NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3064 8.1631 117.3743 63.1182 69.4558 173.5930 2 G 3.5729 8.4733 115.9498 44.7267 0.0000 171.6156 3 A 4.2513 8.5995 123.3258 53.9841 21.0532 177.0990 4 G 4.4146 7.4733 111.4159 44.7628 0.0000 175.6887 5 T 3.8645 9.1087 121.6953 65.9470 68.5772 173.8678 6 P 4.2689 0.0000 0.0000 65.9020 31.0298 178.0033 7 S 4.4552 8.1308 113.6576 59.8587 63.1517 175.8945 8 Q 3.8524 8.1605 119.9516 57.8835 28.7782 178.4490 9 G 3.6526 7.5232 105.1650 47.9335 0.0000 174.5860 10 K 4.2162 7.4127 117.1313 56.9220 32.2326 177.9742 11 K 4.3663 7.5300 120.2212 55.2917 30.3852 175.7721 12 N 5.0529 8.1604 119.7122 52.4124 38.3446 174.6975 13 T 4.3738 7.9560 115.1722 63.3012 69.7295 174.3762 14 T 4.3493 8.3831 123.4174 62.9393 69.0016 172.7231 15 T 4.3190 7.6800 114.7976 63.1733 71.0715 172.7444 16 H 5.0104 7.9490 120.2384 54.8154 29.8564 174.2861 17 T 4.8183 9.4814 113.8843 58.9628 72.8415 173.0613 18 K 4.4363 8.6537 123.3130 57.0094 32.8647 175.4783 19 C 4.2969 9.4079 128.8920 58.6808 32.1575 174.4203 20 R 3.7424 8.5030 126.4931 59.1221 30.0859 177.3998 21 R 3.7685 7.3619 116.8549 57.9529 30.3321 176.4182 22 C 4.4055 8.0297 109.7336 57.5460 31.1318 174.7071 23 G 3.9253 8.2198 108.2156 44.8643 0.0000 173.2337 24 E 4.2984 7.6954 119.0728 54.9012 31.2142 176.4669 25 K 4.5939 8.1205 124.5576 56.1951 29.8170 176.6145 26 S 4.7610 7.8453 114.1585 58.0310 66.4729 174.5993 27 Y 4.6121 8.7982 123.7604 57.2794 39.4097 174.3322 28 H 4.3705 9.0825 129.3634 56.0257 29.9076 175.6840 29 T 3.3793 9.2014 123.1266 64.3984 67.1181 175.4387 30 K 4.2366 8.1599 119.6348 58.9686 32.7504 178.1026 31 K 4.0105 7.9741 115.9034 56.6327 32.7053 176.8299 32 K 3.2457 8.6758 118.7994 57.1442 29.9562 175.2756 33 V 4.5281 6.8493 116.1875 61.0650 34.9421 173.1853 34 C 5.0624 9.0937 127.7321 58.3073 32.0327 174.4650 35 S 4.3906 8.8665 122.2386 60.3111 63.1621 175.2915 36 S 4.4485 8.1924 115.5541 60.2878 62.8000 174.3271 37 C 4.4108 8.1321 112.9577 57.6502 30.6055 175.0174 38 G 4.0357 8.3906 109.2847 45.4409 0.0000 173.0083 39 F 4.5542 8.1111 122.2248 59.7706 39.6961 176.0076 40 G 3.7277 8.7067 115.4990 46.1110 0.0000 173.5247 41 K 4.3778 8.1915 119.2382 57.2231 33.6830 176.2613 42 S 4.7097 7.6516 109.8258 56.1279 66.0186 173.7268 43 A 4.1503 8.6715 125.2514 55.1177 18.4558 178.6821 44 K 4.2987 7.6945 113.4414 56.0095 33.0181 176.5319 45 R 4.4073 8.1597 120.0905 55.5259 30.9153 176.6749 46 R 3.8396 8.8741 125.1838 56.9201 30.5079 175.1687 47 D 4.4902 7.5080 122.9618 53.9276 44.3064 174.0450 48 Y 4.5196 8.6869 121.0168 56.3534 42.1425 176.3548 49 E 4.0072 8.7155 123.0051 58.8656 29.8216 178.6796 50 W 4.5736 7.7120 113.6698 57.8145 28.4144 176.7404 51 Q 4.3813 7.5738 118.1483 57.2815 28.2220 175.4321 52 S 4.7318 7.6575 111.7591 56.1824 66.5888 173.9618 53 K 4.0886 8.5128 119.7216 56.2839 32.5042 177.9173 54 A 3.9919 8.9727 125.9614 55.5946 18.1473 179.2231 55 G 4.0970 7.9397 101.6152 45.2867 0.0000 173.2757 56 E 4.1809 8.0621 126.5614 56.2214 29.8859 174.5936 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 T 8.16 4.31 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 1.21 0.00 0.00 2 G 8.47 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 A 8.60 4.25 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 4 G 7.47 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.11 3.86 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 1.21 0.00 0.00 6 P 0.00 4.27 0.00 2.21 2.32 0.00 3.59 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.00 0.00 7 S 8.13 4.46 0.00 4.24 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 8 Q 8.16 3.85 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.81 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 9 G 7.52 3.65 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 0.00 10 K 7.41 4.22 0.00 1.74 1.86 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.40 7.81 11 K 7.53 4.37 0.00 1.81 1.78 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.37 7.81 12 N 8.16 