NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1620 8.1727 122.0507 56.3052 34.1377 174.1658 2 V 4.5944 8.1592 126.8864 60.5924 32.2556 174.4342 3 F 4.4364 9.8041 128.6353 57.7026 40.0603 174.7400 4 E 4.2289 9.0318 120.9911 55.2132 31.3187 176.2616 5 R 3.1706 8.8685 119.0131 61.1779 29.8811 179.2168 6 C 4.2891 7.9882 115.3705 59.7700 34.9010 175.7385 7 E 3.8866 8.1057 120.6705 59.3233 29.2255 178.5697 8 L 3.6920 8.2083 120.3564 57.6722 41.9925 178.5751 9 A 3.9405 7.8895 120.8472 55.4694 18.3483 179.9476 10 R 3.9373 7.9880 116.4288 59.5672 29.8520 179.4686 11 T 3.9172 7.5160 114.6920 66.5061 68.7357 176.4674 12 L 3.9806 8.1888 121.3268 57.6036 41.8189 179.3206 13 K 3.9152 8.3673 120.0017 59.7157 31.8850 179.0123 14 R 4.0498 8.3079 117.4866 58.3657 29.9754 177.8874 15 L 4.4675 7.5832 117.0834 53.9225 41.8496 176.6280 16 G 3.8269 7.8737 106.3624 46.9724 0.0000 174.9104 17 M 4.0534 7.8027 120.0714 55.7094 32.8598 175.4231 18 D 4.3247 8.0295 117.6195 55.6649 40.9254 175.5699 19 G 3.8947 9.3717 115.3317 45.6068 0.0000 171.0896 20 Y 4.1732 8.1569 121.3760 58.6132 38.7758 176.5391 21 R 3.3420 9.0639 127.5293 57.2858 27.6606 177.5081 22 G 3.8311 8.3476 104.4877 45.4960 0.0000 174.1112 23 I 4.0324 7.5598 122.2085 59.5573 37.5549 175.9510 24 S 4.6939 8.3543 120.9466 58.0596 65.0131 174.8418 25 L 4.2272 8.7126 123.0952 58.0938 41.8349 178.7670 26 A 4.1796 8.1123 120.6068 55.1971 18.3842 179.1575 27 N 4.4507 8.0541 115.0951 56.4573 38.6756 177.7037 28 W 4.3096 7.9046 120.3957 59.9578 29.0721 178.6329 29 M 4.1722 8.3747 118.7570 58.5522 31.4044 177.7827 30 C 3.1534 8.0462 118.6155 59.2043 41.4403 175.4023 31 L 4.0050 8.1746 121.5362 58.2794 41.7427 178.8300 32 A 4.3030 8.2230 122.0383 54.3713 18.2821 179.3067 33 K 2.6594 8.4449 118.4195 59.4202 32.0071 179.1670 34 W 4.0974 7.8494 117.7832 59.4618 29.0517 178.2263 35 E 4.3673 8.6104 118.8164 58.8025 29.0727 178.0204 36 S 4.4834 8.1745 108.6555 57.4955 66.2968 174.4959 37 G 3.1554 8.0856 109.1686 47.0935 0.0000 173.8076 38 Y 3.6670 7.6361 113.3179 58.3663 35.6364 168.3773 39 N 5.1833 7.6180 119.8317 52.5623 39.8701 175.9851 40 T 4.2890 8.8238 116.2967 63.6219 69.4106 176.1188 41 R 4.3865 8.4826 119.9602 56.0377 30.7072 176.3579 42 A 4.3466 7.5212 120.9743 52.4379 19.4452 176.9938 43 T 5.5268 8.2267 111.0698 60.1378 72.2289 172.6773 44 N 4.9440 8.5820 122.8401 51.9218 41.8953 172.4953 45 Y 4.7697 8.7877 127.5537 57.5527 40.3569 174.8725 46 N 4.6777 8.4410 122.9533 50.6471 39.1694 174.8586 47 A 3.4792 8.1296 126.6892 54.6028 19.0853 179.6042 48 G 3.7028 8.1070 104.3786 48.4019 0.0000 174.1509 49 D 4.7567 7.6832 115.8679 51.7975 39.9335 175.6927 50 R 3.7998 7.9368 117.0700 58.1273 28.0380 175.4253 51 S 5.0232 7.5740 110.2034 56.8664 67.2566 172.9015 52 T 5.1132 9.0249 115.6652 61.9811 72.9019 172.9096 53 D 5.3742 9.1113 125.3538 53.2658 42.9595 174.9905 54 Y 4.9205 9.6458 121.5685 57.5390 41.2300 177.0819 55 G 3.8341 9.1209 112.0947 44.4123 0.0000 173.3669 56 I 4.1272 8.0651 116.3005 62.7851 37.8851 177.6356 57 F 4.7622 7.8414 115.8165 56.4621 40.3826 175.0325 58 Q 3.5421 7.9185 119.1832 57.0433 26.4546 173.9326 59 I 4.4433 8.5394 119.5626 60.7724 39.0738 177.0968 60 N 5.2580 9.2653 126.6755 53.7711 39.5898 175.7422 61 S 4.6924 9.4157 120.9780 60.4414 63.4093 175.5022 62 R 3.7591 8.8203 122.0761 58.6739 30.4370 177.8022 63 Y 4.2410 7.9540 114.8060 57.9314 40.5448 176.8509 64 W 5.2391 7.9694 118.3898 57.5052 30.9499 174.1546 65 C 5.9591 8.0580 112.5699 52.9827 46.1794 172.4419 66 N 5.2257 9.0058 120.1279 52.4197 39.8565 174.8739 67 D 4.7545 8.7101 123.5604 52.2025 40.5136 176.8732 68 G 4.0073 9.3090 108.0617 46.0997 0.0000 174.1386 69 K 4.6438 8.1395 117.8428 56.7074 33.2158 176.0952 70 T 4.6627 7.8614 116.2757 61.7644 70.5417 