#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uqv s SER 25 N 0.00 6.62 0.00 1.61 1.04 -1.26 -4.91 113.70 116.81 1uqv s SER 25 Ca 0.00 0.78 0.00 0.00 0.48 0.00 0.00 55.95 57.21 1uqv s SER 25 Cb 0.00 -2.17 0.00 0.00 0.10 0.00 0.00 66.02 63.95 1uqv s SER 25 CO 0.00 0.13 0.00 1.57 0.98 0.00 0.00 173.24 175.92 1uqv n HIS 26 N 0.67 0.00 0.06 5.02 -0.00 -1.26 -5.03 115.22 114.68 1uqv n HIS 26 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.66 1uqv n HIS 26 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.51 1uqv n HIS 26 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.34 176.22 1uqv n MET 27 N -1.40 0.00 -3.69 1.57 0.00 -1.26 -5.13 117.12 107.21 1uqv n MET 27 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.70 57.56 1uqv n MET 27 Cb 0.00 -0.09 -0.08 0.00 0.00 0.00 0.00 33.22 33.04 1uqv n MET 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1uqv s ASN 28 N -5.08 -0.42 -0.09 6.12 2.20 -1.26 -5.04 114.94 111.37 1uqv s ASN 28 Ca 0.00 0.60 0.04 0.00 -0.94 0.00 0.00 52.86 52.56 1uqv s ASN 28 Cb 0.00 0.66 0.11 0.00 -2.00 0.00 0.00 41.25 40.01 1uqv s ASN 28 CO 0.00 -0.35 1.14 -0.46 -2.94 0.00 0.00 177.10 174.49 1uqv n ASN 29 N 1.92 -1.10 -0.09 3.54 0.23 -1.26 -4.94 115.26 113.56 1uqv n ASN 29 Ca -0.17 -2.06 -0.11 0.00 -0.53 0.00 0.00 54.58 51.71 1uqv n ASN 29 Cb 0.56 0.39 -0.11 0.00 -2.08 0.00 0.00 39.78 38.55 1uqv n ASN 29 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 1uqv n GLU 30 N -0.39 0.92 -1.41 -3.83 0.28 -1.26 -4.95 120.64 110.00 1uqv n GLU 30 Ca -0.25 0.06 -0.50 0.00 -0.16 0.00 0.00 57.16 56.31 1uqv n GLU 30 Cb 0.75 -1.40 -0.10 0.00 1.43 0.00 0.00 31.44 32.13 1uqv n GLU 30 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1uqv n ASP 31 N -2.86 1.42 -0.12 -1.84 8.00 -1.26 -4.78 116.55 115.11 1uqv n ASP 31 Ca -0.31 0.34 0.13 0.00 0.71 0.00 0.00 54.79 55.66 1uqv n ASP 31 Cb 0.93 -1.13 0.45 0.00 -0.02 0.00 0.00 41.12 41.35 1uqv n ASP 31 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1uqv n PHE 32 N 10.00 0.00 0.28 1.24 1.16 -1.26 -3.82 117.46 125.05 1uqv n PHE 32 Ca 0.49 0.00 0.12 0.00 -1.87 0.00 0.00 57.45 56.20 1uqv n PHE 32 Cb 0.15 -0.21 0.59 0.00 -1.61 0.00 0.00 39.48 38.41 1uqv n PHE 32 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 1uqv h SER 33 N 0.60 0.00 0.00 5.98 0.02 -1.91 -1.61 113.55 116.62 1uqv h SER 33 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1uqv h SER 33 Cb 0.45 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.99 1uqv h SER 33 CO 0.00 0.00 -1.61 1.67 -1.14 0.00 0.00 176.83 175.75 1uqv n GLN 34 N -2.35 0.62 -1.77 3.45 7.27 -1.25 -4.94 117.38 118.41 1uqv n GLN 34 Ca 0.00 -0.13 -0.41 0.00 0.07 0.00 0.00 57.00 56.53 1uqv n GLN 34 Cb 0.13 -1.45 0.00 0.00 2.41 