NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 111 S 3.5273 8.3349 116.6623 58.0368 65.9144 171.7191 112 F 4.6783 9.0097 119.5627 56.2941 39.0973 175.9462 113 Q 4.8436 9.4860 129.0892 56.8989 32.5763 170.9277 114 C 5.0729 8.4858 122.1301 58.5354 32.6443 173.0658 115 S 4.8687 8.2664 114.8495 58.0042 62.8133 173.8930 116 N 4.9621 7.9506 118.2667 54.6658 45.7800 175.0947 117 C 4.1512 7.4516 114.6880 58.0608 29.0909 171.9385 118 S 4.1056 8.7603 121.7842 59.8218 58.5690 168.0790 119 V 4.1950 9.3874 115.3909 59.9590 33.8043 175.5293 120 T 4.0806 8.6419 122.8860 66.5916 68.5557 175.2330 121 E 4.2885 7.3160 121.6786 55.2008 27.8474 173.9581 122 T 4.0686 7.4967 116.1218 61.3588 68.9980 174.4635 123 I 3.7437 8.1537 128.0104 64.1757 38.0142 176.3770 124 R 4.5458 7.3542 116.8515 55.0798 33.5637 174.9737 125 W 5.0984 8.9768 123.2022 56.6412 30.4301 176.5544 126 R 4.5155 8.3195 114.4818 57.6630 32.0021 175.0361 127 N 4.3837 8.9054 117.1292 55.1687 38.5674 173.3206 128 I 3.2198 7.8202 113.1377 60.9252 35.4001 169.7819 129 R 3.7877 7.6545 122.2251 55.9153 28.7334 174.8573 130 S 4.7240 7.4926 120.1834 58.2823 70.0800 175.1543 131 K 4.4755 7.3609 122.0085 58.4638 36.6462 177.7117 132 E 4.2858 7.8983 119.6835 54.9336 30.6718 177.2558 133 G 3.9197 8.5389 106.4044 45.4326 0.0000 171.7013 134 I 4.5187 7.9631 130.6022 59.5953 35.4346 175.5768 135 Q 4.7483 8.7513 127.7720 58.4946 30.1990 177.0184 136 C 4.6038 7.9790 111.6185 58.0177 30.5338 172.4191 137 N 4.8585 8.3517 114.2710 52.7303 38.5071 176.7287 138 A 4.0370 7.9678 122.7082 55.7089 19.1557 179.3212 139 C 4.3566 8.3125 113.2709 63.2180 28.5144 176.1950 140 F 3.9592 8.3801 119.8055 61.3757 39.4323 176.9509 141 I 4.0755 7.9332 121.9854 64.4631 36.4268 178.1035 142 Y 4.2861 8.5791 119.0019 60.0487 37.8713 177.9518 143 Q 3.2793 7.5859 117.7425 57.2988 28.0861 178.3620 144 R 3.8883 7.6071 120.1719 59.4763 29.9876 178.3377 145 K 4.3235 7.3229 117.9238 58.0548 32.4628 177.4473 146 Y 4.1550 7.7696 113.8897 58.5379 38.0250 175.0609 147 N 4.7966 7.7964 118.2329 54.5020 41.3794 173.6385 148 K 4.2468 7.2456 113.9789 56.7043 35.1166 174.3153 149 T 4.2227 8.4439 117.3978 63.2950 67.4061 174.1658 150 R 3.8715 8.4361 122.5526 55.6828 29.9481 174.9945 151 P 4.2480 0.0000 0.0000 62.9603 31.8336 177.4592 152 V 3.7806 8.4210 121.7438 64.8224 31.5861 177.8841 153 T 3.8441 7.4806 114.7939 67.4730 68.5379 176.0826 154 A 4.1479 8.0311 121.7362 54.9756 18.4350 179.7604 155 V 3.6126 7.6609 116.9294 65.9579 31.5056 177.4278 156 N 4.3027 8.1260 116.0152 56.4301 37.1335 176.8706 157 K 4.1886 7.8108 119.2136 58.2939 32.1724 178.3872 158 Y 4.0247 7.8359 120.0628 60.9443 38.5324 177.8747 159 Q 3.9852 8.2793 120.0464 59.2777 28.6949 178.5213 160 K 3.7234 8.0191 120.2570 59.3926 32.3360 178.1207 161 R 4.0319 7.9593 118.7815 58.7638 30.0949 178.3504 162 K 4.1736 7.7264 115.2141 58.2625 32.2320 177.5234 163 L 4.3997 7.8209 117.8768 55.4095 42.4082 178.2117 164 K 4.1902 7.9170 118.0431 58.4336 32.3926 177.6122 165 V 4.5675 7.1996 109.4861 59.7426 35.4001 175.5580 166 Q 4.2102 8.4615 119.7973 56.9339 27.8235 173.9249 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 111 S 8.33 3.53 0.00 3.78 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 0.00 112 F 9.01 4.68 0.00 3.54 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 9.49 4.84 0.00 2.29 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.59 6.96 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 114 C 8.49 5.07 0.00 3.00 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 0.00 115 S 8.27 4.87 0.00 3.90 3.85 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 0.00 116 N 7.95 4.96 0.00 2.66 2.79 0.00 0.00 7.11 7.68 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 0.00 117 C 7.45 4.15 0.00 2.89 2.78 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 0.00 0.00 0.00 0.00 118 S 8.76 4.11 0.00 4.02 4.06 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 0.00 0.00 0.00 0.00 119 V 9.39 4.20 1.97 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 0.80 0.00 0.00 0.77 0.00 0.00 120 T 8.64 4.08 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 1.36 0.00 0.00 121 E 7.32 4.29 0.00 1.88 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 2.32 2.35 0.00 122 T 7.50 4.07 2.69 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 0.00 0.00 0.00 0.83 0.00 0.00 123 I 8.15 3.74 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.76 0.89 0.00 0.00 124 