#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i9c s LYS 2 N 0.00 3.27 0.10 0.03 0.00 -1.26 -5.06 119.74 116.82 3i9c s LYS 2 Ca 0.00 -0.70 -0.31 0.00 0.00 0.00 0.00 55.97 54.97 3i9c s LYS 2 Cb 0.00 -3.01 -0.09 0.00 0.00 0.00 0.00 37.83 34.72 3i9c s LYS 2 CO 0.00 -0.24 1.74 -1.21 0.00 0.00 0.00 175.35 175.63 3i9c s GLU 3 N 1.45 4.17 1.02 1.78 0.41 -1.26 -4.55 118.70 121.72 3i9c s GLU 3 Ca 0.05 2.46 0.00 0.00 -0.41 0.00 0.00 54.97 57.07 3i9c s GLU 3 Cb -0.15 -3.59 0.00 0.00 -1.78 0.00 0.00 34.13 28.61 3i9c s GLU 3 CO -0.03 -0.78 0.00 0.41 -0.49 0.00 0.00 175.26 174.36 3i9c n GLY 4 N 4.11 -1.60 3.66 -1.39 0.00 -1.26 -4.84 105.19 103.87 3i9c n GLY 4 Ca 0.17 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 45.01 3i9c n GLY 4 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3i9c n ILE 5 N -2.45 0.00 0.00 -0.61 0.00 -1.26 -4.98 119.36 110.06 3i9c n ILE 5 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62.75 62.75 3i9c n ILE 5 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 39.64 39.88 3i9c n ILE 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3i9c n HIS 6 N -1.49 0.00 -2.79 9.51 -0.00 -1.26 -4.99 115.22 114.20 3i9c n HIS 6 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.31 3i9c n HIS 6 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 29.94 3i9c n HIS 6 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.34 174.20 3i9c s PRO 7 N 0.00 4.68 0.67 -1.40 0.02 -1.26 -5.05 135.00 132.66 3i9c s PRO 7 Ca 0.00 1.38 -0.11 0.00 0.02 0.00 0.00 61.00 62.29 3i9c s PRO 7 Cb 0.00 -3.35 0.17 0.00 0.02 0.00 0.00 34.50 31.34 3i9c s PRO 7 CO 0.00 0.29 0.42 1.63 -0.33 0.00 0.00 177.00 179.02 3i9c n LYS 8 N 2.52 -3.11 -3.34 5.54 4.76 -1.26 -5.03 118.16 118.23 3i9c n LYS 8 Ca 0.00 -0.71 -0.17 0.00 -2.87 0.00 0.00 58.31 54.57 3i9c n LYS 8 Cb 0.49 -0.86 -0.07 0.00 -1.84 0.00 0.00 35.03 32.74 3i9c n LYS 8 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3i9c s LEU 9 N 0.00 -0.01 0.00 -0.35 2.96 -1.26 -4.72 118.68 115.30 3i9c s LEU 9 Ca 0.32 -1.70 0.00 0.00 -0.22 0.00 0.00 54.13 52.53 3i9c s LEU 9 Cb -0.05 0.54 0.00 0.00 0.50 0.00 0.00 46.19 47.18 3i9c s LEU 9 CO 0.26 -0.24 0.00 0.52 -1.32 0.00 0.00 176.35 175.57 3i9c n VAL 10 N 4.09 0.00 0.00 1.68 0.31 -1.26 -5.03 118.33 118.12 3i9c n VAL 10 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 3i9c n VAL 10 Cb 0.45 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.38 3i9c n VAL 10 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3i9c n PRO 11 N 0.00 0.00 0.00 5.55 -0.02 -1.26 -4.78 135.00 134.49 3i9c n PRO 11 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3i9c n PRO 11 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 3i9c n PRO 11 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3i9c n ALA 12 N -3.00 0.00 0.00 3.55 0.00 -1.25 -2.12 120.51 117.69 3i9c n ALA 12 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3i9c n ALA 12 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3i9c