NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 M 4.6355 8.2931 120.3270 55.5223 34.8606 175.0440 26 G 4.1293 8.3709 109.9763 45.4257 0.0000 174.0838 27 D 5.0072 9.3281 119.1267 51.9565 44.6946 172.8829 28 K 4.6801 8.3435 121.4103 54.7004 35.4461 174.9993 29 T 4.6808 8.1835 111.0928 59.6806 70.8804 173.8934 30 V 4.3936 7.9171 122.2616 61.1888 34.7173 174.5542 31 R 4.3290 8.5238 125.6255 55.3790 30.7452 176.2562 32 V 4.4973 7.9350 115.1991 58.4196 35.4749 176.0734 33 R 3.8521 8.5900 119.4393 57.1756 30.8106 177.8527 34 A 4.0908 8.7381 125.7856 55.0755 18.1849 179.0574 35 D 4.3590 8.0924 117.2788 56.1175 39.7173 178.6268 36 L 4.1273 7.7988 120.1244 57.7124 42.0592 178.1310 37 H 4.0913 8.2574 118.1585 59.5764 29.6685 176.4847 38 H 4.1394 8.5404 119.9929 59.5164 29.8247 176.9403 39 I 3.5766 7.3603 120.0552 64.9038 36.9627 178.4496 40 I 3.7815 7.6827 119.8464 63.9096 36.8845 178.5658 41 K 3.8709 7.9205 119.4760 59.5152 31.9548 178.9953 42 I 3.6312 7.4951 119.8022 64.5845 37.0447 178.0633 43 E 3.9038 8.0244 119.6723 59.6140 29.3492 179.0190 44 T 4.4074 8.1106 109.4408 64.0207 68.8055 176.0951 45 A 4.0947 8.2280 123.6096 54.7845 18.4922 179.2865 46 K 4.0086 7.8527 116.8033 61.0203 32.9527 176.3261 47 N 4.8979 8.3595 116.6088 51.9348 40.7343 174.8784 48 G 3.8038 8.2529 108.4151 46.0097 0.0000 171.3438 49 G 3.9818 7.9638 103.8025 44.6389 0.0000 172.9570 50 N 4.9153 8.4685 115.8926 50.6933 41.5433 175.2267 51 V 3.6258 8.2646 119.7440 65.9069 31.4932 177.8211 52 K 3.9581 7.9699 119.0211 59.3670 32.1378 178.2281 53 E 3.9450 8.9823 119.3668 59.6445 29.3584 179.7017 54 V 3.5937 7.4358 116.7343 66.1358 31.5837 177.7820 55 M 4.0961 7.8969 118.0905 58.6700 31.8682 178.2545 56 D 4.3919 8.3506 119.1179 57.5506 41.0284 179.0123 57 Q 3.8655 8.2539 119.4105 59.1698 29.1294 177.6541 58 A 4.0281 8.6780 122.4880 55.4136 18.3186 179.4443 59 L 3.9156 8.3908 118.9212 58.2158 42.1128 178.7225 60 E 3.9599 8.2212 119.3353 59.4709 29.6507 178.7038 61 E 3.9705 8.7635 119.0776 59.3157 29.4801 178.6621 62 Y 4.0536 8.3483 119.7339 60.9499 38.9690 178.0564 63 I 3.8943 8.7535 121.0240 64.5409 36.9955 178.6122 64 R 3.8782 8.0400 118.0479 59.1962 30.0150 178.7141 65 K 3.8051 7.5519 117.8055 58.8868 32.2147 177.4910 66 Y 4.6994 7.5946 113.6023 57.3691 40.9565 175.7452 67 L 4.9996 8.2775 120.5248 53.0808 42.8419 176.0755 68 P 4.2132 0.0000 0.0000 66.9638 32.0547 179.0175 69 D 4.4909 7.6091 117.5680 55.7311 40.3823 178.5621 70 K 4.3107 7.5228 121.6548 55.8122 29.4512 176.9086 71 L 4.1913 7.8606 123.4710 54.9580 42.0396 176.2782 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 25 M 8.29 4.64 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.55 0.00 26 G 8.37 4.13 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 0.00 0.00 0.00 27 D 9.33 5.01 0.00 2.64 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.34 4.68 0.00 1.64 1.64 0.00 1.61 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.29 1.43 7.81 29 T 8.18 4.68 4.23 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 1.21 0.00 0.00 30 V 7.92 4.39 2.06 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 0.83 0.00 0.00 0.91 0.00 0.00 31 R 8.52 4.33 0.00 1.82 1.83 0.00 3.34 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 32 V 7.94 4.50 2.07 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 0.73 0.00 0.00 0.95 0.00 0.00 33 R 8.59 3.85 0.00 1.85 2.10 0.00 3.13 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 34 A 8.74 