R 7.35 4.55 0.00 1.82 1.84 0.00 3.52 0.00 0.00 3.32 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 125 W 8.98 5.10 0.00 3.29 3.35 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 0.00 126 R 8.32 4.52 0.00 1.75 2.31 0.00 3.19 0.00 0.00 3.02 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.46 0.00 127 N 8.91 4.38 0.00 2.81 2.79 0.00 0.00 7.08 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 0.00 128 I 7.82 3.22 1.84 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 1.31 0.64 1.06 0.00 0.00 129 R 7.65 3.79 0.00 1.78 1.88 0.00 3.29 0.00 0.00 3.21 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 130 S 7.49 4.72 0.00 3.85 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 0.00 131 K 7.36 4.48 0.00 1.79 1.78 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.30 1.46 7.81 132 E 7.90 4.29 0.00 1.99 1.96 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 0.00 2.32 2.37 0.00 133 G 8.54 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 0.00 0.00 0.00 134 I 7.96 4.52 2.08 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.94 1.05 0.00 0.00 135 Q 8.75 4.75 0.00 2.62 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.73 0.00 0.00 0.00 0.00 0.00 1.45 1.16 0.00 136 C 7.98 4.60 0.00 3.02 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 0.00 137 N 8.35 4.86 0.00 2.88 3.25 0.00 0.00 5.84 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.97 4.04 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 0.00 139 C 8.31 4.36 0.00 3.09 3.06 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 0.00 0.00 0.00 0.00 140 F 8.38 3.96 0.00 3.08 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.93 4.08 2.13 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.41 1.00 0.00 0.00 142 Y 8.58 4.29 0.00 3.11 3.34 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 0.00 0.00 0.00 0.00 143 Q 7.59 3.28 0.00 2.25 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.52 0.00 0.00 0.00 0.00 0.00 1.95 2.20 0.00 144 R 7.61 3.89 0.00 1.85 2.03 0.00 3.16 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 1.72 1.90 0.00 145 K 7.32 4.32 0.00 1.68 1.55 0.00 1.51 0.00 0.00 1.43 0.00 0.00 2.64 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.34 1.35 7.81 146 Y 7.77 4.15 0.00 2.51 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 0.00 147 N 7.80 4.80 0.00 2.59 2.75 0.00 0.00 7.01 6.66 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 0.00 148 K 7.25 4.25 0.00 1.93 1.86 0.00 1.35 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.28 1.35 7.81 149 T 8.44 4.22 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 1.18 0.00 0.00 150 R 8.44 3.87 0.00 1.88 1.96 0.00 3.06 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 151 P 0.00 4.25 0.00 2.21 2.05 0.00 3.61 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 2.14 2.10 0.00 152 V 8.42 3.78 2.08 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 1.09 0.00 0.00 0.92 0.00 0.00 153 T 7.48 3.84 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 1.23 0.00 0.00 154 A 8.03 4.15 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 V 7.66 3.61 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 0.94 0.00 0.00 0.86 0.00 0.00 156 N 8.13 4.30 0.00 2.91 3.20 0.00 0.00 7.47 7.24 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 0.00 157 K 7.81 4.19 0.00 2.02 1.92 0.00 1.59 0.00 0.00 1.60 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.50 7.81 158 Y 7.84 4.02 0.00 3.21 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 0.00 159 Q 8.28 3.99 0.00 2.49 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.62 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 160 K 8.02 3.72 0.00 1.91 1.76 0.00 1.83 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.45 7.81 161 R 7.96 4.03 0.00 1.59 1.43 0.00 3.11 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.66 0.00 162 K 7.73 4.17 0.00 1.85 1.92 0.00 1.99 0.00 0.00 2.02 0.00 0.00 3.07 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.53 1.62 7.81 163 L 7.82 4.40 0.00 1.64 1.71 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 164 K 7.92 4.19 0.00 1.87 1.83 0.00 1.62 0.00 0.00 1.67 0.00 0.00 3.12 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.56 7.81 165 V 7.20 4.57 2.08 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 0.75 0.00 0.00 0.92 0.00 0.00 166 Q 8.46 4.21 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.66 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00