#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3clc s SER 3 N 0.00 5.68 0.09 1.62 0.15 -1.26 -5.02 113.70 114.96 3clc s SER 3 Ca 0.00 0.21 -0.26 0.00 0.70 0.00 0.00 55.95 56.60 3clc s SER 3 Cb 0.00 -1.81 -0.14 0.00 -1.71 0.00 0.00 66.02 62.36 3clc s SER 3 CO 0.00 0.31 1.69 0.15 1.20 0.00 0.00 173.24 176.60 3clc h PHE 4 N 5.66 -0.32 -0.09 3.44 3.04 -2.04 -1.73 116.94 124.90 3clc h PHE 4 Ca -0.47 -0.00 0.03 0.00 3.98 0.00 0.00 57.97 61.51 3clc h PHE 4 Cb 1.19 0.12 -0.03 0.00 2.56 0.00 0.00 35.95 39.79 3clc h PHE 4 CO 0.64 -0.19 -0.09 1.25 -2.02 0.00 0.00 178.31 177.89 3clc h LEU 5 N -0.30 -0.29 -1.61 0.59 6.46 -1.99 -2.21 115.31 115.97 3clc h LEU 5 Ca -0.01 0.06 0.15 0.00 -0.12 0.00 0.00 57.88 57.96 3clc h LEU 5 Cb 0.26 0.14 -0.05 0.00 -0.73 0.00 0.00 40.66 40.29 3clc h LEU 5 CO -0.00 -0.13 0.50 0.25 -0.62 0.00 0.00 178.44 178.43 3clc h LEU 6 N -0.12 0.36 0.00 2.25 6.46 -1.93 -0.17 115.31 122.16 3clc h LEU 6 Ca 0.07 0.02 -0.08 0.00 -0.12 0.00 0.00 57.88 57.77 3clc h LEU 6 Cb 0.21 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.08 3clc h LEU 6 CO -0.16 0.19 -0.61 0.77 -0.62 0.00 0.00 178.44 178.01 3clc h SER 7 N 0.39 0.00 0.54 1.25 4.64 -0.86 -2.72 113.55 116.79 3clc h SER 7 Ca 0.36 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.39 3clc h SER 7 Cb 0.86 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.96 3clc h SER 7 CO -0.11 0.32 -1.31 0.11 -0.87 0.00 0.00 176.83 174.97 3clc h LYS 8 N 0.00 0.34 0.02 4.77 1.79 -0.53 -1.92 116.57 121.04 3clc h LYS 8 Ca -0.03 -0.58 0.02 0.00 -2.18 0.00 0.00 60.65 57.88 3clc h LYS 8 Cb 1.27 0.22 -0.03 0.00 -1.58 0.00 0.00 32.23 32.11 3clc h LYS 8 CO 0.04 1.28 -0.14 0.28 -1.08 0.00 0.00 179.45 179.82 3clc h VAL 9 N 0.09 0.65 -0.48 0.50 2.07 -1.09 0.73 116.25 118.71 3clc h VAL 9 Ca -0.17 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 3clc h VAL 9 Cb 2.02 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 32.42 3clc h VAL 9 CO 0.22 0.00 0.25 0.77 0.02 0.00 0.00 177.57 178.83 3clc h SER 10 N -0.25 0.62 -0.57 0.57 4.64 -1.55 -0.33 113.55 116.67 3clc h SER 10 Ca 0.04 -0.11 0.10 0.00 -0.47 0.00 0.00 61.79 61.35 3clc h SER 10 Cb 0.30 -0.16 -0.08 0.00 -0.31 0.00 0.00 62.40 62.16 3clc h SER 10 CO -0.13 0.55 0.16 0.15 -0.87 0.00 0.00 176.83 176.69 3clc h PHE 11 N 0.64 0.27 0.37 4.77 3.57 -0.95 -1.33 116.94 124.29 3clc h PHE 11 Ca 0.17 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 3clc h PHE 11 Cb 0.08 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 38.79 3clc h PHE 11 CO -0.01 0.03 -0.18 0.28 -2.23 0.00 0.00 178.31 176.20 3clc h