NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 M 4.3546 8.3049 120.3497 55.6552 33.2231 174.2362 1 D 4.5152 8.4550 117.9923 53.2576 42.5866 173.8144 2 I 4.3446 9.6985 122.8630 60.0841 39.7533 175.2365 3 I 4.7627 8.4281 128.1229 59.6228 39.3856 174.8448 4 L 4.8911 8.9921 127.5099 52.9320 45.3460 176.2961 5 G 4.5268 8.3327 107.5704 45.1169 0.0000 172.0912 6 I 4.6679 9.0284 124.9697 59.2546 41.6731 173.5732 7 R 4.8387 8.7574 130.0726 55.3919 30.8877 175.8239 8 V 4.2966 8.1730 121.8268 59.5577 34.0490 175.9197 9 Q 3.9327 8.5125 120.4833 59.9008 28.6375 178.6248 10 D 5.1121 7.6141 114.3528 53.3625 42.1872 175.3042 11 S 4.6420 7.4457 112.6818 57.8066 65.8862 173.8123 12 V 4.8559 8.3502 120.2627 61.1755 33.6677 174.3102 13 I 4.5392 8.9341 128.9368 59.5594 39.4842 174.4606 14 L 5.2126 8.5957 125.9626 52.8019 44.2821 175.5522 15 A 4.8433 8.7673 125.2601 50.2693 21.9779 175.3871 16 S 5.6785 8.6733 117.1355 56.3589 66.8960 174.2613 17 S 4.1560 8.8946 119.5395 59.2304 63.2888 174.3773 18 K 4.7984 8.9910 119.8425 55.7925 33.1815 175.6214 19 A 4.7888 7.7969 122.7102 51.1505 20.1344 177.7069 20 V 4.2445 8.9129 121.6925 61.5304 33.9453 173.8582 21 T 4.9695 8.4806 124.0620 61.6452 70.7645 174.5531 22 R 4.4322 8.9656 125.8767 54.8075 32.9043 178.3927 23 G 3.9181 9.0092 116.8991 46.7291 0.0000 173.7083 24 I 4.0124 9.0542 122.9529 61.9098 39.1967 174.5858 25 S 4.6761 7.6962 116.2363 56.4521 64.6663 173.6637 26 V 4.2409 8.1051 124.1350 61.6583 30.7240 175.6658 27 L 4.1969 8.7331 129.5141 57.0050 41.9529 177.9184 28 K 4.6720 7.7206 117.6445 54.9234 35.1981 175.3514 29 D 5.2319 8.7259 122.1390 53.0128 39.9373 175.8006 30 S 4.7446 7.9009 111.3430 58.2541 64.5757 173.2359 31 D 4.3439 8.2390 120.9840 55.1748 42.0789 174.6994 32 D 4.8906 8.6499 126.0857 51.8768 41.6570 176.6764 33 K 3.8872 7.7662 131.6364 55.6602 31.6886 176.4179 34 T 5.0109 7.0002 112.2679 60.6780 71.4697 173.7943 35 R 4.7871 9.0485 124.1207 54.5755 34.7905 173.9397 36 Q 4.5393 8.6754 124.6260 55.2636 29.6993 176.3207 37 L 4.0930 8.7365 127.7570 57.1582 42.3369 176.9304 38 S 4.5565 7.7794 110.5839 56.5045 64.9524 174.3441 39 P 4.3033 0.0000 0.0000 65.1215 30.7775 176.3424 40 H 5.0740 9.0788 115.0873 55.3446 31.2402 173.1229 41 T 5.0125 8.5755 115.9628 61.9657 72.4805 172.6626 42 L 5.1042 9.4467 128.8732 53.2792 45.5541 174.6455 43 M 5.3904 9.0254 125.1621 53.8600 35.2586 174.1500 44 S 5.1113 9.0155 121.4661 57.1445 65.4857 173.1569 45 F 5.6415 7.8583 115.9214 55.8722 41.2404 173.4855 46 A 4.6892 8.5487 120.4831 50.1201 22.5835 176.9484 47 G 4.1069 8.5233 107.0473 45.7317 0.0000 171.9141 48 E 3.9898 8.4482 123.6901 56.0785 30.3685 177.9877 49 A 4.0037 8.8810 128.0198 55.7969 18.6570 179.9361 50 G 3.7942 8.2057 101.1263 47.7731 0.0000 175.2606 51 D 4.6928 8.2383 121.6416 58.0089 40.8922 178.4038 52 T 3.7241 7.8600 111.7794 66.1674 67.1453 175.9313 53 V 3.0387 7.5095 118.4295 66.0124 32.1076 177.9763 54 Q 3.9852 7.6755 118.0431 59.2916 28.5636 179.6717 55 F 3.6161 8.4604 121.3079 60.8810 39.2862 176.9304 56 A 3.6822 7.4771 120.1684 55.2425 18.1316 179.4406 57 E 3.8197 8.3483 117.3102 59.5454 29.5359 178.7678 58 Y 4.0492 7.7308 119.1621 60.9749 38.7954 178.3757 59 I 3.3851 7.4845 120.4528 64.2088 37.0457 178.0242 60 Q 3.8233 8.1111 120.2945 59.1496 28.8936 177.9199 61 A 3.9224 8.2806 121.8900 55.6778 18.4320 179.3296 62 N 4.1225 7.8123 114.3625 56.5080 38.5129 177.8276 63 I 3.5456 7.6615 121.2042 64.3024 37.0896 178.5242 64 Q 3.9775 8.3174 119.3197 58.7428 28.4329 178.3783 65 L 3.8910 8.0023 121.4599 58.4180 42.0013 178.5059 66 Y 3.8526 7.8590 118.9167 60.5093 38.6599 178.0543 67 S 5.0061 7.9796 117.5642 61.2751 62.7676 176.8177 68 I 3.6780 7.7010 121.1245 64.3163 36.9644 178.0312 69 R 3.9473 7.9154 118.4938 59.1629 30.0109 177.5406 70 E 4.1607 7.9239 114.6725 54.9660 31.0093 175.2260 71 D 4.4232 7.9182 118.4919 54.2019 