NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2798 8.2549 117.2660 56.3749 31.8052 175.7372 3 H 4.6961 8.0248 116.2127 55.0912 28.7340 176.4342 4 L 3.9020 9.5358 125.6439 56.8521 42.9943 176.0607 5 K 4.0138 7.8229 117.2796 59.3901 33.3160 178.7834 6 S 4.6597 7.3858 111.4970 56.8327 62.2453 177.5538 7 G 3.8441 8.8091 103.1913 46.2283 0.0000 173.0585 8 R 4.1475 10.5345 119.5985 55.9865 29.6820 174.3397 9 K 4.5647 7.2991 117.1285 55.0319 34.9836 174.7490 10 L 5.0356 7.6572 125.1913 55.8301 41.5942 173.6686 11 N 4.7795 8.2185 120.4823 53.4865 40.4574 173.8594 12 R 3.6303 9.8941 115.6689 56.9766 30.0535 173.4830 13 H 5.0248 7.8610 111.9680 53.5270 32.1283 173.6618 14 S 4.0496 8.8668 113.6909 62.3097 62.2199 176.6986 15 S 4.0453 8.0652 117.9273 60.8927 63.1315 175.3774 16 H 4.2021 8.1015 122.5339 58.3437 29.1585 176.7470 17 R 3.5271 8.2254 120.5015 58.4781 30.0714 177.8826 18 L 3.5450 7.3930 119.3667 58.2040 42.1070 178.8520 19 A 3.9696 8.2796 120.8016 54.9132 18.1050 179.3722 20 L 3.7631 7.1884 118.9036 58.4782 42.1357 178.8734 21 Y 4.1554 6.9068 116.3410 61.1165 37.5725 178.3110 22 R 4.1319 7.8183 118.8867 59.7999 30.1288 178.6329 23 N 4.3339 8.3727 115.7852 56.6494 38.4785 177.6594 24 Q 3.9909 8.4403 119.1553 58.7634 28.7931 178.2511 25 A 4.0767 8.5871 122.1914 55.3762 18.4682 179.3126 26 K 3.9363 8.3918 117.0902 60.4039 32.2407 179.5893 27 S 4.1309 7.9974 114.7186 61.3585 62.6467 176.7087 28 L 3.9906 8.2271 123.5115 58.1397 41.7489 178.7052 29 L 4.1324 8.5924 117.0530 56.5565 41.5929 178.8765 30 T 4.1556 7.4745 115.7633 66.0585 69.0820 175.9643 31 H 4.8088 8.5718 115.0188 54.8598 29.8732 175.8910 32 G 4.3767 8.8625 115.1986 45.5116 0.0000 173.5669 33 R 5.1274 7.5599 117.1522 54.4969 32.3876 175.9048 34 I 4.7548 8.9692 122.2379 60.2790 42.3546 173.7466 35 T 5.3973 8.7659 115.7444 59.4548 71.0157 173.0604 36 T 4.7505 8.0805 115.6672 60.5166 72.6057 172.7303 37 T 4.4723 8.0948 110.1083 61.6466 69.7565 175.1260 38 V 3.5378 8.1976 125.1437 66.4539 31.3735 176.1708 39 P 4.1835 0.0000 0.0000 65.6264 31.1452 178.2118 40 K 3.8514 7.8688 116.3576 59.8771 32.1558 178.8628 41 A 3.9431 8.2050 120.6500 55.4827 18.1142 179.7669 42 K 3.8056 8.3518 115.8507 59.4643 32.4586 179.1100 43 E 3.9111 8.3932 119.7676 59.2011 29.7110 178.3130 44 L 3.6841 8.2407 120.6915 58.1700 41.7685 178.5229 45 R 3.8915 8.1739 118.6912 59.8736 29.9787 178.4915 46 G 3.5130 8.1298 104.1568 47.9156 0.0000 175.1487 47 F 3.9873 8.0948 122.3104 60.9526 39.6379 177.2431 48 V 3.6368 7.9805 117.4501 66.1713 31.4098 177.1774 49 D 4.5365 7.7727 118.5569 58.2595 40.8357 178.6055 50 H 4.0823 8.1535 117.5972 59.6729 29.5749 177.0661 51 L 3.7127 8.2786 120.7530 57.7688 41.4374 178.8817 52 I 3.3791 7.6380 118.8329 65.2655 36.8336 177.6603 53 H 3.8145 8.5507 118.2567 58.7616 30.0714 176.8633 54 L 4.0964 7.5240 121.8176 57.9423 41.7662 178.5397 55 A 3.9214 7.7798 119.6947 54.3265 18.1746 179.1131 56 K 3.9307 7.7825 118.2237 59.7448 32.4972 176.9704 57 R 4.3243 7.6881 118.0554 55.5279 31.7644 174.2083 58 G 3.9586 8.4289 103.4777 46.9756 0.0000 173.4592 59 D 4.3231 7.9628 120.3709 52.6815 40.7900 177.7401 60 L 3.8659 8.6419 123.1198 59.5154 40.0882 177.8561 61 H 4.0967 8.5518 118.0914 60.0230 29.4932 176.1962 62 A 3.9716 8.9110 122.7664 55.0619 18.3169 179.6020 63 R 4.1200 7.9798 117.4713 59.9201 30.1325 178.7615 64 R 3.9218 8.9223 118.9051 59.3098 29.4948 178.9957 65 L 3.9624 8.1723 118.9360 58.0125 41.5209 179.8787 66 V 3.7067 7.9231 117.8969 65.5131 31.2282 177.5838 67 L 4.0940 7.9901 119.4036 57.2630 41.8682 178.9822 68 R 4.0919 7.4334 117.3051 59.7331 30.2172 178.2323 69 D 4.5884 7.3072 113.8626 56.5775 41.3139 177.3325 70 L 4.3752 6.9785 118.2714 54.7748 42.3258 176.8693 71 Q 4.4002 8.3041 118.4819 55.7398 31.0768 174.7439 72 D 4.4995 8.0303 118.0827 53.5997 41.6965 176.3811 73 V 3.5777 8.6658 126.6340 66.3284 31.5078 177.6273 74 K 3.8636 8.3234 117.6110 59.8217 31.6898 178.7341 75 L 4.0114 8.0291 120.1850 58.0013 41.9207 179.3786 76 V 3.7192 7.8456 112.6162 64.0107 31.3376 178.6730 77 R 4.0259 8.0735 117.6036 59.3538 30.0605 178.4391 78 K 3.5515 7.7833 119.3484 59.8231 31.9103 178.3336 79 L 3.8128 7.6109 120.3658 58.1067 41.8098 178.9020 80 F 4.0772 8.1581 116.5144 59.3133 