NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6845 8.2076 120.5443 54.6801 43.2166 177.5720 2 Y 4.0191 8.3579 117.6089 59.6727 37.8801 176.6045 3 L 3.6457 7.1490 121.1843 56.9575 42.0532 180.5288 4 R 3.9853 7.6476 117.8819 58.5298 30.3931 178.1005 5 E 3.8999 8.0408 119.0457 59.3540 29.7354 178.5343 6 L 3.9592 7.9040 118.9856 58.1852 41.7869 179.5824 7 L 3.9986 7.8977 119.7485 57.8315 42.0830 178.9274 8 K 3.9640 8.1797 119.8199 59.4969 32.1749 178.9048 9 L 4.0767 7.9362 118.9793 57.5803 41.4490 179.0656 10 E 4.2097 7.9867 117.8432 58.3932 29.4134 179.1311 11 L 3.9574 7.9733 119.7459 57.7764 41.7094 178.9620 12 Q 3.9708 7.9408 117.0244 59.5428 28.3414 179.0303 13 A 3.9948 7.9705 122.4260 54.9780 18.6770 179.5333 14 I 3.8318 8.2786 117.4874 63.9304 37.9970 178.0121 15 K 3.9971 8.4048 121.1617 59.5732 31.9645 178.7993 16 Q 4.1105 7.9806 118.2715 58.6103 28.6050 178.0836 17 Y 3.9598 7.8796 117.9171 61.1703 38.0580 178.7430 18 R 4.0137 8.1055 118.9036 59.0804 30.1796 178.8092 19 E 4.0958 8.0888 116.7049 58.8649 29.5906 178.7223 20 A 4.3739 8.3396 121.9657 54.0988 18.4614 178.2879 21 L 4.4318 7.8371 116.4938 55.9208 42.4029 178.0154 22 E 4.0708 7.4557 116.7935 60.4677 29.6091 178.3384 23 Y 4.5069 7.5484 115.0802 59.4266 37.9785 176.8965 24 V 4.2889 6.9244 117.0598 60.3512 34.1265 173.5828 25 K 4.1652 8.7311 125.5893 56.5214 32.4438 177.8423 26 L 4.5656 8.4509 120.8217 51.9891 44.3482 173.4176 27 P 4.0430 0.0000 0.0000 65.5891 31.6227 177.9038 28 V 3.6912 7.8127 117.3882 64.3673 31.4695 178.0456 29 L 4.0199 8.6872 120.4445 58.0531 41.5836 179.4386 30 A 4.0205 7.9221 119.6988 55.0945 18.3928 179.6661 31 K 3.9506 7.9633 117.0047 59.4645 31.9860 179.6750 32 I 3.5510 7.5411 120.4623 63.9606 36.8184 178.1460 33 L 3.6724 7.3670 120.8311 57.7940 41.9341 178.2731 34 E 3.7733 8.0188 119.2709 59.6477 29.6657 178.4097 35 D 4.1768 7.7867 118.2680 57.6160 40.8233 178.8731 36 E 3.7485 8.1873 118.5564 58.3981 29.2413 179.1085 37 E 3.8300 7.7799 118.7165 59.8979 29.7952 178.4060 38 K 3.1475 7.9501 117.1808 59.3456 31.6696 179.3963 39 H 3.7497 7.6769 115.3684 58.9558 29.1123 177.6367 40 I 3.7398 7.4231 121.6426 64.3653 36.5288 177.3984 41 E 3.8565 8.1976 120.2550 58.8717 29.3358 178.6591 42 W 4.9872 7.6270 117.8289 60.3491 29.3142 178.5385 43 L 4.2107 7.9206 118.4026 57.5125 40.9221 179.2438 44 E 3.9749 7.8431 117.2041 60.6075 29.5660 178.7314 45 T 3.5612 8.9177 112.1684 67.8417 68.5160 175.3727 46 I 3.8271 8.4442 125.7759 66.7817 38.2065 178.5555 47 L 4.4271 9.0302 119.9667 56.0031 43.4443 177.4386 48 G 4.2892 8.0076 110.1667 45.9265 0.0000 173.8127 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 D 8.21 4.68 0.00 2.84 2.84 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 2 Y 8.36 4.02 0.00 3.45 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 3 L 7.15 3.65 0.00 1.33 1.50 0.73 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 4 R 7.65 3.99 0.00 1.96 1.94 0.00 3.12 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 5 E 8.04 3.90 0.00 2.08 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 0.00 2.33 2.38 0.00 6 L 7.90 3.96 0.00 1.92 1.74 0.99 0.45 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 7 L 7.90 4.00 0.00 1.75 1.64 0.92 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.18 3.96 0.00 1.87 1.98 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.48 7.81 9 L 7.94 4.08 0.00 1.92 1.73 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 10 E 7.99 4.21 0.00 2.00 