NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3444 8.2644 123.5841 52.5704 19.9101 177.2041 3 R 4.2650 7.8686 122.0501 57.5801 32.6569 175.8177 4 K 3.8344 8.4693 120.2409 59.4826 33.5274 178.0811 5 A 4.1344 8.0574 120.0800 54.3988 18.1108 178.5194 6 L 4.4253 7.5078 116.6839 56.0262 41.6765 178.8436 7 I 3.8105 8.1409 114.0817 63.4304 37.7608 177.5019 8 E 3.9622 8.0416 118.9831 57.6119 29.6339 178.0026 9 K 4.0572 7.4904 117.5956 58.5870 32.2594 178.2745 10 A 3.8717 7.4173 120.5891 54.7285 18.7747 179.1629 11 K 4.0518 7.2742 115.4883 58.3666 32.2508 177.3378 12 R 3.8363 7.2377 119.7338 57.4942 29.3377 177.1738 13 T 4.6404 8.2116 122.2423 62.5198 69.2683 175.1098 14 P 4.3315 0.0000 0.0000 64.7114 31.8320 176.3280 15 K 4.2687 7.0353 114.7664 54.5409 34.0665 175.4577 16 F 3.9450 7.5736 118.4859 56.1158 39.8490 177.0967 17 K 4.2869 8.6635 121.8883 58.1048 32.6764 178.1069 18 V 3.8218 7.8147 119.9252 65.8044 31.6815 176.6779 19 R 4.3498 8.1253 116.0043 56.7412 30.2180 177.2411 20 A 4.2903 7.6596 122.6789 50.9816 17.4131 176.7518 21 Y 4.5623 7.5278 119.8610 55.9451 40.7454 175.5961 22 T 4.4675 8.2223 110.1116 60.9813 70.9562 173.3666 23 R 4.6766 7.8015 118.4053 55.2681 32.6773 173.7858 24 C 4.4878 9.0046 125.5815 59.5803 32.1906 173.8316 25 V 3.7920 8.3218 126.5146 66.1309 31.5820 177.8747 26 R 4.0971 8.1292 117.6230 58.4451 30.2068 176.8291 27 C 4.8631 7.7447 110.7735 55.9586 32.2110 175.2250 28 G 3.9376 8.5410 112.2358 45.4660 0.0000 172.0278 29 R 4.5372 7.7060 120.3635 54.7042 32.5869 176.2472 30 A 4.2846 8.7232 128.1448 54.3833 19.2726 177.7551 31 R 4.3101 7.8290 113.2763 55.4174 32.0918 175.8324 32 S 3.4817 8.2497 111.4089 59.2919 61.7516 172.8988 33 V 4.5323 7.3821 118.1896 62.2835 32.5076 174.3948 34 Y 4.3436 8.7638 126.3932 57.5833 38.4294 177.4526 35 R 4.0733 8.7423 123.6604 59.0735 30.5629 178.0823 36 F 4.3400 8.3520 119.4593 61.2270 39.7319 176.3547 37 F 3.9015 8.3436 118.2060 58.4681 39.2787 177.0964 38 G 3.9942 8.6204 107.1456 45.3778 0.0000 172.5710 39 L 5.0344 7.6789 119.0104 52.7477 44.5248 176.1403 40 C 5.7864 8.4330 117.9097 56.7655 32.9164 174.4237 41 R 3.9869 8.2614 116.3672 59.4510 28.9715 178.9866 42 I 3.7020 7.6667 120.0764 64.4083 37.2300 177.9068 43 C 4.1995 8.0051 116.9021 62.7785 28.0863 175.4247 44 L 3.5040 7.9362 122.3155 58.5091 41.5163 179.2548 45 R 3.8294 7.6727 118.1153 59.0329 30.0793 178.3295 46 E 3.9772 7.9256 118.4372 59.4856 29.4796 179.3129 47 L 4.0344 8.2784 119.1626 57.4447 41.4288 179.4333 48 A 3.9274 7.6734 120.2427 55.3821 18.4068 179.0022 49 H 4.2771 8.0213 113.7701 58.8405 28.7750 178.0292 50 K 4.1536 7.6293 119.2428 59.9377 32.3575 178.4662 51 G 4.0912 8.6012 105.7924 45.4647 0.0000 175.3279 52 Q 4.2553 7.9813 114.8938 56.3967 28.1105 175.6351 53 L 4.6613 7.7364 118.9953 52.0046 43.3852 174.6751 54 P 4.1205 0.0000 0.0000 64.0867 31.4676 178.0888 55 G 4.0401 9.0115 111.7929 45.8909 0.0000 173.6691 56 V 3.7133 7.6827 119.9141 63.1451 31.7120 175.1170 57 R 4.6431 8.2151 126.0613 53.7584 33.2947 174.2191 58 K 3.9173 8.6589 123.7956 56.1819 32.4457 176.5853 59 A 4.2733 8.5269 129.7935 52.7618 18.8536 177.6724 60 S 4.5051 8.4707 118.5146 57.1095 64.7354 174.3793 61 W 4.7718 7.9351 121.0722 56.4138 28.0657 175.6543 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 2 A 8.26 4.34 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 3 R 7.87 4.26 0.00 1.91 1.89 0.00 3.20 0.00 0.00 3.32 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 4 K 8.47 3.83 0.00 1.92 1.79 0.00 1.68 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.57 7.81 5 A 8.06 4.13 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 6 L 7.51 4.43 0.00 1.81 1.80 0.99 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.14 3.81 1.88 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 1.87 0.83 1.05 0.00 0.00 8 E 8.04 3.96 0.00 2.03 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 2.35 2.35 0.00 9 K 7.49 4.06 0.00 2.09 2.05 0.00 1.83 0.00 0.00 1.78 0.00 0.00 3.16 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.49 7.81 10 A 7.42 3.87 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.27 4.05 0.00 1.52 1.83 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.64 7.81 12 R 7.24 3.84 0.00 1.86 1.93 0.00 3.12 0.00 0.00 3.36 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 13 T 8.21 4.64 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 