0.00 0.00 30.24 31.34 1uqv n GLN 34 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 1uqv n TRP 35 N -1.97 2.96 -4.05 3.69 7.02 -0.61 -5.02 117.44 119.47 1uqv n TRP 35 Ca -0.01 0.45 -0.10 0.00 -1.02 0.00 0.00 57.50 56.81 1uqv n TRP 35 Cb 0.45 -2.53 -0.01 0.00 -2.42 0.00 0.00 31.31 26.80 1uqv n TRP 35 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 1uqv n SER 36 N 0.40 2.17 -0.20 -0.99 3.41 -1.26 -4.20 113.62 112.94 1uqv n SER 36 Ca 0.02 -1.68 0.12 0.00 -0.26 0.00 0.00 58.87 57.07 1uqv n SER 36 Cb 0.39 0.07 0.42 0.00 -0.26 0.00 0.00 64.21 64.83 1uqv n SER 36 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1uqv h VAL 37 N 0.92 0.87 -0.01 -3.33 2.07 -1.96 -0.22 116.25 114.59 1uqv h VAL 37 Ca -0.13 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 1uqv h VAL 37 Cb 0.41 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 1uqv h VAL 37 CO 0.21 0.11 -0.05 0.44 0.02 0.00 0.00 177.57 178.30 1uqv h ASP 38 N 0.60 0.06 -0.71 0.57 3.32 -1.96 -2.39 116.42 115.90 1uqv h ASP 38 Ca 0.38 -0.66 -0.01 0.00 0.02 0.00 0.00 57.03 56.76 1uqv h ASP 38 Cb 0.65 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.14 1uqv h ASP 38 CO -0.15 0.71 0.40 0.44 -1.72 0.00 0.00 179.24 178.93 1uqv h ASP 39 N -0.59 0.88 0.08 6.45 3.32 -1.83 -0.42 116.42 124.32 1uqv h ASP 39 Ca -0.00 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 1uqv h ASP 39 Cb 0.71 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1uqv h ASP 39 CO 0.01 0.71 -0.04 0.58 -1.72 0.00 0.00 179.24 178.79 1uqv h VAL 40 N 0.98 1.14 0.77 -1.35 2.07 -1.14 -2.58 116.25 116.14 1uqv h VAL 40 Ca 0.25 -0.84 -0.04 0.00 0.82 0.00 0.00 66.70 66.90 1uqv h VAL 40 Cb 0.02 1.67 0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1uqv h VAL 40 CO -0.04 0.20 -0.37 0.40 0.02 0.00 0.00 177.57 177.78 1uqv h ILE 41 N -0.50 0.00 -0.58 4.57 2.04 -1.38 -0.16 117.51 121.49 1uqv h ILE 41 Ca -0.01 -0.15 0.11 0.00 1.00 0.00 0.00 64.86 65.81 1uqv h ILE 41 Cb 0.42 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.39 1uqv h ILE 41 CO 0.02 0.00 -0.21 0.74 0.00 0.00 0.00 178.15 178.70 1uqv h THR 42 N -1.18 0.31 -0.73 -0.27 2.02 -1.20 0.53 112.91 112.39 1uqv h THR 42 Ca -0.11 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.02 1uqv h THR 42 Cb 0.79 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.48 1uqv h THR 42 CO 0.17 0.00 0.23 -0.25 0.37 0.00 0.00 175.52 176.04 1uqv h TRP 43 N -0.07 1.17 0.16 3.16 7.01 -1.49 -2.04 115.95 123.85 1uqv h TRP 43 Ca 0.27 -0.12 -0.00 0.00 2.11 0.00 0.00 58.89 61.15 1uqv h TRP 43 Cb 0.49 -0.34 -0.01 0.00 -2.10 0.00 0.00 29.16 27.20 1uqv h TRP 43 CO -0.54 0.92 -0.15 0.00 -2.79 0.00 0.00 178.44 175.89 1uqv h ILE 45 N -0.31 0.62 0.00 0.00 2.04 -1.23 1.42 117.51 120.05 