NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4497 8.3044 120.3258 55.1518 32.9307 175.6124 2 S 4.2745 9.3106 120.5857 58.6089 64.5454 171.0351 3 L 4.3666 7.9092 123.8580 53.2387 44.2793 175.1190 4 A 4.1044 8.7981 130.4288 55.0574 18.9441 178.1091 5 E 4.1739 8.3772 114.6435 58.0728 30.2545 177.7117 6 K 4.0501 7.1312 114.3551 57.2826 32.1421 174.4689 7 I 4.3567 7.4068 119.9266 59.6328 38.5527 173.7256 8 K 4.7008 8.2856 128.9635 54.1492 35.8892 174.1562 9 V 4.5395 8.6786 126.4440 61.2481 33.7187 173.9827 10 L 5.1914 9.2593 130.9445 53.3453 43.9898 175.1026 11 I 5.6831 8.9145 120.3284 58.1299 39.9933 175.1160 12 V 4.5468 8.2853 126.3284 59.8675 34.6381 174.2560 13 D 4.9678 8.4726 122.8174 52.4480 44.9324 175.8545 14 D 4.2538 9.0769 122.0099 57.2173 41.6641 177.1131 15 Q 4.4241 7.7875 119.0066 55.0442 31.3205 176.4091 16 V 3.5816 8.2094 125.6981 66.4568 31.7701 178.4613 17 T 3.6761 7.9378 115.0229 66.7353 68.2122 176.5863 18 S 4.0623 7.9246 116.4817 61.7248 63.0635 176.5706 19 R 4.5724 8.0873 122.6351 58.6718 29.6988 178.4293 20 L 3.8884 8.8574 121.6662 57.8799 41.9079 178.6847 21 L 3.8608 7.9814 119.2220 57.6093 41.6290 179.2743 22 L 4.1790 7.9692 119.6892 59.1445 40.2815 179.6942 23 G 3.5686 8.1801 107.1016 46.7791 0.0000 175.2777 24 D 4.1907 8.4376 120.4469 57.0892 41.1168 178.0829 25 A 3.8851 8.4817 120.9108 55.3500 18.7136 179.4705 26 L 4.0402 8.2905 117.4999 57.4726 41.5199 179.7593 27 Q 4.1527 7.6034 118.3747 59.1942 28.5447 178.7004 28 Q 4.1437 8.0212 116.5399 57.6439 28.4763 177.3587 29 L 4.3886 8.0396 121.0954 54.2136 42.1725 176.8209 30 G 4.0322 7.3864 106.2377 49.1945 0.0000 176.0689 31 F 3.5497 8.5183 103.9700 54.1181 38.9986 175.1215 32 K 4.5165 8.5065 118.2783 56.3326 40.3500 175.2657 33 Q 4.5618 7.8703 117.5012 54.7517 33.4385 172.8794 34 I 4.7993 8.9589 118.6820 60.2296 38.9595 175.2719 35 T 4.6940 8.9970 124.3679 61.5246 71.2380 173.1069 36 A 5.1214 8.6849 127.4846 50.0879 22.3232 175.0155 37 A 3.9516 8.6527 121.9347 53.5132 22.4048 179.2886 38 G 3.8380 9.4003 108.7379 45.4402 0.0000 175.0560 39 D 4.6314 6.4970 121.7371 51.5757 46.0406 175.8583 40 G 4.4971 8.8987 106.6073 48.2543 0.0000 175.4759 41 E 3.9100 8.0425 120.1558 59.2118 29.8114 178.9669 42 Q 4.0606 8.0833 119.1272 59.3088 29.1173 178.5011 43 G 3.6506 9.9006 106.2382 47.3356 0.0000 175.6066 44 M 3.9710 7.9919 121.1738 58.4859 32.2858 178.4417 45 K 3.9342 8.0624 119.0508 60.1533 32.6500 179.2594 46 I 3.7005 7.6543 120.1180 63.9196 37.2396 177.8992 47 M 4.1101 8.1823 119.3201 58.4175 31.9325 178.1568 48 A 4.0000 8.2246 119.9893 55.3830 18.7159 179.2788 49 Q 4.1094 8.3895 115.4995 58.6618 29.0457 176.0872 50 N 5.1316 7.7831 115.2096 50.5367 42.6194 171.7699 51 P 4.7268 0.0000 0.0000 63.8374 32.1537 175.3736 52 H 4.8352 8.2848 114.3602 55.6577 30.8435 173.2708 53 H 4.8559 10.7062 116.7826 56.3424 32.8626 172.2171 54 L 4.7265 7.7694 115.7643 53.7770 46.2374 174.5816 55 V 4.8469 9.8566 124.4421 61.0852 33.9017 173.2519 56 I 5.1832 9.2448 121.7454 58.9418 39.3133 174.9330 57 S 5.5014 8.7343 118.8874 56.7036 67.2892 172.1645 58 D 4.7050 7.9912 119.4514 52.4866 43.2152 176.1131 59 F 4.9445 7.8288 113.1521 56.6168 37.6262 176.1017 60 N 4.4124 7.9015 118.1687 55.9293 38.8449 175.4595 61 M 4.7561 7.5213 119.4803 53.3590 31.9337 173.9372 62 P 4.9870 0.0000 0.0000 62.8935 32.6687 177.0323 63 K 4.1464 8.5346 120.2702 58.7975 32.5813 177.1822 64 M 4.5306 7.4645 117.8836 52.7427 32.4263 173.6156 65 D 5.0371 8.2916 124.1497 52.7023 44.1035 175.9824 66 G 4.0312 8.3888 106.7767 48.0193 0.0000 175.5727 67 L 4.0399 8.0207 121.6817 57.1287 41.7827 179.6765 68 G 3.6587 7.9732 104.9583 47.8775 0.0000 175.4655 69 L 3.7775 8.2752 121.7225 57.1435 