NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 45 S 4.4974 8.3344 116.7972 58.8794 63.9292 173.7007 46 D 4.3706 8.1277 121.4082 50.8627 41.4212 173.3496 47 G 4.4807 9.1850 109.7568 46.2138 0.0000 171.0906 48 D 4.6300 8.0622 120.8200 53.2223 39.6067 176.3865 49 Q 4.0432 7.9534 121.9742 57.8863 30.2300 178.5592 50 C 4.3277 7.7105 116.6282 56.0713 43.2795 174.0022 51 A 4.2059 7.5224 124.3363 54.3847 19.2221 179.6522 52 S 4.5891 7.7513 109.3680 58.2991 62.5097 174.6309 53 S 3.5917 7.9689 114.5468 58.5391 59.5327 170.4866 54 P 4.3562 0.0000 0.0000 64.3752 31.9379 178.7913 55 C 4.3338 7.3456 114.8453 57.3127 39.1821 172.9997 56 Q 4.4984 8.3985 126.3566 56.1134 30.9060 175.3744 57 N 3.5851 9.4258 115.4210 53.9404 36.1418 174.0685 58 G 3.8573 8.0133 102.8182 46.7159 0.0000 174.5112 59 G 4.1675 7.8199 105.3554 44.8232 0.0000 174.1678 60 S 4.7702 8.7648 115.5472 57.4289 64.0908 171.8796 61 C 5.2697 8.8151 126.6699 55.1273 46.1733 172.6996 62 K 4.9672 8.9141 125.2626 54.4102 35.6355 175.0863 63 D 4.9062 8.9674 125.0966 52.5722 40.1158 177.0357 64 Q 4.5597 7.9714 125.1908 54.8714 29.2688 172.4283 65 L 3.4057 8.5490 126.1030 55.4530 42.9078 171.0522 66 Q 3.9122 8.4318 124.8339 55.5684 27.8868 177.1136 67 S 4.7851 7.3972 114.6952 57.7478 66.1147 171.8480 68 Y 5.0456 7.5400 117.3512 56.1155 41.8228 174.0435 69 I 4.3359 8.7731 118.4261 59.6115 41.0948 173.0919 70 C 5.1973 8.7632 126.9750 56.0762 37.9586 173.9920 71 F 4.4996 9.5730 123.4234 56.3902 38.6612 174.2254 72 C 5.4869 8.3755 119.9066 54.2853 38.1084 173.6652 73 L 4.2709 8.9453 120.1078 54.3372 41.6406 176.8071 74 P 4.3496 0.0000 0.0000 64.6411 31.6103 176.8083 75 A 4.3152 7.4335 121.4940 52.1696 19.0625 176.4822 76 F 5.4720 7.2965 114.6736 56.3704 41.4365 174.1588 77 E 4.6124 9.6585 122.2849 55.2604 33.1601 174.6326 78 G 4.2515 8.7276 107.9641 44.9019 0.0000 174.8349 79 R 3.8743 8.5318 120.6817 58.6190 30.4640 177.2300 80 N 4.9854 8.0770 114.1172 53.0705 39.5960 175.0870 81 C 4.2932 7.6993 111.8182 58.5730 38.0398 173.3706 82 E 4.6990 7.9712 111.0407 56.2912 30.5805 176.9930 83 T 4.7264 8.1533 115.6336 62.9874 73.5381 172.5651 84 H 5.3288 8.9299 124.4157 54.3662 30.8381 171.9890 85 K 4.3238 8.9138 124.0025 55.0958 32.5736 176.5888 86 D 4.8094 8.4448 127.0136 54.0846 41.9250 176.0586 87 D 4.3855 8.4625 117.0718 56.0787 41.3806 176.3499 88 G 4.1740 7.4451 114.7256 41.7720 0.0000 177.3084 89 S 3.3552 7.7042 113.4383 57.3375 64.6451 172.3276 90 A 4.3123 8.5357 123.7329 51.5603 19.0128 177.3421 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 45 S 8.33 4.50 0.00 3.89 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 46 D 8.13 4.37 0.00 2.70 2.59 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 47 G 9.19 4.48 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 0.00 48 D 8.06 4.63 0.00 2.64 2.61 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 49 Q 7.95 4.04 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 7.39 0.00 0.00 0.00 0.00 0.00 2.74 2.49 0.00 50 C 7.71 4.33 0.00 2.94 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.52 4.21 1.27 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 0.00 0.00 0.00 52 S 7.75 4.59 0.00 3.81 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 53 S 7.97 3.59 0.00 3.95 3.77 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 54 P 0.00 4.36 0.00 1.98 1.94 0.00 3.65 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.56 0.00 55 C 7.35 4.33 0.00 2.99 3.13 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 56 Q 8.40 4.50 0.00 2.20 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.16 0.00 0.00 0.00 0.00 0.00 2.18 2.26 0.00 57 N 9.43 3.59 0.00 2.35 1.58 0.00 0.00 6.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 G 8.01 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 0.00 0.00 0.00 59 G 7.82 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.76 4.77 0.00 4.02 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 61 C 8.82 5.27 0.00 3.06 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 62 K 8.91 4.97 0.00 2.25 1.85 0.00 2.00 0.00 0.00 1.81 0.00 0.00 2.83 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.44 1.54 7.81 63 D 8.97 4.91 0.00 2.73 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 64 Q 7.97 4.56 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.03 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 65 L 8.55 3.41 0.00 1.78 1.66 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 8.43 3.91 0.00 2.26 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.63 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 67 S 7.40 4.79 0.00 3.85 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 68 Y 7.54 5.05 0.00 3.00 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 69 I 8.77 4.34 1.76 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 1.12 1.02 0.00 0.00 70 C 8.76 5.20 0.00 2.91 3.05 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 71 F 9.57 4.50 0.00 3.17 3.06 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 0.00 0.00 0.00 72 C 8.38 5.49 0.00 2.96 3.27 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 0.00 73 L 8.95 4.27 0.00 1.38 1.27 1.14 0.87 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 74 P 0.00 4.35 0.00 2.12 2.15 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.92 0.00 75 A 7.43 4.32 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 F 7.30 5.47 0.00 3.24 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 77 E 9.66 4.61 0.00 1.97 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 78 G 8.73 4.25 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 0.00 79 R 8.53 3.87 0.00 1.76 2.02 0.00 3.05 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 80 N 8.08 4.99 0.00 2.83 2.93 0.00 0.00 7.39 7.81 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 81 C 7.70 4.29 0.00 3.21 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 82 E 7.97 4.70 0.00 1.94 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 2.19 2.32 0.00 83 T 8.15 4.73 4.34 0.00 0.00 0.00 0.00 0.00 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 84 H 8.93 5.33 0.00 3.38 3.29 0.00 5.74 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.91 4.32 0.00 1.71 1.77 0.00 1.74 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.70 7.81 86 D 8.44 4.81 0.00 2.60 2.56 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 87 D 8.46 4.39 0.00 2.66 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 7.45 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 7.70 3.36 0.00 4.08 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 90 A 8.54 4.31 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