NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 A 4.2300 8.2531 123.5697 50.8209 20.5275 176.6480 16 G 3.9911 8.0575 102.6796 45.8032 0.0000 173.6970 17 I 4.0166 7.9462 121.0033 63.5504 38.5679 175.2031 18 T 4.0499 7.5142 116.6014 63.7466 69.2870 173.9568 19 G 3.5347 7.6809 111.5859 44.7201 0.0000 171.7629 20 T 4.6656 7.6995 117.3915 61.5124 70.6270 174.3431 21 W 4.7840 8.0663 124.6031 54.8981 33.4562 173.9313 22 Y 5.4001 9.2248 120.2919 56.4071 41.6100 174.8078 23 N 5.5383 9.1219 120.5876 50.4726 39.7011 174.6800 24 Q 4.1944 8.5707 115.4762 58.8282 29.1709 177.3986 25 L 4.2909 7.9603 115.6277 55.1896 41.4831 177.4604 26 G 4.0195 8.4080 108.2912 45.1414 0.0000 173.6930 27 S 4.8741 9.0831 116.2527 57.8776 65.1744 173.3179 28 T 5.1482 8.6281 117.8395 61.7654 72.6124 173.1619 29 F 5.1651 8.5891 119.4381 55.1663 41.5696 173.3374 30 I 4.7805 8.7893 123.8455 59.5108 39.1825 175.0601 31 V 4.8990 8.8296 126.3338 60.0986 35.2510 174.5168 32 T 4.7781 8.9166 118.7479 61.7430 71.5692 172.7701 33 A 4.7746 8.5140 128.7509 50.2827 20.1876 177.2048 34 G 3.8885 9.6261 112.8099 44.8186 0.0000 174.5313 35 A 4.0895 8.5252 123.9153 54.7949 18.5768 178.4432 36 D 4.5071 8.0313 112.9470 53.7881 39.7948 177.1813 37 G 3.3518 8.2314 108.9101 44.7977 0.0000 173.2491 38 A 4.7559 8.4627 122.7244 51.6422 20.0076 176.5176 39 L 5.2286 8.9026 122.2283 53.1463 44.3775 175.8725 40 T 4.9064 8.8954 113.4838 59.7809 72.6595 174.4808 41 G 3.7583 7.3364 108.7929 46.5402 0.0000 171.1778 42 T 5.1374 7.9605 116.0261 62.0679 73.0049 172.4820 43 Y 4.9593 9.3650 127.4654 56.1527 41.2162 174.2881 44 I 5.0622 8.8237 127.3003 59.2694 40.3361 175.5774 45 G 4.3609 9.4353 114.9741 45.8057 0.0000 173.4411 46 A 4.4347 8.9017 122.0108 54.5616 18.4441 179.0414 47 R 3.9370 8.2218 114.5077 59.1411 29.9683 177.7228 48 G 3.9613 8.1125 104.4639 44.9178 0.0000 172.7999 49 N 4.6879 7.6812 116.9345 50.8877 39.6493 175.6176 50 A 4.0371 8.2958 120.0813 55.2998 18.3474 179.3092 51 E 4.0050 7.8655 113.2760 58.3577 29.9322 177.4137 52 S 4.9026 8.3899 115.1758 58.2128 64.4238 173.2400 53 R 5.2316 7.6281 119.1543 55.0084 31.5448 175.5463 54 Y 4.9811 9.2558 120.4856 56.0443 42.7302 174.8323 55 V 4.3663 8.6336 122.7484 62.7882 32.5071 175.0083 56 L 5.0856 8.7498 127.5215 54.3543 43.3665 175.2015 57 T 4.8608 8.5742 114.8132 61.2588 71.4468 173.1776 58 G 4.0594 8.7253 112.9370 46.2911 0.0000 171.8462 59 R 5.6007 8.9313 117.8070 55.1285 34.9507 174.0212 60 Y 5.2944 8.5455 118.4831 55.4541 41.3721 174.3547 61 D 4.3147 9.0073 120.8938 54.0490 40.9647 176.8724 62 S 4.3426 8.2201 120.6831 58.9678 64.0341 174.4449 63 A 4.6605 8.1224 123.6145 50.0294 18.6155 173.6833 64 P 4.7067 0.0000 0.0000 60.7728 32.7127 177.1346 65 A 4.2154 8.3719 122.0735 52.8612 18.8720 177.5647 66 T 4.5338 8.2878 107.9259 61.5503 69.2771 175.2380 67 D 4.6434 8.0100 119.8190 54.1940 39.2896 177.0476 68 G 3.9681 7.7995 106.7443 45.5539 0.0000 174.3995 69 S 4.3465 8.0892 115.5658 57.9472 63.4223 174.0695 70 G 4.1857 8.2640 109.5740 46.0168 0.0000 172.9397 71 T 4.8074 8.8385 116.8445 61.6360 70.3313 174.5984 72 A 4.8751 8.6963 129.2214 52.0146 20.1927 175.8627 73 L 4.9637 8.9102 120.4207 55.4961 44.7237 173.9751 74 G 4.5711 9.1973 105.1725 45.9524 0.0000 172.1647 75 W 5.6857 8.5159 116.1087 55.7708 32.1243 173.4855 76 T 5.1948 9.3430 117.5502 61.8276 71.9964 173.1874 77 V 4.4763 8.6489 124.3119 60.8971 34.3937 173.9321 78 A 4.5430 8.2382 129.3138 49.5825 20.5623 177.3049 79 W 4.3201 8.4675 124.0210 56.6012 29.0519 176.4053 80 K 5.2881 7.9555 118.2435 54.6677 34.7718 174.4383 81 N 5.0431 8.7954 122.2699 51.8363 39.7912 174.1180 82 N 4.1350 8.4251 113.6330 55.1873 38.7854 175.1021 83 Y 4.6619 7.9300 115.0867 57.9873 40.0646 175.4619 84 R 4.4975 7.5285 114.2587 55.6523 32.3614 173.6596 85 N 5.1926 8.5421 116.9508 52.6645 40.6066 173.6902 86 A 4.3578 8.9022 128.4788 51.8364 19.5402 176.1921 87 H 4.1484 8.7661 113.3053 56.1635 26.7045 173.8069 88 S 5.2191 7.6648 111.1775 57.8077 66.9867 173.2152 89 A 4.8490 9.0250 120.7139 50.9536 22.7918 175.3297 90 T 4.8870 8.4988 118.2895 61.8289 71.5270 173.6611 91 T 4.9697 8.3612 114.9790 59.6475 71.9083 172.6433 92 W 5.0366 8.8410 125.1803 54.7947 31.9447 174.7092 93 S 4.9336 8.8706 119.2716 56.9456 64.9461 