n ALA 12 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3i9c n ARG 13 N -0.44 0.00 -4.11 0.00 3.00 -1.24 -4.65 116.66 109.21 3i9c n ARG 13 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.85 57.77 3i9c n ARG 13 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.36 3i9c n ARG 13 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 3i9c s ILE 14 N 0.00 0.16 0.07 5.15 2.07 -1.06 -2.94 121.20 124.65 3i9c s ILE 14 Ca 0.00 -1.84 0.02 0.00 -1.41 0.00 0.00 60.65 57.42 3i9c s ILE 14 Cb 0.00 -1.79 -0.04 0.00 0.13 0.00 0.00 42.46 40.76 3i9c s ILE 14 CO 0.00 -0.71 0.13 -0.63 -1.91 0.00 0.00 174.94 171.82 3i9c s ILE 15 N -3.98 4.89 -0.09 2.00 1.09 -0.87 -4.17 121.20 120.07 3i9c s ILE 15 Ca 0.16 -0.61 0.03 0.00 -1.10 0.00 0.00 60.65 59.13 3i9c s ILE 15 Cb 0.08 -3.37 0.01 0.00 -1.06 0.00 0.00 42.46 38.12 3i9c s ILE 15 CO -0.04 0.13 -0.18 0.00 -0.10 0.00 0.00 174.94 174.76 3i9c n GLY 17 N 3.80 -0.17 0.10 0.00 0.00 0.23 -0.36 105.19 108.79 3i9c n GLY 17 Ca -0.21 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.75 3i9c n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i9c n GLY 19 N 3.01 -1.14 4.00 0.00 0.00 0.51 -5.11 105.19 106.47 3i9c n GLY 19 Ca -0.16 0.42 -0.20 0.00 0.00 0.00 0.00 46.02 46.07 3i9c n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i9c s ASN 20 N -4.00 5.12 0.00 1.61 4.22 -1.26 -3.30 114.94 117.32 3i9c s ASN 20 Ca 0.00 -0.84 0.00 0.00 -2.14 0.00 0.00 52.86 49.88 3i9c s ASN 20 Cb 0.00 0.11 0.00 0.00 1.28 0.00 0.00 41.25 42.64 3i9c s ASN 20 CO 0.00 -1.17 0.00 1.33 -2.04 0.00 0.00 177.10 175.22 3i9c n VAL 21 N -2.07 0.00 -0.29 3.54 0.24 -1.26 -4.50 118.33 113.99 3i9c n VAL 21 Ca 0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.41 3i9c n VAL 21 Cb 0.62 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.99 3i9c n VAL 21 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3i9c n ILE 22 N 0.00 0.00 0.00 1.34 3.06 -1.26 -2.56 119.36 119.94 3i9c n ILE 22 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 3i9c n ILE 22 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 3i9c n ILE 22 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 3i9c n GLU 23 N 0.00 0.00 0.00 9.51 -0.58 -1.26 -4.48 120.64 123.82 3i9c n GLU 23 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 3i9c n GLU 23 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 3i9c n GLU 23 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 3i9c n THR 24 N 0.00 0.00 0.00 2.62 -1.04 -1.26 -3.86 114.28 110.74 3i9c n THR 24 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3i9c n THR 24 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 3i9c n THR 24 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3i9c n TYR 25 N 0.00 0.00 0.00 -1.42 4.01 -0.90 -4.81 117.16 114.03 3i9c n TYR 25 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3i9c n TYR 25 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 3i9c n TYR 25 