NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 S 4.4429 8.3193 115.2924 58.5741 63.4525 173.4094 9 T 4.0315 8.4792 115.4020 61.1630 69.7841 172.9916 10 G 3.8125 8.2622 110.0032 46.3438 0.0000 175.2866 11 F 4.9091 7.8866 129.2328 57.9918 39.1325 174.2823 12 L 4.0449 7.1550 120.9912 53.1759 42.3759 176.6667 13 V 3.7511 7.6352 119.6776 61.7331 31.8640 177.0459 14 K 4.2248 8.4152 121.7649 55.9139 34.1074 177.9364 15 Q 3.8597 8.6715 123.6230 59.5016 28.9429 179.2097 16 R 3.9213 8.0131 118.6692 59.5425 30.1513 178.1582 17 A 4.4445 7.7002 121.0612 54.1858 18.0883 179.0793 18 F 4.2596 8.2114 119.2580 60.7153 39.6510 177.8436 19 L 4.2774 8.1624 118.2899 57.8378 41.6447 178.9426 20 K 3.8829 8.1780 118.5233 59.7463 32.0318 178.7660 21 L 4.0895 7.8743 120.0592 58.6647 41.9529 178.7651 22 Y 3.8970 7.7186 116.1163 61.2240 37.7497 178.3437 23 M 4.1608 8.2708 119.7954 58.1959 32.0901 178.7768 24 I 3.8565 8.2191 120.4354 64.8088 37.3918 178.6007 25 T 4.2174 7.8484 117.7067 66.5744 68.3384 176.6347 26 M 4.1130 8.6874 120.8251 58.7779 31.9058 178.9969 27 T 3.8131 8.1233 115.9601 66.6166 68.0095 176.5594 28 E 4.2952 8.3652 120.3675 58.9058 29.2497 178.3268 29 Q 4.4831 7.7714 115.3844 54.5545 29.2013 175.1908 30 E 3.8659 7.8213 118.3355 57.7326 27.6364 175.3908 31 R 4.5469 8.5415 115.8208 56.0322 31.1253 177.0278 32 L 4.3199 7.5694 121.6934 53.3866 40.9160 174.2128 33 Y 4.8766 7.1010 121.5044 55.9535 41.2274 175.6523 34 G 4.1523 8.9954 108.5701 45.3058 0.0000 173.7373 35 L 4.3456 8.2896 117.7272 56.4916 42.8420 178.2966 36 K 4.4065 7.7446 119.7597 55.8708 31.2073 178.1671 37 L 3.9681 7.6094 120.9686 57.2504 41.9744 178.9301 38 L 3.8809 7.9232 120.2487 58.3738 42.0102 178.6385 39 E 3.7236 8.0483 118.5373 58.9412 29.3644 178.4185 40 V 3.4691 7.4307 118.5509 66.1507 31.3152 178.1303 41 L 3.7682 8.0661 117.4760 57.5564 41.7336 179.2285 42 R 3.9768 8.7319 119.2543 59.4325 30.0008 178.7013 43 S 4.0185 8.4556 113.0150 61.7017 62.0112 175.9783 44 E 3.7065 7.4378 120.1935 58.3014 29.6168 177.8182 45 F 5.0192 7.3599 114.8147 57.0580 39.2977 177.4154 46 K 4.0218 7.6065 121.1489 59.2857 31.8958 177.6929 47 E 4.0781 7.9352 117.8488 59.4013 29.8805 177.9443 48 I 3.7571 7.8572 119.8296 65.3935 37.3690 177.0524 49 G 4.0613 7.7831 105.1104 45.1584 0.0000 173.3273 50 F 4.6226 8.2026 122.8091 57.7389 39.7897 175.4454 51 K 4.2427 8.3056 128.6943 52.9404 32.2027 173.4150 52 P 4.2672 0.0000 0.0000 62.3751 31.9384 176.9118 53 N 4.8718 8.2793 117.6675 51.6258 40.5955 175.7110 54 H 4.2251 8.6970 117.0040 59.2517 28.4824 177.7498 55 T 3.6806 7.4333 111.8670 64.2085 68.5765 176.3955 56 E 3.9975 8.3507 121.4521 59.2108 29.5280 179.3597 57 V 3.5891 7.6038 118.4492 66.0828 31.5873 177.1102 58 Y 4.0030 8.7611 119.8683 61.1490 38.4364 178.6982 59 R 4.0348 8.2488 118.6645 59.2381 29.9336 179.2888 60 S 4.1357 8.2958 114.5459 61.5001 62.7041 176.1508 61 L 3.8973 8.2534 123.3294 58.4118 41.7546 178.3387 62 H 4.1660 8.1190 114.7083 57.2550 28.6663 177.1080 63 E 3.9765 7.8581 122.3511 59.0089 29.4735 178.3936 64 L 4.1011 7.5624 118.1661 57.0516 41.5650 179.5358 65 L 4.2270 7.5533 120.2341 57.3418 41.6161 178.8329 66 D 4.3690 7.5388 117.4125 57.5508 40.9402 178.4490 67 D 4.5366 8.3786 117.7760 55.4695 40.7460 177.6310 68 G 3.9935 8.1829 108.2544 45.3283 0.0000 175.2866 69 I 3.9385 7.7307 121.7270 63.5026 38.3350 175.9372 70 L 5.3952 8.3833 121.4521 52.6851 44.9177 175.9121 71 K 4.8323 9.0246 120.3560 55.1853 36.0079 174.4973 72 Q 4.7037 8.6568 123.2301 54.7262 30.4630 174.4254 73 I 4.7160 8.4951 126.2587 59.3609 42.2829 173.8445 74 K 4.8504 8.4807 124.0117 54.8390 34.2739 175.0320 75 V 4.5581 8.4432 125.8721 60.7080 36.0209 174.0196 76 K 4.5390 8.4480 122.4383 55.4602 32.9620 176.4796 77 K 3.5932 9.4244 126.9216 57.3055 33.2565 175.2314 78 E 3.8606 8.3145 127.9849 59.6012 28.3129 177.5547 79 G 3.8686 9.0282 112.2265 44.9929 0.0000 171.9417 80 A 4.5396 7.6028 122.6288 50.8139 20.8954 177.1458 81 K 4.4121 8.4627 116.8386 57.5781 33.5759 177.8671 82 L 4.5381 7.6871 114.6361 55.8783 44.5686 177.0434 83 Q 4.1185 7.9905 119.6384 56.3747 30.0488 174.8997 84 E 5.1665 8.7438 124.9405 54.7487 32.3987 175.4261 85 V 4.5679 8.9489 116.0318 59.4554 36.7771 174.3934 86 V 4.4953 8.1662 121.3880 61.9262 32.9151 