40.3480 171.8345 72 Y 4.8190 7.1901 118.1038 56.8475 42.0942 172.0491 73 E 4.6852 7.6813 125.1791 53.7988 30.9746 175.8017 74 L 4.0509 8.4076 126.8143 54.5004 42.4184 177.9463 75 S 4.2413 8.4043 117.3002 57.8607 64.7874 173.7746 76 P 4.1694 0.0000 0.0000 65.7254 31.1475 178.4787 77 Q 3.9279 8.1465 117.6537 59.2779 28.8203 178.3877 78 A 3.9307 7.8820 121.3286 55.2501 18.4864 179.4170 79 V 3.5263 7.9076 117.1726 66.4789 31.5060 178.4112 80 S 4.2029 8.4529 114.0079 61.6374 62.8452 176.6199 81 S 4.2588 8.1688 118.7976 61.0747 62.5054 176.4446 82 F 4.1992 8.4427 123.5083 61.2935 39.2106 177.2247 83 V 3.4702 7.9610 117.8305 65.9785 31.3039 177.7767 84 R 3.8687 8.4709 118.6225 59.4900 29.9368 177.8646 85 Q 3.9221 8.0279 119.1937 59.4226 28.9113 178.2374 86 E 3.9531 7.9501 119.1422 59.5791 29.4870 179.4621 87 L 3.8776 8.1133 118.3081 57.9368 41.5312 179.3548 88 A 3.9622 8.3508 119.4015 55.1848 18.4996 179.7747 89 K 4.0378 8.1193 116.8537 59.7496 32.2674 179.1494 90 S 4.0317 8.1720 113.5505 61.8015 61.9587 176.0801 90A I 3.6776 7.8469 120.0137 63.5275 37.6259 176.4697 90B R 4.4364 7.4896 116.1744 55.8143 30.0633 176.5241 91 S 4.5171 7.5593 114.4897 57.0858 65.0505 173.9978 92 R 3.8483 8.5204 119.5342 59.0522 29.7480 176.9222 93 R 4.3455 7.3739 119.9118 53.1981 30.8429 172.4552 94 P 4.3448 0.0000 0.0000 62.2015 32.0486 176.2326 95 Y 4.2100 9.0206 121.3803 58.3709 38.3814 176.8192 96 Q 4.5475 8.6561 125.1906 54.1903 27.9065 174.2358 97 V 4.9095 7.5503 120.0117 60.9085 35.5504 173.7322 98 N 5.2273 9.3532 123.3219 51.7442 41.9971 173.9211 99 V 5.1639 8.3071 113.5854 59.9573 36.4710 174.2390 100 L 4.8384 8.8796 122.2765 53.0444 44.6767 175.5830 101 I 4.8631 8.5988 124.0505 59.4634 39.8075 175.0538 102 G 4.1851 9.4041 115.1779 44.3413 0.0000 171.8837 103 G 4.5792 8.6585 110.8222 45.4264 0.0000 171.1931 104 Y 4.5294 8.7484 122.5824 55.3210 40.0564 175.2340 105 D 4.3345 8.0398 125.3571 54.4595 41.3702 175.6416 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 4.35 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 1 D 8.46 4.52 0.00 2.79 2.59 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 2 I 9.70 4.34 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.78 0.90 0.00 0.00 3 I 8.43 4.76 1.87 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.87 0.91 0.00 0.00 4 L 8.99 4.89 0.00 1.53 1.51 0.91 0.68 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 5 G 8.33 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 I 9.03 4.67 1.87 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 1.12 1.41 0.96 0.00 0.00 7 R 8.76 4.84 0.00 1.87 1.84 0.00 3.27 0.00 0.00 3.23 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 8 V 8.17 4.30 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 0.73 0.00 0.00 1.00 0.00 0.00 9 Q 8.51 3.93 0.00 2.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 7.41 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 10 D 7.61 5.11 0.00 2.68 2.65 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 11 S 7.45 4.64 0.00 4.06 3.92 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 0.00 0.00 0.00 12 V 8.35 4.86 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 0.86 0.00 0.00 0.97 0.00 0.00 13 I 8.93 4.54 1.87 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 1.23 0.66 0.91 0.00 0.00 14 L 8.60 5.21 0.00 1.47 1.53 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.77 4.84 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.67 5.68 0.00 3.61 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 17 S 8.89 4.16 0.00 3.85 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 18 K 8.99 4.80 0.00 1.76 1.87 0.00 1.92 0.00 0.00 1.77 0.00 0.00 2.84 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.26 7.81 19 A 7.80 4.79 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 20 V 8.91 4.24 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 