NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4734 8.1776 115.2902 57.8842 63.6621 174.5171 3 V 3.3706 8.2776 128.4083 64.5923 31.1314 176.8072 4 Y 4.0003 8.5815 118.3742 60.9407 38.0233 178.8672 5 D 4.4184 7.8740 119.0565 57.1135 41.1848 178.3440 6 A 4.0750 8.1475 121.2695 55.0904 18.4771 179.5717 7 A 3.8869 8.1550 119.0573 55.0515 18.1837 179.5444 8 A 4.0819 7.5818 117.7205 54.6638 18.5198 179.1332 9 Q 4.2417 7.7334 115.2896 56.7724 29.9966 177.1224 10 L 4.2215 7.3267 121.3439 53.6822 40.1334 176.9695 11 T 4.2011 7.6506 114.6566 60.4118 71.5394 175.0311 12 A 3.9474 8.4510 121.9465 55.7010 18.2065 179.5277 13 D 4.2926 7.9848 116.7065 57.3952 40.9542 179.0463 14 V 3.5178 7.4015 117.4644 65.8497 31.5141 178.2561 15 K 3.8653 8.2420 118.5494 59.2561 31.7964 179.2692 16 K 3.9801 8.0686 119.9462 59.6601 32.1377 178.6965 17 D 4.6210 8.1581 119.2430 57.2252 40.6321 178.8296 18 L 3.7200 7.9765 119.6234 57.7588 41.5827 179.7566 19 R 4.0591 8.1214 118.0079 59.4119 30.3538 178.8671 20 D 4.4781 8.6588 119.3923 57.4763 40.8691 179.0274 21 S 3.1345 8.3093 114.7568 60.6631 63.0701 176.3077 22 W 4.3762 8.6896 132.1499 60.1053 30.2018 177.7000 23 K 3.7387 7.9430 119.1312 59.1061 31.6879 178.5341 24 V 3.7457 6.8693 116.8323 65.5625 31.8850 178.1633 25 I 3.6717 7.3835 112.6515 63.2304 37.2636 177.5110 26 G 2.1251 6.9363 105.9930 45.0890 0.0000 175.0713 27 S 4.2796 7.1497 115.4025 59.2850 64.6829 174.0252 28 D 4.6424 7.1559 121.2049 51.2267 41.1760 175.4207 29 K 3.8109 7.9388 123.0210 58.6590 32.5191 178.4734 30 K 4.0072 7.9409 119.5391 59.3579 32.3587 178.9595 31 G 3.6720 8.0221 106.7072 47.6175 0.0000 175.3399 32 N 4.4717 8.3804 119.9123 55.1721 38.6087 178.0464 33 G 3.4824 8.0488 107.6123 47.7922 0.0000 176.0997 34 V 3.5962 7.7404 120.6762 65.3666 31.4785 177.9771 35 A 3.9097 7.7934 120.6368 54.9608 18.2119 179.5547 36 L 3.7620 7.8568 117.4225 58.1821 41.7026 179.7507 37 M 3.4636 7.6619 118.3633 58.4072 31.9418 179.0443 38 T 3.9566 7.8987 109.9004 64.9407 68.7792 176.8140 39 T 3.8542 7.7201 118.8267 66.0760 68.3777 176.4560 40 L 3.8034 7.5676 122.2766 58.3322 41.8795 179.2417 41 F 4.5382 7.4584 115.8491 60.2681 38.8082 177.2661 42 A 4.2221 7.7145 119.9126 55.0029 18.4788 178.8938 43 D 4.6190 8.2979 116.2003 55.4055 42.7543 176.8147 44 N 5.1771 8.4003 116.5664 50.2623 39.2166 174.5909 45 Q 4.2372 8.2732 120.7305 59.0055 29.0794 178.0803 46 E 4.2212 8.2365 116.2823 58.1794 29.9752 177.8532 47 T 4.6319 8.1773 110.5718 62.8296 69.6173 176.5083 48 I 3.8195 7.8912 123.7600 64.5180 36.8429 178.0640 49 G 3.6655 8.0819 107.4320 48.8040 0.0000 174.2201 50 Y 4.2550 7.5952 116.3704 60.3787 38.0971 176.5160 51 F 4.8046 8.1987 118.4760 56.8956 39.9211 177.8742 52 K 3.8216 8.3946 124.5104 59.7209 32.0296 178.4951 53 R 3.9867 7.9844 117.3511 59.1201 30.0991 177.0982 54 L 4.2312 7.9320 116.3039 55.2645 42.7758 178.9773 55 G 3.8405 7.6260 106.0692 46.5173 0.0000 176.7369 56 N 4.5289 8.4392 120.4021 52.6987 38.3662 175.5219 57 V 3.7974 7.9285 121.1311 63.0520 31.6418 177.6317 58 S 4.3291 7.8114 112.9364 60.5173 63.1272 175.6895 59 Q 4.1596 8.1368 121.2707 55.7689 28.9322 177.2226 60 G 3.8054 8.6561 109.5672 46.3805 0.0000 177.0646 61 M 3.9850 8.9484 122.9280 58.0820 31.9882 176.9367 62 A 4.0125 7.6394 120.3042 53.9007 18.8806 177.2800 63 N 4.6129 8.2107 115.2932 52.7050 39.3786 175.0305 64 D 4.3860 8.6821 129.2145 57.5539 41.0391 178.9970 65 K 4.0437 8.1201 118.4518 59.2646 32.1191 179.0530 66 L 4.0471 8.6595 121.1004 58.1232 42.0213 179.0215 67 R 4.0428 8.3631 119.0105 59.3372 30.1596 178.7580 68 G 3.6317 8.3409 105.6846 47.9568 0.0000 175.2036 69 H 4.2184 8.4498 120.7088 59.1851 29.8215 177.5308 70 S 4.0737 8.5670 117.3532 61.6643 62.4321 176.8192 71 I 3.7490 7.7150 121.3013 64.8189 37.3158 178.3573 72 T 4.1980 7.9189 116.1824 66.5110 68.2736 176.4406 73 L 3.8729 8.0719 122.4379 58.4335 42.1034 179.0230 74 M 4.1990 7.8061 118.4464 58.2698 31.8358 177.9761 75 Y 4.0996 7.8870 115.8828 59.8894 38.1204 177.7556 76 A 3.5789 7.6093 122.3735 54.8044 18.3633 179.6348 77 L 3.6040 7.3774 117.0174 57.6266 41.6748 179.2475 78 Q 3.4588 7.8111 119.5353 58.8777 28.7449 177.7909 79 N 4.2639 7.6704 116.9167 56.8251 39.4018 