41.5568 179.2313 70 L 3.3739 7.2926 120.2930 58.2192 41.7693 179.1066 71 Q 3.9724 8.0620 116.7502 58.7709 28.8654 178.5261 72 A 4.0817 7.7246 121.7839 55.2615 18.4605 179.9471 73 V 3.9269 8.0226 112.6549 64.1165 31.4022 178.9577 74 R 4.0169 7.8866 116.3390 58.4042 29.8894 177.8842 75 A 4.6753 8.2771 119.3232 51.1737 19.9666 176.1474 76 N 4.8281 7.7556 116.1858 51.1373 40.4412 172.9280 77 P 4.4963 0.0000 0.0000 63.9543 32.0236 178.1499 78 A 3.9762 7.9789 122.2804 54.9066 18.7279 178.0156 79 T 4.4552 7.7927 108.0552 61.6975 67.6680 175.6678 80 K 4.3213 7.6594 118.9317 58.7713 32.8230 177.6291 81 K 4.5249 8.2139 116.6380 55.6606 33.0386 175.1421 82 A 4.4572 7.7397 122.1305 50.7439 20.2761 176.9047 83 A 3.6972 7.9399 125.3781 50.8726 20.2561 176.4163 84 F 5.1873 7.1568 121.7265 56.5103 41.7655 175.1138 85 I 5.0729 10.1415 121.8204 59.6970 40.5478 174.6008 86 I 4.6780 8.6829 126.3704 59.1694 40.3297 174.1459 87 L 4.6135 7.7963 127.9235 54.8028 40.6630 176.0857 88 T 5.0474 8.2840 115.6428 60.8428 70.4971 172.6201 89 A 4.4441 8.4969 125.7563 53.2010 18.5163 178.0901 90 Q 4.3324 7.5519 117.7110 58.7441 31.3836 177.0993 91 G 3.9948 7.3012 100.2546 46.4131 0.0000 170.7616 92 D 4.8258 7.5586 118.8058 52.1069 44.1169 177.1750 93 R 3.9619 8.8056 124.3907 59.0590 29.8114 178.2363 94 A 3.9696 7.9176 120.3138 55.3415 18.4508 179.4449 95 L 3.9910 7.9463 117.5594 57.6806 41.6224 179.9431 96 V 3.6020 7.6378 117.8369 66.2964 31.5388 178.0641 97 Q 4.1671 8.6162 118.0786 58.3592 28.2547 178.4914 98 K 3.8902 8.1337 120.4524 59.4879 32.5370 178.5121 99 A 4.1271 8.4059 121.0039 55.2352 18.2555 179.3674 100 A 3.8876 8.3699 119.0252 54.8353 18.1701 178.3596 101 A 4.4255 8.0336 117.9793 53.3174 19.7498 179.0738 102 L 4.1185 7.9001 117.5410 56.5602 42.2459 177.1765 103 G 3.9463 7.2355 115.1783 45.6607 0.0000 173.3589 104 A 4.4108 7.7686 123.3940 52.8665 18.5923 177.0237 105 N 4.3844 9.1012 119.4633 56.1645 39.6556 174.6685 106 N 4.4655 6.4627 112.0621 52.6318 42.4778 173.2299 107 V 5.4758 8.5318 125.9006 60.4240 33.7335 174.3002 108 L 4.9848 8.4876 126.7989 52.8482 45.6275 175.7170 109 A 4.8216 8.5231 122.4539 51.1230 20.7542 177.5112 110 K 4.4785 8.3616 121.9424 53.9826 30.1931 174.0776 111 P 4.5861 0.0000 0.0000 61.6742 32.4673 178.0301 112 F 3.9073 8.7120 121.0268 60.3101 39.9103 176.1445 113 T 4.4742 7.3717 118.0306 62.9598 70.4723 175.7901 114 I 3.8854 8.2539 118.5092 63.6793 37.9446 178.2726 115 E 3.9392 8.0733 120.9441 59.1985 29.6190 178.8029 116 K 4.0057 7.9282 118.0054 59.5776 32.2795 178.9376 117 M 4.0215 8.4299 118.9589 58.5847 32.1413 178.2396 118 K 3.9414 8.9144 120.5239 59.1107 32.3243 178.8438 119 A 3.9538 7.8988 120.8673 54.8968 18.3535 179.2805 120 A 3.9611 8.5500 119.8833 55.3479 18.5174 179.8658 121 I 3.7522 7.9609 111.5694 64.4653 37.6801 178.1703 122 E 4.2056 8.6441 120.6943 58.6169 29.1136 179.1442 123 A 4.1900 8.0454 120.9621 54.6124 18.8952 179.8794 124 V 3.5220 8.2456 116.8799 64.6228 31.3429 178.3776 125 F 4.2799 8.7693 118.0959 60.3227 39.2051 177.8053 126 G 3.5915 8.4202 103.8507 46.3905 0.0000 173.8516 127 A 3.6997 7.8248 121.9500 52.1853 16.2714 175.4318 128 L 4.3555 7.5215 123.5120 54.0785 43.9167 176.4187 129 K 4.2197 8.7335 124.1920 57.0394 32.2298 174.3267 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 4.45 0.00 2.02 1.86 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 2 S 9.31 4.27 0.00 3.89 3.86 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 3 L 7.91 4.37 0.00 1.62 1.55 0.92 1.12 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 4 A 8.80 4.10 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 5 E 8.38 4.17 0.00 2.02 1.97 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 