#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 0.91 0.07 1.62 1.04 -1.26 -5.09 113.70 110.99 3clc s SER 3 Ca 0.00 -0.40 -0.21 0.00 0.48 0.00 0.00 55.95 55.82 3clc s SER 3 Cb 0.00 -0.02 -0.09 0.00 0.10 0.00 0.00 66.02 66.02 3clc s SER 3 CO 0.00 -0.08 1.35 0.15 0.98 0.00 0.00 173.24 175.63 3clc h PHE 4 N 5.03 -1.00 -0.45 5.02 3.57 -2.05 -3.00 116.94 124.06 3clc h PHE 4 Ca -0.34 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.17 3clc h PHE 4 Cb 1.20 0.44 -0.02 0.00 2.79 0.00 0.00 35.95 40.35 3clc h PHE 4 CO 0.56 -0.36 0.18 1.25 -2.23 0.00 0.00 178.31 177.71 3clc h LEU 5 N -0.41 0.58 0.14 0.59 6.46 -1.99 -2.80 115.31 117.87 3clc h LEU 5 Ca 0.01 -0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.70 3clc h LEU 5 Cb 0.45 -0.15 0.00 0.00 -0.73 0.00 0.00 40.66 40.23 3clc h LEU 5 CO -0.24 0.53 -0.07 -0.07 -0.62 0.00 0.00 178.44 177.97 3clc h LEU 6 N 0.64 -0.16 -1.44 2.25 3.38 -1.93 0.39 115.31 118.44 3clc h LEU 6 Ca 0.16 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.07 3clc h LEU 6 Cb 0.12 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 3clc h LEU 6 CO -0.02 -0.00 0.41 0.77 0.09 0.00 0.00 178.44 179.69 3clc h SER 7 N -0.30 0.63 -0.37 -0.43 4.64 -1.42 0.69 113.55 116.98 3clc h SER 7 Ca -0.02 -0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.23 3clc h SER 7 Cb 0.24 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 3clc h SER 7 CO 0.03 0.43 -0.03 0.11 -0.87 0.00 0.00 176.83 176.50 3clc h LYS 8 N 0.73 0.68 -0.13 4.77 1.79 -1.24 -1.23 116.57 121.94 3clc h LYS 8 Ca 0.25 -0.23 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 3clc h LYS 8 Cb 0.08 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.67 3clc h LYS 8 CO -0.07 0.80 0.08 0.28 -1.08 0.00 0.00 179.45 179.47 3clc h VAL 9 N 0.50 1.04 -0.05 0.50 2.07 0.14 -1.51 116.25 118.94 3clc h VAL 9 Ca 0.10 -0.09 -0.08 0.00 0.82 0.00 0.00 66.70 67.45 3clc h VAL 9 Cb 0.52 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 3clc h VAL 9 CO 0.03 0.04 -0.35 0.77 0.02 0.00 0.00 177.57 178.07 3clc h SER 10 N 0.17 0.09 -0.71 0.57 4.64 -0.92 -1.87 113.55 115.51 3clc h SER 10 Ca 0.05 -0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.29 3clc h SER 10 Cb -0.01 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.03 3clc h SER 10 CO -0.01 0.44 0.26 0.15 -0.87 0.00 0.00 176.83 176.80 3clc h PHE 11 N 0.08 1.10 -0.34 4.77 3.57 -0.81 -2.62 116.94 122.69 3clc h PHE 11 Ca 0.01 -0.09 -0.14 0.00 3.53 0.00 0.00 57.97 61.28 3clc h PHE 11 Cb 0.66 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 3clc h PHE 11 CO 0.00 0.86 -0.34 0.28 -2.23 0.00 0.00 178.31 