NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 N 4.6759 8.4249 118.2177 50.9187 38.9112 174.4693 11 V 3.8053 7.2178 113.1032 56.8145 34.6687 174.6405 12 Q 3.9190 8.1602 120.3253 57.4013 29.3208 170.6240 13 R 3.7288 8.2298 123.6744 55.7002 27.8485 174.6028 14 P 4.2013 0.0000 0.0000 65.5705 31.5960 177.7794 15 L 3.9810 8.0557 116.3804 57.1891 41.4652 178.9692 16 D 4.4124 8.6002 118.6937 57.4245 41.1189 177.7039 17 A 3.9958 7.8038 120.6866 55.3298 18.2073 179.5169 18 L 3.8300 7.3902 115.9173 57.7919 41.5876 179.6754 19 G 4.1002 7.9009 105.4808 48.4396 0.0000 175.1105 20 N 4.4969 7.6049 117.6442 55.8839 38.9788 176.5880 21 S 4.5144 8.3097 114.7566 57.3720 63.4109 174.0367 22 L 4.3182 7.7177 122.8300 56.7101 41.8436 176.5659 23 N 4.3067 9.5136 119.2179 54.3742 36.9742 174.1352 24 S 4.9643 7.7904 111.5449 55.9321 67.7142 171.8972 25 P 5.0936 0.0000 0.0000 63.1439 32.4139 175.7427 26 V 4.7759 9.0680 114.3175 60.0645 37.0215 173.9424 27 I 4.9378 8.6282 122.8213 59.7788 39.7859 174.7932 28 I 4.7174 8.9537 128.5406 59.4363 39.5425 174.4114 29 K 4.4929 8.2744 129.4278 54.8320 33.6274 175.6490 30 L 5.0188 8.5414 127.3516 52.5538 44.7993 176.1948 31 K 4.1860 8.4240 120.7811 58.1162 32.0129 178.0950 32 G 3.8834 8.7950 111.1001 44.7022 0.0000 174.3507 33 D 4.7037 7.8974 117.7056 54.4399 39.3461 174.0836 34 R 4.4159 7.4467 119.7856 55.8162 31.3048 175.4851 35 E 5.3908 8.5148 120.5489 54.6286 33.3533 174.7293 36 F 5.1658 9.5159 119.0045 55.7968 43.3855 174.2982 37 R 5.0618 8.5371 120.2998 54.4969 33.5662 175.2509 38 G 4.1288 8.2246 109.2754 46.0769 0.0000 171.7158 39 V 4.6378 7.8636 120.3631 61.6144 32.8270 174.9588 40 L 4.3644 8.8576 131.1950 55.4236 42.3243 177.0619 41 K 4.2200 8.7812 125.9900 57.8772 34.3769 176.2226 42 S 4.6851 7.6113 112.2833 58.0082 66.0720 173.9652 43 F 5.0900 7.7583 112.6746 56.3291 39.7310 172.6024 44 D 5.0071 8.3484 121.7826 51.1277 41.7880 176.9205 45 L 4.1192 8.3761 117.9759 57.6545 41.8266 177.9335 46 H 4.5801 8.8811 115.3952 55.8090 28.8603 176.4981 47 M 3.4153 8.3258 118.6903 54.9916 30.5248 176.5926 48 N 4.8664 8.0973 117.6998 53.5452 39.8461 173.9653 49 L 5.2155 9.0065 122.5160 54.4156 45.0181 174.7703 50 V 4.9504 8.4918 118.9083 61.1216 34.3558 174.2111 51 L 5.3897 9.0067 126.8256 53.1337 45.3648 175.2528 52 N 5.0529 9.0130 119.6421 52.1103 41.4771 174.6387 53 D 4.2658 8.9066 118.5304 55.0306 38.9951 173.9649 54 A 4.5384 7.9343 120.1442 52.8654 19.9852 177.6455 55 E 4.8817 8.9486 119.0052 54.8116 34.3367 174.4135 56 E 3.6741 9.1920 127.0832 55.6594 30.5896 175.3190 57 L 5.0081 8.4577 126.3005 52.8093 45.1710 175.4830 58 E 4.5980 8.3707 122.0659 54.7229 29.6732 173.7645 59 D 4.2126 8.4210 123.5990 54.4298 37.4004 175.5540 60 G 4.0517 8.2299 107.0774 45.3500 0.0000 171.1862 61 E 4.6120 7.5605 119.4910 53.8631 31.9238 175.8979 62 V 4.0474 8.3639 123.1183 63.9898 31.9938 175.4184 63 T 4.6111 8.4139 119.5462 62.8790 70.7987 174.0414 64 R 4.3569 7.3069 118.6358 55.6645 33.4082 172.8978 65 R 4.8816 8.7664 123.9763 54.7746 31.4465 175.8006 66 L 4.4455 8.5996 123.1690 52.5390 43.3382 178.4935 67 G 3.8543 8.2119 108.1624 47.0407 0.0000 175.6141 68 T 4.9995 8.6240 122.4651 62.4950 69.0355 173.3085 69 V 4.5655 8.9877 125.6633 59.7219 35.4356 174.1667 70 L 5.0093 8.5429 124.1030 53.6322 43.8066 175.2079 71 I 4.3933 8.6487 128.0021 59.4191 39.8255 175.6299 72 R 4.5149 8.4514 125.9308 55.5302 31.0392 177.7762 73 G 3.9936 10.0027 112.5402 48.0964 0.0000 175.0372 74 D 4.3931 8.1358 118.1499 56.5433 41.3186 176.5790 75 N 4.6661 7.8976 114.5218 53.7993 39.3641 