NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 T 3.9200 8.1593 115.2198 62.4963 68.3500 173.8864 7 V 4.0627 6.6394 117.6043 61.6804 33.0581 173.4989 8 F 4.8265 7.3907 120.8215 57.5840 40.6193 176.2859 9 S 4.7605 8.9901 117.1102 57.2853 65.8589 175.0016 10 Q 3.9616 8.6293 121.2194 59.2436 28.3596 179.4587 11 A 3.9380 7.8660 121.0587 55.2324 18.5719 179.4249 12 Q 3.7900 7.7961 116.1089 59.2497 28.7144 179.3381 13 L 3.7462 8.1972 120.1204 57.7229 41.5597 179.3249 14 C 4.0636 8.2289 116.7139 62.4859 28.0477 176.0257 15 A 3.8540 7.8051 122.3341 55.0549 17.9432 179.4345 16 L 3.5307 7.3068 117.3825 57.8761 41.4985 180.1223 17 K 4.0918 7.8395 118.2763 59.5870 31.8298 179.0354 18 D 4.3471 8.2558 117.3024 56.8647 41.2106 177.9963 19 R 4.1227 7.7623 119.1155 59.2425 29.8965 177.9100 20 F 4.4400 8.4227 122.0401 60.9132 39.0490 176.9242 21 Q 3.9222 8.1651 116.8288 58.4064 28.5703 178.3165 22 K 4.4935 7.9149 117.3445 55.9163 33.0884 176.8489 23 Q 4.4256 7.1754 116.6214 55.0969 32.8280 175.2678 24 K 3.3469 8.7055 123.4964 57.8920 32.6524 176.9392 25 Y 4.7308 7.9352 115.4534 55.9125 40.0644 174.7593 26 L 4.7514 8.1465 124.0212 52.3649 44.4932 176.6805 27 S 4.3537 8.4515 116.8209 57.9697 64.0308 175.1092 28 L 4.1188 8.8526 122.7892 58.5164 41.3812 180.0036 29 Q 4.8484 7.9712 117.6846 58.5826 28.7314 178.2175 30 Q 4.0328 8.1635 120.4912 58.9925 28.7345 178.2113 31 M 4.0229 7.9729 119.3217 57.9982 32.0588 178.4494 32 Q 4.2002 8.1544 118.3129 59.1320 29.1306 178.7297 33 E 4.0193 8.2332 118.3901 59.1826 29.4723 178.9973 34 L 3.9384 7.7875 121.3082 58.0095 42.2613 179.0063 35 S 4.1459 8.2342 114.0238 61.1747 62.9464 176.4809 36 S 4.0650 8.0714 119.2516 61.7247 62.4060 176.5105 37 I 3.7001 7.3856 120.8118 64.4633 36.9768 177.8579 38 L 3.9627 7.8134 118.1992 55.1732 41.9488 176.1350 39 N 4.1098 7.6461 115.7803 55.0051 37.4357 172.7105 40 L 4.8421 7.6020 115.7093 52.1591 45.4662 177.5489 41 S 4.5019 9.6036 116.1738 58.1902 65.1327 174.7469 42 Y 3.9757 8.5329 122.9422 60.5235 38.5227 178.0147 43 K 3.9704 8.1753 120.1203 59.6724 32.3592 178.2956 44 Q 4.1939 8.4728 118.6938 59.2606 28.6936 179.5735 45 V 3.6148 7.4907 118.8403 65.8909 31.7392 177.6993 46 K 3.7424 7.7622 119.3520 59.9416 31.8190 178.8416 47 T 3.9132 8.1544 115.7261 66.3738 68.4150 176.3715 48 W 4.1509 8.5982 130.6200 60.8578 30.6735 177.9870 49 F 3.7600 8.9058 117.5687 60.3263 38.3443 177.5499 50 Q 3.9207 8.1191 118.8458 59.3587 28.7352 177.9312 51 N 4.2186 8.4680 116.6734 56.2093 38.8127 176.8743 52 Q 3.5024 7.3717 120.9233 58.9644 29.0404 178.3194 53 R 4.2865 7.7829 119.6742 59.8444 29.8884 178.2802 54 M 4.2875 7.9540 117.2341 57.6777 31.9330 178.4567 55 K 4.1432 7.8684 118.6250 57.5997 32.6734 177.1225 56 C 4.5241 7.2956 115.6674 57.1889 31.3547 174.5846 57 K 3.8757 8.8230 124.7693 60.1507 31.8644 178.5132 58 R 4.1714 7.6641 112.8998 56.7164 29.5778 176.6046 59 W 4.9717 7.7927 118.0954 56.9176 29.5252 176.3146 60 Q 4.5535 8.0817 123.6314 56.1030 28.4634 175.3175 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 T 8.16 3.92 3.91 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 1.26 0.00 0.00 7 V 6.64 4.06 1.91 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 0.59 0.00 0.00 0.87 0.00 0.00 8 F 7.39 4.83 0.00 3.02 2.98 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 0.00 0.00 0.00 9 S 8.99 4.76 0.00 4.04 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.63 3.96 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.96 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 11 A 7.87 3.94 1.28 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 0.00 0.00 12 Q 7.80 3.79 0.00 2.32 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.75 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 13 L 8.20 3.75 0.00 1.65 1.68 0.99 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 14 C 8.23 4.06 0.00 3.08 2.94 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 0.00 0.00 0.00 15 A 7.81 3.85 1.28 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 0.00 0.00 16 L 7.31 3.53 0.00 0.81 0.13 -0.21 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.84 4.09 0.00 1.83 1.91 0.00 1.72 0.00 0.00 1.67 0.00 0.00 3.06 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.71 