NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 23 M 4.4784 8.2893 118.7895 53.3049 32.7848 175.1234 24 P 4.2041 0.0000 0.0000 59.8301 31.7472 173.0015 25 E 4.0712 9.2919 120.1311 56.6572 31.0552 178.2386 26 V 3.7565 7.9482 111.6587 61.0739 33.0415 175.8802 27 S 4.7586 7.4803 114.7675 57.3266 66.9304 173.5150 28 N 4.6596 8.5918 121.5826 52.2392 40.3076 173.3412 29 P 4.3764 0.0000 0.0000 65.5058 31.5552 177.7260 30 S 4.2193 8.2593 114.2007 59.6426 63.1253 173.8679 31 K 4.2390 7.6309 122.1797 53.8053 32.3952 174.4026 32 P 4.3209 0.0000 0.0000 63.2136 31.7183 175.7291 33 G 5.0446 8.6603 108.0094 44.6231 0.0000 171.2509 34 R 4.5646 8.3426 116.3729 55.4527 32.9249 174.0081 35 K 4.4716 8.4223 119.7421 55.1342 34.2404 175.8929 36 T 4.3051 8.2479 120.8038 60.5955 71.0500 176.1524 37 N 4.3742 8.6104 120.8438 57.9292 37.2436 174.4305 38 Q 4.2078 7.9399 119.7625 58.8500 28.8971 178.6349 39 L 4.0581 7.9954 120.1462 57.5930 41.6274 179.2299 40 Q 3.9792 8.5686 120.1693 59.3705 28.9446 177.7456 41 Y 4.0122 8.2966 120.5723 61.0567 38.8160 177.9301 42 M 4.1391 8.5389 119.8209 58.4061 32.0024 178.5483 43 Q 3.9709 8.0775 119.6207 59.3426 29.2393 177.6191 44 N 4.3535 8.6416 117.1084 55.4983 39.2397 175.7297 45 V 3.9435 7.5623 118.0257 64.5709 32.7549 177.7556 46 V 3.4639 7.1571 117.1759 65.9845 31.5682 178.0737 47 V 3.9469 8.4213 118.3025 66.0193 31.3834 177.9638 48 K 4.0196 7.9732 119.0331 59.7999 31.7744 178.9389 49 T 3.9608 7.7933 115.1088 66.7768 68.5049 176.4733 50 L 4.2606 7.9800 119.6041 57.4544 41.6762 179.0571 51 W 4.4611 8.7681 128.2603 59.6126 32.0313 177.5789 52 K 4.6556 7.8652 119.8070 54.0981 28.9816 175.9873 53 H 4.9025 7.4193 119.3103 54.2294 33.5677 173.9122 54 Q 4.2058 8.5937 124.1220 58.7815 28.4591 177.0440 55 F 5.0457 8.3832 114.7576 57.4260 39.5803 176.3061 56 A 4.2407 8.2624 125.7256 53.9817 18.7509 179.9848 57 W 2.9108 7.8477 113.2210 58.7723 27.9752 176.3964 58 P 3.7826 0.0000 0.0000 63.7607 30.7135 176.6122 59 F 4.6246 7.5723 116.4398 57.2168 39.6550 176.9792 60 Y 4.0124 7.4066 120.1817 60.0887 37.8507 175.4156 61 Q 4.7472 7.5345 115.4309 53.3711 31.8694 172.5430 62 P 4.2553 0.0000 0.0000 62.3914 31.8555 176.7815 63 V 3.1911 8.1669 120.6700 63.7075 31.7522 176.1628 64 D 4.5971 8.1693 126.0423 52.7348 40.9146 176.3541 65 A 3.8636 8.1172 128.9311 54.5769 18.5942 179.1460 66 I 3.6574 7.7076 118.1035 64.3258 37.1478 178.1173 67 K 3.8754 7.8833 118.9930 59.5514 32.1499 178.0899 68 L 4.1401 7.6434 115.5415 54.0183 42.8592 175.9482 69 N 4.1557 7.8788 116.8444 55.1942 37.6180 175.8121 70 L 4.8164 8.2039 119.5072 51.8531 42.3056 176.0516 71 P 4.3329 0.0000 0.0000 64.8553 31.9502 177.1483 72 D 4.7131 8.0677 115.6095 53.6660 40.5095 177.4100 73 Y 3.5698 8.1005 122.1803 61.2765 38.5203 177.2319 74 H 4.5780 7.9746 112.7706 56.7886 29.2236 176.9984 75 K 4.1610 7.7309 120.4658 58.8917 32.2125 178.6066 76 I 4.1883 7.4679 119.0562 62.6316 37.5495 176.3756 77 I 3.9906 7.2474 122.7814 60.2465 36.4827 175.6890 78 K 4.3903 8.4345 124.6568 56.4504 33.3880 176.9902 79 N 4.9769 7.6267 116.0644 50.3013 38.3750 172.0434 80 P 4.4863 0.0000 0.0000 62.9941 32.6326 176.5111 81 M 4.7086 8.0862 118.1602 53.6348 35.3356 173.7372 82 D 4.7844 8.0789 123.0988 51.3019 44.0310 176.3258 83 M 4.1530 9.0157 120.1948 58.1331 31.8728 179.4489 84 G 4.0706 8.2677 107.2223 47.6681 0.0000 175.7528 85 T 3.8706 8.3116 118.1808 66.3194 68.4388 176.8015 86 I 3.6996 7.5983 121.4358 64.2448 37.0772 178.2487 87 K 3.9118 8.3904 120.6347 59.6454 31.9956 178.9283 88 K 4.1919 8.0067 119.9022 58.9138 31.8453 179.5056 89 R 3.6714 8.0620 118.5474 