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 2.35 2.51 0.00 11 L 7.97 3.96 0.00 1.85 1.71 0.92 0.77 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 12 Q 7.94 3.97 0.00 2.32 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 13 A 7.97 3.99 1.52 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 0.00 0.00 0.00 0.00 0.00 0.00 14 I 8.28 3.83 2.08 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.29 0.92 0.00 0.00 15 K 8.40 4.00 0.00 1.86 1.92 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.48 7.81 16 Q 7.98 4.11 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 17 Y 7.88 3.96 0.00 3.27 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 18 R 8.11 4.01 0.00 2.10 1.99 0.00 3.13 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 19 E 8.09 4.10 0.00 2.18 2.36 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 2.49 2.48 0.00 20 A 8.34 4.37 1.41 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 0.00 0.00 21 L 7.84 4.43 0.00 1.95 1.71 0.98 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 22 E 7.46 4.07 0.00 2.00 1.76 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 2.27 2.60 0.00 23 Y 7.55 4.51 0.00 3.18 2.96 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 0.00 0.00 0.00 24 V 6.92 4.29 2.14 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 0.73 0.00 0.00 0.97 0.00 0.00 25 K 8.73 4.17 0.00 1.78 1.82 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.47 7.81 26 L 8.45 4.57 0.00 1.83 1.57 0.95 1.10 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 27 P 0.00 4.04 0.00 2.16 2.12 0.00 3.61 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 28 V 7.81 3.69 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 0.94 0.00 0.00 29 L 8.69 4.02 0.00 1.97 1.89 1.04 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.92 4.02 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.96 3.95 0.00 1.94 1.83 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.63 7.81 32 I 7.54 3.55 1.27 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.75 0.02 0.00 0.00 33 L 7.37 3.67 0.00 1.75 1.57 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.02 3.77 0.00 2.12 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 2.23 2.28 0.00 35 D 7.79 4.18 0.00 2.85 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.19 3.75 0.00 1.76 1.88 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 2.31 1.99 0.00 37 E 7.78 3.83 0.00 2.04 1.87 0.00 0.00 0.00 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 2.26 0.00 38 K 7.95 3.15 0.00 1.47 0.74 0.00 1.43 0.00 0.00 1.39 0.00 0.00 2.87 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.20 1.36 7.81 39 H 7.68 3.75 0.00 3.26 3.24 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 I 7.42 3.74 1.91 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 1.38 0.90 0.88 0.00 0.00 41 E 8.20 3.86 0.00 1.89 1.74 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 2.41 2.38 0.00 42 W 7.63 4.99 0.00 3.65 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.92 4.21 0.00 1.67 1.72 0.93 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 44 E 7.84 3.97 0.00 2.24 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 2.35 2.44 0.00 45 T 8.92 3.56 4.68 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 1.26 0.00 0.00 46 I 8.44 3.83 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.62 0.91 0.00 0.00 47 L 9.03 4.43 0.00 1.90 1.60 0.89 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.01 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