176.3229 80 F 4.6333 7.6133 118.8937 60.9254 39.1374 177.7531 81 I 3.5532 7.6282 119.1748 64.5141 36.6383 178.2601 82 D 4.4990 8.1093 118.2137 56.4836 40.9373 177.6880 83 Q 4.4466 7.7411 117.0906 55.8667 28.8689 177.2601 84 L 3.9958 7.5768 120.7878 57.8824 41.6516 178.2528 85 D 4.3509 8.0822 117.5864 56.1118 41.2790 175.8923 86 N 4.8364 8.1000 117.0456 50.3951 40.8735 172.5304 87 P 4.2600 0.0000 0.0000 66.2546 31.1688 177.9922 88 D 4.4177 8.2244 118.0596 57.1669 40.6123 178.3595 89 D 4.4380 8.2036 119.0583 56.8092 40.9770 178.3788 90 L 3.9673 8.0184 121.0449 58.1003 42.0711 179.1597 91 V 3.4104 8.0018 118.7334 66.1073 30.9948 177.8150 92 C 4.1555 7.9585 113.7816 61.1767 29.5071 176.1794 93 V 3.7380 7.7323 114.7394 63.8521 31.1733 178.6239 94 V 3.8334 8.0747 118.3091 66.1972 31.4619 178.0430 95 E 3.9178 8.4017 118.2516 58.7927 28.6512 179.3557 96 K 3.8217 7.5778 119.5301 59.6124 31.9450 179.0048 97 F 4.7320 8.3540 118.8688 59.5913 38.7689 177.6554 98 A 3.9593 8.2927 121.1582 55.1729 18.2068 179.7238 99 V 3.5824 7.7453 116.5388 66.3101 31.3031 177.9386 100 N 4.3747 7.9502 115.2700 56.2870 38.3400 176.5829 101 H 4.4478 7.9275 116.5557 57.7234 29.4005 177.5827 102 I 3.7519 8.2044 122.5525 64.5152 36.7237 178.3337 103 T 4.0760 7.8108 109.0427 63.7100 68.7296 175.7927 104 R 4.3583 7.5711 118.8456 54.9298 30.6583 175.7812 105 K 3.8548 7.7949 117.0553 57.5391 29.9199 175.5508 106 I 4.0384 7.6236 120.0034 60.0368 38.1749 177.1371 107 S 4.5673 8.3612 120.6116 57.0819 65.8449 174.9967 108 A 3.9824 8.3967 122.6931 55.2046 17.8410 179.5677 109 A 3.9804 7.9343 117.6876 55.5680 18.9444 179.3400 110 E 4.1484 8.1725 116.6638 59.2905 29.6026 179.2926 111 F 4.1712 8.6128 121.1971 61.0657 39.4551 177.2110 112 G 3.8331 8.3614 104.8343 46.7767 0.0000 175.1933 113 K 4.1984 7.8702 120.2940 58.3428 32.0452 177.7053 114 M 3.9988 7.6928 117.8544 56.5385 32.1652 177.3403 115 N 4.4928 8.2634 117.0265 56.7482 38.6954 177.3295 116 G 3.5824 7.5934 106.9131 47.4996 0.0000 173.9676 117 P 4.2199 0.0000 0.0000 65.0342 31.2665 178.8242 118 I 3.4969 7.6382 118.6262 64.0824 36.9176 178.3247 119 K 3.9192 8.2316 120.6605 59.5069 32.0270 179.0204 120 K 3.9443 8.0495 118.7053 59.4900 31.6960 179.5959 121 V 3.5504 7.9735 118.7669 65.7832 31.3652 178.1348 122 L 3.9122 8.1210 118.7637 57.7980 41.5212 179.3131 123 A 4.2870 8.5586 122.4367 54.5269 18.0666 179.6011 124 S 4.2762 8.0205 111.5162 60.2728 63.1301 175.7530 125 K 4.4428 7.0855 120.5475 55.4985 32.3672 175.2668 126 N 4.1548 8.0633 116.1899 54.7259 37.3908 173.8415 127 F 4.4742 8.3306 115.9578 55.1006 40.7365 176.0124 128 G 4.3580 8.6103 114.7597 43.9826 0.0000 172.0874 129 D 4.4975 8.9185 118.7084 57.6698 40.6068 178.7390 130 K 3.7804 8.1873 119.2552 60.0344 32.1026 178.2451 131 Y 4.1199 8.1569 116.4909 60.8990 37.8756 177.9452 132 A 4.2327 8.2828 121.3514 55.4588 18.4106 179.3179 133 N 4.3905 8.7948 115.1805 56.2461 38.0781 177.5953 134 A 3.9522 7.8121 122.5387 54.9981 18.4622 179.7945 135 W 3.9165 8.5516 117.2328 59.5950 29.1000 178.6734 136 A 4.1211 8.2381 121.0279 55.0568 17.5439 179.8407 137 K 3.9713 7.6987 116.4553 59.2479 32.3559 179.0969 138 L 3.9381 7.4726 120.2431 58.0345 42.0355 179.1217 139 V 3.7457 8.1245 118.0832 65.9573 31.4571 177.8188 140 A 4.5632 8.0617 121.8313 54.3651 17.8692 179.8460 141 V 3.3987 7.2860 116.5035 66.0693 31.8896 178.1301 142 V 3.4851 7.4739 117.5453 65.9430 31.4290 177.7648 143 Q 3.8338 8.1178 117.6083 58.8850 28.3231 178.7053 144 A 4.0488 7.8095 120.2613 54.0001 18.4569 178.3728 145 A 4.3506 7.5052 117.2212 52.0485 19.4967 177.0656 146 L 4.1256 7.4201 122.9030 54.7283 41.8643 176.4734 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 2 S 8.18 4.47 0.00 3.92 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 3 V 8.28 3.37 1.88 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 0.15 0.00 0.00 0.72 0.00 0.00 4 Y 8.58 4.00 0.00 3.03 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 5 D 7.87 4.42 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 6 A 8.15 4.08 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 7 A 8.15 3.89 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 8 A 7.58 4.08 