NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3872 8.3044 120.3494 54.8321 33.4144 174.9326 2 I 3.6303 8.3782 126.1265 61.1949 38.7769 173.2537 3 Q 4.8592 8.3633 124.8474 54.1575 33.6358 173.8151 4 S 5.1704 8.6028 116.0644 56.8560 66.3782 173.1058 5 Q 4.8253 8.8907 120.5986 54.6184 30.3188 175.7713 6 I 4.3995 8.4248 112.1816 60.1513 39.0864 174.7464 7 N 4.8695 7.8355 120.1298 50.9991 40.8723 174.7014 8 R 3.9575 8.6382 123.7492 59.3147 29.2845 178.3371 9 N 4.3873 8.7430 117.5296 55.8834 38.4706 177.3465 10 I 3.6844 7.4386 121.4803 64.6414 37.2462 178.6872 11 R 4.0353 7.8938 118.1228 58.9016 30.0683 178.9363 12 L 4.0265 8.1195 119.1728 57.5642 41.6364 179.0228 13 D 4.3511 8.4199 119.3585 57.2469 40.7212 178.4821 14 L 3.9079 7.8673 120.3272 58.1437 41.9985 178.6988 15 A 4.1305 8.1493 120.6690 55.4958 18.2891 179.3422 16 D 4.2805 8.0947 116.7522 57.3856 40.9057 178.8344 17 A 3.9916 7.9385 121.1189 55.2600 18.4190 179.6042 18 I 3.6585 8.1053 118.6390 64.7404 37.2372 178.7301 19 L 4.1145 8.2085 119.8514 57.4583 41.2969 179.4363 20 L 3.9086 8.0001 120.3991 58.1087 42.0465 178.6940 21 S 4.0387 8.0535 113.1040 61.4471 62.3108 175.9249 22 K 3.7467 8.4729 122.2120 59.5500 31.8755 178.5158 23 A 3.9461 8.0600 120.7892 55.1824 18.1186 179.7573 24 K 3.9349 8.1060 116.0456 59.1198 32.2088 178.8160 25 K 4.2074 8.1322 116.0517 55.3270 32.8785 175.8336 26 D 4.2870 7.6036 118.0063 55.0152 40.1616 173.1180 27 L 4.6737 7.6894 116.3562 53.6768 43.6463 177.2917 28 S 4.6641 8.4038 115.6561 56.6656 66.5078 175.3851 29 F 4.1291 8.3083 121.5479 60.6019 38.7252 177.4689 30 A 4.0702 8.2414 119.9325 55.5885 17.8926 179.3812 31 E 3.9291 8.1608 115.3547 59.6475 29.6092 179.4221 32 I 3.8417 7.5936 118.5324 64.4018 37.4762 178.1321 33 A 4.2392 8.2832 121.4260 53.4774 18.1704 177.2019 34 D 4.4738 7.3262 117.7341 55.8663 41.5311 176.3536 35 G 4.0892 9.0796 115.2779 45.6293 0.0000 174.3012 36 T 3.9974 7.6811 108.8880 62.2639 69.2098 176.2015 37 G 3.9235 8.2870 108.8019 45.4673 0.0000 172.8907 38 L 4.6733 7.5180 118.7511 52.1014 44.3165 176.9105 39 A 4.1056 8.3875 123.3768 52.3634 20.1419 178.3983 40 E 3.9175 8.9563 123.3368 59.5586 29.6932 179.3703 41 A 3.9428 7.9754 120.1376 54.9880 18.4990 179.2926 42 F 3.8814 8.0110 118.6245 61.3833 39.5885 177.4139 43 V 3.6107 8.0265 117.8635 66.2727 31.3582 178.0429 44 T 3.7815 8.0161 115.1868 66.5984 68.2963 176.2073 45 A 3.8317 7.8902 122.3552 55.1949 18.2458 179.5450 46 A 4.1610 7.5170 120.2105 54.8529 18.2461 179.7904 47 L 3.9771 7.8550 116.3281 57.6413 41.7271 178.8151 48 L 4.4985 7.5609 116.3193 54.3397 41.6595 177.4388 49 G 3.8835 8.0839 106.9353 45.8832 0.0000 174.3908 50 Q 4.5361 8.3114 115.8197 55.3492 29.7870 175.1552 51 Q 4.4147 7.4292 115.9535 54.5146 32.8468 172.5912 52 A 4.8877 8.2583 121.1831 50.4832 20.7720 176.6197 53 L 4.5595 8.7644 122.6130 53.2917 43.3674 175.1932 54 P 4.3681 0.0000 0.0000 62.5600 32.4889 177.2695 55 A 3.9751 8.8262 123.3368 55.6941 18.2168 179.9720 56 D 4.2985 8.0970 116.5579 57.4578 40.8850 178.7384 57 A 3.9863 8.0149 120.6049 54.9927 18.3849 179.2770 58 A 3.9541 8.2993 119.5289 55.4715 18.4874 180.1302 59 R 3.8544 8.1555 116.5361 59.1266 30.2416 179.0033 60 L 3.9366 8.1249 120.2105 58.4879 42.3249 179.5955 61 V 3.7999 8.2089 112.6643 64.1500 31.3228 178.8244 62 G 3.6378 8.4285 105.7398 47.6762 0.0000 175.6417 63 A 3.9877 8.0966 123.1631 54.9590 18.2352 179.8844 64 K 3.9594 7.8150 115.4192 58.8416 32.1986 178.5388 65 L 4.4115 7.6129 115.6627 53.0998 43.0002 175.5529 66 D 4.3283 7.5770 117.2457 55.0654 39.9725 173.2901 67 L 4.4544 7.9367 118.0624 53.6443 43.4415 177.7795 68 D 4.6632 8.2870 121.9382 52.9384 