#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uqv n SER 25 N 0.00 0.00 -0.13 1.61 3.41 -1.26 -4.95 113.62 112.30 1uqv n SER 25 Ca 0.00 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.36 1uqv n SER 25 Cb 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 1uqv n SER 25 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1uqv n HIS 26 N -0.31 0.12 -3.16 7.33 -0.00 -1.26 -4.95 115.22 113.00 1uqv n HIS 26 Ca 0.00 0.04 0.03 0.00 -0.00 0.00 0.00 57.72 57.79 1uqv n HIS 26 Cb 0.00 -1.01 -0.00 0.00 -0.00 0.00 0.00 29.99 28.97 1uqv n HIS 26 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.34 177.75 1uqv s MET 27 N -2.51 0.55 1.11 -0.41 -2.45 -1.26 -5.16 119.30 109.17 1uqv s MET 27 Ca -0.36 0.51 -0.19 0.00 -1.25 0.00 0.00 55.69 54.40 1uqv s MET 27 Cb 0.12 0.21 0.27 0.00 1.25 0.00 0.00 34.83 36.68 1uqv s MET 27 CO 0.55 -1.05 1.12 0.27 1.05 0.00 0.00 175.02 176.96 1uqv n ASN 28 N 5.40 -1.41 -2.67 1.11 6.94 -1.26 -4.98 115.26 118.39 1uqv n ASN 28 Ca 0.05 -1.24 -0.09 0.00 -0.02 0.00 0.00 54.58 53.28 1uqv n ASN 28 Cb 0.54 -0.97 0.07 0.00 -2.36 0.00 0.00 39.78 37.05 1uqv n ASN 28 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1uqv n ASN 29 N -4.51 -0.52 0.00 0.53 5.03 -1.26 -5.08 115.26 109.46 1uqv n ASN 29 Ca 0.15 -0.96 0.00 0.00 0.87 0.00 0.00 54.58 54.64 1uqv n ASN 29 Cb 0.56 -0.30 0.00 0.00 -1.02 0.00 0.00 39.78 39.02 1uqv n ASN 29 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1uqv n GLU 30 N -2.11 0.00 -3.41 3.52 1.02 -1.26 -5.07 120.64 113.33 1uqv n GLU 30 Ca 0.05 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.93 1uqv n GLU 30 Cb 0.17 0.00 -0.11 0.00 -0.02 0.00 0.00 31.44 31.49 1uqv n GLU 30 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1uqv s ASP 31 N 0.57 2.22 0.56 1.62 1.01 -1.26 -4.99 116.67 116.41 1uqv s ASP 31 Ca 0.00 -2.23 0.32 0.00 0.71 0.00 0.00 52.55 51.35 1uqv s ASP 31 Cb 0.00 -0.17 1.46 0.00 1.01 0.00 0.00 42.92 45.22 1uqv s ASP 31 CO 0.00 -0.27 1.82 0.15 0.21 0.00 0.00 175.17 177.09 1uqv h PHE 32 N 6.71 0.00 0.00 4.23 3.57 -1.97 0.61 116.94 130.09 1uqv h PHE 32 Ca 0.10 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.45 1uqv h PHE 32 Cb 0.98 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.69 1uqv h PHE 32 CO 0.38 0.00 -1.05 0.77 -2.23 0.00 0.00 178.31 176.18 1uqv h SER 33 N 0.00 0.00 -0.10 0.41 0.02 -1.94 -3.34 113.55 108.60 1uqv h SER 33 Ca 0.40 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.29 1uqv h SER 33 Cb 1.79 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 64.28 1uqv h SER 33 CO -0.00 0.59 -0.47 1.67 -1.14 0.00 0.00 176.83 177.48 1uqv n GLN 34 N -3.05 1.77 -1.88 3.45 7.27 0.16 -4.71 117.38 120.39 1uqv n GLN 