#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 0.00 1.61 0.01 -1.26 -5.06 113.70 113.97 1uqv s SER 25 Ca 0.00 -0.95 0.00 0.00 1.31 0.00 0.00 55.95 56.31 1uqv s SER 25 Cb 0.00 0.45 0.00 0.00 0.21 0.00 0.00 66.02 66.68 1uqv s SER 25 CO 0.00 -1.40 0.00 1.41 0.41 0.00 0.00 173.24 173.66 1uqv n HIS 26 N -2.25 0.00 -0.05 2.43 8.25 -1.26 -4.95 115.22 117.39 1uqv n HIS 26 Ca 0.15 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.54 1uqv n HIS 26 Cb 0.62 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.69 1uqv n HIS 26 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1uqv n MET 27 N -1.45 0.25 -2.23 -0.41 0.00 -1.26 -5.05 117.12 106.97 1uqv n MET 27 Ca 0.00 0.06 -0.27 0.00 0.00 0.00 0.00 57.70 57.49 1uqv n MET 27 Cb 0.04 -1.19 0.14 0.00 0.00 0.00 0.00 33.22 32.21 1uqv n MET 27 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 175.97 175.17 1uqv s ASN 28 N -5.03 3.88 -0.30 7.83 -0.87 -1.26 -5.09 114.94 114.10 1uqv s ASN 28 Ca -0.14 0.06 -0.00 0.00 -1.57 0.00 0.00 52.86 51.21 1uqv s ASN 28 Cb 0.04 -0.33 0.14 0.00 -0.02 0.00 0.00 41.25 41.07 1uqv s ASN 28 CO 0.23 -2.21 0.30 0.54 -2.57 0.00 0.00 177.10 173.39 1uqv s ASN 29 N -4.77 1.68 -0.07 -1.22 2.20 -1.26 -4.82 114.94 106.68 1uqv s ASN 29 Ca 0.69 -0.88 0.00 0.00 -0.94 0.00 0.00 52.86 51.72 1uqv s ASN 29 Cb -0.06 0.48 -0.04 0.00 -2.00 0.00 0.00 41.25 39.63 1uqv s ASN 29 CO 0.48 -0.38 -0.06 -1.84 -2.94 0.00 0.00 177.10 172.36 1uqv n GLU 30 N 5.17 0.17 -1.67 3.55 0.28 -1.26 -5.01 120.64 121.87 1uqv n GLU 30 Ca -0.00 0.04 -0.52 0.00 -0.16 0.00 0.00 57.16 56.52 1uqv n GLU 30 Cb 0.46 -1.10 -0.06 0.00 1.43 0.00 0.00 31.44 32.18 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 -2.76 2.63 -0.08 -1.84 8.00 -1.26 -4.84 116.55 116.39 1uqv n ASP 31 Ca -0.12 1.06 0.13 0.00 0.71 0.00 0.00 54.79 56.57 1uqv n ASP 31 Cb 0.62 -1.27 0.48 0.00 -0.02 0.00 0.00 41.12 40.94 1uqv n ASP 31 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1uqv n PHE 32 N 4.68 0.00 0.33 1.24 3.72 -1.26 -3.80 117.46 122.37 1uqv n PHE 32 Ca 0.22 0.00 0.21 0.00 -0.05 0.00 0.00 57.45 57.83 1uqv n PHE 32 Cb 0.22 -0.25 1.13 0.00 -0.94 0.00 0.00 39.48 39.64 1uqv n PHE 32 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1uqv h SER 33 N 0.41 0.00 0.03 4.37 0.87 -1.97 -0.33 113.55 116.92 1uqv h SER 33 Ca 0.00 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.41 1uqv h SER 33 Cb 0.44 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.37 1uqv h SER 33 CO 0.00 0.00 -2.13 0.00 -0.53 0.00 