NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3517 0.0000 0.0000 61.7171 32.6799 175.8400 3 K 3.9844 8.6737 123.3319 55.3869 32.6504 175.2295 4 K 3.9329 9.1081 127.1973 57.1458 33.6102 175.0927 5 V 4.9587 8.4125 126.4619 61.1843 33.4845 174.3498 6 L 4.8905 9.0228 126.2720 53.2104 46.2726 175.3405 7 T 4.7890 8.1733 116.3588 62.2851 71.7742 173.8720 8 G 4.0738 8.5005 111.3727 45.8170 0.0000 171.6305 9 V 4.8717 7.7885 118.1561 60.8750 35.2442 176.2590 10 V 4.1670 8.5155 126.5214 62.7338 31.5449 176.4883 11 V 4.2369 8.6549 121.8039 61.6693 32.5233 176.5456 12 S 4.5179 7.6117 115.7720 56.8414 65.7471 173.6654 13 D 5.0309 8.6089 125.6054 54.0624 41.6006 176.2771 14 K 4.2228 7.8629 115.9904 57.2005 32.1798 176.5358 15 M 4.7238 7.6018 117.7748 53.1426 34.8167 174.9232 16 Q 4.3539 8.4313 118.9670 56.6633 29.6295 176.4722 17 K 4.6928 9.2382 119.1132 56.3523 30.1773 174.1768 18 T 5.1439 7.5856 112.9835 62.1292 72.5192 173.7493 19 V 4.6961 8.9766 116.6441 60.1583 36.9276 174.8022 20 T 4.8738 8.6504 119.9846 62.3383 69.9820 173.8016 21 V 4.4843 8.8890 128.1599 61.4740 33.1668 174.7612 22 L 4.7835 9.1347 131.9130 53.5377 42.2709 173.8864 23 V 4.2747 8.5572 125.4038 62.2116 32.4854 174.5638 24 E 4.8115 8.7454 128.9743 55.6378 31.1219 174.9349 25 R 4.8570 8.6819 123.0870 55.1945 34.1111 173.5768 26 Q 4.9381 8.8040 121.7921 53.8570 33.2743 174.0525 27 F 4.8224 7.5644 116.0348 56.2204 41.5138 170.8621 28 P 4.9654 0.0000 0.0000 61.9816 32.5270 175.5739 29 H 4.2733 9.1407 124.5558 55.6933 30.2310 174.0665 30 P 4.3033 0.0000 0.0000 65.0270 31.1191 176.5351 31 L 4.3470 7.9909 118.3504 55.8867 43.9553 176.1446 32 Y 4.6392 7.7073 113.5086 56.8839 38.3218 178.1128 33 G 4.2944 8.2743 110.3781 46.8548 0.0000 174.8291 34 K 4.0246 8.1763 118.6894 57.1409 33.7999 176.8430 35 V 4.2365 8.3265 122.4385 62.8249 31.9224 175.4371 36 I 4.2616 8.1400 122.4051 59.3804 40.6272 174.8092 37 K 4.6504 8.0582 122.5491 54.3915 34.5046 175.1368 38 R 4.7730 8.4318 128.8986 55.4450 33.1101 174.2385 39 S 5.0879 8.1536 112.2307 57.3952 65.5406 174.0779 40 K 4.6131 8.8753 122.0345 54.7467 35.9752 174.7169 41 K 4.9532 8.3865 124.5746 55.0537 33.9565 175.2630 42 Y 4.6800 9.2663 122.4138 56.0921 41.2316 174.7369 43 L 5.0418 8.7302 123.0893 53.7312 42.8028 175.7560 44 A 5.1295 9.1243 126.5171 50.1766 22.1924 174.8492 45 H 4.7765 9.2067 121.6755 56.1821 31.1176 173.9942 46 D 5.0150 9.6677 127.0513 51.4737 40.5243 173.9500 47 P 4.1753 0.0000 0.0000 65.3694 32.0181 178.5012 48 E 4.0538 8.1772 115.4352 57.0186 29.4570 177.5686 49 E 4.0218 7.8450 116.4034 57.0311 27.2288 175.7726 50 K 3.7018 7.1699 119.1103 59.4812 32.5407 176.4534 51 Y 4.0567 7.3571 115.4413 58.3338 38.6883 176.4319 52 K 4.7383 9.1536 123.6309 53.7470 35.0323 175.1390 53 L 4.1876 8.4158 122.3043 58.4812 40.4607 176.4551 54 G 4.0006 8.5109 114.1083 45.5808 0.0000 172.9409 55 D 4.7026 8.3902 121.0223 54.3077 42.3526 175.4227 56 V 4.6963 8.5742 122.4118 61.7334 33.3986 175.2050 57 V 4.9620 8.7121 120.0046 59.7043 36.7109 173.9638 58 E 5.0295 9.0727 121.7151 55.0879 31.4974 175.6618 59 I 4.6732 9.3291 126.2559 60.0029 39.8003 174.6605 60 I 5.0552 8.4744 124.7106 58.8213 41.4070 174.0629 61 E 3.6140 9.3897 131.0617 57.0792 29.9400 175.9398 62 S 4.7435 7.9110 122.0197 56.5760 67.3082 173.3395 63 R 4.0806 8.4206 120.2524 55.1590 30.5130 174.2654 64 P 4.3576 0.0000 0.0000 63.5556 31.8538 175.9108 65 I 4.2562 8.0844 122.1622 62.3495 39.0867 175.3416 66 S 4.4980 7.3447 111.7323 56.9512 65.3571 173.3064 67 K 3.9591 8.4304 121.6703 57.3713 32.8401 176.2904 68 R 3.6688 8.4186 124.7195 55.1270 27.7119 176.5851 69 K 5.2574 6.6441 124.1234 56.7421 34.2790 173.7023 70 R 4.5402 7.7243 128.0817 55.2437 32.0708 174.5866 71 F 5.3455 8.2626 115.5389 56.0889 43.9592 173.8772 72 R 4.9203 8.7525 120.6226 54.0804 33.7595 175.4559 73 V 3.6108 7.9850 122.9110 63.0325 30.7246 175.6576 74 L 4.2397 9.0455 131.2437 