NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2115 8.2649 123.5671 51.4590 20.5595 176.9666 2 F 4.2852 7.5154 114.6543 58.4127 41.3152 177.5536 3 A 3.8828 7.6129 122.3935 54.6669 20.3945 177.8550 4 G 3.8985 7.9697 101.7282 46.6434 0.0000 173.9943 5 V 4.5909 11.1300 119.0828 61.8804 32.2934 174.7453 6 L 4.6518 7.8853 115.0988 52.0204 45.6606 174.9766 7 N 4.8154 8.5577 119.6033 51.9504 39.9011 175.7943 8 D 4.4390 8.8808 123.4145 57.9536 40.9960 179.5256 9 A 3.9975 7.9484 120.3557 55.1570 18.4964 179.2946 10 D 4.2233 7.9795 116.8823 57.4711 41.0335 178.7420 11 I 3.5222 7.7108 120.0111 64.3536 37.1875 178.1566 12 A 4.0080 7.9479 121.1605 55.3185 18.2274 179.5990 13 A 3.9072 8.0570 118.8798 55.1621 18.2190 179.6973 14 A 3.7810 8.1473 118.5998 55.2394 18.5140 179.5811 15 L 4.2627 8.0739 117.5188 57.9961 41.5802 179.3823 16 E 3.9555 8.3811 119.1159 59.1584 29.3284 178.6795 17 A 4.1198 7.8386 119.9639 53.9961 18.9791 177.6458 18 C 5.2879 7.5712 111.6768 57.1087 30.1951 176.5770 19 K 3.8192 7.8782 122.6003 60.0576 32.1057 178.1305 20 A 4.1236 7.4507 120.2403 51.1321 18.9346 176.5038 21 A 4.0920 8.6010 123.5088 54.2690 18.5812 177.2576 22 D 4.5847 8.8320 121.4196 55.4810 38.7108 174.6236 23 S 4.5812 7.9278 112.7806 57.9413 63.9759 173.8046 24 F 4.2548 8.4825 124.7414 58.4332 39.6557 174.3694 25 N 4.3121 7.2363 124.4218 51.0273 41.6159 174.7263 26 H 2.9251 7.6746 124.7430 58.0124 28.5602 177.4330 27 K 3.8964 7.2858 121.6902 59.0053 32.0384 178.4789 28 A 3.8255 8.0440 121.1335 55.0003 18.2513 179.3206 29 F 3.6903 7.8948 119.2549 61.4895 39.5212 177.2040 30 F 4.5888 8.2271 117.5034 60.6046 38.5655 177.6036 31 A 3.9410 8.0663 120.2353 55.1367 18.0521 179.6300 32 K 3.8043 7.7859 116.9827 59.5097 32.3822 179.0891 33 V 3.6057 7.5564 118.1671 62.7885 31.3569 177.1665 34 G 3.9426 7.5446 107.5704 45.6277 0.0000 174.4872 35 L 4.2448 8.0828 122.4133 57.2905 41.8722 179.5507 36 T 3.8067 8.0644 108.1473 64.0368 68.5513 174.7362 37 S 4.5645 7.8629 113.9601 57.8972 63.7618 174.3438 38 K 4.2951 7.7847 121.3752 55.9277 32.7687 177.6162 39 S 4.3563 8.3935 116.0252 58.1371 65.1464 175.0691 40 A 4.1937 8.6526 124.6958 55.5265 18.0778 179.8093 41 D 4.2807 8.0138 116.1037 57.7266 41.4957 178.0632 42 D 4.4666 8.0883 119.0733 57.1946 40.7815 178.8991 43 V 3.8331 8.4442 119.3240 66.0555 31.5548 178.2520 44 K 4.1026 8.3041 118.2645 59.3404 31.7181 179.4615 45 K 3.9844 8.0568 118.1946 59.4111 32.0018 179.1444 46 A 4.2814 8.3405 121.0166 55.1594 18.2889 179.1842 47 F 3.2158 8.5269 119.0347 61.4397 39.1932 177.2824 48 A 3.7392 7.9310 118.5182 55.0300 18.1260 179.4597 49 I 3.6102 6.9908 117.8422 64.6227 37.2324 178.4541 50 I 4.0618 7.3062 119.3965 63.3502 38.3606 177.3447 51 D 4.5489 7.5861 120.4781 53.3180 38.0346 176.2086 52 Q 3.8897 8.0656 122.6450 58.1235 29.2585 177.3433 53 D 4.5669 8.3150 114.3484 52.3405 40.0072 176.1074 54 K 3.9175 7.6676 118.3129 57.7856 29.9432 176.4407 55 S 4.2678 8.1366 113.5836 59.4607 63.6736 175.3450 56 G 3.8898 9.3225 109.3637 44.7980 0.0000 172.9877 57 F 5.2146 7.6595 116.6147 55.7549 43.6246 174.4415 58 I 4.3897 9.2373 123.0257 60.3918 38.3533 175.8077 59 E 4.5429 8.8855 127.0599 55.1808 31.0946 177.5478 60 E 3.9036 8.9031 121.0660 59.6157 29.2347 178.4796 61 D 4.3574 7.9999 117.8160 56.6927 39.4436 178.0810 62 E 4.0925 8.0893 119.6163 58.8674 29.5496 178.8988 63 L 4.0171 8.0405 120.5735 57.8191 42.0191 178.8606 64 K 4.0228 8.1819 119.8107 58.8399 32.1144 177.6764 65 L 4.5793 7.4076 117.4462 54.3805 41.7492 177.7992 66 F 4.2129 8.1315 123.6783 61.9560 39.2177 177.5384 67 L 3.9673 8.0095 117.5134 57.8026 41.2196 179.2528 68 Q 4.3578 7.8941 116.6836 58.4386 28.6396 178.0130 69 N 4.4200 7.8877 116.6893 55.6355 38.5286 176.7415 70 F 4.7054 8.1583 118.5727 58.2172 39.7657 176.4078 71 K 4.4571 7.6353 119.5967 54.8714 34.5402 