NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3843 8.3044 120.3493 54.8223 33.4204 174.9196 2 I 3.6176 8.3815 125.9662 61.2960 38.7170 173.2301 3 Q 4.8788 8.3515 124.7136 54.1482 33.6636 173.8371 4 S 5.1545 8.5318 115.8197 56.8279 66.3232 173.3087 5 Q 4.7097 8.9563 121.0182 55.0381 29.7794 175.7992 6 I 4.4109 8.4036 111.9834 59.9498 39.3240 174.6956 7 N 4.8820 7.8721 120.1777 51.0631 40.6461 174.6621 8 R 3.9277 8.6572 123.8496 59.5298 29.2747 178.3407 9 N 4.3474 8.7081 117.2355 55.9642 38.5155 177.3607 10 I 3.6772 7.4679 121.5630 64.6512 37.2240 178.7046 11 R 4.0423 7.8932 118.0634 58.8543 29.9729 178.9484 12 L 4.0017 8.1154 119.2530 57.6301 41.6232 179.1203 13 D 4.3215 8.3273 119.1237 57.1911 40.6938 178.3416 14 L 3.9040 7.8281 120.2973 58.1966 42.0070 178.6953 15 A 4.1084 8.1884 120.6721 55.6112 18.2712 179.3792 16 D 4.3010 8.0984 116.9387 57.3298 40.8393 178.8164 17 A 3.9922 7.9748 121.2304 55.2982 18.3977 179.8034 18 I 3.6795 8.0404 118.4468 64.5493 37.1875 178.7243 19 L 4.0876 8.1434 119.9427 57.5176 41.3870 179.4215 20 L 3.9187 7.9398 120.4020 58.2230 42.0475 178.9420 21 S 4.1028 8.0489 113.1629 61.1245 62.2871 175.9618 22 K 3.7952 8.5354 122.5281 59.4500 31.9267 178.6768 23 A 3.9389 8.0566 120.9714 55.1013 18.0877 179.7174 24 K 3.9157 8.2460 116.3208 59.3442 32.2624 178.9310 25 K 4.1778 8.0957 115.5932 55.5029 32.8089 176.0173 26 D 4.2881 7.6647 118.0710 55.0600 40.1100 173.1327 27 L 4.7408 7.7353 116.6039 53.6772 43.7007 177.4323 28 S 4.6137 8.6645 116.3843 56.8768 66.3666 175.4669 29 F 4.2358 8.3382 121.1889 60.6377 38.7844 177.7286 30 A 4.0661 8.1392 120.2586 55.2459 18.0522 179.3167 31 E 4.0526 8.1788 114.7365 59.2848 29.9163 178.9158 32 I 3.8258 7.7151 120.0869 64.2165 37.4737 177.8177 33 A 4.2617 8.2092 121.3044 53.1500 18.2316 177.0398 34 D 4.4677 7.1941 116.9377 56.3549 41.4164 176.8722 35 G 4.0292 9.0847 115.1042 45.5131 0.0000 173.9269 36 T 4.0172 7.7905 109.0639 62.1412 69.2946 176.1694 37 G 3.9347 8.3395 108.9566 45.5393 0.0000 172.8757 38 L 4.7433 7.5808 118.1767 51.8257 44.8713 177.0763 39 A 4.2219 8.3823 123.5002 51.9932 20.3124 178.7235 40 E 3.9788 8.8426 120.6865 59.7107 29.6385 179.6075 41 A 3.9113 7.9794 121.1681 54.5557 18.5158 179.2956 42 F 3.8602 8.1635 118.8524 61.3833 39.6786 177.4202 43 V 3.5981 7.9795 117.8758 66.2610 31.3518 177.9882 44 T 3.7408 8.0753 115.3664 66.6512 68.2171 176.3516 45 A 3.8135 7.8418 122.2512 54.9002 18.3101 179.4656 46 A 4.1192 7.5105 120.4428 54.8578 18.2575 179.6708 47 L 3.9721 7.6688 115.9561 57.7857 41.7606 178.9097 48 L 4.4918 7.5253 115.9732 54.3752 41.7005 177.4230 49 G 3.8930 8.0572 107.0758 45.6986 0.0000 174.3835 50 Q 4.4898 8.1336 116.2750 55.4551 29.8793 175.0539 51 Q 4.4313 7.4213 115.9571 54.3798 33.0098 172.6024 52 A 4.9419 8.3296 120.6858 50.3712 21.0798 176.3511 53 L 4.6280 8.6500 122.5441 53.1370 43.5116 175.1375 54 P 4.6312 0.0000 0.0000 62.6267 32.4418 177.2919 55 A 3.9735 8.8077 122.8001 55.6783 18.2618 179.8465 56 D 4.2873 8.1023 116.5656 57.5340 40.8865 178.8136 57 A 4.0295 8.0058 120.5745 54.9405 18.3955 179.2895 58 A 3.9533 8.2859 119.5264 55.4764 18.4095 180.0852 59 R 3.8674 8.3384 116.8820 59.2162 30.1385 179.1582 60 L 3.9448 7.9748 120.1263 58.3375 42.2480 179.4892 61 V 3.7834 8.1991 112.8290 64.2155 31.4024 178.7588 62 G 3.6408 8.5133 105.7564 47.7095 0.0000 175.5866 63 A 3.9954 8.2410 123.2415 54.9244 18.2113 179.6829 64 K 3.9294 7.7867 115.7324 59.0101 32.2414 178.4808 65 L 4.4963 7.5644 115.2094 53.2503 42.7135 175.8204 66 D 4.4040 7.6206 116.4662 55.2795 38.6726 173.9568 67 L 4.3877 7.8700 117.9586 53.8948 43.1368 177.7313 68 D 4.7145 8.2551 122.0303 52.7897 41.9480 177.3770 69 E 4.0200 8.5314 118.4917 59.5530 29.3321 179.2985 70 D 4.3512 8.0433 118.6148 