NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6438 8.3049 118.1950 54.5210 34.3408 173.9228 2 K 4.1962 7.5357 125.5125 56.5452 39.2847 176.7886 3 A 4.4546 9.7510 135.0000 53.8138 20.5532 179.7719 4 K 3.9855 8.1542 114.4850 58.9953 32.6963 177.5119 5 E 4.5820 7.2956 119.3658 53.9248 27.9828 175.9871 6 L 4.2753 8.2832 117.6562 54.7567 46.4321 176.1603 7 R 3.7975 8.7841 125.3034 57.9609 28.2386 176.2164 8 E 4.4721 7.6934 110.5427 55.0658 29.6606 174.5082 9 K 3.5655 7.9788 123.1386 56.8714 31.5549 174.8648 10 S 4.2518 8.5391 120.9961 61.4173 62.0138 175.5810 11 V 3.7707 7.7470 118.7659 64.7856 31.4835 177.0141 12 E 4.2082 8.5456 118.5220 59.7528 29.6443 178.1818 13 E 4.2944 7.8702 119.2859 58.5146 29.5756 179.7302 14 L 3.9864 7.8311 118.5728 57.7710 41.9483 177.9717 15 N 4.6905 8.0842 113.1581 53.9846 38.6060 176.7587 16 T 4.2257 7.4967 117.0071 66.3054 69.0071 176.9842 17 E 4.3536 7.9356 120.7366 58.1068 29.3688 178.8499 18 L 4.0365 7.4189 119.0994 57.1339 42.1500 177.7634 19 L 4.5962 7.6900 116.2395 54.8430 42.6010 177.7964 20 N 4.5712 7.9832 118.1791 55.8923 38.5644 176.4539 21 L 4.3515 7.5477 117.7815 55.1840 42.6468 179.3542 22 L 4.3277 7.3418 120.7800 54.5530 42.1906 177.3867 23 R 3.8245 8.8900 113.1670 59.8981 30.1153 178.0379 24 E 4.2107 8.1694 114.6928 57.8280 29.9138 177.0089 25 Q 4.4431 7.7987 117.7777 55.8503 31.5194 176.8921 26 F 4.1116 9.4327 120.2498 61.3815 39.7719 176.8568 27 N 4.4357 8.6649 116.1107 55.6316 38.1983 177.2772 28 L 3.9965 7.8937 121.7630 57.8251 41.9548 177.9429 29 R 4.3912 7.4971 115.6067 56.2805 28.6739 176.3521 30 M 4.4653 7.8067 117.4694 55.2393 32.7814 176.6829 31 Q 4.3497 7.6394 115.9462 56.1217 30.8693 177.1942 32 A 4.0924 8.0452 117.3521 53.1511 18.6394 177.0135 33 A 4.4792 8.2806 119.0330 54.4821 21.4439 178.9668 34 S 4.2009 7.6021 107.3246 58.8890 63.1758 174.6466 35 G 4.0136 7.6808 108.5653 46.7311 0.0000 173.0188 36 Q 4.4464 7.0672 114.8923 54.6733 33.1638 172.8213 37 L 3.4650 8.4669 125.6112 55.0563 40.7964 174.6484 38 Q 4.3683 8.5227 121.0403 55.9791 29.4083 177.2350 39 Q 4.2572 7.5925 118.7160 54.9878 26.6495 176.2638 40 S 4.1209 8.5241 119.4966 61.7551 63.4299 176.3650 41 H 4.2396 8.1283 113.4841 56.8279 28.4995 176.8731 42 L 3.8279 7.9966 122.9184 58.3478 41.9788 178.0634 43 L 4.0909 7.0794 117.1942 57.8699 41.6840 178.9071 44 K 3.9912 8.1585 118.6545 59.0535 32.0225 176.7087 45 Q 4.2605 8.2946 117.2315 56.3469 29.2702 177.4182 46 V 3.4361 8.3856 115.9420 63.3667 30.8420 171.4695 47 R 4.2961 7.2020 116.4370 56.7524 32.3927 177.9073 48 R 3.9634 6.4520 115.6624 59.6964 30.8918 177.9913 49 D 4.4033 8.1459 118.0093 57.2604 40.3136 178.7737 50 V 3.8915 8.8369 119.5093 65.2981 31.5215 177.4344 51 A 4.1758 8.0945 119.9201 54.0013 18.1909 179.0565 52 R 4.2163 8.3230 116.9037 58.0664 30.7333 178.6293 53 V 3.7475 7.7441 116.0413 64.7063 31.6462 176.7866 54 K 4.3495 7.6632 116.0243 59.3196 33.0360 177.9348 55 T 3.8475 8.1754 115.7121 67.3312 68.2945 176.1477 56 L 4.0850 8.0693 120.3176 56.5938 42.2545 178.0284 57 L 4.3168 8.0257 120.5865 56.0027 42.8301 178.0420 58 N 4.5512 8.3388 116.7376 56.0320 38.7621 176.7532 59 E 4.1824 8.0865 113.9998 57.9057 29.6233 176.7608 60 K 4.1508 7.3384 119.5769 56.7598 32.1185 176.3624 61 A 4.2795 7.6848 121.5515 51.8967 18.6293 177.4324 62 G 4.2866 9.9454 113.2207 46.0720 0.0000 172.6876 63 A 4.1686 7.4555 125.4399 52.3476 19.2150 175.5138 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 M 8.30 4.64 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 2 K 7.54 4.20 0.00 1.81 0.89 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.50 7.81 3 A 9.75 4.45 1.29 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 4 K 8.15 3.99 0.00 1.74 1.91 0.00 1.62 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.54 7.81 5 E 7.30 4.58 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 2.32 2.42 0.00 6 L 8.28 4.28 0.00 1.69 1.54 0.92 1.33 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 7 R 8.78 3.80 0.00 1.94 2.02 0.00 3.17 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 8 E 7.69 4.47 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 2.15 2.19 0.00 9 K 7.98 3.57 0.00 1.99 2.04 0.00 1.62 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.46 7.81 10 S 8.54 4.25 0.00 3.92 3.86 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 0.00 0.00 0.00 0.00 11 V 7.75 3.77 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 0.93 0.00 0.00 0.93 0.00 0.00 12 E 8.55 4.21 0.00 2.17 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 2.30 2.46 0.00 13 E 7.87 4.29 0.00 2.13 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 2.34 2.38 0.00 14 L 7.83 3.99 0.00 1.70 1.70 