173.0625 94 G 4.5697 8.5102 113.5112 46.3349 0.0000 171.6003 95 Q 5.2964 8.5497 117.3203 54.7734 32.1215 173.6036 96 Y 4.7857 9.0125 123.1449 56.8896 40.8571 174.2523 97 V 4.2565 8.1602 125.9360 61.0964 34.3877 175.7834 98 G 3.9163 8.0874 119.1743 44.4609 0.0000 169.9690 99 G 3.7003 8.7427 104.8147 44.1202 0.0000 173.2352 100 A 4.0912 8.5461 120.4934 54.3736 19.0298 178.3414 101 E 4.6585 7.7373 114.0890 54.9554 29.3636 175.9436 102 A 4.5484 7.6078 120.5099 52.7232 19.7810 178.4827 103 R 5.2632 8.9663 115.6224 55.1965 33.8276 173.9440 104 I 4.8306 8.9515 121.2415 59.8750 39.8980 174.2841 105 N 5.3906 8.9995 125.8507 52.0324 40.4229 174.5860 106 T 5.3412 9.2337 113.2336 60.1688 73.0499 172.7085 107 Q 5.2698 9.0597 121.1874 53.9575 32.3785 174.7666 108 W 5.5032 8.4518 118.2089 54.7709 32.2236 173.8231 109 L 5.2843 8.8097 120.5385 52.9224 45.2322 175.3252 110 L 5.0034 9.2136 124.8875 53.7772 44.9054 174.9502 111 T 5.0407 8.8248 123.6399 62.0170 70.9829 173.8303 112 S 5.1725 8.5423 121.8608 56.5138 65.2524 174.3410 113 G 3.9335 8.8376 112.2181 46.4229 0.0000 172.9621 114 T 4.7825 8.2123 113.1945 59.5684 72.3517 173.0758 115 T 4.1574 8.0661 111.6529 60.8496 70.0206 175.3705 116 E 3.9573 8.7514 120.6400 59.4613 29.5425 179.5712 117 A 4.1962 8.0664 120.0788 54.2630 18.8019 177.4832 118 N 4.9802 7.9930 111.7069 52.9188 39.5366 176.5125 119 A 4.1518 8.2322 123.2014 54.0459 18.6089 180.4101 120 W 4.3519 8.4029 112.3806 58.4748 28.3021 176.8531 121 K 3.9485 6.6319 117.9047 56.1140 32.1784 177.3987 122 S 4.1663 7.7268 116.5821 60.9363 63.4603 173.4431 123 T 5.0818 7.4813 116.8298 61.7709 71.1152 173.5035 124 L 4.7219 8.9121 127.2594 53.5210 43.9138 176.2277 125 V 4.3622 7.7716 120.3153 60.2974 34.5990 174.9226 126 G 3.1751 6.2877 107.9898 45.6960 0.0000 171.2601 127 H 5.4954 8.0570 113.7845 54.2551 31.9402 172.2517 128 D 4.9056 9.2594 117.6309 53.6153 45.2727 173.8912 129 T 5.2530 8.5175 119.9119 61.8363 72.1513 172.7948 130 F 5.5696 9.5162 124.2950 56.0611 42.5230 174.4946 131 T 5.5358 9.2143 111.8108 60.0435 72.1979 174.6889 132 K 3.6927 8.7438 119.5991 57.3121 32.5784 177.6540 133 V 4.3779 7.3672 111.6123 58.8148 33.8562 175.5463 134 K 3.6374 8.0985 122.8634 56.6040 31.9058 176.5412 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 15 A 8.25 4.23 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 16 G 8.06 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 17 I 7.95 4.02 1.40 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 -0.36 0.58 0.00 0.00 18 T 7.51 4.05 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 1.18 0.00 0.00 19 G 7.68 3.53 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 20 T 7.70 4.67 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 0.66 0.00 0.00 21 W 8.07 4.78 0.00 1.78 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 22 Y 9.22 5.40 0.00 2.94 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 23 N 9.12 5.54 0.00 2.68 2.35 0.00 0.00 6.96 7.46 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 24 Q 8.57 4.19 0.00 2.29 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 7.12 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 25 L 7.96 4.29 0.00 1.73 1.79 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.41 4.02 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 0.00 0.00 0.00 27 S 9.08 4.87 0.00 4.11 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 28 T 8.63 5.15 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 0.98 0.00 0.00 29 F 8.59 5.17 0.00 2.89 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 30 I 8.79 4.78 1.82 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 1.16 0.44 0.83 0.00 0.00 31 V 8.83 4.90 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 0.80 0.00 0.00 0.71 0.00 0.00 32 T 8.92 4.78 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 1.18 0.00 0.00 33 A 8.51 4.77 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.63 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 35 A 8.53 4.09 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 36 D 8.03 4.51 0.00 2.78 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 8.23 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.46 4.76 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 39 L 