NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.4063 7.9432 120.3888 54.9645 43.1066 175.7329 2 K 5.3270 7.8381 117.7766 54.0537 35.4955 175.9404 3 C 5.3216 8.4660 120.4938 55.5665 45.8998 171.6959 4 N 5.5798 8.7017 116.1022 51.1820 39.8426 173.7431 5 K 4.3052 8.0654 122.3246 56.6132 32.7857 175.4983 6 L 3.7966 9.4865 129.5027 54.9551 39.7992 174.4420 7 V 4.3547 7.9778 121.2290 62.5606 39.0657 172.5589 8 P 4.4774 0.0000 0.0000 63.1042 31.2571 176.1500 9 L 4.2957 7.4267 120.2873 53.9453 44.2724 177.2005 10 F 4.0237 8.4782 118.2872 57.2992 38.2368 174.7881 11 Y 4.6413 8.4060 113.9423 58.1805 43.0540 176.7684 12 K 4.1592 10.2520 121.8821 55.4298 30.3237 177.1741 13 T 5.0549 8.7026 104.7854 60.7228 71.5957 171.5828 14 C 4.8927 8.4173 121.6776 53.4438 41.4350 171.2476 15 P 4.3937 0.0000 0.0000 62.7185 32.7757 172.4914 16 A 3.5164 9.3541 128.1249 52.8646 18.6799 176.5530 17 G 4.3097 9.1116 115.1323 45.6766 0.0000 174.0500 18 K 4.6971 7.2710 116.9827 54.7324 34.3886 174.6093 19 N 5.0449 8.4996 112.9061 55.6265 44.3941 174.6756 20 L 4.6117 8.3337 116.7186 54.1495 47.2775 173.8111 21 C 5.4117 8.7309 120.5118 55.9384 47.5518 171.6025 22 Y 5.3722 8.6588 117.0833 56.0300 41.2262 173.7583 23 K 4.7024 8.6763 119.8110 54.9184 37.0394 175.0264 24 M 5.2947 8.7771 121.9951 54.5386 35.9781 174.0017 25 F 5.2877 8.2165 120.5045 57.2806 41.6343 171.7267 26 M 5.0293 8.5550 114.8548 54.4379 33.7133 173.9574 27 V 3.7137 7.7148 112.2735 62.0868 31.2074 174.5938 28 S 4.5344 8.1413 118.2166 57.4857 65.1610 173.4693 29 N 4.8528 7.8914 117.3530 54.4912 40.8447 177.6138 30 L 4.4714 7.5038 117.9132 53.9577 42.3140 174.6282 31 T 3.2913 8.0768 113.6239 63.7612 64.7485 171.5287 32 V 4.2867 7.3560 121.7459 59.6134 35.0165 173.2138 33 P 2.0000 0.0000 0.0000 61.9250 32.1410 175.2643 34 V 4.3494 8.4418 118.6753 63.9305 33.5737 175.2582 35 K 4.8298 8.1004 117.9867 55.4046 36.3095 174.4255 36 R 5.2768 7.0933 118.8006 56.4362 33.8744 173.3677 37 G 4.6531 7.9535 108.9553 46.5947 0.0000 170.2172 38 C 5.5083 8.6935 114.4264 53.8040 44.3665 173.5769 39 I 4.2899 8.5798 125.7765 60.5788 39.4255 175.6353 40 D 4.4636 8.7030 116.9516 55.2462 43.9894 174.8731 41 V 4.4803 7.7342 117.9623 61.1981 32.7513 174.0021 42 C 4.9296 8.3348 125.6913 54.0833 41.8563 172.2417 43 P 4.3932 0.0000 0.0000 63.6676 33.2691 175.5458 44 K 4.2826 9.3667 116.7162 56.9024 31.8711 176.0306 45 N 3.9433 7.5923 120.0197 51.6445 41.8362 173.0576 46 S 4.3213 9.0197 119.3235 57.7042 69.0719 174.4704 47 A 4.3730 5.8000 122.8259 52.0782 25.2868 178.4982 48 L 4.6525 7.5809 114.0200 54.8573 44.4052 176.9732 49 V 4.8073 7.7502 111.5216 59.2601 34.8251 175.0218 50 K 3.9010 8.5695 125.1052 55.0543 35.2172 175.2038 51 Y 5.1514 7.3160 119.4600 56.7091 40.8437 174.8278 52 V 4.4621 8.4846 124.3404 61.2267 35.0805 173.3934 53 C 5.5189 8.5341 121.9299 55.0641 45.4415 173.8588 54 C 4.6175 9.1531 126.6258 56.0307 45.1082 172.8821 55 N 4.4941 8.7855 119.1273 54.7842 39.4520 175.0289 56 T 4.5909 7.3087 110.9682 63.4726 72.4982 168.9010 57 D 4.2744 9.0278 129.8421 55.0553 41.1101 175.1020 58 R 3.9132 8.7763 120.8442 55.9883 27.6431 175.5825 59 C 5.4428 7.8862 113.8033 56.0444 41.8649 173.5572 60 N 4.5349 8.4719 126.6934 54.7153 40.0962 173.7616 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 L 7.94 4.41 0.00 1.61 1.81 0.91 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 2 K 7.84 5.33 0.00 1.74 1.76 0.00 1.88 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.37 7.81 3 C 8.47 5.32 0.00 2.80 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 4 N 8.70 5.58 0.00 2.60 2.39 0.00 0.00 5.70 6.99 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 5 K 8.07 4.31 0.00 0.79 1.19 0.00 1.45 0.00 0.00 1.44 0.00 0.00 2.90 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.22 0.95 7.81 6 L 9.49 3.80 0.00 1.78 1.54 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 7 V 7.98 4.35 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 0.88 0.00 0.00 0.93 0.00 0.00 8 P 0.00 4.48 0.00 2.10 2.09 0.00 3.70 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 9 L 7.43 4.30 0.00 1.49 1.66 0.85 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 10 F 8.48 4.02 0.00 3.22 3.05 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 11 Y 8.41 4.64 0.00 3.00 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 12 K 10.25 4.16 0.00 2.00 1.94 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.38 7.81 13 T 8.70 5.05 