#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 -5.18 0.00 1.61 3.41 -1.26 -4.90 113.62 107.31 1uqv n SER 25 Ca 0.00 1.09 0.12 0.00 -0.26 0.00 0.00 58.87 59.82 1uqv n SER 25 Cb 0.00 -3.58 0.30 0.00 -0.26 0.00 0.00 64.21 60.67 1uqv n SER 25 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 1uqv n HIS 26 N 1.65 0.02 -2.67 7.33 -0.00 -1.26 -4.88 115.22 115.40 1uqv n HIS 26 Ca -0.14 0.00 -0.39 0.00 -0.00 0.00 0.00 57.72 57.20 1uqv n HIS 26 Cb 0.31 -0.29 -0.05 0.00 -0.00 0.00 0.00 29.99 29.95 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 -3.00 4.62 0.00 1.57 0.00 -1.26 -4.93 119.30 116.30 1uqv s MET 27 Ca 0.11 1.51 0.00 0.00 0.00 0.00 0.00 55.69 57.31 1uqv s MET 27 Cb 0.18 -3.00 0.00 0.00 0.00 0.00 0.00 34.83 32.01 1uqv s MET 27 CO 0.68 0.28 0.25 0.27 0.00 0.00 0.00 175.02 176.50 1uqv n ASN 28 N 0.90 0.00 -4.92 1.11 2.04 -1.26 -5.10 115.26 108.02 1uqv n ASN 28 Ca 0.00 -1.00 -0.30 0.00 -0.44 0.00 0.00 54.58 52.85 1uqv n ASN 28 Cb 0.48 0.00 -0.04 0.00 -2.53 0.00 0.00 39.78 37.69 1uqv n ASN 28 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1uqv s ASN 29 N 0.00 6.37 0.11 0.53 4.22 -1.26 -5.02 114.94 119.89 1uqv s ASN 29 Ca 0.00 0.30 0.00 0.00 -2.14 0.00 0.00 52.86 51.02 1uqv s ASN 29 Cb 0.00 -1.97 0.00 0.00 1.28 0.00 0.00 41.25 40.56 1uqv s ASN 29 CO 0.00 0.11 0.00 1.21 -2.04 0.00 0.00 177.10 176.38 1uqv n GLU 30 N -0.03 0.00 -1.68 3.55 4.07 -1.26 -5.05 120.64 120.23 1uqv n GLU 30 Ca -0.05 0.00 -0.44 0.00 -0.06 0.00 0.00 57.16 56.61 1uqv n GLU 30 Cb 0.52 -0.25 -0.04 0.00 -0.06 0.00 0.00 31.44 31.62 1uqv n GLU 30 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1uqv n ASP 31 N -3.15 3.75 0.20 4.31 9.92 -1.26 -4.85 116.55 125.47 1uqv n ASP 31 Ca 0.00 0.99 0.14 0.00 -0.53 0.00 0.00 54.79 55.39 1uqv n ASP 31 Cb 0.12 -1.48 0.57 0.00 -0.64 0.00 0.00 41.12 39.69 1uqv n ASP 31 CO 0.00 0.00 0.00 2.19 0.13 0.00 0.00 177.20 179.52 1uqv h PHE 32 N 8.48 0.00 0.00 1.24 -5.15 -1.97 -2.62 116.94 116.92 1uqv h PHE 32 Ca -0.47 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.30 1uqv h PHE 32 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.41 1uqv h PHE 32 CO 0.80 0.00 0.00 0.77 -2.00 0.00 0.00 178.31 177.88 1uqv h SER 33 N 0.00 0.00 -0.41 -0.68 0.02 -1.89 -2.31 113.55 108.27 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 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 1uqv n GLN 34 N -2.66 2.68 -2.58 3.45 1.13 -0.99 -4.59 117.38 113.82 1uqv n GLN 34 Ca 0.01 -2.14 -0.40 0.00 -1.94 0.00 0.00 57.00 52.53 1uqv n GLN 34 Cb 0.26 -1.34 -0.05 0.00 0.11 0.00 0.00 30.24 29.22 1uqv n GLN 34 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 1uqv s TRP 35 