176.88 3clc h VAL 12 N 1.02 1.28 -0.33 1.41 2.07 -0.57 -1.13 116.25 120.01 3clc h VAL 12 Ca 0.23 -1.50 -0.00 0.00 0.82 0.00 0.00 66.70 66.25 3clc h VAL 12 Cb 0.24 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.38 3clc h VAL 12 CO -0.02 0.49 0.19 0.40 0.02 0.00 0.00 177.57 178.65 3clc h ILE 13 N 0.63 1.13 -0.21 4.57 2.04 -1.31 -1.22 117.51 123.14 3clc h ILE 13 Ca 0.06 -0.31 -0.06 0.00 1.00 0.00 0.00 64.86 65.55 3clc h ILE 13 Cb 0.88 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.69 3clc h ILE 13 CO 0.08 0.13 -0.14 0.50 0.00 0.00 0.00 178.15 178.72 3clc h LYS 14 N 0.41 0.35 0.19 2.37 3.64 -1.36 -1.23 116.57 120.95 3clc h LYS 14 Ca 0.12 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 3clc h LYS 14 Cb 0.04 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 3clc h LYS 14 CO -0.02 0.49 -0.09 -0.22 -2.27 0.00 0.00 179.45 177.34 3clc h LYS 15 N 0.33 -0.25 -0.28 1.90 3.64 -0.69 -2.42 116.57 118.80 3clc h LYS 15 Ca 0.06 0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.51 3clc h LYS 15 Cb 0.44 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.27 3clc h LYS 15 CO 0.03 0.12 0.00 0.82 -2.27 0.00 0.00 179.45 178.15 3clc h ILE 16 N -0.67 0.80 -0.56 2.00 2.04 -1.23 -0.93 117.51 118.96 3clc h ILE 16 Ca -0.03 -0.03 0.08 0.00 1.00 0.00 0.00 64.86 65.88 3clc h ILE 16 Cb 0.48 0.71 -0.06 0.00 -0.74 0.00 0.00 36.82 37.20 3clc h ILE 16 CO 0.04 0.02 0.21 -0.09 0.00 0.00 0.00 178.15 178.33 3clc h ARG 17 N 0.09 0.39 -0.20 2.37 2.43 -1.16 0.28 114.38 118.58 3clc h ARG 17 Ca 0.13 -0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 59.13 3clc h ARG 17 Cb 0.17 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 3clc h ARG 17 CO -0.22 0.26 -0.46 -0.07 -1.51 0.00 0.00 179.97 177.96 3clc h LEU 18 N 0.40 0.76 -0.95 3.80 3.38 -1.24 -1.25 115.31 120.20 3clc h LEU 18 Ca 0.28 -0.56 0.23 0.00 0.09 0.00 0.00 57.88 57.92 3clc h LEU 18 Cb 0.31 -0.22 -0.12 0.00 0.09 0.00 0.00 40.66 40.72 3clc h LEU 18 CO -0.27 1.18 0.49 -0.33 0.09 0.00 0.00 178.44 179.60 3clc h GLU 19 N 0.37 0.47 -0.05 1.13 5.08 -0.35 0.25 114.58 121.47 3clc h GLU 19 Ca -0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3clc h GLU 19 Cb 1.07 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.22 3clc h GLU 19 CO 0.10 0.31 0.00 1.63 -1.00 0.00 0.00 179.01 180.05 3clc n LYS 20 N -4.97 1.44 -1.34 2.33 5.02 0.01 -4.90 118.16 115.75 3clc n LYS 20 Ca 0.24 -0.64 -0.12 0.00 -2.02 0.00 0.00 58.31 55.77 3clc n LYS 20 Cb 0.70 -1.43 -0.05 0.00 -0.02 0.00 0.00 35.03 34.23 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 1.06 1.25 3.80 0.72 0.00 0.86 -5.00 105.19 