34 Ca -0.05 -3.36 -0.32 0.00 0.07 0.00 0.00 57.00 53.34 1uqv n GLN 34 Cb 0.81 -1.70 0.02 0.00 2.41 0.00 0.00 30.24 31.79 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 -3.27 3.14 0.52 3.69 0.52 0.16 -4.83 118.94 118.87 1uqv s TRP 35 Ca 0.40 1.45 0.05 0.00 0.02 0.00 0.00 56.10 58.03 1uqv s TRP 35 Cb 0.38 -2.91 0.02 0.00 -1.15 0.00 0.00 33.47 29.81 1uqv s TRP 35 CO -0.05 -1.04 0.36 -1.54 0.02 0.00 0.00 176.95 174.69 1uqv s SER 36 N -3.32 4.61 0.23 2.95 1.04 -1.26 -4.32 113.70 113.62 1uqv s SER 36 Ca 0.60 -1.23 -0.08 0.00 0.48 0.00 0.00 55.95 55.72 1uqv s SER 36 Cb -0.14 0.29 0.20 0.00 0.10 0.00 0.00 66.02 66.47 1uqv s SER 36 CO 0.45 -1.02 1.87 0.58 0.98 0.00 0.00 173.24 176.10 1uqv h VAL 37 N 0.86 1.24 -0.77 5.02 2.07 -1.99 -2.14 116.25 120.55 1uqv h VAL 37 Ca -0.38 -0.54 0.04 0.00 0.82 0.00 0.00 66.70 66.64 1uqv h VAL 37 Cb 1.30 0.04 -0.05 0.00 -1.52 0.00 0.00 31.29 31.05 1uqv h VAL 37 CO 0.59 0.26 0.48 0.44 0.02 0.00 0.00 177.57 179.36 1uqv h ASP 38 N 1.19 0.79 -0.39 0.57 3.32 -1.96 -0.93 116.42 119.01 1uqv h ASP 38 Ca 0.31 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.23 1uqv h ASP 38 Cb -0.04 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 1uqv h ASP 38 CO -0.06 0.54 -0.25 0.44 -1.72 0.00 0.00 179.24 178.19 1uqv h ASP 39 N 0.93 0.89 -0.61 6.45 3.32 -1.88 -1.84 116.42 123.68 1uqv h ASP 39 Ca 0.31 -0.43 -0.06 0.00 0.02 0.00 0.00 57.03 56.87 1uqv h ASP 39 Cb 0.04 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.32 1uqv h ASP 39 CO -0.12 1.13 0.14 0.58 -1.72 0.00 0.00 179.24 179.24 1uqv h VAL 40 N 0.66 1.25 0.22 -1.35 2.07 -1.02 -2.15 116.25 115.94 1uqv h VAL 40 Ca 0.08 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.65 1uqv h VAL 40 Cb 0.82 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 1uqv h VAL 40 CO 0.07 0.35 -0.11 0.40 0.02 0.00 0.00 177.57 178.31 1uqv h ILE 41 N 0.96 0.75 -0.09 4.57 2.04 -1.13 -2.33 117.51 122.27 1uqv h ILE 41 Ca 0.20 -0.92 0.04 0.00 1.00 0.00 0.00 64.86 65.18 1uqv h ILE 41 Cb 0.36 1.20 -0.06 0.00 -0.74 0.00 0.00 36.82 37.58 1uqv h ILE 41 CO 0.00 0.17 -0.35 0.74 0.00 0.00 0.00 178.15 178.71 1uqv h THR 42 N -0.84 0.24 -0.91 -0.27 2.02 -1.35 -0.76 112.91 111.03 1uqv h THR 42 Ca -0.03 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.22 1uqv h THR 42 Cb 0.51 0.24 -0.06 0.00 -1.74 0.00 0.00 68.15 67.10 1uqv h THR 42 CO 0.05 0.00 0.57 -0.25 0.37 0.00 0.00 175.52 176.26 1uqv h TRP 43 N -0.45 1.06 0.02 3.16 7.01 -1.50 0.06 115.95 125.30 1uqv h TRP 43 Ca 0.08 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.11 1uqv h TRP 43 Cb 0.58 -0.34 -0.00 0.00 -2.10 0.00 0.00 29.16 27.30 1uqv h TRP 43 CO -0.41 0.53 -0.01 0.00 -2.79 0.00 0.00 