57.2824 40.9421 178.8089 71 S 4.1039 8.5931 115.8586 61.6841 62.6519 176.6723 72 I 3.7123 7.5354 121.1365 64.2990 37.1546 177.8840 73 L 4.3367 8.0548 122.5201 57.7327 41.9377 179.0711 74 L 4.0344 8.0948 119.0156 57.7676 41.5134 179.4724 75 L 4.0869 8.1066 118.6853 57.3012 41.5699 178.7989 76 Q 4.7100 7.9561 118.3275 55.7901 29.0908 175.6219 77 M 4.5959 7.1924 120.0667 54.9572 33.0829 176.4437 78 I 4.0051 8.7607 124.5347 60.7890 38.0682 174.2670 79 P 4.6648 0.0000 0.0000 62.2854 32.7423 176.3628 80 L 4.2909 8.3204 123.3722 54.2851 41.5208 176.5432 81 R 4.1449 8.2940 125.0751 55.7763 30.8803 175.1440 82 G 3.0037 7.9809 107.6168 44.9159 0.0000 173.2126 83 C 4.3327 8.0861 122.4212 58.4730 30.7462 174.5019 84 I 3.9531 7.5259 122.1029 60.7051 37.4469 174.8934 85 D 4.4829 8.8775 125.6787 57.0690 41.3990 176.7427 86 D 4.6344 7.2874 116.0883 53.1562 41.5538 174.1629 87 R 4.2617 8.3195 126.4091 56.2290 29.4365 177.0424 88 I 4.0883 7.1894 116.7342 58.2251 39.2525 173.7374 89 P 4.3919 0.0000 0.0000 63.0666 31.7529 176.4848 90 T 4.1953 8.3253 111.3429 63.2540 69.9851 175.4281 91 D 4.4816 7.9799 122.4275 53.2090 42.5826 174.4104 92 P 4.3509 0.0000 0.0000 66.2163 31.2103 178.6467 93 T 3.9605 8.0212 112.4935 67.1738 68.8586 176.1211 94 M 4.4540 8.2287 120.3903 58.5080 31.9987 177.9347 95 Y 4.0347 8.7840 120.1007 61.0826 38.9005 178.5665 96 R 4.0223 8.0828 118.3912 59.3890 29.8189 179.0743 97 F 4.0540 8.0365 117.1101 60.4036 38.8934 177.1100 98 Y 3.9408 7.9351 118.8429 60.6186 38.5616 177.5444 99 E 3.7068 8.2753 120.5391 59.2419 29.6828 178.2847 100 M 4.0346 7.9712 118.2932 58.6806 32.1935 178.2148 101 L 3.8936 7.4512 118.6761 58.0090 41.5886 179.4430 102 Q 3.7939 7.4488 116.5223 58.6920 28.6244 178.9043 103 V 3.6800 7.6936 118.1554 65.0991 32.1657 176.8501 104 Y 4.7173 8.2443 113.9842 57.3207 38.4874 177.5906 105 G 3.7557 8.2237 109.2598 48.3810 0.0000 176.1187 106 T 4.0273 7.8381 111.9380 64.4342 68.8696 176.8218 107 T 3.9155 7.8951 118.2653 66.3831 68.5067 176.4134 108 L 3.9808 8.4686 121.3267 57.6572 41.6455 179.0838 109 K 3.7085 8.0814 119.2454 59.8048 32.0666 178.3620 110 A 4.0321 8.1829 120.5951 55.3280 18.2759 179.5235 111 L 4.0890 8.3449 117.4764 57.2941 41.7316 179.7449 112 V 3.8313 8.1103 118.8636 66.4388 30.9549 177.8452 113 H 4.9808 8.3019 117.3612 58.3711 28.3122 177.4906 114 E 3.9432 8.1554 120.1606 59.3105 29.6252 178.6633 115 K 3.9651 8.2762 117.3795 57.7965 32.2334 177.3956 116 F 4.0972 9.0633 115.6578 59.8623 41.2056 175.1304 117 G 4.0045 7.6569 104.5368 44.2455 0.0000 170.9885 118 D 4.8219 8.8770 120.5178 52.7106 42.1976 176.6137 119 G 4.0372 7.8065 114.5725 46.5436 0.0000 170.7618 120 I 4.8096 7.7544 114.7733 59.1972 41.8653 174.7779 121 I 4.6284 8.2359 123.5450 60.0758 37.7521 175.9146 122 A 4.1386 8.8369 130.0234 52.1632 18.6818 177.1559 123 A 4.0024 8.5779 122.8511 52.1268 19.7515 177.5777 124 I 4.1407 7.4587 115.9693 62.6560 39.3850 175.7489 125 N 4.7517 7.8477 121.2348 53.0238 38.1908 173.2478 126 F 5.4952 8.4098 125.4276 56.2189 43.3211 172.9632 127 K 4.6850 8.2705 123.9479 54.5286 35.8484 174.5986 128 L 5.2055 8.4458 127.4563 53.3348 45.0669 174.9540 129 D 4.8553 8.7451 123.6041 51.9824 43.4174 174.1087 130 V 4.8347 8.3439 119.3125 61.1842 34.1461 174.6728 131 K 4.7264 9.1420 126.9878 54.4289 35.8285 174.8409 132 K 5.0165 8.6331 124.8597 55.2342 33.5734 175.7329 133 V 4.7078 8.6435 119.0858 59.1605 36.5879 174.6561 134 A 4.4829 8.6028 123.8905 52.3689 19.2440 176.4391 135 D 4.6516 8.8240 121.4775 52.4171 42.1175 175.8925 136 P 4.2079 0.0000 0.0000 65.6300 31.5340 176.8967 137 E 4.2431 8.7140 116.0217 56.2303 29.4357 177.1573 138 G 3.9452 8.1041 107.0598 46.4563 0.0000 176.0531 139 G 3.8529 8.8134 107.6778 44.5576 0.0000 171.9295 