59.1685 30.0031 179.1540 90 L 4.1027 8.0831 118.6695 57.9610 41.2256 179.4163 91 E 4.0197 8.6157 118.8618 58.9971 29.1520 178.1957 92 N 4.6597 8.1355 113.7422 52.1487 39.7979 174.4353 93 N 4.2425 8.0078 117.6213 54.4907 36.8831 175.7306 94 Y 4.0606 8.2119 119.9352 60.3017 39.8012 175.3374 95 Y 4.7913 7.6973 116.4798 57.3417 39.0646 175.6649 96 W 4.5427 9.4962 132.3985 58.3623 31.8977 176.6865 97 S 4.6890 8.1332 110.9998 55.3219 65.0714 174.3036 98 A 4.0222 8.5499 127.5303 55.2263 18.0073 180.2506 99 S 4.1505 8.1174 113.9517 61.7473 62.7955 176.6842 100 E 3.9944 8.0924 121.5810 59.3319 29.1959 178.8439 101 C 3.7681 7.2265 119.6116 61.9735 31.5964 175.3096 102 M 4.5322 8.2520 120.3938 58.4510 31.4685 178.3104 103 Q 4.0373 8.3417 119.7920 59.5202 29.2287 178.4063 104 D 4.3119 8.1650 119.6336 57.3819 40.7992 178.7383 105 F 3.5376 8.1066 118.1828 60.5576 38.8323 177.5545 106 N 4.4988 8.5954 116.3597 56.4922 38.2296 177.6600 107 T 3.8546 8.2271 117.6546 66.6822 68.3995 176.2416 108 M 3.8522 7.8074 119.9832 58.6451 32.2131 178.3644 109 F 3.9661 7.6874 117.7950 60.8086 39.0246 177.8048 110 T 3.9622 8.3702 115.7148 66.7517 68.2439 176.3064 111 N 4.3404 8.4810 118.7420 56.4580 38.5606 176.9632 112 C 4.2213 7.7397 120.0110 62.9148 31.6007 175.3536 113 Y 4.5371 7.8018 118.1726 60.8634 37.1607 178.4633 114 I 3.8780 8.1034 120.8406 64.5918 37.3661 177.4963 115 Y 4.1023 8.0825 118.9698 59.3135 38.9756 175.4133 116 N 4.8396 7.4717 115.4144 51.3431 40.7045 175.0104 117 K 4.2140 8.4753 119.7278 55.6439 32.6866 176.9778 118 P 4.2666 0.0000 0.0000 65.4639 31.3154 177.3959 119 T 4.3195 7.6617 105.5174 61.6469 69.8510 174.8114 120 D 4.4770 7.9192 123.8763 54.4135 41.6787 176.7711 121 D 4.3149 8.9855 123.2698 57.9560 40.7110 179.4329 122 I 3.5172 7.6489 118.1211 63.8347 37.8724 178.0291 123 V 3.8007 7.8265 119.3036 65.9307 31.4087 177.9915 124 L 3.9959 7.8595 118.2879 57.9881 41.4723 179.2764 125 M 3.7552 8.0992 118.4160 58.2875 31.8427 178.5675 126 A 3.9131 8.3984 121.1092 55.4362 18.5785 179.7288 127 Q 4.0065 8.9135 117.9757 58.3597 28.5173 178.8793 128 A 4.0561 8.0916 121.8909 55.2463 18.4567 179.7482 129 L 3.9267 7.9357 117.5619 57.8383 41.5927 179.3398 130 E 3.3771 8.1620 119.7387 58.6683 29.3651 178.6726 131 K 3.8511 7.9696 119.7447 59.6978 32.1824 178.8860 132 I 3.8805 7.4968 119.8685 64.1385 36.9249 177.9187 133 F 4.0596 8.5684 122.0344 61.5864 39.1688 177.2896 134 L 3.6888 8.2665 118.5523 57.7026 41.1450 179.5690 135 Q 3.9628 7.7879 117.0979 58.9865 29.0893 178.7650 136 K 4.1942 8.3299 119.8818 59.4026 32.0749 179.6696 137 V 3.5380 7.8974 118.7250 65.7925 31.1511 177.8758 138 A 4.0638 7.8653 119.3527 54.0980 18.2358 178.4517 139 Q 4.3353 7.3627 114.2917 54.7926 29.6115 175.5352 140 M 2.7395 7.0939 121.5214 53.9727 32.7680 174.3407 141 P 4.2480 0.0000 0.0000 62.9191 32.2297 176.8733 142 Q 4.0976 8.3397 120.6912 55.2390 28.8141 177.5504 143 E 4.1930 8.5854 113.2566 56.8246 29.6683 178.1393 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 23 M 8.29 4.48 0.00 2.05 1.95 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.11 0.00 24 P 0.00 4.20 0.00 2.16 2.06 0.00 3.71 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 1.93 2.16 0.00 25 E 9.29 4.07 0.00 2.05 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 2.27 2.21 0.00 26 V 7.95 3.76 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 0.59 0.00 0.00 0.83 0.00 0.00 27 S 7.48 4.76 0.00 3.81 3.74 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 28 N 8.59 4.66 0.00 3.01 2.74 0.00 0.00 6.87 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 29 P 0.00 