NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.6846 8.2644 122.4700 52.4277 20.0734 175.5447 2 T 4.5998 8.8679 114.4632 60.2926 71.5672 170.9313 3 K 5.3538 8.9788 125.5338 54.9449 37.3190 174.5469 4 A 5.3403 9.2302 123.9094 51.0038 23.4344 175.1329 5 V 5.0196 8.8406 117.4920 60.9632 35.4740 173.2785 6 C 4.9686 9.1939 121.8005 58.0149 35.3025 172.5625 7 V 4.5697 8.4689 125.9316 61.4333 33.2249 174.0618 8 L 4.7991 8.8879 129.0905 53.7152 43.2647 176.0802 9 K 4.9110 9.0862 122.2283 55.3742 37.0376 176.3063 10 G 4.5666 7.9680 108.1022 45.6852 0.0000 172.1462 11 D 4.6154 8.8006 118.0892 55.3221 42.0902 177.0727 12 G 4.3167 7.6013 109.1964 44.4966 0.0000 171.7257 13 P 4.4181 0.0000 0.0000 63.6329 32.1278 175.9004 14 V 4.5031 7.5582 120.7023 62.8070 32.0992 174.9951 15 Q 4.8141 8.9063 125.1443 55.3272 32.5823 173.7210 16 G 4.3056 8.6419 106.9697 46.0028 0.0000 171.8106 17 I 5.2141 8.4774 119.6821 59.5269 41.2667 175.0201 18 I 4.7182 8.7987 127.1718 59.4871 40.6618 174.2953 19 N 4.9897 8.3624 123.9433 51.3496 41.2925 173.8431 20 F 5.3631 8.9970 119.9707 55.8028 43.1652 173.7761 21 E 5.2527 9.7135 123.1212 54.7038 33.5561 173.7148 22 Q 4.9480 9.3505 127.4713 54.4983 31.4597 176.0230 23 K 4.0826 9.0557 126.8395 58.6450 32.7736 177.4168 24 E 4.7153 7.7414 116.4263 53.7392 33.1850 174.7746 25 S 4.0518 8.7838 115.8288 60.2950 62.5195 173.6572 26 N 4.1165 9.0099 123.4478 54.1212 37.4609 173.7730 27 G 3.9894 8.3848 106.3244 44.0667 0.0000 171.8754 28 P 4.6242 0.0000 0.0000 62.6703 32.2614 176.3499 29 V 4.6491 8.9279 123.0172 61.2704 33.9603 174.5195 30 K 4.9676 9.3534 128.0533 55.5298 34.0894 175.9901 31 V 4.9064 9.2511 118.6017 59.2921 34.5800 174.7574 32 W 5.4518 8.4402 121.9608 54.8168 31.8826 175.4850 33 G 3.8330 7.6864 106.9311 46.3947 0.0000 170.8974 34 S 5.0939 7.8044 114.3550 56.8646 66.5744 174.4023 35 I 5.1522 8.8254 126.5691 59.3363 40.9140 174.6266 36 K 4.8317 9.4746 125.0713 55.5881 36.1979 176.9491 37 G 3.8241 8.8322 106.0664 46.6553 0.0000 173.4979 38 L 4.4389 7.7620 119.9864 53.1332 43.0006 176.4446 39 T 4.3207 8.1242 111.0097 61.0359 69.5330 174.1198 40 E 4.1105 8.6509 124.8020 57.2976 30.4923 175.1706 41 G 3.7714 8.3043 110.9594 44.0116 0.0000 172.3158 42 L 4.9031 8.2056 119.1639 54.6757 42.9672 176.4956 43 H 5.0244 9.1023 119.0187 53.7781 33.0359 173.5040 44 G 4.0523 9.2110 110.7445 46.5906 0.0000 172.5552 45 F 5.4295 8.9628 124.0516 57.1606 42.5947 173.0021 46 H 5.1425 8.9299 122.4497 54.2602 33.9938 172.6525 47 V 4.4382 8.5874 121.4041 62.3971 32.7955 175.1948 48 H 5.0466 9.4603 125.7329 54.6155 30.5375 176.1319 49 E 3.6899 9.0267 122.1986 58.9095 29.6872 177.0376 50 F 4.9446 8.1020 118.3480 54.8764 41.5073 176.9142 51 G 4.3111 8.3285 112.4347 44.4165 0.0000 174.4380 52 D 4.7236 7.8975 117.5867 52.7207 42.5360 174.0628 53 N 5.2949 8.7947 123.8115 52.6913 39.1536 175.6928 54 T 3.9628 8.5106 109.4878 63.4763 68.9566 174.4880 55 A 4.7109 8.1660 126.1182 51.6697 20.3696 176.8522 56 G 3.9311 8.0587 110.6404 48.0782 0.0000 177.1876 57 C 4.4059 8.6476 116.4919 59.6087 40.0314 175.4921 58 T 3.8125 7.5525 111.1499 63.7994 68.3903 175.6361 59 S 4.6004 7.8402 115.3734 58.4359 63.5328 175.1063 60 A 4.3300 7.3596 126.1800 53.4181 18.1474 178.7543 61 G 4.2001 7.8281 106.0515 43.7955 0.0000 170.5444 62 P 4.7067 0.0000 0.0000 61.9636 34.0638 174.9893 63 H 4.5473 8.3998 116.3709 55.8119 29.5139 175.5925 64 F 4.2620 8.9347 125.4186 58.1052 40.1996 175.2590 65 N 5.0270 7.8719 125.8060 51.7932 38.9547 173.1003 66 P 4.2374 0.0000 0.0000 64.8149 32.1160 177.7651 67 L 4.4041 7.5868 117.3276 53.6727 42.0414 176.1830 68 S 3.6085 7.4863 113.5631 59.7920 60.6948 171.8065 69 R 4.4655 8.2658 