NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4111 8.3044 120.3240 54.8281 33.6932 175.3676 2 K 3.9934 8.0325 119.4720 56.0871 33.0025 174.3956 3 T 4.1564 8.6313 123.4891 62.1611 69.9990 173.4311 4 P 4.4494 0.0000 0.0000 62.3974 33.4557 177.0830 5 R 3.8886 8.6031 119.3868 60.0136 29.9208 178.9916 6 R 3.9222 7.9677 117.1540 59.3013 30.0738 178.8670 7 R 3.9716 7.8868 118.0318 59.2640 30.0639 177.9165 8 M 4.0999 8.1165 118.1360 58.8683 32.2840 178.2688 9 R 3.7301 8.2761 119.0806 59.3442 30.2156 178.4500 10 L 4.1758 8.1693 118.7262 57.5935 41.5743 179.3047 11 A 4.0928 8.1508 121.0365 54.9667 18.2839 179.8193 12 V 3.4843 7.5551 116.9229 66.0891 31.6017 177.9863 13 F 4.1165 8.4077 120.3542 61.3741 39.1764 177.1648 14 K 3.7439 8.7097 118.2187 59.2825 31.8071 179.2103 15 A 3.9557 8.0177 121.0425 55.0522 18.0826 179.6631 16 L 3.8383 7.5564 116.3767 57.7449 41.9002 179.2080 17 F 3.9538 7.9936 120.8414 61.5047 39.3044 177.2764 18 Q 4.2729 8.5773 117.9440 59.2287 28.4940 178.2576 19 H 4.1328 8.3525 119.2275 58.9816 29.5951 177.0208 20 E 3.7028 7.5092 119.2380 58.0016 29.1129 178.0400 21 F 4.8008 7.3624 115.0805 56.7176 41.1008 175.6015 22 R 4.7075 7.7560 117.7230 55.3126 30.7033 176.8472 23 R 3.7105 7.7849 116.3324 58.2248 30.6594 177.9038 24 D 4.6071 7.8957 115.6883 53.5064 40.1880 175.9235 25 E 4.6288 7.7037 119.6476 54.6059 31.8274 175.5961 26 D 4.4632 8.3568 120.7502 53.8691 42.6199 176.9015 27 L 3.9120 8.5957 128.3655 58.5278 42.0622 178.8973 28 E 3.9521 8.6482 118.5203 59.4641 29.1420 179.3571 29 Q 4.0026 7.8313 116.7290 58.8784 29.1465 178.2323 30 I 3.8347 7.7358 120.9360 64.2847 37.0548 178.1657 31 L 3.9021 7.9544 121.1166 58.2482 41.6754 178.9067 32 E 3.8958 7.8954 117.2772 59.2853 29.3650 178.8856 33 E 4.1256 7.7028 117.7464 59.1050 29.5532 179.0058 34 I 3.9112 7.3946 118.8329 63.0839 37.7698 176.8191 35 L 3.5994 7.4166 119.8474 54.4993 42.3231 176.2822 36 D 4.6615 8.3974 121.1722 52.5080 41.5152 175.0425 37 E 4.0646 8.9528 116.1237 59.7956 29.4165 177.8503 38 T 4.0469 8.4635 108.5986 62.8376 69.2242 173.7748 39 Y 4.5074 7.9159 121.1335 56.2414 39.8059 176.0193 40 D 4.7133 8.8472 125.3282 52.2337 42.0047 177.3174 41 K 3.8140 8.6294 120.0876 59.8565 31.9223 178.3246 42 K 3.9516 8.0649 118.7790 59.5162 32.1518 178.4756 43 A 4.1266 8.7666 121.4748 55.0437 18.2958 179.8378 44 K 3.8655 8.3041 117.1355 59.3980 32.1564 179.1369 45 E 3.9386 8.3040 119.5787 59.4214 29.5116 178.6204 46 D 4.4546 8.5981 118.9461 57.4456 40.8809 178.5838 47 A 3.8593 8.2236 121.4920 55.2825 18.2793 179.9004 48 R 3.8195 8.0921 116.4762 59.2968 30.0540 179.2799 49 R 3.8792 8.1538 118.4728 59.5592 30.0419 178.0143 50 Y 3.5338 8.4604 116.7084 61.1911 37.8909 178.8697 51 I 3.5976 7.9314 120.5888 64.5109 37.1065 178.8460 52 R 3.9440 8.2153 119.1512 59.0085 29.9481 179.3821 53 G 3.2851 8.1495 106.0767 47.6284 0.0000 175.9679 54 I 3.6342 7.4840 122.5560 63.8045 36.8713 178.4291 55 K 3.8638 7.7786 119.5926 59.5333 32.1324 178.2870 56 E 4.0845 8.2579 118.6052 58.1989 29.6311 176.9630 57 N 4.9457 7.6686 114.5954 52.7731 39.5649 175.9843 58 L 3.9493 7.7239 122.1090 58.5873 41.9018 179.3008 59 S 4.1190 8.0171 114.2747 61.9155 62.8897 176.2608 60 M 4.0630 8.0290 120.3020 58.5881 32.0107 178.1733 61 I 3.7883 8.1964 120.2880 64.5614 37.3373 178.1385 62 D 4.3943 8.5415 120.1204 57.4767 40.4488 178.3350 63 D 4.3523 8.1859 117.5871 57.2006 41.4869 177.8820 64 L 4.1601 8.0766 120.7571 58.3102 42.1103 178.8828 65 I 3.8480 8.0053 119.8446 