NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3910 8.3044 120.3493 54.8758 33.4069 174.9824 2 I 3.6762 8.3394 126.2481 60.9767 38.8465 173.2533 3 Q 4.8558 8.3479 124.5173 54.1574 33.5564 173.8552 4 S 5.1738 8.6105 116.1739 56.8666 66.4164 173.1093 5 Q 4.8229 8.8636 120.4539 54.6343 30.3799 175.7445 6 I 4.3991 8.4063 111.7232 60.1059 38.9534 174.7728 7 N 4.8616 7.8512 120.0096 50.9676 40.7527 174.5530 8 R 4.0308 8.6924 123.9650 59.5434 29.2215 178.3097 9 N 4.3488 8.5276 117.1344 55.9275 38.3785 177.2886 10 I 3.6661 7.3718 120.2490 64.6785 37.3150 178.6918 11 R 4.0432 7.8946 118.0260 58.8738 29.9770 178.9325 12 L 4.0651 8.1469 119.2348 57.6768 41.6922 179.0578 13 D 4.3790 8.5814 119.4777 57.1963 40.6345 178.5568 14 L 3.9691 8.0280 120.7691 58.0061 41.9929 178.8889 15 A 4.1039 8.0584 120.8025 55.2078 18.3284 179.2105 16 D 4.2999 8.1768 117.2335 57.4769 40.9188 178.9812 17 A 3.9687 7.8672 120.5773 55.2683 18.4113 179.6328 18 I 3.6689 8.0781 118.6768 64.7103 37.2138 178.7286 19 L 4.1003 8.2604 119.9380 57.4734 41.3301 179.4384 20 L 3.9158 7.9262 120.3977 58.0590 42.1078 178.6326 21 S 4.0377 8.0006 113.1430 61.5051 62.2880 175.9222 22 K 3.7545 8.4130 122.1976 59.5969 31.8049 178.5144 23 A 3.9331 7.9800 120.7410 55.1429 18.1244 179.6505 24 K 3.8964 8.2020 116.2370 59.1323 32.2114 178.7002 25 K 4.2748 7.9513 115.4738 54.9518 32.8275 175.7763 26 D 4.2903 7.6731 117.9497 55.0576 40.1413 173.2740 27 L 4.6318 7.7135 116.4125 53.7463 43.5318 177.4215 28 S 4.6016 8.4038 115.9144 56.8315 66.4975 175.4171 29 F 4.1560 8.2527 121.2678 60.6777 38.5341 177.7176 30 A 4.0793 8.1047 119.9071 55.3381 18.0101 179.4412 31 E 3.9379 8.0353 115.8212 59.6068 29.6285 179.2414 32 I 3.8290 7.5617 118.5871 64.2951 37.1162 177.8966 33 A 4.3225 8.0747 120.3495 52.6593 18.3864 176.8416 34 D 4.3927 7.1508 118.2536 55.8184 41.4693 176.3849 35 G 4.0533 9.1390 114.6883 45.6370 0.0000 173.8121 36 T 4.1052 7.4806 115.4592 63.6242 69.0203 176.3508 37 G 3.9695 8.3631 107.5887 45.2514 0.0000 172.8726 38 L 4.7225 7.4216 117.9987 51.9122 44.7982 176.7560 39 A 4.1289 8.3949 123.2512 52.3163 20.2191 178.4265 40 E 3.8860 8.9173 122.8273 59.6022 29.6865 179.5049 41 A 3.9454 7.9212 120.2007 54.8505 18.5132 179.3261 42 F 3.8907 8.1029 118.7717 61.4268 39.7001 177.4787 43 V 3.5996 8.2125 118.1913 66.2195 31.3045 178.0229 44 T 3.7402 8.0506 115.2768 66.5919 68.1864 176.2423 45 A 3.8154 7.7629 122.3280 55.1090 18.3297 179.5678 46 A 4.1888 7.5079 120.3400 54.7984 18.2363 179.6797 47 L 3.9906 7.6645 116.2122 57.8808 41.7953 178.9492 48 L 4.4304 7.7207 115.7811 54.5734 41.6947 177.7188 49 G 3.9168 8.0723 107.4297 45.5449 0.0000 174.3107 50 Q 4.4752 8.0169 116.7850 55.6365 29.8358 175.0302 51 Q 4.4100 7.3926 115.8808 54.3798 32.9874 172.5933 52 A 4.9419 8.2622 120.8321 50.5269 20.8243 176.5769 53 L 4.6303 8.7075 122.5353 53.0616 43.5403 175.0969 54 P 4.4973 0.0000 0.0000 62.6908 32.4793 177.3691 55 A 3.9748 8.7512 123.0796 55.5336 18.3184 179.8772 56 D 4.3047 8.1103 116.6785 57.5133 40.9551 178.7919 57 A 4.0033 8.0075 120.5288 55.0784 18.4880 179.2561 58 A 3.9756 8.3533 119.6233 55.5292 18.5286 180.1508 59 R 3.9227 8.2145 116.5549 58.9691 30.0619 178.9121 60 L 3.9289 8.0893 120.2757 58.4638 42.2122 179.5751 61 V 3.7502 8.1030 112.4583 64.2744 31.3623 178.8502 62 G 3.6521 8.3612 105.4459 47.5747 0.0000 175.7386 63 A 3.9791 7.8559 122.6807 55.0370 18.3007 179.6334 64 K 3.8347 7.9516 115.7803 59.2005 32.2541 178.4619 65 L 4.4267 7.7613 115.5721 53.2930 42.7020 175.8313 66 D 4.3965 7.7048 117.8012 55.2379 38.7125 173.9224 67 L 4.3762 7.9803 118.0994 53.8796 43.1592 177.8322 68 D 4.7113 8.2439 121.9764 52.8834 42.0152 177.1948 69 E 4.0346 