NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.1730 8.1593 115.2433 61.1195 68.4156 173.5848 2 P 4.2007 0.0000 0.0000 61.9508 30.8838 174.0785 3 D 4.6675 8.7056 124.6020 53.0779 42.5191 176.3880 4 V 4.0202 7.9266 122.0369 62.4525 34.5950 175.0519 5 S 3.6751 8.4825 112.8119 60.2523 60.9439 173.0619 6 S 3.6367 7.7296 114.4583 60.0683 60.6628 172.2594 7 A 4.5536 7.4594 121.9444 54.1090 20.9157 178.7791 8 L 4.0098 7.7480 116.5016 57.5700 41.4970 179.1880 9 D 4.3352 8.0425 117.3644 57.1384 41.5227 178.0285 10 K 4.3496 7.8752 120.1539 59.5798 32.6954 178.8175 11 L 4.1180 7.9796 121.8341 57.1962 41.7109 178.8399 12 K 3.9567 7.8266 118.3304 59.3585 32.7316 177.9564 13 E 4.4099 7.9648 117.1901 58.0037 30.6233 177.8723 14 F 4.3620 8.0857 121.8294 60.6401 39.3467 177.2857 15 G 3.5443 7.9087 105.4507 47.9116 0.0000 175.1499 16 N 4.2942 8.1172 119.2699 56.4719 38.9545 176.7999 17 T 3.8908 7.8227 117.4197 66.4603 68.6988 176.1828 18 L 4.0802 7.3224 119.8122 57.1944 40.4166 178.4296 19 E 3.9684 7.8209 121.6863 59.5249 29.7923 177.8125 20 D 4.3054 7.7528 116.6361 57.0188 41.3205 178.1135 21 K 3.8431 8.0707 120.0223 59.5866 32.2129 178.6716 22 A 3.9917 7.5964 119.5151 55.0452 18.3518 179.8152 23 R 3.8540 7.8347 116.1522 59.4966 30.2256 179.0929 24 E 3.9590 8.1854 118.3195 59.2850 29.4414 179.2674 25 L 3.9544 7.8852 120.2921 58.2067 42.3155 179.1049 26 I 3.7195 7.8028 119.7683 64.4720 36.8068 178.4386 27 S 4.1287 7.7260 114.7292 61.6547 62.7171 176.5712 28 R 4.0500 7.6095 119.7034 60.2497 30.5237 177.7620 29 I 3.8431 8.1652 120.4645 58.3406 38.0173 175.4203 30 K 3.8581 8.5242 121.0587 59.0448 30.5914 175.6400 31 Q 3.3967 7.8079 117.0346 56.4434 26.8994 174.9818 32 S 4.2811 7.1330 110.4028 59.8540 63.9356 173.2045 33 E 4.3457 9.0555 125.7101 56.5122 29.2093 175.3369 34 L 4.2121 7.8032 118.5435 58.0519 43.9066 177.4120 35 S 4.3814 8.2326 115.3173 57.6960 60.6298 173.6708 36 A 3.9295 9.0432 135.0000 54.4264 17.3977 180.8293 37 K 3.9610 7.6720 113.9197 59.4041 32.5074 179.0595 38 M 3.4872 7.8758 118.5373 58.3853 31.3736 178.7752 39 R 4.0822 7.8322 117.3252 59.3224 30.3051 178.5776 40 E 3.9759 7.9892 118.6687 59.0920 29.6132 178.6288 41 W 4.1847 8.2480 128.3987 60.5341 30.7204 177.9678 42 F 4.5387 8.3441 117.8563 60.5253 38.3439 177.6352 43 S 4.1868 7.9934 112.2753 61.2878 62.2458 175.9156 44 E 3.8685 7.8934 120.8641 59.8370 29.0077 179.5055 45 T 3.5078 7.3937 115.5167 66.3227 68.4636 176.2289 46 F 4.1548 7.9438 122.0337 61.7488 39.3713 177.3143 47 Q 3.8525 7.9916 116.8438 58.7107 27.1725 178.9628 48 K 4.0034 7.8933 119.5806 59.3213 32.1333 179.5753 49 V 3.5356 7.3329 118.2772 65.7616 31.2603 177.9604 50 K 3.7163 7.3560 117.9991 59.4364 32.0966 178.1702 51 E 4.0115 7.7593 116.4546 59.4272 29.2429 179.0975 52 K 4.0693 7.2387 116.0517 58.2745 32.5914 177.9542 53 L 4.2439 6.9666 117.4229 54.9221 42.0852 175.7417 54 K 4.5906 7.8093 120.4746 57.8282 39.7810 177.1016 55 I 4.1352 7.4660 129.3053 59.1421 36.0098 174.7797 56 D 4.4894 7.9007 125.4496 54.5917 41.5466 177.3240 57 S 4.2070 7.8898 122.5715 59.1864 63.9697 174.1364 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 T 8.16 4.17 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 2 P 0.00 4.20 0.00 2.30 2.08 0.00 3.80 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 3 D 8.71 4.67 0.00 2.68 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 4 V 7.93 4.02 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 0.98 0.00 0.00 0.98 0.00 0.00 5 S 8.48 3.68 0.00 3.99 3.83 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 6 S 7.73 3.64 0.00 4.02 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 7 A 7.46 4.55 1.33 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 0.00 0.00 0.00 0.00 0.00 0.00 8 L 7.75 4.01 0.00 1.71 1.74 0.93 0.94 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 9 D 8.04 4.34 0.00 2.65 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 10 K 7.88 4.35 0.00 2.00 2.02 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.70 1.39 7.81 11 L 7.98 4.12 0.00 1.98 1.77 0.97 0.35 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 12 K 7.83 3.96 0.00 1.97 1.96 0.00 1.75 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.69 