#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 4.98 0.71 1.61 0.01 -1.26 -4.74 113.70 115.02 1uqv s SER 25 Ca 0.00 1.09 0.00 0.00 1.31 0.00 0.00 55.95 58.35 1uqv s SER 25 Cb 0.00 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.72 1uqv s SER 25 CO 0.00 -2.46 0.00 1.41 0.41 0.00 0.00 173.24 172.60 1uqv n HIS 26 N 13.77 -2.68 -3.56 2.43 -0.00 -1.26 -5.02 115.22 118.91 1uqv n HIS 26 Ca 0.30 0.75 -0.08 0.00 -0.00 0.00 0.00 57.72 58.69 1uqv n HIS 26 Cb 0.51 -1.22 -0.02 0.00 -0.00 0.00 0.00 29.99 29.27 1uqv n HIS 26 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1uqv s MET 27 N -0.92 0.98 0.00 -0.41 0.00 -1.26 -5.13 119.30 112.55 1uqv s MET 27 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 55.69 55.27 1uqv s MET 27 Cb 0.00 0.41 0.00 0.00 0.00 0.00 0.00 34.83 35.24 1uqv s MET 27 CO 0.00 -0.43 0.00 0.27 0.00 0.00 0.00 175.02 174.86 1uqv n ASN 28 N -0.32 0.00 -1.16 -1.18 2.04 -1.26 -5.17 115.26 108.21 1uqv n ASN 28 Ca -0.09 0.00 0.02 0.00 -0.44 0.00 0.00 54.58 54.07 1uqv n ASN 28 Cb 0.62 0.00 -0.01 0.00 -2.53 0.00 0.00 39.78 37.86 1uqv n ASN 28 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 1uqv n ASN 29 N -0.62 -6.24 0.00 0.53 4.05 -1.26 -5.02 115.26 106.70 1uqv n ASN 29 Ca 0.00 1.36 0.00 0.00 0.45 0.00 0.00 54.58 56.39 1uqv n ASN 29 Cb 0.00 -3.56 0.00 0.00 1.23 0.00 0.00 39.78 37.45 1uqv n ASN 29 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 177.26 175.42 1uqv n GLU 30 N -2.55 0.00 -1.59 1.20 4.07 -1.26 -5.04 120.64 115.47 1uqv n GLU 30 Ca -0.01 0.00 -0.41 0.00 -0.06 0.00 0.00 57.16 56.68 1uqv n GLU 30 Cb 0.38 -0.47 -0.03 0.00 -0.06 0.00 0.00 31.44 31.27 1uqv n GLU 30 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1uqv s ASP 31 N -3.60 5.15 0.03 4.31 1.11 -1.26 -4.80 116.67 117.62 1uqv s ASP 31 Ca 0.00 1.65 0.26 0.00 0.18 0.00 0.00 52.55 54.64 1uqv s ASP 31 Cb 0.00 -2.51 0.64 0.00 1.07 0.00 0.00 42.92 42.13 1uqv s ASP 31 CO 0.00 -2.24 1.52 2.22 1.18 0.00 0.00 175.17 177.86 1uqv n PHE 32 N 12.95 0.16 0.29 4.23 -1.74 -1.26 -3.72 117.46 128.37 1uqv n PHE 32 Ca 0.32 0.05 0.13 0.00 -0.56 0.00 0.00 57.45 57.39 1uqv n PHE 32 Cb 0.48 -0.42 0.62 0.00 1.52 0.00 0.00 39.48 41.68 1uqv n PHE 32 CO 0.00 0.00 0.00 0.66 -0.56 0.00 0.00 176.76 176.86 1uqv h SER 33 N 0.00 0.00 0.00 5.98 4.64 -1.95 -1.99 113.55 120.23 1uqv h SER 33 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1uqv h SER 33 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1uqv h SER 33 CO 0.00 0.00 -0.01 1.67 -0.87 0.00 0.00 176.83 177.62 1uqv n GLN 34 N -2.43 2.50 -1.30 4.77 7.27 -1.24 -4.86 117.38 122.09 1uqv n GLN 34 Ca 0.00 -1.49 -0.34 0.00 0.07 0.00 0.00 57.00 55.24 1uqv n GLN 34 Cb 0.15 -0.99 0.11 0.00 2.41 