N -1.02 3.69 0.42 1.08 0.52 -0.87 -5.03 118.94 117.72 1uqv s TRP 35 Ca 0.29 1.77 0.06 0.00 0.02 0.00 0.00 56.10 58.24 1uqv s TRP 35 Cb 0.15 -3.16 0.06 0.00 -1.15 0.00 0.00 33.47 29.37 1uqv s TRP 35 CO 0.20 -0.20 0.50 0.45 0.02 0.00 0.00 176.95 177.92 1uqv n SER 36 N 1.15 1.76 -0.33 2.95 2.88 -1.26 -3.66 113.62 117.11 1uqv n SER 36 Ca -0.01 -2.20 0.04 0.00 -1.33 0.00 0.00 58.87 55.37 1uqv n SER 36 Cb 0.46 -0.22 0.19 0.00 -0.75 0.00 0.00 64.21 63.88 1uqv n SER 36 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1uqv h VAL 37 N 0.24 0.97 -0.40 2.46 2.07 -1.97 -0.77 116.25 118.85 1uqv h VAL 37 Ca -0.21 -0.33 -0.11 0.00 0.82 0.00 0.00 66.70 66.86 1uqv h VAL 37 Cb 0.91 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1uqv h VAL 37 CO 0.32 0.17 -0.21 0.44 0.02 0.00 0.00 177.57 178.32 1uqv h ASP 38 N 0.96 0.79 0.07 0.57 5.19 -1.99 -1.78 116.42 120.22 1uqv h ASP 38 Ca 0.43 -0.28 -0.11 0.00 -0.62 0.00 0.00 57.03 56.45 1uqv h ASP 38 Cb 0.33 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.62 1uqv h ASP 38 CO -0.23 0.98 -0.37 0.44 -3.12 0.00 0.00 179.24 176.94 1uqv h ASP 39 N 0.68 0.42 -0.02 6.45 3.32 -1.66 -1.73 116.42 123.88 1uqv h ASP 39 Ca 0.10 -0.17 -0.06 0.00 0.02 0.00 0.00 57.03 56.91 1uqv h ASP 39 Cb 0.71 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.15 1uqv h ASP 39 CO 0.05 0.76 -0.23 0.58 -1.72 0.00 0.00 179.24 178.68 1uqv h VAL 40 N 0.34 1.50 0.01 -1.35 2.07 -1.02 -2.60 116.25 115.20 1uqv h VAL 40 Ca 0.04 -1.80 -0.00 0.00 0.82 0.00 0.00 66.70 65.76 1uqv h VAL 40 Cb 0.81 2.58 0.00 0.00 -1.52 0.00 0.00 31.29 33.16 1uqv h VAL 40 CO 0.07 0.50 -0.00 0.40 0.02 0.00 0.00 177.57 178.55 1uqv h ILE 41 N -0.41 1.08 0.64 4.57 2.04 -1.34 -0.86 117.51 123.24 1uqv h ILE 41 Ca -0.02 -0.27 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 1uqv h ILE 41 Cb 0.93 1.26 -0.00 0.00 -0.74 0.00 0.00 36.82 38.27 1uqv h ILE 41 CO 0.05 0.07 -0.37 0.74 0.00 0.00 0.00 178.15 178.64 1uqv h THR 42 N -0.13 0.25 -0.69 -0.27 2.02 -1.43 -1.83 112.91 110.83 1uqv h THR 42 Ca -0.00 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.26 1uqv h THR 42 Cb 0.12 0.25 -0.06 0.00 -1.74 0.00 0.00 68.15 66.72 1uqv h THR 42 CO 0.00 0.00 0.36 -0.25 0.37 0.00 0.00 175.52 176.00 1uqv h TRP 43 N -0.94 0.65 0.00 3.16 7.01 -1.50 0.31 115.95 124.64 1uqv h TRP 43 Ca -0.08 0.03 0.00 0.00 2.11 0.00 0.00 58.89 60.95 1uqv h TRP 43 Cb 0.75 -0.19 0.00 0.00 -2.10 0.00 0.00 29.16 27.62 1uqv h TRP 43 CO -0.08 0.27 0.00 0.00 -2.79 0.00 0.00 178.44 175.84 1uqv h ILE 45 N 0.00 0.56 0.00 0.00 2.04 -1.28 0.62 117.51 119.45 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 0.00 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 