NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2138 8.3144 121.7895 55.6524 33.3719 174.9134 2 E 3.8626 8.5097 123.8835 54.2578 30.1248 175.9415 3 T 4.2038 8.7377 118.6258 61.2843 72.1081 174.8568 4 A 4.1075 8.4776 122.8571 55.0826 18.3795 179.9190 5 A 3.9220 7.9408 118.7132 55.3885 18.7582 179.6179 6 A 4.1815 8.4046 119.7864 55.1649 18.3789 179.8191 7 K 3.9601 8.5857 118.7711 59.2753 32.2188 178.8195 8 F 4.0329 8.3649 121.0929 61.4256 39.3997 176.6771 9 E 3.9914 8.3705 118.1300 59.5791 29.0867 179.4699 10 R 3.8572 7.5967 116.6623 59.7616 30.3222 178.3403 11 Q 4.0410 8.1410 116.0524 57.7733 29.0464 176.2020 12 H 4.7419 8.2526 114.3185 54.0366 31.1724 172.9212 13 M 4.7053 8.0201 118.9146 53.7881 33.7054 176.5722 14 D 4.8186 8.7389 122.0437 53.3543 41.5792 175.5572 15 S 4.5695 8.3391 114.0668 58.8793 63.6544 175.1461 16 S 4.5372 8.0551 114.2990 58.6907 63.4609 173.8212 17 T 4.6658 7.4328 115.0804 60.4772 70.0921 173.6281 18 S 4.2471 8.6754 121.4350 59.7122 63.7956 173.6100 19 A 3.7889 7.0438 121.1973 51.0152 21.0903 175.5294 20 A 3.3381 9.3816 124.9058 52.1414 18.6070 178.1496 21 S 4.2074 8.8576 118.9225 60.8691 63.4508 174.2857 22 S 4.7736 7.6089 114.1713 55.4286 65.9361 174.1510 23 S 4.3282 8.6960 113.5129 60.5020 63.0565 174.3794 24 N 4.8056 7.9392 118.0577 53.3840 39.1463 175.9646 25 Y 3.9964 8.0561 121.0838 61.1136 38.6888 177.5929 26 C 4.2948 8.3616 116.7961 60.0118 38.6583 175.5518 27 N 4.4175 8.2167 117.6601 56.3523 38.1566 176.9257 28 Q 3.7948 7.8494 120.5535 59.6467 29.2294 178.3683 29 M 3.6960 7.7742 119.8468 58.3005 31.6270 178.7303 30 M 4.0740 8.1649 119.3437 58.2110 31.9975 178.5663 31 K 4.3841 7.8203 120.9804 59.0481 32.2585 178.9376 32 S 4.1521 7.8070 113.7655 61.4041 62.8892 175.7781 33 R 4.2019 7.7867 118.4436 55.4319 30.0738 175.8248 34 N 4.3315 8.1982 116.7045 54.9011 37.9572 174.2090 35 L 4.5652 8.9683 115.6918 54.5484 41.5011 177.5780 36 T 5.6823 7.4623 108.5047 60.5760 69.3819 176.5779 37 K 4.1478 8.4555 121.7575 60.3929 32.6326 178.2562 38 D 4.6212 8.0711 116.8393 56.2560 41.5743 176.0981 39 R 4.0161 7.4369 113.4080 55.1835 32.0960 173.8097 40 C 4.9972 8.5763 115.8013 55.5229 40.6573 173.7794 41 K 4.2036 8.6253 127.4024 55.6303 32.2632 174.5274 42 P 4.5889 0.0000 0.0000 65.5243 32.0360 176.3510 43 V 5.0879 7.5017 117.2865 61.0740 35.0049 173.9896 44 N 4.7131 8.9996 121.9250 52.9962 42.7505 173.0334 45 T 4.9993 8.1727 120.5082 61.7811 72.0162 172.6977 46 F 4.9390 9.5578 125.3669 55.7450 41.8398 174.7460 47 V 4.4615 9.1790 123.4601 61.1327 33.5687 175.2915 48 H 5.9267 8.5659 126.9596 53.6366 26.5800 173.2151 49 E 4.7885 7.7640 118.2758 54.2412 34.5685 175.7645 50 S 4.4301 8.3372 114.5210 57.7289 64.2297 175.0627 51 L 4.0072 8.6480 123.3186 58.4556 41.7048 179.3040 52 A 4.0189 7.9900 120.2933 55.2204 18.1436 179.1587 53 D 4.3219 7.7894 116.1573 57.2783 41.0482 178.9064 54 V 3.8040 7.5789 118.2875 66.0050 31.8105 177.8047 55 Q 3.8965 8.7231 117.9062 59.0738 28.4646 178.9219 56 A 3.9638 8.1541 121.4163 54.8589 18.3051 179.6535 57 V 3.4098 7.9483 117.2619 66.0687 31.2674 176.8785 58 C 3.9718 7.9703 114.5374 57.7336 39.9330 173.9943 59 S 4.6573 7.6879 115.2410 57.8953 63.7997 174.6991 60 Q 4.2834 7.3590 120.4423 56.3531 31.2189 177.0150 61 K 4.2805 8.2185 129.8784 56.9241 33.1662 175.9944 62 N 4.4716 8.8240 127.5628 53.6584 39.4013 174.2892 63 V 4.6014 8.2859 118.1480 59.2516 36.6011 174.9004 64 A 4.3649 8.3747 124.5474 51.9719 19.3783 178.3958 65 C 4.6252 8.6844 119.1310 55.6355 41.4874 175.1151 66 K 3.8121 8.5890 121.9573 59.7006 31.6521 177.0694 67 N 4.5610 8.0818 112.8191 52.8264 37.4655 175.8495 68 G 3.8857 8.0711 107.7318 45.5502 0.0000 173.7674 69 Q 4.1710 9.2004 120.3479 56.6429 29.2007 176.5619 70 T 4.6925 8.2413 109.7389 61.9309 68.1643 172.9872 71 N 5.0630 8.0096 116.1617 52.8573 38.5582 174.6502 72 C 5.4024 7.4233 115.8521 56.7447 39.1517 172.7680 73 Y 5.0470 8.8987 118.8412 56.3419 41.8911 173.9704 74 Q 5.1210 9.4603 126.1150 54.1310 31.4170 175.0779 75 S 4.4581 8.5676 120.8608 58.6389 63.3440 174.2143 76 Y 4.5318 8.7338 119.9425 