NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4251 8.3349 115.4125 58.9060 63.5898 174.7436 2 M 4.0577 8.7335 118.7400 54.3164 32.1716 174.2183 3 Q 3.7641 8.8982 118.7676 56.0662 27.6412 172.1476 4 D 4.4851 7.6072 111.7479 51.7408 44.5192 174.9640 5 P 4.2395 0.0000 0.0000 65.7582 31.5211 178.4396 6 I 3.6230 7.8818 117.8524 64.5301 36.9790 178.0008 7 A 3.9360 8.4581 121.2751 55.3411 18.2659 178.8144 8 D 4.3153 7.9908 116.4995 58.5119 41.1311 177.8335 9 M 3.9717 8.3324 118.4218 58.6487 32.2087 177.8273 10 L 3.9558 8.6063 118.7043 58.3390 42.1261 179.9745 11 T 3.8444 8.4429 115.6329 66.5918 68.6054 176.2997 12 R 4.1878 8.1481 119.1884 57.7709 30.2270 178.4703 13 I 3.7844 7.5289 119.7949 64.6741 36.9193 178.3363 14 R 4.3963 7.7663 118.0377 58.8943 29.2305 178.3631 15 N 4.4629 8.4351 117.4073 55.6751 38.5216 176.9738 16 G 3.7966 7.8416 105.5517 46.2074 0.0000 175.6931 17 Q 4.5554 8.7985 121.9422 58.5081 28.6236 179.3939 18 A 4.0072 7.5251 118.3465 54.8676 18.5239 178.8168 19 A 4.1611 7.4878 116.8860 52.7318 18.6279 177.5951 20 N 5.0082 7.7826 112.8740 54.5251 36.5404 174.6451 21 K 4.0805 8.2905 118.5668 56.8004 32.6401 177.4977 22 A 4.2804 8.2102 125.0492 50.7432 19.4038 175.0487 23 A 4.9707 6.9399 117.2281 52.7592 21.5960 176.9079 24 V 4.5765 8.2277 120.9258 60.0513 35.4101 174.2171 25 T 5.6072 8.2965 114.2841 59.7943 70.4985 172.2990 26 M 4.5859 8.2078 120.9778 53.6037 34.3656 171.9325 27 P 4.7588 0.0000 0.0000 63.4527 32.0881 175.8107 28 S 4.5397 8.6481 120.8201 56.5179 62.9228 173.9530 29 S 4.2899 8.5734 122.2277 57.5624 63.1449 174.5162 30 K 3.8361 8.8251 125.9687 59.8547 32.0892 178.3223 31 L 3.8567 8.0829 119.2970 58.2454 41.7174 178.8113 32 K 3.8463 7.7396 117.1822 59.7853 32.0435 178.7835 33 V 3.0796 7.3428 118.0907 65.4974 31.1993 177.6232 34 A 4.3152 7.7135 122.7207 54.2766 18.3642 179.3000 35 I 3.8537 7.3165 117.9325 64.2562 37.3093 178.1047 36 A 3.9163 7.0395 119.8971 54.8539 18.1465 179.0695 37 N 4.7883 7.9735 114.9437 56.5925 38.7327 177.6984 38 V 4.1815 8.0407 115.4117 63.6164 31.7262 178.4205 39 L 4.1674 8.0560 118.5872 57.8484 41.5297 179.6435 40 K 4.8509 7.8270 119.4837 59.3662 32.7153 178.8075 41 E 3.8525 8.1616 119.3542 59.4670 29.0699 179.1425 42 E 3.6966 7.6950 117.8689 57.4122 29.0462 178.1156 43 G 3.7226 7.7041 106.4303 46.2432 0.0000 174.2036 44 F 5.3812 8.4953 120.2330 57.6047 41.1226 176.5046 45 I 4.6075 7.6715 110.5461 58.8938 41.1137 175.4126 46 E 4.0125 9.1216 124.6831 58.8040 30.1250 176.9775 47 D 5.1525 8.3957 116.8221 53.2889 43.0408 172.8919 48 F 5.3228 7.8646 111.1878 56.3752 40.6028 173.7476 49 K 4.5927 9.0192 118.8638 54.9493 36.9354 175.4180 50 V 4.6698 8.5205 123.6664 61.5277 33.4594 175.1578 51 E 4.3708 9.5372 130.1830 54.2971 29.9583 177.1228 52 G 4.4376 8.1930 119.1967 44.7429 0.0000 173.1372 53 D 4.4780 8.1675 120.6248 56.3672 39.6787 178.2439 54 T 4.4426 6.8215 108.9837 61.0250 69.0802 172.5685 55 K 4.6478 6.9203 124.7615 55.5476 35.2757 172.0428 56 P 4.7498 0.0000 0.0000 63.1681 32.8065 174.9121 57 E 5.0827 8.8729 120.4417 54.8734 34.6756 174.2582 58 L 4.7273 9.4828 127.2615 54.0045 43.3439 174.6666 59 E 5.0866 9.7581 130.6755 54.6218 29.4619 173.1570 60 L 5.3222 8.4969 125.2618 53.1613 43.4744 175.7739 61 T 4.6059 8.9244 120.0376 62.6943 69.9914 173.8527 62 L 4.5505 8.2723 127.3905 53.7727 42.2726 177.1005 63 K 4.6102 8.6305 125.2633 56.3464 33.2637 175.1461 64 Y 5.2964 7.8835 121.3651 56.9766 41.8365 176.2891 65 F 4.7627 8.1696 115.1255 57.8549 43.7542 174.6194 66 Q 4.6555 7.9070 119.7587 55.6696 29.8829 172.9542 67 G 2.7185 7.5308 108.2000 44.9868 0.0000 173.6009 68 K 4.5121 7.9980 120.6596 54.4793 35.4437 175.0442 69 A 4.7315 8.7985 126.9787 52.6449 18.9236 177.0391 70 V 4.2852 