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 9 Q 7.73 4.24 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.26 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 10 L 7.33 4.22 0.00 1.68 1.53 0.78 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.65 4.20 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 1.18 0.00 0.00 12 A 8.45 3.95 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 13 D 7.98 4.29 0.00 2.66 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 14 V 7.40 3.52 2.13 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 0.91 0.00 0.00 0.87 0.00 0.00 15 K 8.24 3.87 0.00 1.94 1.80 0.00 1.68 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.53 7.81 16 K 8.07 3.98 0.00 2.01 1.95 0.00 1.56 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.77 7.81 17 D 8.16 4.62 0.00 2.83 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 18 L 7.98 3.72 0.00 1.64 1.23 0.55 -0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.12 4.06 0.00 2.05 2.06 0.00 3.16 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 20 D 8.66 4.48 0.00 2.97 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 21 S 8.31 3.13 0.00 3.56 3.61 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 0.00 22 W 8.69 4.38 0.00 3.81 3.39 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 23 K 7.94 3.74 0.00 1.85 2.01 0.00 1.87 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.44 7.81 24 V 6.87 3.75 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 1.04 0.00 0.00 1.07 0.00 0.00 25 I 7.38 3.67 1.56 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.20 0.64 0.00 0.00 26 G 6.94 2.13 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 0.00 0.00 0.00 27 S 7.15 4.28 0.00 3.89 3.98 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 0.00 0.00 0.00 28 D 7.16 4.64 0.00 2.73 2.38 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 29 K 7.94 3.81 0.00 1.72 1.68 0.00 1.18 0.00 0.00 0.77 0.00 0.00 2.13 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.23 1.35 7.81 30 K 7.94 4.01 0.00 1.82 1.77 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.50 7.81 31 G 8.02 3.67 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 0.00 32 N 8.38 4.47 0.00 2.67 2.71 0.00 0.00 7.01 8.19 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 33 G 8.05 3.48 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 0.00 0.00 0.00 34 V 7.74 3.60 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 1.06 0.00 0.00 0.95 0.00 0.00 35 A 7.79 3.91 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 36 L 7.86 3.76 0.00 1.76 1.56 0.78 0.64 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 37 M 7.66 3.46 0.00 1.62 1.92 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.71 0.00 38 T 7.90 3.96 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 1.30 0.00 0.00 39 T 7.72 3.85 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 1.15 0.00 0.00 40 L 7.57 3.80 0.00 1.56 1.23 0.87 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.46 4.54 0.00 3.04 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 42 A 7.71 4.22 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 43 D 8.30 4.62 0.00 2.70 2.73 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 44 N 8.40 5.18 0.00 2.96 2.90 0.00 0.00 6.84 7.35 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 45 Q 8.27 4.24 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.95 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 46 E 8.24 4.22 0.00 2.14 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 0.00 2.37 2.37 0.00 47 T 8.18 4.63 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 1.46 0.00 0.00 48 I 7.89 3.82 1.91 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 1.13 1.09 0.69 0.00 0.00 49 G 8.08 3.67 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 0.00 50 Y 7.60 4.25 0.00 2.86 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 51 F 8.20 4.80 0.00 3.16 3.08 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 52 K 8.39 3.82 0.00 1.96 1.84 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.45 7.81 53 R 7.98 3.99 0.00 1.84 2.00 0.00 3.32 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 54 L 7.93 4.23 0.00 1.84 1.76 1.05 