1uqv h ILE 45 Ca -0.02 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1uqv h ILE 45 Cb 0.26 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1uqv h ILE 45 CO -0.01 0.08 0.12 -1.28 0.00 0.00 0.00 178.15 177.06 1uqv h SER 46 N 0.44 0.00 0.00 1.72 0.87 -1.18 -2.63 113.55 112.77 1uqv h SER 46 Ca 0.44 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.00 1uqv h SER 46 Cb 0.70 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.66 1uqv h SER 46 CO -0.43 0.00 -0.28 0.35 -0.53 0.00 0.00 176.83 175.94 1uqv n THR 47 N -2.79 0.05 0.00 2.23 -2.24 0.59 -4.95 114.28 107.17 1uqv n THR 47 Ca -0.02 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1uqv n THR 47 Cb 0.17 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 1uqv n THR 47 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1uqv n LEU 48 N -0.04 0.22 0.15 3.22 -0.00 0.46 -5.02 117.00 115.99 1uqv n LEU 48 Ca 0.00 0.18 0.00 0.00 -0.00 0.00 0.00 56.01 56.19 1uqv n LEU 48 Cb 0.61 -0.41 0.00 0.00 -0.00 0.00 0.00 43.42 43.62 1uqv n LEU 48 CO 0.00 -0.41 0.00 1.21 -0.00 0.00 0.00 177.39 178.19 1uqv n GLU 49 N -2.08 0.00 -0.66 1.96 4.07 -1.26 -4.98 120.64 117.70 1uqv n GLU 49 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1uqv n GLU 49 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1uqv n GLU 49 CO 0.00 0.00 0.00 1.33 -0.06 0.00 0.00 177.13 178.40 1uqv n VAL 50 N -3.35 0.00 -2.98 6.31 0.24 -1.26 -5.09 118.33 112.19 1uqv n VAL 50 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.20 1uqv n VAL 50 Cb 0.00 -0.61 0.04 0.00 -1.47 0.00 0.00 33.84 31.80 1uqv n VAL 50 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 1uqv n GLU 51 N -0.28 0.76 -1.79 7.34 0.28 -1.26 -4.38 120.64 121.31 1uqv n GLU 51 Ca 0.00 -1.58 -0.40 0.00 -0.16 0.00 0.00 57.16 55.02 1uqv n GLU 51 Cb 0.00 -0.14 -0.03 0.00 1.43 0.00 0.00 31.44 32.71 1uqv n GLU 51 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1uqv n GLU 52 N -1.66 2.29 0.00 3.44 1.02 -1.26 -3.74 120.64 120.72 1uqv n GLU 52 Ca 0.08 -2.49 0.00 0.00 -0.02 0.00 0.00 57.16 54.74 1uqv n GLU 52 Cb 0.31 -3.30 0.00 0.00 -0.02 0.00 0.00 31.44 28.43 1uqv n GLU 52 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1uqv n THR 53 N 6.12 0.00 -1.77 2.62 -2.24 -1.26 -5.11 114.28 112.64 1uqv n THR 53 Ca 0.49 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.87 1uqv n THR 53 Cb 0.42 -0.41 0.02 0.00 -2.10 0.00 0.00 70.33 68.26 1uqv n THR 53 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1uqv s ASP 54 N -4.47 5.91 0.00 3.42 -1.08 -1.25 -4.85 116.67 114.36 1uqv s ASP 54 Ca 0.00 2.97 0.01 0.00 -0.52 0.00 0.00 52.55 55.01 1uqv s ASP 54 Cb 0.00 -2.66 0.04 0.00 -1.46 0.00 0.00 42.92 38.85 1uqv s ASP 54 CO 0.00 -1.16 0.52 -0.81 0.52 0.00 0.00 