1.48 7.81 13 E 7.96 4.41 0.00 2.21 2.25 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 2.37 2.33 0.00 14 F 8.09 4.36 0.00 3.10 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 15 G 7.91 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.12 4.29 0.00 2.83 2.86 0.00 0.00 7.16 7.21 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 17 T 7.82 3.89 4.12 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 1.16 0.00 0.00 18 L 7.32 4.08 0.00 1.68 1.59 0.81 0.49 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 19 E 7.82 3.97 0.00 2.14 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 0.00 2.27 2.28 0.00 20 D 7.75 4.31 0.00 2.85 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.07 3.84 0.00 1.98 1.73 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.44 7.81 22 A 7.60 3.99 1.38 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 0.00 0.00 23 R 7.83 3.85 0.00 1.87 1.97 0.00 3.12 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 24 E 8.19 3.96 0.00 2.15 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 2.32 2.41 0.00 25 L 7.89 3.95 0.00 1.87 1.64 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 26 I 7.80 3.72 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.03 0.90 0.00 0.00 27 S 7.73 4.13 0.00 4.00 3.92 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 0.00 0.00 0.00 28 R 7.61 4.05 0.00 1.82 2.13 0.00 3.26 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 29 I 8.17 3.84 1.95 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 1.64 0.96 0.94 0.00 0.00 30 K 8.52 3.86 0.00 1.97 1.90 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.54 1.56 7.81 31 Q 7.81 3.40 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 7.10 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 32 S 7.13 4.28 0.00 4.01 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 33 E 9.06 4.35 0.00 2.13 2.22 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 2.15 2.27 0.00 34 L 7.80 4.21 0.00 1.64 1.86 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.23 4.38 0.00 4.05 3.15 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 0.00 0.00 0.00 0.00 36 A 9.04 3.93 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 37 K 7.67 3.96 0.00 1.80 1.74 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.51 7.81 38 M 7.88 3.49 0.00 1.73 2.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.42 0.00 39 R 7.83 4.08 0.00 1.88 2.04 0.00 3.18 0.00 0.00 3.47 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.78 0.00 40 E 7.99 3.98 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 2.33 2.48 0.00 41 W 8.25 4.18 0.00 3.40 3.07 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 42 F 8.34 4.54 0.00 3.15 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 43 S 7.99 4.19 0.00 3.97 4.04 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 44 E 7.89 3.87 0.00 1.93 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 2.29 2.52 0.00 45 T 7.39 3.51 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 46 F 7.94 4.15 0.00 3.16 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 47 Q 7.99 3.85 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.70 0.00 0.00 0.00 0.00 0.00 2.65 2.58 0.00 48 K 7.89 4.00 0.00 1.71 1.78 0.00 1.60 0.00 0.00 1.50 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.51 7.81 49 V 7.33 3.54 1.95 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 1.02 0.00 0.00 0.95 0.00 0.00 50 K 7.36 3.72 0.00 1.31 1.65 0.00 1.14 0.00 0.00 1.33 0.00 0.00 3.09 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.26 1.19 7.81 51 E 7.76 4.01 0.00 2.13 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 2.51 2.31 0.00 52 K 7.24 4.07 0.00 1.82 1.87 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.59 1.58 7.81 53 L 6.97 4.24 0.00 1.72 1.82 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 54 K 7.81 4.59 0.00 1.82 1.80 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.53 7.81 55 I 7.47 4.14 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.86 0.90 0.00 0.00 56 D 7.90 4.49 0.00 2.63 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 S 7.89 4.21 0.00 3.78 3.67 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