57.0847 42.3387 176.7761 75 R 4.6040 7.4545 112.2134 55.6180 32.6164 172.1038 76 L 4.8932 8.6767 121.5870 54.3419 42.5564 175.8985 77 V 4.2332 8.7543 126.7520 64.6412 33.0829 176.2032 78 E 4.6637 7.6209 115.9888 55.5366 32.3871 175.8550 79 S 5.3120 8.6909 118.8391 57.2860 63.5823 174.7280 80 G 3.5905 8.1123 106.5294 45.7959 0.0000 175.1392 81 R 5.3246 7.0664 131.2299 55.9816 30.9083 174.7355 82 M 4.2211 7.4488 124.8297 57.9654 31.9752 177.0089 83 D 4.6214 8.2278 119.6904 56.3773 39.0288 178.6734 84 L 3.9529 7.6437 119.8860 57.4048 41.9830 178.9540 85 V 3.6726 7.8602 117.6352 66.2277 31.1754 177.3367 86 E 3.9328 8.7589 118.3738 59.6697 29.2915 179.0940 87 K 3.9438 7.5551 117.6095 60.0422 32.2362 178.2194 88 Y 4.1295 7.8858 118.7552 61.0005 38.5912 178.6555 89 L 3.5877 8.3295 119.8169 57.8379 41.6423 179.4628 90 I 3.5991 8.4288 120.5014 64.4597 36.7558 178.5111 91 R 3.8291 7.9024 119.0130 59.2258 29.7186 178.2591 92 R 3.1430 7.3316 118.5935 58.9188 30.0545 178.2974 93 Q 3.9374 8.0326 119.8605 59.1501 28.7985 177.9455 94 N 4.4602 7.8194 116.7807 56.3498 38.5872 176.5329 95 Y 4.3043 8.0378 117.8805 60.9023 37.6231 178.5060 96 Q 4.3162 7.4636 117.4164 56.4561 30.4847 175.4538 97 S 4.2258 10.6355 120.1812 57.4812 69.4487 177.5177 98 L 3.6331 8.2948 115.3758 57.0316 38.3759 174.1164 99 S 4.5010 7.5212 116.2043 59.9286 65.1800 174.9976 100 K 4.5933 7.8595 118.2868 54.3554 34.5466 176.4628 101 R 4.2501 9.2608 115.1779 53.6004 32.4184 174.8389 102 G 3.9807 8.2770 109.5421 44.2214 0.0000 172.8304 103 G 4.3593 8.3415 113.8664 44.9109 0.0000 172.9204 104 K 4.4104 7.8089 118.4222 55.0964 31.9641 176.3064 105 A 4.0991 8.6700 130.5776 54.0415 18.9920 176.3596 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 P 0.00 4.35 0.00 2.06 2.06 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 3 K 8.67 3.98 0.00 1.71 1.88 0.00 1.75 0.00 0.00 1.91 0.00 0.00 2.80 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.48 7.81 4 K 9.11 3.93 0.00 1.98 1.84 0.00 1.47 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.51 1.47 7.81 5 V 8.41 4.96 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 0.92 0.00 0.00 0.98 0.00 0.00 6 L 9.02 4.89 0.00 1.09 1.19 -0.13 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.17 4.79 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 1.20 0.00 0.00 8 G 8.50 4.07 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 9 V 7.79 4.87 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 0.96 0.00 0.00 0.91 0.00 0.00 10 V 8.52 4.17 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 0.95 0.00 0.00 0.97 0.00 0.00 11 V 8.65 4.24 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 0.37 0.00 0.00 0.35 0.00 0.00 12 S 7.61 4.52 0.00 3.89 3.64 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 13 D 8.61 5.03 0.00 2.65 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 14 K 7.86 4.22 0.00 1.78 1.86 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.43 7.81 15 M 7.60 4.72 0.00 2.00 1.99 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 2.52 2.54 0.00 16 Q 8.43 4.35 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.21 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 17 K 9.24 4.69 0.00 2.01 1.89 0.00 1.95 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.60 1.43 7.81 18 T 7.59 5.14 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 1.30 0.00 0.00 19 V 8.98 4.70 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 0.77 0.00 0.00 0.99 0.00 0.00 20 T 8.65 4.87 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 1.11 0.00 0.00 21 V 8.89 4.48 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 0.86 0.00 0.00 0.85 0.00 0.00 22 L 9.13 4.78 0.00 1.45 1.49 0.93 -0.45 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 23 V 8.56 4.27 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 0.85 0.00 0.00 0.77 0.00 0.00 24 E 8.75 4.81 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 