175.1172 76 I 4.2400 7.6873 120.1928 61.2413 37.9278 175.5148 77 V 4.3059 8.6405 124.6395 64.6426 32.8005 175.0904 78 Y 4.9249 7.0834 115.6594 56.2386 41.3220 173.4945 79 I 5.0427 8.4822 119.9938 59.9314 40.3867 174.8264 80 S 4.9257 9.0391 122.2362 55.2764 65.4153 174.5820 81 R 4.5672 8.1368 121.0452 55.7589 28.2461 176.8307 82 G 3.7604 7.7695 110.4540 46.6593 0.0000 172.8669 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 10 N 8.42 4.68 0.00 2.83 2.83 0.00 0.00 5.94 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 11 V 7.22 3.81 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 0.69 0.00 0.00 0.93 0.00 0.00 12 Q 8.16 3.92 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.13 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 13 R 8.23 3.73 0.00 2.04 2.00 0.00 3.55 0.00 0.00 3.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 14 P 0.00 4.20 0.00 2.18 2.10 0.00 3.67 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 2.12 2.21 0.00 15 L 8.06 3.98 0.00 1.77 1.86 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.60 4.41 0.00 3.11 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 17 A 7.80 4.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.39 3.83 0.00 1.44 0.44 0.06 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.90 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 0.00 0.00 0.00 20 N 7.60 4.50 0.00 2.85 2.94 0.00 0.00 7.10 7.46 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 21 S 8.31 4.51 0.00 3.93 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 22 L 7.72 4.32 0.00 1.73 1.69 0.98 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 23 N 9.51 4.31 0.00 2.83 2.90 0.00 0.00 6.76 5.12 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 24 S 7.79 4.96 0.00 3.93 3.70 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 25 P 0.00 5.09 0.00 2.09 2.06 0.00 3.73 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 2.12 2.01 0.00 26 V 9.07 4.78 2.10 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 0.86 0.00 0.00 0.98 0.00 0.00 27 I 8.63 4.94 1.99 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 1.27 0.98 0.96 0.00 0.00 28 I 8.95 4.72 1.86 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 1.14 0.88 0.79 0.00 0.00 29 K 8.27 4.49 0.00 0.79 0.74 0.00 1.38 0.00 0.00 1.52 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.12 1.22 7.81 30 L 8.54 5.02 0.00 1.75 1.52 0.73 0.73 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 31 K 8.42 4.19 0.00 1.74 1.74 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.47 1.63 7.81 32 G 8.80 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 D 7.90 4.70 0.00 2.87 2.86 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 34 R 7.45 4.42 0.00 1.72 1.94 0.00 3.09 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.60 0.00 35 E 8.51 5.39 0.00 2.08 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 2.15 2.22 0.00 36 F 9.52 5.17 0.00 2.87 2.97 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 37 R 8.54 5.06 0.00 1.70 1.80 0.00 3.37 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.69 0.00 38 G 8.22 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.86 4.64 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 0.95 0.00 0.00 0.95 0.00 0.00 40 L 8.86 4.36 0.00 1.86 1.73 1.07 0.40 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 41 K 8.78 4.22 0.00 1.69 1.84 0.00 1.84 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.75 7.81 42 S 7.61 4.69 0.00 3.75 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 43 F 7.76 5.09 0.00 3.10 3.02 