NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4155 8.2649 123.5883 51.5734 20.9189 175.9275 2 K 4.2951 7.4949 113.8253 54.2948 34.7961 174.3802 3 K 4.0643 8.5703 124.4038 56.8205 32.2105 177.5515 4 V 3.7987 8.3447 126.8829 61.8485 31.4858 175.5614 5 Q 4.4887 8.6000 124.8913 53.2374 31.9014 174.1531 6 A 4.1395 8.2980 121.5558 52.6951 18.8575 176.0651 7 Y 5.0474 7.7630 118.2059 56.7541 41.4747 174.5148 8 V 4.6782 9.0799 113.5927 59.3266 35.1114 174.9451 9 K 5.1735 8.3513 123.0616 55.2624 35.0796 175.1186 10 L 4.4856 8.4106 120.5850 55.0427 44.1893 173.6160 11 Q 4.8766 8.7464 119.4432 55.0580 29.8004 174.9465 12 V 4.5250 8.0547 117.0753 58.7336 34.8775 175.7373 13 A 4.2932 8.7762 125.8156 52.0869 18.3966 176.7759 14 A 3.9308 8.2415 121.2014 53.6267 18.7040 179.2334 15 G 3.9458 7.6293 107.6694 41.0000 0.0000 171.7943 16 M 4.1687 7.7379 119.3617 55.7622 35.1166 173.8032 17 A 4.2414 8.5157 126.9873 52.2262 21.8717 175.0304 18 N 4.6312 9.0445 116.9571 52.8158 38.1573 172.9042 19 P 4.3552 0.0000 0.0000 62.7436 31.9669 176.6072 20 S 4.0063 8.7508 116.9722 61.3053 62.5308 173.4809 21 P 4.3590 0.0000 0.0000 65.3814 31.0411 175.9922 22 P 4.4332 0.0000 0.0000 65.1121 33.0464 178.1047 23 V 4.2381 7.8188 107.0602 60.0394 32.9834 181.9599 24 G 3.8904 9.5373 121.9368 46.5353 0.0000 173.2092 25 P 4.1353 0.0000 0.0000 66.0438 31.1953 175.9145 26 A 3.9329 7.8873 118.3846 55.1788 18.5318 178.8120 27 L 4.2537 7.5591 115.7069 56.6758 41.3791 178.9913 28 G 3.6282 8.5154 107.7507 47.9227 0.0000 175.6894 29 Q 4.0184 7.5677 119.7068 58.9942 28.8023 178.6112 30 Q 4.1596 7.6615 117.4673 57.2392 28.6447 177.3268 31 G 3.9969 7.6881 108.1234 45.3733 0.0000 173.9356 32 V 3.8759 7.4242 117.8977 62.4988 32.3048 176.7495 33 N 4.8337 8.8667 123.1734 51.3384 37.1421 175.6913 34 I 3.7131 8.0455 125.8554 64.6960 37.1150 176.6929 35 M 4.0122 8.2245 118.0180 58.8646 31.8655 177.7309 36 E 4.0318 8.2857 118.5880 59.2378 29.7174 178.2930 37 F 4.3622 8.7601 120.9646 61.4570 39.3652 176.4557 38 C 4.0073 8.4586 114.6216 61.6231 28.9043 175.9929 39 K 3.9772 7.8574 121.4139 58.6179 31.6619 178.7638 40 A 4.1131 8.3372 121.6822 55.3244 18.3671 178.9870 41 F 4.1921 8.8902 120.2992 61.3767 39.4426 176.8122 42 N 3.9876 8.2200 115.8186 56.3376 38.1655 176.9031 43 A 4.0098 7.3651 121.2332 55.3566 18.8019 179.2479 44 K 4.0384 7.7243 116.4870 59.0238 32.3255 179.2734 45 T 3.6528 7.6341 116.3962 66.3665 67.9200 176.1921 46 D 4.2790 7.5311 119.7378 57.2977 40.9165 178.5498 47 S 4.1816 7.8021 111.7642 61.4470 62.6300 175.5143 48 I 3.8056 7.5241 121.2636 61.1603 37.2659 176.0692 49 E 5.0766 7.3286 115.9225 55.9888 32.3727 176.1760 50 K 4.4786 8.8100 122.2521 55.7496 34.3719 176.7786 51 G 3.9638 9.0147 109.7535 45.0303 0.0000 173.2405 52 L 4.6220 7.3745 119.0831 51.8590 43.5121 174.1893 53 P 4.3836 0.0000 0.0000 63.2046 31.8241 175.7496 54 I 4.6703 8.2212 125.9047 58.6228 39.1231 173.8395 55 P 4.7970 0.0000 0.0000 62.5822 32.6949 175.5907 56 V 4.8905 9.0936 123.9154 59.8330 35.1372 175.0193 57 V 4.1730 8.0931 121.9171 61.3863 32.7442 174.2898 58 I 4.4180 8.4522 130.2205 61.0845 38.4689 175.3385 59 T 4.7451 9.3377 125.2527 61.8599 70.1300 173.7458 60 V 4.4117 7.7928 126.3457 62.1947 31.9706 175.0267 61 Y 4.8500 8.5138 124.0836 55.8810 40.6548 176.6237 62 A 4.2549 8.6160 122.2792 55.6929 18.7534 178.6112 63 D 4.4827 7.9695 112.3426 54.2361 40.4932 176.7527 64 R 3.7647 7.8718 112.4141 57.0069 29.3007 175.9641 65 S 4.7335 7.9681 113.9841 58.7192 64.6891 172.1013 66 F 5.5526 7.6690 113.3462 57.7332 40.0484 172.4835 67 T 5.2838 8.2046 113.3571 61.0603 71.5451 171.8525 68 F 5.9109 8.3637 116.5635 56.6180 40.4024 173.4298 69 V 4.2617 8.4859 121.5423 61.5607 33.6998 174.2999 70 T 4.5353 8.6067 125.1795 62.9308 69.0190 174.5450 71 K 4.5361 7.9260 128.7177 55.1076 34.3852 176.5649 72 T 4.3813 8.6200 109.8017 60.5083 69.8851 172.5655 73 P 4.3475 0.0000 0.0000 61.9447 32.1987 174.9797 74 P 4.3515 0.0000 0.0000 63.1201 33.4223 177.5220 75 A 4.0717 8.5361 120.8851 54.9785 18.4035 180.2093 76 A 3.9561 7.8929 119.2018 55.4781 18.5952 