60.2890 37.9496 176.1210 77 S 4.8318 7.7965 112.2770 56.1126 65.0657 173.0877 78 T 4.1785 7.9943 113.7662 61.7853 69.7250 173.5381 79 M 5.0082 9.5894 122.5660 53.3138 37.0471 174.6229 80 S 4.6509 9.6886 116.8796 58.3798 63.4457 173.0985 81 I 5.1813 9.4046 120.3792 59.5987 41.7031 174.1352 82 T 4.9846 9.1416 119.9508 61.9069 71.7031 172.5065 83 D 4.9164 9.7702 128.4434 53.5209 42.7889 174.2054 84 C 5.5686 9.6285 124.0199 55.2178 41.2696 173.0105 85 R 5.2111 8.9205 123.5701 54.1754 33.1346 173.8799 86 E 4.1540 9.3383 128.8046 56.3766 30.4124 176.7259 87 T 4.1026 8.7266 117.7412 61.1507 70.1232 175.8150 88 G 3.6693 8.8055 111.3112 48.7766 0.0000 175.1850 89 S 4.2319 7.8748 112.5461 59.3278 63.7056 174.2617 90 S 3.9661 7.5247 116.5438 58.4405 62.4324 173.1529 91 K 4.5113 8.3533 127.0629 54.2716 34.3592 174.7435 92 Y 4.4242 8.7021 127.8777 57.2626 39.2584 173.5614 93 P 3.8324 0.0000 0.0000 63.0399 31.6270 176.9561 94 N 4.5935 7.7813 119.6498 52.3826 36.9473 171.8248 95 C 4.4695 8.1439 117.1391 56.2634 40.9130 173.0038 96 A 4.9989 8.0761 126.1050 50.2540 21.6262 174.5373 97 Y 5.1989 8.4277 117.5037 56.0541 42.2601 174.7801 98 K 4.3963 9.3249 125.2852 55.9225 33.8130 175.0193 99 T 5.0757 8.6228 122.2035 60.7752 69.2052 173.3607 100 T 4.6171 8.9384 125.2839 61.8692 71.6927 172.6127 101 Q 4.9267 8.6030 127.7431 54.9545 30.7763 174.1245 102 A 4.4786 8.7924 126.2086 51.7181 23.7012 174.3043 103 N 5.3980 8.4769 116.3592 51.8263 40.5981 174.7529 104 K 4.4999 8.8894 121.7239 55.9106 37.5651 174.4695 105 H 4.7050 8.8743 118.7133 55.5910 29.8977 175.0540 106 I 4.7606 8.2377 113.8535 59.2411 41.0484 174.2553 107 I 5.2016 8.2650 122.8073 59.8570 40.3190 175.2631 108 V 4.6810 8.6153 117.8715 59.7329 36.4060 174.1366 109 A 4.9469 8.5500 124.2469 51.3478 20.1456 177.3705 110 C 5.0349 9.3682 118.3225 55.2296 43.1603 173.6013 111 E 4.7789 8.5103 120.3703 54.0394 33.2049 175.6727 112 G 3.6361 8.6010 110.3113 45.9001 0.0000 173.4027 113 N 4.0861 8.4736 122.6288 54.4050 38.9290 173.8361 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 8.31 4.21 0.00 1.74 1.79 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.51 3.86 0.00 2.06 1.86 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 2.36 2.38 0.00 3 T 8.74 4.20 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 1.22 0.00 0.00 4 A 8.48 4.11 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 5 A 7.94 3.92 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 6 A 8.40 4.18 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.59 3.96 0.00 1.96 1.99 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.62 7.81 8 F 8.36 4.03 0.00 3.36 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 9 E 8.37 3.99 0.00 2.33 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 2.45 2.53 0.00 10 R 7.60 3.86 0.00 1.84 2.07 0.00 3.41 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 11 Q 8.14 4.04 0.00 1.36 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.49 0.00 0.00 0.00 0.00 0.00 2.25 2.41 0.00 12 H 8.25 4.74 0.00 1.92 2.84 0.00 5.61 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.02 4.71 0.00 1.96 2.14 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.65 0.00 14 D 8.74 4.82 0.00 2.83 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.34 4.57 0.00 3.93 3.92 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 16 S 8.06 4.54 0.00 3.98 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 17 T 7.43 4.67 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 1.41 0.00 0.00 18 S 8.68 4.25 0.00 3.99 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 19 A 7.04 3.79 1.11 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 0.00 0.00 20 A 9.38 3.