NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9835 8.0544 114.0506 61.3349 32.9557 174.4408 2 V 4.2672 7.6155 120.2504 61.4444 34.8791 171.8009 3 Y 4.9654 8.1864 131.7700 57.6944 39.5812 177.6974 4 T 4.7117 8.6212 122.7367 61.4106 72.5844 170.5883 5 D 4.8491 8.5837 121.6372 53.8954 41.2635 177.8460 6 C 4.2804 8.8094 121.1889 58.2835 40.7119 174.1822 7 T 4.4300 8.7053 110.4529 62.8198 70.2124 172.8376 8 E 4.6769 7.9530 120.2086 55.4037 32.6345 174.2079 9 S 4.3133 8.5233 122.5407 59.7789 63.5409 174.2702 10 G 4.0200 8.9942 112.1997 45.5356 0.0000 174.0249 11 Q 4.6644 7.5704 118.9153 54.9950 30.6181 174.6788 12 N 4.7936 8.1310 112.9845 54.4330 44.7933 176.2841 13 L 4.2132 7.1494 118.0949 53.9778 39.7223 173.4784 14 C 5.0114 7.3601 113.8726 53.6837 46.5994 175.6417 15 L 4.1190 8.3853 119.8640 55.3298 38.5202 176.6949 16 C 4.2596 8.7268 118.8654 58.5691 39.5420 174.1259 17 E 4.1686 8.1385 128.7484 56.7616 29.9468 177.6862 18 G 3.7142 8.0847 116.5504 47.1916 0.0000 173.3218 19 S 4.5802 8.7683 119.0251 57.6960 62.7907 173.1511 20 N 4.7420 7.9833 117.4496 53.0851 39.4688 174.3963 21 V 4.8524 7.8867 120.7644 61.3980 32.9442 177.5177 22 C 4.7282 8.0229 128.1699 56.6115 40.1987 173.0260 23 G 4.1943 8.5184 103.4187 44.6049 0.0000 172.0753 24 Q 4.0074 8.8195 126.0642 58.0580 29.3439 177.0830 25 G 4.0822 8.9788 111.7357 45.1683 0.0000 172.9854 26 N 5.0681 7.5993 117.8138 52.7063 41.9540 174.2124 27 K 4.5889 8.8229 123.1732 57.7659 34.9745 175.6990 28 C 5.0235 8.8820 125.9342 55.9525 42.0247 173.4781 29 I 4.6221 8.1012 122.0537 59.6738 38.9749 175.5420 30 L 4.6378 8.3108 128.1140 54.8365 43.3472 177.4485 31 G 3.6395 7.6607 105.9519 46.0212 0.0000 176.7019 32 S 4.5289 8.3929 121.2492 58.0370 65.3546 175.9059 33 D 4.2532 9.1129 119.5874 54.0616 37.7839 172.7524 34 G 4.0790 8.3532 107.6811 45.4077 0.0000 171.4989 35 E 4.2988 7.6204 119.2622 55.2822 28.4815 176.8373 36 K 4.1996 8.3264 124.1857 58.7024 32.9070 176.8992 37 N 5.1042 7.6540 113.1681 52.3650 42.8140 174.7811 38 Q 4.1623 8.3145 122.2314 55.8698 31.5075 173.7689 39 C 4.9702 8.8748 126.3822 56.3606 33.6388 173.6872 40 V 4.3200 8.0714 122.1117 60.0572 34.1100 175.9117 41 T 4.7029 7.5746 116.5364 61.0218 68.1715 172.9355 42 G 3.7640 7.8453 110.0588 44.2681 0.0000 174.4190 43 E 4.3690 8.5761 127.5654 54.7638 31.8034 175.7473 44 G 4.2000 8.5185 117.4788 45.4440 0.0000 171.2117 45 T 4.8163 8.2333 113.5571 59.2337 71.1747 172.6232 46 P 4.0690 0.0000 0.0000 62.4793 30.5224 175.0412 47 K 3.6622 8.5451 125.7109 55.8931 31.7167 174.3779 48 P 4.5126 0.0000 0.0000 62.3345 32.0550 176.8063 49 Q 4.1951 8.4427 117.0304 56.5011 28.6983 176.4720 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 V 8.05 3.98 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.90 0.00 0.00 2 V 7.62 4.27 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 0.70 0.00 0.00 0.91 0.00 0.00 3 Y 8.19 4.97 0.00 2.89 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 0.00 0.00 0.00 0.00 4 T 8.62 4.71 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 5 D 8.58 4.85 0.00 2.58 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 6 C 8.81 4.28 0.00 2.95 3.28 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.71 4.43 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 1.21 0.00 0.00 8 E 7.95 4.68 0.00 1.99 1.71 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 2.28 2.32 0.00 9 S 8.52 4.31 0.00 3.89 3.87 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 10 G 8.99 4.02 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 0.00 0.00 0.00 11 Q 7.57 4.66 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.50 0.00 0.00 0.00 0.00 0.00 2.34 2.27 0.00 12 N 8.13 4.79 0.00 2.50 2.66 0.00 0.00 6.87 7.08 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 13 L 7.15 4.21 0.00 0.80 0.13 0.78 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 14 C 7.36 5.01 0.00 3.16 3.10 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 15 L 8.39 4.12 0.00 1.59 1.70 1.