4.38 0.00 2.22 2.19 0.00 3.84 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 30 S 8.26 4.22 0.00 4.04 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 31 K 7.63 4.24 0.00 1.64 1.68 0.00 1.46 0.00 0.00 0.66 0.00 0.00 2.83 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.18 1.23 7.81 32 P 0.00 4.32 0.00 1.34 1.43 0.00 3.48 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 1.60 1.84 0.00 33 G 8.66 5.04 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 0.00 0.00 0.00 34 R 8.34 4.56 0.00 1.51 1.61 0.00 2.25 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 1.07 0.00 35 K 8.42 4.47 0.00 1.93 1.70 0.00 1.92 0.00 0.00 1.76 0.00 0.00 2.79 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.30 1.43 7.81 36 T 8.25 4.31 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 0.94 0.00 0.00 37 N 8.61 4.37 0.00 2.75 2.88 0.00 0.00 6.60 7.73 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 38 Q 7.94 4.21 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.88 0.00 0.00 0.00 0.00 0.00 2.47 2.39 0.00 39 L 8.00 4.06 0.00 1.93 1.80 1.02 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 8.57 3.98 0.00 2.18 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 41 Y 8.30 4.01 0.00 3.20 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 42 M 8.54 4.14 0.00 2.23 2.36 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 3.02 0.00 43 Q 8.08 3.97 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 44 N 8.64 4.35 0.00 2.69 2.85 0.00 0.00 7.16 7.57 0.00 0.00 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 V 7.56 3.94 0.94 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 0.55 0.00 0.00 0.62 0.00 0.00 46 V 7.16 3.46 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 0.92 0.00 0.00 0.89 0.00 0.00 47 V 8.42 3.95 2.37 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 1.32 0.00 0.00 1.33 0.00 0.00 48 K 7.97 4.02 0.00 2.00 1.92 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.45 7.81 49 T 7.79 3.96 4.32 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 1.26 0.00 0.00 50 L 7.98 4.26 0.00 2.01 1.91 0.86 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 51 W 8.77 4.46 0.00 3.76 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 52 K 7.87 4.66 0.00 1.85 1.89 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.63 1.82 7.81 53 H 7.42 4.90 0.00 3.22 3.26 0.00 5.68 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 8.59 4.21 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.73 0.00 0.00 0.00 0.00 0.00 1.80 1.69 0.00 55 F 8.38 5.05 0.00 3.10 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 56 A 8.26 4.24 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 57 W 7.85 2.91 0.00 3.38 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 58 P 0.00 3.78 0.00 0.49 1.09 0.00 2.90 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 0.77 0.44 0.00 59 F 7.57 4.62 0.00 2.94 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 60 Y 7.41 4.01 0.00 2.85 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 61 Q 7.53 4.75 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.92 0.00 0.00 0.00 0.00 0.00 2.20 2.34 0.00 62 P 0.00 4.26 0.00 2.04 2.04 0.00 3.70 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.24 0.00 63 V 8.17 3.19 1.58 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 -0.38 0.00 0.00 0.60 0.00 0.00 64 D 8.17 4.60 0.00 2.67 2.47 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 0.00 65 A 8.12 3.86 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 66 I 7.71 3.66 1.86 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 1.53 0.89 0.91 0.00 