0.00 0.00 30.24 31.92 1uqv n GLN 34 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1uqv s TRP 35 N -1.06 1.89 0.55 3.69 0.52 -0.75 -5.04 118.94 118.74 1uqv s TRP 35 Ca 0.03 1.62 0.07 0.00 0.02 0.00 0.00 56.10 57.84 1uqv s TRP 35 Cb 0.03 -3.53 0.05 0.00 -1.15 0.00 0.00 33.47 28.86 1uqv s TRP 35 CO 0.00 -2.85 0.53 -1.12 0.02 0.00 0.00 176.95 173.54 1uqv s SER 36 N -1.97 4.82 0.09 2.95 0.01 -1.26 -4.48 113.70 113.86 1uqv s SER 36 Ca 0.75 -1.08 -0.20 0.00 1.31 0.00 0.00 55.95 56.73 1uqv s SER 36 Cb -0.31 0.32 -0.10 0.00 0.21 0.00 0.00 66.02 66.14 1uqv s SER 36 CO 0.47 -1.16 1.65 0.58 0.41 0.00 0.00 173.24 175.19 1uqv h VAL 37 N 0.57 1.14 -0.38 3.43 2.07 -1.96 -2.38 116.25 118.74 1uqv h VAL 37 Ca -0.35 -0.41 0.01 0.00 0.82 0.00 0.00 66.70 66.77 1uqv h VAL 37 Cb 1.30 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 1uqv h VAL 37 CO 0.52 0.13 0.25 -2.24 0.02 0.00 0.00 177.57 176.25 1uqv h ASP 38 N 0.14 0.40 -0.35 0.57 2.03 -1.97 -1.20 116.42 116.04 1uqv h ASP 38 Ca 0.06 -0.01 -0.10 0.00 -0.73 0.00 0.00 57.03 56.25 1uqv h ASP 38 Cb 0.14 -0.10 -0.01 0.00 -0.83 0.00 0.00 39.33 38.53 1uqv h ASP 38 CO -0.01 0.29 -0.18 0.44 -1.03 0.00 0.00 179.24 178.75 1uqv h ASP 39 N 0.47 0.76 -0.20 4.15 3.32 -1.88 -1.18 116.42 121.86 1uqv h ASP 39 Ca 0.14 -0.41 -0.07 0.00 0.02 0.00 0.00 57.03 56.71 1uqv h ASP 39 Cb 0.00 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.34 1uqv h ASP 39 CO -0.03 1.01 -0.14 0.58 -1.72 0.00 0.00 179.24 178.93 1uqv h VAL 40 N 0.51 1.32 0.33 -1.35 2.07 -0.93 -2.68 116.25 115.53 1uqv h VAL 40 Ca 0.08 -1.26 -0.02 0.00 0.82 0.00 0.00 66.70 66.32 1uqv h VAL 40 Cb 0.73 1.72 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 1uqv h VAL 40 CO 0.05 0.38 -0.16 0.40 0.02 0.00 0.00 177.57 178.26 1uqv h ILE 41 N 0.12 0.67 0.08 4.57 2.04 -1.27 -1.39 117.51 122.33 1uqv h ILE 41 Ca 0.04 -0.44 0.02 0.00 1.00 0.00 0.00 64.86 65.47 1uqv h ILE 41 Cb 0.66 0.90 -0.05 0.00 -0.74 0.00 0.00 36.82 37.59 1uqv h ILE 41 CO 0.04 0.09 -0.49 0.74 0.00 0.00 0.00 178.15 178.52 1uqv h THR 42 N -0.70 0.06 -0.92 -0.27 2.02 -1.31 0.07 112.91 111.86 1uqv h THR 42 Ca -0.05 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.22 1uqv h THR 42 Cb 0.49 0.06 -0.07 0.00 -1.74 0.00 0.00 68.15 66.89 1uqv h THR 42 CO 0.08 0.00 0.59 -0.25 0.37 0.00 0.00 175.52 176.31 1uqv h TRP 43 N -0.69 1.02 0.04 3.16 7.01 -1.55 -0.25 115.95 124.70 1uqv h TRP 43 Ca 0.01 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.04 1uqv h TRP 43 Cb 0.72 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 27.45 1uqv h TRP 43 CO -0.45 0.48 -0.02 0.00 -2.79 0.00 0.00 178.44 175.66 1uqv h ILE 45 N -0.06 0.54 0.00 0.00 2.04 -0.94 0.84 117.51 119.93 1uqv h ILE 45 