64.7258 37.1869 178.5994 66 S 4.2513 8.4352 115.6412 61.2813 62.4051 176.3029 67 R 4.1552 7.8339 119.0423 57.5452 29.8307 176.4807 68 Y 4.5732 8.0063 115.3021 57.3581 38.9863 175.2236 69 L 4.9746 7.7165 119.8997 53.1888 43.6384 174.6527 70 E 4.5472 8.3384 121.1447 57.4917 32.4608 176.3447 71 K 3.9801 8.3715 120.1388 58.5868 32.6491 177.1685 72 W 4.7418 8.1579 116.5170 54.8394 31.3939 175.3502 73 S 4.9567 8.3477 115.2409 56.1374 64.7015 174.7665 74 L 4.0768 8.6583 123.4771 58.3442 41.8909 179.0319 75 N 4.5340 7.6153 113.0476 55.1459 37.4721 176.1078 76 R 4.3429 7.7874 116.7474 57.2446 30.7216 176.7600 77 L 4.0687 7.3831 116.9625 53.9251 42.3640 177.3732 78 S 4.4123 8.0520 115.2448 58.2449 65.1283 175.5717 79 V 3.5491 8.3105 115.7230 64.4422 31.0802 179.1467 80 V 4.0670 7.8602 117.5244 66.4105 31.6486 177.7421 81 D 4.4489 8.3238 118.7016 57.2704 40.6708 178.7104 82 R 3.9713 8.2652 119.3349 59.7419 30.0532 178.3461 83 N 4.5524 8.2538 115.5263 55.8497 38.4924 177.7673 84 V 3.7826 8.4971 120.4658 66.0028 31.5851 178.0836 85 L 4.0341 8.2347 118.8040 57.7684 41.4222 179.7062 86 R 3.9840 8.2190 118.0063 59.1638 30.0390 178.8149 87 L 4.1297 8.3672 120.0427 58.3442 42.1502 178.9263 88 A 4.1064 8.4591 120.9825 55.4624 18.2491 179.7918 89 T 3.8252 8.2604 114.4662 66.7454 68.4322 176.2281 90 Y 4.2141 8.2946 121.5480 60.7924 38.7287 177.8768 91 E 3.5170 8.4363 120.1422 58.9625 29.5394 178.2940 92 L 3.8814 7.9540 119.5539 58.3922 42.2109 178.7439 93 L 3.7943 7.6419 117.2527 56.6009 41.6247 177.8582 94 F 4.5597 7.7057 115.1622 57.2154 41.0869 175.7350 95 E 4.3446 7.4663 121.1479 54.4166 28.2208 174.9015 96 K 4.1935 7.9263 122.6548 57.0763 32.9762 176.8451 97 D 4.7751 8.8411 120.7282 53.2730 37.0408 175.4160 98 I 4.2791 6.9741 120.3170 58.8671 37.9972 174.4196 99 P 4.3975 0.0000 0.0000 62.6780 32.9776 176.9718 100 I 3.6380 8.4108 121.3674 64.9212 37.0286 178.1488 101 E 3.8917 8.2112 119.2986 59.2758 29.3338 178.9731 102 V 3.5773 7.5974 117.7420 66.1968 31.7361 177.9286 103 T 4.1933 7.7314 116.7563 66.2071 68.2714 176.7416 104 I 3.6913 7.9600 121.6796 64.5027 37.1943 178.2013 105 D 4.3464 8.3461 120.0284 57.5908 40.6664 178.8848 106 E 3.9906 8.4902 118.8931 59.1186 29.3945 179.2931 107 A 3.9799 8.0772 121.0065 55.2066 18.3891 179.6368 108 I 3.6371 7.9329 118.4490 64.5844 37.0863 178.4066 109 E 3.9032 8.0166 119.2617 59.5365 29.2266 179.5929 110 I 3.5148 7.6928 119.4568 64.2077 37.0802 178.3089 111 A 4.0333 8.0694 121.6626 55.2300 17.9722 179.9075 112 K 4.1039 8.1194 116.3049 59.2211 32.1528 179.0927 113 R 3.8192 7.7577 118.5513 59.2368 29.9871 177.3272 114 Y 4.8239 7.3611 111.8109 57.8306 38.9587 175.9101 115 G 4.1656 8.2664 111.6455 44.7802 0.0000 173.4902 116 T 4.7215 9.0897 116.8999 58.8491 73.1494 174.0738 117 E 3.9372 8.6208 119.9543 59.5980 29.4065 178.2482 118 N 4.3866 8.1418 116.0627 56.2278 38.5261 177.3483 119 S 4.2189 7.9726 116.3208 61.5193 62.8825 176.8407 120 G 3.6776 8.0190 108.2697 47.9341 0.0000 175.8192 121 K 3.9908 8.2485 121.3435 58.8608 32.0937 179.1889 122 F 4.1141 8.5337 121.1914 61.3757 39.2750 177.2709 123 V 3.3639 8.1701 118.0784 65.9183 31.2287 177.3269 124 N 4.3006 8.4540 117.1351 56.6482 38.7120 177.0390 125 G 3.4907 8.0226 106.9248 47.8069 0.0000 175.7727 126 I 3.5460 7.2142 122.4058 64.0291 37.0749 178.6426 127 L 3.8357 7.9731 120.0215 57.7155 41.3888 179.2903 128 D 4.3228 8.2210 119.0915 57.3944 40.8308 179.1265 129 R 3.9219 7.6690 118.1514 59.2458 30.1086 179.1904 130 I 3.2547 