NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4746 0.0000 0.0000 62.3427 33.6351 174.9481 2 I 4.8085 8.3057 122.9720 59.1459 39.9684 173.0132 3 A 4.7687 9.4492 130.1849 49.9821 22.0962 174.4669 4 Q 4.9665 8.6985 122.9112 54.3674 31.4548 174.4197 5 I 4.4823 8.8210 128.0064 59.8698 39.8859 174.2995 6 H 5.6943 9.0764 124.2379 53.6075 29.8412 174.3039 7 I 4.6329 8.0010 115.9975 58.5932 41.3755 174.7197 8 L 4.6622 8.3167 122.9347 54.2688 42.2704 176.9650 9 E 4.2373 8.6367 120.7958 57.1164 29.9076 175.9975 10 G 3.5803 8.7612 109.2275 45.6301 0.0000 174.6224 11 R 4.3170 7.6331 119.3693 55.2779 31.5672 176.7913 12 S 4.5115 8.2636 116.0809 57.8570 65.4807 175.2125 13 D 4.3888 8.5173 121.7544 57.3714 40.4750 178.9542 14 E 3.9276 8.0923 118.6873 59.5762 29.5187 179.1239 15 Q 4.0065 7.7666 118.0807 59.1091 28.7902 179.2871 16 K 3.9848 7.9947 118.8621 59.1383 31.9571 179.1004 17 E 3.9880 8.1269 120.0034 59.3332 29.4306 178.9894 18 T 3.9228 7.9853 116.0645 66.2111 68.5668 176.5019 19 L 3.9272 8.1053 122.4732 58.3680 42.2119 179.1365 20 I 3.7047 7.6998 119.6357 64.2745 37.0085 178.5365 21 R 3.8680 7.8327 119.1122 59.3991 30.0356 178.2053 22 E 3.9487 8.4025 118.7681 59.6470 29.5411 179.6947 23 V 3.6278 7.8514 118.0406 66.0833 31.5708 178.2484 24 S 4.1680 7.8977 114.5376 61.4571 62.5598 176.5975 25 E 3.9256 8.3991 121.1819 59.2489 29.2393 178.9819 26 A 3.9719 8.0062 120.8025 55.3185 18.4070 179.8262 27 I 3.6344 7.8256 118.0736 64.5874 37.2360 178.5931 28 S 4.0713 7.9734 113.9448 61.2980 62.0419 176.1060 29 R 3.8319 8.6619 121.6416 59.7000 29.7111 178.5343 30 S 4.1457 8.0047 113.6753 61.1143 62.9974 175.9335 31 L 4.4350 7.7250 118.0505 53.2490 42.2609 175.6943 32 D 4.3375 7.6389 117.3445 55.2106 40.1650 172.8717 33 A 4.7628 7.4646 118.5736 48.9342 21.3781 175.9000 34 P 4.3083 0.0000 0.0000 62.5358 32.1617 176.9198 35 L 3.8823 8.9356 124.9062 58.5311 41.8928 178.8180 36 T 4.0627 7.8978 106.1958 63.3893 68.6749 174.5771 37 S 4.4569 7.9823 116.3749 58.7940 63.9082 174.3921 38 V 4.0809 7.6122 122.5998 62.7936 32.1483 175.3447 39 R 4.7059 8.9615 126.4527 54.3158 33.2692 174.6232 40 V 4.8771 8.4876 123.0461 61.0508 34.5115 174.4352 41 I 4.5331 8.9234 128.2744 59.6178 40.0449 174.3519 42 I 4.7370 8.3838 127.8559 60.1294 39.1780 175.4066 43 T 4.4902 8.7726 122.9754 61.7399 71.5161 173.1278 44 E 4.7228 8.8405 126.3755 56.1327 30.9127 176.0719 45 M 4.8511 8.7628 122.6802 53.1626 35.2459 175.6365 46 A 4.5095 8.5833 125.6886 51.7455 19.3079 178.6131 47 K 4.0751 8.6805 121.4020 59.1507 32.2723 178.3106 48 G 4.0935 7.9870 105.4508 45.6058 0.0000 173.4735 49 H 4.9597 8.6399 114.5870 54.8808 29.8908 173.4443 50 F 5.0800 8.1914 122.5901 56.3013 41.3796 173.6638 51 G 4.1649 8.4020 116.4667 43.5387 0.0000 172.2134 52 I 4.1117 8.1240 122.6955 59.9850 39.7184 176.1073 53 G 3.9418 9.5441 113.7831 46.5561 0.0000 174.0463 54 G 3.9261 8.7285 105.5470 44.9650 0.0000 173.8055 55 E 4.6870 7.6496 117.8408 53.6183 32.8722 175.2431 56 L 4.3181 8.4787 121.2914 55.2488 42.3729 178.6056 57 A 4.2199 8.9141 125.9190 55.0537 18.8039 180.2314 58 S 4.0843 8.1911 109.9357 61.7753 63.0162 175.6780 59 K 4.3388 7.3960 118.3168 56.0893 31.7887 177.6117 60 V 4.0258 7.4313 124.6253 61.9133 31.4567 174.9557 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 4.47 0.00 2.09 2.03 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.12 0.00 2 I 8.31 4.81 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 1.27 0.72 0.91 0.00 0.00 3 A 9.45 4.77 1.19 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 0.00 0.00 0.00 4 Q 8.70 4.97 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.64 0.00 0.00 0.00 0.00 0.00 2.13 2.39 0.00 5 I 8.82 4.48 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.64 0.88 0.00 0.00 6 H 9.08 5.69 0.00 2.90 3.08 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.00 4.63 1.82 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 1.29 1.03 0.86 0.00 0.00 8 L 8.32 4.66 0.00 1.53 1.63 1.01 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.64 4.24 0.00 1.96 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 2.30 2.27 0.00 10 G 8.76 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.63 4.32 0.00 1.78 1.85 0.00 3.25 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.84 0.00 12 S 8.26 