NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 D 5.0029 8.3493 120.4666 53.4062 40.9312 174.3382 7 E 4.5868 8.8069 119.6251 52.8919 32.5854 173.1571 8 S 5.2380 8.8172 116.4550 56.7022 66.5610 173.9863 9 F 5.4092 9.3566 120.8618 55.7051 43.8036 173.5581 10 L 5.1952 9.0380 119.8750 53.2334 45.1289 174.9831 11 C 5.4320 9.4149 121.2117 55.3943 44.4795 172.4945 12 Y 4.8876 9.0727 122.5257 57.0554 38.9894 175.0222 13 Q 5.0194 8.8709 122.2049 53.2375 32.5311 175.0439 14 P 4.2536 0.0000 0.0000 65.2189 31.3710 177.3818 15 D 5.0883 7.7890 113.6654 52.4128 40.1979 174.6342 16 Q 4.2276 7.4201 116.7565 55.7994 31.6044 172.4802 17 V 4.6857 8.1785 118.4519 61.1593 34.3631 173.4697 18 C 5.6137 9.1965 125.0637 55.2684 39.3781 170.6542 19 C 5.4737 9.0177 117.4607 53.9001 44.8976 172.5914 20 F 4.8302 9.1336 118.6074 55.7942 42.6944 173.8778 21 I 4.8279 8.7840 124.7400 59.9736 39.3569 174.0547 22 C 5.8081 9.7064 124.5704 55.1463 39.0527 173.6321 23 R 4.6143 9.1837 119.5258 54.9360 32.9179 176.2491 24 G 4.0149 9.8234 112.2175 45.8619 0.0000 172.0683 25 A 4.5590 7.7470 119.8289 51.2221 22.0239 175.9036 26 A 4.2766 8.0176 120.8423 49.4521 22.2551 174.5025 27 P 3.9189 0.0000 0.0000 62.5503 31.9008 176.9540 28 L 4.2278 8.4600 121.5889 53.7785 42.3180 176.7059 29 P 4.2138 0.0000 0.0000 65.5543 31.3942 178.8123 30 S 4.3015 7.9369 111.1334 60.2729 63.0623 174.5549 31 E 4.2794 8.1201 120.1311 56.7055 29.9877 176.6679 32 G 3.8447 7.6776 104.3160 43.9646 0.0000 173.8819 33 E 4.4428 8.9244 124.5602 55.6273 30.2339 175.6001 34 C 6.1300 8.6050 123.9769 54.5283 44.2111 173.4203 35 N 5.3733 8.6624 118.5238 50.9544 43.1223 172.0951 36 P 4.4562 0.0000 0.0000 63.5846 32.1689 175.4173 37 H 4.6601 8.8730 120.6842 54.4074 33.2447 171.8495 38 P 4.2350 0.0000 0.0000 63.1200 31.4508 175.9661 39 T 3.8149 8.1096 109.6374 61.4293 69.8561 173.9981 40 A 4.4848 7.5261 126.1654 50.0015 21.5187 176.2140 41 P 4.1777 0.0000 0.0000 65.7671 31.1796 179.0816 42 W 4.2838 8.1886 114.6805 59.6986 27.8015 178.6009 43 C 3.6940 6.7128 118.8314 59.3608 42.7771 175.7067 44 R 3.6799 7.5395 117.5945 59.3159 29.6980 178.4532 45 E 4.1675 7.9522 117.1327 58.9244 29.5623 178.8496 46 G 3.9523 7.7282 103.6169 44.7676 0.0000 174.3403 47 A 4.2805 7.6407 125.3729 50.7119 17.1594 176.5632 48 V 4.0306 7.5357 113.7049 60.9507 33.9626 176.2764 49 E 4.6968 7.6404 118.8897 54.2217 32.0249 175.2465 50 W 4.7837 8.7753 123.8798 56.2025 30.0344 176.1449 51 V 4.6976 8.7496 117.9698 58.4978 35.2711 173.5442 52 P 4.8046 0.0000 0.0000 63.2374 31.9350 175.4099 53 Y 4.5222 8.8908 125.5822 56.7525 42.4704 174.8853 54 S 3.5341 7.8326 122.8673 59.9951 62.3801 173.3661 55 T 4.4775 8.8270 106.9650 61.9003 69.9426 174.1882 56 G 4.2106 8.3059 114.3134 45.6794 0.0000 173.3425 57 Q 5.4328 9.5503 122.6763 54.5535 33.4291 172.9338 58 C 5.5572 9.6460 119.1330 55.5627 44.4465 173.0218 59 R 5.1137 8.3092 120.5493 54.2079 31.9985 175.3322 60 T 4.6754 7.8175 115.8028 61.0228 70.6212 172.3410 61 T 4.6689 7.8941 119.7620 61.2385 71.0703 172.6662 62 C 5.7504 8.6528 122.0397 55.2501 41.4342 173.2732 63 I 4.6637 8.1172 113.4251 58.3128 40.7824 173.2866 64 P 4.5135 0.0000 0.0000 62.1337 32.1275 175.6532 65 Y 4.0479 8.3219 117.2619 58.3208 38.2633 176.9874 66 V 4.0020 8.3412 116.8129 61.4985 32.1228 175.5248 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 D 8.35 5.00 0.00 2.98 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 7 E 8.81 4.59 0.00 1.68 1.98 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 2.33 2.47 0.00 8 S 8.82 5.24 0.00 3.76 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 F 9.36 5.41 0.00 2.97 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 10 L 9.04 5.20 0.00 1.51 1.27 0.74 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 11 C 9.41 5.43 0.00 3.03 3.20 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 12 Y 9.07 4.89 0.00 3.00 3.07 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 0.00 0.00 0.00 0.00 13 Q 8.87 5.02 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 14 P 0.00 4.25 0.00 2.10 2.16 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 15 D 7.79 5.09 0.00 2.79 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.42 4.23 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.79 0.00 0.00 0.00 0.00 0.00 2.16 2.16 0.00 17 V 8.18 4.69 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.38 0.00 0.00 18 C 9.20 5.61 0.00 2.96 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 C 9.02 5.47 0.00 2.89 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 20 F 9.13 4.83 0.00 3.00 2.82 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 0.00 0.00 0.00 21 I 8.78 4.83 1.56 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.78 0.89 0.00 0.00 22 C 9.71 5.81 0.00 3.12 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 23 R 9.18 4.61 0.00 1.72 1.81 0.00 2.72 0.00 0.00 3.