180.1410 77 V 3.6152 7.7081 110.5027 64.5479 31.7230 178.7113 78 L 4.0653 7.8633 118.2851 57.6551 41.3380 179.5146 79 L 4.1044 7.9026 118.6669 57.3198 41.5582 179.6005 80 K 3.9984 7.9600 118.9212 59.2605 32.1525 179.5365 81 K 4.0026 8.0879 118.9592 59.9409 32.3692 179.1000 82 A 3.9904 7.9027 120.9200 54.7191 18.3911 179.0343 83 A 4.1924 8.3348 118.2994 52.8355 18.6999 178.7500 84 G 3.8237 7.7000 104.5825 45.6022 0.0000 173.4074 85 I 4.3620 7.4279 112.7085 59.2889 39.6345 175.6956 86 K 4.2512 8.5122 119.3434 57.7399 32.8128 176.6099 87 S 4.8159 7.6036 111.5432 56.0392 66.7820 173.7262 88 G 3.8935 8.2165 109.1718 45.7313 0.0000 172.7449 89 S 4.2363 7.9696 111.8540 58.6703 62.9190 175.2572 90 G 4.3616 8.9034 109.0930 45.0025 0.0000 173.7496 91 K 4.6146 7.2373 116.4556 54.0263 32.3409 173.6029 92 P 4.2601 0.0000 0.0000 64.5132 32.5960 176.9632 93 N 4.6787 8.9929 122.3433 54.6623 37.7837 176.2746 94 K 4.0857 8.0614 115.7589 58.7814 32.3415 176.5193 95 D 4.7584 7.7469 115.9264 52.0760 43.5401 174.8120 96 K 4.4600 8.6438 126.2951 55.9451 32.8132 176.7811 97 V 3.9285 8.1449 124.8385 65.1426 32.5084 175.3456 98 G 4.3418 7.6360 105.8123 45.3566 0.0000 171.7102 99 K 5.1612 8.3867 117.5880 55.4080 36.1226 175.8925 100 I 4.7979 8.9406 121.6468 59.4275 41.6188 175.4484 101 S 4.6740 8.5602 120.4451 57.8467 63.9238 175.3840 102 R 3.9179 8.5806 122.3348 59.3634 29.5935 179.0160 103 A 3.9814 7.9152 120.3235 55.3249 18.4958 179.4129 104 Q 4.5463 7.8667 117.5318 58.5809 28.7485 178.7871 105 L 3.9895 7.9942 119.5727 57.9677 41.5670 179.2926 106 Q 3.9393 7.9464 118.6639 59.1625 29.1644 177.8259 107 E 4.7825 7.9022 120.8831 59.2482 29.6210 179.5349 108 I 3.7239 8.2482 119.6164 64.4464 36.9024 178.4355 109 A 4.0560 7.9016 120.8296 55.0067 18.3411 179.5053 110 Q 4.0847 8.2554 117.0392 59.3263 28.5978 178.8345 111 T 3.8626 7.7709 115.5256 66.6039 68.8537 176.2912 112 K 4.2888 8.4163 119.1359 56.1893 32.0590 178.4887 113 A 3.9497 7.5021 121.5023 55.4489 18.2068 179.2894 114 A 4.0790 7.9111 117.6563 55.3971 18.6713 178.9272 115 D 4.5107 7.9422 114.6618 55.3335 41.6674 177.0771 116 M 4.3455 7.5678 119.5187 55.2635 32.5823 176.4021 117 T 4.2991 8.3262 110.5677 61.4140 69.9461 175.3329 118 G 3.7956 8.1208 110.9401 46.3920 0.0000 173.4454 119 A 4.1102 8.7014 126.9545 54.2833 19.1155 177.2029 120 D 5.0497 7.5989 113.4741 51.7013 46.1225 176.8347 121 I 3.7483 8.1528 120.6572 64.6340 37.0268 178.5564 122 E 3.9295 8.1966 118.7523 59.3107 29.3376 178.8417 123 A 3.9787 8.0157 120.4067 55.5522 18.5423 179.2238 124 M 4.0065 7.9560 114.7709 59.0196 31.0455 178.8758 125 T 3.8778 7.9274 116.5250 66.4869 68.4064 176.7700 126 R 4.7802 7.7186 120.1617 58.9456 30.3096 179.0140 127 S 4.2794 8.1010 114.8977 61.7220 62.8828 176.7944 128 I 3.7634 7.8894 122.4389 64.3571 36.7589 178.3021 129 E 4.0993 8.2746 119.7492 59.3546 29.0418 179.5326 130 G 3.6859 7.6642 104.7950 47.9581 0.0000 175.5312 131 T 4.0530 7.8686 111.3654 64.4570 68.9058 176.5520 132 A 3.9900 7.8598 123.1724 55.0982 18.2643 179.8313 133 R 3.8605 7.9724 115.2306 59.3478 30.1696 178.8968 134 S 4.4602 7.6384 113.1238 59.6564 62.9381 174.6849 135 M 4.4638 7.6432 117.9365 54.4078 31.4721 176.2443 136 G 3.6024 8.1030 106.7033 46.9601 0.0000 173.0714 137 L 5.1624 7.8987 120.2768 51.7019 43.2565 177.0221 138 V 3.9937 8.3296 124.2190 62.6053 33.2833 174.8042 139 V 5.4644 8.1589 117.4128 58.8685 34.3933 174.7098 140 E 4.4192 8.7018 126.1501 54.7907 31.0547 175.5835 141 D 4.5234 8.6071 126.0819 54.5791 41.1147 176.4816 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 A 8.26 4.42 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 2 K 7.49 4.30 0.00 1.81 1.72 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.50 7.81 3 K 8.57 4.06 0.00 1.75 1.81 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.46 7.81 4 V 8.34 3.80 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 0.75 0.00 0.00 0.89 0.00 0.00 5 Q 8.60 4.49 0.00 2.11 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.12 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 6 A 8.30 4.14 