2.34 2.27 0.00 6 K 7.13 4.05 0.00 1.89 2.09 0.00 1.53 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.34 1.32 7.81 7 I 7.41 4.36 1.85 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.78 0.92 0.00 0.00 8 K 8.29 4.70 0.00 1.86 1.69 0.00 1.76 0.00 0.00 1.95 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.41 7.81 9 V 8.68 4.54 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.21 0.00 0.00 10 L 9.26 5.19 0.00 1.69 1.78 0.94 1.10 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 11 I 8.91 5.68 1.80 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 0.79 0.33 0.86 0.00 0.00 12 V 8.29 4.55 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 0.84 0.00 0.00 1.01 0.00 0.00 13 D 8.47 4.97 0.00 2.78 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.08 4.25 0.00 2.65 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 15 Q 7.79 4.42 0.00 2.43 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.74 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 16 V 8.21 3.58 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 0.97 0.00 0.00 0.93 0.00 0.00 17 T 7.94 3.68 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 1.26 0.00 0.00 18 S 7.92 4.06 0.00 4.01 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 0.00 19 R 8.09 4.57 0.00 2.04 2.08 0.00 3.43 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 20 L 8.86 3.89 0.00 1.65 1.87 0.91 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 21 L 7.98 3.86 0.00 1.86 1.51 1.02 0.18 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 22 L 7.97 4.18 0.00 1.80 1.83 0.88 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.18 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 0.00 0.00 0.00 24 D 8.44 4.19 0.00 2.89 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 25 A 8.48 3.89 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 26 L 8.29 4.04 0.00 1.44 1.23 1.02 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 7.60 4.15 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.97 0.00 0.00 0.00 0.00 0.00 2.26 2.50 0.00 28 Q 8.02 4.14 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 29 L 8.04 4.39 0.00 1.77 1.89 0.74 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 30 G 7.39 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 0.00 0.00 0.00 31 F 8.52 3.55 0.00 3.37 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 32 K 8.51 4.52 0.00 1.82 1.88 0.00 1.79 0.00 0.00 1.81 0.00 0.00 3.23 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.51 1.46 7.81 33 Q 7.87 4.56 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.73 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 34 I 8.96 4.80 1.93 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.80 0.50 0.00 0.00 35 T 9.00 4.69 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 1.22 0.00 0.00 36 A 8.68 5.12 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 37 A 8.65 3.95 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 38 G 9.40 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 39 D 6.50 4.63 0.00 2.68 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.90 4.50 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 0.00 0.00 0.00 41 E 8.04 3.91 0.00 2.01 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 2.37 2.42 0.00 42 Q 8.08 4.06 0.00 2.13 2.30 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 2.42 2.43 0.00 43 G 9.90 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 44 M 7.99 3.97 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 45 K 8.06 3.93 0.00 2.03 2.03 0.00 1.36 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.62 1.47 7.81 46 I 7.65 3.70 2.00 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 1.40 0.41 0.91 