8.90 5.23 0.00 1.69 1.44 1.02 0.05 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 40 T 8.90 4.91 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 1.21 0.00 0.00 41 G 7.34 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 0.00 0.00 0.00 42 T 7.96 5.14 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 1.31 0.00 0.00 43 Y 9.37 4.96 0.00 2.93 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 44 I 8.82 5.06 1.88 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 1.22 0.58 0.97 0.00 0.00 45 G 9.44 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 46 A 8.90 4.43 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.22 3.94 0.00 1.79 2.03 0.00 3.28 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 48 G 8.11 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 49 N 7.68 4.69 0.00 2.95 2.94 0.00 0.00 6.12 7.79 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 50 A 8.30 4.04 1.16 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 0.00 0.00 51 E 7.87 4.00 0.00 1.87 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 2.12 1.77 0.00 52 S 8.39 4.90 0.00 3.89 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 53 R 7.63 5.23 0.00 1.72 1.88 0.00 3.12 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 54 Y 9.26 4.98 0.00 2.92 2.75 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 0.00 0.00 0.00 55 V 8.63 4.37 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 0.95 0.00 0.00 56 L 8.75 5.09 0.00 1.69 1.64 0.48 0.08 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 57 T 8.57 4.86 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 1.23 0.00 0.00 58 G 8.73 4.06 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 0.00 0.00 0.00 59 R 8.93 5.60 0.00 1.74 1.78 0.00 3.30 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 1.58 1.73 0.00 60 Y 8.55 5.29 0.00 2.96 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 61 D 9.01 4.31 0.00 2.81 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.22 4.34 0.00 3.90 3.42 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 63 A 8.12 4.66 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.71 0.00 2.27 2.17 0.00 3.45 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 65 A 8.37 4.22 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 66 T 8.29 4.53 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 1.24 0.00 0.00 67 D 8.01 4.64 0.00 2.80 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 68 G 7.80 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 0.00 0.00 0.00 69 S 8.09 4.35 0.00 3.93 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 70 G 8.26 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 71 T 8.84 4.81 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 1.44 0.00 0.00 72 A 8.70 4.88 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 73 L 8.91 4.96 0.00 2.05 1.94 1.18 0.44 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 74 G 9.20 4.57 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 75 W 8.52 5.69 0.00 3.42 3.18 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 76 T 9.34 5.19 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 1.14 0.00 0.00 77 V 8.65 4.48 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 -0.28 0.00 0.00 0.79 0.00 0.00 78 A 8.24 4.54 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.47 4.32 0.00 3.31 2.91 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 80 K 7.96 5.29 0.00 1.89 1.70 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.42 7.81 81 N 8.80 5.04 0.00 2.85 2.80 0.00 0.00 6.74 6.40 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 82 N 8.43 4.13 0.00 1.91 1.87 0.00 0.00 6.62 7.46 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 83 Y 7.93 4.66 0.00 3.05 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 R 7.53 4.50 0.00 1.86 2.09 0.00 2.92 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 85 N 8.54 5.19 0.00 2.64 2.62 0.00 0.00 6.93 7.96 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 86 A 8.90 4.36 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 87 H 8.77 4.15 0.00 3.39 3.36 0.00 5.64 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.66 5.22 0.00 3.99 4.06 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 89 A 9.02 4.85 1.16 