118.0725 54.6556 32.1050 176.2632 70 K 4.4938 8.6790 118.8156 55.4272 34.2664 176.1313 71 H 4.0892 8.6920 122.5662 56.6737 30.3634 174.7258 72 G 4.0648 7.4724 110.4215 45.4331 0.0000 172.0780 73 G 4.1350 9.1197 109.2990 43.4897 0.0000 173.3883 74 P 4.3815 0.0000 0.0000 65.1897 31.3234 177.6288 75 K 4.2311 7.9119 116.2039 57.2410 32.5495 176.5476 76 D 4.6901 7.6451 119.3922 53.1875 41.7828 176.3333 77 E 3.8806 8.7469 123.5193 58.8643 29.7526 176.4666 78 E 4.2716 7.9817 121.5538 55.2902 28.9164 174.6972 79 R 4.6201 7.6430 120.2901 55.8389 32.3680 174.4534 80 H 4.6528 9.2758 116.3548 55.2544 29.5503 176.7760 81 V 3.4517 8.3033 122.5765 66.3024 31.5956 177.1309 82 G 3.8781 8.4213 105.1257 47.1172 0.0000 173.4714 83 D 4.9171 8.1548 121.5009 53.5621 39.9057 175.6943 84 L 4.4953 8.4226 120.2558 53.2223 42.5437 178.4468 85 G 4.0104 8.4486 108.4264 46.7356 0.0000 173.7737 86 N 5.6351 8.7110 121.0025 51.4738 41.8363 173.6920 87 V 4.3707 8.5044 114.0447 59.9727 35.7306 174.7808 88 T 5.0427 8.1448 117.3252 61.8910 71.5019 173.1329 89 A 4.8527 9.1593 129.5119 50.7644 21.0598 177.1650 90 D 5.0809 8.8217 122.2638 51.8048 41.4753 177.1501 91 K 3.8792 8.5630 117.3150 60.1793 32.3047 177.2543 92 D 4.5087 8.5002 117.4365 54.2830 41.0104 177.0801 93 G 4.3476 8.6348 108.5603 44.4455 0.0000 172.5987 94 V 4.7003 7.8707 119.5525 60.8377 33.8813 174.2014 95 A 5.3777 8.9082 130.4895 49.7118 20.5909 175.4236 96 D 4.8537 8.6134 122.9328 54.4155 41.8141 176.3980 97 V 4.1574 8.7188 124.9487 61.4757 33.6621 175.1245 98 S 4.9625 8.3302 122.2629 57.8749 64.3591 173.0715 99 I 4.8320 9.3849 128.3667 59.4059 41.5443 174.1023 100 E 5.2080 8.8410 125.2216 54.5595 32.1349 174.5352 101 D 4.8858 9.2337 125.3439 52.9498 44.9359 175.6084 102 S 4.6876 8.9521 119.4081 58.5040 64.0138 174.9469 103 V 3.9997 8.0021 120.6148 64.6944 31.9617 176.2964 104 I 4.1433 7.8767 111.5451 61.0861 38.3730 174.5975 105 S 4.6353 8.1895 113.3451 57.6137 64.9482 174.0898 106 L 4.4635 8.7675 124.1194 54.4104 41.6247 176.5341 107 S 4.5217 7.9936 112.2136 57.9994 66.1641 175.4073 108 G 3.8112 8.5522 107.6563 44.6147 0.0000 173.3162 109 D 4.3696 8.5991 116.9207 57.1083 41.4539 177.5535 110 H 5.0272 8.0772 114.3170 55.5531 28.9671 174.2966 111 C 4.5272 7.8461 121.0295 59.5461 31.8641 173.3982 112 I 3.9634 8.1776 118.7295 60.2109 38.0221 175.5684 113 I 3.6647 7.3174 122.8583 63.0698 37.4599 176.3661 114 G 3.8147 9.3944 113.5999 45.2105 0.0000 173.0650 115 R 4.7351 7.4114 119.1471 54.9693 33.6336 174.6584 116 T 4.9685 8.0871 115.4249 62.0520 71.4015 173.5952 117 L 4.8225 8.5686 128.3502 53.8980 44.1318 175.3106 118 V 5.0021 8.6067 125.4796 60.9700 35.0719 174.2377 119 V 5.1076 8.6267 126.7038 60.4636 33.9228 174.7225 120 H 5.3047 8.9147 120.8414 54.0250 30.8631 174.5569 121 E 4.2065 9.2497 121.4170 58.8920 29.9938 176.5175 122 K 4.7996 8.3545 116.8741 53.7256 36.6548 175.7944 123 A 4.3945 8.3085 123.6302 52.1132 18.9003 176.4003 124 D 4.6294 9.3650 122.6793 53.9488 41.6633 176.1647 125 D 4.5500 9.2794 125.7840 53.3837 39.6940 176.6747 126 L 3.5952 9.4721 119.1438 56.2143 39.5223 175.4697 127 G 3.9544 8.6136 104.7733 45.9261 0.0000 174.8234 128 K 4.5016 8.0267 116.9632 56.0586 31.9324 177.3849 129 G 3.8296 7.9314 108.1610 44.7772 0.0000 176.1491 130 G 4.1382 8.3657 107.5896 45.5041 0.0000 172.3860 131 N 5.0983 7.2758 115.4911 49.8420 40.4663 174.7896 132 E 4.0457 8.5815 117.9680 59.2186 29.4969 178.0466 133 E 3.9471 8.1824 119.1058 59.1791 29.5267 178.5300 134 S 4.1091 8.3021 113.6415 61.2526 62.3845 175.4110 135 T 4.3171 7.8288 110.0333 62.4198 68.5906 175.5852 136 K 4.3235 7.6969 119.8902 57.7952 34.4027 176.6768 137 T 4.1104 7.8481 105.7299 60.0250 