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 7 Y 7.76 5.05 0.00 3.02 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 8 V 9.08 4.68 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 0.64 0.00 0.00 0.73 0.00 0.00 9 K 8.35 5.17 0.00 1.77 1.91 0.00 1.66 0.00 0.00 1.87 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.42 7.81 10 L 8.41 4.49 0.00 1.70 1.68 0.79 0.54 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 11 Q 8.75 4.88 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.81 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 12 V 8.05 4.53 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 0.75 0.00 0.00 0.21 0.00 0.00 13 A 8.78 4.29 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 14 A 8.24 3.93 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 15 G 7.63 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 16 M 7.74 4.17 0.00 2.00 1.95 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 2.34 2.34 0.00 17 A 8.52 4.24 1.17 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 0.00 0.00 18 N 9.04 4.63 0.00 2.73 3.31 0.00 0.00 6.93 7.69 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 19 P 0.00 4.36 0.00 2.25 2.16 0.00 3.70 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 2.06 1.95 0.00 20 S 8.75 4.01 0.00 3.84 3.93 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 21 P 0.00 4.36 0.00 2.07 2.10 0.00 3.73 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 2.02 2.12 0.00 22 P 0.00 4.43 0.00 2.02 2.07 0.00 3.70 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 23 V 7.82 4.24 2.05 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 0.74 0.00 0.00 0.99 0.00 0.00 24 G 9.54 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.14 0.00 2.14 2.12 0.00 3.99 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 26 A 7.89 3.93 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 27 L 7.56 4.25 0.00 1.59 1.67 0.26 0.29 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 28 G 8.52 3.63 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 0.00 0.00 0.00 29 Q 7.57 4.02 0.00 1.95 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.94 0.00 0.00 0.00 0.00 0.00 2.70 2.51 0.00 30 Q 7.66 4.16 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.00 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 31 G 7.69 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 32 V 7.42 3.88 1.92 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 0.69 0.00 0.00 33 N 8.87 4.83 0.00 3.21 2.93 0.00 0.00 6.90 7.42 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 34 I 8.05 3.71 1.90 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 1.52 0.89 0.98 0.00 0.00 35 M 8.22 4.01 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.60 0.00 36 E 8.29 4.03 0.00 2.18 2.36 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 2.51 2.43 0.00 37 F 8.76 4.36 0.00 2.92 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 38 C 8.46 4.01 0.00 3.14 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 39 K 7.86 3.98 0.00 1.88 1.88 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.46 7.81 40 A 8.34 4.11 1.66 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 41 F 8.89 4.19 0.00 1.51 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.22 3.99 0.00 2.69 2.83 0.00 0.00 7.03 8.64 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 43 A 7.37 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 44 K 7.72 4.04 0.00 1.93 1.76 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.42 7.81 45 T 7.63 3.65 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 1.04 0.00 0.00 46 D 7.53 4.28 0.00 2.61 2.69 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 47 S 7.80 4.18 0.00 3.82 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 48 I 7.52 3.81 1.94 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 1.54 0.84 0.90 0.00 0.00 49 E 7.33 5.08 0.00 2.03 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 2.04 2.06 0.00 50 K 8.81 4.48 0.00 1.73 1.74 0.00 1.85 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.37 1.54 7.81 51 G 