0.00 0.00 47 M 8.18 4.11 0.00 2.16 1.98 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 1.75 0.00 48 A 8.22 4.00 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 49 Q 8.39 4.11 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.59 0.00 0.00 0.00 0.00 0.00 2.44 2.57 0.00 50 N 7.78 5.13 0.00 2.70 2.73 0.00 0.00 7.03 8.07 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 51 P 0.00 4.73 0.00 2.08 2.05 0.00 3.82 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 52 H 8.28 4.84 0.00 3.24 3.27 0.00 5.51 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 H 10.71 4.86 0.00 3.16 3.11 0.00 5.80 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 7.77 4.73 0.00 1.61 1.50 0.78 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 55 V 9.86 4.85 2.49 0.00 0.00 0.00 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 1.15 0.00 0.00 56 I 9.24 5.18 1.85 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.60 0.91 0.00 0.00 57 S 8.73 5.50 0.00 3.99 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 58 D 7.99 4.71 0.00 2.75 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 59 F 7.83 4.94 0.00 2.99 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 60 N 7.90 4.41 0.00 2.81 2.82 0.00 0.00 7.02 7.72 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 61 M 7.52 4.76 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.67 0.00 62 P 0.00 4.99 0.00 2.20 2.23 0.00 3.42 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.15 0.00 63 K 8.53 4.15 0.00 1.76 2.11 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.44 1.36 7.81 64 M 7.46 4.53 0.00 2.03 1.88 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 65 D 8.29 5.04 0.00 2.84 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 66 G 8.39 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 0.00 0.00 0.00 67 L 8.02 4.04 0.00 1.68 1.72 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 68 G 7.97 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 69 L 8.28 3.78 0.00 1.32 1.19 0.90 0.75 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 70 L 7.29 3.37 0.00 1.59 1.71 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.06 3.97 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 72 A 7.72 4.08 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 73 V 8.02 3.93 2.31 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 0.97 0.00 0.00 1.04 0.00 0.00 74 R 7.89 4.02 0.00 2.02 2.00 0.00 3.16 0.00 0.00 3.23 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 75 A 8.28 4.68 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 76 N 7.76 4.83 0.00 2.78 2.67 0.00 0.00 6.83 7.88 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 77 P 0.00 4.50 0.00 2.27 2.29 0.00 3.76 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 78 A 7.98 3.98 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 79 T 7.79 4.46 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 1.34 0.00 0.00 80 K 7.66 4.32 0.00 1.95 2.10 0.00 1.52 0.00 0.00 1.77 0.00 0.00 3.18 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.51 7.81 81 K 8.21 4.52 0.00 1.85 1.91 0.00 1.14 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.35 7.81 82 A 7.74 4.46 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 83 A 7.94 3.70 0.95 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 84 F 7.16 5.19 0.00 2.98 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 85 I 10.14 5.07 1.87 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 1.07 0.71 0.92 0.00 0.00 86 I 8.68 4.68 1.92 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 1.37 1.33 0.95 0.00 0.00 87 L 7.80 4.61 0.00 1.74 1.53 -0.02 0.84 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 88 T 8.28 5.05 