NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9706 8.3549 109.7355 45.5869 0.0000 173.9188 2 S 4.2193 8.6878 119.6282 58.5722 64.0033 172.9715 3 P 4.6618 0.0000 0.0000 62.9810 32.8064 177.3366 4 L 4.4069 8.4095 112.7173 53.9257 40.7524 175.4487 5 G 3.9834 7.8241 110.2319 47.1402 0.0000 173.6026 6 Q 4.0795 8.0862 120.6933 58.6821 29.3466 176.9299 7 D 4.4547 8.1580 119.3770 57.8147 40.9089 179.2566 8 V 3.2714 7.8255 111.8031 64.4804 31.4422 177.8777 9 F 3.7271 7.5514 119.1230 61.7215 39.0787 177.3905 10 L 4.1996 8.4744 118.3491 57.5664 41.3654 179.0620 11 D 4.3886 8.3533 118.5694 57.5587 40.5645 177.7875 12 Y 4.2946 7.6958 117.3848 61.5124 37.7674 177.8346 13 C 3.9197 8.3359 119.5918 63.1136 31.5567 175.3436 14 Q 3.9722 9.0759 121.3231 59.3916 28.5067 179.0190 15 K 3.9963 8.6516 119.6768 59.4916 32.2731 178.8101 16 L 3.9038 9.3602 120.9420 58.5664 41.8099 178.8552 17 L 4.2787 9.1044 121.4714 57.9406 41.9040 178.7997 18 E 4.0657 8.2479 117.6170 58.9799 29.7665 178.5210 19 K 3.6832 8.7281 121.2701 58.7819 32.1881 177.1163 20 F 4.1664 8.3571 113.7070 56.3476 39.2179 175.7067 21 R 3.9226 7.9150 118.6963 57.0962 28.1108 176.2838 22 Y 4.4075 8.0146 114.0525 57.1117 38.7967 174.3065 23 P 4.5807 0.0000 0.0000 62.4764 31.9337 176.9394 24 W 4.6313 8.7018 127.9156 59.3370 30.7669 176.5567 25 E 4.0151 8.1564 114.5094 58.1647 29.6902 177.3515 26 L 4.4323 7.3110 118.9483 55.2620 42.1783 178.3971 27 M 3.8868 7.4527 122.1511 57.9302 31.8313 176.5415 28 P 4.1417 0.0000 0.0000 65.3252 31.3682 178.6632 29 L 3.9155 7.5482 117.3142 58.1357 41.9109 178.8506 30 M 3.9004 8.1399 118.8436 58.7957 31.6484 178.1727 31 Y 4.1372 8.4249 118.9219 60.7446 39.2742 177.9126 32 V 3.8720 8.2180 118.8874 66.2524 31.7061 177.6876 33 I 3.8528 7.7542 120.8878 63.9809 37.0067 178.2330 34 L 3.8464 7.7312 119.0521 57.6138 41.0846 179.4944 35 K 4.2206 8.1060 118.9800 59.4190 31.8184 178.0436 36 D 4.5887 7.9104 118.2921 56.2821 41.2210 177.0525 37 A 4.1155 8.0420 120.8047 52.5237 19.4579 177.4402 38 D 4.2644 8.9697 116.8430 56.2116 40.0686 173.7225 39 A 3.2939 8.4795 117.6168 52.5918 17.0194 178.6430 40 N 4.1595 8.5008 117.2385 52.7567 38.9673 175.2372 41 I 3.5747 7.8903 129.9873 64.7067 37.3115 177.5964 42 E 3.9655 7.8561 118.9920 59.7806 29.1769 179.3367 43 E 3.9963 8.0229 116.4566 58.5892 30.1262 178.1032 44 A 4.1630 8.4731 121.7637 54.7416 18.7209 179.5025 45 S 4.2932 9.7451 112.7250 62.0021 63.0015 176.6832 46 R 4.2310 7.7668 122.7589 58.4250 29.7017 179.0138 47 R 3.9193 7.9562 116.9661 59.1490 29.7437 178.6564 48 I 3.7565 7.7622 118.8414 65.0122 36.6125 177.4863 49 E 4.1396 8.9898 118.8838 60.1020 29.1754 179.0758 50 E 4.1432 8.6277 118.7207 59.6370 29.5887 179.1071 51 G 3.7279 8.8775 106.3066 47.9180 0.0000 175.2029 52 Q 4.1618 9.3998 121.8268 58.7378 28.6909 179.1306 53 Y 3.9953 8.5907 120.4384 60.9842 38.9211 177.4161 54 V 3.6137 9.8823 118.7282 66.4812 31.2643 177.8478 55 V 3.5520 8.5105 118.3874 66.2126 31.7922 177.4204 56 N 4.4022 8.4129 116.3532 56.5338 38.3965 176.5482 57 E 3.6050 9.1066 120.2201 59.7212 29.7608 178.2707 58 Y 3.3308 8.5005 119.3784 60.5843 38.6131 177.9245 59 S 4.3898 8.4578 113.8621 60.3161 62.4536 176.2369 60 R 3.8772 8.5956 122.2221 58.9780 29.8535 178.0804 61 Q 3.7940 7.8566 117.7596 59.5684 28.8028 177.5776 62 H 4.2454 7.2845 110.6592 55.7049 29.1201 174.1471 63 N 4.1252 7.8167 119.0361 53.7198 36.8246 173.7949 64 L 4.8089 8.1780 127.8368 52.7078 42.6245 176.4252 65 N 4.1675 7.8526 121.2674 54.4654 38.8163 173.5054 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 8.35 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 0.00 0.00 0.00 2 S 8.69 4.22 0.00 3.96 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 3 P 0.00 4.66 0.00 2.17 1.99 0.00 3.45 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 4 L 8.41 4.41 0.00 1.67 1.68 0.92 0.77 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 5 G 7.82 3.98 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 0.00 0.00 0.00 6 Q 8.09 4.08 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.71 0.00 0.00 0.00 0.00 0.00 2.48 2.53 0.00 7 D 8.16 4.45 0.00 2.80 2.74 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 8 V 7.83 3.27 1.70 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 0.66 0.00 0.00 0.99 0.00 0.00 9 F 7.55 3.73 0.00 3.46 3.24 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 10 L 8.47 4.20 0.00 1.93 1.86 1.03 1.56 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 11 D 8.35 4.39 0.00 2.62 2.40 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 12 Y 7.70 4.29 0.00 2.88 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 13 C 8.34 3.92 0.00 3.19 3.23 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 0.00 0.00 0.00 0.00 14 Q 9.08 3.97 0.00 2.39 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.69 0.00 0.00 0.00 0.00 0.00 2.73 2.75 0.00 