1.09 0.00 0.00 0.95 0.00 0.00 21 T 8.48 4.97 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 1.25 0.00 0.00 22 R 8.97 4.43 0.00 1.78 1.85 0.00 3.42 0.00 0.00 3.18 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 23 G 9.01 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 24 I 9.05 4.01 1.87 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 1.42 0.89 0.91 0.00 0.00 25 S 7.70 4.68 0.00 3.85 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 26 V 8.11 4.24 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 0.81 0.00 0.00 0.93 0.00 0.00 27 L 8.73 4.20 0.00 1.76 1.72 0.93 0.93 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 28 K 7.72 4.67 0.00 1.73 1.58 0.00 1.67 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.42 7.81 29 D 8.73 5.23 0.00 2.77 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 30 S 7.90 4.74 0.00 3.83 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 31 D 8.24 4.34 0.00 2.83 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.65 4.89 0.00 2.70 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 7.77 3.89 0.00 1.56 1.36 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.49 1.39 7.81 34 T 7.00 5.01 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 1.27 0.00 0.00 35 R 9.05 4.79 0.00 1.88 1.80 0.00 3.38 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.74 0.00 36 Q 8.68 4.54 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.58 0.00 37 L 8.74 4.09 0.00 1.68 1.68 0.93 0.62 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 38 S 7.78 4.56 0.00 3.94 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 39 P 0.00 4.30 0.00 2.00 2.21 0.00 3.29 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 1.99 0.00 40 H 9.08 5.07 0.00 3.25 3.47 0.00 5.75 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.58 5.01 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 42 L 9.45 5.10 0.00 1.69 1.59 0.96 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 43 M 9.03 5.39 0.00 2.19 1.92 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 2.72 2.64 0.00 44 S 9.02 5.11 0.00 3.81 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 45 F 7.86 5.64 0.00 3.05 3.12 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 46 A 8.55 4.69 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 47 G 8.52 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 48 E 8.45 3.99 0.00 2.04 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 2.40 2.34 0.00 49 A 8.88 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 50 G 8.21 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 51 D 8.24 4.69 0.00 2.78 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 52 T 7.86 3.72 4.51 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 1.35 0.00 0.00 53 V 7.51 3.04 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 0.98 0.00 0.00 0.98 0.00 0.00 54 Q 7.68 3.99 0.00 2.44 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.60 0.00 0.00 0.00 0.00 0.00 2.45 2.64 0.00 55 F 8.46 3.62 0.00 1.91 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 56 A 7.48 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.35 3.82 0.00 1.96 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 2.30 2.43 0.00 58 Y 7.73 4.05 0.00 3.12 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 7.48 3.39 1.67 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 -0.11 0.87 0.00 0.00 60 Q 8.11 3.82 0.00 2.13 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 61 A 8.28 3.92 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 62 N 7.81 4.12 0.00 2.67 2.46 0.00 0.00 7.14 6.51 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 63 I 7.66 3.55 1.89 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.79 0.91 0.00 0.00 64 Q 8.32 3.98 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.59 0.00 65 L 8.00 3.89 0.00 1.81 1.80 0.90 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 