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1uqv h ILE 45 Cb 0.05 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1uqv h ILE 45 CO 0.01 0.00 0.00 -0.24 0.00 0.00 0.00 178.15 177.92 1uqv n SER 46 N -4.10 0.34 -0.45 1.72 2.88 -0.11 -3.56 113.62 110.33 1uqv n SER 46 Ca 0.12 0.63 -0.00 0.00 -1.33 0.00 0.00 58.87 58.29 1uqv n SER 46 Cb 0.75 -0.68 -0.00 0.00 -0.75 0.00 0.00 64.21 63.53 1uqv n SER 46 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1uqv n THR 47 N -1.92 0.00 0.00 2.46 5.66 0.33 -5.02 114.28 115.79 1uqv n THR 47 Ca 0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 1uqv n THR 47 Cb 0.09 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.87 1uqv n THR 47 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1uqv n LEU 48 N 0.00 0.25 0.14 1.09 -0.00 0.27 -5.01 117.00 113.74 1uqv n LEU 48 Ca -0.00 0.37 0.00 0.00 -0.00 0.00 0.00 56.01 56.38 1uqv n LEU 48 Cb 0.45 -0.45 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1uqv n LEU 48 CO -0.00 -0.45 0.00 1.21 -0.00 0.00 0.00 177.39 178.15 1uqv n GLU 49 N -1.94 0.00 -1.11 1.96 2.13 -1.26 -4.92 120.64 115.49 1uqv n GLU 49 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1uqv n GLU 49 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1uqv n GLU 49 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 1uqv n VAL 50 N -3.36 0.00 -2.96 6.31 0.24 -1.26 -5.14 118.33 112.17 1uqv n VAL 50 Ca 0.00 0.00 -0.07 0.00 -2.04 0.00 0.00 64.34 62.23 1uqv n VAL 50 Cb 0.00 -0.31 0.03 0.00 -1.47 0.00 0.00 33.84 32.08 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 -0.20 0.81 -1.98 7.34 0.28 -1.26 -4.59 120.64 121.03 1uqv n GLU 51 Ca 0.00 -1.12 -0.41 0.00 -0.16 0.00 0.00 57.16 55.47 1uqv n GLU 51 Cb 0.00 -0.10 -0.01 0.00 1.43 0.00 0.00 31.44 32.76 1uqv n GLU 51 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1uqv n GLU 52 N -1.48 2.69 0.00 3.44 0.00 -1.26 -3.82 120.64 120.22 1uqv n GLU 52 Ca 0.06 -2.73 0.00 0.00 0.00 0.00 0.00 57.16 54.49 1uqv n GLU 52 Cb 0.22 -3.36 0.00 0.00 0.00 0.00 0.00 31.44 28.30 1uqv n GLU 52 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1uqv n THR 53 N 5.90 0.00 -1.84 6.31 -2.24 -1.26 -5.11 114.28 116.05 1uqv n THR 53 Ca 0.50 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.89 1uqv n THR 53 Cb 0.42 -0.37 0.03 0.00 -2.10 0.00 0.00 70.33 68.31 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 -4.35 5.57 0.00 3.42 2.15 -1.25 -4.84 116.67 117.37 1uqv s ASP 54 Ca 0.00 2.77 0.00 0.00 0.43 0.00 0.00 52.55 55.75 1uqv s ASP 54 Cb 0.00 -2.64 0.00 0.00 -0.30 0.00 0.00 42.92 39.98 1uqv s ASP 54 CO 0.00 -1.37 0.47 -2.65 -0.17 0.00 0.00 175.17 171.45 1uqv n PRO 55 N -0.68 0.00 -0.32 4.34 -0.02 -1.26 -3.23 135.00 133.83 