NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 L 3.6850 8.0433 120.5890 55.3652 41.5866 176.6093 3 Q 3.8727 8.3255 116.1622 58.0604 28.7239 175.7471 4 L 4.2831 8.4994 117.8076 55.7305 43.2886 176.9053 5 W 4.4859 8.0854 120.2580 56.9810 29.5310 176.1574 6 S 4.6506 9.4355 119.1936 56.6864 64.2907 175.2392 7 K 4.7075 8.2049 121.0913 59.7446 31.8207 179.0028 8 F 4.4494 7.4423 117.2872 60.1620 38.8381 177.4322 9 D 4.1332 8.0143 118.8251 56.9579 40.4059 178.8534 10 V 3.9578 7.7262 118.7778 65.6687 31.5595 178.1731 11 G 3.6063 8.0738 105.5733 47.9602 0.0000 175.1077 12 D 4.3676 8.2626 122.4914 56.8252 40.8947 179.0126 13 W 4.1381 8.1183 128.4208 60.4767 30.5967 177.9363 14 L 3.4111 8.1380 119.0122 57.7367 40.9617 179.4158 15 E 3.9236 8.3906 118.8397 59.1990 29.0994 179.0524 16 S 4.0064 8.1221 113.1395 60.8287 62.3398 175.5314 17 I 4.1046 6.8351 112.9854 60.4094 38.5333 174.9429 18 H 4.0217 7.9366 114.5358 58.0136 26.1941 175.0166 19 L 4.6948 8.0974 115.3153 53.6060 43.2384 179.2923 20 G 3.6945 8.2300 107.1956 47.0148 0.0000 175.1915 21 E 4.0539 7.9971 118.5395 58.7847 30.0121 177.5448 22 H 4.9118 8.1339 116.4276 55.8553 29.4470 176.8236 23 R 3.9856 7.6680 119.0332 59.2341 29.1557 178.6597 24 D 4.4302 8.1200 119.1823 57.2206 40.9463 178.6474 25 R 4.0323 8.1264 117.9947 59.5726 30.2190 178.9522 26 F 4.1008 8.7109 117.4231 60.5825 38.9714 177.4464 27 E 3.9306 8.5122 119.0374 59.4257 29.2592 178.6550 28 D 4.4512 8.2267 118.0439 57.0103 40.9625 177.4126 29 H 4.4405 8.1169 114.2075 54.4922 29.8873 174.7115 30 E 3.7372 7.7445 119.3741 57.3284 27.4987 175.2170 31 I 4.2078 7.9840 119.5805 60.9544 38.4823 176.0427 32 E 4.9790 8.4235 123.3461 53.6931 32.9904 176.7811 33 G 4.3511 8.6703 107.8556 47.9081 0.0000 175.6626 34 A 3.9095 7.9724 122.4386 54.9635 18.4884 178.8690 35 H 4.4428 8.4140 114.9317 58.3619 28.9449 177.5038 36 L 4.0679 8.0457 121.2609 57.8258 41.3470 177.8761 37 P 4.2951 0.0000 0.0000 65.1385 31.3383 177.5869 38 A 4.3481 7.5686 116.5121 51.4723 19.5035 177.5684 39 L 3.9021 7.2150 117.9384 54.7656 42.2915 177.2942 40 T 4.6192 8.8730 113.3392 59.5518 72.5693 175.5122 41 K 4.1728 8.5707 121.0089 59.8041 32.0772 178.2442 42 E 4.0394 8.1532 117.3699 59.4062 29.4757 178.8238 43 D 4.1683 7.7859 119.4145 57.1621 40.8442 178.6109 44 F 4.1696 8.0039 118.3361 60.4810 38.8822 177.9447 45 V 3.6387 7.9948 117.9289 66.0667 31.1647 177.7907 46 E 3.9757 7.8955 117.8033 58.9061 29.5056 177.8394 47 L 4.1534 7.7762 116.8652 54.6964 41.7356 177.6749 48 G 4.0119 8.1066 107.7517 45.4433 0.0000 175.1534 49 V 4.0614 7.8225 121.5048 61.7673 29.8385 175.2564 50 T 4.1896 7.9690 114.0313 62.9740 70.0748 176.8958 51 R 4.1510 7.8474 122.4485 55.3059 31.1875 177.2211 52 V 3.6852 8.5268 123.7683 66.0022 31.6006 178.1727 53 G 3.5894 7.9649 104.9592 48.2300 0.0000 175.2812 54 H 4.3234 8.0438 118.2266 58.3123 28.7669 177.7955 55 R 3.5645 7.8909 120.5867 59.3878 29.9325 178.2879 56 E 3.9042 8.4145 119.3961 59.2714 29.5919 178.5110 57 N 4.3540 8.1856 116.6783 55.9499 38.5281 177.5985 58 I 3.7023 7.4231 121.0560 64.2451 37.3246 177.8482 59 E 4.0006 8.1096 120.1247 59.4083 29.2208 178.8301 60 R 3.9213 7.9195 116.4142 59.3957 30.0548 178.3198 61 A 4.3360 8.1426 120.1719 56.1933 18.2880 178.7393 62 L 3.8611 8.6918 116.2826 58.0289 41.3544 180.4049 63 R 3.8398 8.0628 119.7893 59.2154 31.1980 178.2093 64 Q 4.3863 7.6231 119.1576 54.8899 28.2343 175.6741 65 L 4.0378 7.5655 122.6616 55.3750 43.0058 175.8306 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 2 L 8.04 3.69 0.00 1.55 1.50 0.97 0.23 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 3 Q 8.33 3.87 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 7.04 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 4 L 8.50 4.28 0.00 1.75 1.85 0.97 0.95 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 5 W 8.09 4.49 0.00 3.50 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 9.44 4.65 0.00 4.00 4.07 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 0.00 0.00 0.00 0.00 7 K 8.20 4.71 0.00 1.86 1.99 0.00 1.54 0.00 0.00 1.54 0.00 0.00 2.33 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.69 0.24 7.81 8 F 7.44 4.45 0.00 3.17 3.09 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 9 D 8.01 4.13 0.00 2.76 1.77 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.73 3.96 2.46 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 1.48 0.00 0.00 1.27 0.00 0.00 11 G 8.07 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.26 4.37 0.00 2.71 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 8.12 4.14 0.00 2.97 3.38 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 14 L 8.14 3.41 0.00 1.78 1.44 0.21 