107.88 3clc n GLY 21 Ca 0.18 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.89 4.40 0.48 1.61 -1.94 -0.52 -5.01 119.30 115.42 3clc s MET 22 Ca 0.00 1.14 -0.01 0.00 -1.71 0.00 0.00 55.69 55.12 3clc s MET 22 Cb 0.00 -2.64 0.00 0.00 2.01 0.00 0.00 34.83 34.20 3clc s MET 22 CO 0.00 0.22 0.72 0.95 -0.01 0.00 0.00 175.02 176.90 3clc s THR 23 N -1.76 3.88 0.40 2.05 -4.23 -1.26 -4.40 115.64 110.31 3clc s THR 23 Ca 0.52 -0.42 0.18 0.00 -1.18 0.00 0.00 61.69 60.79 3clc s THR 23 Cb -0.15 -3.45 0.38 0.00 1.34 0.00 0.00 72.50 70.62 3clc s THR 23 CO 0.20 -0.34 1.79 1.56 -0.54 0.00 0.00 174.62 177.29 3clc h GLN 24 N 0.28 0.41 0.22 3.99 4.20 -1.98 -2.41 115.11 119.82 3clc h GLN 24 Ca -0.46 -0.02 -0.31 0.00 0.06 0.00 0.00 58.65 57.92 3clc h GLN 24 Cb 1.25 -0.09 0.03 0.00 0.30 0.00 0.00 27.48 28.97 3clc h GLN 24 CO 0.58 0.27 -1.38 1.49 -0.67 0.00 0.00 178.83 179.12 3clc h GLU 25 N 0.42 0.47 -0.47 1.46 4.81 -1.93 -0.57 114.58 118.76 3clc h GLU 25 Ca 0.56 -0.80 0.04 0.00 -0.13 0.00 0.00 59.36 59.04 3clc h GLU 25 Cb 1.39 0.30 -0.06 0.00 0.63 0.00 0.00 28.75 31.01 3clc h GLU 25 CO -0.27 1.38 -0.28 -0.25 -0.73 0.00 0.00 179.01 178.87 3clc n ASP 26 N -3.80 -0.50 -0.34 1.04 8.00 -1.09 -1.18 116.55 118.68 3clc n ASP 26 Ca -0.18 1.36 0.10 0.00 0.71 0.00 0.00 54.79 56.79 3clc n ASP 26 Cb 1.04 -0.37 0.22 0.00 -0.02 0.00 0.00 41.12 41.99 3clc n ASP 26 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3clc h LEU 27 N 0.00 -0.64 -0.98 0.64 5.85 -1.21 0.36 115.31 119.33 3clc h LEU 27 Ca 0.08 0.28 -0.08 0.00 0.84 0.00 0.00 57.88 58.99 3clc h LEU 27 Cb 0.19 0.52 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 3clc h LEU 27 CO -0.44 -0.33 -0.17 0.00 -0.34 0.00 0.00 178.44 177.16 3clc h ALA 28 N 1.96 1.14 0.27 1.25 0.00 0.41 -1.10 119.26 123.19 3clc h ALA 28 Ca 0.54 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3clc h ALA 28 Cb 1.00 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3clc h ALA 28 CO -0.94 0.54 -0.13 -0.92 0.00 0.00 0.00 179.25 177.80 3clc h TYR 29 N 0.49 -0.33 -0.21 0.00 5.03 0.42 -1.14 116.97 121.22 3clc h TYR 29 Ca 0.08 -0.01 0.06 0.00 2.58 0.00 0.00 58.73 61.45 3clc h TYR 29 Cb 0.58 0.11 -0.01 0.00 1.55 0.00 0.00 36.73 38.96 3clc h TYR 29 CO 0.02 -0.19 0.75 -0.22 -1.32 0.00 0.00 178.16 177.20 3clc h LYS 30 N -1.09 0.00 0.00 1.82 3.64 -0.43 0.63 116.57 121.15 3clc h LYS 30 Ca -0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3clc h LYS 30 Cb 0.30 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 3clc h LYS 30 CO 0.06 0.00 -0.00 -1.13 -2.27 0.00 0.00 179.45 176.11 3clc n SER 31 N -2.89 1.63 -3.42 4.20 