NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8334 8.3501 109.7350 45.4257 0.0000 173.2262 3 A 3.9974 8.3484 123.0953 50.7797 19.0778 175.8025 4 R 3.9786 8.6722 121.9567 56.1006 31.5831 173.8245 5 A 4.6983 7.9120 126.3534 50.4768 22.2720 175.0582 6 S 3.6543 8.3345 116.1745 57.7578 62.2802 171.6214 7 V 3.7925 7.9322 120.8788 64.0946 31.7169 175.2208 8 L 4.8372 7.2786 118.8134 52.4927 43.8552 177.7555 9 S 4.5437 8.9723 119.9934 57.4062 65.5970 174.8400 10 G 3.7828 8.6943 107.3203 48.2507 0.0000 175.8091 11 G 3.6116 7.6839 107.2093 47.5230 0.0000 175.5511 12 E 4.0212 8.1639 121.1922 58.9225 29.4594 178.9995 13 L 4.0884 8.4889 120.6921 58.2640 41.6306 178.6115 14 D 4.4100 8.0016 118.2977 57.6506 40.8058 179.0768 15 K 4.0876 7.9307 118.6646 58.9544 31.7961 179.2366 16 W 4.0973 8.4878 128.4661 60.7619 30.7708 177.7587 17 E 4.7797 8.3646 118.0947 58.4376 28.8473 179.2173 18 K 4.0338 7.3860 118.1232 58.6368 32.9796 177.3425 19 I 3.9682 7.3288 119.9603 62.2571 38.3831 175.2377 20 R 4.6989 8.6772 124.5186 54.2553 32.2566 177.2773 21 L 3.8835 7.6225 122.2986 56.5071 42.0154 177.7814 22 R 4.7122 7.5353 114.9785 53.1882 33.7955 173.6523 23 P 4.3975 0.0000 0.0000 65.1272 31.7755 176.9873 24 G 4.1649 7.8542 106.9251 45.1227 0.0000 171.1588 25 G 4.3485 7.8369 109.0023 43.5583 0.0000 172.8434 26 K 4.6361 8.1623 115.5763 55.5814 33.0853 177.8262 27 K 4.4135 7.6105 120.3344 54.4785 33.7878 175.3310 28 Q 4.1737 8.3608 125.0397 55.6512 30.2013 175.1384 29 Y 4.2595 8.6178 117.7739 57.7219 39.3686 175.2974 30 K 5.1671 8.7543 121.4373 53.8339 35.8728 176.6679 31 L 4.0347 8.8797 121.5999 58.0233 41.3005 179.7651 32 K 3.9487 8.2694 117.8856 60.1433 31.7014 178.6578 33 H 4.6325 8.5912 116.4391 58.8172 28.5111 177.9196 34 I 3.8188 7.9695 121.4332 64.2369 36.9458 178.3894 35 V 3.7061 8.2236 119.2778 65.4398 31.5862 177.7773 36 W 4.1653 8.5646 128.0363 60.4328 30.3725 177.6402 37 A 4.2192 8.3494 120.7174 54.6047 18.2819 179.6492 38 S 4.0655 7.8380 112.8492 61.4457 62.7584 176.5246 39 R 3.9513 7.6887 121.2546 58.3251 30.0629 177.3997 40 E 3.7835 7.3068 117.6500 58.0589 29.4815 178.5527 41 L 4.1612 8.0966 119.8037 57.8731 41.2844 178.8700 42 E 4.4226 7.5697 119.5907 58.7164 29.1701 179.0465 43 R 3.9209 7.1886 115.8373 58.0714 29.9141 176.8603 44 F 4.8568 8.1719 117.3144 57.4069 39.2465 176.3467 45 A 4.0344 7.7345 119.7228 52.7960 16.7987 178.2279 46 V 4.3333 7.1463 118.5861 61.9999 33.0662 175.1375 47 N 4.6863 8.6017 125.3349 52.6821 39.2993 174.3475 48 P 4.5702 0.0000 0.0000 64.6648 31.2111 178.6000 49 G 3.7092 7.9765 105.6373 47.2239 0.0000 175.3427 50 L 4.2140 7.7673 121.3673 57.3276 41.4362 179.1135 51 L 4.1961 7.7547 118.2173 56.6944 41.4456 177.3897 52 E 4.5618 7.4918 114.7167 56.0329 30.1127 176.1669 53 T 4.5336 7.8398 110.6191 59.8554 71.2333 174.3538 54 S 4.3051 8.7952 121.1108 61.0407 62.9678 176.2336 55 E 4.1666 8.1764 122.7824 58.8942 29.7288 178.1423 56 G 3.7481 8.2117 105.9293 48.2898 0.0000 175.0124 57 C 4.0740 8.1469 119.6147 62.6964 27.9782 176.4179 58 R 3.3711 7.2516 119.2459 59.2200 29.8727 178.4008 59 Q 4.1027 7.8776 117.5684 59.0299 28.6232 178.4450 60 I 3.7350 8.2089 121.1839 64.5373 37.0589 178.4672 61 L 4.3293 8.0824 119.7092 57.3410 41.2224 179.4915 62 G 3.6530 7.8680 104.8781 46.8935 0.0000 174.7393 63 Q 4.2503 7.6344 120.3932 57.5538 29.6357 176.7897 64 L 4.2448 7.6589 118.9592 56.4841 42.0377 178.2089 65 Q 3.4598 8.3183 119.0282 58.5608 28.5236 177.3633 66 P 4.3001 0.0000 0.0000 64.8588 31.9679 176.9229 67 S 4.7312 7.5231 115.2827 58.3998 63.2049 176.3275 68 L 3.9700 7.4485 123.6583 57.6690 41.7798 178.7051 69 Q 4.0727 8.1359 118.3677 59.2968 29.1073 176.8220 70 T 4.4937 7.8288 111.7626 63.2870 68.8138 174.1447 71 G 4.3363 8.0246 110.1171 42.8547 0.0000 175.2758 72 S 4.4592 8.4272 119.6200 57.7614 65.2711 174.7313 73 E 4.0503 8.8181 119.1277 59.8955 28.9281 178.9089 74 E 4.4752 8.2691 