NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4404 8.2893 120.3309 54.2631 33.6257 175.6610 2 K 4.2730 7.9466 118.5840 55.8002 33.9031 173.4947 3 K 4.6309 8.5558 123.5418 53.9740 36.4430 177.9246 4 V 2.0000 6.5060 122.6098 61.9661 31.1699 176.1043 5 V 4.2457 8.8702 116.0330 61.2791 34.5437 175.6425 6 A 4.3779 7.6745 121.4775 50.0920 21.6418 175.9972 7 V 4.2455 8.0002 124.6426 59.4923 30.0120 174.6583 8 V 3.5980 7.7132 126.8214 63.5360 31.8053 175.3072 9 K 5.2039 7.9714 130.9285 56.0248 32.0569 176.1230 10 L 4.5256 7.8005 122.0767 54.1549 44.6735 174.2432 11 Q 5.2109 8.2378 116.6229 54.8648 31.9011 174.4211 12 L 4.5647 8.7121 116.6653 53.1126 46.6672 172.7582 13 P 5.3218 0.0000 0.0000 61.9896 32.6326 175.6145 14 A 4.0820 10.6000 126.6112 51.9046 19.5922 177.1603 15 G 4.2374 8.4320 109.3586 45.1410 0.0000 173.3126 16 K 4.7179 7.2953 122.0828 56.3468 34.6187 173.9782 17 A 4.3112 7.9516 120.8788 52.8334 19.4376 176.3397 18 T 4.2281 7.7268 107.9181 60.4355 70.7554 172.0862 19 P 4.3572 0.0000 0.0000 62.1222 31.9080 177.4748 20 A 4.5525 12.0000 116.3005 50.3920 20.1465 174.8476 21 P 4.5309 0.0000 0.0000 61.1210 33.0324 175.8488 22 P 4.3495 0.0000 0.0000 64.2284 30.6596 176.6810 23 V 4.1008 7.1367 115.8046 61.0576 35.3093 179.3938 24 G 3.9747 8.6638 107.8207 45.9232 0.0000 173.3132 25 P 4.0886 0.0000 0.0000 65.7844 32.1453 179.3864 26 A 3.9219 7.9391 120.9937 53.3893 18.3316 177.3997 27 L 4.3029 8.1474 117.0022 56.0525 43.7236 174.7228 28 G 4.1637 7.9480 109.5770 46.2521 0.0000 171.4191 29 Q 4.6417 8.0653 122.4220 56.9136 36.7975 175.4843 30 H 4.5533 7.7930 115.9656 54.5847 27.1604 176.6422 31 G 3.8116 7.8429 106.8546 45.1103 0.0000 169.7982 32 A 3.4461 8.1015 123.0494 51.7648 15.4903 175.5232 33 N 4.7535 7.9032 114.9050 51.6484 42.7511 174.6977 34 I 4.2705 8.2463 124.6562 63.2501 37.8407 177.3559 35 M 3.8683 7.9132 118.2001 59.1825 32.0127 177.9580 36 E 4.0573 8.3917 117.8074 60.2638 29.6585 178.5294 37 F 4.3170 8.6562 120.3681 62.0026 39.1872 177.2790 38 V 3.4440 7.5671 116.7573 65.5565 31.6189 177.7655 39 K 3.9336 10.4056 119.1234 60.0773 31.7344 178.3818 40 A 4.2057 8.2670 119.7603 55.7948 18.5043 178.3116 41 F 4.0471 8.7770 120.1752 59.4061 39.2179 176.3697 42 N 3.8207 9.4593 117.3046 57.2176 39.1312 177.1167 43 A 4.0280 8.7034 122.1170 54.4016 18.3446 179.2709 44 A 3.9955 8.7708 120.5582 54.9986 19.2677 179.7638 45 T 3.5983 7.4990 107.4896 64.6768 68.3532 176.2914 46 A 3.9477 7.9802 123.3140 54.9364 18.7472 178.8492 47 N 4.3422 7.8215 114.3781 56.6768 38.9174 174.5540 48 M 4.5022 7.7367 115.9372 53.9899 33.5115 178.6496 49 G 4.1353 8.1800 114.7932 45.3719 0.0000 173.8729 50 D 5.0131 8.7341 123.6842 50.9011 42.3044 176.2937 51 A 4.4112 7.7628 120.8859 53.0109 24.9126 174.9546 52 I 5.2166 7.5605 113.6852 60.6020 42.1475 174.6524 53 V 4.6788 9.7969 126.6878 60.3853 35.2748 172.4610 54 P 4.8621 0.0000 0.0000 62.8920 31.7427 176.1451 55 V 4.2490 10.0150 120.0211 60.7578 32.8212 176.1464 56 E 5.7353 8.6053 122.4144 53.8296 28.8285 176.9050 57 I 3.1083 7.0811 120.7837 61.1437 37.1678 175.3835 58 T 4.2481 8.9290 122.9925 63.9131 68.4158 172.9614 59 I 5.6374 8.8730 127.8101 59.3595 39.9384 174.4262 60 Y 4.9025 8.5935 122.0152 55.9022 40.4606 176.5693 61 A 3.9805 9.0410 126.0858 55.6894 18.4423 178.6083 62 D 4.3190 8.1915 113.2248 55.5759 41.5114 175.3679 63 R 3.7724 9.0416 118.9468 56.0547 27.9386 174.7206 64 S 4.8783 7.5447 113.9850 56.5349 66.9455 173.0907 65 F 5.2715 8.3141 120.4065 55.4120 39.7612 173.9448 66 T 4.6056 9.2101 116.3329 59.6536 70.3535 174.0271 67 