7.4166 119.4537 64.0783 36.9896 178.3979 131 A 3.9999 8.2639 122.3267 54.9052 18.0314 179.6623 132 K 4.0317 8.0494 115.7286 58.9453 32.8302 178.0757 133 E 4.5936 7.6691 116.2693 56.4635 30.9335 175.8249 134 H 4.8055 8.0775 112.5270 54.4932 31.1587 173.5261 135 A 4.0523 8.1605 124.2063 51.2987 18.8402 176.0339 136 P 4.3085 0.0000 0.0000 61.9632 32.3335 177.5972 137 K 2.0000 8.1430 119.2691 59.1383 32.2511 178.6646 138 E 3.8940 7.7616 117.5406 58.2686 29.1274 177.3988 139 K 4.4621 7.9359 117.9478 56.0350 32.4824 178.2846 140 F 4.6558 7.9583 119.6925 59.6740 39.0925 175.2880 141 E 4.3312 7.6067 120.9582 56.3974 29.7843 175.5411 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 M 8.30 4.41 0.00 2.00 2.15 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 2 K 8.03 3.99 0.00 1.79 1.70 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.53 7.81 3 T 8.63 4.16 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 1.16 0.00 0.00 4 P 0.00 4.45 0.00 2.25 2.16 0.00 3.65 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.98 0.00 5 R 8.60 3.89 0.00 1.91 1.99 0.00 3.25 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 6 R 7.97 3.92 0.00 1.88 1.96 0.00 3.16 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 1.86 1.69 0.00 7 R 7.89 3.97 0.00 1.84 1.99 0.00 3.06 0.00 0.00 3.00 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 8 M 8.12 4.10 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.78 0.00 9 R 8.28 3.73 0.00 1.91 1.92 0.00 3.20 0.00 0.00 3.28 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 10 L 8.17 4.18 0.00 2.07 1.84 0.95 0.98 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 11 A 8.15 4.09 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 12 V 7.56 3.48 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 1.08 0.00 0.00 0.84 0.00 0.00 13 F 8.41 4.12 0.00 3.29 3.31 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 14 K 8.71 3.74 0.00 1.94 1.82 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.18 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.84 7.81 15 A 8.02 3.96 1.33 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 16 L 7.56 3.84 0.00 1.59 1.64 0.98 0.66 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 17 F 7.99 3.95 0.00 2.16 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 18 Q 8.58 4.27 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.57 0.00 0.00 0.00 0.00 0.00 2.61 2.71 0.00 19 H 8.35 4.13 0.00 3.25 3.35 0.00 5.59 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 7.51 3.70 0.00 1.16 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 0.00 0.00 0.00 2.18 2.07 0.00 21 F 7.36 4.80 0.00 2.96 2.99 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 0.00 0.00 0.00 22 R 7.76 4.71 0.00 1.87 1.94 0.00 3.17 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 23 R 7.78 3.71 0.00 1.70 1.89 0.00 3.10 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 24 D 7.90 4.61 0.00 2.76 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 25 E 7.70 4.63 0.00 2.14 1.90 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 2.25 2.21 0.00 26 D 8.36 4.46 0.00 2.73 2.53 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 27 L 8.60 3.91 0.00 1.60 1.56 0.66 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.65 3.95 0.00 2.09 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 2.28 2.40 0.00 29 Q 7.83 4.00 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.05 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 30 I 7.74 