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 -4.15 0.31 -0.28 1.72 2.88 0.09 -3.42 113.62 110.78 1uqv n SER 46 Ca 0.12 0.64 0.00 0.00 -1.33 0.00 0.00 58.87 58.31 1uqv n SER 46 Cb 0.75 -0.69 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 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 0.07 -5.03 114.28 115.52 1uqv n THR 47 Ca -0.01 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.99 1uqv n THR 47 Cb 0.03 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.81 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 0.10 0.04 1.09 -0.00 0.19 -5.03 117.00 113.40 1uqv n LEU 48 Ca 0.00 0.39 0.00 0.00 -0.00 0.00 0.00 56.01 56.40 1uqv n LEU 48 Cb 0.42 -0.48 0.00 0.00 -0.00 0.00 0.00 43.42 43.36 1uqv n LEU 48 CO 0.00 -0.48 0.00 -0.62 -0.00 0.00 0.00 177.39 176.29 1uqv n GLU 49 N -2.04 0.00 -0.41 1.96 -0.58 -1.26 -4.99 120.64 113.33 1uqv n GLU 49 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1uqv n GLU 49 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1uqv n GLU 49 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1uqv n VAL 50 N -2.76 0.00 -2.96 2.62 0.24 -1.26 -5.12 118.33 109.09 1uqv n VAL 50 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.17 1uqv n VAL 50 Cb 0.00 -0.60 0.05 0.00 -1.47 0.00 0.00 33.84 31.81 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 -0.18 0.67 -1.88 7.34 0.28 -1.26 -4.64 120.64 120.97 1uqv n GLU 51 Ca 0.00 -1.97 -0.40 0.00 -0.16 0.00 0.00 57.16 54.63 1uqv n GLU 51 Cb 0.00 -0.19 -0.02 0.00 1.43 0.00 0.00 31.44 32.66 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 -1.86 2.43 0.00 3.44 2.13 -1.26 -3.76 120.64 121.77 1uqv n GLU 52 Ca 0.11 -2.59 0.00 0.00 0.66 0.00 0.00 57.16 55.33 1uqv n GLU 52 Cb 0.38 -3.33 0.00 0.00 0.27 0.00 0.00 31.44 28.76 1uqv n GLU 52 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1uqv n THR 53 N 6.10 0.00 -1.72 6.31 -2.24 -1.26 -5.11 114.28 116.36 1uqv n THR 53 Ca 0.49 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.89 1uqv n THR 53 Cb 0.42 -0.29 0.04 0.00 -2.10 0.00 0.00 70.33 68.41 1uqv n THR 53 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1uqv n ASP 54 N -2.18 2.40 0.00 3.42 2.03 -1.25 -4.83 116.55 116.15 1uqv n ASP 54 Ca 0.00 0.97 0.00 0.00 0.52 0.00 0.00 54.79 56.28 1uqv n ASP 54 Cb 0.00 -1.54 0.00 0.00 -0.72 0.00 0.00 41.12 38.86 1uqv n ASP 54 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 1uqv n PRO 55 N -0.93 0.00 0.01 -0.67 -0.02 -1.26 -3.18 135.00 128.96 1uqv n PRO 55 Ca 0.11 0.01 0.23 0.00 -2.02 0.00 0.00 63.50 61.82 1uqv n PRO 55 Cb 0.44 -1.50 0.67 0.00 -0.02 0.00 0.00 33.50 33.10 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 -1.93 0.15 115.31 121.76 1uqv h LEU 56 Ca 0.00 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1uqv h LEU 56 Cb 0.00 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 1uqv h LEU 56 CO 0.00 0.00 -0.11 0.00 -0.34 0.00 0.00 178.44 177.99 1uqv h GLN 58 N -0.28 0.34 0.07 0.00 4.15 -1.01 -1.18 115.11 117.21 1uqv h GLN 58 Ca 0.01 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.41 1uqv h GLN 58 Cb 0.68 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.28 1uqv h GLN 58 CO 0.03 0.23 -0.11 -0.09 -1.93 0.00 0.00 178.83 176.96 1uqv h ARG 59 N 0.34 -0.21 -0.23 1.69 9.65 -1.49 -0.92 114.38 123.22 1uqv h ARG 59 Ca 0.09 0.01 0.01 0.00 -1.10 0.00 0.00 59.98 59.00 1uqv h ARG 59 Cb -0.03 0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.59 1uqv h ARG 59 CO -0.02 -0.14 0.15 -0.07 2.80 0.00 0.00 179.97 182.69 1uqv h LEU 60 N -0.22 0.23 -0.66 3.80 3.38 -1.35 -1.54 115.31 118.95 1uqv h LEU 60 Ca 0.02 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.84 1uqv h LEU 60 Cb 0.23 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1uqv h LEU 60 CO -0.06 0.16 -0.59 -0.09 0.09 0.00 0.00 178.44 177.95 1uqv h ARG 61 N 0.27 0.24 0.19 1.13 1.12 -0.46 -3.31 114.38 113.56 1uqv h ARG 61 Ca 0.09 -0.16 0.00 0.00 -1.11 0.00 0.00 59.98 58.79 1uqv h ARG 61 Cb 0.03 0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 29.99 1uqv h ARG 61 CO -0.02 0.77 -0.35 0.93 -3.11 0.00 0.00 179.97 178.18 1uqv h GLU 62 N 0.18 -0.57 -5.21 0.20 4.39 -0.11 -3.30 114.58 110.16 1uqv h GLU 62 Ca -0.00 0.04 -0.68 0.00 0.34 0.00 0.00 59.36 59.06 1uqv h GLU 62 Cb 1.09 0.13 -0.16 0.00 -0.10 0.00 0.00 28.75 29.71 1uqv h GLU 62 CO 0.09 -0.38 1.00 -0.80 -1.16 0.00 0.00 179.01 177.76 1uqv s ASN 63 N -3.83 6.63 -0.74 1.42 0.01 -1.23 -4.95 114.94 112.26 1uqv s ASN 63 Ca -0.12 -2.00 -0.24 0.00 -0.71 0.00 0.00 52.86 49.79 1uqv s ASN 63 Cb 0.04 -2.43 -0.15 0.00 0.41 0.00 0.00 41.25 39.12 1uqv s ASN 63 CO 0.41 -1.12 2.41 0.47 -1.51 0.00 0.00 177.10 177.75 1uqv n ASP 64 N 6.93 1.50 -4.03 -1.22 9.92 -1.25 -4.88 116.55 123.53 1uqv n ASP 64 Ca 0.27 -0.98 -0.31 0.00 -0.53 0.00 0.00 54.79 53.23 1uqv n ASP 64 Cb 0.49 -1.47 -0.15 0.00 -0.64 0.00 0.00 41.12 39.35 1uqv n ASP 64 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1uqv s ILE 65 N 12.04 1.91 1.22 0.53 -1.09 -1.26 -5.12 121.20 129.43 1uqv s ILE 65 Ca 1.02 -1.40 -0.14 0.00 -2.23 0.00 0.00 60.65 57.90 1uqv s ILE 65 Cb -0.30 -2.04 0.31 0.00 -1.58 0.00 0.00 42.46 38.84 1uqv s ILE 65 CO 0.22 0.01 1.01 0.68 -1.23 0.00 0.00 174.94 175.62 1uqv s VAL 66 N 1.23 1.91 -0.67 2.92 -7.23 -1.26 -4.86 120.40 112.45 1uqv s VAL 66 Ca -0.06 0.00 0.23 0.00 -1.81 0.00 0.00 