178.44 175.76 1uqv h ILE 45 N -0.03 0.30 0.00 0.00 2.04 -1.13 0.63 117.51 119.32 1uqv h ILE 45 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1uqv h ILE 45 Cb 0.02 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 1uqv h ILE 45 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 178.15 177.91 1uqv n SER 46 N -3.53 0.37 -0.36 1.72 2.88 0.00 -3.71 113.62 110.99 1uqv n SER 46 Ca 0.03 0.63 0.00 0.00 -1.33 0.00 0.00 58.87 58.20 1uqv n SER 46 Cb 0.46 -0.70 0.00 0.00 -0.75 0.00 0.00 64.21 63.22 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 -1.95 0.00 0.00 2.46 5.66 0.08 -5.03 114.28 115.50 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 0.11 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.89 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 0.11 0.12 1.09 -0.00 0.20 -5.01 117.00 113.51 1uqv n LEU 48 Ca 0.00 0.41 0.00 0.00 -0.00 0.00 0.00 56.01 56.42 1uqv n LEU 48 Cb 0.39 -0.48 0.00 0.00 -0.00 0.00 0.00 43.42 43.33 1uqv n LEU 48 CO 0.00 -0.48 0.00 1.21 -0.00 0.00 0.00 177.39 178.12 1uqv n GLU 49 N -2.01 0.00 -1.06 1.96 4.07 -1.26 -4.94 120.64 117.39 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 -3.26 0.00 -2.94 6.31 0.24 -1.26 -5.13 118.33 112.28 1uqv n VAL 50 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.29 1uqv n VAL 50 Cb 0.00 -0.28 0.00 0.00 -1.47 0.00 0.00 33.84 32.10 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 -0.17 0.95 -1.83 7.34 0.28 -1.26 -4.63 120.64 121.31 1uqv n GLU 51 Ca 0.00 -0.16 -0.41 0.00 -0.16 0.00 0.00 57.16 56.43 1uqv n GLU 51 Cb 0.00 -0.01 -0.02 0.00 1.43 0.00 0.00 31.44 32.83 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 -1.07 2.42 0.00 3.44 -0.58 -1.26 -3.67 120.64 119.93 1uqv n GLU 52 Ca 0.01 -2.55 0.00 0.00 -0.42 0.00 0.00 57.16 54.20 1uqv n GLU 52 Cb 0.03 -3.31 0.00 0.00 -0.57 0.00 0.00 31.44 27.59 1uqv n GLU 52 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 1uqv n THR 53 N 6.01 0.00 -2.40 2.62 5.66 -1.26 -5.11 114.28 119.80 1uqv n THR 53 Ca 0.50 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 61.12 1uqv n THR 53 Cb 0.42 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.17 1uqv n THR 53 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1uqv s ASP 54 N -2.64 6.61 0.00 1.09 2.15 -1.24 -4.89 116.67 117.75 1uqv s ASP 54 Ca 0.00 2.21 0.00 0.00 0.43 0.00 0.00 52.55 55.19 1uqv s ASP 54 Cb 0.00 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 40.02 1uqv s ASP 54 CO 0.00 -0.60 0.45 -2.65 -0.17 0.00 0.00 175.17 172.20 1uqv n PRO 55 N 0.01 0.00 -0.29 4.34 -0.02 -1.26 -3.29 135.00 134.50 1uqv n PRO 55 Ca 0.05 0.00 0.34 0.00 -2.02 0.00 0.00 63.50 61.86 1uqv n PRO 55 Cb 0.48 -1.49 0.74 0.00 -0.02 0.00 0.00 33.50 33.21 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 0.00 -0.07 2.45 5.85 -1.90 0.25 115.31 121.89 1uqv h LEU 56 Ca 0.00 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.51 1uqv h LEU 56 Cb 0.00 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.04 1uqv h LEU 56 CO 0.00 0.00 -0.78 0.00 -0.34 0.00 0.00 178.44 177.32 1uqv h GLN 58 N 0.31 1.18 0.59 0.00 4.15 -0.81 -2.00 115.11 118.54 1uqv h GLN 58 Ca -0.08 -0.20 -0.03 0.00 0.77 0.00 0.00 58.65 59.11 1uqv h GLN 58 Cb 1.43 -0.20 0.01 0.00 0.21 0.00 0.00 27.48 28.93 1uqv h GLN 58 CO 0.16 0.94 -0.29 -0.09 -1.93 0.00 0.00 178.83 177.62 1uqv h ARG 59 N 1.15 -0.77 -1.01 1.69 9.65 -1.39 -2.40 114.38 121.31 1uqv h ARG 59 Ca 0.27 0.05 0.23 0.00 -1.10 0.00 0.00 59.98 59.43 1uqv h ARG 59 Cb 0.19 0.17 -0.11 0.00 -1.39 0.00 0.00 29.97 28.84 1uqv h ARG 59 CO -0.02 -0.47 0.62 -0.07 2.80 0.00 0.00 179.97 182.82 1uqv h LEU 60 N -1.14 0.65 -0.62 3.80 3.38 -1.49 0.15 115.31 120.04 1uqv h LEU 60 Ca -0.08 0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1uqv h LEU 60 Cb 0.65 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 1uqv h LEU 60 CO 0.13 0.17 0.16 -0.09 0.09 0.00 0.00 178.44 178.90 1uqv h ARG 61 N 0.60 0.98 -0.78 1.13 2.43 -1.33 -2.65 114.38 114.75 1uqv h ARG 61 Ca 0.60 -0.23 0.06 0.00 -0.81 0.00 0.00 59.98 59.61 1uqv h ARG 61 Cb 1.17 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 30.54 1uqv h ARG 61 CO -0.38 0.88 0.51 1.49 -1.51 0.00 0.00 179.97 180.96 1uqv h GLU 62 N 0.90 0.82 -4.41 0.20 4.81 -0.19 -3.30 114.58 113.40 1uqv h GLU 62 Ca 0.20 -0.05 -0.74 0.00 -0.13 0.00 0.00 59.36 58.63 1uqv h GLU 62 Cb 0.33 -0.18 -0.22 0.00 0.63 0.00 0.00 28.75 29.31 1uqv h GLU 62 CO -0.00 0.54 0.48 -0.80 -0.73 0.00 0.00 179.01 178.51 1uqv s ASN 63 N -6.14 6.72 -0.60 1.04 0.01 -0.96 -4.99 114.94 110.02 1uqv s ASN 63 Ca -0.10 -2.41 -0.26 0.00 -0.71 0.00 0.00 52.86 49.37 1uqv s ASN 63 Cb 0.19 -2.30 -0.10 0.00 0.41 0.00 0.00 41.25 39.45 1uqv s ASN 63 CO 0.78 -0.80 2.44 -0.67 -1.51 0.00 0.00 177.10 177.34 1uqv n ASP 64 N 5.20 1.94 -4.14 -1.22 2.03 -1.25 -4.90 116.55 114.21 1uqv n ASP 64 Ca 0.19 -0.59 -0.23 0.00 0.52 0.00 0.00 54.79 54.68 1uqv n ASP 64 Cb 0.48 -1.51 -0.15 0.00 -0.72 0.00 0.00 41.12 39.22 1uqv n ASP 64 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1uqv s ILE 65 N 12.06 1.24 0.33 5.18 -1.09 -1.26 -5.13 121.20 132.52 1uqv s ILE 65 Ca 1.02 -0.72 0.05 0.00 -2.23 0.00 0.00 60.65 58.77 1uqv s ILE 65 Cb -0.30 -1.04 -0.02 0.00 -1.58 0.00 0.00 42.46 39.52 1uqv s ILE 65 CO 0.27 0.31 0.47 0.54 -1.23 0.00 0.00 174.94 175.30 1uqv s VAL 66 N -0.43 4.46 0.55 2.92 0.11 -1.26 -4.40 120.40 122.35 1uqv s VAL 66 Ca 0.06 -0.89 