171.9490 71 P 4.1657 0.0000 0.0000 64.4430 31.6860 176.3299 72 G 3.9513 8.7828 110.8404 46.1985 0.0000 173.0040 73 A 4.2710 7.3898 119.7069 51.3714 19.4578 177.1927 74 I 4.4237 8.4502 119.1278 58.9711 41.8733 175.1498 75 N 4.9597 8.0419 121.0221 51.6206 37.6878 174.2921 76 A 3.9496 9.1179 125.4234 55.0459 19.0881 178.4448 77 C 4.6461 8.5133 110.4886 57.0846 40.8658 173.1495 78 H 4.1281 7.8453 116.6362 56.7154 26.6557 174.4663 79 L 4.8501 7.5072 116.5836 52.7200 46.2998 176.6725 80 S 4.6575 8.3956 115.9560 58.1339 63.2526 176.0005 81 C 4.1182 8.6393 124.2264 59.7115 38.8365 176.3459 82 S 3.8719 7.7846 114.4318 61.2970 61.6286 175.9858 83 A 4.1211 7.7625 122.4110 54.3752 18.1335 178.5012 84 L 4.4804 7.6272 115.5243 55.0093 41.9413 177.0588 85 L 5.4182 7.3729 117.2544 53.7243 42.3680 176.6720 86 Q 4.3693 7.7931 117.7071 55.3870 29.5377 175.9901 87 D 4.4072 8.5027 119.6990 57.0217 41.1595 176.7508 88 N 4.5804 8.0482 118.2396 53.1741 39.2723 174.6914 89 I 4.2446 8.4103 118.6962 60.9954 38.0997 176.9922 90 A 3.9507 7.8736 124.9647 55.9229 18.1896 179.9958 91 D 4.3045 8.0737 116.5292 57.3487 40.9158 178.6906 92 A 4.1065 7.9473 120.9458 55.1213 18.4355 179.7112 93 V 3.4061 8.2935 117.0430 66.0090 31.5987 178.1007 94 A 3.8388 8.0354 120.5696 55.2576 18.0931 178.8535 95 C 4.2545 8.3732 116.8041 59.7509 44.6667 175.6937 96 A 3.9355 8.3696 122.8021 54.8386 17.5630 179.8692 97 K 3.8509 7.7065 116.7115 59.4657 32.3344 179.1216 98 R 4.0856 7.8573 119.0348 59.3470 29.9818 178.6020 99 V 2.4363 7.6966 118.2172 65.8199 30.9263 178.2219 100 V 3.8355 7.9170 110.5894 63.0560 31.2283 177.7921 101 R 4.2657 7.5836 116.5857 56.5087 30.5012 176.1928 102 D 4.7744 7.5227 119.9202 52.4590 42.2414 175.5145 103 P 4.2151 0.0000 0.0000 66.1817 31.5948 178.3995 104 Q 4.0346 8.1281 116.1889 56.7333 30.0401 177.4516 105 G 3.6993 7.7379 106.7901 47.1087 0.0000 176.8600 106 I 3.4996 7.7374 122.4033 63.0713 37.8714 177.8636 107 R 4.1144 7.2739 117.7462 58.4818 30.0524 177.4661 108 A 3.8545 7.5687 120.8056 54.3881 18.5879 177.6508 109 W 4.6160 7.9865 116.9545 55.5420 29.8168 177.5651 110 V 3.7319 8.7228 123.6859 65.9703 30.9961 177.5664 111 A 4.0122 8.3419 120.1716 54.8973 18.1536 179.3023 112 W 3.9694 8.3548 126.4490 60.6225 30.5975 178.4221 113 R 3.6270 8.1944 116.3538 59.2492 29.6552 178.3442 114 N 4.3366 8.1367 115.0145 55.8680 38.7248 176.8802 115 R 4.0549 7.5886 115.4522 55.8161 31.2075 175.9819 116 C 4.5188 7.0367 115.0017 57.7400 42.5779 174.2183 117 Q 3.1212 6.9218 119.9970 57.2927 28.8084 175.7629 118 N 4.1278 8.5395 121.6388 54.5750 36.2510 173.3442 119 R 4.5701 7.2731 113.5288 54.2292 34.2373 175.7633 120 D 4.5860 8.4182 118.5879 53.9322 39.8292 175.8390 121 V 4.5410 8.0901 117.6013 61.3187 32.6890 178.3919 122 R 3.9761 7.9307 121.1412 59.6042 29.6991 178.4545 123 Q 3.8915 8.1533 115.2396 60.0426 28.1467 178.6967 124 Y 4.3562 7.7785 117.1425 59.7151 37.8259 176.8094 125 V 4.4103 8.0018 111.6158 60.8476 32.6888 175.3753 126 Q 4.1022 7.9557 119.9424 56.8818 29.0523 176.8415 127 G 3.9925 8.8541 109.7778 46.0553 0.0000 174.7936 128 C 4.4020 7.8009 115.5106 57.0958 40.5131 173.9930 129 G 3.8797 8.2222 107.2454 46.6833 0.0000 174.1636 130 V 4.0164 7.8618 118.0942 61.1005 32.1697 175.7796 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 K 8.17 4.16 0.00 2.00 1.63 0.00 1.25 0.00 0.00 0.94 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.01 1.18 7.81 2 V 8.16 4.59 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 0.92 0.00 0.00 0.95 0.00 0.00 3 F 9.80 4.44 0.00 2.98 2.79 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 4 E 9.03 4.23 0.00 1.93 1.85 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 2.28 2.38 0.00 5 R 8.87 3.17 0.00 1.89 1.85 0.00 3.44 0.00 0.00 3.46 