1uqv n PRO 55 Ca 0.08 0.02 0.34 0.00 -2.02 0.00 0.00 63.50 61.92 1uqv n PRO 55 Cb 0.44 -1.50 0.73 0.00 -0.02 0.00 0.00 33.50 33.15 1uqv n PRO 55 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1uqv h LEU 56 N 0.00 0.03 0.01 2.45 5.85 -1.92 0.46 115.31 122.19 1uqv h LEU 56 Ca 0.00 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1uqv h LEU 56 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1uqv h LEU 56 CO 0.00 0.00 -0.00 0.00 -0.34 0.00 0.00 178.44 178.10 1uqv h GLN 58 N -0.60 0.00 0.49 0.00 4.15 -1.24 -1.14 115.11 116.76 1uqv h GLN 58 Ca -0.00 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 1uqv h GLN 58 Cb 0.59 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.28 1uqv h GLN 58 CO 0.00 0.05 -0.23 -0.09 -1.93 0.00 0.00 178.83 176.63 1uqv h ARG 59 N 0.00 -0.63 -0.49 1.69 9.65 -1.18 -1.41 114.38 122.01 1uqv h ARG 59 Ca -0.00 0.04 0.04 0.00 -1.10 0.00 0.00 59.98 58.97 1uqv h ARG 59 Cb 0.11 0.14 -0.04 0.00 -1.39 0.00 0.00 29.97 28.79 1uqv h ARG 59 CO 0.01 -0.34 0.24 -0.07 2.80 0.00 0.00 179.97 182.61 1uqv h LEU 60 N -1.06 0.35 -1.25 3.80 3.38 -1.29 -1.94 115.31 117.30 1uqv h LEU 60 Ca -0.07 0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.95 1uqv h LEU 60 Cb 0.58 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 1uqv h LEU 60 CO 0.11 0.24 0.52 -0.09 0.09 0.00 0.00 178.44 179.31 1uqv h ARG 61 N 0.48 0.99 -0.10 1.13 2.43 -1.27 -2.63 114.38 115.41 1uqv h ARG 61 Ca 0.22 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 59.36 1uqv h ARG 61 Cb 0.13 -0.22 -0.04 0.00 -0.42 0.00 0.00 29.97 29.42 1uqv h ARG 61 CO -0.15 0.65 -0.12 1.49 -1.51 0.00 0.00 179.97 180.33 1uqv h GLU 62 N 1.02 -0.15 -4.87 0.20 4.81 -0.45 -3.31 114.58 111.82 1uqv h GLU 62 Ca 0.30 0.01 -0.70 0.00 -0.13 0.00 0.00 59.36 58.84 1uqv h GLU 62 Cb -0.05 0.03 -0.19 0.00 0.63 0.00 0.00 28.75 29.18 1uqv h GLU 62 CO -0.08 -0.10 0.65 -0.80 -0.73 0.00 0.00 179.01 177.96 1uqv s ASN 63 N -5.08 6.57 -0.74 1.04 0.01 -0.99 -4.97 114.94 110.78 1uqv s ASN 63 Ca -0.14 -2.00 -0.27 0.00 -0.71 0.00 0.00 52.86 49.74 1uqv s ASN 63 Cb 0.09 -2.37 -0.15 0.00 0.41 0.00 0.00 41.25 39.24 1uqv s ASN 63 CO 0.67 -1.03 2.52 -0.90 -1.51 0.00 0.00 177.10 176.85 1uqv n ASP 64 N 6.27 1.27 -3.88 -1.22 5.75 -1.25 -4.89 116.55 118.61 1uqv n ASP 64 Ca 0.18 -0.30 -0.27 0.00 -0.01 0.00 0.00 54.79 54.38 1uqv n ASP 64 Cb 0.48 -1.27 -0.17 0.00 -1.03 0.00 0.00 41.12 39.13 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 10.49 0.99 0.79 2.12 -1.09 -1.26 -5.14 121.20 128.09 1uqv s ILE 65 Ca 1.15 -0.44 -0.12 0.00 -2.23 0.00 0.00 60.65 59.01 1uqv s ILE 65 Cb -0.64 -1.12 0.06 0.00 -1.58 0.00 0.00 42.46 39.18 1uqv s ILE 65 CO 0.36 0.21 1.10 0.54 -1.23 0.00 0.00 