39.4788 176.3991 81 D 5.0082 8.8972 118.9925 53.0662 41.2188 176.9278 82 E 5.5171 7.6632 130.9665 56.6471 30.3791 178.1510 83 I 3.8491 7.2110 119.8375 63.8225 37.4603 177.7610 84 A 3.9383 8.6137 122.2396 54.9551 18.2438 177.5349 85 P 4.1448 0.0000 0.0000 66.1756 31.2047 178.6355 86 R 3.7833 7.1363 113.9159 59.3361 30.0482 177.7462 87 Y 4.6706 7.2281 112.5291 56.8944 38.5704 175.9439 88 R 3.9616 7.2051 120.8784 57.8224 30.6877 175.2453 89 D 4.4450 9.0819 120.0253 54.7615 37.8797 174.7324 90 R 4.3231 7.9254 118.8119 55.6775 32.0678 174.3989 91 Q 4.2296 8.7590 126.2962 55.4066 28.0055 176.9108 92 G 3.0701 8.7516 114.2992 45.5412 0.0000 172.1559 93 G 3.6606 7.8432 107.5426 46.8305 0.0000 174.4765 94 Y 3.9654 6.0814 113.9356 58.7327 38.4474 175.6163 95 T 4.9924 7.6400 116.0184 61.7792 72.4915 173.3346 96 R 4.6637 8.8174 125.8352 54.7301 33.7087 175.2478 97 V 5.0824 8.0525 116.1942 58.8834 34.2467 174.2016 98 L 4.4944 8.2570 125.6207 53.3347 43.5502 176.2357 99 K 4.3995 8.5458 123.2881 56.0919 32.5520 177.0133 100 L 4.2000 8.2350 125.7559 54.3905 42.3310 176.8312 101 A 4.5215 8.4660 124.4858 51.9552 19.3370 176.3743 102 E 4.7084 7.7646 118.9532 55.5086 33.0597 174.5287 103 R 4.6500 8.5764 125.6176 54.7064 31.8770 176.2640 104 R 3.9524 9.0725 124.4471 57.0695 29.7642 175.5540 105 R 4.4530 8.6728 124.8212 56.3099 31.4323 176.3413 106 G 4.0800 9.2599 110.4225 46.1514 0.0000 173.4205 107 D 4.3378 8.0211 117.1245 52.1940 43.1911 176.2294 108 G 3.9123 7.9780 106.5650 46.3760 0.0000 173.2313 109 A 4.3317 8.4566 122.5999 50.5633 19.5885 176.0121 110 P 4.6360 0.0000 0.0000 62.7375 32.7389 176.4389 111 L 4.6573 8.1379 123.7883 54.0654 44.6158 174.6933 112 A 4.5605 8.3028 120.4794 51.6670 23.6342 174.8510 113 L 4.9740 9.2687 120.8184 53.5959 44.8783 175.3654 114 V 4.7390 9.0066 127.3010 61.7289 33.6909 174.3109 115 E 5.1844 8.6733 126.8279 54.6316 33.6175 173.8497 116 L 4.6186 8.9730 128.0310 54.7229 41.9103 177.6049 117 V 3.8734 8.6156 124.8453 62.2396 32.2815 176.1761 118 E 4.5608 8.4868 121.0477 57.2190 29.5171 175.6364 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 2 R 8.25 4.28 0.00 1.88 1.97 0.00 3.00 0.00 0.00 3.21 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.70 0.00 3 H 8.02 4.70 0.00 3.28 3.03 0.00 5.72 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 9.54 3.90 0.00 1.84 1.79 0.93 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 5 K 7.82 4.01 0.00 1.79 1.91 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.46 7.81 6 S 7.39 4.66 0.00 3.93 3.03 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 7 G 8.81 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 0.00 0.00 0.00 8 R 10.53 4.15 0.00 1.94 2.17 0.00 3.32 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 9 K 7.30 4.56 0.00 1.87 1.74 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.52 1.44 7.81 10 L 7.66 5.04 0.00 1.85 1.83 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.22 4.78 0.00 2.69 2.72 0.00 0.00 7.15 7.65 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 12 R 9.89 3.63 0.00 1.82 1.85 0.00 2.95 0.00 0.00 2.80 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.48 0.00 13 H 7.86 5.02 0.00 3.28 3.40 0.00 5.69 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.87 4.05 0.00 4.07 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 0.00 15 S 8.07 4.05 0.00 4.08 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 16 H 8.10 4.20 0.00 2.97 3.01 0.00 5.85 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 8.23 3.53 0.00 1.62 1.81 0.00 3.11 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.98 0.00 18 L 7.39 3.54 0.00 1.66 1.82 0.91 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.28 3.97 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 20 L 7.19 3.76 0.00 1.52 1.35 0.85 1.14 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 21 Y 6.91 4.16 0.00 2.19 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 22 R 7.82 4.13 0.00 2.05 2.16 0.00 3.19 0.00 0.00 3.44 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.93 0.00 23 N 8.37 4.33 0.00 2.94 2.89 0.00 0.00 7.17 6.95 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 24 Q 8.44 3.99 0.00 2.37 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.41 