174.3008 87 L 5.0244 8.6244 129.3302 53.3868 45.4696 174.2923 88 Y 5.6463 8.0781 122.3075 55.7963 40.0808 174.9849 89 Q 4.4360 8.3362 120.7318 53.6824 34.1655 174.1133 90 F 4.8582 8.3705 119.0867 57.5838 38.6646 175.8973 91 K 4.0885 9.1373 126.9309 58.6029 32.6262 176.7324 92 D 4.8827 7.7419 120.7908 51.8188 41.1515 175.0139 93 Y 4.1363 8.1818 124.7023 59.3528 39.0488 176.4353 94 E 3.6466 8.0919 120.0332 59.3025 29.4825 178.3646 95 A 4.0652 8.1905 119.4516 54.2164 18.4086 178.9689 96 A 4.1515 7.4602 119.3284 54.6305 19.1150 179.8829 97 K 3.7491 7.5376 116.8551 59.1949 32.0822 179.1717 98 L 3.8617 7.8730 120.6698 58.3953 41.8823 178.2015 99 Y 4.2787 7.5726 119.6156 60.0591 38.8356 178.0774 100 K 3.8947 8.2890 120.3175 59.3108 32.3016 178.3511 101 K 3.7804 8.0495 119.7481 59.9114 31.6932 178.4337 102 Q 3.9058 7.9086 118.0059 59.2981 28.5029 179.4548 103 L 3.9950 7.5028 119.0375 56.8176 41.6253 179.0321 104 K 3.7589 7.7156 119.4290 59.5428 32.0362 178.5117 105 V 3.6694 7.7367 117.7159 66.3809 31.0715 177.2651 106 E 3.8645 8.0437 118.5926 59.3296 29.2937 178.8305 107 L 4.0680 8.1836 119.1776 57.3419 41.8693 178.7090 108 D 4.3108 8.6949 119.3764 57.5759 40.6229 178.7653 109 R 3.8702 7.9860 117.7861 59.8093 30.1468 178.3758 110 S 4.1522 7.6791 114.4772 61.2752 62.7080 176.2250 111 K 3.8859 8.4667 122.7404 59.6812 31.9176 178.6144 112 K 3.8251 8.0292 118.4426 59.9846 32.0501 179.1044 113 L 4.0804 7.6629 118.9548 57.3610 41.4749 179.4466 114 I 3.8586 7.8816 119.8892 63.8929 37.3309 177.5165 115 E 3.9090 8.2283 119.7116 59.4214 29.2472 178.8256 116 K 3.9207 7.9521 118.6168 59.5433 32.4606 178.6357 117 A 4.1089 8.1346 121.0492 55.1844 17.9895 179.6895 118 L 4.3152 8.2582 117.6132 57.9668 41.5435 179.5740 119 S 4.1673 8.2170 112.3238 61.6014 62.4474 175.6726 120 D 4.4807 8.4495 120.7602 56.8445 40.7033 177.6170 121 N 4.5093 7.8717 113.5559 53.1181 39.2724 175.1535 122 F 4.4541 7.7326 124.0485 57.6308 40.1640 174.3476 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 8 S 8.32 4.44 0.00 3.87 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 9 T 8.48 4.03 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 1.21 0.00 0.00 10 G 8.26 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 11 F 7.89 4.91 0.00 2.84 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 L 7.16 4.04 0.00 1.26 1.28 0.45 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.64 3.75 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 0.77 0.00 0.00 1.03 0.00 0.00 14 K 8.42 4.22 0.00 1.84 1.80 0.00 1.74 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.47 7.81 15 Q 8.67 3.86 0.00 2.04 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.92 0.00 0.00 0.00 0.00 0.00 2.59 2.41 0.00 16 R 8.01 3.92 0.00 1.98 1.99 0.00 3.30 0.00 0.00 3.47 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.76 0.00 17 A 7.70 4.44 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.21 4.26 0.00 3.25 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 19 L 8.16 4.28 0.00 1.89 1.84 1.05 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.18 3.88 0.00 2.03 1.87 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.56 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.59 1.67 7.81 21 L 7.87 4.09 0.00 1.86 1.82 0.87 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 7.72 3.90 0.00 3.51 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 23 M 8.27 4.16 0.00 1.98 2.23 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.54 0.00 24 I 8.22 3.86 2.14 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 1.67 1.15 1.18 0.00 0.00 25 T 7.85 4.22 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 1.19 0.00 0.00 26 M 8.69 4.11 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 2.63 0.00 27 T 8.12 3.81 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 28 E 8.37 4.30 0.00 2.42 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 2.57 2.96 0.00 29 Q 7.77 4.48 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 30 E 7.82 3.87 0.00 2.15 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 2.24 2.27 0.00 31 R 8.54 4.55 0.00 1.73 1.90 0.00 3.27 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 32 L 7.57 4.32 0.00 1.51 1.59 0.62 0.67 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 33 Y 7.10 4.88 0.00 3.20 2.89 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 34 G 9.00 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 35 L 8.29 4.35 0.00 1.70 1.80 0.97 0.99 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 K 7.74 4.41 0.00 1.82 1.77 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.48 7.81 37 L 7.61 3.97 0.00 1.66 1.66 0.74 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.92 3.88 0.00 1.78 1.68 1.