VAL 12 N 0.31 0.64 -0.66 1.41 2.07 -0.13 0.76 116.25 120.65 3clc h VAL 12 Ca 0.29 -0.09 0.13 0.00 0.82 0.00 0.00 66.70 67.86 3clc h VAL 12 Cb 0.40 0.69 -0.13 0.00 -1.52 0.00 0.00 31.29 30.73 3clc h VAL 12 CO -0.34 0.02 -0.17 0.40 0.02 0.00 0.00 177.57 177.50 3clc h ILE 13 N -0.55 0.34 -0.57 4.57 2.04 -0.70 0.37 117.51 123.01 3clc h ILE 13 Ca -0.05 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.83 3clc h ILE 13 Cb 0.41 0.34 -0.04 0.00 -0.74 0.00 0.00 36.82 36.79 3clc h ILE 13 CO 0.08 0.00 0.35 0.50 0.00 0.00 0.00 178.15 179.08 3clc h LYS 14 N -0.00 0.67 -0.11 2.37 3.64 -0.99 -0.89 116.57 121.26 3clc h LYS 14 Ca 0.32 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.67 3clc h LYS 14 Cb 0.48 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 3clc h LYS 14 CO -0.68 0.45 0.03 -0.22 -2.27 0.00 0.00 179.45 176.76 3clc h LYS 15 N 0.69 0.08 -0.48 1.90 3.64 0.19 -0.69 116.57 121.90 3clc h LYS 15 Ca 0.23 -0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.55 3clc h LYS 15 Cb 0.02 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 3clc h LYS 15 CO -0.10 0.05 0.09 0.82 -2.27 0.00 0.00 179.45 178.05 3clc h ILE 16 N 0.08 1.24 -0.95 2.00 2.04 -0.07 0.02 117.51 121.88 3clc h ILE 16 Ca 0.05 -0.89 0.09 0.00 1.00 0.00 0.00 64.86 65.11 3clc h ILE 16 Cb 0.03 0.89 -0.07 0.00 -0.74 0.00 0.00 36.82 36.93 3clc h ILE 16 CO -0.06 0.32 0.61 -0.09 0.00 0.00 0.00 178.15 178.93 3clc h ARG 17 N 0.67 0.97 -0.03 2.37 2.43 -0.92 -1.57 114.38 118.30 3clc h ARG 17 Ca 0.15 -0.06 -0.13 0.00 -0.81 0.00 0.00 59.98 59.13 3clc h ARG 17 Cb 0.37 -0.22 0.01 0.00 -0.42 0.00 0.00 29.97 29.71 3clc h ARG 17 CO 0.01 0.64 -0.48 -0.07 -1.51 0.00 0.00 179.97 178.56 3clc h LEU 18 N 1.00 0.47 -2.22 3.80 3.38 -0.31 -0.48 115.31 120.95 3clc h LEU 18 Ca 0.44 -0.73 0.05 0.00 0.09 0.00 0.00 57.88 57.73 3clc h LEU 18 Cb 0.35 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3clc h LEU 18 CO -0.20 1.13 0.24 -0.33 0.09 0.00 0.00 178.44 179.38 3clc h GLU 19 N -0.15 0.00 -0.12 1.13 5.08 -0.77 0.34 114.58 120.10 3clc h GLU 19 Ca -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3clc h GLU 19 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 3clc h GLU 19 CO 0.10 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.74 3clc n LYS 20 N -3.61 1.96 -2.24 2.33 5.02 -0.61 -4.94 118.16 116.06 3clc n LYS 20 Ca 0.02 -1.41 -0.13 0.00 -2.02 0.00 0.00 58.31 54.77 3clc n LYS 20 Cb 0.36 -1.46 -0.02 0.00 -0.02 0.00 0.00 35.03 33.90 3clc n LYS 20 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3clc n GLY 21 N 1.25 -0.18 3.75 0.72 0.00 0.12 -4.97 105.19 105.88 3clc n GLY 21 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 3clc n GLY 21 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3clc s MET 22 N -4.67 4.60 0.73 1.61 -1.94 -0.24 -5.02 119.30 114.38 3clc s MET 22 Ca 0.00 1.22 -0.11 0.00 -1.71 0.00 0.00 55.69 55.09 3clc s MET 22 Cb 0.00 -3.33 0.03 0.00 2.01 0.00 0.00 34.83 33.54 3clc s MET 22 CO 0.00 0.38 1.07 0.95 -0.01 0.00 0.00 175.02 177.41 3clc s THR 23 N -0.48 3.69 0.15 2.05 -4.23 -1.26 -4.59 115.64 110.97 3clc s THR 23 Ca 0.40 0.55 -0.18 0.00 -1.18 0.00 0.00 61.69 61.28 3clc s THR 23 Cb -0.22 -3.24 0.05 0.00 1.34 0.00 0.00 72.50 70.42 3clc s THR 23 CO 0.26 -0.72 1.69 1.56 -0.54 0.00 0.00 174.62 176.88 3clc h GLN 24 N -0.88 0.03 -0.49 3.99 4.20 -1.98 -0.41 115.11 119.57 3clc h GLN 24 Ca -0.45 -0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.36 3clc h GLN 24 Cb 1.23 -0.01 -0.08 0.00 0.30 0.00 0.00 27.48 28.92 3clc h GLN 24 CO 0.56 0.02 0.02 1.49 -0.67 0.00 0.00 178.83 180.25 3clc h GLU 25 N 0.04 0.13 -0.56 1.46 4.81 -1.94 0.34 114.58 118.86 3clc h GLU 25 Ca 0.16 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.34 3clc h GLU 25 Cb 0.24 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 3clc h GLU 25 CO -0.32 0.09 0.17 -0.44 -0.73 0.00 0.00 179.01 177.77 3clc h ASP 26 N 0.13 0.83 0.18 1.04 3.32 -1.89 -0.11 116.42 119.93 3clc h ASP 26 Ca 0.25 -0.21 -0.04 0.00 0.02 0.00 0.00 57.03 57.04 3clc h ASP 26 Cb 0.36 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3clc h ASP 26 CO -0.39 0.83 -0.19 0.25 -1.72 0.00 0.00 179.24 178.02 3clc h LEU 27 N 0.79 0.00 0.10 1.55 5.85 0.05 0.09 115.31 123.75 3clc h LEU 27 Ca 0.18 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 3clc h LEU 27 Cb 0.30 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.33 3clc h LEU 27 CO -0.00 0.19 -0.05 0.00 -0.34 0.00 0.00 178.44 178.24 3clc h ALA 28 N 1.81 -0.14 -0.49 1.25 0.00 0.56 -2.65 119.26 119.60 3clc h ALA 28 Ca -0.00 -0.26 0.10 0.00 0.00 0.00 0.00 54.91 54.75 3clc h ALA 28 Cb 0.33 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.07 3clc h ALA 28 CO 0.02 -0.27 -0.23 1.88 0.00 0.00 0.00 179.25 180.65 3clc h TYR 29 N -0.74 -0.60 -0.14 0.00 0.05 -0.91 -2.14 116.97 112.49 3clc h TYR 29 Ca -0.01 0.05 -0.05 0.00 0.05 0.00 0.00 58.73 58.77 3clc h TYR 29 Cb 0.56 0.34 -0.01 0.00 1.01 0.00 0.00 36.73 38.62 3clc h TYR 29 CO 0.10 -0.31 -0.15 0.87 -1.05 0.00 0.00 178.16 177.62 3clc h LYS 30 N -0.12 0.22 -0.27 4.88 1.57 -0.95 -2.09 116.57 119.81 3clc h LYS 30 Ca 0.23 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3clc h