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.63 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 0.00 0.00 0.00 56 N 8.44 4.53 0.00 2.83 2.84 0.00 0.00 6.94 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 57 V 7.93 3.80 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 0.58 0.00 0.00 0.30 0.00 0.00 58 S 7.81 4.33 0.00 4.02 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 59 Q 8.14 4.16 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.85 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 60 G 8.66 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 M 8.95 3.99 0.00 1.96 2.11 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.60 0.00 62 A 7.64 4.01 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 63 N 8.21 4.61 0.00 2.79 2.90 0.00 0.00 7.02 7.84 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 64 D 8.68 4.39 0.00 2.74 2.73 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 65 K 8.12 4.04 0.00 1.99 1.91 0.00 1.69 0.00 0.00 1.90 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.52 7.81 66 L 8.66 4.05 0.00 1.79 1.88 1.06 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.36 4.04 0.00 2.06 2.05 0.00 3.16 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 68 G 8.34 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 H 8.45 4.22 0.00 3.39 3.65 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 S 8.57 4.07 0.00 4.00 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 71 I 7.72 3.75 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.66 1.15 0.00 0.00 72 T 7.92 4.20 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 1.29 0.00 0.00 73 L 8.07 3.87 0.00 1.65 1.76 0.89 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 74 M 7.81 4.20 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.85 0.00 75 Y 7.89 4.10 0.00 3.24 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 76 A 7.61 3.58 0.46 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 0.00 0.00 77 L 7.38 3.60 0.00 1.55 1.29 0.91 1.09 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 78 Q 7.81 3.46 0.00 2.44 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.78 0.00 0.00 0.00 0.00 0.00 2.55 2.52 0.00 79 N 7.67 4.26 0.00 2.94 2.81 0.00 0.00 7.28 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 80 F 7.61 4.63 0.00 3.10 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 81 I 7.63 3.55 1.59 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.21 0.83 0.00 0.00 82 D 8.11 4.50 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 83 Q 7.74 4.45 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.77 0.00 0.00 0.00 0.00 0.00 2.71 2.62 0.00 84 L 7.58 4.00 0.00 1.59 1.69 0.78 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.08 4.35 0.00 2.67 2.73 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 86 N 8.10 4.84 0.00 2.73 2.67 0.00 0.00 6.81 7.72 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 87 P 0.00 4.26 0.00 2.34 2.31 0.00 3.76 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 88 D 8.22 4.42 0.00 2.88 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 D 8.20 4.44 0.00 2.85 2.73 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 90 L 8.02 3.97 0.00 1.92 1.77 0.85 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.00 3.41 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 0.62 0.00 0.00 0.62 0.00 0.00 92 C 7.96 4.16 0.00 3.16 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 93 V 7.73 3.74 2.35 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 1.03 0.00 0.00 1.28 0.00 0.00 94 V 8.07 3.83 2.14 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 0.93 0.00 0.00 0.52 0.00 0.00 95 E 8.40 3.92 0.00 2.01 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.46 0.00 96 K 7.58 3.82 0.00 1.77 1.65 0.00 0.61 0.00 0.00 1.16 0.00 0.00 2.66 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.23 1.37 7.81 97 F 8.35 4.73 0.00 3.40 3.25 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 98 A 8.29 3.96 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 99 V 7.75 3.58 2.22 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 1.01 0.00 0.00 0.96 0.00 0.00 100 N 7.95 4.37 0.00 3.23 2.90 0.00 0.00 6.95 8.04 