175.9244 72 A 4.0972 8.9594 130.4267 55.0051 18.3355 177.3521 73 D 4.7088 7.9663 112.2335 52.9694 39.9191 176.5615 74 A 4.2086 7.7881 123.3107 52.1059 18.9199 178.1739 75 R 4.1248 8.2397 116.1814 55.7351 30.3823 176.3899 76 A 4.4104 8.1571 120.7333 51.6716 19.2681 177.5302 77 L 4.3471 8.5259 120.7656 54.6530 42.6703 177.3378 78 T 4.1735 9.1876 112.8575 61.4028 70.0634 175.3021 79 D 4.4409 8.8524 121.3654 57.2571 40.7168 179.2718 80 G 3.6196 8.0319 105.8697 47.9674 0.0000 175.5033 81 E 4.1007 8.4100 121.4732 59.2630 29.4526 179.6148 82 T 3.9496 8.2048 116.0359 66.6424 68.5495 176.9133 83 K 4.0621 8.3531 120.5615 59.7202 32.0846 179.5416 84 T 3.9290 7.9684 116.0346 66.5909 68.4269 176.4928 85 F 4.4462 8.5350 122.5772 61.2140 39.4625 176.8201 86 L 3.8690 8.4476 120.3740 58.3387 41.7054 179.1519 87 K 4.0917 8.5014 116.9156 59.4509 32.0088 178.9374 88 A 4.2825 8.2570 120.5383 54.5874 18.3637 179.1541 89 G 3.9559 7.7459 102.3707 45.7476 0.0000 174.8539 90 D 4.8409 8.3447 122.3495 53.0143 38.3434 176.4970 91 S 4.1551 8.2704 119.2086 60.4606 63.4792 175.0952 92 D 4.6713 8.1507 116.4826 52.2307 39.7084 176.6718 93 G 3.9316 7.9573 107.8240 46.8496 0.0000 174.2731 94 D 4.4213 8.2658 116.8667 53.2270 39.6816 177.2187 95 G 3.9278 10.2336 108.8799 45.3092 0.0000 172.9930 96 K 4.7373 7.8997 116.5822 55.3762 36.3599 175.3964 97 I 4.8139 8.7861 121.8479 59.8144 39.5090 176.3077 98 G 4.1525 9.5588 115.6177 44.8685 0.0000 174.9302 99 V 2.3817 7.6464 119.1584 64.6147 31.1045 178.1650 100 D 4.3531 7.8113 118.8228 56.6850 40.7957 178.4448 101 E 4.0387 8.0782 119.0275 59.1765 29.5376 178.8626 102 F 4.2367 8.5391 121.0662 61.6730 39.5241 177.2790 103 T 3.7877 8.1765 115.1817 66.5661 68.1817 176.4744 104 A 3.9633 7.9363 122.5114 54.8553 18.1945 179.3265 105 L 3.9433 7.6618 117.9714 58.3307 42.2231 179.2387 106 V 3.0429 7.0392 116.8417 65.6673 31.4868 177.8342 107 K 4.0775 7.8607 116.5648 58.4108 32.2121 176.9050 108 A 4.3039 7.8177 125.4170 52.1614 19.0987 176.4168 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 A 8.26 4.21 0.99 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 2 F 7.52 4.29 0.00 3.19 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 3 A 7.61 3.88 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 4 G 7.97 3.90 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 0.00 0.00 0.00 5 V 11.13 4.59 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 0.97 0.00 0.00 0.97 0.00 0.00 6 L 7.89 4.65 0.00 1.78 1.58 0.87 1.23 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 7 N 8.56 4.82 0.00 2.93 2.96 0.00 0.00 6.04 8.07 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 8 D 8.88 4.44 0.00 2.80 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 9 A 7.95 4.00 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 10 D 7.98 4.22 0.00 2.89 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 11 I 7.71 3.52 1.94 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 1.55 1.16 1.08 0.00 0.00 12 A 7.95 4.01 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 13 A 8.06 3.91 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.15 3.78 0.66 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 15 L 8.07 4.26 0.00 2.11 1.81 1.16 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.38 3.96 0.00 2.03 2.07 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 2.32 2.48 0.00 17 A 7.84 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 18 C 7.57 5.29 0.00 3.18 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 19 K 7.88 3.82 0.00 1.74 1.94 0.00 1.75 0.00 0.00 1.84 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.74 1.56 7.81 20 A 7.45 4.12 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 21 A 8.60 4.09 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 22 D 8.83 4.58 0.00 2.83 