NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3971 0.0000 0.0000 61.7947 32.6537 175.9521 2 K 3.6830 8.7135 119.2739 56.5630 32.4206 175.2280 3 I 3.8182 9.2916 125.6900 61.1796 38.2024 175.7170 4 K 4.1477 8.6249 126.0426 56.1701 32.2082 177.0335 5 T 4.0141 8.3734 119.1412 61.5490 68.2359 174.1930 6 V 3.7936 8.4486 127.5730 62.6226 31.2231 176.9348 7 R 3.9216 8.8900 127.6014 59.4345 30.4649 179.4755 8 G 3.7285 8.3908 103.8450 48.0722 0.0000 175.2527 9 A 4.2285 8.1420 122.3036 54.5636 18.1282 179.3473 10 A 4.2050 8.1850 118.8082 53.9894 18.4603 178.7725 11 K 4.5802 7.5831 115.9121 56.2119 32.9373 177.3036 12 R 4.4440 7.8772 116.7988 55.2758 33.2777 174.6380 13 F 5.2846 7.8214 114.6997 54.7247 42.7513 175.2498 14 K 4.5045 9.0738 122.2648 55.1742 34.3195 175.4021 15 K 3.3706 8.9787 128.9690 57.5250 32.2561 176.1343 16 T 4.5936 7.6808 116.8682 59.9776 71.3866 174.9843 17 G 3.5573 8.7024 108.9651 48.5217 0.0000 174.5843 18 K 4.3092 8.1296 116.1266 55.8795 32.4185 176.9570 19 G 3.8421 7.7553 106.8795 44.9622 0.0000 176.4628 20 G 3.9745 7.4404 110.4922 45.3862 0.0000 174.0119 21 F 4.6257 8.6557 113.4221 57.3574 45.0037 171.5404 22 K 4.6703 8.7266 124.4161 55.8621 33.6778 173.7805 23 H 4.8287 7.9578 113.8684 54.6889 31.3984 172.1337 24 K 4.4024 8.0777 120.1996 55.5278 32.9529 175.9259 25 H 4.3764 8.3589 120.2574 55.6821 29.2783 175.3316 26 A 4.3536 8.2899 125.1281 52.4520 19.6602 177.6407 27 N 4.5915 8.9488 115.5301 53.2445 36.7422 174.9891 28 L 4.7474 7.4294 119.1458 53.5162 41.5018 175.8597 29 R 4.5652 7.2045 114.5191 55.8575 33.2929 173.0859 30 H 4.1281 8.4475 114.6618 57.3456 32.1871 175.2258 31 I 3.1687 6.8142 116.8532 62.2003 34.8631 172.8860 32 L 4.6288 7.5936 128.0237 54.8078 44.2448 178.8068 33 T 3.8418 8.0693 112.4869 64.3898 67.2227 174.3825 34 K 4.3195 7.8946 117.5434 56.7161 33.4513 176.2973 35 K 4.4691 7.5640 119.3642 54.6869 33.9318 176.8705 36 A 4.1676 8.2102 123.4616 52.2836 20.3742 179.0879 37 T 3.7789 8.4180 119.3396 66.9051 68.7429 176.3685 38 K 3.6250 8.1478 120.6248 59.6919 31.7762 177.9873 39 R 3.8697 7.8678 118.5411 59.7080 30.0534 178.3941 40 K 4.0791 8.0152 117.8130 59.4486 31.5545 178.9783 41 R 3.9140 8.2727 119.3535 60.1920 29.6606 177.8026 42 H 4.5730 7.8201 113.0369 57.6156 28.9409 176.7928 43 L 4.2694 8.7041 120.4828 55.8770 41.7632 178.8419 44 R 4.0800 7.4662 117.6641 57.6990 30.3664 175.3421 45 P 4.3468 0.0000 0.0000 62.8118 31.5944 175.4251 46 K 4.4909 8.2193 118.2784 56.4596 33.6179 175.8223 47 A 4.5191 8.0101 119.3557 51.5142 22.8182 176.0784 48 M 4.7141 8.7034 119.6821 55.0509 33.0019 176.8084 49 V 4.0355 8.4154 121.7293 60.9257 33.1905 176.9013 50 S 4.5135 8.2937 117.6772 57.6254 64.8631 175.4792 51 K 4.0714 8.4864 120.2300 59.6772 31.5914 179.7134 52 G 3.7638 8.0476 104.1582 48.0256 0.0000 174.8161 53 D 4.4589 7.6477 117.5336 56.3655 40.9467 178.2262 54 L 3.8962 7.8174 120.9641 58.3046 41.8782 179.3574 55 G 3.5454 7.9668 104.7380 48.0039 0.0000 174.9233 56 L 3.8509 7.8088 120.3072 57.3768 41.9246 179.1487 57 V 3.2702 7.3882 117.2295 66.2835 31.3015 178.1721 58 I 3.5722 7.4220 118.7388 64.4381 36.8060 178.1686 59 A 4.0664 7.7910 119.6402 54.5485 18.4375 178.4222 60 C 4.4275 8.2923 114.7453 59.9032 29.7730 173.4940 61 L 5.2890 7.6787 120.3402 52.3023 41.8051 175.8608 62 P 3.7248 0.0000 0.0000 65.3826 31.4852 177.0896 63 Y 4.5519 7.8496 114.2729 57.5623 38.4163 175.3330 64 A 4.3026 8.8022 130.1299 52.5686 18.5005 178.0998 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 P 0.00 4.40 0.00 2.19 2.13 0.00 3.52 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.12 0.00 2 K 8.71 3.68 0.00 1.86 1.87 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.54 7.81 3 I 9.29 3.82 1.99 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 1.44 0.51 0.97 0.00 0.00 4 K 8.62 4.15 0.00 1.78 1.79 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.45 7.81 5 T 8.37 4.01 4.41 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 1.26 0.00 0.00 6 V 8.45 3.79 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 0.92 0.00 0.00 1.00 0.00 0.00 7 R 8.89 3.92 0.00 1.89 1.98 0.00 3.39 0.00 0.00 3.54 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.59 0.00 8 G 8.39 3.73 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 0.00 0.00 0.00 9 A 8.14 4.23 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.18 4.20 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 11 K 7.58 4.58 0.00 1.73 1.80 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.65 7.81 12 R 7.88 4.44 0.00 1.26 1.32 0.00 2.92 0.00 0.00 3.04 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.46 0.00 13 F 7.82 5.28 0.00 2.93 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 