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.05 3.72 0.00 2.02 1.89 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 2.35 2.28 0.00 40 V 7.43 3.47 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 0.85 0.00 0.00 0.88 0.00 0.00 41 L 8.07 3.77 0.00 1.74 1.74 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.73 3.98 0.00 1.85 1.93 0.00 3.10 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 43 S 8.46 4.02 0.00 3.77 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 44 E 7.44 3.71 0.00 1.71 1.12 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 1.74 2.10 0.00 45 F 7.36 5.02 0.00 3.13 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 46 K 7.61 4.02 0.00 1.99 1.84 0.00 1.80 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.42 7.81 47 E 7.94 4.08 0.00 2.05 1.99 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 2.34 2.36 0.00 48 I 7.86 3.76 1.99 0.00 0.00 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 1.43 0.60 0.94 0.00 0.00 49 G 7.78 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 0.00 0.00 0.00 0.00 50 F 8.20 4.62 0.00 2.68 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 K 8.31 4.24 0.00 1.65 1.62 0.00 1.82 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.25 1.32 7.81 52 P 0.00 4.27 0.00 2.10 1.84 0.00 3.19 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.53 0.00 53 N 8.28 4.87 0.00 3.04 3.00 0.00 0.00 5.77 7.90 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 54 H 8.70 4.23 0.00 3.42 3.60 0.00 5.46 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 7.43 3.68 4.18 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 0.99 0.00 0.00 56 E 8.35 4.00 0.00 2.20 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 57 V 7.60 3.59 2.24 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 0.92 0.00 0.00 0.94 0.00 0.00 58 Y 8.76 4.00 0.00 3.22 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 59 R 8.25 4.03 0.00 2.05 2.02 0.00 3.24 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.96 0.00 60 S 8.30 4.14 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 61 L 8.25 3.90 0.00 1.56 1.53 0.14 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 62 H 8.12 4.17 0.00 3.09 3.19 0.00 5.66 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 E 7.86 3.98 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 64 L 7.56 4.10 0.00 1.76 1.61 0.82 0.36 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 65 L 7.55 4.23 0.00 1.65 1.70 0.78 1.39 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 66 D 7.54 4.37 0.00 2.58 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.38 4.54 0.00 2.63 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 68 G 8.18 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 69 I 7.73 3.94 1.97 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 1.36 0.53 1.02 0.00 0.00 70 L 8.38 5.40 0.00 1.53 1.58 0.66 0.52 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 71 K 9.02 4.83 0.00 1.77 1.89 0.00 1.32 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.33 7.81 72 Q 8.66 4.70 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.84 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 73 I 8.50 4.72 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 1.07 0.58 0.84 0.00 0.00 74 K 8.48 4.85 0.00 1.65 1.62 0.00 1.55 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.40 7.81 75 V 8.44 4.56 1.99 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 0.67 0.00 0.00 0.86 0.00 0.00 76 K 8.45 4.54 0.00 1.64 1.69 0.00 1.80 0.00 0.00 1.60 0.00 0.00 2.76 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.40 7.81 77 K 9.42 3.59 0.00 1.75 1.71 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.79 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.38 7.81 78 E 8.31 3.86 0.00 1.82 1.81 