NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 S 4.3408 8.3231 115.2898 58.3730 63.9203 176.1547 4 G 3.8370 8.7918 104.2055 43.8743 0.0000 171.6080 5 I 4.4133 7.5671 118.2637 59.3787 40.4582 174.0142 6 N 4.8578 8.5062 122.6418 51.6086 41.7378 173.0138 7 A 4.4497 8.5038 128.3639 51.1485 20.0162 177.2018 8 S 4.4925 8.4408 118.8632 58.1609 63.9836 173.8990 9 V 4.4759 8.0036 114.8824 59.5999 33.9819 175.7686 10 V 4.2240 8.0403 121.2696 60.1133 32.9870 175.4299 11 N 4.8065 8.5676 120.7150 52.0731 39.7032 173.0802 12 I 4.7915 7.9109 117.1400 59.3678 38.5393 177.3663 13 Q 3.9095 8.1032 124.8927 59.8492 28.5706 178.2890 14 K 3.8701 8.0893 119.9663 59.7008 32.0306 178.4283 15 E 3.9783 8.0579 118.1865 59.1980 29.1727 178.9246 16 I 3.7186 7.9462 120.0465 64.5296 37.2189 178.1011 17 D 4.3580 8.1805 119.4816 57.4331 40.7187 178.6074 18 R 3.8913 8.1742 119.3448 59.7576 29.9961 178.3674 19 L 4.0559 7.9999 118.3773 57.8906 41.6000 179.2881 20 N 4.3415 7.8860 115.9521 56.1759 38.4094 177.1216 21 E 3.9007 8.2001 120.6847 59.3492 29.7519 179.0318 22 V 3.5527 8.3077 118.4935 65.7511 31.3159 177.7356 23 A 3.9675 7.8690 119.5949 55.2301 18.5907 179.3435 24 K 4.0350 8.0499 116.8730 59.8651 32.1265 179.3173 25 N 4.4719 8.3461 116.1994 55.6738 38.4133 177.3613 26 L 4.0939 7.8128 120.2496 57.1917 41.6426 178.7071 27 N 4.2769 8.1146 117.1103 56.6516 38.3621 176.6520 28 E 4.2456 7.9577 117.0759 57.7751 29.6113 177.5757 29 S 4.6666 7.6495 112.3655 57.5957 63.9360 174.5869 30 L 4.1426 7.5794 121.0192 55.1244 41.9247 176.2751 31 I 4.2128 7.9656 122.0017 59.7417 38.5644 175.2691 32 D 4.5605 8.4925 124.9145 53.2670 40.9739 176.6417 33 L 4.0607 8.5171 128.2186 57.8067 41.9411 179.7615 34 Q 4.0744 8.2169 117.0058 58.7628 28.6781 177.6294 35 E 4.1719 7.8526 115.7875 57.5834 29.9743 176.7096 36 L 4.2768 7.7372 123.6615 54.7381 41.8085 176.1745 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 3 S 8.32 4.34 0.00 3.85 2.96 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 4 G 8.79 3.84 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 0.00 0.00 0.00 5 I 7.57 4.41 1.87 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 1.30 0.68 0.91 0.00 0.00 6 N 8.51 4.86 0.00 2.61 2.63 0.00 0.00 7.12 7.96 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 7 A 8.50 4.45 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 8 S 8.44 4.49 0.00 3.87 3.80 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 9 V 8.00 4.48 2.08 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 0.76 0.00 0.00 0.93 0.00 0.00 10 V 8.04 4.22 2.08 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 0.71 0.00 0.00 0.93 0.00 0.00 11 N 8.57 4.81 0.00 2.65 2.74 0.00 0.00 6.85 7.94 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 12 I 7.91 4.79 1.87 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 1.28 1.52 0.91 0.00 0.00 13 Q 8.10 3.91 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.72 0.00 14 K 8.09 3.87 0.00 1.86 1.80 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.54 7.81 15 E 8.06 3.98 0.00 2.25 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 2.39 2.45 0.00 16 I 7.95 3.72 1.87 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 1.52 1.00 0.91 0.00 0.00 17 D 8.18 4.36 0.00 2.81 2.71 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 0.00 0.00 0.00 0.00 18 R 8.17 3.89 0.00 2.02 2.09 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 19 L 8.00 4.06 0.00 1.74 1.70 0.92 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 20 N 7.89 4.34 0.00 2.98 2.86 0.00 0.00 6.65 7.33 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 21 E 8.20 3.90 0.00 2.17 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 2.30 2.31 0.00 22 V 8.31 3.55 2.08 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 0.95 0.00 0.00 0.98 0.00 0.00 23 A 7.87 3.97 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 24 K 8.05 4.04 0.00 1.99 1.88 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.46 1.57 7.81 25 N 8.35 4.47 0.00 2.85 2.86 0.00 0.00 7.06 6.45 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 26 L 7.81 4.09 0.00 1.85 1.72 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.11 4.28 0.00 2.89 2.89 0.00 0.00 6.85 7.18 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 28 E 7.96 4.25 0.00 2.11 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 2.34 2.31 0.00 29 S 7.65 4.67 0.00 3.95 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 30 L 7.58 4.14 0.00 1.68 1.65 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.97 4.21 1.87 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 1.30 0.53 0.91 0.00 0.00 32 D 8.49 4.56 0.00 2.75 2.57 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 0.00 0.00 0.00 0.00 33 L 8.52 4.06 0.00 1.75 1.70 0.92 0.94 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 34 Q 8.22 4.07 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.98 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 35 E 7.85 4.17 0.00 2.02 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 0.00 2.34 2.32 0.00 36 L 7.74 4.28 0.00 1.78 1.56 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00