NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 T 4.2780 8.1593 115.2355 62.0952 68.1350 173.0240 7 V 4.0212 7.2328 121.2400 59.0947 34.2085 175.8702 8 F 4.8542 8.0240 122.9591 56.9447 40.8731 176.8885 9 S 4.5639 8.9962 117.6502 57.6938 65.2599 175.1129 10 Q 3.9541 8.7529 122.5391 59.5616 28.4834 179.8789 11 A 3.9655 7.9195 120.7337 55.2010 18.5008 179.5151 12 Q 3.7678 7.8709 116.0435 59.0145 28.6990 178.8863 13 L 3.7410 8.1170 120.2539 57.9728 41.6895 179.2771 14 C 3.9871 8.3819 116.6275 62.8176 28.1229 176.1405 15 A 3.8932 7.7752 121.9860 55.0767 17.8946 179.3473 16 L 3.5029 7.4744 117.3695 58.0427 41.6163 180.1333 17 K 4.0907 7.8215 118.1276 59.5165 31.5465 178.9741 18 D 4.3734 8.0542 118.4749 56.9940 41.1099 178.3464 19 R 4.0762 8.1193 119.5243 59.2992 29.9350 177.9736 20 F 4.8691 8.2791 121.0336 61.0588 39.3427 176.7475 21 Q 3.9549 7.9267 116.2712 58.6835 28.5286 178.4874 22 K 4.4140 7.2972 118.4871 56.9074 32.9330 177.2244 23 Q 4.3844 8.1919 118.6970 54.2929 31.9187 175.7722 24 K 3.5378 8.6808 123.4211 57.9685 32.6291 177.1290 25 Y 4.8007 7.8814 114.7801 55.9012 40.5502 174.7842 26 L 4.8919 8.0883 122.9708 52.3095 45.0435 177.1451 27 S 4.4096 9.4121 117.5880 57.6698 65.0490 175.2470 28 L 4.0330 8.4792 123.3031 58.7452 41.6086 179.0885 29 Q 3.9655 8.0201 117.0806 59.1219 28.7958 178.4613 30 Q 3.9788 7.7633 118.6182 59.5068 28.7747 179.0810 31 M 4.1564 8.0070 118.7796 57.6759 31.9294 178.7091 32 Q 4.0768 8.0895 120.3663 59.2680 29.4403 178.0107 33 E 4.0970 8.4737 118.4112 58.6871 29.6768 178.7149 34 L 3.9674 7.9081 122.1879 58.0683 42.1349 178.9324 35 S 4.1580 8.2164 114.1569 61.0852 62.9345 176.5102 36 S 4.0203 7.7873 116.9495 61.4959 62.0407 175.8365 37 I 3.6789 7.3812 121.0967 64.3666 37.0111 177.6495 38 L 4.1602 7.5475 116.4525 53.9197 42.2166 175.8928 39 N 4.1789 7.9110 116.1281 54.8867 37.5800 173.4109 40 L 4.8467 7.9518 115.3380 51.7673 45.7212 177.7999 41 S 4.3882 8.5166 115.9774 58.3915 65.0061 174.8442 42 Y 4.1009 8.6681 124.1587 60.9176 38.5526 178.4414 43 K 3.8288 8.2315 119.9898 59.6752 32.2333 178.6352 44 Q 4.1603 7.8905 118.0473 58.8259 28.6180 178.8884 45 V 3.6496 7.6083 118.8183 66.0459 31.7269 177.8045 46 K 3.8821 7.7477 119.3584 59.9966 31.8364 178.8225 47 T 3.9088 8.0199 115.8199 66.2125 68.4499 176.3365 48 W 4.0902 8.5010 130.4298 60.7072 30.7274 177.8859 49 F 3.7617 9.0842 117.8806 60.4554 38.5224 177.2305 50 Q 3.9641 8.2623 119.0304 59.6408 28.6617 178.5075 51 N 4.2778 8.2756 116.0392 55.9428 38.7457 177.1152 52 Q 3.5583 7.3652 121.1591 59.0088 28.9714 178.2931 53 R 4.3283 7.8431 119.0950 59.6957 29.9259 178.7802 54 M 4.2638 7.7344 116.3078 57.4618 31.9307 178.4603 55 K 4.2758 7.8453 118.6730 57.6427 32.4139 176.8883 56 C 4.1842 7.7667 116.5354 59.1901 30.4443 177.4495 57 K 4.2955 7.3013 122.4461 58.5629 35.6991 177.1623 58 R 4.0705 7.3226 118.0798 57.0000 30.1306 177.5810 59 W 4.7587 7.8820 117.8256 58.2091 29.7289 176.3240 60 Q 4.3188 7.9034 121.9950 56.1864 28.0760 175.7961 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 6 T 8.16 4.28 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 1.16 0.00 0.00 7 V 7.23 4.02 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 0.79 0.00 0.00 0.89 0.00 0.00 8 F 8.02 4.85 0.00 3.03 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 9 S 9.00 4.56 0.00 4.05 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 10 Q 8.75 3.95 0.00 2.11 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.95 0.00 0.00 0.00 0.00 0.00 2.47 2.48 0.00 11 A 7.92 3.97 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 12 Q 7.87 3.77 0.00 2.20 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.72 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 13 L 8.12 3.74 0.00 1.85 1.72 0.98 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 14 C 8.38 3.99 0.00 3.09 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 15 A 7.78 3.89 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 16 L 7.47 3.50 0.00 0.76 0.13 -0.12 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.82 4.09 0.00 1.97 1.91 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.67 