0.00 67 K 7.88 3.88 0.00 1.88 1.94 0.00 1.79 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 1.44 1.48 7.81 68 L 7.64 4.14 0.00 1.58 1.63 0.69 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 69 N 7.88 4.16 0.00 2.83 2.83 0.00 0.00 6.91 7.76 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 70 L 8.20 4.82 0.00 1.62 1.64 0.66 1.25 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 71 P 0.00 4.33 0.00 2.08 2.15 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 2.06 2.11 0.00 72 D 8.07 4.71 0.00 2.90 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 73 Y 8.10 3.57 0.00 2.73 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 74 H 7.97 4.58 0.00 3.20 3.31 0.00 5.75 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 7.73 4.16 0.00 1.87 1.87 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.45 1.55 7.81 76 I 7.47 4.19 1.89 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.67 0.95 0.00 0.00 77 I 7.25 3.99 1.01 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 0.55 0.00 0.78 0.00 0.00 78 K 8.43 4.39 0.00 1.71 1.82 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.57 7.81 79 N 7.63 4.98 0.00 2.64 2.72 0.00 0.00 6.97 8.02 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 80 P 0.00 4.49 0.00 2.22 2.15 0.00 3.85 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 81 M 8.09 4.71 0.00 1.83 1.86 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 2.30 2.59 0.00 82 D 8.08 4.78 0.00 3.08 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 83 M 9.02 4.15 0.00 2.41 2.41 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.48 0.00 84 G 8.27 4.07 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 0.00 0.00 0.00 85 T 8.31 3.87 4.35 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 1.10 0.00 0.00 86 I 7.60 3.70 1.87 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.61 0.93 0.00 0.00 87 K 8.39 3.91 0.00 1.89 1.97 0.00 0.61 0.00 0.00 0.95 0.00 0.00 2.51 0.00 0.00 2.15 0.00 0.00 0.00 0.00 1.42 1.28 7.81 88 K 8.01 4.19 0.00 1.92 1.76 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.49 7.81 89 R 8.06 3.67 0.00 1.65 0.96 0.00 3.04 0.00 0.00 2.83 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.42 0.00 90 L 8.08 4.10 0.00 1.92 1.98 1.14 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 91 E 8.62 4.02 0.00 2.08 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 0.00 2.27 2.43 0.00 92 N 8.14 4.66 0.00 2.76 2.88 0.00 0.00 7.12 7.61 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 93 N 8.01 4.24 0.00 3.04 2.90 0.00 0.00 6.59 7.01 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 94 Y 8.21 4.06 0.00 2.87 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 95 Y 7.70 4.79 0.00 3.15 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 96 W 9.50 4.54 0.00 3.29 3.23 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 97 S 8.13 4.69 0.00 3.97 3.72 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 98 A 8.55 4.02 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 99 S 8.12 4.15 0.00 3.93 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 0.00 100 E 8.09 3.99 0.00 1.95 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 2.45 2.40 0.00 101 C 7.23 3.77 0.00 2.27 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 0.00 102 M 8.25 4.53 0.00 2.37 2.37 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 2.88 2.73 0.00 103 Q 8.34 4.04 0.00 2.25 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 104 D 8.17 4.31 0.00 2.87 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 0.00 105 F 8.11 3.54 0.00 2.86 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 