14 K 9.07 4.50 0.00 1.84 1.75 0.00 1.89 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.58 7.81 15 K 8.98 3.37 0.00 1.66 1.70 0.00 1.03 0.00 0.00 1.19 0.00 0.00 2.66 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.28 1.25 7.81 16 T 7.68 4.59 4.19 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 1.24 0.00 0.00 17 G 8.70 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 K 8.13 4.31 0.00 1.70 1.78 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.32 1.37 7.81 19 G 7.76 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 20 G 7.44 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 21 F 8.66 4.63 0.00 3.14 3.10 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 0.00 0.00 0.00 0.00 22 K 8.73 4.67 0.00 2.13 2.06 0.00 1.71 0.00 0.00 1.87 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.42 7.81 23 H 7.96 4.83 0.00 3.18 3.38 0.00 5.81 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 24 K 8.08 4.40 0.00 1.68 1.69 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.77 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.43 7.81 25 H 8.36 4.38 0.00 3.39 3.19 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.29 4.35 1.26 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 0.00 0.00 27 N 8.95 4.59 0.00 2.89 3.15 0.00 0.00 6.66 7.85 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 28 L 7.43 4.75 0.00 1.56 1.57 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.20 4.57 0.00 1.75 1.85 0.00 3.34 0.00 0.00 3.13 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 30 H 8.45 4.13 0.00 3.07 3.13 0.00 5.80 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 6.81 3.17 1.76 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.71 0.88 0.00 0.00 32 L 7.59 4.63 0.00 1.70 1.64 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.07 3.84 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 1.19 0.00 0.00 34 K 7.89 4.32 0.00 1.89 1.89 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.44 7.81 35 K 7.56 4.47 0.00 1.78 1.75 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.40 1.36 7.81 36 A 8.21 4.17 1.26 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 0.00 0.00 37 T 8.42 3.78 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 1.19 0.00 0.00 38 K 8.15 3.63 0.00 1.77 1.73 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.44 7.81 39 R 7.87 3.87 0.00 1.83 2.09 0.00 3.29 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 1.61 1.74 0.00 40 K 8.02 4.08 0.00 1.84 1.83 0.00 1.74 0.00 0.00 1.57 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.59 7.81 41 R 8.27 3.91 0.00 1.86 2.06 0.00 3.09 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 42 H 7.82 4.57 0.00 3.17 3.30 0.00 5.72 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.70 4.27 0.00 1.65 1.72 0.91 0.81 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 44 R 7.47 4.08 0.00 2.02 2.00 0.00 3.19 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 45 P 0.00 4.35 0.00 2.19 2.10 0.00 3.89 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.04 0.00 46 K 8.22 4.49 0.00 1.65 1.79 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.38 7.81 47 A 8.01 4.52 1.08 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 0.00 0.00 48 M 8.70 4.71 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.51 0.00 49 V 8.42 4.04 2.13 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 0.90 0.00 0.00 0.86 0.00 0.00 50 S 8.29 4.51 0.00 4.08 4.10 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 0.00 0.00 0.00 0.00 51 K 8.49 4.07 0.00 1.87 1.89 0.00 1.58 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.53 1.57 7.81 52 G 8.05 3.76 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 0.00 0.00 0.00 53 D 7.65 4.46 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 54 L 7.82 3.90 0.00 2.02 1.70 1.09 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.97 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 56 L 7.81 3.85 0.00 1.61 1.64 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.39 3.27 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 -0.57 0.00 0.00 0.12 0.00 0.00 58 I 7.42 3.57 1.82 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 1.62 0.65 0.93 0.00 0.00 59 A 7.79 4.07 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 60 C 8.29 4.43 0.00 3.01 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 61 L 7.68 5.29 0.00 1.72 1.66 0.86 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 3.72 0.00 1.64 2.07 0.00 3.91 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.07 0.00 63 Y 7.85 4.55 0.00 3.02 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 64 A 8.80 4.30 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00