8.5135 119.0441 61.3318 32.6068 175.4498 71 V 4.1256 7.7181 118.6530 60.7252 35.3261 173.5178 72 E 4.5992 8.0172 117.5826 55.9655 32.0353 175.4241 73 S 4.5046 6.8978 111.4279 57.6198 66.2627 173.8654 74 I 3.6181 7.5306 115.6177 60.5895 40.4296 172.5808 75 Q 4.5119 7.6230 128.5556 55.5977 32.7299 172.0591 76 R 4.7836 8.6819 123.6494 54.6857 30.8935 176.1793 77 V 4.5970 8.3930 118.4469 61.1151 33.3173 176.9145 78 S 4.5407 8.1779 112.7596 58.9663 64.7838 174.0154 79 R 4.0831 8.2930 115.7806 55.0279 29.5892 174.1472 80 P 4.3250 0.0000 0.0000 64.0618 32.0487 176.2977 81 G 3.8193 9.2753 108.9087 45.4210 0.0000 172.8401 82 L 4.5259 7.2608 118.3774 54.4704 44.6064 173.2074 83 R 4.4443 8.3058 123.7786 54.5677 34.0077 174.8538 84 I 4.1917 7.7456 115.2991 60.4589 39.5481 176.1514 85 Y 4.9661 7.5673 114.4634 57.7017 39.9428 174.4845 86 K 4.3036 7.9011 124.2806 55.6777 33.4822 176.8892 87 R 4.3591 8.9136 120.6461 55.1862 30.9097 177.1493 88 K 4.2169 8.4676 118.4878 58.3120 32.3181 177.1078 89 D 4.9612 7.6598 117.5177 54.0309 41.5790 176.2100 90 E 4.6933 8.3524 113.3750 56.4628 33.4922 174.9498 91 L 3.8081 7.7617 119.6568 54.4559 42.2748 174.5211 92 P 4.7730 0.0000 0.0000 61.2073 32.6010 175.6863 93 K 4.4308 8.6926 122.8017 58.3471 32.5849 178.5490 94 V 3.3259 7.9311 116.2545 64.0244 29.5013 170.5730 95 M 3.2700 8.2270 111.8710 54.9671 28.2288 178.0699 96 A 4.5514 7.3334 119.6814 52.3146 21.1975 177.4697 97 G 3.9371 8.7027 110.6020 46.4420 0.0000 173.8341 98 L 4.1756 8.0093 120.3509 56.9783 42.5464 177.3768 99 G 4.3194 7.1475 110.0144 46.0042 0.0000 171.2781 100 I 4.8336 8.0097 113.4726 60.5757 41.4035 173.4266 101 A 4.8758 9.1667 122.6311 50.5273 22.7383 175.3902 102 V 4.4520 7.7175 123.3097 61.0974 32.7979 175.4642 103 V 4.6857 8.3977 126.8881 61.1485 34.6668 173.7674 104 S 5.2657 8.5944 121.9034 56.7804 65.2586 172.6057 105 T 4.8324 8.7056 115.4246 59.0892 72.1387 173.6276 106 S 4.5775 8.2137 116.4510 58.0316 62.0650 174.4504 107 K 4.6165 7.3914 119.8767 56.8919 38.3684 178.2827 108 G 4.1172 8.3397 106.1403 44.3037 0.0000 170.1917 109 V 4.4287 8.1492 118.6067 61.1903 32.1363 175.8462 110 M 4.8621 8.8397 129.7443 54.8892 35.7803 174.5693 111 T 4.7942 8.6209 118.3485 62.0461 71.1238 175.1600 112 D 4.5454 9.4010 125.8532 56.7479 39.1712 179.5306 113 R 3.9194 7.9214 119.3130 58.6397 30.0886 178.2085 114 A 3.9365 8.3801 120.7111 54.5569 18.1934 179.0631 115 A 3.9373 8.5991 118.8591 55.8140 18.6611 179.0476 116 R 4.0972 8.2203 116.6214 58.8353 29.7580 176.8687 117 Q 4.0992 7.2949 118.2886 57.8607 29.6380 178.3700 118 A 4.1981 8.1505 120.7096 52.7942 17.6904 179.2315 119 G 4.0876 8.7310 104.3733 46.7453 0.0000 174.2702 120 L 4.5442 7.2432 118.1934 53.4776 45.9132 175.7368 121 G 3.9619 8.3018 105.7219 45.2583 0.0000 173.0020 122 G 4.4192 8.3322 115.7767 45.6508 0.0000 174.0612 123 E 4.7387 8.9840 125.9285 55.3124 32.0867 174.5958 124 I 4.5749 8.0965 113.3086 59.6885 40.0220 175.2614 125 I 4.6851 7.9563 119.5100 61.4917 40.3544 174.7331 126 C 5.5165 8.0924 114.8056 59.2510 32.3765 171.9259 127 Y 4.8163 7.2678 114.3133 56.2715 39.8321 173.6030 128 V 4.6474 7.8617 119.3563 59.5337 35.0724 175.4162 129 A 4.9212 7.6035 120.5959 51.9959 18.1627 177.4055 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 S 8.33 4.43 0.00 3.99 3.67 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 2 M 8.73 4.06 0.00 2.10 2.13 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 2.65 2.64 0.00 3 Q 8.90 3.76 0.00 2.13 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.04 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 4 D 7.61 4.49 0.00 2.69 2.48 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 5 P 0.00 4.24 0.00 2.19 2.06 0.00 3.67 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 