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 1.29 0.00 0.00 89 A 8.50 4.44 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 90 Q 7.55 4.33 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.38 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 91 G 7.30 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 0.00 0.00 0.00 92 D 7.56 4.83 0.00 2.68 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 93 R 8.81 3.96 0.00 1.93 1.95 0.00 3.24 0.00 0.00 3.35 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 94 A 7.92 3.97 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 95 L 7.95 3.99 0.00 1.94 1.75 0.94 0.91 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 96 V 7.64 3.60 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 1.21 0.00 0.00 0.98 0.00 0.00 97 Q 8.62 4.17 0.00 2.25 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 98 K 8.13 3.89 0.00 1.95 1.97 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.47 7.81 99 A 8.41 4.13 1.42 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 0.00 100 A 8.37 3.89 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 0.00 101 A 8.03 4.43 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 0.00 102 L 7.90 4.12 0.00 1.91 1.89 0.93 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 103 G 7.24 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 0.00 104 A 7.77 4.41 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.10 4.38 0.00 2.90 2.44 0.00 0.00 6.24 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 N 6.46 4.47 0.00 2.43 2.32 0.00 0.00 6.45 7.64 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 0.00 107 V 8.53 5.48 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 0.94 0.00 0.00 1.03 0.00 0.00 108 L 8.49 4.98 0.00 1.58 1.50 0.87 0.70 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 0.00 109 A 8.52 4.82 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 0.00 110 K 8.36 4.48 0.00 1.70 1.65 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.25 1.32 7.81 111 P 0.00 4.59 0.00 2.30 2.20 0.00 3.70 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.97 0.00 112 F 8.71 3.91 0.00 3.01 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 T 7.37 4.47 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 1.26 0.00 0.00 114 I 8.25 3.89 1.86 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 1.53 0.83 0.88 0.00 0.00 115 E 8.07 3.94 0.00 2.07 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 2.38 2.41 0.00 116 K 7.93 4.01 0.00 1.86 1.85 0.00 1.76 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.51 7.81 117 M 8.43 4.02 0.00 2.07 2.28 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.54 0.00 118 K 8.91 3.94 0.00 1.84 1.83 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.61 1.43 7.81 119 A 7.90 3.95 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.55 3.96 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 0.00 121 I 7.96 3.75 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 1.56 0.83 1.02 0.00 0.00 122 E 8.64 4.21 0.00 2.27 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 0.00 2.30 2.48 0.00 123 A 8.05 4.19 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 0.00 124 V 8.25 3.52 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 1.00 0.00 0.00 0.81 0.00 0.00 125 F 8.77 4.28 0.00 3.19 3.10 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 0.00 0.00 0.00 0.00 126 G 8.42 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 0.00 127 A 7.82 3.70 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 0.00 128 L 7.52 4.36 0.00 1.62 1.58 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 129 K 8.73 4.22 0.00 1.85 1.73 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.41 7.81