LYS 30 Cb 0.48 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.76 3clc h LYS 30 CO -0.57 0.38 0.00 -1.13 -0.57 0.00 0.00 179.45 177.56 3clc n SER 31 N -4.26 3.06 -3.94 0.86 3.41 -1.00 -4.59 113.62 107.16 3clc n SER 31 Ca -0.01 -1.90 -0.40 0.00 -0.26 0.00 0.00 58.87 56.30 3clc n SER 31 Cb 0.28 -0.17 0.02 0.00 -0.26 0.00 0.00 64.21 64.08 3clc n SER 31 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3clc n ASN 32 N 1.19 -4.57 -1.03 4.04 3.02 -0.79 -4.84 115.26 112.29 3clc n ASN 32 Ca 0.15 -1.18 0.00 0.00 -0.03 0.00 0.00 54.58 53.52 3clc n ASN 32 Cb 0.52 -2.11 0.00 0.00 -0.61 0.00 0.00 39.78 37.58 3clc n ASN 32 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3clc n LEU 33 N -4.53 0.00 -4.61 3.41 4.77 -0.96 -5.07 117.00 110.02 3clc n LEU 33 Ca -0.13 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.51 3clc n LEU 33 Cb 0.58 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.57 3clc n LEU 33 CO 0.71 0.00 -0.29 -0.62 -1.33 0.00 0.00 177.39 175.86 3clc s ASP 34 N -0.55 5.31 0.29 -1.43 -1.08 -1.26 -4.45 116.67 113.50 3clc s ASP 34 Ca 0.00 0.04 0.04 0.00 -0.52 0.00 0.00 52.55 52.11 3clc s ASP 34 Cb 0.00 -1.82 0.75 0.00 -1.46 0.00 0.00 42.92 40.39 3clc s ASP 34 CO 0.00 0.22 1.69 -0.09 0.52 0.00 0.00 175.17 177.50 3clc h ARG 35 N 6.36 0.36 0.00 4.34 1.12 -1.91 0.49 114.38 125.14 3clc h ARG 35 Ca -0.38 -0.02 -0.09 0.00 -1.11 0.00 0.00 59.98 58.38 3clc h ARG 35 Cb 1.18 -0.08 -0.01 0.00 -0.01 0.00 0.00 29.97 31.05 3clc h ARG 35 CO 0.65 0.23 -0.44 1.79 -3.11 0.00 0.00 179.97 179.09 3clc h THR 36 N 0.37 1.30 -0.26 0.20 1.35 -1.98 0.62 112.91 114.50 3clc h THR 36 Ca 0.57 -1.53 -0.02 0.00 -0.55 0.00 0.00 66.41 64.87 3clc h THR 36 Cb 1.10 1.83 -0.01 0.00 -1.73 0.00 0.00 68.15 69.35 3clc h THR 36 CO -0.55 0.44 0.07 0.22 -0.25 0.00 0.00 175.52 175.45 3clc h TYR 37 N 0.00 0.42 -0.16 4.73 3.20 -0.50 -2.46 116.97 122.20 3clc h TYR 37 Ca -0.00 -0.04 -0.17 0.00 3.14 0.00 0.00 58.73 61.65 3clc h TYR 37 Cb 0.80 -0.12 0.01 0.00 1.54 0.00 0.00 36.73 38.95 3clc h TYR 37 CO 0.00 0.47 -0.55 0.82 -1.64 0.00 0.00 178.16 177.26 3clc h ILE 38 N 0.25 1.32 -0.25 1.81 1.08 -0.55 -1.93 117.51 119.24 3clc h ILE 38 Ca 0.08 -1.80 0.06 0.00 -0.39 0.00 0.00 64.86 62.80 3clc h ILE 38 Cb 0.25 2.00 -0.08 0.00 -3.07 0.00 0.00 36.82 35.93 3clc h ILE 38 CO -0.00 0.56 -0.39 -1.28 -0.69 0.00 0.00 178.15 176.35 3clc h SER 39 N 0.33 -1.25 -0.75 1.72 0.87 -0.95 -1.65 113.55 111.86 3clc h SER 39 Ca -0.02 0.18 0.09 0.00 -1.23 0.00 0.00 61.79 60.81 3clc h SER 39 Cb 1.18 0.54 -0.07 0.00 -0.44 0.00 0.00 62.40 63.61 3clc h SER 39 CO 