8.5465 118.0298 59.4503 29.4143 179.2004 70 D 4.3714 8.0318 118.6473 57.3687 41.0203 178.7694 71 S 4.1092 8.6100 115.8186 61.7583 62.6551 176.7651 72 I 3.7195 7.5965 121.1006 64.2102 37.0957 177.9391 73 L 4.2400 8.3432 121.5322 58.2755 41.9727 179.0156 74 L 4.0223 8.4353 119.2352 57.8694 41.4710 179.5318 75 L 4.1041 7.9818 118.3641 57.2005 41.2923 178.7950 76 Q 4.5791 7.6707 117.7733 55.8516 29.3740 176.0984 77 M 4.4901 7.1363 119.8735 55.0561 33.0570 176.3590 78 I 4.0691 8.7494 124.3534 60.6868 38.1901 174.4074 79 P 4.7476 0.0000 0.0000 62.1341 32.9963 176.2290 80 L 4.3449 8.2781 122.7815 53.9409 41.3082 176.2935 81 R 4.1436 8.2218 124.6318 55.7946 30.8194 175.1822 82 G 3.0118 8.1713 108.9387 44.9631 0.0000 173.0493 83 C 4.3026 8.0404 122.4777 58.7772 30.7018 174.5154 84 I 4.0015 7.5314 122.0827 60.5625 37.5036 174.9209 85 D 4.4577 8.8805 125.6279 57.1047 41.6096 176.5710 86 D 4.6425 7.3673 114.9217 53.1483 41.5518 173.8436 87 R 4.3138 8.2089 126.9478 56.3958 29.1858 177.1585 88 I 4.0475 7.1541 116.2876 58.2838 39.1388 173.9013 89 P 4.4355 0.0000 0.0000 62.8375 31.8474 176.5709 90 T 4.1334 8.3644 111.7246 63.7185 69.8679 175.5784 91 D 4.4711 7.9837 122.1913 53.2144 42.4743 174.5181 92 P 4.3712 0.0000 0.0000 66.2002 31.1917 178.7227 93 T 3.9146 8.0068 112.6440 67.1468 68.7501 176.1629 94 M 4.4604 8.1830 120.6745 58.5570 31.8696 178.1810 95 Y 4.0553 8.7369 120.1334 60.8108 38.9731 178.2513 96 R 3.8571 8.1496 118.9540 59.3866 29.9340 179.0516 97 F 4.2139 8.0070 117.2424 60.4348 38.9157 176.9829 98 Y 3.9908 8.0430 118.8154 60.8100 38.4142 177.8645 99 E 3.6981 7.9986 120.3537 59.2314 29.6144 178.4276 100 M 4.0941 8.0217 118.8802 58.6329 31.9579 178.7659 101 L 3.9594 7.4668 118.9757 57.8772 41.5259 179.6266 102 Q 3.7868 7.4227 117.1046 58.3330 28.6167 178.3137 103 V 3.7028 7.8312 118.8845 64.7998 32.1340 176.6849 104 Y 4.6822 8.2261 114.2165 57.2171 38.8834 177.6230 105 G 3.8584 8.1633 108.7783 48.4373 0.0000 175.9147 106 T 4.0186 7.8422 111.7595 64.3077 68.8714 176.8111 107 T 3.9396 7.8589 118.4753 66.3668 68.5527 176.3633 108 L 3.9926 8.6003 121.3124 57.7091 41.6394 179.4480 109 K 3.7718 8.1623 119.0186 59.4577 32.1988 178.2904 110 A 4.0295 8.2458 121.2888 55.5872 18.2117 179.6779 111 L 4.0420 8.3370 117.5219 57.5252 41.6568 179.6987 112 V 3.7884 8.1457 118.7393 66.6165 31.1686 177.9190 113 H 5.0109 8.2754 117.2172 58.2610 28.2565 177.5264 114 E 3.9458 8.1146 120.4817 59.3258 29.6392 178.7053 115 K 3.9679 8.2252 117.2468 57.9000 32.2191 177.6485 116 F 4.1060 8.4834 116.0417 59.4533 41.2408 174.1124 117 G 3.8795 7.2948 104.6355 43.6040 0.0000 172.0951 118 D 4.6698 8.7581 119.0683 54.3412 42.3457 175.5881 119 G 4.1231 7.9043 112.5627 45.3694 0.0000 172.3370 120 I 4.7955 8.2960 115.1427 59.2704 41.7247 174.8393 121 I 4.5047 8.2932 124.5282 60.0610 37.7760 176.1720 122 G 3.7622 8.8996 115.3220 46.4263 0.0000 173.0975 123 A 4.0629 8.4788 124.0454 51.5605 19.8168 176.9878 124 I 4.2563 7.6917 116.3434 63.2297 39.1499 176.4043 125 N 4.7826 7.7868 122.5561 52.0334 37.9559 172.1651 126 F 5.4741 8.0225 122.7388 56.6608 42.7618 172.6781 127 K 4.5299 8.3995 124.2924 54.4246 36.3387 174.9351 128 L 5.4138 8.2664 123.3337 52.5331 45.3325 174.9811 129 D 4.8127 8.4631 123.3356 51.8780 43.2958 173.8855 130 V 4.8057 8.3791 119.8791 61.2096 33.7552 174.6862 131 K 4.6809 9.0197 127.3484 54.3737 35.5804 175.1978 132 K 4.7398 8.6972 126.1482 55.7794 33.3773 175.9531 133 V 4.5815 8.8221 126.3913 60.6673 35.2188 174.3007 134 A 4.3365 8.7161 129.2721 52.1557 19.2034 176.3598 135 D 4.5246 9.4193 122.7681 52.9634 41.9582 175.1286 136 P 4.2025 0.0000 0.0000 66.0375 31.3318 177.3273 137 E 4.0994 8.1936 114.2931 