174.94 175.92 1uqv s VAL 66 N 1.70 3.00 0.53 2.92 0.11 -1.26 -4.77 120.40 122.64 1uqv s VAL 66 Ca 0.03 0.33 0.24 0.00 -2.93 0.00 0.00 61.98 59.65 1uqv s VAL 66 Cb -0.14 -3.14 0.31 0.00 -1.53 0.00 0.00 36.38 31.88 1uqv s VAL 66 CO -0.08 -0.43 2.18 1.23 -3.33 0.00 0.00 175.10 174.68 1uqv h GLY 67 N -1.04 0.00 1.65 6.54 0.00 -1.78 -0.90 103.07 107.55 1uqv h GLY 67 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1uqv h GLY 67 CO 0.61 0.00 0.00 1.34 0.00 0.00 0.00 176.54 178.49 1uqv n ASP 68 N -4.04 0.00 -0.48 0.19 2.03 -1.26 -2.12 116.55 110.87 1uqv n ASP 68 Ca -0.03 0.12 0.09 0.00 0.52 0.00 0.00 54.79 55.49 1uqv n ASP 68 Cb 0.12 -0.33 0.02 0.00 -0.72 0.00 0.00 41.12 40.22 1uqv n ASP 68 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1uqv n LEU 69 N -1.33 1.93 0.00 -2.67 4.32 -0.34 -4.25 117.00 114.66 1uqv n LEU 69 Ca 0.08 -0.83 -0.13 0.00 -0.02 0.00 0.00 56.01 55.10 1uqv n LEU 69 Cb 0.16 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 41.86 1uqv n LEU 69 CO 0.14 0.36 0.62 -0.07 -1.22 0.00 0.00 177.39 177.22 1uqv h LEU 70 N 2.37 -0.03 -0.28 2.23 3.38 -1.48 -2.71 115.31 118.79 1uqv h LEU 70 Ca 0.00 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1uqv h LEU 70 Cb 0.63 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1uqv h LEU 70 CO 0.00 0.45 -0.19 -0.81 0.09 0.00 0.00 178.44 177.98 1uqv n PRO 71 N -4.88 0.63 -0.01 1.13 -0.04 -1.26 -3.78 135.00 126.79 1uqv n PRO 71 Ca -0.08 -0.28 -0.09 0.00 -0.04 0.00 0.00 63.50 63.01 1uqv n PRO 71 Cb 0.25 -1.49 -0.14 0.00 -0.04 0.00 0.00 33.50 32.08 1uqv n PRO 71 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1uqv h GLU 72 N 0.68 0.01 -6.96 0.54 4.81 -1.73 -3.47 114.58 108.46 1uqv h GLU 72 Ca 0.00 -0.01 -0.45 0.00 -0.13 0.00 0.00 59.36 58.77 1uqv h GLU 72 Cb 0.43 0.00 0.05 0.00 0.63 0.00 0.00 28.75 29.86 1uqv h GLU 72 CO 0.00 0.60 0.04 -0.51 -0.73 0.00 0.00 179.01 178.41 1uqv s LEU 73 N -6.22 3.20 0.00 1.64 1.43 -1.02 -5.09 118.68 112.61 1uqv s LEU 73 Ca -0.04 0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 1uqv s LEU 73 Cb 0.08 -3.02 0.00 0.00 0.03 0.00 0.00 46.19 43.28 1uqv s LEU 73 CO 0.82 -1.19 0.00 0.00 0.23 0.00 0.00 176.35 176.21 1uqv n LEU 75 N 0.00 0.00 0.25 0.00 4.77 -1.26 -3.36 117.00 117.41 1uqv n LEU 75 Ca 0.00 0.43 -0.10 0.00 -0.03 0.00 0.00 56.01 56.31 1uqv n LEU 75 Cb 0.00 -0.43 -0.05 0.00 -2.33 0.00 0.00 43.42 40.62 1uqv n LEU 75 CO 0.00 -0.23 0.48 -0.61 -1.33 0.00 0.00 177.39 175.69 1uqv h GLN 76 N 0.00 -0.63 -0.38 3.23 5.75 -2.00 -0.67 115.11 120.42 1uqv h GLN 76 Ca 0.00 0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.50 1uqv h GLN 76 Cb 0.19 0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.87 1uqv h GLN 76 CO 0.00 -0.42 