140 E 5.2309 8.4357 117.8969 54.7900 33.8210 175.4507 141 R 4.8263 9.4211 119.5419 54.5118 34.8651 173.9623 142 A 5.2006 8.5789 122.6637 50.4113 21.2475 176.5368 143 V 4.2927 9.0574 122.1948 61.2310 34.2255 174.3276 144 I 4.9118 8.5072 128.9832 59.9443 39.5901 175.1104 145 T 4.5062 8.7211 124.4060 61.7220 70.7907 173.6091 146 L 4.2094 8.5145 126.5538 53.1419 43.5151 175.8660 147 D 4.5323 8.1644 126.2325 52.6656 42.1614 175.2787 148 G 4.9629 8.4595 112.4258 44.1227 0.0000 170.0234 149 K 4.7709 8.3292 119.9424 54.3723 35.2057 174.2558 150 Y 4.6616 8.6480 128.6637 57.4765 40.2366 173.7317 151 L 4.4314 8.6438 127.4778 51.9588 44.0311 174.3222 152 P 4.4029 0.0000 0.0000 62.8371 32.6337 175.9892 153 T 4.5085 9.2465 119.7916 62.2194 69.9013 174.0565 154 K 4.7058 8.5093 125.6608 53.3870 35.1060 174.5372 155 P 4.3808 0.0000 0.0000 63.1130 31.9390 176.4850 156 F 4.5557 8.0470 114.4384 57.1316 37.9703 174.6767 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 4.38 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.38 3.62 1.87 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 1.42 1.05 0.91 0.00 0.00 3 Q 8.35 4.88 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.60 0.00 0.00 0.00 0.00 0.00 2.53 2.26 0.00 4 S 8.53 5.15 0.00 3.80 3.77 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 5 Q 8.96 4.71 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 6 I 8.40 4.41 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 1.29 0.66 0.91 0.00 0.00 7 N 7.87 4.88 0.00 2.76 2.68 0.00 0.00 6.95 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 8 R 8.66 3.93 0.00 2.06 2.29 0.00 3.10 0.00 0.00 3.32 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 9 N 8.71 4.35 0.00 2.86 2.91 0.00 0.00 6.89 7.10 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 10 I 7.47 3.68 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 1.52 1.41 0.91 0.00 0.00 11 R 7.89 4.04 0.00 1.80 1.95 0.00 3.28 0.00 0.00 3.52 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 12 L 8.12 4.00 0.00 1.69 1.70 0.91 0.88 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 13 D 8.33 4.32 0.00 2.95 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 14 L 7.83 3.90 0.00 1.79 1.86 0.92 0.92 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 15 A 8.19 4.11 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.10 4.30 0.00 2.88 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 17 A 7.97 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 18 I 8.04 3.68 2.04 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.61 0.95 0.00 0.00 19 L 8.14 4.09 0.00 1.87 1.74 0.99 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.94 3.92 0.00 1.77 1.79 0.92 0.88 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 S 8.05 4.10 0.00 3.94 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 22 K 8.54 3.80 0.00 1.75 1.89 0.00 1.18 0.00 0.00 1.16 0.00 0.00 2.21 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.20 1.23 7.81 23 A 8.06 3.94 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 24 K 8.25 3.92 0.00 1.88 1.87 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.59 7.81 25 K 8.10 4.18 0.00 1.73 1.82 0.00 1.83 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.60 7.81 26 D 7.66 4.29 0.00 2.76 2.65 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 27 L 7.74 4.74 0.00 1.55 1.45 0.92 0.63 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 28 S 8.66 4.61 0.00 4.02 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 29 F 8.34 4.24 0.00 3.20 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 30 A 8.14 4.07 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 31 E 8.18 4.05 0.00 2.15 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 0.00 2.55 2.32 0.00 32 I 7.72 