61.98 60.34 1uqv s VAL 66 Cb -0.19 -2.05 0.23 0.00 0.56 0.00 0.00 36.38 34.93 1uqv s VAL 66 CO -0.06 0.00 1.70 0.61 -0.31 0.00 0.00 175.10 177.04 1uqv n GLY 67 N 0.93 -1.34 0.01 2.32 0.00 -1.24 -2.42 105.19 103.45 1uqv n GLY 67 Ca 0.03 0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.20 1uqv n GLY 67 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1uqv n ASP 68 N -2.06 0.08 -0.10 1.61 2.03 -1.24 -2.91 116.55 113.97 1uqv n ASP 68 Ca 0.03 0.51 0.07 0.00 0.52 0.00 0.00 54.79 55.92 1uqv n ASP 68 Cb 0.27 -0.53 -0.06 0.00 -0.72 0.00 0.00 41.12 40.08 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 -1.58 0.92 -0.01 -2.67 4.32 -1.01 -4.54 117.00 112.43 1uqv n LEU 69 Ca 0.06 -0.58 -0.10 0.00 -0.02 0.00 0.00 56.01 55.38 1uqv n LEU 69 Cb 0.30 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.06 1uqv n LEU 69 CO 0.24 0.21 0.83 -0.07 -1.22 0.00 0.00 177.39 177.38 1uqv h LEU 70 N 0.48 -0.16 -0.02 2.23 3.38 -1.59 0.05 115.31 119.69 1uqv h LEU 70 Ca 0.00 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1uqv h LEU 70 Cb 0.39 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1uqv h LEU 70 CO 0.00 -0.06 -0.02 -0.81 0.09 0.00 0.00 178.44 177.64 1uqv n PRO 71 N -5.18 0.39 -0.04 1.13 -0.04 -1.26 -3.41 135.00 126.59 1uqv n PRO 71 Ca -0.04 -0.02 -0.07 0.00 -0.04 0.00 0.00 63.50 63.33 1uqv n PRO 71 Cb 0.11 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 31.93 1uqv n PRO 71 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1uqv n GLU 72 N -1.29 0.65 -3.25 0.54 2.13 -0.81 -4.92 120.64 113.69 1uqv n GLU 72 Ca 0.13 0.16 -0.35 0.00 0.66 0.00 0.00 57.16 57.76 1uqv n GLU 72 Cb 0.26 -1.69 -0.06 0.00 0.27 0.00 0.00 31.44 30.22 1uqv n GLU 72 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1uqv s LEU 73 N -5.78 4.31 0.00 4.31 1.43 -0.06 -5.09 118.68 117.79 1uqv s LEU 73 Ca -0.06 1.20 0.00 0.00 -1.03 0.00 0.00 54.13 54.24 1uqv s LEU 73 Cb 0.08 -3.47 0.00 0.00 0.03 0.00 0.00 46.19 42.82 1uqv s LEU 73 CO 0.83 0.04 0.00 0.00 0.23 0.00 0.00 176.35 177.45 1uqv h LEU 75 N 0.00 0.00 0.32 0.00 3.38 -1.98 -3.06 115.31 113.96 1uqv h LEU 75 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1uqv h LEU 75 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1uqv h LEU 75 CO 0.00 0.00 -0.17 1.56 0.09 0.00 0.00 178.44 179.92 1uqv h GLN 76 N 0.00 -0.44 0.00 1.13 4.20 -1.99 0.21 115.11 118.22 1uqv h GLN 76 Ca 0.00 0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.70 1uqv h GLN 76 Cb 0.31 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 1uqv h GLN 76 CO 0.00 -0.30 -0.17 -0.44 -0.67 0.00 0.00 178.83 177.25 1uqv h ASP 77 N -0.46 0.00 0.95 1.46 5.19 -1.91 -2.47 116.42 119.19 