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 6 C 7.99 4.29 0.00 2.99 3.11 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 0.00 0.00 0.00 7 E 8.11 3.89 0.00 2.04 2.31 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 2.52 2.39 0.00 8 L 8.21 3.69 0.00 1.37 1.39 -0.05 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.89 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 10 R 7.99 3.94 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.30 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 11 T 7.52 3.92 4.30 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 1.25 0.00 0.00 12 L 8.19 3.98 0.00 1.75 1.58 0.92 0.43 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 13 K 8.37 3.92 0.00 1.91 1.92 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.45 1.51 7.81 14 R 8.31 4.05 0.00 1.95 1.97 0.00 3.20 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 15 L 7.58 4.47 0.00 1.64 1.56 0.88 0.67 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 16 G 7.87 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 17 M 7.80 4.05 0.00 1.42 1.98 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 18 D 8.03 4.32 0.00 2.69 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.37 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 20 Y 8.16 4.17 0.00 3.35 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 21 R 9.06 3.34 0.00 1.79 1.80 0.00 3.29 0.00 0.00 2.97 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.18 0.00 22 G 8.35 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 23 I 7.56 4.03 1.72 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.75 -0.01 0.00 0.00 24 S 8.35 4.69 0.00 4.12 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 25 L 8.71 4.23 0.00 2.03 1.81 0.98 1.01 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 26 A 8.11 4.18 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.05 4.45 0.00 2.77 2.81 0.00 0.00 7.05 7.52 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 28 W 7.90 4.31 0.00 3.49 3.10 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 0.00 0.00 0.00 29 M 8.37 4.17 0.00 2.20 2.37 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 2.72 2.94 0.00 30 C 8.05 3.15 0.00 2.60 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 31 L 8.17 4.01 0.00 1.81 1.87 0.77 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.22 4.30 1.49 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 0.00 0.00 0.00 33 K 8.44 2.66 0.00 1.64 1.51 0.00 0.61 0.00 0.00 0.75 0.00 0.00 2.80 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.22 0.27 7.81 34 W 7.85 4.10 0.00 3.42 3.31 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 35 E 8.61 4.37 0.00 2.00 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 2.57 2.41 0.00 36 S 8.17 4.48 0.00 4.05 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 37 G 8.09 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 0.00 0.00 0.00 38 Y 7.64 3.67 0.00 3.28 2.97 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 39 N 7.62 5.18 0.00 2.75 2.80 0.00 0.00 7.00 6.95 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 40 T 8.82 4.29 4.43 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 1.41 0.00 0.00 41 R 8.48 4.39 0.00 1.98 2.03 0.00 3.18 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 42 A 7.52 4.35 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 43 T 8.23 5.53 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 1.22 0.00 0.00 44 N 8.58 4.94 0.00 2.85 2.77 0.00 0.00 6.85 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 8.79 4.77 0.00 2.90 2.84 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 46 N 8.44 4.68 0.00 2.54 2.56 0.00 0.00 6.93 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 47 A 8.13 3.48 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 