0.23 0.00 -2.93 0.00 0.00 61.98 58.45 1uqv s VAL 66 Cb -0.06 -3.57 0.33 0.00 -1.53 0.00 0.00 36.38 31.55 1uqv s VAL 66 CO -0.00 -0.26 2.12 1.23 -3.33 0.00 0.00 175.10 174.86 1uqv h GLY 67 N 0.89 0.00 2.00 6.54 0.00 -1.75 0.75 103.07 111.50 1uqv h GLY 67 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1uqv h GLY 67 CO 0.56 0.00 0.00 -1.80 0.00 0.00 0.00 176.54 175.30 1uqv h ASP 68 N 0.00 0.00 -0.53 0.19 3.58 -1.84 -3.10 116.42 114.72 1uqv h ASP 68 Ca 0.07 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.52 1uqv h ASP 68 Cb 0.34 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.39 1uqv h ASP 68 CO -0.00 0.00 0.00 0.18 -2.88 0.00 0.00 179.24 176.54 1uqv n LEU 69 N -2.57 3.54 -0.03 2.28 4.32 0.23 -4.53 117.00 120.23 1uqv n LEU 69 Ca 0.04 -2.08 -0.13 0.00 -0.02 0.00 0.00 56.01 53.82 1uqv n LEU 69 Cb 0.42 -0.38 -0.11 0.00 -1.62 0.00 0.00 43.42 41.73 1uqv n LEU 69 CO 0.29 0.84 0.51 -0.07 -1.22 0.00 0.00 177.39 177.75 1uqv h LEU 70 N 3.10 -0.01 0.00 2.23 3.38 -1.40 -3.26 115.31 119.34 1uqv h LEU 70 Ca 0.00 -0.69 0.00 0.00 0.09 0.00 0.00 57.88 57.28 1uqv h LEU 70 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1uqv h LEU 70 CO 0.03 0.70 0.00 -0.81 0.09 0.00 0.00 178.44 178.45 1uqv n PRO 71 N -4.76 0.12 0.20 1.13 -0.04 -1.26 -3.17 135.00 127.22 1uqv n PRO 71 Ca -0.09 0.04 0.08 0.00 -0.04 0.00 0.00 63.50 63.48 1uqv n PRO 71 Cb 0.35 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.63 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 0.00 0.00 -6.26 0.54 4.57 -1.79 -3.44 114.58 108.20 1uqv h GLU 72 Ca 0.00 0.00 -0.57 0.00 -1.18 0.00 0.00 59.36 57.61 1uqv h GLU 72 Cb 0.40 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.95 1uqv h GLU 72 CO 0.00 0.31 -0.13 -0.51 -1.18 0.00 0.00 179.01 177.50 1uqv s LEU 73 N -6.73 4.35 0.00 1.64 1.43 -1.19 -5.09 118.68 113.09 1uqv s LEU 73 Ca 0.02 1.00 -0.03 0.00 -1.03 0.00 0.00 54.13 54.08 1uqv s LEU 73 Cb 0.09 -3.17 0.06 0.00 0.03 0.00 0.00 46.19 43.20 1uqv s LEU 73 CO 0.67 0.13 0.35 0.00 0.23 0.00 0.00 176.35 177.73 1uqv n LEU 75 N 0.00 0.66 -0.03 0.00 4.77 -1.26 -3.11 117.00 118.02 1uqv n LEU 75 Ca 0.05 0.63 -0.13 0.00 -0.03 0.00 0.00 56.01 56.52 1uqv n LEU 75 Cb 0.17 -0.50 -0.11 0.00 -2.33 0.00 0.00 43.42 40.64 1uqv n LEU 75 CO 0.12 -0.43 0.53 -0.61 -1.33 0.00 0.00 177.39 175.67 1uqv h GLN 76 N 0.00 0.02 -0.59 3.23 5.75 -1.98 -2.20 115.11 119.34 1uqv h GLN 76 Ca 0.00 -0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.45 1uqv h GLN 76 Cb 0.46 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.99 1uqv h GLN 76 CO 0.00 0.70 0.25 -0.44 -2.65 0.00 0.00 178.83 176.69 1uqv h ASP 77 N -0.65 0.78 0.01 -0.69 3.32 -1.92 -2.20 116.42 115.06 