NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8283 8.3549 109.7362 45.2784 0.0000 173.3053 2 K 4.2163 8.3475 120.3579 52.4277 32.6449 174.9868 3 K 4.2679 8.2520 124.1860 56.0704 34.8936 177.2708 4 S 4.5585 8.1945 116.5897 57.2973 65.9568 175.0489 5 K 3.9838 8.4258 121.0848 59.2686 31.8095 178.5008 6 A 3.9828 7.8681 120.8558 55.3215 18.4508 179.3652 7 T 3.7936 7.8649 114.3269 66.8269 68.5713 176.6405 8 K 3.9161 8.1236 121.3178 59.4816 32.1615 178.9990 9 K 4.0339 7.8421 118.6636 59.2834 31.8458 179.6514 10 R 3.9006 7.9725 118.3319 59.3911 30.1152 178.9021 11 L 3.9698 8.2210 118.8065 57.7697 41.5674 179.5403 12 A 3.9702 7.9878 120.5041 55.1309 18.4056 179.5005 13 K 3.8499 8.1358 118.0175 59.7398 32.0263 178.8067 14 L 4.0424 8.0518 118.4563 57.9237 41.6855 178.7222 15 D 4.4696 8.1578 117.9286 57.2587 40.8535 177.9091 16 N 4.3221 8.0922 117.5884 56.8058 38.8597 176.9167 17 Q 4.1109 8.3851 118.2299 57.9957 28.8239 176.5541 18 N 4.8333 7.6318 118.0499 53.2676 40.4316 174.3265 19 S 4.7478 6.8935 112.0867 55.5116 65.6910 173.3128 20 R 4.0608 8.1126 121.1291 55.7177 30.5375 175.6920 21 V 3.7885 8.0088 121.2546 60.9017 32.0630 173.7358 22 P 4.0707 0.0000 0.0000 62.9213 31.5104 176.5452 23 A 3.9791 8.9546 124.2056 55.3961 18.5703 179.9534 24 W 4.2795 8.2110 112.9715 59.6694 27.7825 178.4802 25 V 3.3051 6.6444 118.4943 65.6300 30.7096 178.0639 26 M 4.0414 7.6229 118.7464 58.2525 31.8610 178.6364 27 L 3.9982 7.8299 118.5069 57.7475 41.8304 179.2191 28 K 4.2534 8.7074 117.9162 58.3883 32.0512 176.9441 29 T 4.5402 6.9683 106.1684 61.1482 69.1557 173.2405 30 D 4.3412 9.1579 118.0846 55.1565 39.2714 170.8985 31 R 3.8162 7.7034 122.5580 55.5420 30.5504 176.3290 *35 R 3.8054 8.3166 118.9571 56.1240 30.6684 175.1052 36 N 4.5254 8.4233 122.7415 52.3627 38.1493 174.1515 37 H 4.6342 8.4427 121.1401 56.7065 28.7688 176.0543 38 K 4.6188 8.3253 119.6898 55.9769 32.9055 176.6178 39 R 4.1834 8.2057 118.7438 55.6771 30.3145 176.1838 40 R 4.6542 8.4204 123.0891 54.5066 32.6807 174.2514 41 H 5.0257 8.2816 122.3854 53.5559 32.3412 174.8634 42 W 4.1911 8.5912 123.0590 59.2579 27.8669 176.9691 43 R 3.7600 5.8400 117.9654 58.0095 30.0555 177.1923 44 R 3.8843 7.7443 116.7143 58.8340 30.3288 176.6691 45 N 4.7281 7.6138 113.8823 52.2197 40.6419 173.9076 46 D 4.3355 8.1192 118.8561 53.8243 42.2778 175.0535 47 T 4.0987 8.3029 117.2731 61.4185 69.4863 173.2508 48 D 4.5887 8.1931 122.1181 54.3097 42.1199 176.8013 49 E 4.1296 8.6366 118.4477 57.0372 28.9583 174.8728 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 G 8.35 3.83 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 0.00 0.00 0.00 2 K 8.35 4.22 0.00 1.82 1.77 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.43 7.81 3 K 8.25 4.27 0.00 1.86 1.80 0.00 1.56 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.42 7.81 4 S 8.19 4.56 0.00 4.07 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 5 K 8.43 3.98 0.00 1.84 1.84 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.50 7.81 6 A 7.87 3.98 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 7 T 7.86 3.79 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 8 K 8.12 3.92 0.00 1.94 1.97 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.48 7.81 9 K 7.84 4.03 0.00 1.96 1.84 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.68 7.81 10 R 7.97 3.90 0.00 2.06 1.98 0.00 3.39 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 1.65 1.89 0.00 11 L 8.22 3.97 0.00 1.81 1.74 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 12 A 7.99 3.97 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.14 3.85 0.00 1.85 1.99 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.50 7.81 14 L 8.05 4.04 0.00 1.86 1.74 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 15 D 8.16 4.47 0.00 2.81 2.85 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 16 N 8.09 4.32 0.00 2.87 2.90 0.00 0.00 7.22 6.90 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 17 Q 8.39 4.11 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.38 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 18 N 7.63 4.83 0.00 2.89 3.00 0.00 0.00 7.01 7.79 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 19 S 6.89 4.75 0.00 3.99 3.83 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 20 R 8.11 4.06 0.00 1.78 1.86 0.00 3.22 0.00 0.00 3.13 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 21 V 8.01 3.79 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 0.69 0.00 0.00 0.86 0.00 0.00 22 P 0.00 4.07 0.00 1.39 2.13 0.00 3.54 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.65 0.00 23 A 8.95 3.98 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.21 4.28 0.00 3.63 3.34 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 0.00 25 V 6.64 3.31 1.72 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 0.77 0.00 0.00 -0.43 0.00 0.00 26 M 7.62 4.04 0.00 1.99 2.21 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.78 0.00 27 L 7.83 4.00 0.00 1.92 1.77 0.99 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.71 4.25 0.00 2.04 2.03 0.00 2.15 0.00 0.00 2.07 0.00 0.00 3.18 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.56 1.59 7.81 29 T 6.97 4.54 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 1.29 0.00 0.00 30 D 9.16 4.34 0.00 2.79 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 31 R 7.70 3.82 0.00 1.98 1.95 0.00 3.19 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.78 0.00 *35 R 8.32 3.81 0.00 1.70 1.82 0.00 3.20 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 36 N 8.42 4.53 0.00 2.61 2.72 0.00 0.00 7.28 7.89 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 37 H 8.44 4.63 0.00 3.18 3.30 0.00 5.71 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.33 4.62 0.00 1.80 1.76 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.38 7.81 39 R 8.21 4.18 0.00 1.80 1.89 0.00 3.15 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 40 R 8.42 4.65 0.00 1.75 1.81 0.00 3.21 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 41 H 8.28 5.03 0.00 3.12 2.97 0.00 5.93 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 W 8.59 4.19 0.00 3.52 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 43 R 5.84 3.76 0.00 0.67 1.20 0.00 2.51 0.00 0.00 2.91 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.24 0.00 44 R 7.74 3.88 0.00 1.75 1.91 0.00 3.33 0.00 0.00 3.11 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.48 0.00 45 N 7.61 4.73 0.00 3.02 2.78 0.00 0.00 6.78 7.86 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 46 D 8.12 4.34 0.00 2.59 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.30 4.10 4.26 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 1.24 0.00 0.00 48 D 8.19 4.59 0.00 2.70 2.67 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 49 E 8.64 4.13 0.00 2.15 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 2.18 2.29 0.00 * Residues marked with a * may have inaccurate shift predictions.