3.41 -0.44 -4.48 113.62 111.62 3clc n SER 31 Ca 0.04 -1.84 -0.20 0.00 -0.26 0.00 0.00 58.87 56.61 3clc n SER 31 Cb 0.83 -0.01 0.08 0.00 -0.26 0.00 0.00 64.21 64.85 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 -0.43 -4.45 -4.35 4.04 4.13 0.22 -4.60 115.26 109.83 3clc n ASN 32 Ca 0.00 -0.55 -0.18 0.00 1.68 0.00 0.00 54.58 55.53 3clc n ASN 32 Cb 0.31 -4.91 -0.10 0.00 -1.54 0.00 0.00 39.78 33.53 3clc n ASN 32 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3clc s LEU 33 N -6.71 2.29 0.54 3.41 1.43 -0.53 -5.06 118.68 114.06 3clc s LEU 33 Ca 0.33 -1.19 -0.20 0.00 -1.03 0.00 0.00 54.13 52.03 3clc s LEU 33 Cb -0.14 -0.36 -0.07 0.00 0.03 0.00 0.00 46.19 45.65 3clc s LEU 33 CO 0.70 -0.46 0.98 -0.67 0.23 0.00 0.00 176.35 177.14 3clc n ASP 34 N -0.44 0.98 -0.18 2.29 -0.08 -1.26 -4.40 116.55 113.46 3clc n ASP 34 Ca -0.06 0.88 0.02 0.00 -1.51 0.00 0.00 54.79 54.13 3clc n ASP 34 Cb 0.63 -1.38 0.29 0.00 2.34 0.00 0.00 41.12 43.00 3clc n ASP 34 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 3clc h ARG 35 N 0.88 0.88 -0.40 -0.67 0.11 -1.93 -2.36 114.38 110.89 3clc h ARG 35 Ca -0.47 -0.05 -0.15 0.00 0.10 0.00 0.00 59.98 59.40 3clc h ARG 35 Cb 1.35 -0.20 -0.01 0.00 1.11 0.00 0.00 29.97 32.23 3clc h ARG 35 CO 0.53 0.58 -0.34 1.79 0.10 0.00 0.00 179.97 182.63 3clc h THR 36 N 0.91 1.27 -0.33 0.08 1.35 -1.98 -3.02 112.91 111.19 3clc h THR 36 Ca 0.27 -1.51 0.00 0.00 -0.55 0.00 0.00 66.41 64.62 3clc h THR 36 Cb -0.03 1.32 -0.02 0.00 -1.73 0.00 0.00 68.15 67.70 3clc h THR 36 CO -0.07 0.51 0.22 0.22 -0.25 0.00 0.00 175.52 176.15 3clc h TYR 37 N 0.77 0.42 -0.57 4.73 3.20 -1.79 -0.68 116.97 123.05 3clc h TYR 37 Ca 0.07 0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.98 3clc h TYR 37 Cb 0.92 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 39.01 3clc h TYR 37 CO 0.06 0.27 0.34 0.82 -1.64 0.00 0.00 178.16 178.00 3clc h ILE 38 N 0.45 1.05 -0.27 1.81 1.08 -1.56 -0.46 117.51 119.61 3clc h ILE 38 Ca 0.12 -0.23 0.05 0.00 -0.39 0.00 0.00 64.86 64.41 3clc h ILE 38 Cb -0.05 0.33 -0.04 0.00 -3.07 0.00 0.00 36.82 33.99 3clc h ILE 38 CO -0.03 0.12 -0.02 -1.28 -0.69 0.00 0.00 178.15 176.26 3clc h SER 39 N 0.66 -0.14 -0.43 1.72 0.87 -1.33 -1.85 113.55 113.05 3clc h SER 39 Ca 0.23 0.07 -0.09 0.00 -1.23 0.00 0.00 61.79 60.76 3clc h SER 39 Cb 0.04 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.10 3clc h SER 39 CO -0.11 -0.04 -0.07 1.23 -0.53 0.00 0.00 176.83 177.31 3clc h GLY 40 N 0.06 0.95 0.66 5.77 0.00 -0.24 0.12 103.07 110.38 3clc h GLY 40 Ca 0.13 -0.71 0.06 0.00 0.00 0.00 0.00 47.33 46.80 3clc h GLY 40 CO -0.23 0.65 0.28 -2.22 