70.1783 175.1021 138 G 3.7329 8.0662 110.8510 45.5765 0.0000 173.6698 139 N 4.3058 7.8476 114.6481 54.0146 36.7769 175.8292 140 A 3.8833 6.9715 119.3751 52.0901 19.3192 179.9288 141 G 4.1105 7.3172 102.4341 44.5858 0.0000 173.3505 142 S 4.4361 8.8401 115.0874 58.5088 64.8914 174.0390 143 R 4.4788 8.3398 119.6010 55.0306 29.9146 176.4948 144 L 4.3278 8.8940 125.9390 57.3158 43.0715 177.1989 145 A 5.1081 7.7370 118.0312 51.2715 22.8651 173.9881 146 C 5.5799 8.5093 113.1518 55.9610 46.6617 172.6881 147 G 4.5936 8.1247 104.7039 46.3008 0.0000 172.2231 148 V 4.5791 8.1978 120.4137 61.9003 32.9269 175.4848 149 I 4.0632 8.7189 129.4057 61.1246 37.8991 175.3002 150 G 4.4133 8.9616 114.7640 43.8630 0.0000 172.2426 151 I 4.2572 8.3464 122.1170 61.1995 37.5620 175.4308 152 A 4.8288 8.4645 128.0646 49.5499 22.1530 176.1197 153 Q 4.0697 8.5324 118.7931 56.4578 29.1844 176.1205 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 8.26 4.68 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 2 T 8.87 4.60 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 1.24 0.00 0.00 3 K 8.98 5.35 0.00 1.89 1.69 0.00 1.95 0.00 0.00 1.97 0.00 0.00 3.15 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.50 7.81 4 A 9.23 5.34 1.10 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 0.00 0.00 5 V 8.84 5.02 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 0.81 0.00 0.00 0.87 0.00 0.00 6 C 9.19 4.97 0.00 3.15 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 7 V 8.47 4.57 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 0.98 0.00 0.00 0.92 0.00 0.00 8 L 8.89 4.80 0.00 1.70 1.59 1.05 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.09 4.91 0.00 1.64 1.62 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.37 7.81 10 G 7.97 4.57 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 0.00 0.00 0.00 11 D 8.80 4.62 0.00 2.68 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 12 G 7.60 4.32 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 0.00 13 P 0.00 4.42 0.00 2.22 2.29 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.94 0.00 14 V 7.56 4.50 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 0.80 0.00 0.00 0.91 0.00 0.00 15 Q 8.91 4.81 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.30 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 16 G 8.64 4.31 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 0.00 17 I 8.48 5.21 1.82 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 1.20 0.66 0.82 0.00 0.00 18 I 8.80 4.72 1.85 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 1.26 1.28 0.46 0.00 0.00 19 N 8.36 4.99 0.00 1.44 1.48 0.00 0.00 6.43 8.43 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 20 F 9.00 5.36 0.00 2.91 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 21 E 9.71 5.25 0.00 2.45 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 0.00 2.32 2.39 0.00 22 Q 9.35 4.95 0.00 2.19 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.60 0.00 0.00 0.00 0.00 0.00 2.41 2.65 0.00 23 K 9.06 4.08 0.00 1.81 1.87 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.48 7.81 24 E 7.74 4.72 0.00 1.98 1.79 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 2.29 2.27 0.00 25 S 8.78 4.05 0.00 3.83 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 26 N 9.01 4.12 0.00 2.89 2.87 0.00 0.00 7.14 7.98 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 27 G 8.38 3.99 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 0.00 0.00 0.00 28 P 0.00 4.62 0.00 1.98 2.04 0.00 3.67 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 2.05 2.11 0.00 29 V 8.93 4.65 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 1.25 0.00 0.00 1.06 0.00 0.00 30 K 9.35 4.97 