NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3330 8.1593 117.3731 62.5527 70.0227 173.4365 2 P 4.3278 0.0000 0.0000 62.0842 32.6686 174.0588 3 D 4.3559 8.8718 121.5506 55.5002 41.5067 176.4359 4 C 4.8496 8.9897 119.6960 57.6518 46.0976 174.0899 5 V 4.7136 7.3791 109.9351 59.8972 36.2468 173.9007 6 T 4.9709 8.3908 118.0896 61.6356 72.1321 173.8031 7 G 3.9250 8.1862 111.9417 46.0862 0.0000 172.1203 8 K 4.8007 8.4774 118.7380 55.2354 33.1663 178.2948 9 V 3.8258 8.2614 122.5999 62.3640 30.8496 175.2529 10 E 4.2940 8.7206 130.0297 59.1886 29.9281 176.2931 11 Y 4.9837 7.1142 114.7083 56.4018 41.0553 172.9478 12 T 4.9909 8.5938 109.8581 59.9052 72.5249 173.1185 13 K 4.4795 8.3618 122.8986 55.0117 35.7425 174.3499 14 Y 4.5263 8.8017 129.2809 57.6559 39.6145 174.2194 15 N 5.0730 8.4246 123.6449 51.2632 41.2720 175.6304 16 D 4.4463 8.9530 120.4743 56.8018 41.4206 176.6339 17 D 4.8271 7.9829 116.9640 52.9939 39.6674 175.8956 18 D 3.9924 8.0779 116.5245 56.0132 39.1321 173.7887 19 T 4.5897 7.4355 110.0484 60.6333 71.7150 173.1666 20 F 5.1780 8.7352 123.0863 56.9135 42.4221 173.5851 21 T 5.3288 8.7486 123.4830 62.2042 71.0947 174.1855 22 V 4.7044 8.6213 123.1620 59.8844 35.5583 173.8910 23 K 4.7578 8.3194 124.3934 54.6182 34.2950 174.8925 24 V 4.3495 7.9902 126.7098 61.6857 34.7065 175.3934 25 G 3.6543 8.7593 115.9737 47.3069 0.0000 173.5458 26 D 4.7996 8.6822 124.6771 52.8218 40.1079 176.1147 27 K 4.8262 7.7576 119.0415 54.9707 35.6225 174.5051 28 E 4.9923 9.1042 125.4889 54.7356 31.4911 174.7139 29 L 5.6436 8.8869 125.9407 53.0656 46.8618 175.1000 30 F 5.6516 9.3708 114.5673 55.6738 42.0637 173.5892 31 T 4.4344 8.7303 113.5469 60.2387 70.2699 173.9094 32 N 4.8093 8.7733 124.5661 53.3209 38.3390 175.0829 33 R 4.2291 7.8541 120.4036 55.5219 30.3114 177.3764 34 W 4.3193 8.9177 124.5324 59.7690 28.8939 177.9877 35 N 4.3642 8.4421 115.3391 56.5934 38.2047 176.6937 36 L 4.2941 8.0469 119.1822 56.7248 41.7382 179.0708 37 Q 2.9173 7.7714 119.0604 58.8715 28.7801 179.0932 38 S 4.2142 7.7780 113.9908 60.7275 63.3544 176.2960 39 L 3.8553 7.7461 122.7211 57.8137 41.4989 179.1246 40 L 4.3491 8.7841 119.3056 57.7053 41.4602 179.3704 41 L 4.1925 8.1250 120.5800 58.2417 41.9987 179.2094 42 S 4.1281 8.1578 114.8328 61.4118 62.6681 176.5050 43 A 4.0874 8.3213 123.6844 54.9747 18.0420 179.5157 44 Q 3.9221 8.1330 118.1132 59.5849 29.0297 178.5909 45 I 3.8066 7.8816 119.8432 64.1654 37.2784 177.7079 46 T 4.3767 8.0408 107.6821 61.1872 69.0992 175.4101 47 G 3.9162 7.6745 109.2926 46.4892 0.0000 173.8888 48 M 4.2503 7.6510 118.8507 55.8692 33.5930 175.5753 49 T 4.7964 8.1541 117.9658 62.7752 70.1315 174.6312 50 V 4.8266 8.8383 120.0042 59.7759 35.5230 174.7898 51 T 4.8626 8.3331 118.4196 61.9332 71.7320 173.1513 52 I 4.4817 8.2885 127.2588 59.6209 39.4028 174.7654 53 K 4.9386 8.2754 126.3552 54.4380 33.4533 175.7322 54 T 4.5185 8.0577 117.5815 61.3495 69.8023 173.1868 55 N 4.4700 9.1200 124.2628 54.6261 39.5338 175.6492 56 A 4.5545 7.8247 124.2590 50.9904 18.0875 177.1059 57 C 4.7777 7.5535 124.7747 53.8780 39.0246 171.5338 58 H 4.9488 7.2446 117.6908 53.5558 31.3988 173.6482 59 N 4.7022 8.5943 118.1822 55.0145 38.6683 175.9986 60 G 4.0536 9.1448 111.1162 45.2750 0.0000 173.8076 61 G 3.9597 7.4872 107.4058 45.0733 0.0000 173.7495 62 G 3.7064 8.4652 108.8067 44.9664 0.0000 172.8806 63 F 5.2115 7.8384 115.4612 55.4290 40.8018 174.4446 64 S 4.4517 8.8114 111.4535 57.3614 64.6204 173.2232 65 E 4.7402 8.2694 121.8822 54.7982 31.3671 174.9878 66 V 4.6883 8.3726 123.6480 61.0079 35.1045 174.2731 67 I 4.3969 8.3106 127.7604 59.5373 39.6673 174.4323 68 F 4.9962 8.9216 126.0190 56.1711 40.3469 176.1416 69 R 4.3507 8.7883 122.6158 56.1978 30.3951 176.2371 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 T 8.16 4.33 4.23 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 1.20 0.00 0.00 2 P 0.00 4.33 0.00 2.18 2.16 0.00 3.69 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 3 D 8.87 4.36 0.00 2.55 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.99 4.85 0.00 2.89 3.13 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 0.00 0.00 0.00 0.00 5 V 7.38 4.71 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 0.75 0.00 0.00 0.82 0.00 0.00 6 T 8.39 4.97 4.19 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 0.00 0.00 0.00 1.20 0.00 0.00 7 G 8.19 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 8 K 8.48 4.80 0.00 1.65 1.76 0.00 1.81 0.00 0.00 2.37 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.27 7.81 9 V 8.26 3.83 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 0.76 0.00 0.00 0.95 0.00 0.00 10 E 8.72 4.29 0.00 1.95 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 2.46 2.31 0.00 11 Y 7.11 4.98 0.00 3.04 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 12 T 8.59 4.99 3.54 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 13 K 8.36 4.48 0.00 1.78 1.62 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.39 7.81 14 Y 8.80 4.53 0.00 3.19 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 