0.00 0.00 0.00 176.54 175.02 3clc h ILE 41 N 0.80 0.93 -0.02 2.60 2.04 -0.97 -1.21 117.51 121.68 3clc h ILE 41 Ca 0.14 -0.18 -0.14 0.00 1.00 0.00 0.00 64.86 65.67 3clc h ILE 41 Cb 0.58 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 3clc h ILE 41 CO 0.04 0.10 -0.66 -0.33 0.00 0.00 0.00 178.15 177.29 3clc h GLU 42 N 0.53 0.08 -1.03 2.37 5.08 0.02 0.54 114.58 122.17 3clc h GLU 42 Ca 0.26 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 3clc h GLU 42 Cb 0.19 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.45 3clc h GLU 42 CO -0.19 0.71 0.00 0.54 -1.00 0.00 0.00 179.01 179.07 3clc n ARG 43 N -3.78 0.84 -1.78 2.33 1.74 -0.23 -4.83 116.66 110.95 3clc n ARG 43 Ca -0.02 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.03 3clc n ARG 43 Cb 0.65 -1.22 -0.01 0.00 -1.02 0.00 0.00 32.46 30.87 3clc n ARG 43 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3clc n ASN 44 N 0.38 -1.35 -1.54 0.55 5.15 0.19 -4.72 115.26 113.92 3clc n ASN 44 Ca 0.00 0.25 0.07 0.00 -0.60 0.00 0.00 54.58 54.29 3clc n ASN 44 Cb 0.34 -1.43 0.32 0.00 -0.53 0.00 0.00 39.78 38.48 3clc n ASN 44 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 3clc n SER 45 N -0.47 4.55 -3.85 1.20 7.64 -0.47 -4.79 113.62 117.44 3clc n SER 45 Ca -0.04 -2.58 -0.14 0.00 1.01 0.00 0.00 58.87 57.12 3clc n SER 45 Cb 0.32 -0.60 -0.15 0.00 -1.01 0.00 0.00 64.21 62.77 3clc n SER 45 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3clc s ARG 46 N -2.15 0.08 -0.63 1.43 1.81 -1.22 -4.87 118.95 113.39 3clc s ARG 46 Ca 0.44 0.04 -0.11 0.00 -1.72 0.00 0.00 55.73 54.39 3clc s ARG 46 Cb 0.31 -0.18 0.16 0.00 -0.45 0.00 0.00 34.95 34.80 3clc s ARG 46 CO 0.17 -0.05 0.54 1.21 -0.68 0.00 0.00 175.30 176.48 3clc s ASN 47 N 0.42 6.06 0.48 0.23 2.47 -1.26 -4.87 114.94 118.48 3clc s ASN 47 Ca -0.04 -2.34 -0.14 0.00 0.42 0.00 0.00 52.86 50.77 3clc s ASN 47 Cb -0.06 -2.08 -0.07 0.00 -1.45 0.00 0.00 41.25 37.59 3clc s ASN 47 CO -0.01 -0.62 0.91 -1.48 -3.72 0.00 0.00 177.10 172.17 3clc s LEU 48 N 0.72 3.68 0.56 3.21 2.34 -1.26 -5.07 118.68 122.86 3clc s LEU 48 Ca 0.12 1.39 -0.19 0.00 0.06 0.00 0.00 54.13 55.51 3clc s LEU 48 Cb -0.20 -4.31 -0.05 0.00 -0.56 0.00 0.00 46.19 41.06 3clc s LEU 48 CO -0.03 -0.53 1.11 -0.89 -1.06 0.00 0.00 176.35 174.94 3clc s THR 49 N -2.56 3.29 0.19 5.48 2.01 -1.26 -4.94 115.64 117.85 3clc s THR 49 Ca 0.56 0.76 -0.12 0.00 0.31 0.00 0.00 61.69 63.20 3clc s THR 49 Cb -0.10 -3.28 0.10 0.00 0.01 0.00 0.00 72.50 69.23 3clc s THR 49 CO 0.33 -0.22 1.76 0.40 -0.69 0.00 0.00 174.62 176.19 3clc h ILE 50 N 1.00 0.85 -0.98 1.82 1.08 -1.99 -0.67 117.51 118.63 