120.2229 58.6497 29.6580 178.8474 75 L 4.0290 8.0476 119.8749 58.1143 42.3908 178.6631 76 R 3.9739 8.0192 118.7101 59.6230 29.9227 178.4510 77 S 4.1383 8.2598 113.9325 61.5232 62.7812 176.3808 78 L 4.3682 8.3016 122.4412 58.0343 41.1988 178.7262 79 Y 4.3697 8.3357 119.2534 60.9329 38.5254 178.2717 80 N 4.3839 8.1634 117.0036 56.5275 38.7983 177.4154 81 T 4.0563 8.1802 116.8143 67.0689 68.7612 176.8683 82 I 3.8138 8.4811 121.5551 64.3249 36.9301 178.1456 83 A 3.9120 7.5554 121.7409 54.9002 18.0972 179.4895 84 V 3.4052 7.5670 115.8595 66.0205 31.7301 178.0725 85 L 4.1944 8.2734 119.8266 58.2571 42.1054 177.9350 86 Y 4.1666 8.0488 119.5138 61.3352 38.7947 177.9865 87 C 3.7888 8.2914 117.3167 62.8583 27.8974 176.5924 88 V 3.5656 7.4852 119.1106 66.2252 31.2786 177.5866 89 H 4.4447 7.8018 113.5901 58.4222 28.6838 175.9984 90 Q 4.1274 7.1916 119.2192 54.9910 29.1295 175.0826 91 R 4.3745 7.8282 127.8638 56.9744 34.7215 175.8525 92 I 3.6230 7.8940 118.0051 62.1057 37.8361 175.7236 93 D 4.9319 8.2626 124.4977 52.7204 41.0728 175.7290 94 V 3.8607 7.5190 112.5781 62.0167 32.7729 176.6250 95 K 4.2534 8.8162 121.8244 57.4326 32.8319 175.6455 96 D 5.4119 7.5223 116.3698 50.9937 44.1175 175.8721 97 T 4.0002 8.3623 115.7966 66.3316 68.2812 176.9130 98 K 3.8596 8.0134 121.1954 59.7015 32.2608 178.0507 99 E 3.9109 8.8309 119.4997 59.4263 29.5974 178.6471 100 A 4.0387 7.6914 120.5579 55.0108 18.2424 179.6872 101 L 3.9784 7.9323 117.7972 57.9691 41.7501 179.0964 102 D 4.3451 8.0362 117.5743 57.0897 40.8801 178.3199 103 K 3.9916 8.1722 119.1539 59.6426 32.0914 179.4582 104 I 3.9026 7.7449 119.5288 64.0233 36.9264 178.1054 105 E 4.0434 8.5655 120.8358 59.0418 29.4334 178.4964 106 E 3.9367 8.2467 119.6356 59.0687 29.5048 178.2692 107 E 3.9484 7.7007 118.1003 59.4433 29.9951 178.3240 108 Q 4.1214 8.0165 119.1529 59.0143 29.1799 177.3565 109 N 4.3249 8.5343 118.5071 56.5208 38.3888 176.6192 110 K 3.9342 8.2582 121.0938 59.4957 32.1056 178.5257 111 S 4.3786 8.0808 113.3583 60.5753 62.0649 175.7587 112 K 3.8563 7.7773 122.0365 59.5488 31.9324 178.2488 113 K 3.9847 7.3500 118.0751 59.2728 31.9575 178.9289 114 K 4.0941 7.8924 116.9114 58.3454 33.0240 178.4767 115 A 3.8007 7.9985 119.3307 53.4342 16.6704 177.8380 116 Q 4.4627 8.2431 118.4558 58.0488 30.5520 176.4777 117 Q 4.3575 8.0575 115.0439 56.2354 30.2472 175.6629 118 A 4.6765 7.9060 118.8450 51.9258 19.2280 176.5481 119 A 4.7625 7.7942 120.1424 53.7144 19.7999 177.7689 120 A 4.5519 8.2580 121.6185 55.4467 21.2080 178.4559 121 D 4.5076 8.1655 114.0118 57.1966 41.2811 177.6762 122 T 4.0003 7.7665 107.9058 61.7854 69.3382 174.1029 123 G 3.6896 8.5474 113.0312 47.4036 0.0000 174.1286 124 N 4.7340 7.6552 122.3027 50.5469 40.8080 174.0671 125 N 4.5840 8.5794 121.7228 53.0377 40.0124 173.7013 126 S 4.7304 8.3025 116.2119 56.7568 63.7369 173.7931 127 Q 4.6684 8.5016 128.0296 55.6937 29.3144 176.2540 128 V 4.2846 7.3987 115.5652 60.6393 31.7570 171.6816 129 S 4.5886 8.1450 115.9003 56.2891 63.1404 173.1552 130 Q 4.7524 8.2721 126.6320 53.5999 31.4071 175.3816 131 N 4.6753 8.4384 118.2524 52.7460 38.3550 174.7505 132 Y 4.0153 8.6872 116.5650 58.5056 37.9799 175.8318 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 2 G 8.35 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 3 A 8.35 4.00 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 4 R 8.67 3.98 0.00 1.74 1.81 0.00 3.21 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 5 A 7.91 4.70 1.20 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 6 S 8.33 3.65 0.00 3.97 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 7 V 7.93 3.79 1.92 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 0.70 0.00 0.00 0.87 0.00 0.00 8 L 7.28 4.84 0.00 1.39 1.42 0.12 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.97 4.54 0.00 4.03 4.02 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 0.00 0.00 0.00 0.00 10 G 8.69 