1uqv h ASP 77 Ca -0.00 -0.09 -0.12 0.00 0.02 0.00 0.00 57.03 56.84 1uqv h ASP 77 Cb 0.71 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 1uqv h ASP 77 CO 0.00 0.69 -0.37 0.00 -1.72 0.00 0.00 179.24 177.84 1uqv h GLN 79 N 0.41 1.15 -0.14 0.00 4.15 -0.79 -1.92 115.11 117.97 1uqv h GLN 79 Ca 0.04 -0.20 -0.04 0.00 0.77 0.00 0.00 58.65 59.22 1uqv h GLN 79 Cb 0.84 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.33 1uqv h GLN 79 CO 0.07 0.93 -0.08 0.22 -1.93 0.00 0.00 178.83 178.04 1uqv h ASP 80 N 1.11 0.20 0.88 -0.69 3.58 -1.30 -0.76 116.42 119.44 1uqv h ASP 80 Ca 0.26 -0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.68 1uqv h ASP 80 Cb 0.20 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.20 1uqv h ASP 80 CO -0.02 0.31 0.00 0.18 -2.88 0.00 0.00 179.24 176.83 1uqv n LEU 81 N -4.33 0.47 0.00 2.28 4.32 -0.75 -4.79 117.00 114.21 1uqv n LEU 81 Ca -0.01 0.59 -0.11 0.00 -0.02 0.00 0.00 56.01 56.46 1uqv n LEU 81 Cb 0.22 -0.49 0.04 0.00 -1.62 0.00 0.00 43.42 41.57 1uqv n LEU 81 CO 0.37 -0.34 0.21 0.00 -1.22 0.00 0.00 177.39 176.41 1uqv h ASP 83 N 0.05 0.00 0.00 0.00 3.32 -1.87 -3.46 116.42 114.46 1uqv h ASP 83 Ca -0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.90 1uqv h ASP 83 Cb 0.70 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.25 1uqv h ASP 83 CO 0.22 0.05 0.00 0.61 -1.72 0.00 0.00 179.24 178.40 1uqv n GLY 84 N 0.83 -0.86 3.67 2.75 0.00 -1.26 -5.11 105.19 105.20 1uqv n GLY 84 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 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 0.00 6.84 0.04 1.61 2.15 -1.26 -4.96 116.67 121.09 1uqv s ASP 85 Ca 0.00 1.03 -0.22 0.00 0.43 0.00 0.00 52.55 53.80 1uqv s ASP 85 Cb 0.00 -2.41 -0.14 0.00 -0.30 0.00 0.00 42.92 40.07 1uqv s ASP 85 CO 0.00 -0.35 1.44 0.25 -0.17 0.00 0.00 175.17 176.34 1uqv h LEU 86 N 8.27 0.23 -1.66 -1.34 5.85 -1.98 -2.92 115.31 121.74 1uqv h LEU 86 Ca -0.30 -0.36 0.22 0.00 0.84 0.00 0.00 57.88 58.28 1uqv h LEU 86 Cb 1.14 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 42.05 1uqv h LEU 86 CO 0.81 0.53 0.60 0.78 -0.34 0.00 0.00 178.44 180.82 1uqv h ASN 87 N -0.08 0.27 0.02 1.25 -0.26 -2.00 -0.26 115.58 114.53 1uqv h ASN 87 Ca 0.03 0.03 -0.00 0.00 -0.56 0.00 0.00 56.30 55.80 1uqv h ASN 87 Cb 0.43 -0.02 0.00 0.00 -1.06 0.00 0.00 38.32 37.67 1uqv h ASN 87 CO 0.01 0.10 -0.01 0.50 -1.06 0.00 0.00 177.43 176.98 1uqv h LYS 88 N 0.27 -0.02 -0.00 0.81 1.63 -1.93 -2.52 116.57 114.81 1uqv h LYS 88 Ca 0.45 0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 60.20 1uqv h LYS 88 Cb 1.33 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.96 1uqv h LYS 88 CO -0.13 0.03 -0.23 0.00 -3.45 0.00 0.00 179.45 