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.86 4.21 0.00 4.01 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 22 S 7.61 4.77 0.00 3.98 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 23 S 8.70 4.33 0.00 4.04 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 24 N 7.94 4.81 0.00 2.83 2.88 0.00 0.00 6.47 8.79 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 25 Y 8.06 4.00 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 26 C 8.36 4.29 0.00 3.17 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 27 N 8.22 4.42 0.00 2.96 2.92 0.00 0.00 6.76 7.74 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 28 Q 7.85 3.79 0.00 2.33 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 29 M 7.77 3.70 0.00 0.75 1.13 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.82 0.00 30 M 8.16 4.07 0.00 1.71 1.84 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 2.53 0.00 31 K 7.82 4.38 0.00 1.91 2.02 0.00 1.57 0.00 0.00 1.78 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.33 7.81 32 S 7.81 4.15 0.00 4.01 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.79 4.20 0.00 2.05 2.06 0.00 3.55 0.00 0.00 3.14 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.11 0.00 34 N 8.20 4.33 0.00 2.81 2.92 0.00 0.00 7.11 7.36 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 35 L 8.97 4.57 0.00 1.73 1.64 0.88 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.46 5.68 4.38 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 1.42 0.00 0.00 37 K 8.46 4.15 0.00 1.80 1.95 0.00 1.68 0.00 0.00 1.93 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.61 1.55 7.81 38 D 8.07 4.62 0.00 2.63 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 39 R 7.44 4.02 0.00 1.90 1.73 0.00 3.00 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 40 C 8.58 5.00 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 41 K 8.63 4.20 0.00 1.92 1.78 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.13 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.40 7.81 42 P 0.00 4.59 0.00 2.19 2.33 0.00 3.73 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.00 0.00 43 V 7.50 5.09 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 0.91 0.00 0.00 0.97 0.00 0.00 44 N 9.00 4.71 0.00 2.67 2.32 0.00 0.00 7.12 7.43 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 45 T 8.17 5.00 4.11 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 1.24 0.00 0.00 46 F 9.56 4.94 0.00 3.06 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 47 V 9.18 4.46 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 1.00 0.00 0.00 0.92 0.00 0.00 48 H 8.57 5.93 0.00 3.04 3.57 0.00 5.62 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.76 4.79 0.00 1.92 1.82 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 2.24 2.25 0.00 50 S 8.34 4.43 0.00 4.02 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 51 L 8.65 4.01 0.00 1.82 1.75 1.02 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 52 A 7.99 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 53 D 7.79 4.32 0.00 2.91 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 54 V 7.58 3.80 2.19 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 1.33 0.00 0.00 1.00 0.00 0.00 55 Q 8.72 3.90 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 56 A 8.15 3.96 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 57 V 7.95 3.41 2.21 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 1.04 0.00 0.00 0.92 0.00 0.00 58 C 7.97 3.97 0.00 2.82 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 59 S 7.69 4.66 0.00 3.86 3.77 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 60 Q 7.36 4.28 0.00 1.83 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.96 0.00 0.00 0.00 0.00 0.00 1.51 2.08 0.00 61 K 8.22 4.28 0.00 2.12 1.88 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.50 1.47 7.81 62 N 8.82 4.47 0.00 2.76 2.66 0.00 0.00 7.01 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 63 V 8.29 4.60 2.02 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 0.69 0.00 0.00 0.85 0.00 0.00 64 A 8.37 4.36 1.19 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 0.00 0.00 65 C 8.68 4.63 0.00 3.20 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 66 K 8.59 3.81 0.00 1.68 1.84 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.13 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.50 7.81 67 N 8.08 4.56 0.00 2.87 2.90 0.00 0.00 6.13 7.00 0.00 0.00 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 