15 K 8.65 4.00 0.00 2.06 1.93 0.00 1.98 0.00 0.00 1.64 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.90 7.81 16 L 9.36 3.90 0.00 1.95 1.88 1.13 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 17 L 9.10 4.28 0.00 2.04 2.02 1.04 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.25 4.07 0.00 2.32 2.46 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 2.51 2.33 0.00 19 K 8.73 3.68 0.00 1.71 1.99 0.00 1.82 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.17 1.35 7.81 20 F 8.36 4.17 0.00 3.01 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 0.00 0.00 0.00 21 R 7.92 3.92 0.00 1.85 1.98 0.00 3.34 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 22 Y 8.01 4.41 0.00 3.09 2.86 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 0.00 0.00 0.00 23 P 0.00 4.58 0.00 2.35 2.12 0.00 4.16 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.08 0.00 24 W 8.70 4.63 0.00 3.38 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 25 E 8.16 4.02 0.00 2.08 2.09 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 2.28 2.32 0.00 26 L 7.31 4.43 0.00 1.65 1.40 0.74 0.75 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 27 M 7.45 3.89 0.00 1.65 1.44 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.84 0.00 28 P 0.00 4.14 0.00 2.06 1.97 0.00 3.43 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 29 L 7.55 3.92 0.00 1.58 1.53 0.75 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 30 M 8.14 3.90 0.00 2.11 2.22 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.72 0.00 31 Y 8.42 4.14 0.00 3.12 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 32 V 8.22 3.87 2.24 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 1.23 0.00 0.00 1.15 0.00 0.00 33 I 7.75 3.85 1.96 0.00 0.00 0.69 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 1.16 0.83 0.00 0.00 34 L 7.73 3.85 0.00 1.71 0.84 0.75 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 35 K 8.11 4.22 0.00 1.73 2.01 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.46 7.81 36 D 7.91 4.59 0.00 2.80 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 37 A 8.04 4.12 1.25 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 0.00 0.00 0.00 38 D 8.97 4.26 0.00 2.76 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.48 3.29 1.20 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 0.00 0.00 40 N 8.50 4.16 0.00 2.57 2.61 0.00 0.00 7.07 5.15 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 41 I 7.89 3.57 1.78 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.47 0.95 0.00 0.00 42 E 7.86 3.97 0.00 2.04 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 2.31 2.28 0.00 43 E 8.02 4.00 0.00 1.91 2.01 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 2.26 2.35 0.00 44 A 8.47 4.16 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 9.75 4.29 0.00 4.35 4.42 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.77 4.23 0.00 2.05 2.06 0.00 3.13 0.00 0.00 3.34 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 47 R 7.96 3.92 0.00 1.96 1.95 0.00 3.13 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 1.64 1.86 0.00 48 I 7.76 3.76 1.76 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.96 0.17 0.00 0.00 49 E 8.99 4.14 0.00 2.33 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 2.52 2.81 0.00 50 E 8.63 4.14 0.00 2.22 2.09 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 2.40 2.34 0.00 51 G 8.88 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 9.40 4.16 0.00 2.36 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 7.01 0.00 0.00 0.00 0.00 0.00 2.73 2.86 0.00 53 Y 8.59 4.00 0.00 3.07 3.25 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 0.00 54 V 9.88 3.61 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 0.77 0.00 0.00 1.10 0.00 0.00 55 V 8.51 3.55 2.11 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 0.86 0.00 0.00 1.00 0.00 0.00 56 N 8.41 4.40 0.00 2.93 2.84 0.00 0.00 6.78 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 57 E 9.11 3.61 0.00 1.16 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 0.00 2.15 2.22 0.00 58 Y 8.50 3.33 0.00 3.10 3.10 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 59 S 8.46 4.39 0.00 4.06 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 0.00 60 R 8.60 3.88 0.00 1.82 1.89 0.00 3.17 0.00 0.00 3.02 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 61 Q 7.86 3.79 0.00 1.77 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.53 6.45 0.00 0.00 0.00 0.00 0.00 2.18 2.12 0.00 62 H 7.28 4.25 0.00 3.21 3.27 0.00 5.86 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 7.82 4.13 0.00 2.78 2.80 0.00 0.00 6.97 7.30 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 64 L 8.18 4.81 0.00 1.66 1.63 1.02 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 65 N 7.85 4.17 0.00 2.62 2.61 0.00 0.00 7.12 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00