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 24 G 9.82 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 25 A 7.75 4.56 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.02 4.28 0.93 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 0.00 0.00 27 P 0.00 3.92 0.00 1.55 0.79 0.00 2.44 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.04 0.00 28 L 8.46 4.23 0.00 1.74 1.53 0.80 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.21 0.00 2.16 2.09 0.00 3.55 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.05 0.00 30 S 7.94 4.30 0.00 3.99 3.99 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 31 E 8.12 4.28 0.00 1.92 2.10 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 2.49 2.08 0.00 32 G 7.68 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 E 8.92 4.44 0.00 2.20 2.10 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 2.39 2.36 0.00 34 C 8.60 6.13 0.00 2.81 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 35 N 8.66 5.37 0.00 2.72 2.75 0.00 0.00 7.14 8.03 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 36 P 0.00 4.46 0.00 1.86 1.68 0.00 3.80 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.20 0.00 37 H 8.87 4.66 0.00 3.11 3.10 0.00 5.78 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 P 0.00 4.23 0.00 2.10 1.96 0.00 3.39 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 39 T 8.11 3.81 3.99 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 1.06 0.00 0.00 40 A 7.53 4.48 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.18 0.00 2.23 2.14 0.00 3.63 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.15 0.00 42 W 8.19 4.28 0.00 3.55 3.30 0.00 0.00 0.00 0.00 0.00 0.00 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 C 6.71 3.69 0.00 1.50 2.63 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 44 R 7.54 3.68 0.00 1.72 1.89 0.00 3.18 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 45 E 7.95 4.17 0.00 2.12 2.02 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 2.34 2.56 0.00 46 G 7.73 3.95 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 0.00 0.00 0.00 47 A 7.64 4.28 1.04 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 0.00 0.00 48 V 7.54 4.03 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 0.73 0.00 0.00 0.88 0.00 0.00 49 E 7.64 4.70 0.00 1.83 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 50 W 8.78 4.78 0.00 3.20 3.32 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.75 4.70 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 0.77 0.00 0.00 1.09 0.00 0.00 52 P 0.00 4.80 0.00 1.99 2.07 0.00 3.71 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 53 Y 8.89 4.52 0.00 3.10 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 54 S 7.83 3.53 0.00 3.76 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 55 T 8.83 4.48 4.26 0.00 0.00 0.00 0.00 0.00 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 56 G 8.31 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 57 Q 9.55 5.43 0.00 2.11 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.67 0.00 0.00 0.00 0.00 0.00 2.60 2.41 0.00 58 C 9.65 5.56 0.00 2.74 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 R 8.31 5.11 0.00 1.17 1.37 0.00 2.90 0.00 0.00 2.57 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.50 0.00 60 T 7.82 4.68 3.34 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 0.97 0.00 0.00 61 T 7.89 4.67 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 1.30 0.00 0.00 62 C 8.65 5.75 0.00 2.76 2.90 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 63 I 8.12 4.66 1.33 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.24 0.25 0.00 0.00 64 P 0.00 4.51 0.00 2.15 2.04 0.00 3.53 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.90 0.00 65 Y 8.32 4.05 0.00 2.95 2.92 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 0.00 0.00 0.00 66 V 8.34 4.00 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 0.61 0.00 0.00 0.86 0.00 0.00