F 5.0535 8.5522 124.5607 57.2375 39.5092 174.3611 68 V 3.4246 7.9166 115.7843 62.7683 32.2761 171.2488 69 T 4.5955 7.9479 120.0281 59.9496 69.1478 173.8530 70 K 4.3827 8.2958 127.3743 55.6143 34.8145 175.0766 71 T 3.8343 8.4660 115.7362 60.5844 69.1692 169.4458 72 P 4.4346 0.0000 0.0000 60.6108 32.0132 173.3996 73 P 4.3165 0.0000 0.0000 62.6313 31.4866 174.7935 74 A 4.0682 8.3646 119.3871 52.8594 18.2698 178.8724 75 S 4.3474 8.0894 109.8549 60.4052 63.5306 176.5499 76 Y 5.1230 8.3705 118.2949 58.9053 37.7676 178.0954 77 L 4.4334 5.9268 116.1940 53.9005 42.3245 178.1763 78 I 3.5566 7.5111 121.3623 64.2372 36.3791 178.1180 79 R 3.8605 7.5668 118.6826 59.5311 29.7202 178.4288 80 K 3.8612 7.9172 116.9142 59.5319 32.5545 177.9819 81 A 4.0894 8.0411 119.6133 54.2659 18.3214 178.2625 82 A 4.1761 8.4073 122.0457 51.7345 18.7384 177.5880 83 G 4.4827 6.7962 105.0701 44.5433 0.0000 173.5271 84 L 4.3100 8.1979 121.4546 53.9204 41.4351 175.9518 85 E 4.5549 8.6558 121.7444 54.9819 34.9671 174.1954 86 K 3.7105 8.7113 119.1068 53.0856 31.8755 177.7505 87 G 3.7914 9.0649 107.5141 44.2643 0.0000 170.9573 88 A 4.3986 7.8272 118.5610 51.6732 21.0809 175.8958 89 H 4.7312 8.4624 126.7420 53.0820 31.1382 173.1341 90 K 4.6518 7.8403 124.8670 53.3115 35.2604 175.8845 91 P 4.1712 0.0000 0.0000 64.2510 31.5627 176.9538 92 G 3.6545 7.2771 103.9603 45.2554 0.0000 171.6159 93 R 3.6363 8.3308 117.3960 55.4538 26.2243 174.6470 94 E 4.7136 7.8486 120.7349 56.4810 32.7051 173.7757 95 K 4.4783 8.0648 117.7098 55.9189 35.6218 174.9740 96 V 4.4506 7.7402 117.6930 62.7297 35.2729 174.6723 97 G 3.5971 8.7711 109.6031 46.2063 0.0000 173.9867 98 R 5.1035 8.8824 115.7982 54.5831 33.8623 177.1082 99 I 5.3256 9.2940 118.4231 58.8533 40.9980 174.2797 100 T 4.6825 8.0729 110.9241 59.2218 71.5750 173.7061 101 W 4.5298 9.4279 129.8402 61.5061 30.6222 177.1540 102 E 3.9136 8.3118 117.5946 59.7023 29.2937 179.0600 103 Q 3.9505 7.7580 117.7147 59.5171 28.8078 180.0035 104 V 3.6685 7.9303 112.7631 64.4656 31.2395 177.7363 105 L 3.7836 7.9111 120.1040 56.5204 41.1385 178.4696 106 E 3.8908 8.1373 117.7029 60.0467 29.5735 179.8723 107 I 3.7017 7.6231 117.7862 63.8739 37.2519 177.5107 108 A 4.4040 8.1106 121.2535 54.2222 18.9773 178.3164 109 K 3.8617 10.5711 117.3424 59.2000 31.7282 178.7750 110 Q 3.9996 8.0211 122.5630 59.2570 29.1522 179.1783 111 K 4.2312 7.6234 118.5567 57.3550 33.6163 176.3285 112 M 4.8638 9.6480 114.6036 53.8494 30.8489 173.5957 113 P 4.3122 0.0000 0.0000 65.6997 32.2809 177.0757 114 D 4.9701 7.8538 121.4370 53.6961 42.3889 176.6916 115 L 3.7308 7.4398 115.3389 58.4736 41.9479 176.8484 116 N 4.9758 7.7322 118.9733 54.6644 44.3778 175.9447 117 T 4.1637 7.7261 113.4394 65.6479 68.9994 170.8775 118 T 4.1158 7.6965 120.3173 63.8864 73.1878 173.8054 119 D 4.5859 7.5856 120.8521 53.6085 41.7536 177.7209 120 L 3.9830 8.5424 124.4999 57.8772 42.6726 178.7502 121 E 4.1580 8.3249 118.7104 59.8021 29.5213 177.3400 122 A 4.1891 8.2975 121.5872 53.3949 18.2599 178.8441 123 A 3.8969 8.0175 116.3857 55.5402 18.6803 178.8481 124 A 3.5907 8.4254 118.6780 55.3176 18.1677 179.3601 125 R 3.9639 8.5664 115.2775 60.5216 30.0635 177.6207 126 M 4.0661 8.4081 117.4259 57.9642 31.6685 177.8286 127 I 4.0113 8.1510 123.7809 64.6092 38.1899 177.7495 128 A 4.1948 8.6472 122.3764 53.9811 18.1887 179.3876 129 G 3.9507 8.8783 102.9288 47.7209 0.0000 175.3748 130 S 4.1456 9.8443 116.0776 61.1868 62.6105 176.2725 131 A 3.9619 7.9898 123.7520 54.8129 18.1376 178.9138 132 R 4.7027 8.0246 117.8376 59.6869 29.7452 177.5162 133 S 