#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c1c h ILE 26 N 0.00 0.65 0.00 2.41 6.09 -2.02 2.07 117.51 126.71 3c1c h ILE 26 Ca 0.00 -0.18 0.00 0.00 -1.37 0.00 0.00 64.86 63.31 3c1c h ILE 26 Cb 0.00 0.07 0.00 0.00 0.47 0.00 0.00 36.82 37.36 3c1c h ILE 26 CO 0.00 0.10 0.00 1.56 -3.07 0.00 0.00 178.15 176.74 3c1c h GLN 27 N 0.53 0.00 0.00 2.19 1.08 -2.03 0.14 115.11 117.03 3c1c h GLN 27 Ca 0.48 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.67 3c1c h GLN 27 Cb 0.75 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.18 3c1c h GLN 27 CO -0.41 0.00 -0.06 0.78 -0.95 0.00 0.00 178.83 178.19 3c1c h GLY 28 N 0.62 0.00 -7.20 3.46 0.00 0.29 -3.31 103.07 96.92 3c1c h GLY 28 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.75 3c1c h GLY 28 CO 0.00 0.00 1.33 -0.42 0.00 0.00 0.00 176.54 177.45 3c1c s ILE 29 N -4.36 3.88 0.80 2.60 1.01 0.50 -4.96 121.20 120.67 3c1c s ILE 29 Ca -0.04 -0.39 -0.11 0.00 0.00 0.00 0.00 60.65 60.12 3c1c s ILE 29 Cb 0.14 -5.00 0.07 0.00 0.01 0.00 0.00 42.46 37.68 3c1c s ILE 29 CO 0.55 -1.90 1.09 0.42 0.00 0.00 0.00 174.94 175.11 3c1c s THR 30 N 5.16 3.20 0.09 2.92 -4.23 -1.25 -4.87 115.64 116.66 3c1c s THR 30 Ca 0.42 0.39 -0.26 0.00 -1.18 0.00 0.00 61.69 61.06 3c1c s THR 30 Cb -0.03 -2.87 -0.14 0.00 1.34 0.00 0.00 72.50 70.81 3c1c s THR 30 CO -0.01 -0.51 1.69 0.50 -0.54 0.00 0.00 174.62 175.75 3c1c h LYS 31 N -1.21 -0.29 -1.00 3.99 3.64 -1.93 -1.23 116.57 118.54 3c1c h LYS 31 Ca -0.45 0.02 0.18 0.00 -1.27 0.00 0.00 60.65 59.13 3c1c h LYS 31 Cb 1.24 0.07 -0.10 0.00 -0.41 0.00 0.00 32.23 33.02 3c1c h LYS 31 CO 0.52 -0.19 0.62 -1.35 -2.27 0.00 0.00 179.45 176.77 3c1c h PRO 32 N -0.30 0.78 0.80 1.90 0.11 -1.98 0.46 132.00 133.77 3c1c h PRO 32 Ca -0.01 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.01 3c1c h PRO 32 Cb 0.27 -0.18 0.01 0.00 0.11 0.00 0.00 31.00 31.21 3c1c h PRO 32 CO -0.01 0.52 -0.39 0.00 -0.21 0.00 0.00 178.00 177.92 3c1c h ALA 33 N 1.63 -1.24 -0.33 -0.75 0.00 -1.83 -0.59 119.26 116.14 3c1c h ALA 33 Ca 0.56 -0.24 0.10 0.00 0.00 0.00 0.00 54.91 55.33 3c1c h ALA 33 Cb 0.83 0.42 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3c1c h ALA 33 CO -0.36 -1.16 0.24 0.82 0.00 0.00 0.00 179.25 178.79 3c1c h ILE 34 N -1.12 0.81 0.91 0.00 2.04 -0.74 -0.30 117.51 119.11 3c1c h ILE 34 Ca -0.11 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.71 3c1c h ILE 34 Cb 0.83 0.83 0.01 0.00 -0.74 0.00 0.00 36.82 37.75 3c1c h ILE 34 CO 0.18 0.00 -0.46 -0.09 0.00 0.00 0.00 178.15 177.78 3c1c h ARG 35 N 0.00 -1.21 -0.48 2.37 9.65 0.25 -2.38 114.38 122.58 3c1c h ARG 35 Ca 0.16 0.08 0.10 0.00 -1.10 0.00 0.00 59.98 59.21 3c1c h ARG 35 Cb 0.63 0.27 -0.10 0.00 -1.39 0.00 0.00 29.97 29.39 3c1c h ARG 35 CO -0.00 -0.80 -0.25 0.00 2.80 0.00 0.00 179.97 181.71 3c1c h ARG 36 N -1.25 -0.14 -0.15 0.20 3.08 0.53 -0.99 114.38 115.66 3c1c h ARG 36 Ca -0.12 0.01 0.03 0.00 0.07 0.00 0.00 59.98 59.97 3c1c h ARG 36 Cb 0.97 0.03 -0.07 0.00 0.08 0.00 0.00 29.97 30.98 3c1c h ARG 36 CO 0.19 -0.09 -0.53 -0.07 -1.07 0.00 0.00 179.97 178.39 3c1c h LEU 37 N -0.15 -1.69 -1.75 3.04 3.38 -1.23 0.22 115.31 117.13 3c1c h LEU 37 Ca 0.22 0.20 0.21 0.00 0.09 0.00 0.00 57.88 58.60 3c1c h LEU 37 Cb 0.49 0.66 -0.05 0.00 0.09 0.00 0.00 40.66 41.86 3c1c h LEU 37 CO -0.57 -0.48 0.57 0.00 0.09 0.00 0.00 178.44 178.05 3c1c h ALA 38 N -0.23 2.45 0.01 1.53 0.00 -0.85 0.11 119.26 122.28 3c1c h ALA 38 Ca 0.04 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3c1c h ALA 38 Cb 0.68 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3c1c h ALA 38 CO -0.44 -0.69 -0.01 0.00 0.00 0.00 0.00 179.25 178.11 3c1c h ARG 39 N 0.21 -0.02 0.00 0.00 2.47 0.71 0.12 114.38 117.87 3c1c h ARG 39 Ca 0.41 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 59.12 3c1c h ARG 39 Cb 1.28 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.60 3c1c h ARG 39 CO -0.09 0.03 -0.04 -0.09 0.56 0.00 0.00 179.97 180.34 3c1c h ARG 40 N -0.06 0.00 -0.00 0.04 2.43 0.18 0.64 114.38 117.61 3c1c h ARG 40 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3c1c h ARG 40 Cb 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 3c1c h ARG 40 CO 0.00 0.04 -0.11 0.41 -1.51 0.00 0.00 179.97 178.80 3c1c n GLY 41 N -1.08 -1.27 1.21 2.80 0.00 -0.24 -4.92 105.19 101.69 3c1c n GLY 41 Ca -0.03 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.80 3c1c n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3c1c n GLY 42 N 1.39 0.64 3.73 -0.02 0.00 0.22 -5.04 105.19 106.11 3c1c n GLY 42 Ca 0.10 -0.54 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 3c1c n GLY 42 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3c1c s VAL 43 N -2.00 4.73 -0.26 1.61 1.01 0.21 -4.99 120.40 120.71 3c1c s VAL 43 Ca 0.00 1.89 -0.16 0.00 0.00 0.00 0.00 61.98 63.72 3c1c s VAL 43 Cb 0.00 -4.24 -0.14 0.00 0.00 0.00 0.00 36.38 31.99 3c1c s VAL 43 CO 0.00 0.27 -0.18 1.17 0.00 0.00 0.00 175.10 176.37 3c1c n LYS 44 N 3.25 0.59 -4.90 2.72 4.81 -1.26 -4.51 118.16 118.85 3c1c n LYS 44 Ca 0.02 0.35 -0.33 0.00 -0.87 0.00 0.00 58.31 57.48 3c1c n LYS 44 Cb 0.50 -1.57 -0.13 0.00 0.02 0.00 0.00 35.03 33.85 3c1c n LYS 44 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 3c1c s ARG 45 N -2.47 2.63 -0.25 1.64 1.81 -1.26 -5.12 