41.5992 177.3596 69 E 3.9809 8.5918 118.8919 59.7154 29.4204 179.3450 70 D 4.3612 8.0627 118.4089 57.3888 40.9227 178.9268 71 S 4.1149 8.5303 115.6917 61.7200 62.6588 176.6855 72 I 3.7235 7.5583 121.2167 64.2234 37.0954 178.0013 73 L 4.2258 8.2781 121.4296 58.2448 42.0208 178.9330 74 L 4.0055 8.3955 119.3035 57.9120 41.4756 179.5150 75 L 4.0725 8.1547 118.5540 57.2548 41.3003 178.6040 76 Q 4.6052 7.6843 117.0898 55.0212 29.5146 175.8087 77 M 4.5208 7.3011 120.3914 54.9269 33.1344 176.3425 78 I 4.0497 8.7902 124.5669 60.7020 38.1113 174.2683 79 P 4.6934 0.0000 0.0000 62.2682 32.8059 176.2781 80 L 4.3195 8.3082 123.2873 54.1433 41.5501 176.5589 81 R 4.1979 8.2787 125.0967 55.9214 30.8565 175.2412 82 G 3.0492 8.2716 107.6222 45.1453 0.0000 173.3186 83 C 4.2676 8.0642 122.2272 59.2869 30.6847 174.6791 84 I 4.0167 7.4914 121.9864 60.4739 37.4962 174.9182 85 D 4.4632 8.8875 125.6527 57.0715 41.5475 176.5174 86 D 4.6333 7.2836 115.4408 53.1589 41.4833 173.8394 87 R 4.2139 8.2019 127.0685 56.5737 29.1962 176.9467 88 I 3.9983 7.1847 116.4223 58.2969 38.8186 173.9854 89 P 4.4101 0.0000 0.0000 62.9816 31.7970 176.4590 90 T 4.2005 8.3294 111.3484 63.3817 69.9763 175.5647 91 D 4.4852 7.9567 122.1572 53.2031 42.6285 174.5675 92 P 4.3354 0.0000 0.0000 66.2223 31.2311 178.8194 93 T 3.9483 8.0125 112.6710 67.0870 68.6106 176.1438 94 M 4.4758 8.2191 120.7103 58.3717 31.9968 178.0728 95 Y 4.0034 8.8328 120.1496 60.8917 38.9753 177.9946 96 Q 4.0206 8.2577 118.8897 59.3902 28.6048 179.4743 97 F 4.1507 7.9459 118.5175 60.5206 38.8832 177.0977 98 Y 3.9616 7.9215 118.8004 60.6226 38.5850 177.5109 99 E 3.7138 8.1528 120.6095 59.4785 29.5969 178.5686 100 M 4.1196 8.0723 118.7049 58.5172 32.0085 178.7915 101 L 3.9473 7.4806 119.0259 57.8145 41.5628 179.5160 102 Q 3.8299 7.5407 117.1482 58.4259 28.5871 178.5913 103 V 3.6683 7.6467 118.4991 65.0403 32.1679 176.8115 104 Y 4.6531 7.9378 113.8551 57.3472 38.5012 177.6906 105 G 3.6857 8.0992 108.9842 48.2955 0.0000 176.1268 106 T 4.0043 7.8233 112.1187 64.4546 68.8612 176.7326 107 T 3.8960 7.8922 118.1705 66.4261 68.4985 176.2671 108 L 3.9862 8.5030 121.2456 57.6368 41.6216 179.3638 109 K 3.7577 8.0667 119.1612 59.5442 32.1847 178.4212 110 A 4.0238 8.2614 121.1567 55.4527 18.2345 179.6354 111 L 4.0461 8.2707 117.5043 57.4485 41.6404 179.7043 112 V 3.8040 8.0402 118.5745 66.5803 31.3292 177.8264 113 H 5.0264 8.2054 117.1997 58.3131 28.2882 177.4315 114 E 3.9712 8.1037 120.0803 59.4347 29.6379 178.8170 115 K 3.9410 8.2280 117.3245 58.3694 32.1614 177.6888 116 F 4.1056 8.8471 115.8538 59.8144 40.7913 174.8350 117 G 3.8865 7.1842 105.2072 43.6940 0.0000 172.3285 118 D 4.6859 8.6447 118.9934 54.8239 42.4381 175.2248 119 G 4.2404 8.0539 110.3860 45.1149 0.0000 172.7179 120 I 4.7845 8.4402 114.9839 59.2493 41.7929 174.8922 121 I 4.5151 8.1614 124.1891 60.2491 37.8322 175.7338 122 S 4.2553 9.0115 123.6949 58.2795 62.5149 173.9662 123 A 3.5617 8.6167 128.5839 52.7496 18.9424 177.6786 124 I 4.1460 7.6546 116.3742 63.1869 38.2627 176.9919 125 N 4.7784 7.7667 124.1135 52.3416 37.9936 172.0122 126 F 5.3782 8.0488 123.1961 56.6481 42.9067 172.7485 127 K 4.5784 8.0803 123.8479 54.3526 36.3218 175.2035 128 L 5.7361 8.3042 122.1104 53.1525 43.8647 174.9934 129 D 4.7735 8.2858 117.7210 52.1731 43.1588 173.8609 130 V 4.6507 8.3296 119.2841 61.1601 33.8070 174.6739 131 K 4.7135 8.8796 127.0033 54.4056 35.6406 174.9678 132 K 4.8554 8.6316 125.1705 55.4135 33.5597 175.9761 133 V 4.6119 8.8575 120.2643 59.0197 35.4596 175.0546 134 A 4.3111 8.7433 126.6012 52.2274 19.3494 176.3059 135 D 4.6128 9.1183 122.1374 52.3605 42.0855 175.5878 136 P 4.3706 0.0000 0.0000 