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 2.15 2.27 0.00 79 G 9.03 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 7.60 4.54 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 81 K 8.46 4.41 0.00 1.73 1.84 0.00 1.68 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 1.34 1.42 7.81 82 L 7.69 4.54 0.00 1.54 1.63 0.91 0.87 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 83 Q 7.99 4.12 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.86 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 84 E 8.74 5.17 0.00 1.83 1.78 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 2.38 2.22 0.00 85 V 8.95 4.57 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 0.79 0.00 0.00 0.85 0.00 0.00 86 V 8.17 4.50 2.05 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 0.68 0.00 0.00 0.90 0.00 0.00 87 L 8.62 5.02 0.00 1.66 1.31 1.03 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 88 Y 8.08 5.65 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 89 Q 8.34 4.44 0.00 1.90 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.10 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 90 F 8.37 4.86 0.00 2.89 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 9.14 4.09 0.00 1.83 2.08 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.42 7.81 92 D 7.74 4.88 0.00 2.82 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 93 Y 8.18 4.14 0.00 2.92 2.85 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 94 E 8.09 3.65 0.00 2.08 1.89 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 2.34 2.36 0.00 95 A 8.19 4.07 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 96 A 7.46 4.15 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 97 K 7.54 3.75 0.00 1.46 1.61 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.58 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.05 0.51 7.81 98 L 7.87 3.86 0.00 1.72 1.77 0.90 0.71 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 99 Y 7.57 4.28 0.00 3.21 3.12 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 0.00 100 K 8.29 3.89 0.00 2.12 1.89 0.00 1.75 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.47 7.81 101 K 8.05 3.78 0.00 2.06 1.84 0.00 1.55 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.49 7.81 102 Q 7.91 3.91 0.00 2.02 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.59 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 103 L 7.50 3.99 0.00 1.60 1.57 0.84 0.04 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 0.00 104 K 7.72 3.76 0.00 1.83 1.76 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.56 7.81 105 V 7.74 3.67 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 1.03 0.00 0.00 0.89 0.00 0.00 106 E 8.04 3.86 0.00 2.24 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 0.00 2.28 2.37 0.00 107 L 8.18 4.07 0.00 1.87 1.67 0.81 0.96 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 0.00 108 D 8.69 4.31 0.00 2.78 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 0.00 109 R 7.99 3.87 0.00 1.92 1.94 0.00 3.41 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 110 S 7.68 4.15 0.00 4.09 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 0.00 111 K 8.47 3.89 0.00 1.77 1.99 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.43 1.64 7.81 112 K 8.03 3.83 0.00 2.04 1.89 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.67 7.81 113 L 7.66 4.08 0.00 1.80 1.70 0.87 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 0.00 114 I 7.88 3.86 1.94 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.65 0.90 0.00 0.00 115 E 8.23 3.91 0.00 2.24 1.98 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 2.39 2.47 0.00 116 K 7.95 3.92 0.00 1.99 2.01 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.55 7.81 117 A 8.13 4.11 1.48 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 0.00 118 L 8.26 4.32 0.00 1.94 1.81 0.91 0.73 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 0.00 119 S 8.22 4.17 0.00 3.88 4.14 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 0.00 120 D 8.45 4.48 0.00 2.69 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 0.00 121 N 7.87 4.51 0.00 2.38 1.98 0.00 0.00 6.83 6.89 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 0.00 122 F 7.73 4.45 0.00 3.18 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00