4.0218 7.8568 110.2107 62.2296 62.4588 175.4864 134 M 4.0033 8.3549 120.0876 57.1049 32.0772 177.3588 135 G 3.9765 9.6938 106.3897 45.9204 0.0000 174.1133 136 V 3.9429 7.0707 119.2391 63.7355 32.9417 174.6161 137 E 5.0353 8.8676 121.3722 54.5862 34.3489 175.3508 138 V 4.3314 8.4078 121.4254 62.2017 32.7536 175.8783 139 V 4.5497 9.9121 122.1228 58.5846 29.8081 176.0466 140 G 4.2520 9.2558 117.0143 45.9822 0.0000 173.0752 141 A 3.4233 8.9893 122.4362 51.9383 15.6739 175.8908 142 P 4.3392 0.0000 0.0000 62.8102 32.3976 177.8676 143 E 4.4541 7.9942 118.6935 55.8943 31.0407 174.4352 144 V 4.5948 7.5835 116.0942 60.0801 36.0567 175.2465 145 K 4.5813 8.0871 115.0227 57.6205 38.0429 176.4671 146 D 4.3648 8.2039 117.8857 53.4468 39.6783 176.1496 147 A 4.0946 7.7765 128.7523 53.6999 19.2532 177.5755 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 8.29 4.44 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 2 K 7.95 4.27 0.00 1.92 1.79 0.00 1.55 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.46 7.81 3 K 8.56 4.63 0.00 1.70 1.61 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.31 1.45 7.81 4 V 6.51 2.00 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 0.41 0.00 0.00 0.78 0.00 0.00 5 V 8.87 4.25 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 0.76 0.00 0.00 0.91 0.00 0.00 6 A 7.67 4.38 1.14 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 7 V 8.00 4.25 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.91 0.00 0.00 8 V 7.71 3.60 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.74 0.00 0.00 9 K 7.97 5.20 0.00 1.79 1.75 0.00 1.65 0.00 0.00 2.28 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.20 7.81 10 L 7.80 4.53 0.00 1.79 1.56 0.90 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.24 5.21 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.47 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 12 L 8.71 4.56 0.00 1.43 0.85 0.94 -0.25 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 13 P 0.00 5.32 0.00 2.12 2.09 0.00 3.65 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 14 A 10.60 4.08 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 15 G 8.43 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 0.00 0.00 0.00 0.00 16 K 7.30 4.72 0.00 1.75 1.93 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.18 1.22 7.81 17 A 7.95 4.31 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 18 T 7.73 4.23 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 1.19 0.00 0.00 19 P 0.00 4.36 0.00 2.06 2.13 0.00 3.94 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 20 A 12.00 4.55 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 21 P 0.00 4.53 0.00 2.14 1.93 0.00 3.67 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.66 0.00 22 P 0.00 4.35 0.00 2.05 2.13 0.00 3.55 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 23 V 7.14 4.10 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 0.75 0.00 0.00 0.98 0.00 0.00 24 G 8.66 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 0.00 0.00 0.00 25 P 0.00 4.09 0.00 2.22 2.31 0.00 3.96 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 2.07 1.97 0.00 26 A 7.94 3.92 1.35 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 27 L 8.15 4.30 0.00 1.64 1.56 -0.14 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 28 G 7.95 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 29 Q 8.07 4.64 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.60 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 30 H 7.79 4.55 0.00 3.39 3.48 0.00 5.48 