1uqv h ASP 77 Ca -0.04 0.00 -0.17 0.00 -0.62 0.00 0.00 57.03 56.20 1uqv h ASP 77 Cb 0.37 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.85 1uqv h ASP 77 CO 0.05 0.17 -0.83 0.00 -3.12 0.00 0.00 179.24 175.52 1uqv h GLN 79 N 0.00 0.51 0.00 0.00 4.15 -0.15 -2.88 115.11 116.73 1uqv h GLN 79 Ca -0.01 -0.53 0.00 0.00 0.77 0.00 0.00 58.65 58.88 1uqv h GLN 79 Cb 1.53 0.15 0.00 0.00 0.21 0.00 0.00 27.48 29.36 1uqv h GLN 79 CO 0.11 1.16 0.00 0.22 -1.93 0.00 0.00 178.83 178.39 1uqv h ASP 80 N 0.29 0.00 0.66 -0.69 1.82 -1.50 -1.33 116.42 115.67 1uqv h ASP 80 Ca -0.09 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.55 1uqv h ASP 80 Cb 1.59 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.60 1uqv h ASP 80 CO 0.17 0.00 -0.68 0.18 -1.61 0.00 0.00 179.24 177.31 1uqv n LEU 81 N -2.36 0.62 -4.92 2.28 4.32 -1.10 -4.90 117.00 110.94 1uqv n LEU 81 Ca 0.01 0.11 -0.21 0.00 -0.02 0.00 0.00 56.01 55.90 1uqv n LEU 81 Cb 0.20 -0.18 -0.03 0.00 -1.62 0.00 0.00 43.42 41.79 1uqv n LEU 81 CO 0.19 0.02 -0.06 0.00 -1.22 0.00 0.00 177.39 176.32 1uqv h ASP 83 N 1.22 0.00 0.00 0.00 1.82 -1.91 -3.44 116.42 114.12 1uqv h ASP 83 Ca -0.49 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.15 1uqv h ASP 83 Cb 1.24 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.25 1uqv h ASP 83 CO 0.59 0.00 0.00 0.61 -1.61 0.00 0.00 179.24 178.83 1uqv n GLY 84 N -0.72 -0.93 3.60 -0.78 0.00 -1.26 -5.13 105.19 99.97 1uqv n GLY 84 Ca -0.02 0.00 -0.40 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 0.00 6.36 0.11 1.61 2.15 -1.26 -4.97 116.67 120.67 1uqv s ASP 85 Ca 0.00 0.30 -0.19 0.00 0.43 0.00 0.00 52.55 53.10 1uqv s ASP 85 Cb 0.00 -2.26 -0.06 0.00 -0.30 0.00 0.00 42.92 40.30 1uqv s ASP 85 CO 0.00 -0.33 1.65 0.25 -0.17 0.00 0.00 175.17 176.58 1uqv h LEU 86 N 8.84 0.37 -1.93 -1.34 5.85 -2.00 -2.58 115.31 122.52 1uqv h LEU 86 Ca -0.29 -0.16 0.22 0.00 0.84 0.00 0.00 57.88 58.49 1uqv h LEU 86 Cb 1.14 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 1uqv h LEU 86 CO 0.72 0.43 0.57 -1.13 -0.34 0.00 0.00 178.44 178.68 1uqv h ASN 87 N 0.28 0.06 0.03 1.25 -1.24 -2.00 -0.81 115.58 113.16 1uqv h ASN 87 Ca 0.09 0.01 -0.00 0.00 0.71 0.00 0.00 56.30 57.10 1uqv h ASN 87 Cb 0.18 -0.01 0.00 0.00 0.73 0.00 0.00 38.32 39.22 1uqv h ASN 87 CO -0.01 0.02 -0.01 0.11 -1.29 0.00 0.00 177.43 176.25 1uqv h LYS 88 N 0.06 -0.04 0.00 6.67 1.79 -1.88 -2.78 116.57 120.39 1uqv h LYS 88 Ca 0.38 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.83 1uqv h LYS 88 Cb 1.44 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 32.09 1uqv h LYS 88 CO -0.03 0.44 -0.11 0.00 -1.08 0.00 0.00 179.45 178.68 1uqv h ALA 89 N 0.41 1.57 0.40 