4.09 1.31 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 0.00 0.00 35 D 8.09 4.36 0.00 2.91 2.96 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 0.00 0.00 0.00 36 L 7.80 4.13 0.00 1.86 1.75 0.93 1.03 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 37 H 8.26 4.09 0.00 3.21 3.45 0.00 5.59 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 H 8.54 4.14 0.00 3.42 3.51 0.00 5.86 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 39 I 7.36 3.58 2.02 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 1.49 0.97 0.89 0.00 0.00 40 I 7.68 3.78 1.92 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 1.74 0.87 0.88 0.00 0.00 41 K 7.92 3.87 0.00 1.95 1.84 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.27 1.37 7.81 42 I 7.50 3.63 1.93 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 1.39 0.87 0.87 0.00 0.00 43 E 8.02 3.90 0.00 2.09 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 2.29 2.35 0.00 44 T 8.11 4.41 4.23 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 1.27 0.00 0.00 45 A 8.23 4.09 1.39 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 46 K 7.85 4.01 0.00 1.89 1.94 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.47 7.81 47 N 8.36 4.90 0.00 2.80 2.77 0.00 0.00 7.12 7.21 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 48 G 8.25 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 0.00 0.00 0.00 49 G 7.96 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 50 N 8.47 4.92 0.00 2.88 2.89 0.00 0.00 5.62 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 51 V 8.26 3.63 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 1.05 0.00 0.00 0.91 0.00 0.00 52 K 7.97 3.96 0.00 1.87 1.79 0.00 1.79 0.00 0.00 1.90 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.60 1.53 7.81 53 E 8.98 3.94 0.00 2.30 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 54 V 7.44 3.59 2.21 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 1.03 0.00 0.00 0.99 0.00 0.00 55 M 7.90 4.10 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.63 0.00 56 D 8.35 4.39 0.00 2.81 2.74 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 0.00 0.00 0.00 57 Q 8.25 3.87 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 58 A 8.68 4.03 1.40 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 0.00 0.00 0.00 59 L 8.39 3.92 0.00 1.90 1.70 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.22 3.96 0.00 2.22 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 2.33 2.38 0.00 61 E 8.76 3.97 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.55 0.00 62 Y 8.35 4.05 0.00 3.17 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 8.75 3.89 2.02 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.77 1.01 0.00 0.00 64 R 8.04 3.88 0.00 1.90 1.95 0.00 3.16 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 65 K 7.55 3.81 0.00 1.61 1.31 0.00 1.48 0.00 0.00 1.22 0.00 0.00 2.66 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.30 0.97 7.81 66 Y 7.59 4.70 0.00 2.49 2.66 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 67 L 8.28 5.00 0.00 1.76 1.59 1.11 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.21 0.00 2.16 2.28 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.92 0.00 69 D 7.61 4.49 0.00 2.81 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 K 7.52 4.31 0.00 1.92 1.85 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.55 7.81 71 L 7.86 4.19 0.00 1.58 1.54 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00