65.8867 31.4302 177.1855 137 E 4.0978 8.5342 115.1481 56.8358 29.4337 177.6251 138 G 3.9060 8.3690 107.3191 46.5844 0.0000 175.8211 139 G 3.8489 8.7385 108.5823 44.4459 0.0000 171.7959 140 E 5.1978 8.4783 117.4231 54.6678 33.4875 175.5993 141 R 4.8106 9.2474 120.5881 54.3901 34.1782 174.3114 142 A 5.0769 8.5464 123.2166 50.5477 21.0510 176.5417 143 V 4.2062 8.7999 123.3636 61.4187 33.3954 174.4163 144 I 4.9507 8.4090 129.3010 60.0149 39.1134 175.2805 145 T 4.4894 8.7590 124.6055 61.9100 70.4428 173.6172 146 L 4.7321 8.5631 127.2249 53.3671 43.3094 175.9517 147 D 4.7357 8.6887 124.7964 52.2354 43.0530 174.2925 148 G 4.7290 8.4751 111.7070 43.6619 0.0000 170.5444 149 K 4.3134 8.9060 124.9537 56.2560 33.5923 175.2285 150 Y 4.7778 8.6077 128.4694 57.3881 39.7735 174.2622 151 L 4.4748 8.5583 127.3678 51.9852 44.1558 174.3054 152 P 4.5467 0.0000 0.0000 62.8144 32.6694 176.1060 153 T 4.4752 8.6493 119.2762 62.4018 69.5987 174.1681 154 K 4.7187 8.4793 125.5681 53.4026 35.2973 174.6787 155 P 4.4195 0.0000 0.0000 63.0264 31.9544 176.5776 156 F 4.5037 7.6725 114.2542 57.2216 37.9275 174.4364 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 1.98 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 3.63 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 1.05 0.91 0.00 0.00 3 Q 8.36 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 6.59 0.00 0.00 0.00 0.00 0.00 2.51 2.27 0.00 4 S 8.60 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 8.89 4.83 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 8.42 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 7.84 4.87 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 8.64 3.96 0.00 2.06 2.29 0.00 3.13 0.00 0.00 3.32 7.64 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 8.74 4.39 0.00 2.85 2.91 0.00 0.00 6.84 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 10 I 7.44 3.68 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 1.34 0.91 0.00 0.00 11 R 7.89 4.04 0.00 1.81 1.96 0.00 3.28 0.00 0.00 3.51 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 12 L 8.12 4.03 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 1.72 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.42 4.35 0.00 2.93 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 7.87 3.91 0.00 1.79 1.86 0.92 1.20 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 15 A 8.15 4.13 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 8.09 4.28 0.00 2.95 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 7.94 3.99 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 18 I 8.11 3.66 2.05 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 1.53 0.61 0.95 0.00 0.00 19 L 8.21 4.11 0.00 1.87 1.75 0.99 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 20 L 8.00 3.91 0.00 1.77 1.80 0.92 0.75 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 8.05 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 8.47 3.75 0.00 1.75 1.91 0.00 1.15 0.00 0.00 1.22 0.00 0.00 2.37 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 1.24 7.81 23 A 8.06 3.95 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 24 K 8.11 3.93 0.00 1.87 1.88 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 1.66 7.81 25 K 8.13 4.21 0.00 1.73 1.81 0.00 1.83 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.50 7.81 26 D 7.60 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 7.69 4.67 0.00 1.56 1.46 0.87 0.60 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 28 S 8.40 4.66 0.00 4.03 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 8.31 4.13 0.00 3.20 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 8.24 