0.00 176.83 174.17 1uqv n GLN 34 N -3.00 0.67 -2.02 2.24 1.13 -1.25 -4.87 117.38 110.28 1uqv n GLN 34 Ca -0.03 -0.11 -0.40 0.00 -1.94 0.00 0.00 57.00 54.52 1uqv n GLN 34 Cb 0.11 -1.53 -0.03 0.00 0.11 0.00 0.00 30.24 28.90 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 -3.09 1.74 0.06 1.08 0.52 -0.14 -4.96 118.94 114.16 1uqv s TRP 35 Ca -0.09 0.75 0.01 0.00 0.02 0.00 0.00 56.10 56.80 1uqv s TRP 35 Cb 0.11 -4.10 0.01 0.00 -1.15 0.00 0.00 33.47 28.34 1uqv s TRP 35 CO 0.87 -2.54 0.08 0.43 0.02 0.00 0.00 176.95 175.82 1uqv n SER 36 N 11.72 0.28 -0.04 2.95 7.64 -1.26 -3.34 113.62 131.57 1uqv n SER 36 Ca 0.22 -1.17 -0.08 0.00 1.01 0.00 0.00 58.87 58.85 1uqv n SER 36 Cb 0.50 -0.04 -0.02 0.00 -1.01 0.00 0.00 64.21 63.64 1uqv n SER 36 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1uqv h VAL 37 N 0.04 0.56 -0.14 0.44 2.07 -1.93 -0.50 116.25 116.79 1uqv h VAL 37 Ca -0.03 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.51 1uqv h VAL 37 Cb 0.14 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1uqv h VAL 37 CO 0.04 0.00 0.10 -0.78 0.02 0.00 0.00 177.57 176.95 1uqv h ASP 38 N -0.15 0.09 0.07 0.57 3.58 -1.98 -1.35 116.42 117.25 1uqv h ASP 38 Ca 0.13 -0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.57 1uqv h ASP 38 Cb 0.34 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.37 1uqv h ASP 38 CO -0.31 0.06 -0.03 0.44 -2.88 0.00 0.00 179.24 176.52 1uqv h ASP 39 N 0.10 -0.08 -0.54 2.28 5.19 -1.54 -2.28 116.42 119.56 1uqv h ASP 39 Ca 0.06 -0.53 -0.02 0.00 -0.62 0.00 0.00 57.03 55.93 1uqv h ASP 39 Cb 0.11 0.02 -0.03 0.00 0.18 0.00 0.00 39.33 39.61 1uqv h ASP 39 CO -0.01 0.54 0.29 0.58 -3.12 0.00 0.00 179.24 177.52 1uqv h VAL 40 N -0.74 1.18 0.43 -1.35 2.07 -0.91 -2.58 116.25 114.36 1uqv h VAL 40 Ca -0.01 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 1uqv h VAL 40 Cb 0.60 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1uqv h VAL 40 CO 0.01 0.21 -0.21 0.40 0.02 0.00 0.00 177.57 178.01 1uqv h ILE 41 N 0.80 0.36 -1.01 4.57 2.04 -1.32 -0.45 117.51 122.49 1uqv h ILE 41 Ca 0.20 -0.58 0.25 0.00 1.00 0.00 0.00 64.86 65.73 1uqv h ILE 41 Cb 0.06 0.54 -0.12 0.00 -0.74 0.00 0.00 36.82 36.56 1uqv h ILE 41 CO -0.03 0.07 0.60 0.74 0.00 0.00 0.00 178.15 179.53 1uqv h THR 42 N -1.00 0.54 -0.02 -0.27 2.02 -1.35 0.17 112.91 112.99 1uqv h THR 42 Ca -0.06 -0.19 -0.25 0.00 0.77 0.00 0.00 66.41 66.67 1uqv h THR 42 Cb 0.55 -0.08 0.02 0.00 -1.74 0.00 0.00 68.15 66.90 1uqv h THR 42 CO 0.10 0.10 -0.99 -0.25 0.37 0.00 0.00 