3.83 2.02 0.00 0.00 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 1.42 1.21 0.97 0.00 0.00 31 L 7.95 3.90 0.00 1.70 1.77 0.79 0.73 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 32 E 7.90 3.90 0.00 2.15 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 2.53 2.47 0.00 33 E 7.70 4.13 0.00 2.06 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 2.34 2.55 0.00 34 I 7.39 3.91 1.92 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 1.63 0.45 0.83 0.00 0.00 35 L 7.42 3.60 0.00 1.48 1.42 0.79 0.58 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 36 D 8.40 4.66 0.00 2.90 2.82 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 37 E 8.95 4.06 0.00 2.12 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 0.00 2.31 2.27 0.00 38 T 8.46 4.05 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 1.20 0.00 0.00 39 Y 7.92 4.51 0.00 3.06 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 40 D 8.85 4.71 0.00 2.95 2.82 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 41 K 8.63 3.81 0.00 1.86 1.89 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.53 1.54 7.81 42 K 8.06 3.95 0.00 1.93 1.95 0.00 1.70 0.00 0.00 1.85 0.00 0.00 3.62 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.75 7.81 43 A 8.77 4.13 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 44 K 8.30 3.87 0.00 1.99 1.85 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.42 1.66 7.81 45 E 8.30 3.94 0.00 2.15 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 0.00 2.35 2.38 0.00 46 D 8.60 4.45 0.00 2.69 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 47 A 8.22 3.86 1.22 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 0.00 0.00 0.00 48 R 8.09 3.82 0.00 2.08 1.98 0.00 3.20 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 49 R 8.15 3.88 0.00 1.97 2.24 0.00 3.17 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 50 Y 8.46 3.53 0.00 3.13 2.88 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 51 I 7.93 3.60 1.89 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 1.61 0.79 0.83 0.00 0.00 52 R 8.22 3.94 0.00 1.86 1.90 0.00 3.22 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 53 G 8.15 3.29 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 54 I 7.48 3.63 1.67 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 1.32 0.35 0.87 0.00 0.00 55 K 7.78 3.86 0.00 1.72 1.88 0.00 1.74 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.37 7.81 56 E 8.26 4.08 0.00 1.89 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 2.22 2.29 0.00 57 N 7.67 4.95 0.00 2.90 2.85 0.00 0.00 6.52 6.26 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 58 L 7.72 3.95 0.00 1.89 1.66 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 59 S 8.02 4.12 0.00 3.92 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 60 M 8.03 4.06 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.63 0.00 61 I 8.20 3.79 2.14 0.00 0.00 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 1.72 0.70 1.05 0.00 0.00 62 D 8.54 4.39 0.00 2.83 2.76 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 0.00 0.00 0.00 63 D 8.19 4.35 0.00 2.68 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 64 L 8.08 4.16 0.00 1.92 1.90 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 65 I 8.01 3.85 2.09 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.64 1.00 0.00 0.00 66 S 8.44 4.25 0.00 4.07 3.97 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.83 4.16 0.00 1.74 1.61 0.00 3.07 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.88 