118.95 115.94 3c1c s ARG 45 Ca -0.36 -0.71 -0.00 0.00 -1.72 0.00 0.00 55.73 52.94 3c1c s ARG 45 Cb 0.12 -2.40 0.07 0.00 -0.45 0.00 0.00 34.95 32.29 3c1c s ARG 45 CO 0.53 0.55 0.02 0.42 -0.68 0.00 0.00 175.30 176.14 3c1c s ILE 46 N -0.53 1.14 0.30 1.52 1.01 -1.26 -5.12 121.20 118.25 3c1c s ILE 46 Ca 0.07 -1.18 -0.29 0.00 0.00 0.00 0.00 60.65 59.25 3c1c s ILE 46 Cb -0.12 -1.63 -0.13 0.00 0.01 0.00 0.00 42.46 40.60 3c1c s ILE 46 CO 0.01 -0.33 1.20 -0.24 0.00 0.00 0.00 174.94 175.58 3c1c n SER 47 N 4.79 2.15 -0.10 3.58 2.88 -1.26 -4.87 113.62 120.79 3c1c n SER 47 Ca -0.07 1.18 0.14 0.00 -1.33 0.00 0.00 58.87 58.80 3c1c n SER 47 Cb 0.44 -1.39 0.53 0.00 -0.75 0.00 0.00 64.21 63.04 3c1c n SER 47 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 3c1c h GLY 48 N 2.63 0.53 2.00 0.46 0.00 -2.05 -0.18 103.07 106.47 3c1c h GLY 48 Ca -0.43 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 46.74 3c1c h GLY 48 CO 0.64 0.07 -0.04 1.41 0.00 0.00 0.00 176.54 178.62 3c1c h LEU 49 N 0.35 0.00 -2.02 3.11 3.38 -2.03 -3.15 115.31 114.94 3c1c h LEU 49 Ca 0.30 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.41 3c1c h LEU 49 Cb 0.71 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 3c1c h LEU 49 CO -0.08 0.04 0.39 0.40 0.09 0.00 0.00 178.44 179.28 3c1c h ILE 50 N 0.00 0.60 0.27 1.22 1.08 -1.37 -2.91 117.51 116.40 3c1c h ILE 50 Ca -0.00 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.46 3c1c h ILE 50 Cb 0.43 0.71 0.00 0.00 -3.07 0.00 0.00 36.82 34.90 3c1c h ILE 50 CO 0.01 0.00 -0.13 1.88 -0.69 0.00 0.00 178.15 179.22 3c1c h TYR 51 N 0.00 -0.34 0.00 1.37 0.05 -1.73 -0.67 116.97 115.65 3c1c h TYR 51 Ca 0.23 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.00 3c1c h TYR 51 Cb 1.01 0.11 0.00 0.00 1.01 0.00 0.00 36.73 38.86 3c1c h TYR 51 CO 0.00 0.02 0.00 0.93 -1.05 0.00 0.00 178.16 178.06 3c1c h GLU 52 N -0.91 0.00 0.00 4.88 4.39 -1.76 -1.50 114.58 119.68 3c1c h GLU 52 Ca -0.04 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 3c1c h GLU 52 Cb 0.51 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.15 3c1c h GLU 52 CO 0.06 0.00 -0.09 1.49 -1.16 0.00 0.00 179.01 179.31 3c1c h GLU 53 N 0.00 0.00 -0.19 2.33 4.57 -1.39 -3.24 114.58 116.66 3c1c h GLU 53 Ca 0.00 0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.22 3c1c h GLU 53 Cb 0.07 0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 28.60 3c1c h GLU 53 CO 0.00 0.96 -0.51 1.15 -1.18 0.00 0.00 179.01 179.43 3c1c h THR 54 N -1.00 0.04 -0.21 0.32 2.02 -0.13 -2.40 112.91 111.55 3c1c h THR 54 Ca -0.02 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.21 3c1c h THR 54 Cb 