2.10 2.16 0.00 6 I 7.88 3.62 1.97 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 1.56 0.93 0.89 0.00 0.00 7 A 8.46 3.94 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 8 D 7.99 4.32 0.00 2.94 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 9 M 8.33 3.97 0.00 2.24 2.06 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 10 L 8.61 3.96 0.00 1.78 1.69 0.90 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.44 3.84 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 12 R 8.15 4.19 0.00 1.97 1.94 0.00 3.09 0.00 0.00 3.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 13 I 7.53 3.78 2.11 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.44 0.98 0.00 0.00 14 R 7.77 4.40 0.00 2.07 2.18 0.00 3.04 0.00 0.00 3.27 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.52 0.00 15 N 8.44 4.46 0.00 2.88 2.93 0.00 0.00 6.81 7.20 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 16 G 7.84 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Q 8.80 4.56 0.00 2.16 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.52 2.47 0.00 18 A 7.53 4.01 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 19 A 7.49 4.16 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 20 N 7.78 5.01 0.00 2.97 3.15 0.00 0.00 6.99 7.18 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 21 K 8.29 4.08 0.00 1.94 1.94 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.52 7.81 22 A 8.21 4.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 6.94 4.97 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 24 V 8.23 4.58 2.09 0.00 0.00 0.00 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 0.94 0.00 0.00 25 T 8.30 5.61 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 1.28 0.00 0.00 26 M 8.21 4.59 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 27 P 0.00 4.76 0.00 1.95 2.06 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 28 S 8.65 4.54 0.00 3.85 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 29 S 8.57 4.29 0.00 3.88 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 30 K 8.83 3.84 0.00 1.82 1.83 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.48 7.81 31 L 8.08 3.86 0.00 1.78 1.62 0.92 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 32 K 7.74 3.85 0.00 1.87 1.78 0.00 1.93 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.42 7.81 33 V 7.34 3.08 2.15 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 1.13 0.00 0.00 1.00 0.00 0.00 34 A 7.71 4.32 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 35 I 7.32 3.85 1.91 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 1.42 0.74 0.87 0.00 0.00 36 A 7.04 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 N 7.97 4.79 0.00 3.03 3.18 0.00 0.00 7.19 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 38 V 8.04 4.18 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 1.28 0.00 0.00 1.01 0.00 0.00 39 L 8.06 4.17 0.00 1.92 1.97 0.97 1.05 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 40 K 7.83 4.85 0.00 2.37 2.30 0.00 1.59 0.00 0.00 2.16 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.67 1.35 7.81 41 E 8.16 3.85 0.00 2.15 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 2.39 2.50 0.00 42 E 7.70 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 2.15 2.19 0.00 43 G 7.70 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 0.00 0.00 0.00 44 F 8.50 5.38 0.00 3.07 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 I 7.67 4.61 2.08 0.00 0.00 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 1.43 0.85 1.03 0.00 0.00 46 E 9.12 4.01 0.00 2.05 1.91 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 2.27 2.30 0.00 47 D 8.40 5.15 0.00 2.66 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 48 