3clc h ILE 50 Ca -0.49 -0.14 0.17 0.00 -0.39 0.00 0.00 64.86 64.01 3clc h ILE 50 Cb 1.25 0.40 -0.10 0.00 -3.07 0.00 0.00 36.82 35.30 3clc h ILE 50 CO 0.57 0.08 0.58 0.11 -0.69 0.00 0.00 178.15 178.80 3clc h LYS 51 N 0.42 0.76 -0.32 2.37 1.57 -1.99 0.25 116.57 119.63 3clc h LYS 51 Ca 0.25 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.88 3clc h LYS 51 Cb 0.25 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 3clc h LYS 51 CO -0.23 0.50 -0.24 0.77 -0.57 0.00 0.00 179.45 179.67 3clc h SER 52 N 0.78 0.76 -0.39 0.86 0.02 -1.66 -2.33 113.55 111.58 3clc h SER 52 Ca 0.55 -0.45 0.07 0.00 -0.84 0.00 0.00 61.79 61.12 3clc h SER 52 Cb 0.79 -0.21 -0.07 0.00 0.14 0.00 0.00 62.40 63.05 3clc h SER 52 CO -0.36 1.05 -0.03 0.25 -1.14 0.00 0.00 176.83 176.60 3clc h LEU 53 N 0.48 -0.22 -0.81 5.07 6.46 0.16 0.18 115.31 126.63 3clc h LEU 53 Ca 0.06 0.10 0.12 0.00 -0.12 0.00 0.00 57.88 58.04 3clc h LEU 53 Cb 0.80 0.19 -0.08 0.00 -0.73 0.00 0.00 40.66 40.84 3clc h LEU 53 CO 0.06 -0.07 0.42 -0.08 -0.62 0.00 0.00 178.44 178.15 3clc h GLU 54 N 0.07 0.64 -0.29 1.25 4.81 -0.39 0.11 114.58 120.78 3clc h GLU 54 Ca 0.19 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.28 3clc h GLU 54 Cb 0.28 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 3clc h GLU 54 CO -0.35 0.42 -0.28 -0.07 -0.73 0.00 0.00 179.01 178.00 3clc h LEU 55 N 0.65 0.59 -0.63 1.64 3.38 -0.48 -1.37 115.31 119.10 3clc h LEU 55 Ca 0.42 -0.22 -0.13 0.00 0.09 0.00 0.00 57.88 58.04 3clc h LEU 55 Cb 0.51 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3clc h LEU 55 CO -0.31 0.85 -0.32 0.40 0.09 0.00 0.00 178.44 179.15 3clc h ILE 56 N 0.50 1.28 -0.52 1.22 2.04 0.36 -1.46 117.51 120.94 3clc h ILE 56 Ca 0.07 -1.46 -0.05 0.00 1.00 0.00 0.00 64.86 64.42 3clc h ILE 56 Cb 0.74 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 38.17 3clc h ILE 56 CO 0.06 0.48 0.14 0.24 0.00 0.00 0.00 178.15 179.07 3clc h MET 57 N 0.61 0.83 0.00 2.37 2.86 -0.18 0.12 114.93 121.54 3clc h MET 57 Ca 0.07 -0.19 -0.03 0.00 -2.06 0.00 0.00 59.70 57.49 3clc h MET 57 Cb 0.84 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 32.38 3clc h MET 57 CO 0.07 0.78 -0.15 -0.22 1.06 0.00 0.00 176.91 178.45 3clc h LYS 58 N 0.73 0.00 -0.18 1.72 3.64 -1.17 -2.28 116.57 119.03 3clc h LYS 58 Ca 0.17 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.47 3clc h LYS 58 Cb 0.31 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3clc h LYS 58 CO -0.00 0.15 -0.20 0.78 -2.27 0.00 0.00 179.45 177.91 3clc h GLY 59 N 0.90 0.48 0.89 5.01 0.00 0.18 -2.67 103.07 107.87 3clc h GLY 59 Ca -0.00 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 