8.07 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 69 Q 9.20 4.17 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 70 T 8.24 4.69 4.21 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 1.18 0.00 0.00 71 N 8.01 5.06 0.00 3.10 3.04 0.00 0.00 6.05 7.68 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 72 C 7.42 5.40 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 73 Y 8.90 5.05 0.00 2.74 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 74 Q 9.46 5.12 0.00 2.04 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.96 0.00 0.00 0.00 0.00 0.00 2.32 2.30 0.00 75 S 8.57 4.46 0.00 3.91 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 76 Y 8.73 4.53 0.00 3.07 2.98 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 77 S 7.80 4.83 0.00 3.84 3.78 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 78 T 7.99 4.18 4.28 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 1.08 0.00 0.00 79 M 9.59 5.01 0.00 1.92 1.95 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 80 S 9.69 4.65 0.00 3.86 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 81 I 9.40 5.18 1.97 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.26 0.92 0.00 0.00 82 T 9.14 4.98 4.37 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 1.23 0.00 0.00 83 D 9.77 4.92 0.00 2.74 2.58 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 84 C 9.63 5.57 0.00 2.99 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 85 R 8.92 5.21 0.00 1.98 1.81 0.00 3.18 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 86 E 9.34 4.15 0.00 2.00 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 2.10 1.86 0.00 87 T 8.73 4.10 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 1.20 0.00 0.00 88 G 8.81 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 89 S 7.87 4.23 0.00 3.97 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 90 S 7.52 3.97 0.00 3.89 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 91 K 8.35 4.51 0.00 1.86 1.59 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.33 1.41 7.81 92 Y 8.70 4.42 0.00 2.96 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 93 P 0.00 3.83 0.00 1.87 1.34 0.00 3.67 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.75 0.00 94 N 7.78 4.59 0.00 2.91 2.77 0.00 0.00 7.02 7.63 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 95 C 8.14 4.47 0.00 3.10 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 96 A 8.08 5.00 1.13 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 97 Y 8.43 5.20 0.00 2.87 2.87 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 98 K 9.32 4.40 0.00 1.86 1.75 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.42 7.81 99 T 8.62 5.08 4.40 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 1.31 0.00 0.00 100 T 8.94 4.62 4.28 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 1.23 0.00 0.00 101 Q 8.60 4.93 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.81 0.00 0.00 0.00 0.00 0.00 2.20 2.36 0.00 102 A 8.79 4.48 1.20 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 0.00 0.00 103 N 8.48 5.40 0.00 2.59 2.72 0.00 0.00 6.72 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 0.00 104 K 8.89 4.50 0.00 1.67 1.70 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.41 7.81 105 H 8.87 4.70 0.00 3.02 3.29 0.00 5.83 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.24 4.76 1.91 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.94 0.93 0.00 0.00 107 I 8.26 5.20 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.69 0.95 0.00 0.00 108 V 8.62 4.68 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 0.86 0.00 0.00 0.88 0.00 0.00 109 A 8.55 4.95 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 0.00 110 C 9.37 5.03 0.00 2.75 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 0.00 111 E 8.51 4.78 0.00 1.86 1.77 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 2.19 2.27 0.00 112 G 8.60 3.64 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 0.00 0.00 0.00 113 N 8.47 4.09 0.00 2.59 2.58 0.00 0.00 7.06 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