F 7.86 5.32 0.00 3.08 3.08 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 0.00 0.00 0.00 49 K 9.02 4.59 0.00 1.89 1.67 0.00 1.58 0.00 0.00 1.52 0.00 0.00 2.78 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.26 1.31 7.81 50 V 8.52 4.67 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 0.94 0.00 0.00 1.13 0.00 0.00 51 E 9.54 4.37 0.00 2.06 1.91 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 2.48 2.41 0.00 52 G 8.19 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.17 4.48 0.00 2.80 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 54 T 6.82 4.44 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 1.21 0.00 0.00 55 K 6.92 4.65 0.00 2.05 1.92 0.00 1.37 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.35 1.13 7.81 56 P 0.00 4.75 0.00 2.26 2.23 0.00 3.66 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 2.16 2.00 0.00 57 E 8.87 5.08 0.00 1.91 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 2.23 2.64 0.00 58 L 9.48 4.73 0.00 1.68 1.65 0.77 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 59 E 9.76 5.09 0.00 2.10 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 2.25 2.39 0.00 60 L 8.50 5.32 0.00 2.09 1.90 0.95 0.82 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 61 T 8.92 4.61 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 1.16 0.00 0.00 62 L 8.27 4.55 0.00 1.28 1.60 0.98 0.78 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 63 K 8.63 4.61 0.00 1.95 1.84 0.00 1.73 0.00 0.00 2.61 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.79 1.35 7.81 64 Y 7.88 5.30 0.00 2.84 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 65 F 8.17 4.76 0.00 3.22 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 66 Q 7.91 4.66 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.06 2.15 0.00 67 G 7.53 2.72 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 0.00 0.00 0.00 68 K 8.00 4.51 0.00 1.66 1.72 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.46 7.81 69 A 8.80 4.73 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 V 8.51 4.29 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 0.64 0.00 0.00 0.59 0.00 0.00 71 V 7.72 4.13 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 0.46 0.00 0.00 0.87 0.00 0.00 72 E 8.02 4.60 0.00 1.79 1.86 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 2.13 2.18 0.00 73 S 6.90 4.50 0.00 3.83 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 7.53 3.62 1.68 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 1.12 0.42 0.81 0.00 0.00 75 Q 7.62 4.51 0.00 2.27 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.66 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 76 R 8.68 4.78 0.00 1.84 1.83 0.00 3.30 0.00 0.00 3.20 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.63 0.00 77 V 8.39 4.60 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 0.97 0.00 0.00 1.05 0.00 0.00 78 S 8.18 4.54 0.00 3.75 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 79 R 8.29 4.08 0.00 1.88 2.05 0.00 2.68 0.00 0.00 2.89 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 80 P 0.00 4.32 0.00 2.19 2.08 0.00 3.83 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.95 0.00 81 G 9.28 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 82 L 7.26 4.53 0.00 1.55 1.75 0.88 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 83 R 8.31 4.44 0.00 1.48 1.00 0.00 3.28 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.52 0.00 84 I 7.75 4.19 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 1.50 0.49 0.89 0.00 0.00 85 Y 7.57 4.97 0.00 3.01 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 K 7.90 4.30 0.00 2.09 1.92 0.00 1.65 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.54 1.48 7.81 87 R 8.91 4.36 0.00 1.86 2.07 0.00 3.17 