NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 23 E 4.1975 8.4449 118.7981 55.6190 31.7193 175.4541 24 Y 4.5977 7.7154 115.9958 55.1254 41.7861 173.1927 25 A 4.3232 8.9933 125.3069 52.1505 20.6376 176.1602 26 V 4.2049 8.3685 122.8345 61.9587 32.4269 175.2467 27 E 4.3073 8.8889 130.0753 58.1544 30.1094 176.1974 28 K 4.3366 7.3616 115.5726 56.1764 35.6989 173.4792 29 I 4.3599 8.2074 122.1777 60.5970 37.5452 175.7187 30 I 4.2701 8.6561 128.2069 63.2055 38.6201 175.0206 31 D 4.9966 7.5074 118.9659 53.9506 44.9817 173.7406 32 R 5.4232 8.6703 120.2131 55.0157 33.5193 173.6208 33 R 4.6034 9.0493 120.5790 55.3739 33.6334 173.3802 34 V 4.7534 8.0408 118.6791 61.1352 33.8467 174.9539 35 R 4.4357 8.6297 126.3661 55.5437 33.6268 175.4556 36 K 3.8465 9.5767 121.6977 57.5569 29.6341 176.1316 37 G 3.8990 8.4001 103.2081 46.1699 0.0000 173.7296 38 M 4.6153 7.8571 119.8083 52.9746 34.3532 175.2280 39 V 4.1948 8.0907 123.0548 62.7290 33.0762 174.5062 40 E 5.1762 9.3673 126.3460 54.7930 33.9840 174.0859 41 Y 5.2215 9.0477 120.0525 56.4006 41.6685 174.2452 42 Y 4.1283 8.6460 125.6389 56.5688 39.9489 173.9893 43 L 4.6000 8.0558 127.3224 52.6156 44.8126 175.4485 44 K 4.9291 7.8068 123.7471 53.7956 34.0928 175.1473 45 W 4.7126 8.4994 127.7132 55.3968 30.7355 176.0037 46 K 4.1900 8.7661 126.4580 57.8598 32.0167 177.3025 47 G 3.9608 9.1408 113.8183 45.6894 0.0000 172.3819 48 Y 4.6795 7.6544 116.2652 55.1145 40.9565 173.9705 49 P 4.5797 0.0000 0.0000 62.1568 32.3600 177.5510 50 E 4.1363 8.8621 119.9393 59.8417 29.4844 179.6856 51 T 3.9176 7.9657 107.3820 63.8575 68.7617 174.3806 52 E 4.4471 8.1635 120.7502 56.0828 30.2885 175.8900 53 N 4.9624 8.3519 118.4960 53.4505 39.6163 174.1629 54 T 5.0920 7.8442 110.8520 60.0796 72.9337 172.3179 55 W 5.2085 9.0171 122.7308 56.1604 30.3568 175.7217 56 E 5.0402 9.4144 124.1364 53.5254 32.9852 173.9967 57 P 4.7928 0.0000 0.0000 62.4445 32.2932 177.0257 58 E 4.1779 9.0428 119.1007 59.7850 29.4627 179.2037 59 N 4.4978 8.1602 115.4259 55.7805 38.7365 175.7060 60 N 4.6000 8.2532 114.8467 54.7787 39.0166 175.2508 61 L 4.5118 7.5570 118.3806 53.7718 43.3229 176.3335 62 D 4.9269 8.3240 119.3887 53.0167 41.6251 176.1293 63 C 4.7993 7.2995 120.4420 57.3820 29.8325 175.2829 64 Q 3.9086 8.0158 123.2540 59.3310 29.0749 177.0858 65 D 4.2925 7.9795 119.2436 57.4003 41.0159 178.5384 66 L 3.9411 7.7667 118.7169 57.8338 41.6069 179.4903 67 I 3.3955 7.7623 119.7837 64.3249 37.1771 178.0625 68 Q 3.9617 8.4440 120.6680 59.4999 28.8068 178.4462 69 Q 3.9802 8.5510 120.8076 59.0862 28.8902 177.4656 70 Y 3.8845 8.4838 120.9627 60.9013 38.7262 177.9075 71 E 4.0864 8.4881 117.9848 59.2365 29.5598 179.1864 72 A 4.1288 7.7055 120.0605 55.1828 18.7369 179.4490 73 S 4.2358 7.9161 109.7236 59.4886 63.4581 174.7316 74 R 3.8760 7.4844 127.6301 56.8925 29.9370 175.4597 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 23 E 8.44 4.20 0.00 1.57 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 2.20 2.34 0.00 24 Y 7.72 4.60 0.00 2.88 2.87 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 0.00 0.00 0.00 25 A 8.99 4.32 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 V 8.37 4.20 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 0.46 0.00 0.00 0.70 0.00 0.00 27 E 8.89 4.31 0.00 2.10 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 2.26 2.24 0.00 28 K 7.36 4.34 0.00 1.76 1.78 0.00 1.52 0.00 0.00 1.79 0.00 0.00 2.76 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.25 1.31 7.81 29 I 8.21 4.36 1.72 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.30 0.35 0.00 0.00 30 I 8.66 4.27 2.01 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.37 1.03 0.00 0.00 31 D 7.51 5.00 0.00 2.73 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 R 8.67 5.42 0.00 1.73 1.92 0.00 3.64 0.00 0.00 3.47 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.16 