NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 S 4.2334 8.3349 115.2815 59.0553 63.5422 170.8280 8 H 4.0462 8.7208 127.6479 52.2662 28.3869 172.5277 9 P 4.4429 0.0000 0.0000 62.9734 32.7885 175.4886 10 E 4.3797 8.5567 121.7410 56.8155 29.9216 176.5395 11 D 4.8523 7.9434 119.1483 53.0248 41.1721 177.3859 12 D 4.7117 7.7442 128.6868 51.5215 42.1562 177.6404 13 W 4.1316 8.4429 127.9136 58.3207 32.5452 174.3478 14 L 3.6055 8.9402 130.4371 55.7172 39.1665 175.7079 15 E 4.3903 8.3488 116.0820 58.5475 26.2973 174.5800 16 N 4.2989 7.8026 109.9753 54.5169 36.9433 174.8448 17 I 4.2744 8.2437 117.4174 61.9156 39.0662 175.9067 18 D 4.7344 8.0064 121.9563 52.5017 45.1944 174.7408 19 V 4.1007 7.9445 121.1634 61.3850 33.0706 175.4117 20 C 4.2673 8.4753 128.5930 58.4835 30.2146 173.5291 21 E 4.0154 8.5899 125.9846 58.7158 29.4107 178.1552 22 N 4.3536 8.2852 117.9143 56.0675 38.7283 174.7132 23 C 4.2820 7.4543 108.7889 56.8656 30.8444 174.7094 24 H 4.2520 8.6922 119.6220 56.4230 30.0333 174.0264 25 Y 4.7291 6.7029 116.8363 57.1172 39.1185 173.3550 26 P 4.1539 0.0000 0.0000 63.0564 32.1159 176.0329 27 I 4.1488 8.1477 126.0770 60.0639 37.3252 175.5040 28 V 4.2232 8.1101 126.6787 60.2554 33.5472 173.3825 29 P 4.6585 0.0000 0.0000 60.9546 32.7136 175.6330 30 L 3.7705 8.4123 119.2891 55.8413 41.6656 176.9677 31 D 4.7957 8.6899 124.3321 52.9027 40.6186 175.9244 32 G 4.2867 8.3701 113.8184 44.4601 0.0000 170.6455 33 K 4.6154 8.3843 116.7079 55.2610 35.6243 174.5369 34 G 3.5498 9.0016 111.0123 46.2259 0.0000 173.9586 35 T 3.9856 7.8180 118.9834 62.2962 67.3153 173.4806 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 7 S 8.33 4.23 0.00 3.75 3.66 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.72 4.05 0.00 3.43 3.27 0.00 5.76 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.44 0.00 2.20 2.07 0.00 3.79 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 10 E 8.56 4.38 0.00 1.97 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 2.28 2.34 0.00 11 D 7.94 4.85 0.00 2.71 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 12 D 7.74 4.71 0.00 2.68 2.63 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 13 W 8.44 4.13 0.00 3.40 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 14 L 8.94 3.61 0.00 2.26 2.14 0.63 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.35 4.39 0.00 2.17 2.50 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 2.19 2.25 0.00 16 N 7.80 4.30 0.00 3.08 3.17 0.00 0.00 6.79 7.84 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 17 I 8.24 4.27 1.84 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.84 0.47 0.00 0.00 18 D 8.01 4.73 0.00 2.49 2.40 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 0.00 19 V 7.94 4.10 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 0.80 0.00 0.00 0.82 0.00 0.00 20 C 8.48 4.27 0.00 2.91 2.99 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 21 E 8.59 4.02 0.00 2.11 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 0.00 2.25 2.28 0.00 22 N 8.29 4.35 0.00 2.62 2.81 0.00 0.00 6.71 7.62 0.00 0.00 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 C 7.45 4.28 0.00 1.75 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 24 H 8.69 4.25 0.00 3.10 3.56 0.00 5.76 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 6.70 4.73 0.00 2.93 2.73 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 0.00 0.00 0.00 0.00 26 P 0.00 4.15 0.00 1.71 1.22 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 27 I 8.15 4.15 1.76 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.48 0.84 0.00 0.00 28 V 8.11 4.22 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 0.81 0.00 0.00 0.86 0.00 0.00 29 P 0.00 4.66 0.00 2.20 2.00 0.00 3.83 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 30 L 8.41 3.77 0.00 1.65 1.69 0.92 1.01 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 D 8.69 4.80 0.00 2.65 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 32 G 8.37 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.38 4.62 0.00 1.79 1.73 0.00 1.46 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.49 7.81 34 G 9.00 3.55 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 0.00 0.00 0.00 35 T 7.82 3.99 4.24 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 1.21 0.00 0.00