1.19 0.00 0.00 14 P 0.00 4.33 0.00 2.13 2.15 0.00 3.86 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 15 K 7.04 4.27 0.00 1.80 1.89 0.00 1.73 0.00 0.00 1.44 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.59 7.81 16 F 7.57 3.95 0.00 3.08 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 17 K 8.66 4.29 0.00 1.90 1.96 0.00 1.60 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.48 7.81 18 V 7.81 3.82 2.12 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 0.83 0.00 0.00 0.97 0.00 0.00 19 R 8.13 4.35 0.00 2.11 2.10 0.00 3.46 0.00 0.00 3.37 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 20 A 7.66 4.29 1.24 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 0.00 0.00 0.00 21 Y 7.53 4.56 0.00 3.13 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 22 T 8.22 4.47 4.31 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 1.26 0.00 0.00 23 R 7.80 4.68 0.00 1.74 1.78 0.00 3.38 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.69 0.00 24 C 9.00 4.49 0.00 3.06 3.21 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 25 V 8.32 3.79 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 0.82 0.00 0.00 1.03 0.00 0.00 26 R 8.13 4.10 0.00 1.85 1.98 0.00 3.20 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 27 C 7.74 4.86 0.00 3.05 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.54 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 0.00 0.00 0.00 29 R 7.71 4.54 0.00 1.86 1.82 0.00 3.20 0.00 0.00 3.38 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.62 0.00 30 A 8.72 4.28 1.32 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 0.00 0.00 31 R 7.83 4.31 0.00 1.82 1.88 0.00 3.35 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 32 S 8.25 3.48 0.00 4.16 4.09 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.38 4.53 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 0.93 0.00 0.00 1.08 0.00 0.00 34 Y 8.76 4.34 0.00 3.29 3.17 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 0.00 0.00 0.00 0.00 35 R 8.74 4.07 0.00 1.90 2.06 0.00 3.23 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 36 F 8.35 4.34 0.00 2.89 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 37 F 8.34 3.90 0.00 3.10 3.02 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 0.00 0.00 0.00 38 G 8.62 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 0.00 0.00 0.00 39 L 7.68 5.03 0.00 1.64 1.53 0.84 0.87 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 40 C 8.43 5.79 0.00 3.32 3.17 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 0.00 0.00 0.00 0.00 41 R 8.26 3.99 0.00 2.16 2.43 0.00 2.82 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 42 I 7.67 3.70 1.88 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 1.67 1.38 0.92 0.00 0.00 43 C 8.01 4.20 0.00 2.95 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 44 L 7.94 3.50 0.00 1.33 1.57 0.21 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 0.00 0.00 0.00 0.00 45 R 7.67 3.83 0.00 1.91 1.88 0.00 3.18 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 46 E 7.93 3.98 0.00 2.22 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 2.33 2.54 0.00 47 L 8.28 4.03 0.00 1.55 1.66 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.67 3.93 1.21 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 49 H 8.02 4.28 0.00 3.40 3.34 0.00 5.66 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.63 4.15 0.00 1.90 1.87 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.73 7.81 51 G 8.60 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.98 4.26 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 53 L 7.74 4.66 0.00 1.64 1.73 0.68 0.94 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 54 P 0.00 4.12 0.00 2.24 2.06 0.00 3.78 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 55 G 9.01 4.04 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 0.00 56 V 7.68 3.71 2.31 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 0.75 0.00 0.00 1.29 0.00 0.00 57 R 8.22 4.64 0.00 1.77 1.75 0.00 3.32 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 58 K 8.66 3.92 0.00 1.76 1.74 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.40 7.81 59 A 8.53 4.27 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.47 4.51 0.00 3.87 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 W 7.94 4.77 0.00 3.28 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