1.64 7.81 18 D 8.26 4.35 0.00 2.69 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 19 R 7.76 4.12 0.00 2.12 2.24 0.00 3.27 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.97 0.00 20 F 8.42 4.44 0.00 3.16 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 21 Q 8.17 3.92 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.56 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 22 K 7.91 4.49 0.00 1.70 1.84 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.25 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.66 7.81 23 Q 7.18 4.43 0.00 2.19 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 24 K 8.71 3.35 0.00 1.68 1.48 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.15 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.11 1.20 7.81 25 Y 7.94 4.73 0.00 2.96 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 L 8.15 4.75 0.00 1.08 1.32 0.83 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 27 S 8.45 4.35 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.85 4.12 0.00 1.74 1.86 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 7.97 4.85 0.00 2.28 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.31 0.00 30 Q 8.16 4.03 0.00 2.28 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.85 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 31 M 7.97 4.02 0.00 1.72 2.06 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.17 0.00 32 Q 8.15 4.20 0.00 2.36 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 33 E 8.23 4.02 0.00 2.25 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 2.29 2.53 0.00 34 L 7.79 3.94 0.00 1.90 1.82 0.87 1.10 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 35 S 8.23 4.15 0.00 4.28 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 36 S 8.07 4.06 0.00 4.04 3.94 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 0.00 0.00 0.00 37 I 7.39 3.70 1.83 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 1.58 0.71 0.88 0.00 0.00 38 L 7.81 3.96 0.00 1.68 1.55 0.81 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 39 N 7.65 4.11 0.00 2.84 2.83 0.00 0.00 6.95 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 40 L 7.60 4.84 0.00 1.51 1.57 0.11 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 41 S 9.60 4.50 0.00 4.08 4.10 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 42 Y 8.53 3.98 0.00 3.05 3.04 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 43 K 8.18 3.97 0.00 2.02 1.87 0.00 1.81 0.00 0.00 1.90 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.58 1.67 7.81 44 Q 8.47 4.19 0.00 2.35 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.59 0.00 0.00 0.00 0.00 0.00 2.64 2.53 0.00 45 V 7.49 3.61 1.91 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 0.96 0.00 0.00 0.82 0.00 0.00 46 K 7.76 3.74 0.00 1.51 1.86 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.45 7.81 47 T 8.15 3.91 4.55 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 1.31 0.00 0.00 48 W 8.60 4.15 0.00 3.68 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.91 3.76 0.00 3.28 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.12 3.92 0.00 2.32 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 51 N 8.47 4.22 0.00 2.42 2.67 0.00 0.00 7.06 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 7.37 3.50 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 53 R 7.78 4.29 0.00 2.18 1.93 0.00 2.21 0.00 0.00 2.89 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 54 M 7.95 4.29 0.00 2.02 2.20 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.85 0.00 55 K 7.87 4.14 0.00 2.00 1.83 0.00 1.50 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.59 7.81 56 C 7.30 4.52 0.00 1.71 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 0.00 0.00 0.00 57 K 8.82 3.88 0.00 1.85 2.05 0.00 1.37 0.00 0.00 1.63 0.00 0.00 2.74 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.34 7.81 58 R 7.66 4.17 0.00 1.96 2.03 0.00 2.88 0.00 0.00 3.19 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.41 0.00 59 W 7.79 4.97 0.00 3.64 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 60 Q 8.08 4.55 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.55 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00