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3i9c n SER 26 N 4.59 0.00 0.00 7.72 3.41 -1.26 -4.26 113.62 123.82 3i9c n SER 26 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3i9c n SER 26 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3i9c n SER 26 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3i9c n THR 27 N 0.00 0.00 -3.00 6.66 -2.24 -1.26 -4.59 114.28 109.84 3i9c n THR 27 Ca 0.00 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.43 3i9c n THR 27 Cb 0.00 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.17 3i9c n THR 27 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3i9c s LYS 28 N -1.00 4.26 0.30 -0.78 1.02 -1.26 -4.98 119.74 117.29 3i9c s LYS 28 Ca 0.00 0.95 0.09 0.00 0.02 0.00 0.00 55.97 57.03 3i9c s LYS 28 Cb 0.00 -2.67 0.45 0.00 -0.52 0.00 0.00 37.83 35.09 3i9c s LYS 28 CO 0.00 0.26 1.68 -1.00 -0.92 0.00 0.00 175.35 175.37 3i9c h PRO 29 N 2.90 0.12 -0.10 -1.68 0.13 -1.90 -3.42 132.00 128.06 3i9c h PRO 29 Ca -0.48 -0.07 0.28 0.00 -0.87 0.00 0.00 66.00 64.87 3i9c h PRO 29 Cb 1.19 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.11 3i9c h PRO 29 CO 0.65 0.59 0.25 -1.83 -0.23 0.00 0.00 178.00 177.43 3i9c s GLU 30 N -3.95 0.06 0.36 0.86 -1.05 -1.15 -3.72 118.70 110.11 3i9c s GLU 30 Ca -0.03 0.10 -0.02 0.00 -0.15 0.00 0.00 54.97 54.87 3i9c s GLU 30 Cb 0.13 0.05 -0.04 0.00 -0.44 0.00 0.00 34.13 33.84 3i9c s GLU 30 CO 0.76 -0.07 0.60 0.42 0.95 0.00 0.00 175.26 177.93 3i9c s ILE 31 N 2.99 5.04 -0.30 1.83 1.01 -1.26 -4.81 121.20 125.70 3i9c s ILE 31 Ca -0.05 -0.20 -0.17 0.00 0.00 0.00 0.00 60.65 60.23 3i9c s ILE 31 Cb -0.08 -3.84 -0.02 0.00 0.01 0.00 0.00 42.46 38.53 3i9c s ILE 31 CO -0.09 -0.57 0.46 -0.47 0.00 0.00 0.00 174.94 174.27 3i9c s TYR 32 N -2.36 3.23 -0.46 3.97 5.04 -1.26 -2.05 117.35 123.45 3i9c s TYR 32 Ca 0.42 0.38 -0.15 0.00 -2.44 0.00 0.00 57.07 55.29 3i9c s TYR 32 Cb -0.10 -2.74 0.07 0.00 0.35 0.00 0.00 41.96 39.54 3i9c s TYR 32 CO 0.37 -0.36 0.37 0.08 -1.34 0.00 0.00 175.55 174.67 3i9c s VAL 33 N 2.25 5.13 0.00 3.14 1.01 -0.53 -5.02 120.40 126.39 3i9c s VAL 33 Ca 0.18 -1.06 0.00 0.00 0.00 0.00 0.00 61.98 61.10 3i9c s VAL 33 Cb -0.16 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.17 3i9c s VAL 33 CO 0.11 -0.55 0.00 1.21 0.00 0.00 0.00 175.10 175.87 3i9c n GLU 34 N 5.17 0.00 -1.70 2.72 0.00 -1.26 0.75 120.64 126.32 3i9c n GLU 34 Ca -0.12 0.00 -0.38 0.00 0.00 0.00 0.00 57.16 56.65 3i9c n GLU 34 Cb 0.44 0.00 0.05 0.00 0.00 0.00 0.00 31.44 31.92 3i9c n GLU 34 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 3i9c n VAL 35 N 0.00 3.82 -3.94 6.31 0.24 -1.26 -2.59 118.33 120.91 3i9c n VAL 35 Ca 0.00 -0.50 -0.36 0.00 -2.04 0.00 0.00 64.34 61.44 3i9c n VAL 35 Cb 0.00 -1.50 -0.06 0.00 -1.47 0.00 0.00 33.84 30.81 3i9c n VAL 35 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3i9c n SER 37 N 1.85 0.00 0.00 0.00 2.88 -1.26 -4.20 113.62 112.89 3i9c n SER 37 Ca -0.19 