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.08 4.69 0.00 2.73 2.83 0.00 0.00 7.06 7.07 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 16 T 7.50 4.23 4.38 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 1.21 0.00 0.00 17 E 7.94 4.35 0.00 2.01 2.00 0.00 0.00 0.00 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 2.22 0.00 18 L 7.42 4.04 0.00 1.93 1.70 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.69 4.60 0.00 1.76 1.67 0.99 1.32 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 20 N 7.98 4.57 0.00 3.01 2.82 0.00 0.00 6.99 6.88 0.00 0.00 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 L 7.55 4.35 0.00 1.66 1.75 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.34 4.33 0.00 1.90 1.64 0.98 0.92 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 23 R 8.89 3.82 0.00 1.93 2.33 0.00 3.49 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 24 E 8.17 4.21 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 25 Q 7.80 4.44 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.94 0.00 0.00 0.00 0.00 0.00 2.35 2.32 0.00 26 F 9.43 4.11 0.00 3.10 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 27 N 8.66 4.44 0.00 3.06 2.89 0.00 0.00 6.72 7.07 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 28 L 7.89 4.00 0.00 1.74 1.70 0.96 0.98 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 29 R 7.50 4.39 0.00 1.87 1.79 0.00 3.16 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 30 M 7.81 4.47 0.00 1.98 1.82 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 31 Q 7.64 4.35 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.73 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 32 A 8.05 4.09 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 33 A 8.28 4.48 1.22 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 0.00 0.00 0.00 34 S 7.60 4.20 0.00 3.98 3.91 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 0.00 0.00 0.00 35 G 7.68 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 36 Q 7.07 4.45 0.00 2.07 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.67 6.10 0.00 0.00 0.00 0.00 0.00 2.24 2.44 0.00 37 L 8.47 3.46 0.00 1.96 1.66 0.96 0.94 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 38 Q 8.52 4.37 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 7.38 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 39 Q 7.59 4.26 0.00 2.05 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.83 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 40 S 8.52 4.12 0.00 3.89 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 41 H 8.13 4.24 0.00 3.51 3.56 0.00 5.66 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.00 3.83 0.00 1.83 1.64 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 43 L 7.08 4.09 0.00 1.61 1.73 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 44 K 8.16 3.99 0.00 1.87 2.04 0.00 1.61 0.00 0.00 1.83 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.64 7.81 45 Q 8.29 4.26 0.00 2.41 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 5.70 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 46 V 8.39 3.44 2.09 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 0.87 0.00 0.00 1.06 0.00 0.00 47 R 7.20 4.30 0.00 1.98 1.76 0.00 3.19 0.00 0.00 3.17 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 48 R 6.45 3.96 0.00 1.98 1.98 0.00 3.19 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 1.66 1.73 0.00 49 D 8.15 4.40 0.00 2.69 2.72 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 0.00 0.00 0.00 0.00 50 V 8.84 3.89 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.99 0.00 0.00 51 A 8.09 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 52 R 8.32 4.22 0.00 2.02 1.97 0.00 3.23 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 53 V 7.74 3.75 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.00 0.00 0.00 54 K 7.66 4.35 0.00 1.86 1.81 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.64 7.81 55 T 8.18 3.85 4.28 0.00 0.00 0.00 0.00 0.00 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 56 L 8.07 4.08 0.00 1.81 1.73 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 57 L 8.03 4.32 0.00 1.69 1.73 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 58 N 8.34 4.55 0.00 3.07 2.84 0.00 0.00 6.58 8.45 0.00 0.00 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 E 8.09 4.18 0.00 2.07 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 2.49 2.30 0.00 60 K 7.34 4.15 0.00 1.81 2.09 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.45 1.38 7.81 61 A 7.68 4.28 1.29 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 62 G 9.95 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 63 A 7.46 4.17 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