3.78 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 0.00 0.00 0.00 11 G 7.68 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 12 E 8.16 4.02 0.00 2.06 2.02 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 0.00 2.41 2.37 0.00 13 L 8.49 4.09 0.00 1.88 1.84 0.93 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 14 D 8.00 4.41 0.00 2.99 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 15 K 7.93 4.09 0.00 1.87 1.89 0.00 1.58 0.00 0.00 1.58 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.67 1.50 7.81 16 W 8.49 4.10 0.00 3.39 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 17 E 8.36 4.78 0.00 2.32 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 2.67 2.36 0.00 18 K 7.39 4.03 0.00 1.96 1.91 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.48 7.81 19 I 7.33 3.97 1.61 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 1.29 0.52 0.85 0.00 0.00 20 R 8.68 4.70 0.00 1.79 1.71 0.00 3.08 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 21 L 7.62 3.88 0.00 1.18 1.35 0.54 -0.87 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 22 R 7.54 4.71 0.00 1.66 1.73 0.00 3.18 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.49 0.00 23 P 0.00 4.40 0.00 2.16 2.30 0.00 3.67 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 1.97 1.95 0.00 24 G 7.85 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 0.00 0.00 0.00 25 G 7.84 4.35 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 0.00 26 K 8.16 4.64 0.00 1.65 1.71 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 1.36 7.81 27 K 7.61 4.41 0.00 1.67 1.46 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.31 1.39 7.81 28 Q 8.36 4.17 0.00 1.92 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.19 6.73 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 29 Y 8.62 4.26 0.00 2.58 1.57 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 0.00 0.00 0.00 0.00 30 K 8.75 5.17 0.00 1.71 1.59 0.00 1.78 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.51 1.45 7.81 31 L 8.88 4.03 0.00 1.79 1.77 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.27 3.95 0.00 1.74 1.88 0.00 1.66 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.59 1.58 7.81 33 H 8.59 4.63 0.00 3.95 3.68 0.00 5.64 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 7.97 3.82 1.87 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.86 0.67 0.00 0.00 35 V 8.22 3.71 2.17 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 0.98 0.00 0.00 1.00 0.00 0.00 36 W 8.56 4.17 0.00 3.66 3.47 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 37 A 8.35 4.22 1.64 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 0.00 0.00 38 S 7.84 4.07 0.00 4.04 4.35 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 39 R 7.69 3.95 0.00 1.76 1.80 0.00 3.17 0.00 0.00 3.05 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.50 0.00 40 E 7.31 3.78 0.00 1.54 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 1.79 1.99 0.00 41 L 8.10 4.16 0.00 1.81 1.95 0.97 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 42 E 7.57 4.42 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 2.29 2.34 0.00 43 R 7.19 3.92 0.00 1.55 1.51 0.00 3.18 0.00 0.00 3.08 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.53 0.00 44 F 8.17 4.86 0.00 3.20 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 45 A 7.73 4.03 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 46 V 7.15 4.33 2.31 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 1.12 0.00 0.00 1.08 0.00 0.00 47 N 8.60 4.69 0.00 2.80 2.72 0.00 0.00 6.85 8.03 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 48 P 0.00 4.57 0.00 2.25 2.48 0.00 3.69 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 49 G 7.98 3.71 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 0.00 50 L 7.77 4.21 0.00 1.67 1.75 0.94 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.75 4.20 0.00 1.80 1.74 0.95 0.75 