9.01 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 52 L 7.37 4.62 0.00 1.61 1.61 0.96 1.12 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 53 P 0.00 4.38 0.00 1.96 2.05 0.00 3.65 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.16 0.00 54 I 8.22 4.67 2.13 0.00 0.00 0.89 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 0.95 1.08 0.00 0.00 55 P 0.00 4.80 0.00 2.15 2.21 0.00 3.76 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 56 V 9.09 4.89 2.40 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 0.68 0.00 0.00 1.39 0.00 0.00 57 V 8.09 4.17 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 0.32 0.00 0.00 0.86 0.00 0.00 58 I 8.45 4.42 1.59 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.24 -0.36 0.33 0.00 0.00 59 T 9.34 4.75 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 1.12 0.00 0.00 60 V 7.79 4.41 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 0.82 0.00 0.00 0.84 0.00 0.00 61 Y 8.51 4.85 0.00 3.09 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 62 A 8.62 4.25 1.36 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 63 D 7.97 4.48 0.00 2.79 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 64 R 7.87 3.76 0.00 2.27 2.09 0.00 3.18 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 65 S 7.97 4.73 0.00 4.03 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 66 F 7.67 5.55 0.00 2.96 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.20 5.28 4.48 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 1.34 0.00 0.00 68 F 8.36 5.91 0.00 3.26 3.02 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 0.00 0.00 0.00 69 V 8.49 4.26 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 0.99 0.00 0.00 0.90 0.00 0.00 70 T 8.61 4.54 4.30 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 1.32 0.00 0.00 71 K 7.93 4.54 0.00 1.81 2.15 0.00 1.71 0.00 0.00 1.92 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.39 7.81 72 T 8.62 4.38 4.26 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 1.26 0.00 0.00 73 P 0.00 4.35 0.00 2.22 2.21 0.00 3.82 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 2.01 2.01 0.00 74 P 0.00 4.35 0.00 2.19 2.06 0.00 3.62 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 75 A 8.54 4.07 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 76 A 7.89 3.96 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 77 V 7.71 3.62 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 0.87 0.00 0.00 1.01 0.00 0.00 78 L 7.86 4.07 0.00 1.71 1.72 0.97 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.90 4.10 0.00 1.90 1.71 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 80 K 7.96 4.00 0.00 2.01 2.02 0.00 1.87 0.00 0.00 1.70 0.00 0.00 3.18 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.78 7.81 81 K 8.09 4.00 0.00 2.01 2.07 0.00 1.32 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.60 1.60 7.81 82 A 7.90 3.99 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 83 A 8.33 4.19 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 84 G 7.70 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 85 I 7.43 4.36 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 1.41 0.70 0.91 0.00 0.00 86 K 8.51 4.25 0.00 1.76 1.89 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.44 7.81 87 S 7.60 4.82 0.00 3.80 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.22 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.97 4.24 0.00 3.99 3.89 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.90 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 91 K 7.24 4.61 0.00 1.88 1.90 0.00 1.55 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.43 7.81 92 P 0.00 4.26 0.00 2.06 2.27 0.00 3.79 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 2.07 2.14 0.00 93 N 8.99 4.68 0.00 2.88 2.98 0.00 0.00 7.01 7.61 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 94 K 8.06 4.09 0.00 1.97 1.87 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.59 7.81 95 D 7.75 4.76 0.00 2.59 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 K 8.64 4.46 0.00 1.76 1.74 