175.67 1uqv h ALA 89 N 0.91 1.61 0.76 5.00 0.00 -1.07 -2.71 119.26 123.75 1uqv h ALA 89 Ca -0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1uqv h ALA 89 Cb 0.07 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.83 1uqv h ALA 89 CO 0.00 0.30 -0.36 0.82 0.00 0.00 0.00 179.25 180.01 1uqv h ILE 90 N 0.01 0.24 -0.64 0.00 2.04 -0.91 -1.82 117.51 116.42 1uqv h ILE 90 Ca -0.00 -0.04 0.06 0.00 1.00 0.00 0.00 64.86 65.87 1uqv h ILE 90 Cb 0.42 0.25 -0.04 0.00 -0.74 0.00 0.00 36.82 36.71 1uqv h ILE 90 CO 0.03 0.00 0.42 0.11 0.00 0.00 0.00 178.15 178.72 1uqv h LYS 91 N -1.05 0.65 0.66 2.37 1.79 -1.42 -1.67 116.57 117.90 1uqv h LYS 91 Ca -0.10 -0.04 -0.03 0.00 -2.18 0.00 0.00 60.65 58.30 1uqv h LYS 91 Cb 0.79 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 31.28 1uqv h LYS 91 CO 0.17 0.43 -0.45 0.35 -1.08 0.00 0.00 179.45 178.87 1uqv h PHE 92 N 0.67 -1.22 -0.18 -1.35 3.57 -1.20 -1.31 116.94 115.91 1uqv h PHE 92 Ca 0.27 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.82 1uqv h PHE 92 Cb 0.22 0.45 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 1uqv h PHE 92 CO -0.00 -0.66 0.14 -0.22 -2.23 0.00 0.00 178.31 175.35 1uqv h LYS 93 N -1.06 0.00 0.18 1.11 1.63 -1.06 -2.78 116.57 114.59 1uqv h LYS 93 Ca -0.09 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.70 1uqv h LYS 93 Cb 0.86 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.49 1uqv h LYS 93 CO 0.06 0.00 -0.09 0.82 -3.45 0.00 0.00 179.45 176.79 1uqv h ILE 94 N 0.00 0.00 -1.27 2.00 2.04 -0.78 -1.21 117.51 118.30 1uqv h ILE 94 Ca 0.09 -0.08 0.37 0.00 1.00 0.00 0.00 64.86 66.24 1uqv h ILE 94 Cb 0.37 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.37 1uqv h ILE 94 CO -0.00 0.00 0.86 -0.07 0.00 0.00 0.00 178.15 178.94 1uqv h LEU 95 N -0.32 0.20 -0.20 1.44 3.38 -1.16 0.59 115.31 119.24 1uqv h LEU 95 Ca -0.02 0.06 -0.21 0.00 0.09 0.00 0.00 57.88 57.80 1uqv h LEU 95 Cb 0.18 0.04 0.01 0.00 0.09 0.00 0.00 40.66 40.98 1uqv h LEU 95 CO 0.04 -0.02 -0.69 0.40 0.09 0.00 0.00 178.44 178.26 1uqv h ILE 96 N 0.14 1.28 -0.95 1.22 2.04 -1.47 -2.58 117.51 117.19 1uqv h ILE 96 Ca 0.68 -1.88 0.00 0.00 1.00 0.00 0.00 64.86 64.67 1uqv h ILE 96 Cb 2.28 1.86 -0.05 0.00 -0.74 0.00 0.00 36.82 40.17 1uqv h ILE 96 CO -0.20 0.60 0.61 -1.13 0.00 0.00 0.00 178.15 178.03 1uqv h ASN 97 N 0.58 1.11 -0.41 1.72 -0.73 0.14 -2.14 115.58 115.85 1uqv h ASN 97 Ca -0.03 -0.04 -0.13 0.00 1.87 0.00 0.00 56.30 57.97 1uqv h ASN 97 Cb 1.31 -0.28 -0.01 0.00 0.27 0.00 0.00 38.32 39.61 1uqv h ASN 97 CO 0.15 0.82 -0.24 0.11 -0.37 0.00 0.00 177.43 177.90 1uqv h LYS 98 N 1.30 0.88 -1.00 6.67 6.56 -1.36 -2.46 116.57 127.16 1uqv h LYS 98 Ca 0.35 -0.40 0.01 0.00 -1.06 0.00 