2.27 2.32 0.00 25 R 8.68 4.86 0.00 1.98 1.79 0.00 3.13 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.73 0.00 26 Q 8.80 4.94 0.00 1.95 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.85 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 27 F 7.56 4.82 0.00 3.17 3.19 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 28 P 0.00 4.97 0.00 2.18 2.16 0.00 4.06 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.04 0.00 29 H 9.14 4.27 0.00 3.32 3.40 0.00 5.61 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.30 0.00 2.15 2.16 0.00 3.63 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.90 0.00 31 L 7.99 4.35 0.00 1.33 1.11 0.81 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.71 4.64 0.00 2.92 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 33 G 8.27 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 0.00 0.00 0.00 0.00 34 K 8.18 4.02 0.00 1.79 1.99 0.00 1.28 0.00 0.00 1.54 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.41 7.81 35 V 8.33 4.24 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 0.78 0.00 0.00 0.93 0.00 0.00 36 I 8.14 4.26 1.71 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 0.05 -0.19 0.91 0.00 0.00 37 K 8.06 4.65 0.00 1.66 1.65 0.00 1.58 0.00 0.00 0.61 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.32 7.81 38 R 8.43 4.77 0.00 2.19 1.94 0.00 3.51 0.00 0.00 3.48 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 39 S 8.15 5.09 0.00 3.90 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 40 K 8.88 4.61 0.00 1.75 1.58 0.00 1.49 0.00 0.00 1.52 0.00 0.00 2.22 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.30 1.04 7.81 41 K 8.39 4.95 0.00 1.56 1.61 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.18 1.38 7.81 42 Y 9.27 4.68 0.00 2.72 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 43 L 8.73 5.04 0.00 1.60 1.67 0.99 0.77 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 44 A 9.12 5.13 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 45 H 9.21 4.78 0.00 3.26 3.24 0.00 5.72 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 9.67 5.02 0.00 2.73 2.54 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 0.00 0.00 0.00 0.00 47 P 0.00 4.18 0.00 2.20 2.07 0.00 3.64 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.69 0.00 48 E 8.18 4.05 0.00 1.99 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 2.39 2.34 0.00 49 E 7.85 4.02 0.00 2.12 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 2.40 2.38 0.00 50 K 7.17 3.70 0.00 1.63 1.33 0.00 1.73 0.00 0.00 1.28 0.00 0.00 2.77 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.55 1.08 7.81 51 Y 7.36 4.06 0.00 3.09 2.96 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 52 K 9.15 4.74 0.00 1.77 1.69 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.48 7.81 53 L 8.42 4.19 0.00 1.60 1.64 1.01 1.11 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 54 G 8.51 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 0.00 0.00 0.00 55 D 8.39 4.70 0.00 2.84 2.70 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 0.00 0.00 0.00 0.00 56 V 8.57 4.70 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 1.01 0.00 0.00 0.93 0.00 0.00 57 V 8.71 4.96 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 0.65 0.00 0.00 0.77 0.00 0.00 58 E 9.07 5.03 0.00 1.81 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 2.19 2.23 0.00 59 I 9.33 4.67 1.48 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.68 0.49 0.00 0.00 60 I 8.47 5.06 1.89 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 1.13 1.76 0.96 0.00 0.00 61 E 9.39 3.61 0.00 2.08 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 0.00 2.13 1.94 0.00 62 S 7.91 4.74 0.00 3.65 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 63 R 8.42 4.08 0.00 1.73 1.77 0.00 3.24 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 64 P 0.00 4.36 0.00 2.04 1.97 0.00 3.64 