NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 E 4.3181 8.3033 121.4705 55.8023 31.0240 176.5771 4 V 3.8334 8.3799 120.0151 64.3186 31.7731 177.5366 5 C 4.6333 8.0958 116.1195 58.7851 40.9391 173.9996 6 S 4.6918 7.6658 112.7023 57.8076 63.1941 174.2410 7 E 4.2684 7.9053 121.0371 55.9814 29.9398 176.8328 8 Q 4.0440 8.3576 120.5524 55.5251 29.4464 176.2386 9 A 3.2707 7.7690 124.1085 51.7791 18.2222 176.9121 10 E 4.5758 8.0033 122.4929 54.5868 31.6523 177.2796 11 T 4.0969 8.6021 121.8118 64.6686 68.8434 175.9188 12 G 4.3777 8.4092 105.9286 45.1436 0.0000 171.4514 13 P 4.3627 0.0000 0.0000 64.9899 31.8068 177.8542 14 C 4.5093 7.8506 116.4666 57.0369 40.7311 173.3097 15 R 4.4180 8.2327 119.0259 56.4408 30.1892 176.6894 16 A 4.3358 7.9161 121.3429 51.0564 20.7329 177.4952 17 M 4.9276 7.8930 116.4588 53.9838 31.2566 173.9372 18 I 4.4580 8.6772 122.7137 59.9101 39.7372 176.3450 19 S 4.1516 8.8235 123.5961 58.6071 63.5717 173.6223 20 R 4.9010 8.0731 122.7853 54.5264 35.0817 173.7299 21 W 5.9529 9.9492 118.8675 55.6889 33.6888 174.5254 22 Y 5.5362 9.4052 120.0739 55.2821 41.5120 173.9985 23 F 4.3011 10.0856 124.8207 57.9678 40.2055 174.8763 24 D 4.3943 8.1334 127.8404 52.4716 40.0747 176.7790 25 V 3.7872 8.3958 120.8646 64.7828 31.9719 178.3758 26 T 3.9979 7.9000 115.2335 66.4817 68.2057 175.2510 27 E 4.1025 8.1827 118.9097 56.0729 30.1239 177.7226 28 G 3.9793 8.1917 106.7305 45.5112 0.0000 172.7352 29 K 4.5249 6.6599 118.4286 55.0132 36.7707 174.3751 30 C 4.9115 8.5780 117.2551 56.4978 42.4286 173.4129 31 A 5.1586 8.8691 124.0682 49.3551 22.3623 173.7405 32 P 4.0641 0.0000 0.0000 62.5594 32.5354 175.2276 33 F 4.7032 8.1029 115.2145 56.0538 41.8799 172.5712 34 F 5.0400 8.5906 118.3126 56.0940 40.2924 174.9034 35 Y 4.7847 9.2514 126.5384 56.7779 39.8881 176.3956 36 G 3.8895 8.3020 113.3419 46.1447 0.0000 175.0191 37 G 3.9338 6.6485 106.9065 45.5541 0.0000 172.2312 38 C 4.8312 7.4836 112.8226 55.0736 45.0369 174.4769 39 G 3.8918 9.1376 107.8472 47.7112 0.0000 173.1541 40 G 3.9782 9.1454 109.7964 45.3261 0.0000 170.1172 41 N 4.9724 8.1338 117.3086 51.6308 40.3089 174.1940 42 R 3.9110 7.6377 114.0375 58.1410 30.7968 177.0402 43 N 4.4037 7.7777 119.1758 51.6278 37.4618 175.4891 44 N 4.9240 6.4085 116.5001 52.6311 41.1193 172.8759 45 F 5.2044 9.5942 125.2272 55.6903 42.3259 176.5340 46 D 4.3842 9.0535 122.3501 56.5350 41.3970 177.2883 47 T 4.6505 7.7064 108.3218 58.8883 73.2246 174.2800 48 E 2.9447 7.3197 121.8749 58.8035 29.3915 179.0319 49 E 3.7799 7.6087 118.3193 59.5574 29.6976 178.5214 50 Y 4.2687 7.9913 119.5330 60.5336 38.7256 177.0985 51 C 2.7948 7.9295 119.6013 59.4344 42.9133 175.4118 52 M 3.8800 8.0347 120.2796 58.3665 31.3077 178.5553 53 A 3.8580 7.8994 120.0959 54.9223 18.5520 179.4855 54 V 3.4844 7.0597 115.4621 65.4812 31.8286 176.8182 55 C 4.4478 8.3370 114.1293 56.7968 41.3291 174.1193 56 G 3.7237 7.9285 113.9186 45.4528 0.0000 173.1557 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 3 E 8.30 4.32 0.00 2.05 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.46 0.00 4 V 8.38 3.83 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.99 0.00 0.00 5 C 8.10 4.63 0.00 2.79 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 7.67 4.69 0.00 3.97 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 7.91 4.27 0.00 2.12 1.91 0.00 0.00 0.00 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 2.49 0.00 8 Q 8.36 4.04 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.93 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 9 A 7.77 3.27 -0.65 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 10 E 8.00 4.58 0.00 1.99 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.39 0.00 11 T 8.60 4.10 4.32 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 1.30 0.00 0.00 12 G 8.41 4.38 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 