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 16 C 8.73 4.26 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 17 E 8.14 4.17 0.00 1.99 1.92 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 2.39 2.24 0.00 18 G 8.08 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 0.00 0.00 0.00 0.00 19 S 8.77 4.58 0.00 3.84 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 20 N 7.98 4.74 0.00 2.97 2.71 0.00 0.00 6.57 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.89 4.85 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 1.07 0.00 0.00 1.01 0.00 0.00 22 C 8.02 4.73 0.00 3.14 2.91 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.52 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.82 4.01 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 5.73 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 25 G 8.98 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 N 7.60 5.07 0.00 2.93 2.81 0.00 0.00 6.26 7.79 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 27 K 8.82 4.59 0.00 1.86 1.63 0.00 1.66 0.00 0.00 1.73 0.00 0.00 2.82 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.32 7.81 28 C 8.88 5.02 0.00 3.10 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 29 I 8.10 4.62 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 1.33 0.87 0.90 0.00 0.00 30 L 8.31 4.64 0.00 1.63 1.64 1.01 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 31 G 7.66 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.39 4.53 0.00 4.07 3.78 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 0.00 0.00 0.00 33 D 9.11 4.25 0.00 2.79 2.69 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 0.00 0.00 0.00 34 G 8.35 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.62 4.30 0.00 2.17 1.92 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 2.38 2.26 0.00 36 K 8.33 4.20 0.00 1.82 1.84 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.52 1.59 7.81 37 N 7.65 5.10 0.00 2.54 2.66 0.00 0.00 6.63 7.68 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 38 Q 8.31 4.16 0.00 2.08 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.17 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 39 C 8.87 4.97 0.00 2.89 3.03 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 0.00 0.00 0.00 40 V 8.07 4.32 2.07 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 0.87 0.00 0.00 0.92 0.00 0.00 41 T 7.57 4.70 4.23 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 1.20 0.00 0.00 42 G 7.85 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 43 E 8.58 4.37 0.00 1.92 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.27 0.00 44 G 8.52 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.23 4.82 4.22 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 0.00 0.00 1.20 0.00 0.00 46 P 0.00 4.07 0.00 2.23 2.10 0.00 3.84 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 47 K 8.55 3.66 0.00 1.70 1.85 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.18 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.51 7.81 48 P 0.00 4.51 0.00 2.09 2.01 0.00 3.73 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 2.03 2.12 0.00 49 Q 8.44 4.20 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.66 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00