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 G 7.84 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 32 A 8.10 3.45 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 33 N 7.90 4.75 0.00 2.64 2.78 0.00 0.00 7.17 7.45 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 34 I 8.25 4.27 1.90 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.97 0.90 0.00 0.00 35 M 7.91 3.87 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.63 0.00 36 E 8.39 4.06 0.00 2.10 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 0.00 2.51 2.47 0.00 37 F 8.66 4.32 0.00 2.83 3.05 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 38 V 7.57 3.44 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 0.88 0.00 0.00 0.45 0.00 0.00 39 K 10.41 3.93 0.00 1.95 2.05 0.00 1.61 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.59 7.81 40 A 8.27 4.21 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 0.00 0.00 0.00 0.00 0.00 41 F 8.78 4.05 0.00 3.33 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 42 N 9.46 3.82 0.00 2.90 2.87 0.00 0.00 7.31 7.38 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 43 A 8.70 4.03 1.46 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 0.00 0.00 0.00 44 A 8.77 4.00 1.17 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 45 T 7.50 3.60 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 0.52 0.00 0.00 46 A 7.98 3.95 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 47 N 7.82 4.34 0.00 2.83 2.94 0.00 0.00 7.10 7.76 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 48 M 7.74 4.50 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.46 0.00 49 G 8.18 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 50 D 8.73 5.01 0.00 2.76 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 51 A 7.76 4.41 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 52 I 7.56 5.22 1.93 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 1.28 1.16 1.04 0.00 0.00 53 V 9.80 4.68 2.44 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 1.25 0.00 0.00 1.00 0.00 0.00 54 P 0.00 4.86 0.00 2.15 2.12 0.00 3.93 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 55 V 10.01 4.25 2.19 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 1.06 0.00 0.00 1.04 0.00 0.00 56 E 8.61 5.74 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 2.22 2.40 0.00 57 I 7.08 3.11 1.33 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.39 0.00 0.00 58 T 8.93 4.25 4.47 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 1.31 0.00 0.00 59 I 8.87 5.64 2.03 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.46 1.05 0.00 0.00 60 Y 8.59 4.90 0.00 2.85 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 61 A 9.04 3.98 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 62 D 8.19 4.32 0.00 2.73 2.79 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 63 R 9.04 3.77 0.00 1.95 2.06 0.00 3.27 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.76 0.00 64 S 7.54 4.88 0.00 3.88 3.57 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 65 F 8.31 5.27 0.00 2.95 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 66 T 9.21 4.61 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 1.13 0.00 0.00 67 F 8.55 5.05 0.00 3.38 3.17 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 68 V 7.92 3.42 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 0.54 0.00 0.00 0.73 0.00 0.00 69 T 7.95 4.60 4.39 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 1.48 0.00 0.00 70 K 8.30 4.38 0.00 1.79 1.54 0.00 1.52 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.25 1.29 7.81 71 T 8.47 