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 8.16 3.93 0.00 2.08 2.02 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 2.34 2.35 0.00 32 I 7.59 3.84 1.91 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.53 0.95 0.00 0.00 33 A 8.28 4.24 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 7.33 4.47 0.00 2.82 2.76 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 35 G 9.08 4.09 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 0.00 0.00 0.00 36 T 7.68 4.00 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 1.25 0.00 0.00 37 G 8.29 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 38 L 7.52 4.67 0.00 1.74 1.68 1.07 0.64 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 39 A 8.39 4.11 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 8.96 3.92 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 2.45 2.47 0.00 41 A 7.98 3.94 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 42 F 8.01 3.88 0.00 3.18 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 43 V 8.03 3.61 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 1.12 0.00 0.00 1.11 0.00 0.00 44 T 8.02 3.78 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 0.36 0.00 0.00 45 A 7.89 3.83 1.22 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 0.00 0.00 46 A 7.52 4.16 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 7.85 3.98 0.00 1.86 1.84 1.14 1.17 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 7.56 4.50 0.00 1.67 1.63 0.73 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.08 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 50 Q 8.31 4.54 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.34 6.61 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 51 Q 7.43 4.41 0.00 1.53 1.24 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 2.02 1.42 0.00 52 A 8.26 4.89 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.76 4.56 0.00 1.64 1.65 0.95 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.37 0.00 2.10 1.99 0.00 3.71 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 2.13 2.14 0.00 55 A 8.83 3.98 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 4.30 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 3.99 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 8.30 3.95 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 R 8.16 3.85 0.00 2.03 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 1.80 0.00 60 L 8.12 3.94 0.00 1.92 1.79 0.93 1.07 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 61 V 8.21 3.80 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 1.01 0.00 0.00 1.05 0.00 0.00 62 G 8.43 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 8.10 3.99 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 7.82 3.96 0.00 1.92 1.88 0.00 1.69 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 1.47 1.70 7.81 65 L 7.61 4.41 0.00 1.73 1.68 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.58 4.33 0.00 2.76 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 67 L 7.94 4.45 0.00 1.67 1.57 0.93 1.30 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 8.29 4.66 0.00 2.94 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 8.59 3.98 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 2.35 0.00 70 D 8.06 4.36 0.00 2.72 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 71 S 8.53 4.11 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 7.56 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 0.56 0.92 0.00 0.00 73 L 8.28 4.23 0.00 1.85 1.89 0.93 0.74 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 74 L 8.40 4.01 0.00 1.86 1.71 0.92 0.66 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 75 L 8.15 4.07 0.00 