NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4091 8.3349 115.2888 58.7225 62.9124 174.2908 2 V 4.2118 8.1423 111.9685 60.2574 32.7911 175.5930 3 S 4.1150 8.1266 119.1250 61.8517 63.5347 176.0131 4 E 4.0002 8.0939 119.3264 58.9752 29.4242 179.1834 5 I 3.6214 7.5027 120.7948 64.2161 37.2042 177.7066 6 Q 3.9051 8.1818 120.5724 59.2040 28.8225 178.4716 7 L 3.9843 8.0875 119.9904 58.2013 41.6420 179.4702 8 M 4.1432 8.1254 118.5637 58.5406 31.8479 178.5769 9 H 4.2332 8.5331 116.7272 59.0612 28.8502 177.5854 10 N 4.3165 8.4563 118.4875 56.1700 38.3174 177.1910 11 L 4.1221 8.4828 122.3215 58.2282 42.1176 179.3372 12 G 3.6438 8.3658 105.7627 47.6228 0.0000 175.8380 13 K 3.9448 8.1387 120.7914 59.6672 32.0728 179.1869 14 H 4.2499 8.3679 116.6375 58.7963 28.5187 177.8955 15 L 4.0283 8.4165 121.2702 57.8460 41.5330 179.1721 16 N 4.3057 8.4086 116.5931 56.5976 38.4880 177.6051 17 S 4.1666 8.2208 116.3678 61.9216 62.8321 176.7194 18 M 4.1439 8.3182 121.4252 58.2730 31.5852 178.5684 19 E 4.0123 8.5150 119.1295 59.6037 29.6528 179.6724 20 R 4.0599 8.0150 117.8843 59.2290 30.0369 179.2908 21 V 3.7121 8.0831 118.2158 65.9836 31.5169 177.7687 22 E 3.9774 8.6353 119.4286 58.6403 29.4576 178.3262 23 W 4.2241 8.7004 129.1388 60.5148 30.6612 177.6585 24 L 3.3661 8.3115 119.9526 57.9265 41.5190 178.5568 25 R 3.8232 8.2235 119.0210 59.7376 29.9684 178.6083 26 K 3.9920 8.0780 117.9101 59.1646 31.9591 179.4761 27 K 3.7279 7.5970 118.8338 59.4941 31.8218 179.3883 28 L 3.9729 8.0260 119.3827 57.6422 41.4381 179.4122 29 Q 3.9879 8.4158 118.5578 59.2693 28.6944 178.8696 30 D 4.6071 8.2396 119.7368 57.3429 40.6102 179.0060 31 V 3.6094 7.6040 118.0430 66.2619 31.6087 177.2812 32 H 4.2362 8.3894 117.3043 58.9306 29.8037 176.2871 33 N 4.3337 8.1371 116.3186 53.6080 38.8819 175.1729 34 F 4.4501 7.8360 123.4108 57.5221 39.8444 174.5838 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 S 8.33 4.41 0.00 3.84 3.68 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 2 V 8.14 4.21 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.92 0.00 0.00 3 S 8.13 4.11 0.00 3.85 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 4 E 8.09 4.00 0.00 2.15 2.20 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 2.34 2.33 0.00 5 I 7.50 3.62 1.92 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 1.48 0.65 0.68 0.00 0.00 6 Q 8.18 3.91 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 7 L 8.09 3.98 0.00 1.89 1.70 0.92 1.02 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 8 M 8.13 4.14 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.85 0.00 9 H 8.53 4.23 0.00 3.30 3.30 0.00 5.64 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 10 N 8.46 4.32 0.00 2.93 2.90 0.00 0.00 6.72 7.54 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 11 L 8.48 4.12 0.00 1.82 1.89 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 12 G 8.37 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 0.00 0.00 0.00 13 K 8.14 3.94 0.00 1.89 1.79 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.58 7.81 14 H 8.37 4.25 0.00 3.32 3.35 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.42 4.03 0.00 1.81 1.73 0.94 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 16 N 8.41 4.31 0.00 2.92 2.86 0.00 0.00 7.05 7.69 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 17 S 8.22 4.17 0.00 4.07 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 18 M 8.32 4.14 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.61 0.00 19 E 8.51 4.01 0.00 2.21 2.04 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 2.36 2.57 0.00 20 R 8.02 4.06 0.00 2.07 2.01 0.00 3.03 0.00 0.00 2.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.80 0.00 21 V 8.08 3.71 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 1.11 0.00 0.00 1.02 0.00 0.00 22 E 8.64 3.98 0.00 2.16 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 0.00 2.35 2.41 0.00 23 W 8.70 4.22 0.00 3.42 3.49 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 0.00 24 L 8.31 3.37 0.00 2.01 1.90 0.82 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 25 R 8.22 3.82 0.00 1.97 2.07 0.00 3.14 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 26 K 8.08 3.99 0.00 1.75 1.78 0.00 1.74 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.60 7.81 27 K 7.60 3.73 0.00 1.41 1.50 0.00 1.42 0.00 0.00 1.33 0.00 0.00 2.69 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.55 0.21 7.81 28 L 8.03 3.97 0.00 1.74 1.66 0.88 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 8.42 3.99 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 30 D 8.24 4.61 0.00 2.87 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.60 3.61 2.19 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 0.79 0.00 0.00 0.95 0.00 0.00 32 H 8.39 4.24 0.00 3.17 3.46 0.00 5.99 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 33 N 8.14 4.33 0.00 2.44 1.85 0.00 0.00 6.83 6.96 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 34 F 7.84 4.45 0.00 3.17 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