56.4212 29.5952 176.7740 138 G 4.0346 8.6970 107.9169 45.2324 0.0000 175.8868 139 G 3.8316 8.8782 109.9657 44.2069 0.0000 171.5651 140 E 5.1809 8.4921 116.8475 54.5974 32.9344 175.8406 141 R 4.7835 9.2624 121.4049 54.3535 33.7841 174.4855 142 A 4.9174 8.5577 123.9842 50.7063 20.7261 176.6313 143 V 4.1824 9.1823 123.5653 61.4338 33.2950 174.4419 144 I 4.8087 8.3775 129.4617 60.2062 38.8215 175.3552 145 T 4.5250 8.7115 124.4845 61.8351 70.5890 173.4090 146 L 4.6946 8.5505 126.9534 53.2089 43.4674 175.6889 147 D 4.7193 8.7381 124.2159 52.3887 43.4419 174.3961 148 G 4.6601 8.5485 112.1587 43.8259 0.0000 170.7520 149 K 4.3052 8.7618 124.5669 56.0617 33.4458 175.4123 150 Y 4.6007 8.6847 129.2329 57.6435 39.7246 174.5519 151 L 4.4162 8.6884 127.7553 51.9889 43.7492 174.2723 152 P 4.6020 0.0000 0.0000 62.8100 32.5484 175.9014 153 T 4.5711 8.6707 118.8452 62.0843 70.1358 174.0747 154 K 4.6608 8.5261 125.2847 53.3867 35.5523 174.4417 155 P 4.3866 0.0000 0.0000 63.0123 31.9225 176.6284 156 F 4.5648 7.8873 114.4377 57.1452 37.9791 174.6862 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 4.39 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 8.34 3.68 1.88 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 1.06 0.91 0.00 0.00 3 Q 8.35 4.86 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.51 2.27 0.00 4 S 8.61 5.17 0.00 3.81 3.78 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 5 Q 8.86 4.82 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 6 I 8.41 4.40 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 1.30 0.66 0.91 0.00 0.00 7 N 7.85 4.86 0.00 2.76 2.67 0.00 0.00 6.94 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 8.69 4.03 0.00 2.06 2.30 0.00 3.13 0.00 0.00 3.32 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 9 N 8.53 4.35 0.00 2.89 2.91 0.00 0.00 6.86 7.06 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 10 I 7.37 3.67 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 1.52 0.84 0.91 0.00 0.00 11 R 7.89 4.04 0.00 1.80 1.96 0.00 3.28 0.00 0.00 3.55 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 8.15 4.07 0.00 1.69 1.70 0.91 0.89 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 13 D 8.58 4.38 0.00 2.90 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 14 L 8.03 3.97 0.00 1.77 1.83 0.93 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.06 4.10 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 4.30 0.00 2.93 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 17 A 7.87 3.97 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 18 I 8.08 3.67 2.06 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 0.70 0.96 0.00 0.00 19 L 8.26 4.10 0.00 1.86 1.75 0.99 1.01 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 20 L 7.93 3.92 0.00 1.78 1.81 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.00 4.04 0.00 3.93 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 22 K 8.41 3.75 0.00 1.78 1.94 0.00 1.22 0.00 0.00 1.24 0.00 0.00 2.14 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.23 7.81 23 A 7.98 3.93 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 24 K 8.20 3.90 0.00 1.87 1.88 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.66 7.81 25 K 7.95 4.27 0.00 1.69 1.80 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.54 7.81 26 D 7.67 4.29 0.00 2.75 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 7.71 4.63 0.00 1.55 1.44 1.02 0.62 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 S 8.40 4.60 0.00 4.04 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 29 F 8.25 4.16 0.00 3.23 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 30 A 8.10 4.08 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 