15 N 8.42 5.07 0.00 2.75 2.62 0.00 0.00 6.30 7.61 0.00 0.00 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 D 8.95 4.45 0.00 2.64 2.72 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 17 D 7.98 4.83 0.00 2.85 2.73 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 18 D 8.08 3.99 0.00 3.09 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 19 T 7.44 4.59 4.49 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 0.00 0.00 0.00 1.40 0.00 0.00 20 F 8.74 5.18 0.00 2.93 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 21 T 8.75 5.33 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 1.30 0.00 0.00 22 V 8.62 4.70 2.26 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 0.62 0.00 0.00 0.94 0.00 0.00 23 K 8.32 4.76 0.00 0.86 0.74 0.00 1.46 0.00 0.00 1.49 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.17 1.16 7.81 24 V 7.99 4.35 1.90 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 0.77 0.00 0.00 0.77 0.00 0.00 25 G 8.76 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.68 4.80 0.00 2.78 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 27 K 7.76 4.83 0.00 1.57 1.67 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.30 1.44 7.81 28 E 9.10 4.99 0.00 2.10 1.86 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 2.25 2.29 0.00 29 L 8.89 5.64 0.00 1.71 1.89 0.72 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 30 F 9.37 5.65 0.00 3.14 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 31 T 8.73 4.43 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 32 N 8.77 4.81 0.00 2.95 3.05 0.00 0.00 6.22 7.66 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 33 R 7.85 4.23 0.00 1.88 1.93 0.00 3.24 0.00 0.00 3.10 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.69 0.00 34 W 8.92 4.32 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 35 N 8.44 4.36 0.00 2.73 2.95 0.00 0.00 6.94 7.85 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 36 L 8.05 4.29 0.00 1.95 1.86 1.05 1.19 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 37 Q 7.77 2.92 0.00 1.98 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.82 0.00 0.00 0.00 0.00 0.00 1.52 2.10 0.00 38 S 7.78 4.21 0.00 4.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 3.86 0.00 1.91 1.34 0.95 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.78 4.35 0.00 2.02 2.07 1.41 0.88 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 41 L 8.13 4.19 0.00 2.05 1.72 1.11 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 42 S 8.16 4.13 0.00 4.12 3.87 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 43 A 8.32 4.09 1.63 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 0.00 0.00 44 Q 8.13 3.92 0.00 2.32 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.42 2.64 0.00 45 I 7.88 3.81 1.91 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 1.62 0.80 0.93 0.00 0.00 46 T 8.04 4.38 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 1.26 0.00 0.00 47 G 7.67 3.92 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 0.00 0.00 0.00 48 M 7.65 4.25 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.60 0.00 49 T 8.15 4.80 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 1.19 0.00 0.00 50 V 8.84 4.83 1.78 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 0.64 0.00 0.00 0.81 0.00 0.00 51 T 8.33 4.86 4.13 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 0.00 0.00 0.00 1.19 0.00 0.00 52 I 8.29 4.48 1.54 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.60 0.39 0.00 0.00 53 K 8.28 4.94 0.00 1.59 1.71 0.00 1.66 0.00 0.00 1.46 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.14 7.81 54 T 8.06 4.52 4.29 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 0.00 0.00 0.00 1.18 0.00 0.00 55 N 9.12 4.47 0.00 2.73 2.85 0.00 0.00 6.84 7.35 0.00 0.00 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 A 7.82 4.55 1.23 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 0.00 0.00 57 C 7.55 4.78 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 58 H 7.24 4.95 0.00 3.37 3.36 0.00 5.71 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.59 4.70 0.00 2.79 2.86 0.00 0.00 7.04 7.65 0.00 0.00 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 G 9.14 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.49 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 0.00 0.00 0.00 62 G 8.47 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 0.00 0.00 0.00 63 F 7.84 5.21 0.00 2.90 2.85 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 64 S 8.81 4.45 0.00 3.89 3.83 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 65 E 8.27 4.74 0.00 2.14 1.90 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 2.32 2.29 0.00 66 V 8.37 4.69 1.77 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 0.02 0.00 0.00 1.03 0.00 0.00 67 I 8.31 4.40 1.76 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.54 0.90 0.00 0.00 68 F 8.92 5.00 0.00 2.92 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 69 R 8.79 4.35 0.00 1.76 1.80 0.00 3.13 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00