0.98 0.04 -0.07 0.00 -1.74 0.00 0.00 68.15 67.36 3c1c h THR 54 CO -0.02 0.00 -0.29 0.03 0.37 0.00 0.00 175.52 175.61 3c1c h ARG 55 N -0.52 -0.31 -1.07 6.66 3.08 -1.53 0.13 114.38 120.82 3c1c h ARG 55 Ca 0.06 0.02 0.30 0.00 0.07 0.00 0.00 59.98 60.43 3c1c h ARG 55 Cb 0.66 0.07 -0.12 0.00 0.08 0.00 0.00 29.97 30.66 3c1c h ARG 55 CO -0.46 -0.21 0.65 0.78 -1.07 0.00 0.00 179.97 179.67 3c1c h GLY 56 N -0.32 1.61 0.35 0.04 0.00 -1.47 0.41 103.07 103.69 3c1c h GLY 56 Ca 0.12 -0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 3c1c h GLY 56 CO -0.39 -0.30 -0.03 -2.08 0.00 0.00 0.00 176.54 173.74 3c1c h VAL 57 N 0.37 1.21 -1.09 4.60 2.07 -0.52 -1.66 116.25 121.23 3c1c h VAL 57 Ca 0.68 -1.35 0.30 0.00 0.82 0.00 0.00 66.70 67.14 3c1c h VAL 57 Cb 1.65 2.04 -0.09 0.00 -1.52 0.00 0.00 31.29 33.37 3c1c h VAL 57 CO -0.44 0.32 0.72 0.25 0.02 0.00 0.00 177.57 178.44 3c1c h LEU 58 N -0.75 0.34 0.27 2.57 5.85 0.19 0.14 115.31 123.93 3c1c h LEU 58 Ca -0.01 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 3c1c h LEU 58 Cb 0.59 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.65 3c1c h LEU 58 CO 0.02 0.04 -0.13 0.50 -0.34 0.00 0.00 178.44 178.53 3c1c h LYS 59 N 0.29 -0.35 -1.01 1.25 3.64 -0.26 -2.88 116.57 117.25 3c1c h LYS 59 Ca 0.61 0.02 0.25 0.00 -1.27 0.00 0.00 60.65 60.27 3c1c h LYS 59 Cb 1.75 0.08 -0.09 0.00 -0.41 0.00 0.00 32.23 33.57 3c1c h LYS 59 CO -0.26 -0.01 0.66 0.28 -2.27 0.00 0.00 179.45 177.85 3c1c h VAL 60 N -0.91 0.56 0.25 2.00 2.07 0.13 -1.28 116.25 119.08 3c1c h VAL 60 Ca -0.04 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 3c1c h VAL 60 Cb 0.51 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 3c1c h VAL 60 CO 0.06 0.07 -0.12 0.15 0.02 0.00 0.00 177.57 177.75 3c1c h PHE 61 N 0.40 -0.32 -0.99 1.57 3.57 -0.81 -2.86 116.94 117.49 3c1c h PHE 61 Ca 0.56 -0.01 0.23 0.00 3.53 0.00 0.00 57.97 62.28 3c1c h PHE 61 Cb 1.43 0.10 -0.09 0.00 2.79 0.00 0.00 35.95 40.18 3c1c h PHE 61 CO -0.00 -0.20 0.63 -0.07 -2.23 0.00 0.00 178.31 176.45 3c1c h LEU 62 N -0.35 0.52 0.64 0.59 3.38 -1.21 -1.73 115.31 117.15 3c1c h LEU 62 Ca -0.03 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 3c1c h LEU 62 Cb 0.26 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.00 3c1c h LEU 62 CO 0.06 0.15 -0.31 -0.33 0.09 0.00 0.00 178.44 178.10 3c1c h GLU 63 N 0.49 -0.82 -0.98 1.13 5.08 -1.25 0.48 114.58 118.71 3c1c h GLU 63 Ca 0.56 0.06 0.06 0.00 -1.00 0.00 0.00 59.36 59.03 3c1c h GLU 63 Cb 1.27 0.19 -0.07 0.00 0.50 0.00 0.00 28.75 30.64 3c1c h GLU 63 CO -0.29 -0.54 0.63 -0.91 -1.00 0.00 0.00 179.01 176.90 3c1c h ASN 64 N -0.87 1.01 