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 7.93 4.58 0.00 4.01 4.10 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 24 F 8.48 4.25 0.00 2.96 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 25 N 7.24 4.31 0.00 2.46 2.26 0.00 0.00 6.96 7.89 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 26 H 7.67 2.93 0.00 2.30 2.04 0.00 5.51 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 K 7.29 3.90 0.00 1.71 1.80 0.00 1.63 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.50 7.81 28 A 8.04 3.83 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 29 F 7.89 3.69 0.00 2.76 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 30 F 8.23 4.59 0.00 3.14 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 A 8.07 3.94 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 32 K 7.79 3.80 0.00 1.66 1.57 0.00 1.61 0.00 0.00 1.67 0.00 0.00 3.09 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.33 7.81 33 V 7.56 3.61 1.68 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 0.82 0.00 0.00 0.58 0.00 0.00 34 G 7.54 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 8.08 4.24 0.00 1.91 1.71 1.34 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 36 T 8.06 3.81 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 1.38 0.00 0.00 37 S 7.86 4.56 0.00 4.00 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 38 K 7.78 4.30 0.00 1.92 1.84 0.00 1.80 0.00 0.00 1.81 0.00 0.00 3.14 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.75 1.61 7.81 39 S 8.39 4.36 0.00 4.06 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 40 A 8.65 4.19 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 41 D 8.01 4.28 0.00 2.74 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 42 D 8.09 4.47 0.00 2.96 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 43 V 8.44 3.83 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 1.26 0.00 0.00 0.99 0.00 0.00 44 K 8.30 4.10 0.00 2.05 1.89 0.00 1.72 0.00 0.00 1.62 0.00 0.00 3.12 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.70 7.81 45 K 8.06 3.98 0.00 2.11 1.87 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.66 7.81 46 A 8.34 4.28 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 0.00 0.00 0.00 0.00 0.00 0.00 47 F 8.53 3.22 0.00 2.93 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 48 A 7.93 3.74 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 49 I 6.99 3.61 1.81 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.42 0.52 0.00 0.00 50 I 7.31 4.06 1.66 0.00 0.00 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 1.62 0.60 1.08 0.00 0.00 51 D 7.59 4.55 0.00 1.86 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 0.00 0.00 0.00 0.00 52 Q 8.07 3.89 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.28 2.49 0.00 53 D 8.32 4.57 0.00 2.76 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 54 K 7.67 3.92 0.00 1.91 1.88 0.00 1.65 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.31 1.45 7.81 55 S 8.14 4.27 0.00 4.06 4.19 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 0.00 0.00 0.00 0.00 56 G 9.32 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 57 F 7.66 5.21 0.00 3.22 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 58 I 9.24 4.39 1.93 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.60 0.88 0.00 0.00 59 E 8.89 4.54 0.00 2.19 1.87 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 2.31 2.31 0.00 60 E 8.90 3.90 0.00 2.02 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 2.37 2.37 0.00 61 D 8.00 4.36 0.00 2.86 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.09 4.09 0.00 2.18 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 0.00 2.36 2.34 0.00 63 L 8.04 4.02 0.00 1.94 1.60 0.60 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.18 4.02 0.00 1.88 1.96 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.66 7.81 65 L 