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.35 3i9c n SER 37 Cb 0.55 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 3i9c n SER 37 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 3i9c n LYS 38 N 0.00 0.00 0.00 -1.46 3.00 -1.26 -3.32 118.16 115.12 3i9c n LYS 38 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 3i9c n LYS 38 Cb 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 35.03 33.60 3i9c n LYS 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3i9c n HIS 40 N 0.00 0.00 -3.50 0.00 8.25 -1.21 -4.99 115.22 113.77 3i9c n HIS 40 Ca 0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.14 3i9c n HIS 40 Cb 0.00 0.06 -0.05 0.00 1.12 0.00 0.00 29.99 31.11 3i9c n HIS 40 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3i9c s PRO 41 N 0.00 3.74 0.00 -0.41 0.04 -1.26 -4.49 135.00 132.62 3i9c s PRO 41 Ca 0.00 0.16 0.00 0.00 0.04 0.00 0.00 61.00 61.20 3i9c s PRO 41 Cb 0.00 -2.71 0.00 0.00 0.04 0.00 0.00 34.50 31.83 3i9c s PRO 41 CO 0.00 0.36 0.00 0.34 0.04 0.00 0.00 177.00 177.74 3i9c n PHE 42 N -0.07 0.00 -2.91 0.56 -0.00 -1.26 -4.30 117.46 109.48 3i9c n PHE 42 Ca -0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 57.45 57.43 3i9c n PHE 42 Cb 0.52 -0.73 0.00 0.00 -0.00 0.00 0.00 39.48 39.28 3i9c n PHE 42 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.76 177.74 3i9c n TYR 43 N 2.10 -2.66 0.00 -5.13 4.19 -1.26 -4.96 117.16 109.44 3i9c n TYR 43 Ca 0.00 1.17 0.00 0.00 3.31 0.00 0.00 57.90 62.38 3i9c n TYR 43 Cb 0.00 -2.99 0.00 0.00 0.49 0.00 0.00 39.34 36.84 3i9c n TYR 43 CO 0.00 0.00 0.00 2.41 0.91 0.00 0.00 176.86 180.18 3i9c n THR 44 N 0.80 0.00 0.00 2.97 -1.04 -1.26 -4.85 114.28 110.90 3i9c n THR 44 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3i9c n THR 44 Cb 0.21 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.72 3i9c n THR 44 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3i9c n GLY 45 N 0.00 1.29 1.10 3.41 0.00 -1.26 -4.32 105.19 105.41 3i9c n GLY 45 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 3i9c n GLY 45 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3i9c n GLN 46 N -0.82 -2.06 -2.68 1.61 7.27 -1.26 -4.99 117.38 114.44 3i9c n GLN 46 Ca 0.00 1.64 -0.05 0.00 0.07 0.00 0.00 57.00 58.66 3i9c n GLN 46 Cb 0.00 -2.62 0.07 0.00 2.41 0.00 0.00 30.24 30.10 3i9c n GLN 46 CO 0.00 0.00 0.00 0.94 0.07 0.00 0.00 177.06 178.07 3i9c n GLN 47 N -3.72 0.53 -0.28 3.69 7.27 -1.26 -4.87 117.38 118.75 3i9c n GLN 47 Ca -0.05 -1.16 0.00 0.00 0.07 0.00 0.00 57.00 55.86 3i9c n GLN 47 Cb 0.50 -0.27 0.00 0.00 2.41 0.00 0.00 30.24 32.88 3i9c n GLN 47 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 3i9c n ARG 48 N -0.03 0.00 -0.29 3.69 3.00 -1.26 -4.74 116.66 117.03 3i9c n ARG 48 Ca -0.09 0.00 -0.08 0.00 -0.00 0.00 0.00 57.85 57.68 3i9c n ARG 48 Cb 0.73 -0.28 -0.07 0.00 0.00 0.00 0.00 32.46 32.85 3i9c n ARG 48 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 3i9c n PHE 49 N 1.14 -0.30 0.00 -0.14 