NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.4450 8.4444 118.7967 55.5166 32.8012 176.3360 3 E 4.3495 8.2949 124.6194 53.5521 29.6350 176.5222 4 K 4.0662 8.6415 121.6701 55.3322 33.5241 176.0452 5 P 4.6261 0.0000 0.0000 61.8408 27.7017 176.6590 6 K 4.1197 7.8875 122.8637 61.1533 32.5581 177.7543 7 G 3.7277 8.5311 103.8364 47.5745 0.0000 174.8093 8 A 3.9709 7.9354 120.7827 54.5688 18.7660 179.8197 9 L 3.8696 7.6305 115.4333 58.0078 41.8097 179.3157 10 A 4.0788 8.7568 121.5104 56.0161 18.1834 179.1014 11 V 3.6143 8.2135 117.4552 65.4332 31.5470 177.8734 12 I 3.7288 8.9009 114.1053 64.2517 37.2993 176.8655 13 L 4.0309 9.2001 123.1539 56.0347 41.4229 180.2737 14 V 3.4522 7.3622 117.0414 65.9395 32.9582 176.6803 15 L 3.7121 8.6827 118.4943 58.6890 41.6209 180.2833 16 T 3.6936 8.1515 113.8423 66.1138 68.8007 175.9015 17 L 4.0820 8.8076 122.0019 58.7786 41.0672 179.0429 18 T 4.2589 8.6300 116.6694 65.4118 68.2195 177.3362 19 I 3.9216 7.8075 122.4064 64.0634 37.3819 178.0495 20 L 4.1382 8.1045 120.3655 57.6204 41.2781 179.0336 21 V 3.6655 8.2070 118.4154 66.4939 31.0265 178.0444 22 F 4.2422 9.9063 117.5257 59.6363 39.0181 177.7856 23 W 4.2448 8.2521 127.9165 60.1298 30.6050 178.1673 24 L 4.2938 8.4068 118.9507 58.1425 40.9322 179.6481 25 G 4.0434 7.5435 103.3691 48.5589 0.0000 175.3215 26 V 3.7035 8.1398 121.5300 65.4074 31.5445 179.0742 27 Y 3.5384 8.2031 116.0565 58.2526 40.1589 177.5634 28 A 4.1577 9.0663 121.2947 55.5856 18.7225 179.9932 29 V 3.4903 9.5270 116.2952 66.1358 31.4761 177.6611 30 F 3.9077 8.2599 118.5855 61.6615 39.2530 176.8302 31 F 4.0134 8.7251 117.0529 60.5568 38.6327 177.3568 32 A 4.3055 8.3540 119.7171 54.9393 18.1633 178.8109 33 R 4.3431 7.6329 113.9869 56.0930 30.6363 176.7530 34 G 3.3947 8.0983 114.0451 45.4054 0.0000 173.7286 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 2 E 8.44 4.45 0.00 2.07 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 2.17 2.36 0.00 3 E 8.29 4.35 0.00 1.87 1.35 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 0.00 2.20 2.35 0.00 4 K 8.64 4.07 0.00 1.75 1.72 0.00 1.82 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.41 1.42 7.81 5 P 0.00 4.63 0.00 2.30 2.20 0.00 3.78 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.04 0.00 6 K 7.89 4.12 0.00 1.86 1.93 0.00 1.63 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.62 7.81 7 G 8.53 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 8 A 7.94 3.97 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 9 L 7.63 3.87 0.00 1.92 1.72 0.97 0.83 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 10 A 8.76 4.08 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.21 3.61 2.29 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 1.03 0.00 0.00 0.93 0.00 0.00 12 I 8.90 3.73 1.85 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 1.39 0.75 0.90 0.00 0.00 13 L 9.20 4.03 0.00 1.88 1.79 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 14 V 7.36 3.45 2.18 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 1.03 0.00 0.00 0.97 0.00 0.00 15 L 8.68 3.71 0.00 1.78 1.70 0.86 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 16 T 8.15 3.69 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 1.19 0.00 0.00 17 L 8.81 4.08 0.00 1.79 1.76 0.94 -0.06 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 18 T 8.63 4.26 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 1.16 0.00 0.00 19 I 7.81 3.92 1.98 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.31 0.90 0.00 0.00 20 L 8.10 4.14 0.00 1.89 1.74 0.91 0.49 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 21 V 8.21 3.67 2.34 0.00 0.00 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 0.99 0.00 0.00 22 F 9.91 4.24 0.00 3.32 3.19 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 0.00 23 W 8.25 4.24 0.00 3.46 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 8.41 4.29 0.00 1.96 1.86 1.09 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.54 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 26 V 8.14 3.70 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 0.93 0.00 0.00 0.97 0.00 0.00 27 Y 8.20 3.54 0.00 3.07 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 28 A 9.07 4.16 1.53 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 0.00 0.00 0.00 0.00 0.00 0.00 29 V 9.53 3.49 2.23 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 0.97 0.00 0.00 0.97 0.00 0.00 30 F 8.26 3.91 0.00 2.81 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 31 F 8.73 4.01 0.00 3.38 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 32 A 8.35 4.31 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 33 R 7.63 4.34 0.00 1.67 1.81 0.00 3.06 0.00 0.00 3.16 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.71 0.00 34 G 8.10 3.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00