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 88 K 8.47 4.22 0.00 1.98 1.80 0.00 1.89 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.64 7.81 89 D 7.66 4.96 0.00 2.67 2.61 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 90 E 8.35 4.69 0.00 2.03 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 2.18 2.44 0.00 91 L 7.76 3.81 0.00 1.67 1.71 1.05 1.12 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 92 P 0.00 4.77 0.00 2.19 2.06 0.00 3.80 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 93 K 8.69 4.43 0.00 1.79 1.93 0.00 1.88 0.00 0.00 1.00 0.00 0.00 3.09 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.46 1.34 7.81 94 V 7.93 3.33 2.20 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 1.07 0.00 0.00 1.05 0.00 0.00 95 M 8.23 3.27 0.00 2.23 2.17 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 2.50 2.53 0.00 96 A 7.33 4.55 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 97 G 8.70 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 L 8.01 4.18 0.00 1.68 1.76 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 99 G 7.15 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 0.00 100 I 8.01 4.83 2.00 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 1.50 0.76 0.98 0.00 0.00 101 A 9.17 4.88 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 7.72 4.45 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 0.96 0.00 0.00 0.97 0.00 0.00 103 V 8.40 4.69 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 1.08 0.00 0.00 1.03 0.00 0.00 104 S 8.59 5.27 0.00 3.94 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 0.00 105 T 8.71 4.83 4.29 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 1.29 0.00 0.00 106 S 8.21 4.58 0.00 3.88 3.90 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 0.00 107 K 7.39 4.62 0.00 1.69 1.71 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.38 7.81 108 G 8.34 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.15 4.43 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.94 0.00 0.00 110 M 8.84 4.86 0.00 1.94 1.89 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.46 0.00 111 T 8.62 4.79 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 1.27 0.00 0.00 112 D 9.40 4.55 0.00 2.87 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 R 7.92 3.92 0.00 1.89 1.99 0.00 3.16 0.00 0.00 3.62 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 114 A 8.38 3.94 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 0.00 115 A 8.60 3.94 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 0.00 116 R 8.22 4.10 0.00 2.00 1.98 0.00 3.13 0.00 0.00 3.14 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 117 Q 7.29 4.10 0.00 2.22 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 118 A 8.15 4.20 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.73 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.24 4.54 0.00 1.57 1.60 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.30 3.96 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 0.00 0.00 0.00 122 G 8.33 4.42 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 0.00 123 E 8.98 4.74 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.27 0.00 124 I 8.10 4.57 2.21 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 1.36 0.73 1.01 0.00 0.00 125 I 7.96 4.69 1.87 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 1.40 1.29 0.90 0.00 0.00 126 C 8.09 5.52 0.00 2.69 3.08 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 0.00 0.00 0.00 127 Y 7.27 4.82 0.00 2.99 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 0.00 128 V 7.86 4.65 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 0.79 0.00 0.00 0.81 0.00 0.00 129 A 7.60 4.92 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