3.83 1.94 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 1.44 0.58 0.96 0.00 0.00 33 A 8.21 4.26 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 34 D 7.19 4.47 0.00 2.81 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 35 G 9.08 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 36 T 7.79 4.02 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 1.28 0.00 0.00 37 G 8.34 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 38 L 7.58 4.74 0.00 1.73 1.67 1.05 0.63 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 39 A 8.38 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 40 E 8.84 3.98 0.00 2.27 2.28 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 2.39 2.40 0.00 41 A 7.98 3.91 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 42 F 8.16 3.86 0.00 3.26 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 43 V 7.98 3.60 2.16 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 1.05 0.00 0.00 1.17 0.00 0.00 44 T 8.08 3.74 4.04 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 0.00 0.00 0.00 0.33 0.00 0.00 45 A 7.84 3.81 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 46 A 7.51 4.12 1.15 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 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.67 3.97 0.00 1.84 1.84 1.14 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.53 4.49 0.00 1.64 1.62 0.72 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.06 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 50 Q 8.13 4.49 0.00 1.87 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.38 6.63 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 51 Q 7.42 4.43 0.00 1.39 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.88 0.00 0.00 0.00 0.00 0.00 2.03 1.51 0.00 52 A 8.33 4.94 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 53 L 8.65 4.63 0.00 1.67 1.66 0.98 0.92 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 54 P 0.00 4.63 0.00 2.09 2.00 0.00 3.73 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 55 A 8.81 3.97 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 56 D 8.10 4.29 0.00 2.71 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 57 A 8.01 4.03 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 58 A 8.29 3.95 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 3.87 0.00 2.00 2.00 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 60 L 7.97 3.94 0.00 1.92 1.81 0.93 1.16 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 61 V 8.20 3.78 2.11 0.00 0.00 0.00 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 1.02 0.00 0.00 62 G 8.51 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 0.00 0.00 0.00 63 A 8.24 4.00 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 64 K 7.79 3.93 0.00 1.95 1.90 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.61 7.81 65 L 7.56 4.50 0.00 1.73 1.67 0.98 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.62 4.40 0.00 2.86 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 67 L 7.87 4.39 0.00 1.64 1.59 0.93 0.90 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 68 D 8.26 4.71 0.00 2.95 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 69 E 8.53 4.02 0.00 2.00 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 0.00 2.40 2.34 0.00 70 D 8.04 4.35 0.00 2.72 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 71 S 8.59 4.10 0.00 4.05 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 72 I 7.54 3.71 2.01 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 1.42 0.57 0.97 0.00 0.00 73 L 8.05 4.34 0.00 1.88 1.86 0.93 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.09 4.03 0.00 1.90 1.70 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.11 4.09 0.00 1.89 1.73 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.96 