0.12 -0.38 0.41 1.23 -0.53 0.00 0.00 176.83 177.67 3clc h GLY 40 N -0.39 1.14 0.82 5.77 0.00 -1.22 0.11 103.07 109.30 3clc h GLY 40 Ca 0.11 -0.27 0.05 0.00 0.00 0.00 0.00 47.33 47.22 3clc h GLY 40 CO -0.46 0.11 0.58 -2.22 0.00 0.00 0.00 176.54 174.55 3clc h ILE 41 N 0.70 1.12 0.00 2.60 2.04 -1.02 0.15 117.51 123.10 3clc h ILE 41 Ca 0.36 -0.38 -0.09 0.00 1.00 0.00 0.00 64.86 65.75 3clc h ILE 41 Cb 0.33 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.31 3clc h ILE 41 CO -0.24 0.20 -0.41 -0.33 0.00 0.00 0.00 178.15 177.37 3clc h GLU 42 N 1.11 0.00 -1.08 2.37 5.08 0.15 0.90 114.58 123.10 3clc h GLU 42 Ca 0.37 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 58.25 3clc h GLU 42 Cb 0.07 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 29.07 3clc h GLU 42 CO -0.14 0.41 0.63 0.54 -1.00 0.00 0.00 179.01 179.45 3clc n ARG 43 N -3.30 2.20 -2.89 2.33 3.00 -0.76 -4.82 116.66 112.43 3clc n ARG 43 Ca 0.01 -2.58 -0.12 0.00 -0.01 0.00 0.00 57.85 55.15 3clc n ARG 43 Cb 0.64 -2.01 -0.01 0.00 0.00 0.00 0.00 32.46 31.08 3clc n ARG 43 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 3clc n ASN 44 N -0.68 -2.17 -1.54 0.55 5.15 0.31 -4.80 115.26 112.07 3clc n ASN 44 Ca 0.50 0.07 0.09 0.00 -0.60 0.00 0.00 54.58 54.64 3clc n ASN 44 Cb 1.08 -1.91 0.35 0.00 -0.53 0.00 0.00 39.78 38.77 3clc n ASN 44 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 3clc n SER 45 N -1.82 4.84 -3.95 1.20 3.41 0.50 -4.92 113.62 112.88 3clc n SER 45 Ca -0.02 -2.62 -0.13 0.00 -0.26 0.00 0.00 58.87 55.84 3clc n SER 45 Cb 0.52 -0.59 -0.13 0.00 -0.26 0.00 0.00 64.21 63.76 3clc n SER 45 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3clc s ARG 46 N -2.16 0.30 -0.51 4.33 0.52 -1.22 -4.86 118.95 115.34 3clc s ARG 46 Ca 0.50 -0.28 -0.02 0.00 -0.52 0.00 0.00 55.73 55.41 3clc s ARG 46 Cb 0.34 -0.20 0.13 0.00 0.52 0.00 0.00 34.95 35.75 3clc s ARG 46 CO 0.20 0.05 0.30 1.21 0.02 0.00 0.00 175.30 177.08 3clc s ASN 47 N -0.51 5.12 0.23 0.23 2.47 -1.26 -4.81 114.94 116.41 3clc s ASN 47 Ca -0.03 -2.50 -0.08 0.00 0.42 0.00 0.00 52.86 50.66 3clc s ASN 47 Cb -0.04 -1.81 -0.07 0.00 -1.45 0.00 0.00 41.25 37.89 3clc s ASN 47 CO -0.00 -0.42 0.52 -1.48 -3.72 0.00 0.00 177.10 172.00 3clc s LEU 48 N 0.45 4.17 0.68 3.21 0.05 -1.26 -5.06 118.68 120.91 3clc s LEU 48 Ca 0.13 0.84 -0.15 0.00 0.05 0.00 0.00 54.13 55.00 3clc s LEU 48 Cb -0.22 -3.61 0.01 0.00 -2.05 0.00 0.00 46.19 40.32 3clc s LEU 48 CO -0.04 -0.07 1.15 0.28 -0.55 0.00 0.00 176.35 177.12 3clc s THR 49 N -1.83 2.89 0.24 5.48 -1.32 -1.26 -4.87 115.64 114.97 3clc s THR 49 Ca 0.46 0.43 -0.06 0.00 -1.21 0.00 0.00 61.69 61.31 3clc s THR 49 Cb -0.11 -2.97 0.22 0.00 -1.51 0.00 0.00 72.50 68.13 3clc s THR 49 CO 0.23 -0.24 1.69 0.40 -2.21 0.00 0.00 174.62 174.49 3clc h ILE 50 N -0.02 0.54 -0.73 5.08 1.08 -1.99 -1.13 117.51 120.35 3clc h ILE 50 Ca -0.47 -0.09 0.11 0.00 -0.39 0.00 0.00 64.86 64.01 3clc h ILE 50 Cb 1.27 0.24 -0.08 0.00 -3.07 0.00 0.00 36.82 35.18 3clc h ILE 50 CO 0.53 0.05 0.34 0.11 -0.69 0.00 0.00 178.15 178.49 3clc h LYS 51 N 0.28 0.54 -0.50 2.37 1.57 -1.99 0.31 116.57 119.14 3clc h LYS 51 Ca 0.40 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 59.03 3clc h LYS 51 Cb 0.66 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 3clc h LYS 51 CO -0.49 0.36 -0.15 0.77 -0.57 0.00 0.00 179.45 179.37 3clc h SER 52 N 0.56 1.00 -1.01 0.86 0.02 -1.63 -1.80 113.55 111.55 3clc h SER 52 Ca 0.37 -0.37 0.09 0.00 -0.84 0.00 0.00 61.79 61.04 3clc h SER 52 Cb 0.46 -0.27 -0.08 0.00 0.14 0.00 0.00 62.40 62.65 3clc h SER 52 CO -0.31 1.14 0.64 0.25 -1.14 0.00 0.00 176.83 177.41 3clc h LEU 53 N 0.84 0.99 -0.67 5.07 6.46 -0.00 -0.54 115.31 127.47 3clc h LEU 53 Ca 0.12 0.03 -0.12 0.00 -0.12 0.00 0.00 57.88 57.79 3clc h LEU 53 Cb 0.72 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.45 3clc h LEU 53 CO 0.05 0.59 -0.24 -0.08 -0.62 0.00 0.00 178.44 178.14 3clc h GLU 54 N 1.10 0.77 -0.28 1.25 4.81 -0.34 0.06 114.58 121.95 3clc h GLU 54 Ca 0.46 -0.32 -0.08 0.00 -0.13 0.00 0.00 59.36 59.30 3clc h GLU 54 Cb 0.31 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 3clc h GLU 54 CO -0.21 0.94 -0.14 -0.07 -0.73 0.00 0.00 179.01 178.79 3clc h LEU 55 N 0.67 0.48 -0.17 1.64 3.38 -0.34 -1.88 115.31 119.09 3clc h LEU 55 Ca 0.09 -0.13 -0.22 0.00 0.09 0.00 0.00 57.88 57.71 3clc h LEU 55 Cb 0.76 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3clc h LEU 55 CO 0.06 0.65 -0.96 0.40 0.09 0.00 0.00 178.44 178.68 3clc h ILE 56 N 0.45 1.47 -0.56 1.22 2.04 -0.17 -2.40 117.51 119.56 3clc h ILE 56 Ca 0.08 -2.66 -0.08 0.00 1.00 0.00 0.00 64.86 63.20 3clc h ILE 56 Cb 0.52 2.54 -0.02 0.00 -0.74 0.00 0.00 36.82 39.11 3clc h ILE 56 CO 0.03 0.78 0.02 0.24 0.00 0.00 0.00 178.15 179.22 3clc h MET 57 N 0.14 0.96 0.00 2.37 2.86 -0.79 0.19 114.93 120.66 3clc h MET 57 Ca -0.07 -0.27 -0.06 0.00 -2.06 0.00 0.00 59.70 57.24 3clc h MET 57 Cb 1.61 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 33.16 3clc h MET 57 CO 0.15 0.93 -0.29 0.87 1.06 0.00 0.00 176.91 179.64 3clc h LYS 58 N 0.88 0.00 0.17 1.72 6.56 -1.18 -0.37 116.57 124.36 3clc h LYS 58 Ca 0.17 0.00 -0.24 0.00 -1.06 0.00 0.00 60.65 59.52 3clc h LYS 