0.00 60.65 59.55 1uqv h LYS 98 Cb -0.11 -0.02 -0.05 0.00 -0.57 0.00 0.00 32.23 31.48 1uqv h LYS 98 CO -0.07 1.05 0.66 1.98 -2.06 0.00 0.00 179.45 181.01 1uqv h MET 99 N 0.69 1.30 0.57 3.15 4.05 -1.04 0.27 114.93 123.93 1uqv h MET 99 Ca 0.09 -0.08 -0.03 0.00 -0.28 0.00 0.00 59.70 59.40 1uqv h MET 99 Cb 0.81 -0.29 0.01 0.00 -0.80 0.00 0.00 31.60 31.32 1uqv h MET 99 CO 0.07 0.86 -0.28 -0.09 0.23 0.00 0.00 176.91 177.71 1uqv h ARG 100 N 1.34 -0.74 0.00 0.39 2.43 -1.33 -3.05 114.38 113.42 1uqv h ARG 100 Ca 0.37 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.59 1uqv h ARG 100 Cb -0.13 0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1uqv h ARG 100 CO -0.09 -0.49 0.00 -0.25 -1.51 0.00 0.00 179.97 177.63 1uqv n ASP 101 N -5.28 0.11 -1.03 -3.80 8.00 -0.93 -4.96 116.55 108.66 1uqv n ASP 101 Ca -0.10 0.54 0.04 0.00 0.71 0.00 0.00 54.79 55.99 1uqv n ASP 101 Cb 0.30 -0.56 -0.02 0.00 -0.02 0.00 0.00 41.12 40.82 1uqv n ASP 101 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1uqv n SER 102 N -1.64 -5.54 -4.43 -2.24 7.64 0.93 -4.79 113.62 103.56 1uqv n SER 102 Ca 0.01 1.16 -0.44 0.00 1.01 0.00 0.00 58.87 60.62 1uqv n SER 102 Cb 0.08 -3.18 -0.06 0.00 -1.01 0.00 0.00 64.21 60.03 1uqv n SER 102 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1uqv s LYS 103 N -4.57 3.09 0.00 1.43 2.20 -1.26 -4.89 119.74 115.74 1uqv s LYS 103 Ca 0.00 -1.02 0.00 0.00 -0.36 0.00 0.00 55.97 54.59 1uqv s LYS 103 Cb 0.00 -4.11 0.00 0.00 -1.51 0.00 0.00 37.83 32.21 1uqv s LYS 103 CO 0.00 -1.19 0.00 1.28 -0.36 0.00 0.00 175.35 175.08 1uqv n LEU 104 N 5.95 0.00 -2.76 5.43 7.99 -1.26 -4.98 117.00 127.37 1uqv n LEU 104 Ca -0.08 0.00 -0.10 0.00 -0.01 0.00 0.00 56.01 55.82 1uqv n LEU 104 Cb 0.45 0.00 0.05 0.00 -0.11 0.00 0.00 43.42 43.81 1uqv n LEU 104 CO 0.53 0.00 0.09 -0.62 -1.51 0.00 0.00 177.39 175.88 1uqv n GLU 105 N -1.37 1.12 -0.03 3.23 1.02 -1.26 -4.89 120.64 118.46 1uqv n GLU 105 Ca 0.00 -2.73 0.03 0.00 -0.02 0.00 0.00 57.16 54.44 1uqv n GLU 105 Cb 0.00 -0.94 0.04 0.00 -0.02 0.00 0.00 31.44 30.52 1uqv n GLU 105 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 1uqv n TRP 106 N -0.13 0.00 -3.55 -0.32 8.01 -1.26 -4.95 117.44 115.24 1uqv n TRP 106 Ca 0.08 -0.59 -0.41 0.00 -1.31 0.00 0.00 57.50 55.27 1uqv n TRP 106 Cb 0.79 -0.07 -0.09 0.00 -2.01 0.00 0.00 31.31 29.93 1uqv n TRP 106 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.69 176.89 1uqv s LYS 107 N -1.42 2.54 0.00 -0.99 2.20 -1.26 -5.21 119.74 115.60 1uqv s LYS 107 Ca 0.09 -1.69 0.03 0.00 -0.36 0.00 0.00 55.97 54.04 1uqv s LYS 107 Cb 0.07 -3.91 0.02 0.00 -1.51 0.00 0.00 37.83 32.50 1uqv s LYS 107 CO 0.01 -1.14 0.58 -3.47 -0.36 0.00 0.00 175.35 170.97