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.48 7.81 97 V 8.14 3.93 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 0.72 0.00 0.00 0.98 0.00 0.00 98 G 7.64 4.34 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 0.00 99 K 8.39 5.16 0.00 1.77 1.73 0.00 1.52 0.00 0.00 1.70 0.00 0.00 2.71 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.29 1.46 7.81 100 I 8.94 4.80 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 1.29 1.05 0.98 0.00 0.00 101 S 8.56 4.67 0.00 4.08 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 0.00 102 R 8.58 3.92 0.00 2.13 1.98 0.00 3.10 0.00 0.00 3.35 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 103 A 7.92 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 0.00 104 Q 7.87 4.55 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.69 0.00 0.00 0.00 0.00 0.00 2.56 2.26 0.00 105 L 7.99 3.99 0.00 1.87 1.74 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 7.95 3.94 0.00 2.14 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 107 E 7.90 4.78 0.00 2.22 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 2.34 2.42 0.00 108 I 8.25 3.72 2.00 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 1.46 1.08 0.92 0.00 0.00 109 A 7.90 4.06 1.36 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 0.00 110 Q 8.26 4.08 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.70 0.00 111 T 7.77 3.86 4.39 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 1.22 0.00 0.00 112 K 8.42 4.29 0.00 1.82 1.84 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.41 7.81 113 A 7.50 3.95 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 0.00 114 A 7.91 4.08 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 0.00 115 D 7.94 4.51 0.00 2.67 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 0.00 116 M 7.57 4.35 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.48 0.00 117 T 8.33 4.30 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 0.00 118 G 8.12 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 0.00 119 A 8.70 4.11 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 0.00 120 D 7.60 5.05 0.00 2.64 2.69 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 0.00 121 I 8.15 3.75 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 1.64 0.69 0.91 0.00 0.00 122 E 8.20 3.93 0.00 2.05 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 2.40 2.44 0.00 123 A 8.02 3.98 1.36 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 0.00 124 M 7.96 4.01 0.00 2.30 2.36 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.78 0.00 125 T 7.93 3.88 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 1.21 0.00 0.00 126 R 7.72 4.78 0.00 1.92 2.00 0.00 3.13 0.00 0.00 3.08 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.83 0.00 127 S 8.10 4.28 0.00 4.07 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 0.00 128 I 7.89 3.76 2.02 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 1.85 1.25 0.92 0.00 0.00 129 E 8.27 4.10 0.00 2.25 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 2.33 2.64 0.00 130 G 7.66 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 0.00 0.00 0.00 131 T 7.87 4.05 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 0.00 132 A 7.86 3.99 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 0.00 133 R 7.97 3.86 0.00 1.94 2.02 0.00 3.16 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.83 0.00 134 S 7.64 4.46 0.00 3.99 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 0.00 135 M 7.64 4.46 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.71 0.00 136 G 8.10 3.60 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 0.00 137 L 7.90 5.16 0.00 1.51 1.61 0.95 1.00 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 0.00 138 V 8.33 3.99 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 0.89 0.00 0.00 0.93 0.00 0.00 139 V 8.16 5.46 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 0.88 0.00 0.00 0.93 0.00 0.00 140 E 8.70 4.42 0.00 2.09 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 2.30 2.38 0.00 141 D 8.61 4.52 0.00 2.70 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