58 Cb 0.49 0.00 0.02 0.00 -0.57 0.00 0.00 32.23 32.17 3clc h LYS 58 CO 0.02 0.29 -1.09 0.78 -2.06 0.00 0.00 179.45 177.40 3clc h GLY 59 N 1.23 0.40 2.00 3.86 0.00 -0.83 -2.91 103.07 106.82 3clc h GLY 59 Ca -0.00 -1.03 -0.00 0.00 0.00 0.00 0.00 47.33 46.29 3clc h GLY 59 CO 0.04 0.91 -0.02 1.41 0.00 0.00 0.00 176.54 178.87 3clc h LEU 60 N -0.23 0.00 -1.24 3.11 3.38 -0.55 -3.44 115.31 116.34 3clc h LEU 60 Ca -0.20 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.55 3clc h LEU 60 Cb 1.80 0.00 0.09 0.00 0.09 0.00 0.00 40.66 42.64 3clc h LEU 60 CO 0.17 0.02 -0.42 -0.62 0.09 0.00 0.00 178.44 177.68 3clc n GLU 61 N -3.47 -4.39 -4.84 1.13 1.02 -0.23 -5.02 120.64 104.85 3clc n GLU 61 Ca -0.03 0.49 -0.27 0.00 -0.02 0.00 0.00 57.16 57.33 3clc n GLU 61 Cb 0.12 -4.48 -0.15 0.00 -0.02 0.00 0.00 31.44 26.91 3clc n GLU 61 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3clc s VAL 62 N -3.20 1.75 0.44 2.62 0.11 -0.70 -5.03 120.40 116.38 3clc s VAL 62 Ca 0.22 -1.12 -0.23 0.00 -2.93 0.00 0.00 61.98 57.91 3clc s VAL 62 Cb -0.10 -1.49 -0.08 0.00 -1.53 0.00 0.00 36.38 33.18 3clc s VAL 62 CO 0.43 0.33 1.10 -0.94 -3.33 0.00 0.00 175.10 172.69 3clc s SER 63 N -0.94 6.43 0.28 3.54 1.04 -1.26 -4.52 113.70 118.27 3clc s SER 63 Ca 0.08 2.16 0.02 0.00 0.48 0.00 0.00 55.95 58.69 3clc s SER 63 Cb -0.09 -2.59 0.66 0.00 0.10 0.00 0.00 66.02 64.11 3clc s SER 63 CO 0.01 -0.73 1.71 0.44 0.98 0.00 0.00 173.24 175.66 3clc h ASP 64 N 2.19 0.37 -0.24 7.02 3.32 -1.99 -1.12 116.42 125.96 3clc h ASP 64 Ca -0.49 0.14 0.05 0.00 0.02 0.00 0.00 57.03 56.75 3clc h ASP 64 Cb 1.23 0.10 -0.05 0.00 0.22 0.00 0.00 39.33 40.83 3clc h ASP 64 CO 0.61 0.06 -0.10 0.58 -1.72 0.00 0.00 179.24 178.66 3clc h VAL 65 N 0.45 0.66 0.00 -1.35 2.07 -2.00 -0.75 116.25 115.33 3clc h VAL 65 Ca 0.53 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.97 3clc h VAL 65 Cb 0.94 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 3clc h VAL 65 CO -0.48 0.00 -0.38 -0.37 0.02 0.00 0.00 177.57 176.36 3clc h VAL 66 N -0.07 0.93 -0.21 2.57 -1.51 -1.68 -1.10 116.25 115.19 3clc h VAL 66 Ca 0.13 -1.50 -0.01 0.00 -1.23 0.00 0.00 66.70 64.08 3clc h VAL 66 Cb 0.26 1.90 -0.01 0.00 -2.13 0.00 0.00 31.29 31.31 3clc h VAL 66 CO -0.29 0.37 0.09 0.15 -1.23 0.00 0.00 177.57 176.66 3clc h PHE 67 N 0.00 0.31 -0.00 5.19 3.57 -0.46 -1.71 116.94 123.84 3clc h PHE 67 Ca -0.00 -0.02 -0.19 0.00 3.53 0.00 0.00 57.97 61.29 3clc h PHE 67 Cb 0.87 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.50 3clc h PHE 67 CO 0.00 0.34 -0.84 0.74 -2.23 0.00 0.00 178.31 176.32 3clc h PHE 68 