175.17 174.24 1uqv n PRO 55 N -0.11 0.02 -0.37 4.34 -0.04 -1.26 -3.47 135.00 134.12 1uqv n PRO 55 Ca 0.04 0.00 0.32 0.00 -0.04 0.00 0.00 63.50 63.83 1uqv n PRO 55 Cb 0.41 -1.48 0.66 0.00 -0.04 0.00 0.00 33.50 33.05 1uqv n PRO 55 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1uqv h LEU 56 N 0.00 0.19 -0.44 1.53 5.85 -1.97 0.34 115.31 120.81 1uqv h LEU 56 Ca 0.00 0.05 -0.11 0.00 0.84 0.00 0.00 57.88 58.67 1uqv h LEU 56 Cb 0.00 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1uqv h LEU 56 CO 0.00 0.00 -0.14 0.00 -0.34 0.00 0.00 178.44 177.96 1uqv h GLN 58 N 0.70 0.92 -0.77 0.00 5.75 -0.63 0.46 115.11 121.55 1uqv h GLN 58 Ca 0.11 -0.07 -0.04 0.00 -0.15 0.00 0.00 58.65 58.49 1uqv h GLN 58 Cb 0.69 -0.20 -0.03 0.00 1.07 0.00 0.00 27.48 29.00 1uqv h GLN 58 CO 0.05 0.64 0.31 0.00 -2.65 0.00 0.00 178.83 177.17 1uqv h ARG 59 N 0.93 1.15 0.00 1.69 2.47 -1.41 -2.19 114.38 117.02 1uqv h ARG 59 Ca 0.25 -0.21 0.00 0.00 -1.26 0.00 0.00 59.98 58.76 1uqv h ARG 59 Cb -0.06 -0.19 0.00 0.00 -1.65 0.00 0.00 29.97 28.07 1uqv h ARG 59 CO -0.05 0.93 -0.14 -0.07 0.56 0.00 0.00 179.97 181.20 1uqv h LEU 60 N 1.11 0.00 -0.01 3.04 3.38 -1.10 -3.32 115.31 118.41 1uqv h LEU 60 Ca 0.26 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.11 1uqv h LEU 60 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1uqv h LEU 60 CO -0.02 0.02 -0.25 -0.09 0.09 0.00 0.00 178.44 178.19 1uqv h ARG 61 N 0.00 0.19 0.06 1.13 1.12 0.51 -3.36 114.38 114.03 1uqv h ARG 61 Ca 0.00 -0.19 0.01 0.00 -1.11 0.00 0.00 59.98 58.69 1uqv h ARG 61 Cb 0.75 0.05 -0.03 0.00 -0.01 0.00 0.00 29.97 30.72 1uqv h ARG 61 CO 0.00 0.90 -0.37 0.93 -3.11 0.00 0.00 179.97 178.32 1uqv h GLU 62 N -0.46 -0.50 -6.11 0.20 5.08 -1.55 -3.28 114.58 107.96 1uqv h GLU 62 Ca -0.03 0.03 -0.56 0.00 -1.00 0.00 0.00 59.36 57.80 1uqv h GLU 62 Cb 0.98 0.11 -0.09 0.00 0.50 0.00 0.00 28.75 30.25 1uqv h GLU 62 CO 0.05 -0.33 1.37 -0.80 -1.00 0.00 0.00 179.01 178.30 1uqv s ASN 63 N -4.02 6.32 -0.72 1.42 0.01 -1.26 -4.92 114.94 111.77 1uqv s ASN 63 Ca -0.11 -1.22 -0.25 0.00 -0.71 0.00 0.00 52.86 50.56 1uqv s ASN 63 Cb 0.04 -2.57 -0.14 0.00 0.41 0.00 0.00 41.25 39.00 1uqv s ASN 63 CO 0.43 -1.67 2.41 -0.90 -1.51 0.00 0.00 177.10 175.85 1uqv n ASP 64 N 9.46 1.59 -4.53 -1.22 5.75 -1.24 -4.88 116.55 121.49 1uqv n ASP 64 Ca 0.30 -0.99 -0.40 0.00 -0.01 0.00 0.00 54.79 53.68 1uqv n ASP 64 Cb 0.50 -1.50 -0.11 0.00 -1.03 0.00 0.00 41.12 38.99 1uqv n ASP 64 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1uqv s ILE 65 N 12.35 5.27 0.69 2.12 -1.09 -1.26 -5.05 121.20 134.23 1uqv s ILE 65 Ca 1.01 -0.22 -0.10 0.00 -2.23 0.00 0.00 60.65 59.10 1uqv s ILE 65 Cb -0.28 -3.71 0.02 0.00 -1.58 0.00 0.00 42.46 36.92 1uqv s ILE 65 CO 0.21 -0.01 1.06 0.54 -1.23 0.00 0.00 174.94 175.51 1uqv s VAL 66 N 1.72 3.33 0.40 2.92 0.11 -1.26 -4.69 120.40 122.92 1uqv s VAL 66 Ca 0.06 0.31 0.09 0.00 -2.93 0.00 0.00 61.98 59.51 1uqv s VAL 66 Cb -0.17 -3.41 0.30 0.00 -1.53 0.00 0.00 36.38 31.57 1uqv s VAL 66 CO 0.10 -0.51 1.99 1.23 -3.33 0.00 0.00 175.10 174.58 1uqv h GLY 67 N -0.60 0.74 2.00 6.54 0.00 -1.73 0.10 103.07 110.12 1uqv h GLY 67 Ca -0.45 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.64 1uqv h GLY 67 CO 0.63 0.18 0.00 1.34 0.00 0.00 0.00 176.54 178.69 1uqv n ASP 68 N -4.47 0.41 -0.00 0.19 2.03 -1.26 -2.90 116.55 110.54 1uqv n ASP 68 Ca 0.08 0.55 0.10 0.00 0.52 0.00 0.00 54.79 56.05 1uqv n ASP 68 Cb 0.23 -0.66 -0.12 0.00 -0.72 0.00 0.00 41.12 39.85 1uqv n ASP 68 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1uqv n LEU 69 N -1.90 0.84 -0.04 -2.67 7.94 0.25 -4.29 117.00 117.13 1uqv n LEU 69 Ca 0.05 -0.41 -0.11 0.00 -1.11 0.00 0.00 56.01 54.44 1uqv n LEU 69 Cb 0.34 -0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.24 1uqv n LEU 69 CO 0.26 0.21 0.88 -0.07 -1.11 0.00 0.00 177.39 177.55 1uqv h LEU 70 N 0.00 0.22 -0.29 -1.96 3.38 -1.13 -2.77 115.31 112.76 1uqv h LEU 70 Ca 0.00 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1uqv h LEU 70 Cb 0.58 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1uqv h LEU 70 CO 0.00 0.27 -0.05 -0.81 0.09 0.00 0.00 178.44 177.94 1uqv n PRO 71 N -4.90 0.95 -0.07 1.13 -0.04 -1.26 -3.52 135.00 127.28 1uqv n PRO 71 Ca -0.04 -0.29 0.11 0.00 -0.04 0.00 0.00 63.50 63.24 1uqv n PRO 71 Cb 0.09 -1.49 0.39 0.00 -0.04 0.00 0.00 33.50 32.45 1uqv n PRO 71 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1uqv n GLU 72 N -0.78 1.73 -4.85 0.54 -0.58 -1.05 -4.86 120.64 110.80 1uqv n GLU 72 Ca 0.18 -1.10 -0.29 0.00 -0.42 0.00 0.00 57.16 55.54 1uqv n GLU 72 Cb 0.24 -1.41 -0.15 0.00 -0.57 0.00 0.00 31.44 29.56 1uqv n GLU 72 CO 0.00 0.00 0.00 -0.48 -0.48 0.00 0.00 177.13 176.17 1uqv s LEU 73 N -1.63 2.16 0.00 -4.62 0.05 -1.23 -5.08 118.68 108.33 1uqv s LEU 73 Ca 0.33 -0.56 -0.04 0.00 0.05 0.00 0.00 54.13 53.91 1uqv s LEU 73 Cb 0.18 -1.20 0.06 0.00 -2.05 0.00 0.00 46.19 43.18 1uqv s LEU 73 CO 0.27 0.23 0.36 0.00 -0.55 0.00 0.00 176.35 176.67 1uqv h LEU 75 N 0.00 0.00 -0.73 0.00 -0.00 -2.00 -3.14 115.31 109.44 1uqv h LEU 75 Ca -0.12 0.00 -0.08 0.00 -0.00 0.00 0.00 57.88 57.68 1uqv h LEU 75 Cb 0.34 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.98 1uqv h LEU 75 CO 0.09 0.00 0.07 1.56 -0.00 0.00 0.00 178.44 180.16 1uqv h GLN 76 N 0.00 1.04 0.59 1.13 1.08 -1.99 -1.21 115.11 115.75 1uqv h GLN 76 Ca 0.00 -0.29 -0.03 0.00 -1.45 0.00 0.00 58.65 56.89 1uqv h GLN 76 Cb 0.68 -0.12 0.01 0.00 -0.05 0.00 0.00 27.48 28.00 1uqv h GLN 76 CO 0.00 0.97 -0.28 0.22 -0.95 0.00 0.00 178.83 178.79 1uqv h ASP 77 N 0.97 -0.67 -0.71 1.46 3.58 -1.92 -2.56 116.42 116.57 1uqv h ASP 77 Ca 0.19 0.02 0.13 0.00 0.42 0.00 0.00 57.03 57.79 1uqv h ASP 77 Cb 0.46 0.17 -0.09 0.00 1.72 0.00 0.00 39.33 41.60 1uqv h ASP 77 CO 0.02 -0.31 0.27 0.00 -2.88 0.00 0.00 179.24 176.34 1uqv h GLN 79 N 0.43 0.74 0.00 0.00 4.15 -1.26 0.13 115.11 119.30 1uqv h GLN 79 Ca 0.38 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.72 1uqv h GLN 79 Cb 0.55 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 1uqv h GLN 79 CO -0.38 0.49 -0.17 0.22 -1.93 0.00 0.00 178.83 177.06 1uqv h ASP 80 N 0.76 0.00 1.18 -0.69 1.82 -0.63 -1.65 116.42 117.22 1uqv h ASP 80 Ca 0.37 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.01 1uqv h ASP 80 Cb 0.30 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.31 1uqv h ASP 80 CO -0.23 0.17 -0.13 0.18 -1.61 0.00 0.00 179.24 177.63 1uqv n LEU 81 N -3.63 0.55 -5.01 2.28 4.77 0.37 -4.86 117.00 111.46 1uqv n LEU 81 Ca -0.01 0.46 -0.18 0.00 -0.03 0.00 0.00 56.01 56.25 1uqv n LEU 81 Cb 0.30 -0.34 0.03 0.00 -2.33 0.00 0.00 43.42 41.07 1uqv n LEU 81 CO 0.32 -0.09 0.23 0.00 -1.33 0.00 0.00 177.39 176.52 1uqv h ASP 83 N 0.45 0.00 0.00 0.00 2.03 -1.89 -3.45 116.42 113.56 1uqv h ASP 83 Ca -0.37 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.93 1uqv h ASP 83 Cb 1.28 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.78 1uqv h ASP 83 CO 0.44 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 179.26 1uqv n GLY 84 N -0.62 1.20 3.61 7.15 0.00 -1.26 -5.10 105.19 110.17 1uqv n GLY 84 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 1uqv n GLY 84 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1uqv s ASP 85 N -0.30 5.81 0.20 1.61 2.15 -1.26 -4.87 116.67 120.00 1uqv s ASP 85 Ca 0.00 1.66 -0.12 0.00 0.43 0.00 0.00 52.55 54.52 1uqv s ASP 85 Cb 0.00 -2.52 0.12 0.00 -0.30 0.00 0.00 42.92 40.22 1uqv s ASP 85 CO 0.00 -1.71 1.86 0.25 -0.17 0.00 0.00 175.17 175.40 1uqv h LEU 86 N 13.80 0.77 -0.76 -1.34 5.85 -1.99 -2.69 115.31 128.96 1uqv h LEU 86 Ca -0.38 -0.02 0.15 0.00 0.84 0.00 0.00 57.88 58.47 1uqv h LEU 86 Cb 1.20 -0.19 -0.10 0.00 0.37 0.00 0.00 40.66 41.94 1uqv h LEU 86 CO 0.99 0.56 0.29 0.78 -0.34 0.00 0.00 178.44 180.72 1uqv h ASN 87 N 0.90 0.24 -0.94 1.25 2.35 -2.00 0.15 115.58 117.52 1uqv h ASN 87 Ca 0.24 0.12 0.04 0.00 -0.55 0.00 0.00 56.30 56.15 1uqv h ASN 87 Cb -0.10 0.11 -0.06 0.00 0.05 0.00 0.00 38.32 38.32 1uqv h ASN 87 CO -0.05 0.07 0.61 0.50 -1.65 0.00 0.00 177.43 176.91 1uqv h LYS 88 N 0.41 1.15 -0.35 0.81 1.63 -1.88 -2.09 116.57 116.24 1uqv h LYS 88 Ca 0.43 -0.07 -0.10 0.00 -0.85 0.00 0.00 60.65 60.05 1uqv h LYS 88 Cb 0.67 -0.26 -0.01 0.00 -0.60 0.00 0.00 32.23 32.03 1uqv