8.04 3.94 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 32 I 7.56 3.83 1.93 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 1.42 0.54 0.96 0.00 0.00 33 A 8.07 4.32 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 34 D 7.15 4.39 0.00 2.72 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 35 G 9.14 4.05 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 0.00 0.00 0.00 36 T 7.48 4.11 4.52 0.00 0.00 0.00 0.00 0.00 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 37 G 8.36 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 38 L 7.42 4.72 0.00 1.70 1.66 1.02 0.67 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 39 A 8.39 4.13 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 40 E 8.92 3.89 0.00 2.08 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 2.44 2.47 0.00 41 A 7.92 3.95 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 42 F 8.10 3.89 0.00 3.17 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 43 V 8.21 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 1.04 0.00 0.00 1.07 0.00 0.00 44 T 8.05 3.74 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 0.36 0.00 0.00 45 A 7.76 3.82 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 7.51 4.19 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 47 L 7.66 3.99 0.00 1.87 1.85 1.16 0.86 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 48 L 7.72 4.43 0.00 1.63 1.63 0.71 0.90 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 49 G 8.07 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 50 Q 8.02 4.48 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.68 6.63 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 51 Q 7.39 4.41 0.00 1.41 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.90 0.00 0.00 0.00 0.00 0.00 2.03 1.46 0.00 52 A 8.26 4.94 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 53 L 8.71 4.63 0.00 1.65 1.65 0.95 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.50 0.00 2.10 2.00 0.00 3.72 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 55 A 8.75 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 8.11 4.30 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 4.00 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 58 A 8.35 3.98 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 59 R 8.21 3.92 0.00 2.02 1.99 0.00 3.14 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 60 L 8.09 3.93 0.00 1.88 1.86 0.93 0.90 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 61 V 8.10 3.75 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 0.92 0.00 0.00 1.00 0.00 0.00 62 G 8.36 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 63 A 7.86 3.98 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.95 3.83 0.00 1.90 1.90 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.68 7.81 65 L 7.76 4.43 0.00 1.71 1.69 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.70 4.40 0.00 2.75 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 67 L 7.98 4.38 0.00 1.62 1.59 0.93 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.24 4.71 0.00 2.95 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.55 4.03 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 8.03 4.37 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 8.61 4.11 0.00 4.01 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 7.60 3.72 1.99 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 1.41 0.59 0.97 0.00 0.00 73 L 8.34 4.24 0.00 1.85 1.90 0.93 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.44 4.02 0.00 1.85 1.70 0.92 0.65 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 7.98 4.10 0.00 1.90 1.73 0.93 1.05 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 