0.00 1.90 1.80 0.00 1.46 0.00 0.00 1.46 0.00 0.00 2.78 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.42 1.45 7.81 31 V 9.25 4.91 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 0.89 0.00 0.00 0.81 0.00 0.00 32 W 8.44 5.45 0.00 3.44 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 33 G 7.69 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 34 S 7.80 5.09 0.00 3.87 3.62 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 35 I 8.83 5.15 1.80 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 1.28 0.43 0.95 0.00 0.00 36 K 9.47 4.83 0.00 1.72 1.87 0.00 1.32 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.42 1.34 7.81 37 G 8.83 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 0.00 0.00 0.00 38 L 7.76 4.44 0.00 1.77 1.39 0.81 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.12 4.32 4.28 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 1.24 0.00 0.00 40 E 8.65 4.11 0.00 1.96 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 0.00 2.30 2.46 0.00 41 G 8.30 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 42 L 8.21 4.90 0.00 1.49 1.58 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.10 5.02 0.00 3.04 3.32 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 9.21 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 0.00 0.00 0.00 45 F 8.96 5.43 0.00 2.97 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 46 H 8.93 5.14 0.00 3.13 2.98 0.00 5.67 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 47 V 8.59 4.44 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 0.85 0.00 0.00 0.91 0.00 0.00 48 H 9.46 5.05 0.00 3.08 3.43 0.00 5.69 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 9.03 3.69 0.00 1.70 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 1.47 2.08 0.00 50 F 8.10 4.94 0.00 3.14 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 51 G 8.33 4.31 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 0.00 52 D 7.90 4.72 0.00 2.62 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 53 N 8.79 5.29 0.00 2.69 2.74 0.00 0.00 7.37 7.70 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 54 T 8.51 3.96 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 1.21 0.00 0.00 55 A 8.17 4.71 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 56 G 8.06 3.93 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 0.00 0.00 0.00 57 C 8.65 4.41 0.00 2.96 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 58 T 7.55 3.81 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 1.22 0.00 0.00 59 S 7.84 4.60 0.00 4.15 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 60 A 7.36 4.33 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 61 G 7.83 4.20 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 0.00 62 P 0.00 4.71 0.00 2.04 2.20 0.00 3.63 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 1.97 1.99 0.00 63 H 8.40 4.55 0.00 2.78 3.16 0.00 5.73 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.93 4.26 0.00 2.94 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 65 N 7.87 5.03 0.00 2.64 2.46 0.00 0.00 6.93 7.71 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 66 P 0.00 4.24 0.00 2.07 1.95 0.00 2.94 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.16 0.00 67 L 7.59 4.40 0.00 1.56 1.67 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.49 3.61 0.00 3.98 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 69 R 8.27 4.47 0.00 1.86 1.97 0.00 3.62 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 70 K 8.68 4.49 0.00 1.76 1.70 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.36 7.81 71 H 8.69 4.09 0.00 3.20 3.28 0.00 5.94 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.47 4.06 