h LYS 88 CO -0.43 0.76 -0.21 0.00 -3.45 0.00 0.00 179.45 176.12 1uqv h ALA 89 N 1.39 0.97 -0.00 5.00 0.00 -0.96 -2.63 119.26 123.03 1uqv h ALA 89 Ca 0.38 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1uqv h ALA 89 Cb 0.02 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1uqv h ALA 89 CO -0.13 0.60 -0.02 0.82 0.00 0.00 0.00 179.25 180.53 1uqv h ILE 90 N 0.60 0.95 -0.62 0.00 2.04 -0.61 -2.00 117.51 117.87 1uqv h ILE 90 Ca 0.09 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.94 1uqv h ILE 90 Cb 0.68 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 37.68 1uqv h ILE 90 CO 0.05 0.00 0.33 0.11 0.00 0.00 0.00 178.15 178.64 1uqv h LYS 91 N -0.03 0.86 0.75 2.37 1.79 -1.43 -1.87 116.57 119.00 1uqv h LYS 91 Ca 0.01 -0.09 -0.03 0.00 -2.18 0.00 0.00 60.65 58.35 1uqv h LYS 91 Cb 0.04 -0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 30.52 1uqv h LYS 91 CO -0.02 0.64 -0.45 0.35 -1.08 0.00 0.00 179.45 178.89 1uqv h PHE 92 N 0.86 -1.20 -0.94 -1.35 3.57 -1.06 -1.49 116.94 115.34 1uqv h PHE 92 Ca 0.22 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.80 1uqv h PHE 92 Cb 0.04 0.42 -0.07 0.00 2.79 0.00 0.00 35.95 39.13 1uqv h PHE 92 CO 0.01 -0.68 0.60 -0.22 -2.23 0.00 0.00 178.31 175.79 1uqv h LYS 93 N -1.12 0.94 0.41 1.11 3.11 -1.29 -2.73 116.57 117.02 1uqv h LYS 93 Ca -0.10 -0.06 -0.02 0.00 -2.81 0.00 0.00 60.65 57.66 1uqv h LYS 93 Cb 0.89 -0.21 0.00 0.00 -1.00 0.00 0.00 32.23 31.91 1uqv h LYS 93 CO 0.11 0.63 -0.22 0.82 -2.81 0.00 0.00 179.45 177.97 1uqv h ILE 94 N 0.97 0.00 -1.32 2.00 2.04 -1.13 -1.16 117.51 118.91 1uqv h ILE 94 Ca 0.43 0.00 0.39 0.00 1.00 0.00 0.00 64.86 66.68 1uqv h ILE 94 Cb 0.36 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.36 1uqv h ILE 94 CO -0.19 0.00 0.91 -0.07 0.00 0.00 0.00 178.15 178.80 1uqv h LEU 95 N -0.58 0.16 -0.18 1.44 3.38 -1.16 0.52 115.31 118.89 1uqv h LEU 95 Ca -0.06 0.05 -0.20 0.00 0.09 0.00 0.00 57.88 57.77 1uqv h LEU 95 Cb 0.46 0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.25 1uqv h LEU 95 CO 0.08 -0.03 -0.66 0.40 0.09 0.00 0.00 178.44 178.32 1uqv h ILE 96 N 0.11 1.29 -0.29 1.22 2.04 -1.17 -2.76 117.51 117.95 1uqv h ILE 96 Ca 0.70 -1.87 -0.00 0.00 1.00 0.00 0.00 64.86 64.68 1uqv h ILE 96 Cb 2.42 1.93 -0.01 0.00 -0.74 0.00 0.00 36.82 40.41 1uqv h ILE 96 CO -0.18 0.59 0.17 -1.13 0.00 0.00 0.00 178.15 177.61 1uqv h ASN 97 N 0.49 0.36 0.11 1.72 -1.24 0.13 -0.66 115.58 116.49 1uqv h ASN 97 Ca -0.03 -0.07 -0.00 0.00 0.71 0.00 0.00 56.30 56.91 1uqv h ASN 97 Cb 1.29 -0.09 -0.00 0.00 0.73 0.00 0.00 38.32 40.24 1uqv h ASN 97 CO 0.14 0.32 -0.07 0.11 -1.29 0.00 0.00 177.43 176.64 1uqv h LYS 98 N 0.37 -0.17 -0.10 6.67 6.56 -1.43 -2.14 116.57 126.33 1uqv h LYS 98 Ca 0.10 