175.52 174.85 1uqv h TRP 43 N 0.57 0.95 0.00 3.16 7.01 -1.47 -0.14 115.95 126.03 1uqv h TRP 43 Ca 0.64 -0.50 0.00 0.00 2.11 0.00 0.00 58.89 61.14 1uqv h TRP 43 Cb 1.25 -0.11 0.00 0.00 -2.10 0.00 0.00 29.16 28.20 1uqv h TRP 43 CO -0.01 1.33 0.00 0.00 -2.79 0.00 0.00 178.44 176.98 1uqv n ILE 45 N -1.86 0.00 0.00 0.00 5.41 0.04 -3.96 119.36 118.99 1uqv n ILE 45 Ca 0.02 -0.25 0.00 0.00 1.00 0.00 0.00 62.75 63.52 1uqv n ILE 45 Cb 0.14 0.46 0.00 0.00 -0.71 0.00 0.00 39.64 39.53 1uqv n ILE 45 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1uqv n SER 46 N -1.71 0.00 0.00 4.38 2.88 -0.08 -4.40 113.62 114.70 1uqv n SER 46 Ca -0.01 0.72 0.00 0.00 -1.33 0.00 0.00 58.87 58.25 1uqv n SER 46 Cb 0.25 -0.36 0.00 0.00 -0.75 0.00 0.00 64.21 63.35 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 -1.58 0.57 0.01 2.46 5.66 -1.22 -4.85 114.28 115.34 1uqv n THR 47 Ca 0.00 -0.68 -0.01 0.00 -3.05 0.00 0.00 64.05 60.31 1uqv n THR 47 Cb 0.00 0.77 -0.00 0.00 -1.55 0.00 0.00 70.33 69.55 1uqv n THR 47 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 175.07 172.27 1uqv h LEU 48 N 0.00 -0.03 0.00 1.09 7.12 -1.72 -3.49 115.31 118.28 1uqv h LEU 48 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 1uqv h LEU 48 Cb 0.46 0.01 0.00 0.00 -0.53 0.00 0.00 40.66 40.60 1uqv h LEU 48 CO 0.00 -0.02 0.00 1.21 -0.13 0.00 0.00 178.44 179.50 1uqv n GLU 49 N -2.13 0.00 -1.47 1.25 4.07 -1.25 -4.80 120.64 116.31 1uqv n GLU 49 Ca -0.00 0.00 -0.06 0.00 -0.06 0.00 0.00 57.16 57.04 1uqv n GLU 49 Cb 0.02 0.00 0.02 0.00 -0.06 0.00 0.00 31.44 31.42 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 -0.65 0.00 -3.20 6.31 0.24 -1.26 -5.05 118.33 114.72 1uqv n VAL 50 Ca 0.00 -0.52 -0.01 0.00 -2.04 0.00 0.00 64.34 61.77 1uqv n VAL 50 Cb 0.00 -0.94 0.00 0.00 -1.47 0.00 0.00 33.84 31.43 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 -1.39 1.15 -1.99 7.34 0.28 -1.26 -4.55 120.64 120.23 1uqv n GLU 51 Ca 0.05 -0.22 -0.41 0.00 -0.16 0.00 0.00 57.16 56.41 1uqv n GLU 51 Cb 0.17 -0.00 -0.01 0.00 1.43 0.00 0.00 31.44 33.02 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 -0.89 2.71 0.00 3.44 1.02 -1.26 -3.85 120.64 121.80 1uqv n GLU 52 Ca 0.01 -2.74 0.00 0.00 -0.02 0.00 0.00 57.16 54.41 1uqv n GLU 52 Cb 0.04 -3.36 0.00 0.00 -0.02 0.00 0.00 31.44 28.11 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 5.89 0.00 -2.51 2.62 -2.24 -1.26 -5.10 114.28 111.67 1uqv n THR 53 Ca 0.50 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.90 1uqv n THR 53 Cb 