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 0.00 0.00 0.00 73 G 9.12 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 0.00 0.00 0.00 74 P 0.00 4.38 0.00 2.23 2.39 0.00 3.79 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.19 0.00 75 K 7.91 4.23 0.00 1.77 1.90 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.47 7.81 76 D 7.65 4.69 0.00 2.83 2.56 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 0.00 0.00 0.00 77 E 8.75 3.88 0.00 1.92 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 2.28 2.23 0.00 78 E 7.98 4.27 0.00 2.06 1.81 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 2.31 2.30 0.00 79 R 7.64 4.62 0.00 1.96 1.89 0.00 2.85 0.00 0.00 2.51 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 80 H 9.28 4.65 0.00 3.43 3.36 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.30 3.45 1.47 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 0.74 0.00 0.00 0.38 0.00 0.00 82 G 8.42 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 83 D 8.15 4.92 0.00 2.68 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 84 L 8.42 4.50 0.00 1.90 1.90 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.45 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 86 N 8.71 5.64 0.00 2.60 2.72 0.00 0.00 6.60 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 87 V 8.50 4.37 1.81 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 -0.08 0.00 0.00 0.74 0.00 0.00 88 T 8.14 5.04 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 1.20 0.00 0.00 89 A 9.16 4.85 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 90 D 8.82 5.08 0.00 2.87 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 91 K 8.56 3.88 0.00 1.88 2.00 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.47 7.81 92 D 8.50 4.51 0.00 2.78 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 93 G 8.63 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 94 V 7.87 4.70 2.26 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 0.98 0.00 0.00 0.92 0.00 0.00 95 A 8.91 5.38 1.15 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 0.00 0.00 96 D 8.61 4.85 0.00 2.56 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 97 V 8.72 4.16 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 0.65 0.00 0.00 0.57 0.00 0.00 98 S 8.33 4.96 0.00 3.92 3.72 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 0.00 0.00 0.00 99 I 9.38 4.83 1.99 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 1.17 0.52 1.02 0.00 0.00 100 E 8.84 5.21 0.00 1.96 1.82 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 2.21 2.30 0.00 101 D 9.23 4.89 0.00 2.87 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 0.00 102 S 8.95 4.69 0.00 3.90 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 0.00 103 V 8.00 4.00 2.26 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 0.85 0.00 0.00 0.96 0.00 0.00 104 I 7.88 4.14 1.96 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.82 1.04 0.00 0.00 105 S 8.19 4.64 0.00 3.88 3.79 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 0.00 106 L 8.77 4.46 0.00 1.82 1.65 1.05 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.99 4.52 0.00 3.97 3.79 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 0.00 108 G 8.55 3.81 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 0.00 0.00 0.00 109 D 8.60 4.37 0.00 2.66 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 0.00 110 H 8.08 5.03 0.00 3.19 3.43 0.00 5.77 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.85 4.53 0.00 3.12 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 0.00 112 I 8.18 3.96 1.63 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 1.39 0.23 1.01 0.00 0.00 113 I 7.32 3.66 1.77 