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 0.00 0.00 0.00 44 D 8.35 5.01 0.00 2.88 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 45 L 8.38 4.12 0.00 1.49 1.72 0.90 1.07 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 46 H 8.88 4.58 0.00 3.28 3.31 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 M 8.33 3.42 0.00 2.18 2.30 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 48 N 8.10 4.87 0.00 2.97 2.77 0.00 0.00 6.58 6.74 0.00 0.00 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 L 9.01 5.22 0.00 1.92 1.83 0.90 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 50 V 8.49 4.95 2.10 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 1.04 0.00 0.00 0.94 0.00 0.00 51 L 9.01 5.39 0.00 1.62 1.55 0.98 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 52 N 9.01 5.05 0.00 2.73 2.72 0.00 0.00 6.99 7.59 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 53 D 8.91 4.27 0.00 2.81 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.93 4.54 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 55 E 8.95 4.88 0.00 1.86 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 2.20 2.43 0.00 56 E 9.19 3.67 0.00 1.45 1.69 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 2.09 1.98 0.00 57 L 8.46 5.01 0.00 1.68 1.45 0.87 0.90 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 58 E 8.37 4.60 0.00 1.78 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 2.18 2.26 0.00 59 D 8.42 4.21 0.00 2.91 2.73 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 60 G 8.23 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.56 4.61 0.00 1.92 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 62 V 8.36 4.05 2.05 0.00 0.00 0.00 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 0.90 0.00 0.00 63 T 8.41 4.61 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 64 R 7.31 4.36 0.00 1.79 1.62 0.00 3.13 0.00 0.00 3.35 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.50 0.00 65 R 8.77 4.88 0.00 1.70 1.82 0.00 3.22 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 66 L 8.60 4.45 0.00 1.56 1.75 0.94 1.49 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 67 G 8.21 3.85 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 0.00 0.00 0.00 68 T 8.62 5.00 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 1.27 0.00 0.00 69 V 8.99 4.57 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 0.93 0.00 0.00 0.94 0.00 0.00 70 L 8.54 5.01 0.00 1.64 1.57 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 71 I 8.65 4.39 1.73 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.36 0.68 0.00 0.00 72 R 8.45 4.51 0.00 1.83 1.81 0.00 3.11 0.00 0.00 3.31 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 73 G 10.00 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 0.00 0.00 0.00 74 D 8.14 4.39 0.00 2.61 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 75 N 7.90 4.67 0.00 2.73 2.77 0.00 0.00 6.85 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 I 7.69 4.24 1.93 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 1.07 0.38 0.89 0.00 0.00 77 V 8.64 4.31 2.10 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 0.94 0.00 0.00 0.92 0.00 0.00 78 Y 7.08 4.92 0.00 3.02 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 I 8.48 5.04 1.87 0.00 0.00 0.78 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 0.66 0.89 0.00 0.00 80 S 9.04 4.93 0.00 3.97 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 81 R 8.14 4.57 0.00 1.97 1.98 0.00 3.08 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 82 G 7.77 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