1.65 7.81 18 D 8.05 4.37 0.00 2.95 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 19 R 8.12 4.08 0.00 2.06 2.26 0.00 3.28 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.92 0.00 20 F 8.28 4.87 0.00 3.09 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 21 Q 7.93 3.95 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.68 0.00 0.00 0.00 0.00 0.00 2.40 2.64 0.00 22 K 7.30 4.41 0.00 1.85 1.85 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.31 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.66 7.81 23 Q 8.19 4.38 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 24 K 8.68 3.54 0.00 1.63 1.48 0.00 0.65 0.00 0.00 0.61 0.00 0.00 2.31 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.08 1.19 7.81 25 Y 7.88 4.80 0.00 2.91 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 26 L 8.09 4.89 0.00 1.21 1.38 0.61 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 27 S 9.41 4.41 0.00 4.01 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 28 L 8.48 4.03 0.00 1.74 1.73 0.87 0.41 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 29 Q 8.02 3.97 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.63 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 30 Q 7.76 3.98 0.00 2.24 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 31 M 8.01 4.16 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.29 0.00 32 Q 8.09 4.08 0.00 2.34 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 33 E 8.47 4.10 0.00 2.22 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 0.00 2.43 2.40 0.00 34 L 7.91 3.97 0.00 1.94 1.73 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.22 4.16 0.00 4.38 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 0.00 36 S 7.79 4.02 0.00 3.95 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 37 I 7.38 3.68 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.90 0.88 0.00 0.00 38 L 7.55 4.16 0.00 1.65 1.54 0.84 1.28 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 39 N 7.91 4.18 0.00 2.83 2.84 0.00 0.00 6.92 7.50 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 40 L 7.95 4.85 0.00 1.45 1.34 0.19 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.52 4.39 0.00 4.16 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 42 Y 8.67 4.10 0.00 3.03 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 43 K 8.23 3.83 0.00 1.95 1.85 0.00 1.83 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.60 7.81 44 Q 7.89 4.16 0.00 2.34 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.60 0.00 0.00 0.00 0.00 0.00 2.71 2.51 0.00 45 V 7.61 3.65 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 1.18 0.00 0.00 0.86 0.00 0.00 46 K 7.75 3.88 0.00 1.32 1.51 0.00 1.67 0.00 0.00 1.41 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.46 7.81 47 T 8.02 3.91 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 1.27 0.00 0.00 48 W 8.50 4.09 0.00 3.71 3.45 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 49 F 9.08 3.76 0.00 3.28 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 50 Q 8.26 3.96 0.00 2.24 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 51 N 8.28 4.28 0.00 2.42 2.68 0.00 0.00 7.10 7.70 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 52 Q 7.37 3.56 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 53 R 7.84 4.33 0.00 2.05 2.02 0.00 2.41 0.00 0.00 2.51 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.00 0.00 54 M 7.73 4.26 0.00 1.99 2.20 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.85 0.00 55 K 7.85 4.28 0.00 2.06 1.81 0.00 1.52 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.40 7.81 56 C 7.77 4.18 0.00 1.77 2.01 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 57 K 7.30 4.30 0.00 1.89 2.06 0.00 1.37 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.22 1.27 7.81 58 R 7.32 4.07 0.00 1.97 2.04 0.00 2.85 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.44 0.00 59 W 7.88 4.76 0.00 3.58 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 60 Q 7.90 4.32 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.55 0.00 0.00 0.00 0.00 0.00 2.48 2.71 0.00