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.71 1uqv h LYS 98 Cb 0.03 0.04 -0.01 0.00 -0.57 0.00 0.00 32.23 31.73 1uqv h LYS 98 CO -0.02 -0.11 0.07 1.98 -2.06 0.00 0.00 179.45 179.31 1uqv h MET 99 N -0.18 0.12 0.14 3.15 4.05 -1.38 -1.84 114.93 119.01 1uqv h MET 99 Ca -0.01 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.40 1uqv h MET 99 Cb 0.15 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 30.93 1uqv h MET 99 CO 0.00 0.08 -0.07 -0.09 0.23 0.00 0.00 176.91 177.07 1uqv h ARG 100 N 0.13 -0.18 0.00 0.39 2.43 -0.46 -3.36 114.38 113.33 1uqv h ARG 100 Ca 0.04 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1uqv h ARG 100 Cb 0.00 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1uqv h ARG 100 CO -0.01 -0.08 0.00 -0.25 -1.51 0.00 0.00 179.97 178.12 1uqv n ASP 101 N -5.15 0.00 -3.41 -3.80 8.00 -0.98 -5.05 116.55 106.16 1uqv n ASP 101 Ca -0.08 0.61 -0.05 0.00 0.71 0.00 0.00 54.79 55.97 1uqv n ASP 101 Cb 0.12 -0.40 0.01 0.00 -0.02 0.00 0.00 41.12 40.82 1uqv n ASP 101 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1uqv s SER 102 N -2.36 -0.08 -0.41 -2.24 0.01 -0.73 -5.13 113.70 102.76 1uqv s SER 102 Ca 0.00 -0.73 -0.09 0.00 1.31 0.00 0.00 55.95 56.44 1uqv s SER 102 Cb 0.00 0.63 0.07 0.00 0.21 0.00 0.00 66.02 66.93 1uqv s SER 102 CO 0.00 -1.22 0.25 -0.54 0.41 0.00 0.00 173.24 172.13 1uqv s LYS 103 N -2.75 2.62 0.06 12.44 1.02 -1.26 -4.26 119.74 127.61 1uqv s LYS 103 Ca 0.16 -1.41 0.00 0.00 0.02 0.00 0.00 55.97 54.74 1uqv s LYS 103 Cb -0.03 -3.76 0.00 0.00 -0.52 0.00 0.00 37.83 33.51 1uqv s LYS 103 CO 0.07 -0.92 0.00 -0.11 -0.92 0.00 0.00 175.35 173.47 1uqv n LEU 104 N 4.92 0.14 -4.55 3.17 7.94 -1.26 -4.98 117.00 122.37 1uqv n LEU 104 Ca -0.10 0.10 -0.36 0.00 -1.11 0.00 0.00 56.01 54.55 1uqv n LEU 104 Cb 0.43 0.02 -0.04 0.00 0.53 0.00 0.00 43.42 44.37 1uqv n LEU 104 CO 0.38 -0.42 1.47 -1.61 -1.11 0.00 0.00 177.39 176.10 1uqv s GLU 105 N -2.00 2.75 -0.00 1.96 2.02 -1.26 -4.61 118.70 117.55 1uqv s GLU 105 Ca 0.00 0.11 0.01 0.00 0.02 0.00 0.00 54.97 55.11 1uqv s GLU 105 Cb 0.00 -4.63 0.01 0.00 0.10 0.00 0.00 34.13 29.61 1uqv s GLU 105 CO 0.00 -2.81 0.72 -2.67 0.02 0.00 0.00 175.26 170.52 1uqv n TRP 106 N 12.41 0.00 -3.79 1.61 2.14 -1.26 -5.02 117.44 123.52 1uqv n TRP 106 Ca 0.25 -0.05 -0.29 0.00 2.07 0.00 0.00 57.50 59.48 1uqv n TRP 106 Cb 0.50 -0.02 -0.16 0.00 -0.81 0.00 0.00 31.31 30.82 1uqv n TRP 106 CO 0.00 0.00 0.00 0.21 2.07 0.00 0.00 177.69 179.97 1uqv s LYS 107 N -0.12 0.93 0.00 -2.67 2.47 -1.26 -5.31 119.74 113.78 1uqv s LYS 107 Ca 0.01 -0.73 0.19 0.00 -1.56 0.00 0.00 55.97 53.88 1uqv s LYS 107 Cb 0.01 -2.23 0.15 0.00 -1.46 0.00 0.00 37.83 34.30 1uqv s LYS 107 CO 0.00 -0.71 1.10 -0.25 0.16 0.00 0.00 175.35 175.65