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 65 I 8.08 4.26 1.82 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 1.26 0.73 0.72 0.00 0.00 66 S 7.34 4.50 0.00 3.93 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 67 K 8.43 3.96 0.00 1.74 1.75 0.00 1.93 0.00 0.00 1.64 0.00 0.00 2.74 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.43 7.81 68 R 8.42 3.67 0.00 1.98 1.93 0.00 3.41 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 1.53 1.62 0.00 69 K 6.64 5.26 0.00 1.90 1.86 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.28 1.50 7.81 70 R 7.72 4.54 0.00 1.61 1.41 0.00 3.18 0.00 0.00 3.34 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 71 F 8.26 5.35 0.00 2.94 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 72 R 8.75 4.92 0.00 1.76 1.81 0.00 3.17 0.00 0.00 3.12 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 73 V 7.99 3.61 1.65 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 -0.70 0.00 0.00 0.67 0.00 0.00 74 L 9.05 4.24 0.00 1.66 1.72 0.97 0.95 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 75 R 7.45 4.60 0.00 1.93 2.02 0.00 3.02 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 76 L 8.68 4.89 0.00 1.97 1.71 0.99 0.96 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 77 V 8.75 4.23 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 0.83 0.00 0.00 0.92 0.00 0.00 78 E 7.62 4.66 0.00 2.04 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 2.24 2.28 0.00 79 S 8.69 5.31 0.00 3.86 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 80 G 8.11 3.59 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 81 R 7.07 5.32 0.00 2.34 2.11 0.00 3.03 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.38 0.00 82 M 7.45 4.22 0.00 2.06 2.16 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 2.70 2.55 0.00 83 D 8.23 4.62 0.00 2.87 2.96 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 84 L 7.64 3.95 0.00 1.71 1.75 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.86 3.67 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 1.17 0.00 0.00 0.99 0.00 0.00 86 E 8.76 3.93 0.00 2.19 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 0.00 2.60 2.52 0.00 87 K 7.56 3.94 0.00 1.83 1.92 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.65 7.81 88 Y 7.89 4.13 0.00 3.02 3.20 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 89 L 8.33 3.59 0.00 1.79 1.61 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.43 3.60 2.05 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 1.38 1.31 0.89 0.00 0.00 91 R 7.90 3.83 0.00 1.86 1.78 0.00 3.26 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 92 R 7.33 3.14 0.00 1.34 1.69 0.00 2.99 0.00 0.00 2.98 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.31 0.00 93 Q 8.03 3.94 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 94 N 7.82 4.46 0.00 2.86 2.96 0.00 0.00 7.06 7.97 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 95 Y 8.04 4.30 0.00 3.21 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 96 Q 7.46 4.32 0.00 2.08 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.67 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 97 S 10.64 4.23 0.00 4.07 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 98 L 8.29 3.63 0.00 1.79 2.16 0.85 0.36 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 99 S 7.52 4.50 0.00 3.92 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 0.00 100 K 7.86 4.59 0.00 1.70 1.81 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.32 1.42 7.81 101 R 9.26 4.25 0.00 1.76 1.71 0.00 3.42 0.00 0.00 3.23 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 102 G 8.28 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 0.00 103 G 8.34 4.36 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 0.00 104 K 7.81 4.41 0.00 1.76 1.33 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.44 7.81 105 A 8.67 4.10 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