3.83 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 1.18 0.00 0.00 72 P 0.00 4.43 0.00 2.24 2.14 0.00 3.94 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.15 0.00 73 P 0.00 4.32 0.00 2.09 2.07 0.00 3.88 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 74 A 8.36 4.07 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 75 S 8.09 4.35 0.00 3.89 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 76 Y 8.37 5.12 0.00 3.26 3.27 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 77 L 5.93 4.43 0.00 1.46 0.68 0.86 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 78 I 7.51 3.56 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.63 0.88 0.00 0.00 79 R 7.57 3.86 0.00 1.88 1.94 0.00 3.26 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.83 0.00 80 K 7.92 3.86 0.00 1.66 1.83 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.41 7.81 81 A 8.04 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 82 A 8.41 4.18 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 83 G 6.80 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.20 4.31 0.00 1.62 1.62 0.89 0.86 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 85 E 8.66 4.55 0.00 1.86 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 2.19 2.28 0.00 86 K 8.71 3.71 0.00 1.91 1.70 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.41 7.81 87 G 9.06 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 0.00 0.00 0.00 88 A 7.83 4.40 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 89 H 8.46 4.73 0.00 3.04 3.25 0.00 5.87 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 K 7.84 4.65 0.00 1.77 1.60 0.00 1.72 0.00 0.00 1.80 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.39 7.81 91 P 0.00 4.17 0.00 2.03 2.09 0.00 3.86 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 2.01 1.95 0.00 92 G 7.28 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 93 R 8.33 3.64 0.00 1.97 2.00 0.00 3.42 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 94 E 7.85 4.71 0.00 1.85 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 2.05 2.17 0.00 95 K 8.06 4.48 0.00 1.74 1.69 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.78 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.35 1.41 7.81 96 V 7.74 4.45 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 0.85 0.00 0.00 0.96 0.00 0.00 97 G 8.77 3.60 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 0.00 0.00 0.00 98 R 8.88 5.10 0.00 1.61 1.83 0.00 3.14 0.00 0.00 3.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 99 I 9.29 5.33 1.88 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 0.92 0.72 0.92 0.00 0.00 100 T 8.07 4.68 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 1.27 0.00 0.00 101 W 9.43 4.53 0.00 3.40 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 0.00 102 E 8.31 3.91 0.00 2.14 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 2.38 2.47 0.00 103 Q 7.76 3.95 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.56 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 104 V 7.93 3.67 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 0.94 0.00 0.00 0.56 0.00 0.00 105 L 7.91 3.78 0.00 1.84 1.41 0.62 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.14 3.89 0.00 2.38 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 2.30 2.42 0.00 107 I 7.62 3.70 2.05 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 1.42 0.72 0.96 0.00 0.00 108 A 8.11 4.40 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 0.00 109 K 10.57 3.86 0.00 1.89 1.74 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.61 