1.88 1.74 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.68 4.61 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.88 0.00 0.00 0.00 0.00 0.00 2.54 2.39 0.00 77 M 7.30 4.52 0.00 1.92 2.08 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 2.89 2.52 0.00 78 I 8.79 4.05 1.88 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 1.42 1.01 0.92 0.00 0.00 79 P 0.00 4.69 0.00 2.12 2.03 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 80 L 8.31 4.32 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 1.60 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.28 4.20 0.00 1.82 1.88 0.00 3.24 0.00 0.00 3.21 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 82 G 8.27 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 C 8.06 4.27 0.00 3.06 3.03 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 84 I 7.49 4.02 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 0.95 0.00 0.00 85 D 8.89 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 7.28 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 8.20 4.21 0.00 1.98 2.05 0.00 3.22 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 88 I 7.18 4.00 1.75 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.73 0.68 0.00 0.00 89 P 0.00 4.41 0.00 2.17 2.04 0.00 3.33 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 2.05 2.08 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 1.20 0.00 0.00 91 D 7.96 4.49 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 4.34 0.00 2.23 2.13 0.00 3.69 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 93 T 8.01 3.95 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 94 M 8.22 4.48 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.59 0.00 95 Y 8.83 4.00 0.00 3.18 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 96 Q 8.26 4.02 0.00 1.88 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.63 2.53 0.00 97 F 7.95 4.15 0.00 3.24 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 98 Y 7.92 3.96 0.00 2.90 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.15 3.71 0.00 1.98 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 2.31 2.39 0.00 100 M 8.07 4.12 0.00 2.17 2.32 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.60 0.00 101 L 7.48 3.95 0.00 1.51 1.54 0.90 0.87 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 0.00 102 Q 7.54 3.83 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.91 0.00 0.00 0.00 0.00 0.00 1.65 2.36 0.00 103 V 7.65 3.67 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 0.20 0.00 0.00 0.87 0.00 0.00 104 Y 7.94 4.65 0.00 3.28 2.92 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 0.00 105 G 8.10 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 0.00 106 T 7.82 4.00 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 7.89 3.90 4.61 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 0.00 0.00 0.00 1.35 0.00 0.00 108 L 8.50 3.99 0.00 1.83 1.73 0.95 0.98 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 0.00 109 K 8.07 3.76 0.00 1.83 1.99 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.43 7.81 110 A 8.26 4.02 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 8.27 4.05 0.00 1.79 1.76 0.95 1.13 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 0.00 112 V 8.04 3.80 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 1.04 0.00 0.00 0.92 0.00 0.00 113 H 8.21 5.03 0.00 3.26 3.36 0.00 5.69 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 0.00 114 E 8.10 3.97 0.00 2.07 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 0.00 2.30 2.34 0.00 115 K 8.23 3.94 0.00 1.61 1.22 0.00 1.75 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.51 7.81 116 F 8.85 4.11 0.00 