0.07 -0.44 -2.65 0.00 0.00 178.83 175.39 1uqv h ASP 77 N -0.69 0.53 -0.94 -0.69 3.32 -1.96 -2.35 116.42 113.63 1uqv h ASP 77 Ca -0.07 -0.08 0.01 0.00 0.02 0.00 0.00 57.03 56.91 1uqv h ASP 77 Cb 0.50 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.87 1uqv h ASP 77 CO 0.11 0.55 0.62 0.00 -1.72 0.00 0.00 179.24 178.79 1uqv h GLN 79 N 1.28 0.72 0.00 0.00 4.15 -0.60 -2.56 115.11 118.10 1uqv h GLN 79 Ca 0.34 -0.38 0.00 0.00 0.77 0.00 0.00 58.65 59.38 1uqv h GLN 79 Cb -0.14 0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.57 1uqv h GLN 79 CO -0.07 1.00 0.00 0.22 -1.93 0.00 0.00 178.83 178.05 1uqv h ASP 80 N 0.58 0.00 0.82 -0.69 3.58 -1.00 -2.41 116.42 117.30 1uqv h ASP 80 Ca 0.04 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.49 1uqv h ASP 80 Cb 0.96 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.01 1uqv h ASP 80 CO 0.09 0.00 -0.53 0.18 -2.88 0.00 0.00 179.24 176.10 1uqv n LEU 81 N -3.09 0.62 -5.02 2.28 4.32 -0.19 -4.90 117.00 111.02 1uqv n LEU 81 Ca 0.01 0.21 -0.18 0.00 -0.02 0.00 0.00 56.01 56.03 1uqv n LEU 81 Cb 0.32 -0.22 0.03 0.00 -1.62 0.00 0.00 43.42 41.93 1uqv n LEU 81 CO 0.28 -0.02 0.24 0.00 -1.22 0.00 0.00 177.39 176.67 1uqv h ASP 83 N 0.43 0.00 0.00 0.00 3.32 -1.91 -3.45 116.42 114.81 1uqv h ASP 83 Ca -0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.69 1uqv h ASP 83 Cb 1.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.83 1uqv h ASP 83 CO 0.43 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.56 1uqv n GLY 84 N -0.43 1.49 3.68 2.75 0.00 -1.26 -5.11 105.19 106.32 1uqv n GLY 84 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.81 6.76 0.17 1.61 2.15 -1.26 -4.91 116.67 120.38 1uqv s ASP 85 Ca 0.00 2.20 -0.14 0.00 0.43 0.00 0.00 52.55 55.05 1uqv s ASP 85 Cb 0.00 -2.56 0.07 0.00 -0.30 0.00 0.00 42.92 40.13 1uqv s ASP 85 CO 0.00 -0.80 1.82 0.25 -0.17 0.00 0.00 175.17 176.28 1uqv h LEU 86 N 8.77 0.65 -1.53 -1.34 5.85 -1.99 -2.13 115.31 123.58 1uqv h LEU 86 Ca -0.39 -0.04 0.14 0.00 0.84 0.00 0.00 57.88 58.44 1uqv h LEU 86 Cb 1.18 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 42.00 1uqv h LEU 86 CO 0.92 0.49 0.51 0.78 -0.34 0.00 0.00 178.44 180.80 1uqv h ASN 87 N 0.74 0.44 -0.30 1.25 2.35 -2.00 -1.08 115.58 116.97 1uqv h ASN 87 Ca 0.20 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 1uqv h ASN 87 Cb -0.05 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.24 1uqv h ASN 87 CO -0.04 0.23 0.20 0.50 -1.65 0.00 0.00 177.43 176.67 1uqv h LYS 88 N 0.47 0.40 0.00 0.81 1.63 -1.78 -2.08 116.57 116.03 1uqv h LYS 88 Ca 0.37 -0.03 -0.05 0.00 -0.85 0.00 0.00 60.65 60.10 1uqv h LYS 88 Cb 0.78 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 32.32 1uqv h LYS 88 CO -0.13 0.27 -0.23 0.00 -3.45 0.00 0.00 179.45 175.92 1uqv h ALA 89 N 1.11 1.57 0.86 5.00 0.00 -1.17 -2.40 119.26 124.23 1uqv h ALA 89 Ca 0.11 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1uqv h ALA 89 Cb -0.04 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.72 1uqv h ALA 89 CO -0.02 0.29 -0.41 0.82 0.00 0.00 0.00 179.25 179.92 1uqv h ILE 90 N 0.00 0.00 -0.37 0.00 2.04 -0.81 -1.63 117.51 116.74 1uqv h ILE 90 Ca -0.00 -0.15 0.11 0.00 1.00 0.00 0.00 64.86 65.81 1uqv h ILE 90 Cb 0.42 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 1uqv h ILE 90 CO 0.03 0.00 0.28 0.11 0.00 0.00 0.00 178.15 178.57 1uqv h LYS 91 N -1.31 0.00 0.45 2.37 1.79 -1.39 -0.19 116.57 118.28 1uqv h LYS 91 Ca -0.12 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.33 1uqv h LYS 91 Cb 0.89 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.54 1uqv h LYS 91 CO 0.19 0.00 -0.21 0.35 -1.08 0.00 0.00 179.45 178.70 1uqv h PHE 92 N 0.00 -0.56 0.00 -1.35 3.57 -1.17 -2.48 116.94 114.95 1uqv h PHE 92 Ca 0.17 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.66 1uqv h PHE 92 Cb 0.73 0.18 -0.00 0.00 2.79 0.00 0.00 35.95 39.65 1uqv h PHE 92 CO 0.00 -0.35 -0.00 -0.22 -2.23 0.00 0.00 178.31 175.51 1uqv h LYS 93 N -0.70 0.00 0.26 1.11 3.64 -0.95 -2.80 116.57 117.12 1uqv h LYS 93 Ca -0.06 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 1uqv h LYS 93 Cb 0.46 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1uqv h LYS 93 CO 0.10 0.00 -0.12 0.82 -2.27 0.00 0.00 179.45 177.98 1uqv h ILE 94 N 0.00 0.00 -0.92 2.00 2.04 -0.87 0.26 117.51 120.02 1uqv h ILE 94 Ca -0.00 -0.13 0.19 0.00 1.00 0.00 0.00 64.86 65.92 1uqv h ILE 94 Cb 0.04 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.05 1uqv h ILE 94 CO 0.00 0.00 0.60 -0.07 0.00 0.00 0.00 178.15 178.68 1uqv h LEU 95 N -0.48 0.51 -0.59 1.44 3.38 -1.34 0.34 115.31 118.57 1uqv h LEU 95 Ca -0.04 0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1uqv h LEU 95 Cb 0.26 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1uqv h LEU 95 CO 0.06 0.21 -0.64 0.40 0.09 0.00 0.00 178.44 178.56 1uqv h ILE 96 N 0.51 1.35 0.60 1.22 2.04 -1.50 -2.60 117.51 119.13 1uqv h ILE 96 Ca 0.48 -2.28 -0.03 0.00 1.00 0.00 0.00 64.86 64.04 1uqv h ILE 96 Cb 1.05 2.26 0.01 0.00 -0.74 0.00 0.00 36.82 39.40 1uqv h ILE 96 CO -0.22 0.63 -0.29 -1.13 0.00 0.00 0.00 178.15 177.15 1uqv h ASN 97 N 0.00 -0.68 -0.64 1.72 -1.24 0.33 -2.08 115.58 113.00 1uqv h ASN 97 Ca -0.01 0.02 0.02 0.00 0.71 0.00 0.00 56.30 57.04 1uqv h ASN 97 Cb 1.21 0.18 -0.03 0.00 0.73 0.00 0.00 38.32 40.41 1uqv h ASN 97 CO 0.08 -0.45 0.42 0.11 -1.29 0.00 0.00 177.43 176.31 1uqv h LYS 98 N -0.88 0.80 -0.81 6.67 6.56 -1.57 -1.63 116.57 125.70 1uqv h