3.86 0.00 -1.09 -2.29 119.26 122.11 1uqv h ALA 89 Ca -0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1uqv h ALA 89 Cb 0.50 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1uqv h ALA 89 CO 0.01 0.13 -0.19 0.82 0.00 0.00 0.00 179.25 180.01 1uqv h ILE 90 N 0.00 0.46 -0.20 0.00 2.04 -1.16 -2.48 117.51 116.17 1uqv h ILE 90 Ca -0.00 -0.58 0.06 0.00 1.00 0.00 0.00 64.86 65.34 1uqv h ILE 90 Cb 0.22 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1uqv h ILE 90 CO 0.01 0.08 0.17 0.11 0.00 0.00 0.00 178.15 178.53 1uqv h LYS 91 N -0.93 0.00 0.66 2.37 1.79 -1.33 -1.19 116.57 117.93 1uqv h LYS 91 Ca -0.06 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.38 1uqv h LYS 91 Cb 0.55 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.21 1uqv h LYS 91 CO 0.09 0.00 -0.32 0.35 -1.08 0.00 0.00 179.45 178.49 1uqv h PHE 92 N 0.00 -0.82 -0.06 -1.35 3.57 -1.29 -2.26 116.94 114.74 1uqv h PHE 92 Ca 0.10 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.59 1uqv h PHE 92 Cb 0.44 0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.45 1uqv h PHE 92 CO 0.00 -0.51 0.05 -0.22 -2.23 0.00 0.00 178.31 175.40 1uqv h LYS 93 N -1.05 0.00 0.18 1.11 3.64 -1.06 -2.75 116.57 116.64 1uqv h LYS 93 Ca -0.09 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 1uqv h LYS 93 Cb 0.68 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 1uqv h LYS 93 CO 0.15 0.00 -0.09 0.82 -2.27 0.00 0.00 179.45 178.06 1uqv h ILE 94 N 0.00 0.00 -1.09 2.00 2.04 -1.09 0.16 117.51 119.53 1uqv h ILE 94 Ca 0.03 -0.06 0.31 0.00 1.00 0.00 0.00 64.86 66.13 1uqv h ILE 94 Cb 0.13 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.15 1uqv h ILE 94 CO -0.00 0.00 0.76 -0.07 0.00 0.00 0.00 178.15 178.84 1uqv h LEU 95 N -0.31 0.12 -0.08 1.44 3.38 -1.32 0.52 115.31 119.07 1uqv h LEU 95 Ca -0.03 0.02 -0.24 0.00 0.09 0.00 0.00 57.88 57.73 1uqv h LEU 95 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1uqv h LEU 95 CO 0.04 0.02 -1.04 0.40 0.09 0.00 0.00 178.44 177.95 1uqv h ILE 96 N 0.11 1.46 -0.51 1.22 2.04 -1.44 -2.26 117.51 118.13 1uqv h ILE 96 Ca 0.55 -2.71 -0.11 0.00 1.00 0.00 0.00 64.86 63.59 1uqv h ILE 96 Cb 1.95 2.63 -0.02 0.00 -0.74 0.00 0.00 36.82 40.64 1uqv h ILE 96 CO -0.09 0.80 -0.10 -1.13 0.00 0.00 0.00 178.15 177.63 1uqv h ASN 97 N 0.15 0.97 -0.07 1.72 -1.24 0.30 -1.20 115.58 116.22 1uqv h ASN 97 Ca -0.09 -0.35 -0.08 0.00 0.71 0.00 0.00 56.30 56.48 1uqv h ASN 97 Cb 1.71 -0.27 0.00 0.00 0.73 0.00 0.00 38.32 40.50 1uqv h ASN 97 CO 0.17 1.10 -0.29 0.11 -1.29 0.00 0.00 177.43 177.24 1uqv h LYS 98 N 0.83 0.32 -0.86 6.67 6.56 -1.28 -0.54 116.57 128.27 1uqv h LYS 98 Ca 0.13 -0.25 0.03 0.00 -1.06 0.00 0.00 60.65 