2.42 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 7.18 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 0.00 118 D 8.64 4.69 0.00 2.75 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 0.00 119 G 8.05 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 0.00 0.00 0.00 0.00 120 I 8.44 4.78 1.85 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 1.18 1.14 0.91 0.00 0.00 121 I 8.16 4.52 1.80 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.64 0.92 0.00 0.00 122 S 9.01 4.26 0.00 3.82 3.79 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 0.00 0.00 0.00 0.00 123 A 8.62 3.56 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.65 4.15 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 1.15 0.90 0.93 0.00 0.00 125 N 7.77 4.78 0.00 2.80 2.75 0.00 0.00 6.46 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 8.05 5.38 0.00 3.13 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 0.00 127 K 8.08 4.58 0.00 1.45 1.41 0.00 1.57 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.24 1.25 7.81 128 L 8.30 5.74 0.00 1.66 1.23 0.87 0.87 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 0.00 129 D 8.29 4.77 0.00 2.66 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 0.00 130 V 8.33 4.65 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 8.88 4.71 0.00 1.73 1.65 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.46 7.81 132 K 8.63 4.86 0.00 1.78 1.72 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.23 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.48 7.81 133 V 8.86 4.61 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 0.64 0.00 0.00 0.94 0.00 0.00 134 A 8.74 4.31 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 9.12 4.61 0.00 2.69 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 4.37 0.00 2.08 2.11 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 2.03 2.12 0.00 137 E 8.53 4.10 0.00 2.09 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 2.35 2.26 0.00 138 G 8.37 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 0.00 0.00 0.00 139 G 8.74 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 8.48 5.20 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 2.20 2.31 0.00 141 R 9.25 4.81 0.00 1.67 1.78 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 1.53 1.54 0.00 142 A 8.55 5.08 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 8.80 4.21 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.94 0.00 0.00 144 I 8.41 4.95 2.00 0.00 0.00 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 1.42 0.83 1.00 0.00 0.00 145 T 8.76 4.49 4.41 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 1.18 0.00 0.00 146 L 8.56 4.73 0.00 1.65 1.96 1.01 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 0.00 147 D 8.69 4.74 0.00 2.63 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 0.00 148 G 8.48 4.73 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 0.00 0.00 0.00 149 K 8.91 4.31 0.00 1.93 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 1.46 7.81 150 Y 8.61 4.78 0.00 2.52 2.93 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 0.00 151 L 8.56 4.47 0.00 1.43 1.39 0.87 0.81 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 4.55 0.00 2.02 1.88 0.00 3.47 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.87 0.00 153 T 8.65 4.48 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 1.29 0.00 0.00 154 K 8.48 4.72 0.00 1.76 1.73 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.42 7.81 155 P 0.00 4.42 0.00 2.02 1.93 0.00 3.66 0.00 0.00 3.74 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 7.67 4.50 0.00 3.09 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