0.00 0.00 0.00 106 N 8.60 4.50 0.00 3.01 2.97 0.00 0.00 7.06 7.04 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 0.00 107 T 8.23 3.85 4.34 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 1.20 0.00 0.00 108 M 7.81 3.85 0.00 1.55 1.71 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.22 0.00 109 F 7.69 3.97 0.00 2.97 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 0.00 110 T 8.37 3.96 4.32 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 1.27 0.00 0.00 111 N 8.48 4.34 0.00 2.87 2.93 0.00 0.00 6.67 7.23 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 0.00 112 C 7.74 4.22 0.00 3.07 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 0.00 113 Y 7.80 4.54 0.00 3.09 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 0.00 114 I 8.10 3.88 2.07 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 1.46 0.67 0.95 0.00 0.00 115 Y 8.08 4.10 0.00 3.03 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 0.00 116 N 7.47 4.84 0.00 3.01 2.97 0.00 0.00 7.11 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 0.00 117 K 8.48 4.21 0.00 2.00 1.71 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.36 7.81 118 P 0.00 4.27 0.00 2.01 2.09 0.00 3.65 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 119 T 7.66 4.32 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 0.00 120 D 7.92 4.48 0.00 2.86 2.64 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 0.00 121 D 8.99 4.31 0.00 2.62 2.64 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 0.00 122 I 7.65 3.52 1.73 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.47 0.96 0.00 0.00 123 V 7.83 3.80 2.29 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 1.18 0.00 0.00 1.13 0.00 0.00 124 L 7.86 4.00 0.00 1.84 1.63 1.02 0.94 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 0.00 125 M 8.10 3.76 0.00 1.97 2.15 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.30 0.00 126 A 8.40 3.91 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 8.91 4.01 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.22 2.42 0.00 128 A 8.09 4.06 1.63 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 0.00 129 L 7.94 3.93 0.00 1.91 1.81 0.83 0.73 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 0.00 130 E 8.16 3.38 0.00 1.16 1.67 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 2.13 1.74 0.00 131 K 7.97 3.85 0.00 1.95 1.97 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.48 7.81 132 I 7.50 3.88 2.02 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 1.43 0.70 0.94 0.00 0.00 133 F 8.57 4.06 0.00 2.93 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 0.00 134 L 8.27 3.69 0.00 1.82 1.65 0.94 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 7.79 3.96 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.98 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 136 K 8.33 4.19 0.00 1.68 1.86 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.63 1.55 7.81 137 V 7.90 3.54 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 0.83 0.00 0.00 0.25 0.00 0.00 138 A 7.87 4.06 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 0.00 139 Q 7.36 4.34 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 140 M 7.09 2.74 0.00 1.81 1.61 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.18 0.00 141 P 0.00 4.25 0.00 2.11 1.92 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.83 0.00 142 Q 8.34 4.10 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 7.10 0.00 0.00 0.00 0.00 0.00 2.28 1.93 0.00 143 E 8.59 4.19 0.00 1.98 1.76 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 2.23 1.88 0.00