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 52 E 7.49 4.56 0.00 2.16 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 2.23 0.00 53 T 7.84 4.53 4.24 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 1.26 0.00 0.00 54 S 8.80 4.31 0.00 4.17 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 0.00 55 E 8.18 4.17 0.00 2.09 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 2.38 2.40 0.00 56 G 8.21 3.75 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 0.00 0.00 0.00 57 C 8.15 4.07 0.00 3.39 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 58 R 7.25 3.37 0.00 2.16 2.00 0.00 3.32 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.41 0.00 59 Q 7.88 4.10 0.00 2.27 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.55 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 60 I 8.21 3.73 2.00 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 1.55 0.90 0.97 0.00 0.00 61 L 8.08 4.33 0.00 1.73 1.80 0.48 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 62 G 7.87 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.63 4.25 0.00 2.01 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.79 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 64 L 7.66 4.24 0.00 1.89 1.69 1.09 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 8.32 3.46 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.86 0.00 0.00 0.00 0.00 0.00 2.37 2.71 0.00 66 P 0.00 4.30 0.00 2.13 2.14 0.00 3.50 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.01 0.00 67 S 7.52 4.73 0.00 3.82 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 68 L 7.45 3.97 0.00 1.62 1.70 0.34 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 8.14 4.07 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.45 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 70 T 7.83 4.49 4.22 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 1.20 0.00 0.00 71 G 8.02 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 72 S 8.43 4.46 0.00 4.14 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 0.00 73 E 8.82 4.05 0.00 2.29 2.32 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 2.45 2.53 0.00 74 E 8.27 4.48 0.00 2.31 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 0.00 2.52 2.49 0.00 75 L 8.05 4.03 0.00 1.75 1.82 0.82 0.87 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 76 R 8.02 3.97 0.00 1.99 1.97 0.00 3.34 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.87 0.00 77 S 8.26 4.14 0.00 3.72 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 78 L 8.30 4.37 0.00 2.24 1.97 1.14 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 79 Y 8.34 4.37 0.00 3.06 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 80 N 8.16 4.38 0.00 3.08 2.89 0.00 0.00 6.88 6.33 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 81 T 8.18 4.06 4.53 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 1.73 0.00 0.00 82 I 8.48 3.81 1.91 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.02 0.91 0.00 0.00 83 A 7.56 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 V 7.57 3.41 1.49 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 0.22 0.00 0.00 0.80 0.00 0.00 85 L 8.27 4.19 0.00 2.13 1.68 0.04 0.61 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 86 Y 8.05 4.17 0.00 3.15 3.15 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 0.00 0.00 0.00 0.00 87 C 8.29 3.79 0.00 3.12 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 88 V 7.49 3.57 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 0.87 0.00 0.00 1.06 0.00 0.00 89 H 7.80 4.44 0.00 3.20 3.27 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Q 7.19 4.13 0.00 1.59 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 7.18 0.00 0.00 0.00 0.00 0.00 2.14 1.66 0.00 91 R 7.83 4.37 0.00 1.70 1.83 0.00 3.26 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.38 0.00 92 I 7.89 3.62 1.81 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 1.29 