N 0.19 0.20 -0.63 0.41 0.04 -0.94 0.22 116.94 116.44 3clc h PHE 68 Ca 0.07 -0.11 0.07 0.00 2.80 0.00 0.00 57.97 60.80 3clc h PHE 68 Cb 0.16 -0.02 -0.06 0.00 2.20 0.00 0.00 35.95 38.23 3clc h PHE 68 CO -0.01 0.91 0.31 0.93 -0.60 0.00 0.00 178.31 179.84 3clc h GLU 69 N 0.08 0.54 -0.40 1.51 5.08 -1.10 -0.49 114.58 119.80 3clc h GLU 69 Ca -0.03 -0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.14 3clc h GLU 69 Cb 1.46 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 3clc h GLU 69 CO 0.12 0.36 -0.36 0.52 -1.00 0.00 0.00 179.01 178.65 3clc h MET 70 N 0.56 0.95 -0.90 2.33 2.86 -0.81 -2.43 114.93 117.49 3clc h MET 70 Ca 0.30 -0.49 0.00 0.00 -2.06 0.00 0.00 59.70 57.45 3clc h MET 70 Cb 0.26 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.89 3clc h MET 70 CO -0.23 1.15 0.58 1.25 1.06 0.00 0.00 176.91 180.72 3clc h LEU 71 N 0.78 1.05 -0.36 1.22 6.46 -0.35 -0.50 115.31 123.62 3clc h LEU 71 Ca 0.07 -0.04 -0.06 0.00 -0.12 0.00 0.00 57.88 57.73 3clc h LEU 71 Cb 0.96 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 40.61 3clc h LEU 71 CO 0.09 0.78 -0.01 0.40 -0.62 0.00 0.00 178.44 179.08 3clc h ILE 72 N 1.23 1.26 -0.57 4.05 2.04 -0.90 -0.50 117.51 124.13 3clc h ILE 72 Ca 0.33 -1.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 3clc h ILE 72 Cb -0.11 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 3clc h ILE 72 CO -0.07 0.33 0.33 0.50 0.00 0.00 0.00 178.15 179.24 3clc h LYS 73 N 0.45 0.79 -0.56 2.37 3.64 -0.93 -2.02 116.57 120.30 3clc h LYS 73 Ca 0.10 -0.08 -0.10 0.00 -1.27 0.00 0.00 60.65 59.29 3clc h LYS 73 Cb 0.48 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 3clc h LYS 73 CO 0.02 0.59 -0.06 1.49 -2.27 0.00 0.00 179.45 179.22 3clc h GLU 74 N 0.77 1.02 -0.35 1.90 4.57 -0.87 -1.91 114.58 119.71 3clc h GLU 74 Ca 0.20 -0.34 0.01 0.00 -1.18 0.00 0.00 59.36 58.04 3clc h GLU 74 Cb 0.02 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.51 3clc h GLU 74 CO -0.03 1.03 0.23 0.82 -1.18 0.00 0.00 179.01 179.88 3clc h ILE 75 N 0.92 1.08 -0.00 2.32 2.04 -0.48 -2.60 117.51 120.79 3clc h ILE 75 Ca 0.15 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.85 3clc h ILE 75 Cb 0.61 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 3clc h ILE 75 CO 0.04 0.08 -0.04 0.18 0.00 0.00 0.00 178.15 178.41 3clc n LEU 76 N -4.49 0.15 0.00 1.44 4.77 -0.72 -5.10 117.00 113.06 3clc n LEU 76 Ca 0.02 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 3clc n LEU 76 Cb 0.07 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 3clc n LEU 76 CO 0.35 0.03 0.00 1.17 -1.33 0.00 0.00 177.39 177.61