0.42 -0.32 -0.04 0.00 -2.10 0.00 0.00 70.33 68.29 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 -4.10 7.04 0.00 3.42 2.15 -1.25 -4.90 116.67 119.03 1uqv s ASP 54 Ca 0.00 2.16 0.01 0.00 0.43 0.00 0.00 52.55 55.15 1uqv s ASP 54 Cb 0.00 -2.61 0.05 0.00 -0.30 0.00 0.00 42.92 40.06 1uqv s ASP 54 CO 0.00 -0.30 0.53 -2.65 -0.17 0.00 0.00 175.17 172.59 1uqv n PRO 55 N 0.63 0.03 -0.34 4.34 -0.02 -1.26 -3.37 135.00 135.00 1uqv n PRO 55 Ca 0.02 0.00 0.22 0.00 -2.02 0.00 0.00 63.50 61.71 1uqv n PRO 55 Cb 0.47 -1.49 0.47 0.00 -0.02 0.00 0.00 33.50 32.93 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 0.52 -0.72 2.45 6.46 -1.90 0.27 115.31 122.39 1uqv h LEU 56 Ca 0.00 0.11 -0.11 0.00 -0.12 0.00 0.00 57.88 57.76 1uqv h LEU 56 Cb 0.00 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 39.94 1uqv h LEU 56 CO 0.00 0.07 -0.17 0.00 -0.62 0.00 0.00 178.44 177.72 1uqv h GLN 58 N 0.71 0.78 -0.80 0.00 4.20 -0.80 -0.09 115.11 119.11 1uqv h GLN 58 Ca 0.11 -0.42 -0.02 0.00 0.06 0.00 0.00 58.65 58.38 1uqv h GLN 58 Cb 0.68 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.44 1uqv h GLN 58 CO 0.05 1.05 0.41 0.00 -0.67 0.00 0.00 178.83 179.67 1uqv h ARG 59 N 0.55 1.13 0.00 1.46 2.47 -1.13 -1.55 114.38 117.30 1uqv h ARG 59 Ca 0.05 -0.14 -0.11 0.00 -1.26 0.00 0.00 59.98 58.51 1uqv h ARG 59 Cb 0.91 -0.22 -0.02 0.00 -1.65 0.00 0.00 29.97 29.00 1uqv h ARG 59 CO 0.08 0.85 -0.56 1.25 0.56 0.00 0.00 179.97 182.15 1uqv h LEU 60 N 1.13 0.00 -0.08 3.04 5.85 -1.40 -3.28 115.31 120.56 1uqv h LEU 60 Ca 0.28 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.97 1uqv h LEU 60 Cb 0.07 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 1uqv h LEU 60 CO -0.04 0.53 -0.08 -0.09 -0.34 0.00 0.00 178.44 178.42 1uqv h ARG 61 N 0.00 0.20 -0.30 1.25 2.43 -0.43 -3.25 114.38 114.29 1uqv h ARG 61 Ca -0.01 -0.10 0.06 0.00 -0.81 0.00 0.00 59.98 59.12 1uqv h ARG 61 Cb 1.41 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.91 1uqv h ARG 61 CO 0.07 0.62 -0.08 0.93 -1.51 0.00 0.00 179.97 180.00 1uqv h GLU 62 N -0.22 -0.00 -6.06 0.20 5.08 -1.40 -3.30 114.58 108.87 1uqv h GLU 62 Ca 0.01 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.81 1uqv h GLU 62 Cb 0.58 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.74 1uqv h GLU 62 CO 0.02 -0.00 1.41 -0.80 -1.00 0.00 0.00 179.01 178.64 1uqv s ASN 63 N -5.21 6.34 -0.78 1.42 0.01 -1.23 -4.91 114.94 110.58 1uqv s ASN 63 Ca -0.14 -1.36 -0.24 0.00 -0.71 0.00 0.00 52.86 50.41 1uqv s ASN 63 Cb 0.12 -2.57 -0.17 