2.53 0.00 25 A 8.59 4.08 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 0.00 0.00 0.00 0.00 0.00 26 K 8.39 3.94 0.00 2.01 1.92 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.79 7.81 27 S 8.00 4.13 0.00 3.97 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 28 L 8.23 3.99 0.00 1.86 1.85 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.59 4.13 0.00 1.82 1.69 0.88 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.47 4.16 4.18 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 0.85 0.00 0.00 31 H 8.57 4.81 0.00 3.20 3.32 0.00 5.72 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.86 4.38 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 0.00 33 R 7.56 5.13 0.00 1.70 1.87 0.00 3.30 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.82 0.00 34 I 8.97 4.75 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.78 0.94 0.00 0.00 35 T 8.77 5.40 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 36 T 8.08 4.75 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 1.23 0.00 0.00 37 T 8.09 4.47 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 38 V 8.20 3.54 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 0.91 0.00 0.00 0.97 0.00 0.00 39 P 0.00 4.18 0.00 2.20 2.05 0.00 3.60 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 2.12 2.19 0.00 40 K 7.87 3.85 0.00 1.75 1.93 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.51 7.81 41 A 8.21 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 42 K 8.35 3.81 0.00 1.80 1.88 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.61 7.81 43 E 8.39 3.91 0.00 2.02 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.99 0.00 44 L 8.24 3.68 0.00 1.71 1.94 0.95 1.01 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 45 R 8.17 3.89 0.00 2.04 2.05 0.00 3.10 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 1.59 1.65 0.00 46 G 8.13 3.51 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 0.00 47 F 8.09 3.99 0.00 2.74 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 48 V 7.98 3.64 2.34 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 0.80 0.00 0.00 1.06 0.00 0.00 49 D 7.77 4.54 0.00 2.83 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 50 H 8.15 4.08 0.00 3.22 3.37 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 8.28 3.71 0.00 1.80 1.51 0.31 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.64 3.38 1.69 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.87 0.14 0.00 0.00 53 H 8.55 3.81 0.00 3.41 3.36 0.00 5.75 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.52 4.10 0.00 1.87 1.59 0.90 1.37 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 55 A 7.78 3.92 0.42 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 56 K 7.78 3.93 0.00 1.60 1.82 0.00 1.68 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.34 1.42 7.81 57 R 7.69 4.32 0.00 1.88 2.07 0.00 3.51 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 58 G 8.43 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 59 D 7.96 4.32 0.00 2.92 2.85 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 0.00 0.00 0.00 0.00 60 L 8.64 3.87 0.00 1.80 1.91 0.89 0.61 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 61 H 8.55 4.10 0.00 3.19 3.64 0.00 5.69 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.91 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 63 R 7.98 4.12 0.00 1.58 1.98 0.00 2.75 0.00 0.00 3.00 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.92 0.00 64 R 8.92 3.92 0.00 1.89 1.97 0.00 3.18 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.90 0.00 65 L 8.17 3.96 0.00 1.82 1.71 0.83 0.94 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 66 V 7.92 3.71 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.80 0.00 0.00 67 L 7.99 4.09 0.00 1.89 1.85 0.94 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.43 4.09 0.00 2.07 2.01 0.00 3.23 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.85 0.00 69 D 7.31 4.59 0.00 2.71 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 70 L 6.98 4.38 0.00 1.63 1.63 0.88 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.30 4.40 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.01 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 72 D 8.03 4.50 0.00 2.77 