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 0.00 101 H 7.93 4.45 0.00 3.37 3.41 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 8.20 3.75 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.04 0.90 0.00 0.00 103 T 7.81 4.08 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 1.24 0.00 0.00 104 R 7.57 4.36 0.00 1.83 1.85 0.00 3.35 0.00 0.00 3.46 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.70 0.00 105 K 7.79 3.85 0.00 2.02 2.00 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.59 7.81 106 I 7.62 4.04 1.98 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 1.29 0.69 0.96 0.00 0.00 107 S 8.36 4.57 0.00 4.07 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 0.00 108 A 8.40 3.98 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 0.00 109 A 7.93 3.98 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 0.00 110 E 8.17 4.15 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 111 F 8.61 4.17 0.00 3.27 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 0.00 112 G 8.36 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 0.00 113 K 7.87 4.20 0.00 1.98 1.88 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.72 7.81 114 M 7.69 4.00 0.00 1.88 1.73 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 115 N 8.26 4.49 0.00 2.93 2.87 0.00 0.00 6.79 7.18 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 0.00 116 G 7.59 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.22 0.00 2.03 2.12 0.00 3.61 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.09 0.00 118 I 7.64 3.50 1.94 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.62 0.62 0.00 0.00 119 K 8.23 3.92 0.00 1.90 1.99 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.53 7.81 120 K 8.05 3.94 0.00 1.94 1.81 0.00 1.77 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.59 7.81 121 V 7.97 3.55 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 0.89 0.00 0.00 0.86 0.00 0.00 122 L 8.12 3.91 0.00 1.97 1.97 0.95 0.47 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 0.00 123 A 8.56 4.29 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 0.00 124 S 8.02 4.28 0.00 4.04 4.08 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 0.00 125 K 7.09 4.44 0.00 1.93 1.95 0.00 1.79 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.65 1.52 7.81 126 N 8.06 4.15 0.00 2.75 2.63 0.00 0.00 6.91 7.05 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 0.00 127 F 8.33 4.47 0.00 3.26 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.61 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 0.00 129 D 8.92 4.50 0.00 2.82 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 0.00 130 K 8.19 3.78 0.00 1.74 1.72 0.00 1.58 0.00 0.00 1.66 0.00 0.00 2.29 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.76 1.30 7.81 131 Y 8.16 4.12 0.00 3.50 3.27 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 0.00 132 A 8.28 4.23 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 0.00 133 N 8.79 4.39 0.00 2.96 2.89 0.00 0.00 6.91 6.61 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 0.00 134 A 7.81 3.95 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 0.00 135 W 8.55 3.92 0.00 3.63 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 0.00 136 A 8.24 4.12 1.46 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 0.00 0.00 137 K 7.70 3.97 0.00 1.79 1.82 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.62 7.81 138 L 7.47 3.94 0.00 1.49 1.71 0.60 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.12 3.75 2.34 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 1.18 0.00 0.00 1.14 0.00 0.00 140 A 8.06 4.56 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 0.00 141 V 7.29 3.40 1.97 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 0.61 0.00 0.00 0.82 0.00 0.00 142 V 7.47 3.49 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 0.25 0.00 0.00 0.78 0.00 0.00 143 Q 8.12 3.83 0.00 2.30 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.63 2.69 0.00 144 A 7.81 4.05 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 0.00 145 A 7.51 4.35 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 0.00 146 L 7.42 4.13 0.00 1.69 1.50 0.46 0.65 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