0.25 1.42 2.35 -1.10 -0.43 115.58 118.21 3c1c h ASN 64 Ca -0.09 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 3c1c h ASN 64 Cb 0.66 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.83 3c1c h ASN 64 CO 0.14 0.65 -0.12 0.58 -1.65 0.00 0.00 177.43 177.03 3c1c h VAL 65 N 1.15 0.32 -0.90 2.81 2.07 -1.18 -3.17 116.25 117.34 3c1c h VAL 65 Ca 0.42 -0.88 0.18 0.00 0.82 0.00 0.00 66.70 67.24 3c1c h VAL 65 Cb 0.15 0.54 -0.11 0.00 -1.52 0.00 0.00 31.29 30.35 3c1c h VAL 65 CO -0.17 0.09 0.47 0.40 0.02 0.00 0.00 177.57 178.37 3c1c h ILE 66 N -1.03 0.64 -0.13 4.57 2.04 -0.01 -1.11 117.51 122.49 3c1c h ILE 66 Ca -0.03 -0.20 0.04 0.00 1.00 0.00 0.00 64.86 65.66 3c1c h ILE 66 Cb 0.40 0.01 -0.07 0.00 -0.74 0.00 0.00 36.82 36.42 3c1c h ILE 66 CO 0.06 0.11 -0.45 -0.09 0.00 0.00 0.00 178.15 177.77 3c1c h ARG 67 N 0.59 -0.50 -0.60 2.37 2.43 -1.16 -0.41 114.38 117.10 3c1c h ARG 67 Ca 0.52 0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.69 3c1c h ARG 67 Cb 0.84 0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 30.48 3c1c h ARG 67 CO -0.42 -0.33 0.21 -0.44 -1.51 0.00 0.00 179.97 177.48 3c1c h ASP 68 N -0.52 0.82 -0.00 -3.80 3.32 -1.20 -1.79 116.42 113.25 3c1c h ASP 68 Ca 0.06 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 3c1c h ASP 68 Cb 0.65 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.98 3c1c h ASP 68 CO -0.41 0.75 0.00 0.00 -1.72 0.00 0.00 179.24 177.87 3c1c h ALA 69 N 1.36 0.00 -0.94 3.45 0.00 -0.89 -1.47 119.26 120.77 3c1c h ALA 69 Ca 0.20 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 55.09 3c1c h ALA 69 Cb 0.21 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.93 3c1c h ALA 69 CO -0.01 -0.38 0.58 0.28 0.00 0.00 0.00 179.25 179.72 3c1c h VAL 70 N -0.23 0.96 -0.15 0.00 2.07 -0.96 0.44 116.25 118.39 3c1c h VAL 70 Ca 0.00 -0.33 0.02 0.00 0.82 0.00 0.00 66.70 67.20 3c1c h VAL 70 Cb 0.23 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.89 3c1c h VAL 70 CO 0.00 0.18 0.04 0.74 0.02 0.00 0.00 177.57 178.55 3c1c h THR 71 N 0.98 0.96 -0.22 2.57 2.02 -1.04 0.34 112.91 118.51 3c1c h THR 71 Ca 0.44 -0.04 0.06 0.00 0.77 0.00 0.00 66.41 67.65 3c1c h THR 71 Cb 0.35 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 3c1c h THR 71 CO -0.23 0.02 0.16 1.88 0.37 0.00 0.00 175.52 177.72 3c1c h TYR 72 N 0.12 0.00 0.38 3.16 0.99 0.11 -2.05 116.97 119.67 3c1c h TYR 72 Ca 0.07 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.78 3c1c h TYR 72 Cb 0.04 0.00 0.00 0.00 1.00 0.00 0.00 36.73 37.78 3c1c h TYR 72 CO -0.11 0.00 -0.18 1.15 -0.00 0.00 0.00 178.16 179.01 3c1c h THR 73 N 0.00 0.00 -0.96 -2.88 2.02 0.28 -3.10 112.91 108.27 3c1c h THR 73 Ca 0.10 -0.35 0.22 0.00 0.77 0.00 0.00 66.41 67.15 3c1c h THR 73 Cb 0.43 0.00 -0.18 0.00 -1.74 0.00 0.00 68.15 66.66 3c1c h THR 73 CO -0.00 0.00 -0.14 -0.33 0.37 0.00 0.00 175.52 175.42 3c1c h GLU 74 N -0.85 0.01 -0.93 6.66 5.08 -0.20 0.34 114.58 124.68 3c1c h GLU 74 Ca -0.05 -0.00 0.18 0.00 -1.00 0.00 0.00 59.36 58.49 3c1c h GLU 74 Cb 0.39 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.56 3c1c h GLU 74 CO 0.08 0.01 0.60 1.25 -1.00 0.00 0.00 179.01 179.95 3c1c h HIS 75 N 0.01 0.79 -0.26 4.33 2.76 -1.42 0.46 115.15 121.82 3c1c h HIS 75 Ca 0.50 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.68 3c1c h HIS 75 Cb 0.88 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 29.58 3c1c h HIS 75 CO -0.64 0.23 0.02 0.00 -1.30 0.00 0.00 177.93 176.24 3c1c n ALA 76 N -2.44 3.16 -4.17 5.26 0.00 0.12 -4.88 120.51 117.57 3c1c n ALA 76 Ca 0.20 -0.86 -0.31 0.00 0.00 0.00 0.00 53.44 52.47 3c1c n ALA 76 Cb 0.59 -1.07 -0.05 0.00 0.00 0.00 0.00 19.45 18.92 3c1c n ALA 76 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3c1c n LYS 77 N 0.23 -2.35 -4.37 0.00 4.76 0.16 -4.94 118.16 111.65 3c1c n LYS 77 Ca 0.13 0.28 -0.28 0.00 -2.87 0.00 0.00 58.31 55.58 3c1c n LYS 77 Cb 0.69 -4.40 -0.13 0.00 -1.84 0.00 0.00 35.03 29.35 3c1c n LYS 77 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3c1c s ARG 78 N -6.94 1.35 0.00 1.97 0.52 -1.19 -5.03 118.95 109.63 3c1c s ARG 78 Ca 0.24 -1.33 0.21 0.00 -0.52 0.00 0.00 55.73 54.34 3c1c s ARG 78 Cb -0.13 -1.78 0.43 0.00 0.52 0.00 0.00 34.95 33.99 3c1c s ARG 78 CO 0.94 0.42 1.38 1.63 0.02 0.00 0.00 175.30 179.69 3c1c n LYS 79 N 0.87 2.47 -4.03 3.54 5.02 -1.26 -4.45 118.16 120.32 3c1c n LYS 79 Ca -0.18 -2.27 -0.17 0.00 -2.02 0.00 0.00 58.31 53.67 3c1c n LYS 79 Cb 0.53 -1.49 -0.16 0.00 -0.02 0.00 0.00 35.03 33.90 3c1c n LYS 79 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3c1c s THR 80 N -1.33 0.30 -0.01 -0.18 -4.23 -1.26 -5.12 115.64 103.81 3c1c s THR 80 Ca 0.38 -0.04 -0.30 0.00 -1.18 0.00 0.00 61.69 60.55 3c1c s THR 80 Cb 0.22 -0.34 -0.03 0.00 1.34 0.00 0.00 72.50 73.69 3c1c s THR 80 CO 0.30 0.15 0.99 -0.69 -0.54 0.00 0.00 174.62 174.82 3c1c s VAL 81 N 0.66 4.83 -0.11 2.29 1.01 -1.26 -5.01 120.40 122.82 3c1c s VAL 81 Ca -0.07 2.03 -0.05 0.00 0.00 0.00 0.00 61.98 63.89 3c1c s VAL 81 Cb -0.10 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 31.93 3c1c s VAL 81 CO -0.01 0.14 0.09 0.42 0.00 0.00 0.00 175.10 175.75 3c1c s THR 82 N 1.13 5.10 0.37 3.92 -4.23 -1.26 -4.98 115.64 115.69 3c1c s THR 82 Ca 0.52 0.04 0.25 0.00 -1.18 0.00 0.00 61.69 61.32 3c1c s THR 82 