LYS 98 Ca -0.08 -0.05 0.05 0.00 -1.06 0.00 0.00 60.65 59.51 1uqv h LYS 98 Cb 0.61 -0.18 -0.05 0.00 -0.57 0.00 0.00 32.23 32.04 1uqv h LYS 98 CO 0.13 0.53 0.53 1.98 -2.06 0.00 0.00 179.45 180.57 1uqv h MET 99 N 0.82 0.93 0.05 3.15 4.05 -1.41 -1.83 114.93 120.68 1uqv h MET 99 Ca 0.24 -0.06 -0.23 0.00 -0.28 0.00 0.00 59.70 59.37 1uqv h MET 99 Cb -0.03 -0.21 0.02 0.00 -0.80 0.00 0.00 31.60 30.58 1uqv h MET 99 CO -0.06 0.61 -0.93 -0.09 0.23 0.00 0.00 176.91 176.67 1uqv h ARG 100 N 0.95 0.55 -0.97 0.39 1.12 -0.59 -3.27 114.38 112.56 1uqv h ARG 100 Ca 0.33 -0.66 0.09 0.00 -1.11 0.00 0.00 59.98 58.64 1uqv h ARG 100 Cb 0.12 0.20 -0.07 0.00 -0.01 0.00 0.00 29.97 30.21 1uqv h ARG 100 CO -0.11 1.26 0.62 -0.44 -3.11 0.00 0.00 179.97 178.20 1uqv h ASP 101 N 0.13 0.94 -1.59 -3.80 3.32 -0.94 -3.48 116.42 110.99 1uqv h ASP 101 Ca -0.13 0.02 0.12 0.00 0.02 0.00 0.00 57.03 57.06 1uqv h ASP 101 Cb 1.63 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 40.98 1uqv h ASP 101 CO 0.18 0.56 -0.16 -1.20 -1.72 0.00 0.00 179.24 176.90 1uqv n SER 102 N -4.54 -6.25 -3.24 6.45 7.64 -0.72 -4.88 113.62 108.08 1uqv n SER 102 Ca 0.16 0.48 -0.23 0.00 1.01 0.00 0.00 58.87 60.29 1uqv n SER 102 Cb 0.26 -1.37 0.05 0.00 -1.01 0.00 0.00 64.21 62.14 1uqv n SER 102 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1uqv n LYS 103 N -2.52 -5.76 0.00 1.43 5.02 -1.26 -4.72 118.16 110.35 1uqv n LYS 103 Ca 0.00 0.86 0.00 0.00 -2.02 0.00 0.00 58.31 57.15 1uqv n LYS 103 Cb 0.20 -5.78 0.00 0.00 -0.02 0.00 0.00 35.03 29.44 1uqv n LYS 103 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1uqv n LEU 104 N -4.33 0.00 -3.71 -0.35 -0.00 -1.26 -4.99 117.00 102.36 1uqv n LEU 104 Ca -0.07 0.00 -0.42 0.00 -0.00 0.00 0.00 56.01 55.52 1uqv n LEU 104 Cb 0.60 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 44.01 1uqv n LEU 104 CO 0.54 0.00 2.69 -1.84 -0.00 0.00 0.00 177.39 178.78 1uqv n GLU 105 N -0.49 2.96 -0.16 1.96 0.28 -1.26 -4.25 120.64 119.68 1uqv n GLU 105 Ca 0.00 -2.64 0.02 0.00 -0.16 0.00 0.00 57.16 54.38 1uqv n GLU 105 Cb 0.00 -3.23 0.02 0.00 1.43 0.00 0.00 31.44 29.66 1uqv n GLU 105 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 177.13 174.30 1uqv n TRP 106 N 5.78 0.00 -3.59 -1.84 2.14 -1.26 -4.98 117.44 113.69 1uqv n TRP 106 Ca 0.53 -0.28 -0.29 0.00 2.07 0.00 0.00 57.50 59.53 1uqv n TRP 106 Cb 0.38 -0.05 -0.15 0.00 -0.81 0.00 0.00 31.31 30.68 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 -0.71 0.41 0.00 -2.67 2.20 -1.26 -5.26 119.74 112.46 1uqv s LYS 107 Ca 0.06 -0.83 0.00 0.00 -0.36 0.00 0.00 55.97 54.84 1uqv s LYS 107 Cb 0.05 -1.45 0.00 0.00 -1.51 0.00 0.00 37.83 34.92 1uqv s LYS 107 CO 0.01 -1.04 0.14 -3.47 -0.36 0.00 0.00 175.35 170.62