46.82 3clc h GLY 59 CO 0.02 0.46 0.00 1.04 0.00 0.00 0.00 176.54 178.06 3clc n LEU 60 N -4.47 0.00 -3.50 3.11 4.77 0.21 -4.80 117.00 112.32 3clc n LEU 60 Ca -0.06 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.74 3clc n LEU 60 Cb 0.40 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.56 3clc n LEU 60 CO 0.41 0.00 0.05 -0.62 -1.33 0.00 0.00 177.39 175.90 3clc n GLU 61 N -0.95 -5.78 -4.02 3.23 1.02 -0.99 -5.01 120.64 108.15 3clc n GLU 61 Ca 0.18 0.78 -0.13 0.00 -0.02 0.00 0.00 57.16 57.97 3clc n GLU 61 Cb 0.08 -5.64 -0.13 0.00 -0.02 0.00 0.00 31.44 25.73 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 -3.45 0.26 0.35 2.62 0.11 -0.91 -5.06 120.40 114.33 3clc s VAL 62 Ca 0.03 -0.44 -0.25 0.00 -2.93 0.00 0.00 61.98 58.39 3clc s VAL 62 Cb -0.01 -0.28 -0.10 0.00 -1.53 0.00 0.00 36.38 34.47 3clc s VAL 62 CO 0.76 -0.12 0.99 -0.94 -3.33 0.00 0.00 175.10 172.45 3clc s SER 63 N -0.60 7.11 0.23 3.54 1.04 -1.26 -4.39 113.70 119.37 3clc s SER 63 Ca -0.04 1.92 -0.17 0.00 0.48 0.00 0.00 55.95 58.15 3clc s SER 63 Cb -0.04 -2.58 0.26 0.00 0.10 0.00 0.00 66.02 63.75 3clc s SER 63 CO -0.00 -0.23 1.55 0.44 0.98 0.00 0.00 173.24 175.98 3clc h ASP 64 N 2.91 -1.39 -0.05 7.02 3.32 -1.98 0.02 116.42 126.27 3clc h ASP 64 Ca -0.47 0.31 0.01 0.00 0.02 0.00 0.00 57.03 56.89 3clc h ASP 64 Cb 1.20 0.74 -0.01 0.00 0.22 0.00 0.00 39.33 41.48 3clc h ASP 64 CO 0.64 -0.29 -0.10 0.58 -1.72 0.00 0.00 179.24 178.35 3clc h VAL 65 N -0.00 0.00 -0.17 -1.35 2.07 -2.00 -1.37 116.25 113.43 3clc h VAL 65 Ca 0.36 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.93 3clc h VAL 65 Cb 0.61 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 3clc h VAL 65 CO -0.99 0.00 0.14 1.62 0.02 0.00 0.00 177.57 178.36 3clc h VAL 66 N -0.08 0.73 0.06 2.57 3.04 -1.68 -0.32 116.25 120.57 3clc h VAL 66 Ca 0.01 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.70 3clc h VAL 66 Cb 0.11 0.90 0.00 0.00 -2.01 0.00 0.00 31.29 30.29 3clc h VAL 66 CO -0.09 0.00 -0.03 0.15 -1.01 0.00 0.00 177.57 176.59 3clc h PHE 67 N 0.00 -0.07 0.00 3.17 3.57 -0.22 -2.65 116.94 120.74 3clc h PHE 67 Ca 0.08 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 3clc h PHE 67 Cb 0.36 0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.12 3clc h PHE 67 CO 0.00 0.15 -0.16 0.74 -2.23 0.00 0.00 178.31 176.81 3clc h PHE 68 N -0.28 0.00 0.00 0.41 0.04 -0.04 -0.51 116.94 116.56 3clc h PHE 68 Ca -0.01 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.73 3clc h PHE 68 Cb 0.25 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.39 3clc h PHE 68 CO -0.01 0.16 -0.17 