7.86 3.85 0.00 3.01 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 67 S 7.98 5.01 0.00 4.10 3.92 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 0.00 0.00 0.00 68 I 7.70 3.68 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.58 0.88 0.00 0.00 69 R 7.92 3.95 0.00 1.74 1.75 0.00 3.06 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 1.47 1.58 0.00 70 E 7.92 4.16 0.00 1.60 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 1.90 2.14 0.00 71 D 7.92 4.42 0.00 2.72 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 72 Y 7.19 4.82 0.00 3.13 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 73 E 7.68 4.69 0.00 1.86 1.60 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 2.10 2.24 0.00 74 L 8.41 4.05 0.00 1.46 1.41 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.40 4.24 0.00 4.00 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 76 P 0.00 4.17 0.00 2.14 2.13 0.00 3.55 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 2.11 2.12 0.00 77 Q 8.15 3.93 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 78 A 7.88 3.93 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 79 V 7.91 3.53 2.22 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 1.06 0.00 0.00 0.85 0.00 0.00 80 S 8.45 4.20 0.00 4.10 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 81 S 8.17 4.26 0.00 4.11 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 82 F 8.44 4.20 0.00 2.97 3.28 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 83 V 7.96 3.47 2.30 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 1.13 0.00 0.00 1.04 0.00 0.00 84 R 8.47 3.87 0.00 1.88 1.92 0.00 3.17 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 85 Q 8.03 3.92 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.53 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 86 E 7.95 3.95 0.00 2.20 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 0.00 1.67 1.97 0.00 87 L 8.11 3.88 0.00 1.79 1.62 0.86 -0.12 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 88 A 8.35 3.96 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 89 K 8.12 4.04 0.00 2.05 1.87 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.66 7.81 90 S 8.17 4.03 0.00 4.02 4.03 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 0.00 0.00 0.00 0.00 90A I 7.85 3.68 1.84 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 1.50 0.78 0.93 0.00 0.00 90B R 7.49 4.44 0.00 1.85 1.90 0.00 3.20 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 91 S 7.56 4.52 0.00 3.91 3.84 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 92 R 8.52 3.85 0.00 1.75 1.93 0.00 3.14 0.00 0.00 3.12 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 93 R 7.37 4.35 0.00 1.66 1.65 0.00 3.25 0.00 0.00 3.16 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.54 0.00 94 P 0.00 4.34 0.00 2.02 1.98 0.00 3.66 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.18 0.00 95 Y 9.02 4.21 0.00 2.66 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.66 4.55 0.00 2.00 2.02 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 2.27 2.39 0.00 97 V 7.55 4.91 1.73 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 0.92 0.00 0.00 0.90 0.00 0.00 98 N 9.35 5.23 0.00 2.73 2.67 0.00 0.00 6.77 7.39 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 99 V 8.31 5.16 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.05 0.00 0.00 100 L 8.88 4.84 0.00 1.58 1.55 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 101 I 8.60 4.86 1.91 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 1.33 0.68 0.94 0.00 0.00 102 G 9.40 4.19 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 0.00 103 G 8.66 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 Y 8.75 4.53 0.00 3.00 2.94 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 0.00 105 D 8.04 4.33 0.00 2.51 2.25 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