NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.2264 8.1749 117.3688 63.4866 69.7382 172.8782 3 S 4.6728 8.1140 121.3590 56.3952 66.5460 171.6487 4 Y 4.7181 9.0467 119.6880 56.8946 42.4403 174.8244 5 T 4.8096 8.4631 119.8388 61.6988 72.3916 173.0936 6 L 4.8358 8.2793 124.8305 53.5021 45.3472 175.2411 7 N 5.1337 8.5406 121.1137 51.7897 42.4028 173.5160 8 E 4.6430 8.3727 119.6800 54.9741 33.7502 174.9144 9 V 3.9902 8.2543 121.0898 61.7420 31.6979 175.9803 10 V 4.4548 8.1805 127.0849 59.2235 32.9923 174.4047 11 P 4.5992 0.0000 0.0000 61.0364 29.7549 176.2940 12 L 4.1822 8.4064 127.6653 58.9780 41.5574 178.5373 13 K 3.8536 7.9924 117.7560 59.2483 32.1153 177.8957 14 E 3.9255 7.8986 117.8803 57.5428 29.4489 177.1672 15 F 4.9156 7.4866 115.8652 57.7415 41.0168 176.0589 16 V 4.5152 7.6077 111.9341 58.4304 33.9458 173.6000 17 P 4.5470 0.0000 0.0000 62.4163 31.9098 176.5955 18 E 4.0084 8.7988 118.2179 58.5006 29.4875 177.8297 19 W 4.7219 8.0668 117.4088 54.8461 31.1852 175.3269 20 V 4.6793 8.3112 114.7089 59.7130 35.2487 174.7150 21 R 4.6763 8.4178 119.4900 54.3975 32.5326 175.6675 22 I 4.4140 7.9563 114.0197 58.6749 40.2916 175.1171 23 G 3.6826 7.0272 106.5227 45.9684 0.0000 171.9074 24 F 4.9880 8.1739 116.4445 55.7142 42.4464 174.4623 25 S 4.6648 8.3834 115.9278 56.9441 65.4874 172.9760 26 A 4.5364 8.0534 126.4988 51.4901 21.6065 175.4742 27 T 4.7443 7.9800 109.8530 60.2516 72.0905 172.5352 28 T 4.9653 8.2492 110.9811 60.1381 73.1317 174.9933 29 G 4.2185 8.4872 113.4843 45.1231 0.0000 174.9525 30 A 4.1296 9.1316 127.2586 53.8905 18.4728 177.9537 31 E 4.4299 7.8846 114.2652 54.6842 31.9824 174.4530 32 F 5.2124 6.7838 113.8001 55.9593 41.0665 173.1770 33 A 4.5327 8.1080 120.9809 51.1765 21.4764 175.9252 34 A 4.3050 8.3819 123.3094 51.9210 19.4456 177.0552 35 H 4.8833 8.6136 118.2501 53.9528 31.5525 173.2615 36 E 4.6401 8.5102 122.6497 54.4801 33.4229 174.7479 37 V 4.2129 8.1056 121.3541 61.1046 33.6247 175.2282 38 L 4.5245 8.3404 125.5125 55.8408 43.0659 176.3639 39 S 4.7410 7.5882 110.0585 57.3984 65.5761 173.4114 40 W 5.1531 8.4734 128.7005 56.9219 33.2089 172.7269 41 Y 4.8641 9.0532 126.5930 55.6870 40.8357 174.2009 42 F 4.4480 7.3394 126.7708 56.6485 42.6951 173.2973 43 H 4.3141 6.7274 124.9770 54.7189 32.4812 172.6880 44 S 4.5406 7.8863 120.6030 56.2146 65.9103 173.0422 45 E 4.5183 8.1807 118.2749 54.6665 32.1786 174.5066 46 L 4.4553 8.2406 122.9357 52.8900 44.4301 175.7758 47 A 4.1965 8.6133 129.2845 52.1188 19.1576 177.1836 48 G 3.7161 8.3345 108.2537 45.7401 0.0000 172.7838 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 T 8.17 4.23 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 1.18 0.00 0.00 3 S 8.11 4.67 0.00 3.79 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.05 4.72 0.00 2.90 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.46 4.81 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 6 L 8.28 4.84 0.00 1.55 1.50 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 7 N 8.54 5.13 0.00 2.70 2.66 0.00 0.00 6.78 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 8 E 8.37 4.64 0.00 1.91 1.80 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 2.22 2.24 0.00 9 V 8.25 3.99 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 0.86 0.00 0.00 0.95 0.00 0.00 10 V 8.18 4.45 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 0.90 0.00 0.00 1.01 0.00 0.00 11 P 0.00 4.60 0.00 2.15 2.26 0.00 4.04 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.02 0.00 12 L 8.41 4.18 0.00 1.74 1.85 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.99 3.85 0.00 1.69 1.76 0.00 1.72 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.48 7.81 14 E 7.90 3.93 0.00 1.16 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 15 F 7.49 4.92 0.00 3.07 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 16 V 7.61 4.52 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 0.79 0.00 0.00 1.06 0.00 0.00 17 P 0.00 4.55 0.00 2.27 2.08 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 18 E 8.80 4.01 0.00 2.03 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 2.26 2.33 0.00 19 W 8.07 4.72 0.00 3.23 3.08 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.31 4.68 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 0.79 0.00 0.00 0.95 0.00 0.00 21 R 8.42 4.68 0.00 1.76 1.79 0.00 3.16 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 22 I 7.96 4.41 1.75 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.52 0.78 0.00 0.00 23 G 7.03 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 0.00 0.00 0.00 24 F 8.17 4.99 0.00 2.82 2.64 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 25 S 8.38 4.66 0.00 3.76 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 26 A 8.05 4.54 1.01 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 0.00 0.00 27 T 7.98 4.74 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 1.20 0.00 0.00 28 T 8.25 4.97 4.54 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 1.33 0.00 0.00 29 G 8.49 4.22 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 0.00 30 A 9.13 4.13 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.88 4.43 0.00 1.91 1.60 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 2.12 2.17 0.00 32 F 6.78 5.21 0.00 3.07 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 33 A 8.11 4.53 1.11 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 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.38 4.30 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 35 H 8.61 4.88 0.00 3.03 3.12 0.00 5.84 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.51 4.64 0.00 1.83 1.74 0.00 0.00 0.00 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 2.24 0.00 37 V 8.11 4.21 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 0.55 0.00 0.00 0.08 0.00 0.00 38 L 8.34 4.52 0.00 1.64 1.71 0.89 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 39 S 7.59 4.74 0.00 4.05 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 40 W 8.47 5.15 0.00 3.34 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 41 Y 9.05 4.86 0.00 2.96 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 42 F 7.34 4.45 0.00 2.36 2.35 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 43 H 6.73 4.31 0.00 2.85 2.84 0.00 5.92 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 7.89 4.54 0.00 3.87 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 E 8.18 4.52 0.00 2.00 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 2.10 2.24 0.00 46 L 8.24 4.46 0.00 1.43 1.45 0.83 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.61 4.20 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 G 8.33 3.72 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 0.00 0.00 0.00