7.81 110 Q 8.02 4.00 0.00 1.98 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.07 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 111 K 7.62 4.23 0.00 1.90 1.93 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.11 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.42 7.81 112 M 9.65 4.86 0.00 2.09 2.00 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 2.44 2.76 0.00 113 P 0.00 4.31 0.00 2.19 2.22 0.00 3.84 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.03 0.00 114 D 7.85 4.97 0.00 2.63 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.44 3.73 0.00 1.66 1.58 0.91 0.94 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 0.00 116 N 7.73 4.98 0.00 2.60 2.75 0.00 0.00 6.97 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 0.00 117 T 7.73 4.16 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 1.23 0.00 0.00 118 T 7.70 4.12 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 1.22 0.00 0.00 119 D 7.59 4.59 0.00 2.82 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 0.00 120 L 8.54 3.98 0.00 1.68 1.65 0.84 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.32 4.16 0.00 2.19 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 2.48 2.54 0.00 122 A 8.30 4.19 1.35 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 0.00 123 A 8.02 3.90 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 0.00 124 A 8.43 3.59 1.01 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 0.00 125 R 8.57 3.96 0.00 2.16 2.03 0.00 3.18 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 1.71 1.79 0.00 126 M 8.41 4.07 0.00 2.23 2.00 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 2.62 2.64 0.00 127 I 8.15 4.01 1.86 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 2.20 0.93 0.00 0.00 128 A 8.65 4.19 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 0.00 129 G 8.88 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 0.00 130 S 9.84 4.15 0.00 4.10 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 0.00 131 A 7.99 3.96 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 0.00 132 R 8.02 4.70 0.00 1.89 2.24 0.00 3.44 0.00 0.00 3.24 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.55 0.00 133 S 7.86 4.02 0.00 3.90 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 0.00 134 M 8.35 4.00 0.00 2.27 2.08 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 2.62 2.59 0.00 135 G 9.69 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 0.00 136 V 7.07 3.94 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 0.98 0.00 0.00 0.93 0.00 0.00 137 E 8.87 5.04 0.00 1.93 1.78 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 2.24 2.43 0.00 138 V 8.41 4.33 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 1.02 0.00 0.00 1.11 0.00 0.00 139 V 9.91 4.55 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 0.72 0.00 0.00 0.94 0.00 0.00 140 G 9.26 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 0.00 0.00 0.00 0.00 141 A 8.99 3.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 P 0.00 4.34 0.00 2.13 2.03 0.00 3.71 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 143 E 7.99 4.45 0.00 1.83 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.07 0.00 144 V 7.58 4.59 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 0.71 0.00 0.00 0.90 0.00 0.00 145 K 8.09 4.58 0.00 1.76 1.76 0.00 1.64 0.00 0.00 1.86 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.39 7.81 146 D 8.20 4.36 0.00 2.75 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 A 7.78 4.09 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