0.00 68 Y 8.01 4.57 0.00 3.04 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.72 4.97 0.00 1.78 2.03 1.11 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.34 4.55 0.00 1.91 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 2.20 2.30 0.00 71 K 8.37 3.98 0.00 1.80 1.98 0.00 1.84 0.00 0.00 1.86 0.00 0.00 2.54 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.86 1.28 7.81 72 W 8.16 4.74 0.00 3.39 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 73 S 8.35 4.96 0.00 4.05 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 74 L 8.66 4.08 0.00 1.83 1.79 1.01 0.61 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 75 N 7.62 4.53 0.00 2.87 2.97 0.00 0.00 7.03 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 76 R 7.79 4.34 0.00 2.19 2.31 0.00 3.14 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 77 L 7.38 4.07 0.00 1.83 1.53 1.12 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 78 S 8.05 4.41 0.00 4.08 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 79 V 8.31 3.55 1.77 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 0.64 0.00 0.00 0.84 0.00 0.00 80 V 7.86 4.07 2.27 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 1.34 0.00 0.00 1.31 0.00 0.00 81 D 8.32 4.45 0.00 2.72 2.82 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 82 R 8.27 3.97 0.00 1.92 2.07 0.00 3.09 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 83 N 8.25 4.55 0.00 3.13 2.90 0.00 0.00 6.71 8.01 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 84 V 8.50 3.78 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 1.18 0.00 0.00 0.92 0.00 0.00 85 L 8.23 4.03 0.00 1.98 1.75 1.02 0.76 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 86 R 8.22 3.98 0.00 2.10 2.05 0.00 3.17 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 1.83 1.84 0.00 87 L 8.37 4.13 0.00 2.01 2.11 1.30 1.55 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 88 A 8.46 4.11 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 89 T 8.26 3.83 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 1.23 0.00 0.00 90 Y 8.29 4.21 0.00 3.20 3.31 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 91 E 8.44 3.52 0.00 2.38 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 0.00 2.34 2.41 0.00 92 L 7.95 3.88 0.00 1.89 1.65 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 93 L 7.64 3.79 0.00 0.84 0.58 0.80 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 94 F 7.71 4.56 0.00 2.14 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 95 E 7.47 4.34 0.00 2.04 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 1.67 1.92 0.00 96 K 7.93 4.19 0.00 1.71 1.69 0.00 1.61 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.30 7.81 97 D 8.84 4.78 0.00 2.83 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 98 I 6.97 4.28 1.89 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 1.40 0.96 1.01 0.00 0.00 99 P 0.00 4.40 0.00 2.26 2.19 0.00 3.73 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 100 I 8.41 3.64 1.88 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 1.52 0.60 0.90 0.00 0.00 101 E 8.21 3.89 0.00 2.03 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 2.46 2.37 0.00 102 V 7.60 3.58 2.24 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 1.12 0.00 0.00 0.94 0.00 0.00 103 T 7.73 4.19 4.40 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 1.26 0.00 0.00 104 I 7.96 3.69 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 1.49 0.71 0.93 0.00 0.00 105 