NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 N 4.6882 8.4249 119.2030 53.6548 39.6621 174.2372 7 I 3.9325 8.1065 127.0776 62.2385 37.7854 175.9114 8 Q 3.9001 8.8998 121.6373 59.5904 29.2107 177.7501 9 D 4.3774 8.4015 119.3547 57.0318 40.8453 178.8008 10 K 3.7793 7.9065 119.4519 59.4032 32.3374 178.4142 11 A 3.3912 8.0083 121.0790 54.9885 18.3153 179.4894 12 L 3.6073 7.9443 117.6473 57.7985 41.5617 179.4781 13 E 3.9935 8.1174 119.4715 59.2243 29.4243 178.0019 14 N 4.0703 7.9447 117.1134 56.8488 38.8956 176.4954 15 F 4.8185 7.2750 120.0996 60.1005 39.2069 177.8526 16 K 4.3666 8.4535 120.0646 59.1944 31.7431 177.9526 17 A 4.1223 8.3404 121.1115 54.5600 18.2035 177.8571 18 N 4.7024 8.0570 113.3006 51.3578 39.5114 175.8480 19 Q 3.3165 7.4556 116.0686 58.0082 26.1969 172.7767 20 T 4.2030 8.3017 116.8849 63.4432 71.0545 175.1137 21 E 4.4493 8.6017 124.1109 55.1503 29.3278 174.4709 22 V 4.1510 8.8087 126.8179 61.5895 33.9502 174.5180 23 T 4.7411 8.3927 123.8623 61.8677 70.7264 173.3406 24 V 4.2479 8.5251 128.1866 61.5933 33.2185 174.5004 25 F 5.0325 8.9079 127.0850 55.9164 41.2960 175.6910 26 F 4.8755 9.4185 122.6624 56.1824 40.5939 176.8236 27 L 4.1509 8.4359 120.5978 57.3924 41.8943 178.1973 28 N 4.7253 8.3894 114.6696 52.7919 37.3124 176.6353 29 G 4.1567 8.3708 108.1413 46.4895 0.0000 174.6506 30 F 4.5755 8.6297 122.7586 58.2939 40.6241 173.9680 31 Q 4.8416 6.9164 120.4606 54.4584 31.7764 173.9530 32 M 4.6692 8.5938 120.1245 53.7225 35.8077 173.5082 33 K 4.7672 8.3519 127.0610 55.2011 34.2626 175.6057 34 G 4.2067 8.6185 113.1155 46.0996 0.0000 171.3772 35 V 4.9986 7.8574 119.2932 58.7748 34.2185 175.2947 36 I 3.9538 8.3780 125.3814 61.4289 37.1582 176.2409 37 E 4.1737 9.1293 129.3907 58.4306 29.6835 176.6809 38 E 4.7937 7.7380 114.6678 55.5938 32.8756 172.5844 39 Y 5.1063 7.6538 115.5098 57.1408 40.2143 172.5325 40 D 4.4146 8.5054 118.0075 52.7785 41.4704 174.8681 41 K 3.9586 8.6630 116.7877 59.6168 32.5353 176.9241 42 Y 4.8764 9.0323 115.4432 59.2639 40.4808 176.7962 43 V 4.7383 7.9905 110.9428 59.9085 35.3701 174.9223 44 V 4.8420 8.5225 120.5436 61.9495 35.3145 173.1776 45 S 5.0661 9.2635 123.6928 57.0533 63.7932 172.2450 46 L 5.2150 9.2278 130.3243 53.3779 44.6057 174.6323 47 N 5.2123 8.7167 124.0462 52.4045 40.1461 174.3361 48 S 4.7063 8.9568 117.9158 57.7155 66.3304 173.8189 49 Q 3.4288 9.8574 125.1295 57.0852 26.2404 175.1803 50 G 4.1619 8.5517 108.6701 45.6933 0.0000 175.0420 51 K 4.3228 7.6740 118.3213 55.6844 33.1349 175.2782 52 Q 5.0667 8.2111 118.3941 54.4951 31.6305 174.9807 53 H 4.8937 9.1948 120.7938 53.8642 32.1401 172.5371 54 L 4.8813 8.7086 125.8139 54.0037 42.7656 175.2052 55 I 4.6393 8.6773 128.4787 59.6182 39.8606 175.2503 56 Y 4.4573 8.6008 124.3408 57.3292 38.9237 177.0183 57 K 4.1215 9.3616 124.5111 59.6070 32.3960 179.0831 58 H 4.3400 8.3393 112.9994 57.6909 28.6362 175.7616 59 A 4.5906 8.2488 122.1251 52.3168 19.4246 176.5897 60 I 4.1330 7.2318 116.2361 59.9329 38.9756 174.6115 61 S 4.6345 9.1108 117.1503 59.8370 63.8852 174.2107 62 T 4.7384 7.4859 114.3892 62.1605 73.0534 171.8752 63 Y 5.1818 8.6026 121.0146 56.7499 40.7626 175.3026 64 T 4.8051 8.6966 118.3184 61.9379 73.5252 174.7897 65 V 3.9196 8.3470 115.9566 61.5994 31.9970 175.9366 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 6 N 8.42 4.69 0.00 2.68 2.81 0.00 0.00 6.97 7.06 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 7 I 8.11 3.93 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.23 0.88 0.00 0.00 8 Q 8.90 3.90 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 9 D 8.40 4.38 0.00 2.84 2.76 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 10 K 7.91 3.78 0.00 1.75 1.87 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.43 7.81 11 A 8.01 3.39 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 L 7.94 3.61 0.00 0.92 0.20 0.61 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.12 3.99 0.00 2.21 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 2.33 2.36 0.00 14 N 7.94 4.07 0.00 2.67 2.28 0.00 0.00 7.21 7.29 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 15 F 7.27 4.82 0.00 3.01 2.93 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 16 K 8.45 4.37 0.00 2.04 2.15 0.00 2.01 0.00 0.00 2.14 0.00 0.00 3.01 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.52 1.60 7.81 17 A 8.34 4.12 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 18 N 8.06 4.70 0.00 2.87 2.92 0.00 0.00 7.38 7.28 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 19 Q 