7.41 4.58 0.00 1.86 1.66 0.92 0.82 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 66 F 8.13 4.21 0.00 3.26 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 67 L 8.01 3.97 0.00 1.86 1.72 0.52 0.98 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 68 Q 7.89 4.36 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.01 0.00 0.00 0.00 0.00 0.00 2.55 2.42 0.00 69 N 7.89 4.42 0.00 2.49 2.73 0.00 0.00 6.97 7.12 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 70 F 8.16 4.71 0.00 3.25 3.26 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 71 K 7.64 4.46 0.00 1.85 1.71 0.00 1.80 0.00 0.00 1.89 0.00 0.00 3.35 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.78 1.50 7.81 72 A 8.96 4.10 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 73 D 7.97 4.71 0.00 2.81 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 74 A 7.79 4.21 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 75 R 8.24 4.12 0.00 1.94 1.96 0.00 3.05 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 76 A 8.16 4.41 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 77 L 8.53 4.35 0.00 1.48 1.53 0.65 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 78 T 9.19 4.17 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 1.27 0.00 0.00 79 D 8.85 4.44 0.00 2.72 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 80 G 8.03 3.62 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 0.00 0.00 0.00 81 E 8.41 4.10 0.00 2.26 2.06 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 2.44 2.54 0.00 82 T 8.20 3.95 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 83 K 8.35 4.06 0.00 1.79 1.88 0.00 1.70 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.69 1.64 7.81 84 T 7.97 3.93 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 85 F 8.53 4.45 0.00 3.19 3.14 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 0.00 0.00 0.00 0.00 86 L 8.45 3.87 0.00 1.81 1.87 0.90 0.69 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 87 K 8.50 4.09 0.00 1.86 1.90 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.62 7.81 88 A 8.26 4.28 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 89 G 7.75 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 0.00 0.00 0.00 90 D 8.34 4.84 0.00 2.75 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 91 S 8.27 4.16 0.00 4.06 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 D 8.15 4.67 0.00 2.78 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 7.96 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 8.27 4.42 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 95 G 10.23 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.90 4.74 0.00 1.97 1.70 0.00 1.15 0.00 0.00 1.42 0.00 0.00 2.22 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.08 7.81 97 I 8.79 4.81 2.03 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.97 1.21 0.00 0.00 98 G 9.56 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 V 7.65 2.38 1.09 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 0.62 0.00 0.00 0.49 0.00 0.00 100 D 7.81 4.35 0.00 2.71 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 0.00 101 E 8.08 4.04 0.00 2.26 2.26 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 2.45 2.41 0.00 102 F 8.54 4.24 0.00 3.32 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 0.00 103 T 8.18 3.79 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 1.19 0.00 0.00 104 A 7.94 3.96 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 0.00 105 L 7.66 3.94 0.00 1.87 1.77 1.01 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 106 V 7.04 3.04 1.03 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 0.59 0.00 0.00 -0.48 0.00 0.00 107 K 7.86 4.08 0.00 1.80 1.81 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.61 7.81 108 A 7.82 4.30 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