4.71 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.98 0.00 0.00 0.00 0.00 0.00 2.54 2.36 0.00 77 M 7.19 4.60 0.00 1.92 2.15 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.52 0.00 78 I 8.76 4.01 1.87 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 1.30 0.82 0.91 0.00 0.00 79 P 0.00 4.66 0.00 2.13 2.02 0.00 3.75 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 80 L 8.32 4.29 0.00 1.67 1.65 0.91 0.93 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 81 R 8.29 4.14 0.00 1.81 1.79 0.00 3.22 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 82 G 7.98 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 0.00 0.00 0.00 83 C 8.09 4.33 0.00 3.05 3.01 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 0.00 0.00 0.00 84 I 7.53 3.95 1.86 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 1.30 0.52 0.91 0.00 0.00 85 D 8.88 4.48 0.00 2.62 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 86 D 7.29 4.63 0.00 2.60 2.48 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 0.00 87 R 8.32 4.26 0.00 1.99 2.06 0.00 3.19 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 88 I 7.19 4.09 1.71 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.74 0.29 0.00 0.00 89 P 0.00 4.39 0.00 2.17 2.05 0.00 3.35 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 90 T 8.33 4.20 4.23 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 1.19 0.00 0.00 91 D 7.98 4.48 0.00 2.85 2.65 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 92 P 0.00 4.35 0.00 2.24 2.14 0.00 3.70 0.00 0.00 3.93 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 93 T 8.02 3.96 4.49 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 1.35 0.00 0.00 94 M 8.23 4.45 0.00 2.10 2.31 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 2.80 2.58 0.00 95 Y 8.78 4.03 0.00 3.21 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 96 R 8.08 4.02 0.00 1.55 1.71 0.00 3.35 0.00 0.00 3.28 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.78 0.00 97 F 8.04 4.05 0.00 3.38 3.16 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 98 Y 7.94 3.94 0.00 2.96 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 99 E 8.28 3.71 0.00 1.93 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 2.30 2.35 0.00 100 M 7.97 4.03 0.00 2.25 2.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.85 0.00 101 L 7.45 3.89 0.00 1.43 1.53 0.88 0.96 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 0.00 102 Q 7.45 3.79 0.00 1.96 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.91 0.00 0.00 0.00 0.00 0.00 1.76 2.39 0.00 103 V 7.69 3.68 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 0.19 0.00 0.00 0.87 0.00 0.00 104 Y 8.24 4.72 0.00 3.23 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 0.00 105 G 8.22 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 0.00 106 T 7.84 4.03 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 0.00 107 T 7.90 3.92 4.60 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 1.34 0.00 0.00 108 L 8.47 3.98 0.00 1.90 1.73 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.08 3.71 0.00 1.83 2.02 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.45 7.81 110 A 8.18 4.03 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 0.00 111 L 8.34 4.09 0.00 1.73 1.75 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.11 3.83 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 1.07 0.00 0.00 0.93 0.00 0.00 113 H 8.30 4.98 0.00 3.39 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.16 3.94 0.00 2.06 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 0.00 2.29 2.34 0.00 115 K 8.28 3.97 0.00 1.70 1.25 0.00 1.70 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.50 7.81 116 F 9.06 4.10 0.00 2.37 