0.61 0.92 0.00 0.00 93 D 8.26 4.93 0.00 2.55 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 94 V 7.52 3.86 2.16 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 0.83 0.00 0.00 0.94 0.00 0.00 95 K 8.82 4.25 0.00 1.79 1.76 0.00 1.56 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.34 7.81 96 D 7.52 5.41 0.00 2.78 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 97 T 8.36 4.00 4.36 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 1.29 0.00 0.00 98 K 8.01 3.86 0.00 1.84 1.95 0.00 1.60 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.52 1.56 7.81 99 E 8.83 3.91 0.00 2.20 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 2.31 2.34 0.00 100 A 7.69 4.04 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 0.00 101 L 7.93 3.98 0.00 1.86 1.77 0.79 0.82 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 0.00 102 D 8.04 4.35 0.00 2.73 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 0.00 103 K 8.17 3.99 0.00 1.99 1.86 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.57 1.63 7.81 104 I 7.74 3.90 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.41 0.90 0.00 0.00 105 E 8.57 4.04 0.00 2.18 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 2.35 2.37 0.00 106 E 8.25 3.94 0.00 2.33 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 2.33 2.33 0.00 107 E 7.70 3.95 0.00 2.06 2.13 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 2.38 2.36 0.00 108 Q 8.02 4.12 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.57 0.00 0.00 0.00 0.00 0.00 2.51 2.42 0.00 109 N 8.53 4.32 0.00 2.89 2.99 0.00 0.00 6.84 7.07 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 0.00 110 K 8.26 3.93 0.00 2.08 1.96 0.00 1.58 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.51 7.81 111 S 8.08 4.38 0.00 3.96 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 0.00 112 K 7.78 3.86 0.00 1.94 1.84 0.00 1.88 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.50 7.81 113 K 7.35 3.98 0.00 2.12 1.89 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.51 7.81 114 K 7.89 4.09 0.00 1.85 1.85 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.15 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.56 7.81 115 A 8.00 3.80 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 0.00 116 Q 8.24 4.46 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.85 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 117 Q 8.06 4.36 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.59 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 118 A 7.91 4.68 1.26 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 0.00 0.00 119 A 7.79 4.76 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 0.00 120 A 8.26 4.55 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 0.00 121 D 8.17 4.51 0.00 2.66 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 0.00 122 T 7.77 4.00 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 1.20 0.00 0.00 123 G 8.55 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 0.00 124 N 7.66 4.73 0.00 2.63 2.72 0.00 0.00 6.84 7.99 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 0.00 125 N 8.58 4.58 0.00 2.68 2.71 0.00 0.00 7.06 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 0.00 126 S 8.30 4.73 0.00 3.86 3.71 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 0.00 127 Q 8.50 4.67 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.98 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 128 V 7.40 4.28 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 0.95 0.00 0.00 0.92 0.00 0.00 129 S 8.15 4.59 0.00 3.87 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 0.00 130 Q 8.27 4.75 0.00 1.96 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 131 N 8.44 4.68 0.00 2.89 2.86 0.00 0.00 6.17 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 0.00 132 Y 8.69 4.02 0.00 2.95 2.96 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 0.00