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.36 0.00 2.18 2.19 0.00 3.98 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 14 C 7.85 4.51 0.00 2.82 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.23 4.42 0.00 1.74 1.88 0.00 3.32 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 16 A 7.92 4.34 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.89 4.93 0.00 1.80 1.73 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.82 0.00 18 I 8.68 4.46 2.09 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 1.27 0.77 1.01 0.00 0.00 19 S 8.82 4.15 0.00 3.79 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 20 R 8.07 4.90 0.00 0.67 1.88 0.00 3.27 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 21 W 9.95 5.95 0.00 3.46 3.31 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 22 Y 9.41 5.54 0.00 3.14 2.84 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 0.00 0.00 0.00 23 F 10.09 4.30 0.00 3.09 3.27 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 0.00 24 D 8.13 4.39 0.00 2.00 2.27 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 0.00 25 V 8.40 3.79 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 0.96 0.00 0.00 0.98 0.00 0.00 26 T 7.90 4.00 4.40 0.00 0.00 0.00 0.00 0.00 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 27 E 8.18 4.10 0.00 1.84 1.87 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 2.31 2.29 0.00 28 G 8.19 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 6.66 4.52 0.00 1.71 1.79 0.00 1.28 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.22 7.81 30 C 8.58 4.91 0.00 2.91 3.31 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 31 A 8.87 5.16 1.03 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 0.00 0.00 32 P 0.00 4.06 0.00 1.28 0.49 0.00 3.63 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.54 0.00 33 F 8.10 4.70 0.00 2.95 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 8.59 5.04 0.00 2.98 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.25 4.78 0.00 2.64 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 36 G 8.30 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 6.65 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 38 C 7.48 4.83 0.00 3.07 3.10 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.14 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.15 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.13 4.97 0.00 2.85 2.76 0.00 0.00 5.91 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 42 R 7.64 3.91 0.00 1.85 1.96 0.00 3.15 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.54 0.00 43 N 7.78 4.40 0.00 2.95 2.86 0.00 0.00 6.84 7.81 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 44 N 6.41 4.92 0.00 2.57 2.40 0.00 0.00 7.09 7.02 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 45 F 9.59 5.20 0.00 3.28 3.10 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.05 4.38 0.00 2.79 2.83 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 47 T 7.71 4.65 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 48 E 7.32 2.94 0.00 1.16 1.12 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 0.00 1.91 1.67 0.00 49 E 7.61 3.78 0.00 1.97 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 2.28 2.20 0.00 50 Y 7.99 4.27 0.00 2.98 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 C 7.93 2.79 0.00 3.24 3.13 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 0.00 0.00 0.00 0.00 52 M 8.03 3.88 0.00 1.97 2.11 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.79 0.00 53 A 7.90 3.86 1.28 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 0.00 0.00 0.00 54 V 7.06 3.48 1.15 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 0.75 0.00 0.00 0.09 0.00 0.00 55 C 8.34 4.45 0.00 2.88 2.27 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 0.00 56 G 7.93 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