4.51 0.00 4.00 3.99 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 13 D 8.52 4.39 0.00 2.78 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 14 E 8.09 3.93 0.00 2.05 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 2.40 2.46 0.00 15 Q 7.77 4.01 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 16 K 7.99 3.98 0.00 1.83 1.84 0.00 1.64 0.00 0.00 1.55 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.66 7.81 17 E 8.13 3.99 0.00 2.27 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 2.30 2.34 0.00 18 T 7.99 3.92 4.39 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 1.21 0.00 0.00 19 L 8.11 3.93 0.00 1.82 1.83 0.91 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.70 3.70 2.00 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 1.39 0.86 0.90 0.00 0.00 21 R 7.83 3.87 0.00 1.96 1.91 0.00 3.10 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 22 E 8.40 3.95 0.00 2.04 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 2.47 2.47 0.00 23 V 7.85 3.63 2.23 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 1.02 0.00 0.00 0.92 0.00 0.00 24 S 7.90 4.17 0.00 4.17 3.89 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 0.00 0.00 0.00 0.00 25 E 8.40 3.93 0.00 2.09 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 2.48 2.47 0.00 26 A 8.01 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.83 3.63 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 1.40 0.76 0.91 0.00 0.00 28 S 7.97 4.07 0.00 3.91 4.08 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 29 R 8.66 3.83 0.00 2.12 1.90 0.00 3.16 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 30 S 8.00 4.15 0.00 3.91 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.72 4.44 0.00 1.63 1.69 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 32 D 7.64 4.34 0.00 2.73 2.70 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 0.00 0.00 0.00 0.00 33 A 7.46 4.76 1.23 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 0.00 0.00 0.00 34 P 0.00 4.31 0.00 2.23 2.20 0.00 3.73 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 35 L 8.94 3.88 0.00 1.74 1.73 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.90 4.06 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 37 S 7.98 4.46 0.00 3.97 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 38 V 7.61 4.08 2.15 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 0.75 0.00 0.00 0.98 0.00 0.00 39 R 8.96 4.71 0.00 1.80 1.77 0.00 3.16 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 40 V 8.49 4.88 2.07 0.00 0.00 0.00 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 0.92 0.00 0.00 41 I 8.92 4.53 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 1.21 0.58 0.88 0.00 0.00 42 I 8.38 4.74 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.51 0.87 0.00 0.00 43 T 8.77 4.49 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 44 E 8.84 4.72 0.00 1.84 1.85 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 2.27 2.31 0.00 45 M 8.76 4.85 0.00 1.94 1.85 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.44 0.00 46 A 8.58 4.51 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.68 4.08 0.00 1.80 1.95 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.58 1.46 7.81 48 G 7.99 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.64 4.96 0.00 3.38 3.32 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 8.19 5.08 0.00 2.94 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.40 4.16 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 0.00 0.00 0.00 52 I 8.12 4.11 1.68 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.32 0.82 0.00 0.00 53 G 9.54 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 0.00 0.00 0.00 54 G 8.73 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 E 7.65 4.69 0.00 1.93 1.75 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 2.19 2.21 0.00 56 L 8.48 4.32 0.00 1.69 1.61 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.91 4.22 1.46 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 0.00 0.00 0.00 58 S 8.19 4.08 0.00 4.01 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 K 7.40 4.34 0.00 1.95 1.88 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.37 7.81 60 V 7.43 4.03 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 0.70 0.00 0.00 0.92 0.00 0.00