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 1.22 0.00 0.00 14 C 8.42 4.89 0.00 2.93 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 15 P 0.00 4.39 0.00 2.19 2.09 0.00 3.89 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 16 A 9.35 3.52 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 17 G 9.11 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 0.00 0.00 0.00 0.00 18 K 7.27 4.70 0.00 1.87 1.76 0.00 1.86 0.00 0.00 1.30 0.00 0.00 2.70 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.34 7.81 19 N 8.50 5.04 0.00 2.81 2.74 0.00 0.00 6.63 7.78 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 20 L 8.33 4.61 0.00 1.68 1.65 0.94 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 21 C 8.73 5.41 0.00 3.11 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 Y 8.66 5.37 0.00 3.20 3.03 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 0.00 0.00 0.00 0.00 23 K 8.68 4.70 0.00 2.03 1.82 0.00 1.57 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.35 7.81 24 M 8.78 5.29 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.53 0.00 25 F 8.22 5.29 0.00 3.24 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 26 M 8.55 5.03 0.00 2.12 2.28 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.66 0.00 27 V 7.71 3.71 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 0.63 0.00 0.00 0.96 0.00 0.00 28 S 8.14 4.53 0.00 3.82 3.66 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 29 N 7.89 4.85 0.00 2.72 2.81 0.00 0.00 6.88 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.50 4.47 0.00 1.55 1.56 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 31 T 8.08 3.29 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 1.33 0.00 0.00 32 V 7.36 4.29 1.94 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 0.72 0.00 0.00 0.91 0.00 0.00 33 P 0.00 2.00 0.00 1.87 1.42 0.00 3.50 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.68 0.00 34 V 8.44 4.35 2.53 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 0.86 0.00 0.00 1.05 0.00 0.00 35 K 8.10 4.83 0.00 1.92 1.89 0.00 1.14 0.00 0.00 1.57 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.57 7.81 36 R 7.09 5.28 0.00 1.83 2.03 0.00 3.27 0.00 0.00 3.40 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.51 0.00 37 G 7.95 4.65 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 38 C 8.69 5.51 0.00 2.88 3.01 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 39 I 8.58 4.29 1.78 0.00 0.00 0.57 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 0.94 0.84 0.00 0.00 40 D 8.70 4.46 0.00 2.61 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.73 4.48 2.03 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 0.79 0.00 0.00 0.91 0.00 0.00 42 C 8.33 4.93 0.00 3.11 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 43 P 0.00 4.39 0.00 2.21 2.14 0.00 3.84 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 44 K 9.37 4.28 0.00 1.98 2.03 0.00 1.67 0.00 0.00 1.77 0.00 0.00 3.12 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.50 7.81 45 N 7.59 3.94 0.00 2.39 2.14 0.00 0.00 5.73 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 46 S 9.02 4.32 0.00 3.92 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 5.80 4.37 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.58 4.65 0.00 1.62 1.71 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 49 V 7.75 4.81 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.20 0.00 0.00 50 K 8.57 3.90 0.00 1.47 1.60 0.00 1.03 0.00 0.00 1.34 0.00 0.00 2.75 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.39 0.71 7.81 51 Y 7.32 5.15 0.00 3.06 3.14 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 52 V 8.48 4.46 2.15 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 0.92 0.00 0.00 0.89 0.00 0.00 53 C 8.53 5.52 0.00 3.07 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 54 C 9.15 4.62 0.00 3.08 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 N 8.79 4.49 0.00 2.73 2.78 0.00 0.00 6.81 7.71 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 56 T 7.31 4.59 4.24 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 1.27 0.00 0.00 57 D 9.03 4.27 0.00 2.86 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 0.00 58 R 8.78 3.91 0.00 1.95 2.03 0.00 3.44 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 59 C 7.89 5.44 0.00 3.14 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.47 4.53 0.00 2.99 2.76 0.00 0.00 7.11 6.84 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