5.05 0.00 2.76 2.82 0.00 0.00 6.29 7.71 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 13 T 7.96 4.37 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 14 T 8.38 4.35 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 1.22 0.00 0.00 15 T 7.68 4.32 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 16 H 7.95 5.01 0.00 3.09 3.52 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 17 T 9.48 4.82 4.33 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 1.27 0.00 0.00 18 K 8.65 4.44 0.00 1.81 1.78 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.41 1.58 7.81 19 C 9.41 4.30 0.00 3.16 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 20 R 8.50 3.74 0.00 1.60 1.59 0.00 3.23 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.53 0.00 21 R 7.36 3.77 0.00 0.67 1.37 0.00 3.20 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.29 0.00 22 C 8.03 4.41 0.00 3.07 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 23 G 8.22 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 24 E 7.70 4.30 0.00 1.94 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 2.38 2.26 0.00 25 K 8.12 4.59 0.00 1.80 1.78 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.52 7.81 26 S 7.85 4.76 0.00 3.86 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 27 Y 8.80 4.61 0.00 3.13 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 28 H 9.08 4.37 0.00 3.17 3.07 0.00 5.84 0.00 0.00 0.00 0.00 6.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 9.20 3.38 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 1.20 0.00 0.00 30 K 8.16 4.24 0.00 1.87 1.85 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.43 7.81 31 K 7.97 4.01 0.00 1.55 1.72 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.53 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.21 0.86 7.81 32 K 8.68 3.25 0.00 1.76 1.89 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.50 7.81 33 V 6.85 4.53 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 1.08 0.00 0.00 0.92 0.00 0.00 34 C 9.09 5.06 0.00 3.41 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 35 S 8.87 4.39 0.00 4.10 4.08 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 36 S 8.19 4.45 0.00 3.90 3.97 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.13 4.41 0.00 3.15 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 38 G 8.39 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 39 F 8.11 4.55 0.00 3.04 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 8.71 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 41 K 8.19 4.38 0.00 1.70 1.99 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.35 7.81 42 S 7.65 4.71 0.00 3.96 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.67 4.15 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 44 K 7.69 4.30 0.00 1.74 1.71 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.45 7.81 45 R 8.16 4.41 0.00 1.64 1.81 0.00 3.36 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 46 R 8.87 3.84 0.00 1.88 1.98 0.00 3.44 0.00 0.00 3.39 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 47 D 7.51 4.49 0.00 2.58 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 0.00 0.00 0.00 48 Y 8.69 4.52 0.00 1.43 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.72 4.01 0.00 2.04 2.03 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 2.38 2.25 0.00 50 W 7.71 4.57 0.00 3.42 3.21 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 51 Q 7.57 4.38 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.72 0.00 0.00 0.00 0.00 0.00 2.18 1.40 0.00 52 S 7.66 4.73 0.00 3.88 3.80 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 0.00 0.00 0.00 53 K 8.51 4.09 0.00 1.83 1.80 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.41 7.81 54 A 8.97 3.99 1.32 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 0.00 0.00 0.00 55 G 7.94 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 0.00 0.00 0.00 0.00 56 E 8.06 4.18 0.00 1.93 1.77 0.00 0.00 0.00 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 2.26 0.00