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 0.00 117 G 7.66 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 0.00 118 D 8.88 4.82 0.00 2.75 2.63 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 0.00 119 G 7.81 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 I 7.75 4.81 1.86 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 1.17 0.94 0.92 0.00 0.00 121 I 8.24 4.63 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 1.16 0.66 0.90 0.00 0.00 122 A 8.84 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 0.00 123 A 8.58 4.00 1.08 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 0.00 124 I 7.46 4.14 1.84 0.00 0.00 0.81 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 0.93 0.91 0.00 0.00 125 N 7.85 4.75 0.00 2.80 2.78 0.00 0.00 6.55 7.71 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 0.00 126 F 8.41 5.50 0.00 2.86 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.27 4.68 0.00 1.78 1.44 0.00 1.59 0.00 0.00 1.53 0.00 0.00 2.75 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.21 1.23 7.81 128 L 8.45 5.21 0.00 1.73 1.52 1.07 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.75 4.86 0.00 2.73 2.66 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 0.00 130 V 8.34 4.83 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 0.88 0.00 0.00 0.92 0.00 0.00 131 K 9.14 4.73 0.00 1.67 1.65 0.00 1.72 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.48 7.81 132 K 8.63 5.02 0.00 1.78 1.72 0.00 2.01 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.47 7.81 133 V 8.64 4.71 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 0.71 0.00 0.00 0.94 0.00 0.00 134 A 8.60 4.48 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 0.00 135 D 8.82 4.65 0.00 2.76 2.72 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 0.00 0.00 0.00 0.00 136 P 0.00 4.21 0.00 2.08 2.11 0.00 3.72 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 2.03 2.11 0.00 137 E 8.71 4.24 0.00 2.03 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 0.00 2.33 2.25 0.00 138 G 8.10 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 0.00 139 G 8.81 3.85 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 0.00 0.00 0.00 140 E 8.44 5.23 0.00 1.82 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 2.21 2.32 0.00 141 R 9.42 4.83 0.00 1.67 1.76 0.00 3.22 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 1.60 1.56 0.00 142 A 8.58 5.20 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 0.00 143 V 9.06 4.29 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 1.06 0.00 0.00 0.94 0.00 0.00 144 I 8.51 4.91 1.97 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.86 0.98 0.00 0.00 145 T 8.72 4.51 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 1.15 0.00 0.00 146 L 8.51 4.21 0.00 1.52 1.69 1.12 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 147 D 8.16 4.53 0.00 2.57 2.41 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 0.00 148 G 8.46 4.96 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 0.00 149 K 8.33 4.77 0.00 1.89 1.66 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.46 7.81 150 Y 8.65 4.66 0.00 2.66 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 L 8.64 4.43 0.00 1.37 1.38 0.86 0.76 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 0.00 152 P 0.00 4.40 0.00 2.04 1.99 0.00 3.50 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.93 0.00 153 T 9.25 4.51 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 1.26 0.00 0.00 154 K 8.51 4.71 0.00 1.75 1.73 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.45 7.81 155 P 0.00 4.38 0.00 2.03 1.96 0.00 3.65 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 2.04 2.09 0.00 156 F 8.05 4.56 0.00 3.05 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