76 Q 7.67 4.58 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.88 0.00 0.00 0.00 0.00 0.00 2.54 2.26 0.00 77 M 7.14 4.49 0.00 1.93 2.12 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 2.87 2.53 0.00 78 I 8.75 4.07 1.88 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 0.89 0.92 0.00 0.00 79 P 0.00 4.75 0.00 2.10 2.05 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 1.92 0.00 80 L 8.28 4.34 0.00 1.67 1.64 0.91 0.92 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 81 R 8.22 4.14 0.00 1.82 1.81 0.00 3.24 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.76 0.00 82 G 8.17 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 0.00 0.00 0.00 83 C 8.04 4.30 0.00 3.06 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 84 I 7.53 4.00 1.85 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 0.53 0.90 0.00 0.00 85 D 8.88 4.46 0.00 2.63 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 7.37 4.64 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 8.21 4.31 0.00 1.98 2.06 0.00 3.20 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 1.50 1.62 0.00 88 I 7.15 4.05 1.74 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.72 0.62 0.00 0.00 89 P 0.00 4.44 0.00 2.17 2.03 0.00 3.39 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.09 0.00 90 T 8.36 4.13 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 4.47 0.00 2.85 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 92 P 0.00 4.37 0.00 2.24 2.14 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 93 T 8.01 3.91 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 1.35 0.00 0.00 94 M 8.18 4.46 0.00 2.11 2.22 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 2.83 2.60 0.00 95 Y 8.74 4.06 0.00 3.16 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 96 R 8.15 3.86 0.00 1.53 1.70 0.00 3.35 0.00 0.00 3.30 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.76 0.00 97 F 8.01 4.21 0.00 3.28 3.04 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 98 Y 8.04 3.99 0.00 2.95 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 99 E 8.00 3.70 0.00 1.88 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 2.29 2.37 0.00 100 M 8.02 4.09 0.00 2.16 2.33 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.59 0.00 101 L 7.47 3.96 0.00 1.45 1.55 0.90 1.06 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 7.42 3.79 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.91 0.00 0.00 0.00 0.00 0.00 1.68 2.31 0.00 103 V 7.83 3.70 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 0.28 0.00 0.00 0.91 0.00 0.00 104 Y 8.23 4.68 0.00 3.20 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 0.00 105 G 8.16 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 0.00 0.00 0.00 106 T 7.84 4.02 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 1.20 0.00 0.00 107 T 7.86 3.94 4.59 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 1.33 0.00 0.00 108 L 8.60 3.99 0.00 1.84 1.73 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.16 3.77 0.00 1.82 1.99 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.45 7.81 110 A 8.25 4.03 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 0.00 111 L 8.34 4.04 0.00 1.75 1.75 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.15 3.79 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 1.05 0.00 0.00 0.95 0.00 0.00 113 H 8.28 5.01 0.00 3.24 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.11 3.95 0.00 2.06 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 0.00 2.29 2.33 0.00 115 K 8.23 3.97 0.00 1.70 1.17 0.00 1.68 0.00 0.00 1.57 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.30 1.49 7.81 116 F 8.48 4.11 0.00 2.41 