 0.00 44 T 7.72 4.21 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 45 I 8.34 3.93 1.79 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 0.90 0.52 0.92 0.00 0.00 46 K 8.54 3.94 0.00 1.72 1.74 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.38 7.81 47 G 8.94 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 48 M 8.09 4.81 0.00 2.00 2.05 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 2.48 2.41 0.00 49 I 7.47 4.46 1.70 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.56 0.86 0.00 0.00 50 P 0.00 4.41 0.00 2.17 2.08 0.00 2.69 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.52 0.00 51 D 8.22 4.46 0.00 2.67 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 52 G 8.97 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.46 4.74 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 54 E 8.41 4.75 0.00 2.12 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 2.28 2.39 0.00 55 A 8.32 4.20 1.21 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 0.00 0.00 56 F 7.90 5.16 0.00 3.10 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 57 K 8.48 4.86 0.00 1.66 1.64 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.24 1.34 7.81 58 S 8.72 4.10 0.00 3.50 2.63 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 59 K 9.32 4.47 0.00 1.65 1.74 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.57 1.56 7.81 60 I 8.15 3.95 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.71 0.86 0.00 0.00 61 N 8.84 4.49 0.00 2.93 3.02 0.00 0.00 7.01 6.95 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 62 E 7.72 4.41 0.00 2.18 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 2.60 2.42 0.00 63 N 8.68 4.83 0.00 2.68 2.87 0.00 0.00 6.74 7.46 0.00 0.00 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 Y 8.98 4.65 0.00 3.11 2.98 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 65 K 8.21 4.76 0.00 1.68 1.47 0.00 1.57 0.00 0.00 1.51 0.00 0.00 2.77 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.24 1.26 7.81 66 V 8.37 3.88 1.30 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 -0.12 0.00 0.00 0.58 0.00 0.00 67 T 8.02 4.69 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 1.23 0.00 0.00 68 F 8.88 3.99 0.00 2.91 2.80 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 69 T 8.88 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 1.22 0.00 0.00 70 A 7.88 4.22 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 71 P 0.00 4.57 0.00 2.23 2.11 0.00 3.82 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 72 G 7.65 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 73 V 8.42 4.71 2.04 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 0.78 0.00 0.00 0.91 0.00 0.00 74 Y 9.22 4.76 0.00 3.01 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 75 G 9.06 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 0.00 0.00 0.00 0.00 76 V 8.68 5.00 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 0.79 0.00 0.00 0.53 0.00 0.00 77 K 9.21 5.26 0.00 1.64 1.60 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.45 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.15 1.15 7.81 78 C 8.96 5.05 0.00 3.09 2.92 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 79 T 9.31 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 1.18 0.00 0.00 80 P 0.00 4.37 0.00 1.89 2.08 0.00 3.74 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.88 0.00 81 H 7.92 4.99 0.00 3.31 3.35 0.00 5.64 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 82 Y 7.97 4.39 0.00 3.10 2.98 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 83 G 8.14 3.55 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 0.00 0.00 0.00 84 M 8.01 4.22 0.00 2.03 2.28 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.54 0.00 85 G 8.16 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 0.00 0.00 0.00 86 M 8.05 4.82 0.00 2.26 2.09 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.10 0.00 87 V 8.33 5.26 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 1.01 0.00 0.00 1.12 0.00 0.00 88 G 8.77 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 89 V 8.80 4.91 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 0.92 0.00 0.00 0.93 0.00 0.00 90 V 8.78 4.48 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 0.12 0.00 0.00 0.93 0.00 0.00 91 Q 9.03 4.61 0.00 2.08 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.40 2.27 0.00 92 V 9.10 4.38 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 0.96 0.00 0.00 0.59 0.00 0.00 93 G 9.08 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 0.00 0.00 0.00 0.00 94 D 8.31 4.46 0.00 2.68 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 95 A 8.52 3.73 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 4.25 0.00 2.21 2.20 0.00 3.69 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 2.06 1.95 0.00 97 A 8.67 4.12 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 98 N 7.90 4.77 0.00 2.81 2.97 0.00 0.00 5.90 6.67 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 99 L 7.65 3.90 0.00 1.80 1.78 0.91 0.96 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 0.00 100 E 8.09 3.96 0.00 1.94 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 2.31 2.43 0.00 101 A 7.90 4.16 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 0.00 102 V 7.93 3.64 2.04 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 1.01 0.00 0.00 0.91 0.00 0.00 103 K 7.92 4.14 0.00 1.96 1.86 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.58 7.81 104 G 7.59 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 0.00 105 A 7.12 4.13 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 0.00 106 K 8.41 4.43 0.00 1.77 1.77 0.00 1.72 0.00 0.00 1.85 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.40 7.81 107 N 8.28 5.14 0.00 2.65 2.63 0.00 0.00 7.14 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 0.00 108 P 0.00 4.27 0.00 1.83 1.76 0.00 3.21 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.40 0.00 109 K 8.61 3.79 0.00 1.82 1.81 0.00 1.59 0.00 0.00 1.80 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.74 7.81 110 K 7.99 4.00 0.00 1.91 1.83 0.00 1.82 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.43 7.81 111 A 7.78 4.03 1.30 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 0.00 0.00 0.00 112 Q 8.51 3.96 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.73 0.00 0.00 0.00 0.00 0.00 2.35 2.61 0.00 113 E 8.31 3.95 0.00 2.22 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 2.33 2.58 0.00 114 R 7.83 4.02 0.00 1.97 2.03 0.00 3.36 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.69 0.00 115 L 8.38 4.01 0.00 1.81 1.74 1.00 0.96 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 0.00 116 D 8.37 4.36 0.00 2.89 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 0.00 117 A 7.87 3.99 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 0.00 118 A 7.89 4.33 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 0.00 119 L 8.63 4.06 0.00 1.84 1.73 0.92 0.67 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 0.00 120 A 8.23 4.02 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 0.00 121 A 7.90 4.05 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 0.00 122 L 7.46 4.44 0.00 1.69 1.69 0.89 1.12 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 0.00 123 G 7.70 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 124 N 8.19 4.66 0.00 2.86 2.85 0.00 0.00 7.04 7.56 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