0.93 -0.60 0.00 0.00 178.31 178.62 3clc h GLU 69 N 0.00 0.00 0.05 1.51 5.08 -0.95 -0.87 114.58 119.39 3clc h GLU 69 Ca -0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.03 3clc h GLU 69 Cb 0.42 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.63 3clc h GLU 69 CO 0.02 0.17 -1.93 -1.33 -1.00 0.00 0.00 179.01 174.94 3clc n MET 70 N -3.50 0.69 -0.00 2.33 2.81 -0.30 -3.05 117.12 116.09 3clc n MET 70 Ca -0.01 0.25 -0.06 0.00 -1.81 0.00 0.00 57.70 56.07 3clc n MET 70 Cb 0.33 -1.72 -0.04 0.00 -0.71 0.00 0.00 33.22 31.08 3clc n MET 70 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 3clc h LEU 71 N 0.03 -0.63 -0.96 4.03 6.46 -0.98 -0.25 115.31 123.01 3clc h LEU 71 Ca -0.38 0.07 0.17 0.00 -0.12 0.00 0.00 57.88 57.63 3clc h LEU 71 Cb 2.04 0.25 -0.17 0.00 -0.73 0.00 0.00 40.66 42.04 3clc h LEU 71 CO 0.07 -0.18 -0.31 0.40 -0.62 0.00 0.00 178.44 177.80 3clc h ILE 72 N -0.21 0.03 -0.60 4.05 2.04 -1.30 0.18 117.51 121.69 3clc h ILE 72 Ca 0.01 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.84 3clc h ILE 72 Cb 0.25 0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.33 3clc h ILE 72 CO -0.16 0.00 0.23 0.11 0.00 0.00 0.00 178.15 178.33 3clc h LYS 73 N -0.01 0.87 -0.32 2.37 1.57 -1.41 -2.60 116.57 117.04 3clc h LYS 73 Ca 0.40 -0.14 -0.13 0.00 -1.87 0.00 0.00 60.65 58.91 3clc h LYS 73 Cb 0.65 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 3clc h LYS 73 CO -0.97 0.72 -0.31 1.49 -0.57 0.00 0.00 179.45 179.80 3clc h GLU 74 N 0.86 0.78 -0.14 3.15 4.57 0.11 -2.12 114.58 121.79 3clc h GLU 74 Ca 0.20 -0.41 0.04 0.00 -1.18 0.00 0.00 59.36 58.01 3clc h GLU 74 Cb 0.18 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.78 3clc h GLU 74 CO -0.02 1.04 0.22 0.82 -1.18 0.00 0.00 179.01 179.89 3clc h ILE 75 N 0.55 0.31 -0.37 2.32 2.04 -0.58 -3.14 117.51 118.65 3clc h ILE 75 Ca 0.05 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.91 3clc h ILE 75 Cb 0.89 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.79 3clc h ILE 75 CO 0.08 0.00 0.00 0.18 0.00 0.00 0.00 178.15 178.41 3clc n LEU 76 N -3.53 3.21 0.09 1.44 4.32 -0.80 -4.82 117.00 116.90 3clc n LEU 76 Ca 0.01 -1.38 -0.17 0.00 -0.02 0.00 0.00 56.01 54.44 3clc n LEU 76 Cb 0.32 -0.24 -0.14 0.00 -1.62 0.00 0.00 43.42 41.74 3clc n LEU 76 CO 0.24 0.69 -0.23 0.07 -1.22 0.00 0.00 177.39 176.94 3clc h LYS 77 N 4.14 0.29 0.00 3.23 2.10 -1.59 -3.51 116.57 121.23 3clc h LYS 77 Ca 0.00 -0.49 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 3clc h LYS 77 Cb 0.91 0.18 0.00 0.00 -0.90 0.00 0.00 32.23 32.42 3clc h LYS 77 CO 0.00 1.19 0.00 -2.39 -2.00 0.00 0.00 179.45 176.25