D 8.35 4.35 0.00 2.76 2.71 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 0.00 106 E 8.49 3.99 0.00 2.06 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 2.52 2.49 0.00 107 A 8.08 3.98 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 0.00 108 I 7.93 3.64 2.02 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 1.66 0.77 0.90 0.00 0.00 109 E 8.02 3.90 0.00 2.22 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 2.29 2.48 0.00 110 I 7.69 3.51 1.82 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 1.35 1.42 0.22 0.00 0.00 111 A 8.07 4.03 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 0.00 112 K 8.12 4.10 0.00 1.80 1.84 0.00 1.70 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.61 1.58 7.81 113 R 7.76 3.82 0.00 1.66 1.75 0.00 2.93 0.00 0.00 2.67 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.20 0.00 114 Y 7.36 4.82 0.00 3.00 3.02 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 0.00 115 G 8.27 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 0.00 116 T 9.09 4.72 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 1.22 0.00 0.00 117 E 8.62 3.94 0.00 2.10 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 2.38 2.47 0.00 118 N 8.14 4.39 0.00 2.81 2.87 0.00 0.00 7.15 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 0.00 119 S 7.97 4.22 0.00 4.03 4.10 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 0.00 0.00 0.00 120 G 8.02 3.68 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 0.00 121 K 8.25 3.99 0.00 2.01 1.91 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.65 7.81 122 F 8.53 4.11 0.00 3.08 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 0.00 123 V 8.17 3.36 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 1.10 0.00 0.00 124 N 8.45 4.30 0.00 2.95 2.94 0.00 0.00 7.13 8.64 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 0.00 125 G 8.02 3.49 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 0.00 0.00 0.00 126 I 7.21 3.55 1.55 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 -0.07 0.77 0.00 0.00 127 L 7.97 3.84 0.00 1.59 1.64 0.90 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 128 D 8.22 4.32 0.00 2.85 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 0.00 129 R 7.67 3.92 0.00 1.86 2.09 0.00 3.17 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 130 I 7.42 3.25 1.59 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.02 0.77 0.00 0.00 131 A 8.26 4.00 1.32 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 0.00 0.00 0.00 0.00 0.00 132 K 8.05 4.03 0.00 1.91 1.99 0.00 1.59 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.73 1.49 7.81 133 E 7.67 4.59 0.00 2.09 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 2.27 2.50 0.00 134 H 8.08 4.81 0.00 3.22 3.24 0.00 5.86 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 0.00 135 A 8.16 4.05 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 0.00 136 P 0.00 4.31 0.00 2.28 2.01 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.78 0.00 137 K 8.14 2.00 0.00 1.20 1.44 0.00 1.40 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.22 1.21 7.81 138 E 7.76 3.89 0.00 1.83 1.96 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 2.22 2.27 0.00 139 K 7.94 4.46 0.00 1.87 1.82 0.00 1.60 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.30 7.81 140 F 7.96 4.66 0.00 3.04 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 0.00 141 E 7.61 4.33 0.00 2.00 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 0.00 2.31 2.40 0.00