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 7.29 3.88 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 0.00 0.00 0.00 118 D 8.76 4.67 0.00 2.76 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 0.00 119 G 7.90 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 0.00 0.00 0.00 120 I 8.30 4.80 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 1.19 1.27 0.92 0.00 0.00 121 I 8.29 4.50 1.80 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.63 0.90 0.00 0.00 122 G 8.90 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 0.00 123 A 8.48 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.69 4.26 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 1.27 0.95 0.93 0.00 0.00 125 N 7.79 4.78 0.00 2.79 2.75 0.00 0.00 6.54 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 8.02 5.47 0.00 2.94 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 0.00 127 K 8.40 4.53 0.00 1.46 1.42 0.00 1.59 0.00 0.00 1.49 0.00 0.00 2.74 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.24 1.25 7.81 128 L 8.27 5.41 0.00 1.28 1.35 1.02 1.18 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 0.00 129 D 8.46 4.81 0.00 2.67 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 0.00 130 V 8.38 4.81 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 0.91 0.00 0.00 131 K 9.02 4.68 0.00 1.70 1.65 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.50 7.81 132 K 8.70 4.74 0.00 1.79 1.72 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.44 7.81 133 V 8.82 4.58 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 0.72 0.00 0.00 0.94 0.00 0.00 134 A 8.72 4.34 1.24 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 0.00 0.00 0.00 135 D 9.42 4.52 0.00 2.68 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 0.00 136 P 0.00 4.20 0.00 2.08 2.13 0.00 3.73 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 137 E 8.19 4.10 0.00 1.98 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 2.26 0.00 138 G 8.70 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 0.00 139 G 8.88 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 E 8.49 5.18 0.00 1.83 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 2.20 2.30 0.00 141 R 9.26 4.78 0.00 1.68 1.79 0.00 3.11 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 142 A 8.56 4.92 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 0.00 143 V 9.18 4.18 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 1.05 0.00 0.00 0.94 0.00 0.00 144 I 8.38 4.81 2.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.68 0.99 0.00 0.00 145 T 8.71 4.53 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 1.18 0.00 0.00 146 L 8.55 4.69 0.00 1.66 2.01 1.01 1.21 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 0.00 147 D 8.74 4.72 0.00 2.59 2.43 0.00 0.00 0.00 0.00 0.00 0.00 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 8.55 4.66 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 0.00 149 K 8.76 4.31 0.00 1.95 1.71 0.00 1.57 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.44 7.81 150 Y 8.68 4.60 0.00 2.47 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 0.00 151 L 8.69 4.42 0.00 1.44 1.41 0.87 0.60 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 0.00 152 P 0.00 4.60 0.00 2.01 1.90 0.00 3.43 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.83 0.00 153 T 8.67 4.57 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 1.30 0.00 0.00 154 K 8.53 4.66 0.00 1.75 1.72 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.43 7.81 155 P 0.00 4.39 0.00 2.02 1.94 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 2.03 2.08 0.00 156 F 7.89 4.56 0.00 3.07 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