48 G 8.11 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.68 4.76 0.00 2.71 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 50 R 7.94 3.80 0.00 2.01 2.16 0.00 3.13 0.00 0.00 3.34 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.57 0.00 51 S 7.57 5.02 0.00 3.95 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 9.02 5.11 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 0.69 0.00 0.00 53 D 9.11 5.37 0.00 2.65 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 54 Y 9.65 4.92 0.00 2.90 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 55 G 9.12 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 56 I 8.07 4.13 1.66 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 0.89 1.97 0.06 0.00 0.00 57 F 7.84 4.76 0.00 3.16 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 58 Q 7.92 3.54 0.00 2.52 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.70 0.00 59 I 8.54 4.44 2.16 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.07 1.16 0.00 0.00 60 N 9.27 5.26 0.00 3.03 3.09 0.00 0.00 6.96 7.31 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 61 S 9.42 4.69 0.00 4.05 4.45 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 62 R 8.82 3.76 0.00 1.63 1.59 0.00 2.65 0.00 0.00 2.77 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.00 0.00 63 Y 7.95 4.24 0.00 1.55 1.75 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 64 W 7.97 5.24 0.00 3.42 3.32 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 65 C 8.06 5.96 0.00 3.16 3.21 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 66 N 9.01 5.23 0.00 2.87 2.71 0.00 0.00 6.83 8.05 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 67 D 8.71 4.75 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 68 G 9.31 4.01 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 69 K 8.14 4.64 0.00 1.83 1.86 0.00 1.56 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.45 7.81 70 T 7.86 4.66 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 1.21 0.00 0.00 71 P 0.00 4.17 0.00 2.00 2.00 0.00 3.82 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 72 G 8.78 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 73 A 7.39 4.27 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 74 I 8.45 4.42 1.75 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 1.02 0.77 0.83 0.00 0.00 75 N 8.04 4.96 0.00 2.79 2.56 0.00 0.00 6.75 8.75 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 76 A 9.12 3.95 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 77 C 8.51 4.65 0.00 3.33 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 78 H 7.85 4.13 0.00 3.27 3.35 0.00 5.79 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.51 4.85 0.00 1.69 1.51 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.40 4.66 0.00 3.83 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 81 C 8.64 4.12 0.00 2.31 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 82 S 7.78 3.87 0.00 3.87 3.82 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 83 A 7.76 4.12 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 84 L 7.63 4.48 0.00 1.85 1.86 1.15 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.37 5.42 0.00 1.78 1.71 1.13 1.10 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 86 Q 7.79 4.37 0.00 2.23 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.44 7.11 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 87 D 8.50 4.41 0.00 2.62 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 88 N 8.05 4.58 0.00 2.69 2.74 0.00 0.00 6.93 7.94 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 89 I 8.41 4.24 1.74 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.98 0.97 0.00 0.00 90 A 7.87 3.95 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 91 D 8.07 4.30 0.00 2.75 