0.99 -1.26 -4.78 117.46 113.11 3i9c n PHE 49 Ca 0.00 0.87 0.00 0.00 -0.00 0.00 0.00 57.45 58.32 3i9c n PHE 49 Cb 0.11 -0.56 0.00 0.00 -1.00 0.00 0.00 39.48 38.03 3i9c n PHE 49 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 3i9c n VAL 50 N -4.88 0.00 0.00 -4.37 0.31 -1.26 -5.09 118.33 103.04 3i9c n VAL 50 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 3i9c n VAL 50 Cb 0.18 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.11 3i9c n VAL 50 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 3i9c n ASP 51 N 0.00 0.00 0.00 4.52 5.68 -1.26 -5.10 116.55 120.39 3i9c n ASP 51 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 3i9c n ASP 51 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 3i9c n ASP 51 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3i9c n THR 52 N 0.00 0.00 -0.61 2.12 -2.24 -1.26 -4.75 114.28 107.54 3i9c n THR 52 Ca 0.00 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.57 3i9c n THR 52 Cb 0.00 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.25 3i9c n THR 52 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 3i9c n GLU 53 N 0.36 0.00 -4.28 -0.78 0.28 -1.26 -5.04 120.64 109.92 3i9c n GLU 53 Ca 0.00 0.00 -0.19 0.00 -0.16 0.00 0.00 57.16 56.81 3i9c n GLU 53 Cb 0.00 -0.58 -0.11 0.00 1.43 0.00 0.00 31.44 32.18 3i9c n GLU 53 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 3i9c s GLY 54 N -0.58 1.20 0.00 -1.84 0.00 -1.26 -5.07 107.32 99.78 3i9c s GLY 54 Ca 0.25 -1.40 -0.21 0.00 0.00 0.00 0.00 44.72 43.37 3i9c s GLY 54 CO 0.46 -1.46 1.12 0.07 0.00 0.00 0.00 173.10 173.29 3i9c h ARG 55 N 3.30 0.37 -0.58 2.90 -0.00 -1.98 -3.20 114.38 115.19 3i9c h ARG 55 Ca -0.40 -0.36 0.11 0.00 -0.00 0.00 0.00 59.98 59.32 3i9c h ARG 55 Cb 1.20 0.09 -0.11 0.00 -0.00 0.00 0.00 29.97 31.15 3i9c h ARG 55 CO 0.53 1.03 -0.27 -0.24 -0.00 0.00 0.00 179.97 181.02 3i9c h VAL 56 N -0.15 0.25 0.70 0.08 3.04 -1.97 0.55 116.25 118.75 3i9c h VAL 56 Ca -0.05 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.60 3i9c h VAL 56 Cb 1.18 0.25 0.01 0.00 -2.01 0.00 0.00 31.29 30.71 3i9c h VAL 56 CO 0.10 0.00 -0.33 -0.33 -1.01 0.00 0.00 177.57 175.99 3i9c h GLU 57 N -0.12 -0.90 0.04 4.17 5.08 -1.99 -3.20 114.58 117.66 3i9c h GLU 57 Ca 0.25 0.06 -0.25 0.00 -1.00 0.00 0.00 59.36 58.42 3i9c h GLU 57 Cb 0.52 0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.95 3i9c h GLU 57 CO -0.65 -0.57 -1.36 0.07 -1.00 0.00 0.00 179.01 175.50 3i9c h ARG 58 N -1.08 0.08 -0.98 2.33 0.11 -1.52 -3.35 114.38 109.97 3i9c h ARG 58 Ca -0.10 -0.14 0.24 0.00 0.10 0.00 0.00 59.98 60.09 3i9c h ARG 58 Cb 0.75 0.05 -0.07 0.00 1.11 0.00 0.00 29.97 31.81 3i9c h ARG 58 CO 0.16 1.07 0.65 0.74 0.10 0.00 0.00 179.97 182.68 3i9c h PHE 59 N -0.71 0.47 -0.00 4.08 0.05 -0.08 2.05 116.94 122.79 3i9c h PHE 59 Ca -0.34 0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.46 3i9c h PHE 59 Cb 1.48 -0.14 0.00 0.00 2.00 0.00 0.00 35.95 39.29 3i9c h PHE 59 CO 0.11 0.08 -0.00 1.04 -0.18 0.00 0.00 178.31 179.36 3i9c n GLN 60 N -4.49 1.06 0.00 1.51 3.00 -1.15 0.07 117.38 117.38 3i9c n GLN 60 Ca 0.22 -0.13 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 3i9c n GLN 60 Cb 0.84 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.58 3i9c n GLN 60 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 3i9c n ARG 61 N -0.85 2.54 -0.06 -1.09 3.00 0.56 -3.61 116.66 117.14 3i9c n ARG 61 Ca 0.23 -0.18 -0.06 0.00 -0.00 0.00 0.00 57.85 57.84 3i9c n ARG 61 Cb 0.15 -0.62 -0.02 0.00 0.00 0.00 0.00 32.46 31.97 3i9c n ARG 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 3i9c n ARG 62 N -0.41 0.37 0.25 -0.14 5.12 0.56 -1.25 116.66 121.15 3i9c n ARG 62 Ca 0.00 0.15 0.12 0.00 -1.93 0.00 0.00 57.85 56.18 3i9c n ARG 62 Cb 0.03 -1.13 0.64 0.00 -1.16 0.00 0.00 32.46 30.84 3i9c n ARG 62 CO 0.00 0.00 0.00 -0.92 -1.93 0.00 0.00 177.63 174.78 3i9c h TYR 63 N -0.69 0.00 0.00 -1.55 3.20 -0.55 -1.14 116.97 116.24 3i9c h TYR 63 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3i9c h TYR 63 Cb 0.69 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.96 3i9c h TYR 63 CO -0.30 0.16 -0.83 0.78 -1.64 0.00 0.00 178.16 176.33 3i9c h GLY 64 N 1.26 0.00 1.47 1.82 0.00 -1.58 -3.27 103.07 102.77 3i9c h GLY 64 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3i9c h GLY 64 CO 0.02 0.00 0.22 -1.80 0.00 0.00 0.00 176.54 174.98 3i9c h ASP 65 N 0.00 0.62 -0.35 0.19 -0.00 0.14 -0.87 116.42 116.15 3i9c h ASP 65 Ca 0.00 -0.06 -0.49 0.00 -0.00 0.00 0.00 57.03 56.48 3i9c h ASP 65 Cb 0.96 -0.16 -0.06 0.00 -0.00 0.00 0.00 39.33 40.07 3i9c h ASP 65 CO 0.00 0.54 1.59 -1.54 -0.00 0.00 0.00 179.24 179.83 3i9c n SER 66 N -4.37 7.06 -0.20 2.28 3.41 -1.17 -4.68 113.62 115.95 3i9c n SER 66 Ca 0.04 -2.73 0.00 0.00 -0.26 0.00 0.00 58.87 55.92 3i9c n SER 66 Cb 0.13 -1.43 0.00 0.00 -0.26 0.00 0.00 64.21 62.66 3i9c n SER 66 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i9c n TYR 67 N 2.48 0.00 0.39 7.33 4.19 -0.33 -2.37 117.16 128.85 3i9c n TYR 67 Ca 0.59 0.00 0.11 0.00 3.31 0.00 0.00 57.90 61.91 3i9c n TYR 67 Cb 0.53 0.00 0.46 0.00 0.49 0.00 0.00 39.34 40.82 3i9c n TYR 67 CO 0.00 0.00 0.00 0.54 0.91 0.00 0.00 176.86 178.31 3i9c n ARG 68 N -0.09 0.16 -0.13 2.98 3.00 -1.26 0.73 116.66 122.04 3i9c n ARG 68 Ca 0.00 0.41 0.11 0.00 -0.01 0.00 0.00 57.85 58.36 3i9c n ARG 68 Cb 0.00 -1.81 0.29 0.00 0.00 0.00 0.00 32.46 30.94 3i9c n ARG 68 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 3i9c n LYS 69 N -2.11 2.11 -1.54 5.56 0.00 -1.00 -4.97 118.16 116.21 3i9c n LYS 69 Ca 0.02 -1.67 -0.38 0.00 -0.00 0.00 0.00 58.31 56.28 3i9c n LYS 69 Cb 0.20 -1.45 0.04 0.00 -0.00 0.00 0.00 35.03 33.82 3i9c n LYS 69 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3i9c n GLY 70 N 1.31 -0.94 1.92 2.58 0.00 0.22 -5.19 105.19 105.09 3i9c n GLY 70 Ca 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3i9c n GLY 70 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19