NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2989 8.2033 121.7114 55.6356 30.8813 177.1152 2 P 4.0394 0.0000 0.0000 63.0412 31.4020 174.3489 3 L 3.6159 7.0920 120.1274 52.3532 42.5022 171.9341 4 P 4.0137 0.0000 0.0000 63.2972 30.9555 174.6095 5 D 4.4111 8.7103 123.2594 55.0127 40.5839 177.0907 6 C 4.5335 8.3126 128.5557 55.8347 34.5222 174.1918 7 C 3.9978 8.2614 120.1526 58.2759 36.7477 174.1290 8 R 3.9305 8.8080 116.0945 56.7007 28.1085 176.3450 9 Q 3.4505 8.0700 115.3072 57.2775 27.1651 173.1057 10 K 4.3017 7.7853 114.1377 56.5707 32.2459 176.9849 11 T 3.3881 8.2277 108.4681 61.9171 65.6467 171.7749 12 C 4.1295 7.9474 114.8337 57.9720 32.0718 175.5724 13 S 3.9959 7.5976 116.7911 61.6960 62.5012 174.6035 14 C 4.4653 8.3529 119.7066 59.7207 37.5148 175.7938 15 R 3.9232 8.0577 120.1437 59.5187 29.4755 178.9647 16 L 4.0092 7.8300 118.0104 57.9206 41.3949 178.8470 17 Y 4.1268 7.9423 115.1407 59.7650 37.8150 177.8262 18 E 4.0065 8.4132 120.8715 59.4432 29.4209 178.9959 19 L 3.6546 7.6034 117.8432 57.0613 41.6864 179.4253 20 L 3.8596 7.7250 119.7274 56.9793 41.4161 178.2628 21 H 4.6723 7.7294 113.5753 57.4884 29.5236 176.8201 22 G 3.5648 8.2817 110.4875 47.3439 0.0000 175.5531 23 A 4.7015 7.4192 123.1337 51.3806 19.8183 177.1543 24 G 4.5741 7.6773 105.5443 45.9673 0.0000 176.3401 25 N 4.3658 8.1999 120.2224 56.6223 38.5083 174.9621 26 H 4.3845 7.9511 116.7177 58.1106 29.0893 177.2881 27 A 4.1014 7.8051 122.0459 54.8447 18.3763 179.2950 28 A 4.0411 8.6730 119.7886 55.3899 18.2968 180.0797 29 G 3.6263 7.5886 102.3057 47.8354 0.0000 175.2841 30 I 4.0865 6.9760 120.9088 63.2633 37.5640 177.2450 31 L 4.2616 7.8093 118.9758 56.3697 42.0303 176.8278 32 T 4.4318 7.3842 114.3879 63.7984 68.9588 174.7249 33 L 3.9889 8.0054 127.1207 55.4458 41.7676 174.5617 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 Q 8.20 4.30 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.78 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 2 P 0.00 4.04 0.00 2.16 2.12 0.00 3.88 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 2.03 2.16 0.00 3 L 7.09 3.62 0.00 1.85 1.67 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.01 0.00 2.17 2.12 0.00 3.79 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 5 D 8.71 4.41 0.00 2.65 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 6 C 8.31 4.53 0.00 3.03 3.14 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 0.00 0.00 0.00 0.00 7 C 8.26 4.00 0.00 3.15 3.11 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 0.00 0.00 0.00 8 R 8.81 3.93 0.00 1.91 2.03 0.00 3.47 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 9 Q 8.07 3.45 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.60 0.00 0.00 0.00 0.00 0.00 2.25 2.52 0.00 10 K 7.79 4.30 0.00 2.04 1.74 0.00 1.63 0.00 0.00 1.57 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.42 7.81 11 T 8.23 3.39 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 1.23 0.00 0.00 12 C 7.95 4.13 0.00 3.20 3.19 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 13 S 7.60 4.00 0.00 4.28 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 14 C 8.35 4.47 0.00 3.03 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 R 8.06 3.92 0.00 1.97 2.01 0.00 3.30 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 16 L 7.83 4.01 0.00 1.67 1.58 1.02 1.10 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 17 Y 7.94 4.13 0.00 3.13 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 18 E 8.41 4.01 0.00 2.30 1.97 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 2.42 2.62 0.00 19 L 7.60 3.65 0.00 1.71 1.70 0.95 0.55 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 20 L 7.72 3.86 0.00 1.67 1.67 0.57 0.78 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 21 H 7.73 4.67 0.00 3.32 3.57 0.00 5.55 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 8.28 3.56 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 0.00 0.00 0.00 23 A 7.42 4.70 1.22 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 0.00 0.00 0.00 24 G 7.68 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.20 4.37 0.00 2.69 2.65 0.00 0.00 7.03 7.87 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 26 H 7.95 4.38 0.00 3.28 3.31 0.00 5.86 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 7.81 4.10 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.67 4.04 1.34 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 0.00 0.00 0.00 29 G 7.59 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 I 6.98 4.09 1.99 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.76 0.91 0.00 0.00 31 L 7.81 4.26 0.00 1.73 1.82 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 32 T 7.38 4.43 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 1.21 0.00 0.00 33 L 8.01 3.99 0.00 1.79 1.64 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00