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 0.00 0.00 90 T 8.50 4.89 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 -0.46 0.00 0.00 91 T 8.36 4.97 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 1.14 0.00 0.00 92 W 8.84 5.04 0.00 1.78 2.18 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 93 S 8.87 4.93 0.00 3.80 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 94 G 8.51 4.57 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 95 Q 8.55 5.30 0.00 2.17 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.86 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 96 Y 9.01 4.79 0.00 3.03 2.88 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 97 V 8.16 4.26 1.98 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 0.84 0.00 0.00 0.91 0.00 0.00 98 G 8.09 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 99 G 8.74 3.70 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 0.00 0.00 0.00 100 A 8.55 4.09 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 0.00 101 E 7.74 4.66 0.00 1.96 1.93 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 2.22 2.22 0.00 102 A 7.61 4.55 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 0.00 103 R 8.97 5.26 0.00 2.12 2.15 0.00 2.77 0.00 0.00 3.38 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 104 I 8.95 4.83 1.84 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 -0.21 1.11 0.00 0.00 105 N 9.00 5.39 0.00 2.74 2.81 0.00 0.00 6.07 7.21 0.00 0.00 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 T 9.23 5.34 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 1.51 0.00 0.00 107 Q 9.06 5.27 0.00 1.95 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.75 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 108 W 8.45 5.50 0.00 2.64 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 0.00 109 L 8.81 5.28 0.00 1.53 1.52 0.87 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 110 L 9.21 5.00 0.00 1.63 1.63 0.67 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.82 5.04 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 1.19 0.00 0.00 112 S 8.54 5.17 0.00 3.69 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 0.00 113 G 8.84 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 0.00 0.00 0.00 114 T 8.21 4.78 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 1.21 0.00 0.00 115 T 8.07 4.16 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 1.21 0.00 0.00 116 E 8.75 3.96 0.00 2.07 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 2.42 2.33 0.00 117 A 8.07 4.20 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 0.00 118 N 7.99 4.98 0.00 2.68 2.71 0.00 0.00 6.71 8.97 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 0.00 119 A 8.23 4.15 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 0.00 120 W 8.40 4.35 0.00 3.65 3.29 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 0.00 121 K 6.63 3.95 0.00 1.05 0.74 0.00 1.27 0.00 0.00 1.13 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.60 0.88 7.81 122 S 7.73 4.17 0.00 4.15 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 0.00 123 T 7.48 5.08 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 1.18 0.00 0.00 124 L 8.91 4.72 0.00 1.78 1.75 0.96 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.77 4.36 1.76 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 0.54 0.00 0.00 0.66 0.00 0.00 126 G 6.29 3.18 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 0.00 127 H 8.06 5.50 0.00 3.19 3.15 0.00 5.74 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 0.00 128 D 9.26 4.91 0.00 3.16 2.64 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 0.00 129 T 8.52 5.25 4.46 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 1.43 0.00 0.00 130 F 9.52 5.57 0.00 3.17 3.22 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 0.00 131 T 9.21 5.54 4.37 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 1.38 0.00 0.00 132 K 8.74 3.69 0.00 1.54 1.61 0.00 1.46 0.00 0.00 1.36 0.00 0.00 2.21 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.30 0.21 7.81 133 V 7.37 4.38 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 0.66 0.00 0.00 0.93 0.00 0.00 134 K 8.10 3.64 0.00 0.79 1.33 0.00 1.54 0.00 0.00 1.33 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.21 1.10 7.81