NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2783 8.1127 120.8598 56.6746 32.2386 177.4408 2 M 3.8977 7.8305 116.7023 57.3053 32.0521 176.3825 3 K 4.1555 8.7467 120.9723 59.2419 32.9318 178.2647 4 Q 4.0960 7.9719 117.8614 59.1212 28.7775 178.3050 5 I 3.7042 7.4312 120.8710 64.8644 37.2800 178.3232 6 E 4.0253 8.0529 118.7200 59.4031 29.0568 179.1822 7 D 4.3629 8.3587 119.5041 57.2039 40.8638 178.7141 8 K 3.9914 8.1900 120.2092 59.3831 32.1718 179.0464 9 I 3.7515 7.8516 120.3461 64.3382 36.9562 178.2634 10 E 4.0317 8.1986 119.3490 59.2775 29.3026 179.2050 11 E 4.0093 7.9023 118.8032 59.2906 29.5107 179.3753 12 I 3.7061 7.9165 119.8874 64.5377 37.2996 178.5908 13 L 4.1346 7.9848 119.4053 57.4234 41.3615 179.9112 14 S 4.1997 7.9353 115.2456 61.4280 62.9837 176.6331 15 K 4.0175 7.9901 121.0322 59.6943 31.9721 179.5208 16 I 3.7820 7.8966 120.0218 64.3275 36.8869 177.8813 17 Y 4.4388 7.9329 121.3209 60.4894 38.6926 177.4678 18 H 3.9181 8.1563 118.6220 59.5478 29.8498 177.2388 19 I 3.9643 7.5892 122.3549 63.8829 36.6796 178.3397 20 E 3.9451 8.0253 119.1202 59.1672 29.1728 179.1914 21 N 4.1838 7.6703 116.4202 56.0796 38.0721 177.0933 22 E 3.8550 7.8563 119.9644 59.6526 29.5460 179.4840 23 I 3.6841 8.0100 119.6769 64.4314 36.9175 178.3118 24 A 3.9805 7.6319 121.3453 55.1464 18.1600 179.6252 25 R 3.8907 7.8321 116.7517 59.1421 30.0093 178.8456 26 I 3.6798 7.6599 119.8448 64.3597 37.0802 178.2378 27 K 3.8603 8.3741 119.7097 59.6405 31.7391 179.4149 28 K 4.0413 7.7535 118.3232 59.5389 31.8987 179.2067 29 L 3.8765 7.6500 118.4586 57.0539 41.5847 178.3488 30 I 4.2813 7.2121 109.2884 60.0098 37.7510 175.6498 31 G 3.8328 8.6410 108.3349 46.7653 0.0000 173.5950 32 E 4.1116 8.9910 123.8786 56.0629 30.2774 177.4227 33 R 4.1908 8.3292 123.1687 57.1449 30.3036 171.3185 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 R 8.11 4.28 0.00 1.83 1.98 0.00 3.31 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 2 M 7.83 3.90 0.00 2.20 2.04 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.65 0.00 3 K 8.75 4.16 0.00 1.83 1.78 0.00 1.79 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.47 7.81 4 Q 7.97 4.10 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.60 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 5 I 7.43 3.70 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.73 0.91 0.00 0.00 6 E 8.05 4.03 0.00 2.16 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 0.00 2.33 2.49 0.00 7 D 8.36 4.36 0.00 2.80 2.71 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 8 K 8.19 3.99 0.00 1.88 1.96 0.00 1.52 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.52 7.81 9 I 7.85 3.75 2.06 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.49 0.91 0.00 0.00 10 E 8.20 4.03 0.00 2.01 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 0.00 2.58 2.48 0.00 11 E 7.90 4.01 0.00 2.12 2.00 0.00 0.00 0.00 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 2.35 0.00 12 I 7.92 3.71 2.04 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 1.53 1.08 0.93 0.00 0.00 13 L 7.98 4.13 0.00 1.84 1.73 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.94 4.20 0.00 4.10 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 15 K 7.99 4.02 0.00 2.05 1.89 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.63 1.64 7.81 16 I 7.90 3.78 2.01 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 1.43 1.28 0.96 0.00 0.00 17 Y 7.93 4.44 0.00 3.11 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 18 H 8.16 3.92 0.00 3.35 3.58 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 I 7.59 3.96 2.05 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 1.55 1.29 0.90 0.00 0.00 20 E 8.03 3.95 0.00 2.12 1.92 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 2.32 2.34 0.00 21 N 7.67 4.18 0.00 2.67 2.65 0.00 0.00 6.92 8.93 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 22 E 7.86 3.86 0.00 2.10 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 0.00 2.22 2.29 0.00 23 I 8.01 3.68 1.96 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.80 0.89 0.00 0.00 24 A 7.63 3.98 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.83 3.89 0.00 1.83 2.05 0.00 3.06 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 26 I 7.66 3.68 1.99 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.11 0.90 0.00 0.00 27 K 8.37 3.86 0.00 2.00 1.87 0.00 1.65 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.61 7.81 28 K 7.75 4.04 0.00 1.99 1.83 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.58 7.81 29 L 7.65 3.88 0.00 1.91 1.77 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.21 4.28 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.82 0.95 0.00 0.00 31 G 8.64 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 0.00 0.00 0.00 32 E 8.99 4.11 0.00 1.90 1.93 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 2.31 2.24 0.00 33 R 8.33 4.19 0.00 1.81 1.60 0.00 3.35 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.04 0.00