NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9299 8.3393 109.7369 45.7147 0.0000 173.3835 2 S 4.1445 8.6377 117.9430 57.9183 64.0301 174.5495 3 S 3.6657 7.9467 114.8337 58.3262 62.7614 173.3100 4 G 4.1400 8.0058 107.9710 44.9173 0.0000 173.6633 5 S 4.5751 8.1798 120.4737 57.3190 66.8688 173.4377 6 S 4.5050 7.8966 117.6820 57.8189 65.1343 174.2656 7 G 3.4047 7.6623 113.7575 45.1038 0.0000 172.1061 8 N 4.9633 7.4677 116.6560 51.8118 42.6333 174.5405 9 L 4.8118 8.4489 122.2936 53.1599 45.2676 175.8255 10 S 4.5490 8.4239 117.6058 57.3545 67.0844 173.0480 11 E 4.4965 8.4861 121.3524 54.8593 29.9955 174.2402 12 L 4.5904 8.1164 124.6345 52.9016 46.1207 175.6530 13 T 3.8573 8.6297 109.2150 62.0712 67.9931 172.7715 14 P 4.6480 0.0000 0.0000 63.8789 31.4989 177.6323 15 Y 3.6868 8.2475 117.5050 60.8727 38.2116 176.7834 16 I 3.7647 7.4864 120.4080 64.3809 37.3799 176.4093 17 L 4.8513 7.0294 117.6418 54.5032 42.1829 175.7511 18 C 4.5299 8.1504 119.9291 57.5248 33.0427 175.0914 19 S 4.1279 8.3872 122.6474 60.9709 62.4419 174.7754 20 I 4.2411 7.3921 119.6498 63.3013 37.9055 176.8449 21 C 4.1686 7.9417 117.5440 60.9757 28.3076 175.1803 22 K 4.2520 8.4684 117.2119 56.9238 30.9131 175.1126 23 G 3.8420 7.0033 114.6210 45.3702 0.0000 175.7161 24 Y 4.9332 8.3652 122.9830 56.7956 38.9939 174.1434 25 L 4.7610 8.2650 120.9766 53.6620 43.9632 175.4581 26 I 4.3686 8.0242 116.6740 63.1208 39.6397 176.9049 27 D 4.3270 8.1966 118.1120 55.5785 41.8076 176.3018 28 A 3.5351 7.9490 118.1732 53.2623 15.1995 178.3342 29 T 4.2819 7.7034 118.6302 64.2873 69.7174 175.5133 30 T 5.1093 8.4321 123.7115 62.2591 70.2307 175.0982 31 I 4.0779 8.7388 126.8340 61.5024 38.4581 176.6628 32 T 4.2345 8.0786 121.4115 63.6162 68.3155 174.6998 33 E 4.4093 7.6289 121.1078 56.9235 31.6820 176.5415 34 C 4.3704 7.8751 113.3330 57.2614 31.1509 173.1200 35 L 4.3717 7.5903 118.5152 55.9283 38.5572 173.4982 36 H 5.1964 7.6998 114.6105 54.3809 32.6308 175.2206 37 T 4.6477 8.2312 118.0844 62.8387 69.2866 174.4615 38 F 4.8594 8.9860 124.1096 56.0494 44.2358 173.9619 39 C 4.2305 9.1486 121.1087 59.8145 28.9067 174.1752 40 K 3.9169 9.0690 126.0264 60.1590 32.1294 178.6386 41 S 4.2711 8.2598 114.1387 62.0977 62.6692 175.9399 42 C 4.1924 8.0698 119.0799 62.7884 28.0318 175.5873 43 I 3.3171 8.5605 120.2428 64.2015 37.4595 178.4872 44 V 3.6614 8.0657 118.5954 65.9153 31.6479 177.7537 45 R 4.3322 8.5850 118.9249 59.8194 29.9324 178.0235 46 H 4.2566 8.7083 118.4253 59.0339 29.5762 176.8864 47 F 5.3043 7.7041 119.3643 59.2275 38.8361 176.8816 48 Y 4.3552 7.6910 116.5064 60.5339 37.7386 176.1211 49 Y 4.4712 7.8617 115.5443 59.2073 39.2829 176.1082 50 S 4.7767 8.4212 115.9934 56.8572 65.9572 173.8392 51 N 4.9967 8.7755 123.1317 54.3575 39.1107 174.5553 52 R 5.0809 8.0403 116.3617 54.5381 34.8771 174.1640 53 C 4.1358 8.5094 120.6075 57.2265 32.6880 172.5031 54 P 4.5023 0.0000 0.0000 63.4263 30.3486 175.7778 55 K 4.4280 7.4146 117.2314 57.6825 34.3499 176.4478 56 C 4.3559 7.9395 113.8188 57.9879 30.9517 172.7437 57 N 4.3629 8.1914 116.8335 54.4050 35.4280 173.9711 58 I 4.5429 7.3450 111.1236 58.9887 40.6614 176.5146 59 V 5.1931 8.4084 125.6529 60.9590 30.0653 174.1551 60 V 4.1827 8.5965 126.8662 62.7221 31.6722 176.1241 61 H 4.7154 7.8065 129.6568 54.9169 27.7392 174.4013 62 Q 4.3306 7.3431 119.5709 58.4943 30.6643 177.6947 63 T 3.8131 7.2417 106.9610 63.4305 68.5502 173.6321 64 Q 4.4337 7.1754 116.5808 53.6938 30.8583 172.8190 65 P 4.4787 0.0000 0.0000 63.7230 31.7175 175.5832 66 L 4.6902 7.0463 120.1511 53.2296 44.0864 176.0871 67 S 4.0880 8.7394 120.6039 60.8770 62.6802 175.4154 68 G 4.1119 8.0718 103.6950 44.9615 0.0000 172.1147 69 P 4.5728 0.0000 0.0000 62.3394 32.6748 175.6911 70 S 4.5288 8.2456 110.3983 58.6557 63.4689 174.3584 71 S 4.3564 7.9802 116.6426 58.0558 62.4199 173.6144 72 G 3.7181 8.5996 116.0673 45.9097 0.0000 172.4909 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 G 8.34 3.93 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 0.00 2 S 8.64 4.14 0.00 4.07 3.97 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 3 S 7.95 3.67 0.00 4.09 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 4 G 8.01 4.14 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 0.00 0.00 0.00 5 S 8.18 4.58 0.00 3.82 3.74 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 0.00 0.00 0.00 0.00 6 S 7.90 4.50 0.00 3.94 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.66 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.47 4.96 0.00 2.68 2.68 0.00 0.00 6.97 7.83 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 9 L 8.45 4.81 0.00 1.56 1.53 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.42 4.55 0.00 3.81 3.74 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 0.00 0.00 0.00 0.00 11 E 8.49 4.50 0.00 1.86 1.84 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 2.18 2.35 0.00 12 L 8.12 4.59 0.00 1.64 1.54 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 13 T 8.63 3.86 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 1.15 0.00 0.00 14 P 0.00 4.65 0.00 2.24 2.36 0.00 3.88 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.07 0.00 15 Y 8.25 3.69 0.00 2.87 3.06 