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 92 A 7.95 4.11 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 93 V 8.29 3.41 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.85 0.00 0.00 94 A 8.04 3.84 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 95 C 8.37 4.25 0.00 3.18 3.33 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 96 A 8.37 3.94 0.79 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 0.00 0.00 97 K 7.71 3.85 0.00 1.63 1.39 0.00 1.30 0.00 0.00 0.95 0.00 0.00 2.30 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 0.85 7.81 98 R 7.86 4.09 0.00 2.00 2.16 0.00 3.29 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.99 0.00 99 V 7.70 2.44 1.79 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 -0.40 0.00 0.00 -0.52 0.00 0.00 100 V 7.92 3.84 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 1.14 0.00 0.00 1.45 0.00 0.00 101 R 7.58 4.27 0.00 2.04 2.04 0.00 3.24 0.00 0.00 3.42 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.15 0.00 102 D 7.52 4.77 0.00 3.04 2.61 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 0.00 103 P 0.00 4.22 0.00 2.01 2.13 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 104 Q 8.13 4.03 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.79 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.74 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 7.74 3.50 0.96 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.34 -0.63 0.00 0.00 107 R 7.27 4.11 0.00 2.09 2.04 0.00 3.25 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.61 0.00 108 A 7.57 3.85 0.77 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 0.00 0.00 109 W 7.99 4.62 0.00 3.53 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 0.00 110 V 8.72 3.73 2.17 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 1.20 0.00 0.00 0.99 0.00 0.00 111 A 8.34 4.01 1.54 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 0.00 0.00 112 W 8.35 3.97 0.00 3.47 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 R 8.19 3.63 0.00 1.98 1.97 0.00 3.34 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.17 0.00 114 N 8.14 4.34 0.00 2.66 2.71 0.00 0.00 6.95 8.38 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 0.00 115 R 7.59 4.05 0.00 0.82 0.66 0.00 2.21 0.00 0.00 2.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.98 0.00 116 C 7.04 4.52 0.00 1.58 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 0.00 117 Q 6.92 3.12 0.00 0.93 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.73 0.00 0.00 0.00 0.00 0.00 2.15 2.11 0.00 118 N 8.54 4.13 0.00 2.76 2.79 0.00 0.00 6.83 7.66 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 0.00 119 R 7.27 4.57 0.00 1.80 1.78 0.00 3.14 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.43 0.00 120 D 8.42 4.59 0.00 2.64 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 8.09 4.54 2.39 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 0.93 0.00 0.00 1.06 0.00 0.00 122 R 7.93 3.98 0.00 1.89 2.02 0.00 3.18 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 123 Q 8.15 3.89 0.00 1.94 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.12 0.00 0.00 0.00 0.00 0.00 2.28 1.72 0.00 124 Y 7.78 4.36 0.00 3.23 3.17 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 0.00 125 V 8.00 4.41 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 0.97 0.00 0.00 1.10 0.00 0.00 126 Q 7.96 4.10 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.76 0.00 0.00 0.00 0.00 0.00 2.54 2.29 0.00 127 G 8.85 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 7.80 4.40 0.00 3.12 3.15 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 0.00 129 G 8.22 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 0.00 130 V 7.86 4.02 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 0.81 0.00 0.00 0.96 0.00 0.00