Cb -0.21 -3.20 0.39 0.00 1.34 0.00 0.00 72.50 70.82 3c1c s THR 82 CO 0.27 0.61 1.42 0.00 -0.54 0.00 0.00 174.62 176.37 3c1c n ALA 83 N 2.00 1.10 -0.15 3.99 0.00 -1.26 0.26 120.51 126.45 3c1c n ALA 83 Ca -0.19 0.85 -0.08 0.00 0.00 0.00 0.00 53.44 54.01 3c1c n ALA 83 Cb 0.54 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 19.06 3c1c n ALA 83 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 3c1c h MET 84 N 0.00 0.64 -0.97 0.00 2.86 -1.94 -0.62 114.93 114.90 3c1c h MET 84 Ca 0.78 -0.09 0.20 0.00 -2.06 0.00 0.00 59.70 58.54 3c1c h MET 84 Cb 2.32 -0.12 -0.11 0.00 0.06 0.00 0.00 31.60 33.75 3c1c h MET 84 CO -0.54 0.53 0.56 -0.44 1.06 0.00 0.00 176.91 178.08 3c1c h ASP 85 N 0.58 0.68 0.32 1.22 3.32 0.33 0.74 116.42 123.60 3c1c h ASP 85 Ca 0.15 0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.30 3c1c h ASP 85 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 3c1c h ASP 85 CO -0.02 0.19 -0.15 0.58 -1.72 0.00 0.00 179.24 178.12 3c1c h VAL 86 N 0.66 0.64 -0.75 -1.35 2.07 -1.06 -2.35 116.25 114.11 3c1c h VAL 86 Ca 0.58 -0.64 0.15 0.00 0.82 0.00 0.00 66.70 67.61 3c1c h VAL 86 Cb 0.97 0.94 -0.10 0.00 -1.52 0.00 0.00 31.29 31.58 3c1c h VAL 86 CO -0.42 0.12 0.24 0.58 0.02 0.00 0.00 177.57 178.11 3c1c h VAL 87 N -0.82 0.58 -0.61 2.57 2.07 -0.34 0.41 116.25 120.11 3c1c h VAL 87 Ca -0.04 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.37 3c1c h VAL 87 Cb 0.52 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 3c1c h VAL 87 CO 0.07 0.06 0.39 1.88 0.02 0.00 0.00 177.57 179.99 3c1c h TYR 88 N 0.35 0.73 0.00 1.57 0.99 -0.89 0.60 116.97 120.32 3c1c h TYR 88 Ca 0.42 0.02 0.00 0.00 2.00 0.00 0.00 58.73 61.17 3c1c h TYR 88 Cb 0.69 -0.24 0.00 0.00 1.00 0.00 0.00 36.73 38.18 3c1c h TYR 88 CO -0.21 0.44 0.00 0.00 -0.00 0.00 0.00 178.16 178.39 3c1c n ALA 89 N -2.28 -0.42 -0.28 3.88 0.00 0.11 -2.02 120.51 119.51 3c1c n ALA 89 Ca 0.05 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.61 3c1c n ALA 89 Cb 0.05 0.06 0.23 0.00 0.00 0.00 0.00 19.45 19.79 3c1c n ALA 89 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3c1c n LEU 90 N -2.08 -0.10 0.04 0.00 4.77 0.52 -0.06 117.00 120.10 3c1c n LEU 90 Ca 0.00 1.36 -0.13 0.00 -0.03 0.00 0.00 56.01 57.21 3c1c n LEU 90 Cb 0.00 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 40.54 3c1c n LEU 90 CO 0.00 -1.37 0.60 0.50 -1.33 0.00 0.00 177.39 175.79 3c1c h LYS 91 N 0.00 -0.51 0.00 3.23 1.63 -0.33 0.37 116.57 120.96 3c1c h LYS 91 Ca 0.48 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.31 3c1c h LYS 91 Cb 0.98 0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.72 3c1c h