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.39 3.92 0.00 2.06 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 16 S 8.12 4.01 0.00 3.78 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 6.84 4.10 1.63 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.43 0.56 0.00 0.00 18 H 7.94 4.02 0.00 3.21 3.39 0.00 5.79 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 19 L 8.10 4.69 0.00 1.47 1.44 0.71 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.23 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.00 4.05 0.00 2.01 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 2.09 1.85 0.00 22 H 8.13 4.91 0.00 3.03 3.27 0.00 5.62 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 R 7.67 3.99 0.00 2.05 2.16 0.00 2.87 0.00 0.00 3.19 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.71 0.00 24 D 8.12 4.43 0.00 2.78 2.83 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 25 R 8.13 4.03 0.00 2.07 2.26 0.00 3.41 0.00 0.00 3.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.79 0.00 26 F 8.71 4.10 0.00 3.15 3.25 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.51 3.93 0.00 2.25 2.20 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 2.35 2.24 0.00 28 D 8.23 4.45 0.00 2.84 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 29 H 8.12 4.44 0.00 3.06 3.25 0.00 5.81 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 7.74 3.74 0.00 2.13 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.23 0.00 31 I 7.98 4.21 2.11 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.59 1.08 0.00 0.00 32 E 8.42 4.98 0.00 1.72 1.96 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 2.23 2.33 0.00 33 G 8.67 4.35 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.97 3.91 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.41 4.44 0.00 3.36 3.28 0.00 5.67 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.05 4.07 0.00 1.68 1.81 0.73 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.30 0.00 1.98 2.09 0.00 3.81 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.07 0.00 38 A 7.57 4.35 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.21 3.90 0.00 1.42 0.53 0.82 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.87 4.62 4.37 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 1.25 0.00 0.00 41 K 8.57 4.17 0.00 1.94 1.92 0.00 1.76 0.00 0.00 1.90 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.57 1.58 7.81 42 E 8.15 4.04 0.00 2.17 2.19 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 2.34 2.33 0.00 43 D 7.79 4.17 0.00 2.41 2.41 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 0.00 44 F 8.00 4.17 0.00 3.28 3.09 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 45 V 7.99 3.64 2.26 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 1.02 0.00 0.00 1.02 0.00 0.00 46 E 7.90 3.98 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.31 0.00 47 L 7.78 4.15 0.00 1.55 1.10 0.07 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.11 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 0.00 0.00 0.00 49 V 7.82 4.06 2.33 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 0.81 0.00 0.00 1.17 0.00 0.00 50 T 7.97 4.19 4.27 0.00 0.00 0.00 0.00 0.00 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 51 R 7.85 4.15 0.00 1.73 1.73 0.00 3.03 0.00 0.00 3.06 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 52 V 8.53 3.69 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 1.12 0.00 0.00 0.93 0.00 0.00 53 G 7.96 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.04 4.32 0.00 3.33 3.33 0.00 5.65 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 R 7.89 3.56 0.00 1.97 1.97 0.00 3.20 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.37 0.00 56 E 8.41 3.90 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 57 N 8.19 4.35 0.00 2.87 2.77 0.00 0.00 6.95 6.79 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 58 I 7.42 3.70 1.77 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 1.26 1.03 1.20 0.00 0.00 59 E 8.11 4.00 0.00 2.07 1.92 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 2.32 2.44 0.00 60 R 7.92 3.92 0.00 2.02 2.02 0.00 3.24 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 1.69 1.98 0.00 61 A 8.14 4.34 1.80 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 0.00 0.00 62 L 8.69 3.86 0.00 2.08 1.68 1.12 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 63 R 8.06 3.84 0.00 1.84 2.01 0.00 3.18 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 64 Q 7.62 4.39 0.00 2.08 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.67 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 65 L 7.57 4.04 0.00 1.53 1.25 0.36 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00