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 73 V 8.67 3.58 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 1.03 0.00 0.00 0.95 0.00 0.00 74 K 8.32 3.86 0.00 2.01 1.89 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.54 7.81 75 L 8.03 4.01 0.00 1.72 1.83 0.92 1.00 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 76 V 7.85 3.72 2.33 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 0.89 0.00 0.00 1.12 0.00 0.00 77 R 8.07 4.03 0.00 2.06 2.02 0.00 3.18 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.90 0.00 78 K 7.78 3.55 0.00 1.79 2.05 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.48 7.81 79 L 7.61 3.81 0.00 1.74 1.38 0.59 0.68 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 80 F 8.16 4.08 0.00 3.05 3.03 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 81 D 8.90 5.01 0.00 2.58 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 82 E 7.66 5.52 0.00 1.93 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 2.00 2.05 0.00 83 I 7.21 3.85 1.92 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 1.66 1.19 1.00 0.00 0.00 84 A 8.61 3.94 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 85 P 0.00 4.14 0.00 2.11 2.11 0.00 3.61 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 86 R 7.14 3.78 0.00 1.44 1.50 0.00 3.02 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.64 0.00 87 Y 7.23 4.67 0.00 2.81 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 88 R 7.21 3.96 0.00 1.92 1.85 0.00 3.43 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 89 D 9.08 4.44 0.00 2.89 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 90 R 7.93 4.32 0.00 1.87 2.29 0.00 3.50 0.00 0.00 3.51 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.71 0.00 91 Q 8.76 4.23 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.64 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 92 G 8.75 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 7.84 3.66 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 0.00 0.00 0.00 94 Y 6.08 3.97 0.00 2.86 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 0.00 0.00 0.00 95 T 7.64 4.99 4.33 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 1.19 0.00 0.00 96 R 8.82 4.66 0.00 1.88 1.74 0.00 3.04 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.56 0.00 97 V 8.05 5.08 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 0.97 0.00 0.00 0.91 0.00 0.00 98 L 8.26 4.49 0.00 1.60 1.58 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.55 4.40 0.00 1.64 1.76 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.41 7.81 100 L 8.24 4.20 0.00 1.67 1.60 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.47 4.52 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 0.00 102 E 7.76 4.71 0.00 2.00 1.75 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 2.26 2.31 0.00 103 R 8.58 4.65 0.00 1.73 1.84 0.00 3.29 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 104 R 9.07 3.95 0.00 2.04 2.08 0.00 3.13 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 105 R 8.67 4.45 0.00 1.88 1.76 0.00 3.33 0.00 0.00 3.34 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 106 G 9.26 4.08 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 0.00 0.00 0.00 107 D 8.02 4.34 0.00 2.77 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.98 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 8.46 4.33 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 0.00 110 P 0.00 4.64 0.00 2.13 2.21 0.00 3.69 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 2.07 2.00 0.00 111 L 8.14 4.66 0.00 1.84 1.65 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.30 4.56 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 0.00 113 L 9.27 4.97 0.00 1.70 1.64 0.98 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 114 V 9.01 4.74 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 0.78 0.00 0.00 0.94 0.00 0.00 115 E 8.67 5.18 0.00 2.10 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 0.00 2.25 2.33 0.00 116 L 8.97 4.62 0.00 1.62 1.84 1.01 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.62 3.87 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 0.79 0.00 0.00 0.98 0.00 0.00 118 E 8.49 4.56 0.00 1.93 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 2.08 2.25 0.00