7.46 3.32 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.23 6.96 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 20 T 8.30 4.20 4.36 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 1.29 0.00 0.00 21 E 8.60 4.45 0.00 1.94 1.86 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 2.19 2.30 0.00 22 V 8.81 4.15 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 0.71 0.00 0.00 0.18 0.00 0.00 23 T 8.39 4.74 4.15 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 0.68 0.00 0.00 24 V 8.53 4.25 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 0.32 0.00 0.00 0.88 0.00 0.00 25 F 8.91 5.03 0.00 2.95 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 26 F 9.42 4.88 0.00 3.24 3.08 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 27 L 8.44 4.15 0.00 1.60 1.80 1.03 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 28 N 8.39 4.73 0.00 2.86 2.94 0.00 0.00 6.05 7.00 0.00 0.00 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 8.37 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.63 4.58 0.00 3.14 3.08 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 31 Q 6.92 4.84 0.00 1.17 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.46 0.00 0.00 0.00 0.00 0.00 1.78 1.83 0.00 32 M 8.59 4.67 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.51 0.00 33 K 8.35 4.77 0.00 1.67 1.60 0.00 1.82 0.00 0.00 1.67 0.00 0.00 2.73 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.34 7.81 34 G 8.62 4.21 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 0.00 0.00 0.00 35 V 7.86 5.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.91 0.00 0.00 36 I 8.38 3.95 1.93 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.66 0.98 0.00 0.00 37 E 9.13 4.17 0.00 2.13 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 0.00 2.34 2.32 0.00 38 E 7.74 4.79 0.00 2.08 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 0.00 2.27 2.31 0.00 39 Y 7.65 5.11 0.00 3.19 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 40 D 8.51 4.41 0.00 2.69 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 41 K 8.66 3.96 0.00 0.87 1.31 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.74 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.25 1.17 7.81 42 Y 9.03 4.88 0.00 2.99 3.12 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 0.00 43 V 7.99 4.74 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 0.21 0.00 0.00 0.99 0.00 0.00 44 V 8.52 4.84 2.19 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 1.04 0.00 0.00 1.08 0.00 0.00 45 S 9.26 5.07 0.00 3.95 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 46 L 9.23 5.21 0.00 1.79 1.57 0.91 0.52 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 47 N 8.72 5.21 0.00 3.00 2.74 0.00 0.00 5.97 6.84 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 48 S 8.96 4.71 0.00 3.93 3.80 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 0.00 0.00 0.00 0.00 49 Q 9.86 3.43 0.00 2.36 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.37 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 50 G 8.55 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 K 7.67 4.32 0.00 1.80 1.64 0.00 1.53 0.00 0.00 1.88 0.00 0.00 3.11 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.45 7.81 52 Q 8.21 5.07 0.00 1.85 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.68 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 53 H 9.19 4.89 0.00 3.11 3.24 0.00 5.60 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 8.71 4.88 0.00 1.61 1.57 0.87 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.68 4.64 1.95 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.80 1.11 0.00 0.00 56 Y 8.60 4.46 0.00 2.88 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.36 4.12 0.00 1.97 1.99 0.00 1.95 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.61 1.70 7.81 58 H 8.34 4.34 0.00 3.24 3.51 0.00 5.53 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.25 4.59 1.56 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 60 I 7.23 4.13 1.72 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.67 0.33 0.00 0.00 61 S 9.11 4.63 0.00 3.80 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 62 T 7.49 4.74 4.21 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 1.20 0.00 0.00 63 Y 8.60 5.18 0.00 2.84 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.70 4.81 4.39 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 1.28 0.00 0.00 65 V 8.35 3.92 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 0.85 0.00 0.00 0.99 0.00 0.00