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.73 0.83 0.00 0.00 114 G 9.39 3.81 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 0.00 0.00 0.00 115 R 7.41 4.74 0.00 1.61 1.84 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.23 0.00 116 T 8.09 4.97 4.27 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 1.22 0.00 0.00 117 L 8.57 4.82 0.00 1.79 1.52 0.36 0.59 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 0.00 118 V 8.61 5.00 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 0.74 0.00 0.00 0.73 0.00 0.00 119 V 8.63 5.11 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 0.78 0.00 0.00 1.00 0.00 0.00 120 H 8.91 5.30 0.00 3.32 3.55 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.25 4.21 0.00 2.09 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 0.00 2.36 2.34 0.00 122 K 8.35 4.80 0.00 1.78 1.67 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.38 7.81 123 A 8.31 4.39 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 0.00 124 D 9.37 4.63 0.00 2.70 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 0.00 125 D 9.28 4.55 0.00 2.91 2.90 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 0.00 126 L 9.47 3.60 0.00 1.81 1.81 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.61 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 0.00 0.00 0.00 128 K 8.03 4.50 0.00 1.91 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.52 7.81 129 G 7.93 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 0.00 130 G 8.37 4.14 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 0.00 0.00 0.00 131 N 7.28 5.10 0.00 2.60 2.79 0.00 0.00 6.81 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 0.00 132 E 8.58 4.05 0.00 2.10 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 2.37 2.42 0.00 133 E 8.18 3.95 0.00 2.11 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 2.43 2.41 0.00 134 S 8.30 4.11 0.00 4.13 3.99 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 0.00 135 T 7.83 4.32 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 1.30 0.00 0.00 136 K 7.70 4.32 0.00 1.78 1.81 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.33 1.65 7.81 137 T 7.85 4.11 4.15 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 1.14 0.00 0.00 138 G 8.07 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 0.00 139 N 7.85 4.31 0.00 2.99 2.88 0.00 0.00 6.92 8.75 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 0.00 140 A 6.97 3.88 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 0.00 141 G 7.32 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 0.00 0.00 0.00 142 S 8.84 4.44 0.00 3.92 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 0.00 143 R 8.34 4.48 0.00 1.69 1.86 0.00 3.25 0.00 0.00 3.13 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.67 0.00 144 L 8.89 4.33 0.00 1.72 1.70 0.94 0.62 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 0.00 145 A 7.74 5.11 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 0.00 146 C 8.51 5.58 0.00 3.02 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 0.00 147 G 8.12 4.59 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 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.20 4.58 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 0.80 0.00 0.00 0.97 0.00 0.00 149 I 8.72 4.06 1.77 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.23 0.31 0.00 0.00 150 G 8.96 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 0.00 0.00 0.00 0.00 151 I 8.35 4.26 1.85 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 1.25 0.54 0.91 0.00 0.00 152 A 8.46 4.83 1.18 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 0.00 0.00 153 Q 8.53 4.07 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00