LYS 91 CO -0.75 -0.34 0.00 2.89 -3.45 0.00 0.00 179.45 177.79 3c1c n ARG 92 N -5.44 0.17 0.00 1.90 1.85 0.91 -0.96 116.66 115.09 3c1c n ARG 92 Ca -0.05 0.34 0.15 0.00 -1.00 0.00 0.00 57.85 57.28 3c1c n ARG 92 Cb 0.36 -1.79 0.70 0.00 -1.05 0.00 0.00 32.46 30.69 3c1c n ARG 92 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 3c1c n GLN 93 N -2.10 0.93 -1.79 2.89 1.13 -0.40 -4.87 117.38 113.17 3c1c n GLN 93 Ca 0.03 -0.28 -0.02 0.00 -1.94 0.00 0.00 57.00 54.79 3c1c n GLN 93 Cb 0.26 -1.49 -0.00 0.00 0.11 0.00 0.00 30.24 29.12 3c1c n GLN 93 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3c1c n GLY 94 N 1.18 0.35 2.57 1.08 0.00 -0.14 -4.97 105.19 105.27 3c1c n GLY 94 Ca 0.18 -0.84 -0.19 0.00 0.00 0.00 0.00 46.02 45.17 3c1c n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3c1c n ARG 95 N -1.67 2.34 -1.47 1.61 1.74 0.12 -5.01 116.66 114.31 3c1c n ARG 95 Ca -0.03 -3.97 -0.44 0.00 -0.77 0.00 0.00 57.85 52.65 3c1c n ARG 95 Cb 0.41 -1.82 -0.01 0.00 -1.02 0.00 0.00 32.46 30.02 3c1c n ARG 95 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 3c1c n THR 96 N -0.24 1.81 -3.76 0.55 -1.04 -1.24 -4.38 114.28 105.99 3c1c n THR 96 Ca 0.26 -0.50 -0.17 0.00 -2.04 0.00 0.00 64.05 61.60 3c1c n THR 96 Cb 0.70 -0.52 -0.17 0.00 -1.82 0.00 0.00 70.33 68.52 3c1c n THR 96 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 3c1c s LEU 97 N 1.80 0.83 0.16 -4.42 2.96 -1.26 -4.98 118.68 113.78 3c1c s LEU 97 Ca 0.62 0.04 -0.02 0.00 -0.22 0.00 0.00 54.13 54.55 3c1c s LEU 97 Cb -0.69 -0.11 -0.05 0.00 0.50 0.00 0.00 46.19 45.84 3c1c s LEU 97 CO 0.58 -0.16 0.37 -0.31 -1.32 0.00 0.00 176.35 175.51 3c1c s TYR 98 N 1.37 3.48 0.00 5.38 2.02 -1.26 -4.61 117.35 123.73 3c1c s TYR 98 Ca -0.05 0.43 0.00 0.00 -0.37 0.00 0.00 57.07 57.08 3c1c s TYR 98 Cb -0.13 -1.91 0.00 0.00 -0.40 0.00 0.00 41.96 39.52 3c1c s TYR 98 CO -0.03 0.42 0.00 0.41 -1.57 0.00 0.00 175.55 174.78 3c1c n GLY 99 N -0.24 0.83 0.35 0.71 0.00 -1.26 -4.95 105.19 100.62 3c1c n GLY 99 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3c1c n GLY 99 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3c1c n PHE 100 N -0.91 0.00 0.00 1.61 3.01 -1.26 -5.11 117.46 114.79 3c1c n PHE 100 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3c1c n PHE 100 Cb 0.00 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 39.44 3c1c n PHE 100 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3c1c n GLY 101 N 0.00 4.72 0.00 1.37 0.00 -1.26 -4.63 105.19 105.38 3c1c n GLY 101 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.23 3c1c n GLY 101 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93