59.51 1uqv h LYS 98 Cb 0.66 0.05 -0.05 0.00 -0.57 0.00 0.00 32.23 32.32 1uqv h LYS 98 CO 0.05 0.88 0.57 1.98 -2.06 0.00 0.00 179.45 180.87 1uqv h MET 99 N -0.18 1.05 0.00 3.15 4.05 -1.41 -1.42 114.93 120.16 1uqv h MET 99 Ca -0.02 -0.06 -0.17 0.00 -0.28 0.00 0.00 59.70 59.17 1uqv h MET 99 Cb 0.93 -0.24 -0.02 0.00 -0.80 0.00 0.00 31.60 31.47 1uqv h MET 99 CO 0.06 0.69 -0.81 -0.09 0.23 0.00 0.00 176.91 176.99 1uqv h ARG 100 N 1.08 0.00 0.00 0.39 1.12 -1.22 -3.36 114.38 112.38 1uqv h ARG 100 Ca 0.34 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.21 1uqv h ARG 100 Cb 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 29.97 1uqv h ARG 100 CO -0.10 0.81 0.00 -3.47 -3.11 0.00 0.00 179.97 174.11 1uqv n ASP 101 N -3.50 0.00 -3.47 -3.80 2.03 -0.21 -5.01 116.55 102.58 1uqv n ASP 101 Ca -0.00 0.91 -0.03 0.00 0.52 0.00 0.00 54.79 56.18 1uqv n ASP 101 Cb 0.80 -0.45 0.01 0.00 -0.72 0.00 0.00 41.12 40.76 1uqv n ASP 101 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1uqv s SER 102 N -2.07 -0.05 0.17 1.67 0.15 -0.93 -5.09 113.70 107.54 1uqv s SER 102 Ca 0.00 -0.59 -0.31 0.00 0.70 0.00 0.00 55.95 55.74 1uqv s SER 102 Cb 0.00 0.50 -0.10 0.00 -1.71 0.00 0.00 66.02 64.71 1uqv s SER 102 CO 0.00 -0.97 1.57 -0.75 1.20 0.00 0.00 173.24 174.29 1uqv s LYS 103 N -2.53 4.21 -0.04 5.44 2.20 -1.26 -4.59 119.74 123.17 1uqv s LYS 103 Ca 0.18 2.37 -0.04 0.00 -0.36 0.00 0.00 55.97 58.12 1uqv s LYS 103 Cb -0.02 -3.15 -0.03 0.00 -1.51 0.00 0.00 37.83 33.13 1uqv s LYS 103 CO 0.04 -0.60 -0.09 -0.11 -0.36 0.00 0.00 175.35 174.23 1uqv n LEU 104 N 3.88 0.81 -2.68 5.43 7.94 -1.26 -5.01 117.00 126.11 1uqv n LEU 104 Ca 0.14 0.13 -0.05 0.00 -1.11 0.00 0.00 56.01 55.11 1uqv n LEU 104 Cb 0.38 -0.30 0.06 0.00 0.53 0.00 0.00 43.42 44.10 1uqv n LEU 104 CO 0.61 -0.13 0.50 1.21 -1.11 0.00 0.00 177.39 178.48 1uqv n GLU 105 N -3.48 0.22 -0.34 1.96 4.07 -1.26 -5.00 120.64 116.80 1uqv n GLU 105 Ca -0.11 -0.90 0.11 0.00 -0.06 0.00 0.00 57.16 56.21 1uqv n GLU 105 Cb 0.44 -0.36 0.30 0.00 -0.06 0.00 0.00 31.44 31.76 1uqv n GLU 105 CO 0.00 0.00 0.00 0.91 -0.06 0.00 0.00 177.13 177.98 1uqv n TRP 106 N 1.81 0.90 -3.97 4.31 5.03 -1.26 -4.75 117.44 119.51 1uqv n TRP 106 Ca 0.05 -0.47 -0.30 0.00 3.03 0.00 0.00 57.50 59.81 1uqv n TRP 106 Cb 0.68 -0.00 -0.14 0.00 -1.03 0.00 0.00 31.31 30.81 1uqv n TRP 106 CO 0.00 0.00 0.00 0.15 -0.03 0.00 0.00 177.69 177.81 1uqv s LYS 107 N -1.05 1.86 0.00 -0.99 1.02 -1.26 -5.27 119.74 114.05 1uqv s LYS 107 Ca 0.46 -2.44 0.23 0.00 0.02 0.00 0.00 55.97 54.24 1uqv s LYS 107 Cb 0.24 -3.30 0.18 0.00 -0.52 0.00 0.00 37.83 34.44 1uqv s LYS 107 CO 0.32 -1.07 1.23 -0.25 -0.92 0.00 0.00 175.35 174.66