0.00 33 R 9.05 4.60 0.00 1.55 1.65 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.08 0.00 34 V 8.04 4.75 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 0.83 0.00 0.00 0.87 0.00 0.00 35 R 8.63 4.44 0.00 1.64 1.62 0.00 3.31 0.00 0.00 3.00 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.38 0.00 36 K 9.58 3.85 0.00 1.84 1.85 0.00 1.83 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.36 7.81 37 G 8.40 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 M 7.86 4.62 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.56 0.00 39 V 8.09 4.19 2.12 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 0.66 0.00 0.00 0.88 0.00 0.00 40 E 9.37 5.18 0.00 1.86 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 2.23 2.34 0.00 41 Y 9.05 5.22 0.00 2.79 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 42 Y 8.65 4.13 0.00 1.43 2.27 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 43 L 8.06 4.60 0.00 0.50 0.54 0.38 0.30 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 44 K 7.81 4.93 0.00 1.68 1.59 0.00 1.60 0.00 0.00 1.82 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.30 7.81 45 W 8.50 4.71 0.00 3.18 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 46 K 8.77 4.19 0.00 1.81 1.96 0.00 1.88 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.53 1.44 7.81 47 G 9.14 3.96 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 0.00 0.00 0.00 48 Y 7.65 4.68 0.00 3.15 2.88 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 49 P 0.00 4.58 0.00 2.22 1.99 0.00 3.75 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 50 E 8.86 4.14 0.00 2.02 2.04 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 2.42 2.27 0.00 51 T 7.97 3.92 4.27 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 1.24 0.00 0.00 52 E 8.16 4.45 0.00 2.18 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 53 N 8.35 4.96 0.00 2.39 1.47 0.00 0.00 6.66 7.88 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 54 T 7.84 5.09 4.42 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 0.00 0.00 0.00 1.34 0.00 0.00 55 W 9.02 5.21 0.00 3.29 3.35 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 56 E 9.41 5.04 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.63 0.00 57 P 0.00 4.79 0.00 2.26 2.22 0.00 3.83 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.02 0.00 58 E 9.04 4.18 0.00 2.41 2.40 0.00 0.00 0.00 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 2.37 0.00 59 N 8.16 4.50 0.00 2.78 2.97 0.00 0.00 6.94 8.00 0.00 0.00 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 N 8.25 4.60 0.00 3.02 3.00 0.00 0.00 6.97 8.66 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 61 L 7.56 4.51 0.00 1.81 1.54 1.05 0.75 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 62 D 8.32 4.93 0.00 2.60 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.30 4.80 0.00 2.81 2.68 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 0.00 64 Q 8.02 3.91 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 65 D 7.98 4.29 0.00 2.78 2.68 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 0.00 66 L 7.77 3.94 0.00 1.67 1.59 0.80 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 67 I 7.76 3.40 1.90 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.50 0.90 0.00 0.00 68 Q 8.44 3.96 0.00 2.14 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 69 Q 8.55 3.98 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 70 Y 8.48 3.88 0.00 3.04 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 71 E 8.49 4.09 0.00 2.05 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 2.75 2.61 0.00 72 A 7.71 4.13 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.92 4.24 0.00 3.96 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 74 R 7.48 3.88 0.00 1.83 1.96 0.00 3.48 0.00 0.00 3.33 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00