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 0.00 0.00 0.00 0.00 16 I 7.49 3.76 1.95 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.70 0.99 0.00 0.00 17 L 7.03 4.85 0.00 1.43 1.54 0.85 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 18 C 8.15 4.53 0.00 2.91 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 S 8.39 4.13 0.00 4.02 4.07 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 20 I 7.39 4.24 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.80 0.96 0.00 0.00 21 C 7.94 4.17 0.00 3.00 2.99 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 22 K 8.47 4.25 0.00 1.84 1.84 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.50 1.48 7.81 23 G 7.00 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 24 Y 8.37 4.93 0.00 3.01 2.80 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 25 L 8.26 4.76 0.00 1.66 1.62 0.96 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 26 I 8.02 4.37 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.53 0.94 0.00 0.00 27 D 8.20 4.33 0.00 2.65 2.78 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 28 A 7.95 3.54 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.70 4.28 4.53 0.00 0.00 0.00 0.00 0.00 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 30 T 8.43 5.11 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 1.30 0.00 0.00 31 I 8.74 4.08 1.97 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.00 1.02 0.00 0.00 32 T 8.08 4.23 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 33 E 7.63 4.41 0.00 1.97 1.84 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 2.28 2.25 0.00 34 C 7.88 4.37 0.00 2.85 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.59 4.37 0.00 1.77 1.75 0.96 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 36 H 7.70 5.20 0.00 3.33 3.26 0.00 5.62 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 37 T 8.23 4.65 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 1.18 0.00 0.00 38 F 8.99 4.86 0.00 2.97 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 39 C 9.15 4.23 0.00 3.07 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 40 K 9.07 3.92 0.00 2.12 1.90 0.00 1.66 0.00 0.00 2.01 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.62 7.81 41 S 8.26 4.27 0.00 3.97 3.97 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 42 C 8.07 4.19 0.00 3.27 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 I 8.56 3.32 1.91 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.18 1.10 0.00 0.00 44 V 8.07 3.66 2.23 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 0.73 0.00 0.00 0.95 0.00 0.00 45 R 8.58 4.33 0.00 2.13 2.17 0.00 3.49 0.00 0.00 3.58 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.96 0.00 46 H 8.71 4.26 0.00 3.12 3.05 0.00 5.83 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 F 7.70 5.30 0.00 3.19 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.69 4.36 0.00 3.02 2.38 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.86 4.47 0.00 2.94 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 50 S 8.42 4.78 0.00 3.60 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 51 N 8.78 5.00 0.00 2.73 2.89 0.00 0.00 6.94 7.70 0.00 0.00 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 R 8.04 5.08 0.00 1.70 1.84 0.00 3.38 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 53 C 8.51 4.14 0.00 2.98 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 54 P 0.00 4.50 0.00 2.03 1.82 0.00 2.87 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.11 0.00 55 K 7.41 4.43 0.00 2.04 1.84 0.00 1.50 0.00 0.00 1.49 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.35 1.24 7.81 56 C 7.94 4.36 0.00 3.17 3.16 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 57 N 8.19 4.36 0.00 2.91 3.02 0.00 0.00 6.83 7.15 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 58 I 7.35 4.54 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.86 0.94 0.00 0.00 59 V 8.41 5.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 1.05 0.00 0.00 60 V 8.60 4.18 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.10 0.00 0.00 61 H 7.81 4.72 0.00 3.25 3.32 0.00 5.55 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Q 7.34 4.33 0.00 1.91 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.97 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 63 T 7.24 3.81 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 0.84 0.00 0.00 64 Q 7.18 4.43 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.86 0.00 0.00 0.00 0.00 0.00 2.36 2.17 0.00 65 P 0.00 4.48 0.00 2.18 2.19 0.00 3.69 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 1.96 1.92 0.00 66 L 7.05 4.69 0.00 1.61 1.55 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 67 S 8.74 4.09 0.00 3.88 3.88 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 68 G 8.07 4.11 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 0.00 0.00 0.00 69 P 0.00 4.57 0.00 2.18 2.12 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 70 S 8.25 4.53 0.00 3.95 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 71 S 7.98 4.36 0.00 3.84 3.82 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 72 G 8.60 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00