0.00 0.41 0.00 0.00 41.25 39.04 1uqv s ASN 63 CO 0.70 -1.66 2.44 -0.67 -1.51 0.00 0.00 177.10 176.40 1uqv n ASP 64 N 9.51 1.04 -3.85 -1.22 -0.08 -1.25 -4.87 116.55 115.84 1uqv n ASP 64 Ca 0.34 -0.61 -0.30 0.00 -1.51 0.00 0.00 54.79 52.71 1uqv n ASP 64 Cb 0.50 -1.27 -0.15 0.00 2.34 0.00 0.00 41.12 42.55 1uqv n ASP 64 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1uqv s ILE 65 N 10.02 1.26 1.10 5.18 -1.09 -1.26 -5.12 121.20 131.28 1uqv s ILE 65 Ca 1.12 -1.32 -0.16 0.00 -2.23 0.00 0.00 60.65 58.05 1uqv s ILE 65 Cb -0.54 -1.75 0.24 0.00 -1.58 0.00 0.00 42.46 38.83 1uqv s ILE 65 CO 0.32 -0.37 1.12 0.68 -1.23 0.00 0.00 174.94 175.47 1uqv s VAL 66 N 1.47 1.80 -0.26 2.92 -7.23 -1.26 -4.76 120.40 113.08 1uqv s VAL 66 Ca 0.02 0.00 0.28 0.00 -1.81 0.00 0.00 61.98 60.47 1uqv s VAL 66 Cb -0.18 -2.56 0.32 0.00 0.56 0.00 0.00 36.38 34.52 1uqv s VAL 66 CO -0.13 0.00 1.83 1.23 -0.31 0.00 0.00 175.10 177.72 1uqv h GLY 67 N -2.20 0.00 1.65 2.32 0.00 -1.77 -2.49 103.07 100.57 1uqv h GLY 67 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1uqv h GLY 67 CO 0.45 0.00 0.00 1.34 0.00 0.00 0.00 176.54 178.33 1uqv n ASP 68 N -2.67 0.00 -0.00 0.19 2.03 -1.26 -2.72 116.55 112.12 1uqv n ASP 68 Ca 0.02 0.02 0.08 0.00 0.52 0.00 0.00 54.79 55.43 1uqv n ASP 68 Cb 0.30 -0.32 -0.11 0.00 -0.72 0.00 0.00 41.12 40.27 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 -1.32 0.49 0.04 -2.67 4.32 -0.94 -4.35 117.00 112.56 1uqv n LEU 69 Ca 0.11 -0.30 -0.11 0.00 -0.02 0.00 0.00 56.01 55.68 1uqv n LEU 69 Cb 0.22 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 41.96 1uqv n LEU 69 CO 0.20 0.12 0.84 -0.07 -1.22 0.00 0.00 177.39 177.27 1uqv h LEU 70 N 0.00 -0.11 -0.26 2.23 3.38 -1.57 -2.29 115.31 116.69 1uqv h LEU 70 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1uqv h LEU 70 Cb 0.56 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1uqv h LEU 70 CO 0.00 -0.06 -0.03 -0.81 0.09 0.00 0.00 178.44 177.63 1uqv n PRO 71 N -5.15 1.00 -0.54 1.13 -0.04 -1.26 -3.45 135.00 126.69 1uqv n PRO 71 Ca -0.06 -0.26 0.08 0.00 -0.04 0.00 0.00 63.50 63.22 1uqv n PRO 71 Cb 0.08 -1.49 0.29 0.00 -0.04 0.00 0.00 33.50 32.34 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 -0.77 3.44 -4.23 0.54 -0.58 -0.89 -4.98 120.64 113.17 1uqv n GLU 72 Ca 0.20 -2.84 -0.14 0.00 -0.42 0.00 0.00 57.16 53.95 1uqv n GLU 72 Cb 0.22 -1.89 -0.10 0.00 -0.57 0.00 0.00 31.44 29.09 1uqv n GLU 72 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1uqv s LEU 73 N -2.55 2.50 0.68 -4.62 1.43 -1.06 -5.01 118.68 110.05 1uqv s LEU 73 Ca 0.44 -0.97 -0.09 0.00 -1.03 0.00 0.00 54.13 52.48 1uqv s LEU 73 Cb 0.34 -0.31 0.03 0.00 0.03 0.00 0.00 46.19 46.27 1uqv s LEU 73 CO 0.13 -0.33 1.03 0.00 0.23 0.00 0.00 176.35 177.40 1uqv h LEU 75 N -0.53 0.00 -0.93 0.00 5.85 -1.98 -2.39 115.31 115.34 1uqv h LEU 75 Ca -0.45 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.22 1uqv h LEU 75 Cb 1.27 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.27 1uqv h LEU 75 CO 0.62 0.15 0.19 1.56 -0.34 0.00 0.00 178.44 180.63 1uqv h GLN 76 N 0.00 0.98 -0.73 1.25 1.08 -1.99 -2.23 115.11 113.46 1uqv h GLN 76 Ca -0.00 -0.20 0.14 0.00 -1.45 0.00 0.00 58.65 57.14 1uqv h GLN 76 Cb 0.32 -0.15 -0.05 0.00 -0.05 0.00 0.00 27.48 27.55 1uqv h GLN 76 CO 0.02 0.84 0.49 0.22 -0.95 0.00 0.00 178.83 179.45 1uqv h ASP 77 N 0.94 0.39 -0.11 1.46 3.58 -1.81 -1.12 116.42 119.76 1uqv h ASP 77 Ca 0.21 0.02 -0.07 0.00 0.42 0.00 0.00 57.03 57.61 1uqv h ASP 77 Cb 0.28 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.27 1uqv h ASP 77 CO -0.01 0.21 -0.21 0.00 -2.88 0.00 0.00 179.24 176.35 1uqv h GLN 79 N -0.11 0.17 -0.33 0.00 4.15 -1.00 0.54 115.11 118.53 1uqv h GLN 79 Ca 0.00 -0.01 -0.13 0.00 0.77 0.00 0.00 58.65 59.29 1uqv h GLN 79 Cb 0.80 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.44 1uqv h GLN 79 CO 0.05 0.11 -0.29 0.22 -1.93 0.00 0.00 178.83 176.99 1uqv h ASP 80 N 0.18 0.83 0.26 -0.69 3.58 -1.33 -2.63 116.42 116.62 1uqv h ASP 80 Ca 0.49 -0.46 0.00 0.00 0.42 0.00 0.00 57.03 57.48 1uqv h ASP 80 Cb 1.62 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 42.43 1uqv h ASP 80 CO -0.10 1.12 0.00 -0.07 -2.88 0.00 0.00 179.24 177.30 1uqv h LEU 81 N 0.56 0.00 0.00 2.28 4.07 0.19 -3.43 115.31 118.98 1uqv h LEU 81 Ca 0.06 0.00 -0.40 0.00 0.08 0.00 0.00 57.88 57.61 1uqv h LEU 81 Cb 0.87 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.59 1uqv h LEU 81 CO 0.07 0.00 -0.14 0.00 -1.08 0.00 0.00 178.44 177.29 1uqv h ASP 83 N 0.32 0.00 0.00 0.00 3.32 -1.84 -3.47 116.42 114.75 1uqv h ASP 83 Ca -0.24 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.70 1uqv h ASP 83 Cb 0.95 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.50 1uqv h ASP 83 CO 0.36 0.05 0.00 0.61 -1.72 0.00 0.00 179.24 178.54 1uqv n GLY 84 N 1.27 -0.37 3.63 2.75 0.00 -1.26 -5.10 105.19 106.12 1uqv n GLY 84 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1uqv n GLY 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1uqv s ASP 85 N 0.00 6.45 0.02 1.61 1.01 -1.26 -4.90 116.67 119.60 1uqv s ASP 85 Ca 0.00 1.48 -0.22 0.00 0.71 0.00 0.00 52.55 54.52 1uqv s ASP 85 Cb 0.00 -2.53 -0.16 0.00 1.01 0.00 0.00 42.92 41.24 1uqv s ASP 85 CO 0.00 -1.22 1.35 0.25 0.21 0.00 0.00 175.17 175.76 1uqv h LEU 86 N 11.52 0.24 -0.87 1.23 5.85 -1.99 -3.10 115.31 128.19 1uqv h LEU 86 Ca -0.31 -0.45 0.18 0.00 0.84 0.00 0.00 57.88 58.14 1uqv h LEU 86 Cb 1.14 -0.07 -0.11 0.00 0.37 0.00 0.00 40.66 41.99 1uqv h LEU 86 CO 1.01 0.64 0.41 -1.13 -0.34 0.00 0.00 178.44 179.03 1uqv h ASN 87 N -0.16 0.43 -0.40 1.25 -0.73 -2.00 0.02 115.58 113.99 1uqv h ASN 87 Ca 0.02 0.12 0.05 0.00 1.87 0.00 0.00 56.30 58.36 1uqv h ASN 87 Cb 0.56 0.07 -0.05 0.00 0.27 0.00 0.00 38.32 39.17 1uqv h ASN 87 CO 0.02 0.11 0.14 0.50 -0.37 0.00 0.00 177.43 177.83 1uqv h LYS 88 N 0.51 0.29 0.00 6.67 1.63 -1.95 -1.08 116.57 122.64 1uqv h LYS 88 Ca 0.51 -0.02 -0.03 0.00 -0.85 0.00 0.00 60.65 60.26 1uqv h LYS 88 Cb 0.84 -0.07 -0.00 0.00 -0.60 0.00 0.00 32.23 32.40 1uqv h LYS 88 CO -0.44 0.19 -0.12 0.00 -3.45 0.00 0.00 179.45 175.63 1uqv h ALA 89 N 1.26 1.28 0.46 5.00 0.00 -0.95 -2.45 119.26 123.87 1uqv h ALA 89 Ca 0.19 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1uqv h ALA 89 Cb 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1uqv h ALA 89 CO -0.19 0.15 -0.22 0.82 0.00 0.00 0.00 179.25 179.81 1uqv h ILE 90 N 0.00 0.36 -0.29 0.00 2.04 -0.40 -2.21 117.51 117.01 1uqv h ILE 90 Ca -0.00 -0.51 0.08 0.00 1.00 0.00 0.00 64.86 65.43 1uqv h ILE 90 Cb 0.35 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 1uqv h ILE 90 CO 0.02 0.06 0.21 0.11 0.00 0.00 0.00 178.15 178.55 1uqv h LYS 91 N -0.99 0.03 0.44 2.37 1.79 -1.37 -1.20 116.57 117.64 1uqv h LYS 91 Ca -0.06 -0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.38 1uqv h LYS 91 Cb 0.58 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.23 1uqv h LYS 91 CO 0.10 0.02 -0.21 0.35 -1.08 0.00 0.00 179.45 178.63 1uqv h PHE 92 N 0.03 -0.55 -0.11 -1.35 3.57 -1.32 -1.98 116.94 115.24 1uqv h PHE 92 Ca 0.14 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.66 1uqv h PHE 92 Cb 0.52 0.18 -0.00 0.00 2.79 0.00 0.00 35.95 39.43 1uqv h PHE 92 CO -0.00 -0.34 0.15 -0.22 -2.23 0.00 0.00 178.31 175.67 1uqv h LYS 93 N -0.63 0.00 0.18 1.11 3.64 -1.13 -2.65 116.57 117.08 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 0.45 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 1uqv h LYS 93 CO 0.10 0.00 -0.08 0.82 -2.27 0.00 0.00 179.45 178.01 1uqv h ILE 94 N 0.00 0.00 -0.74 2.00 2.04 -1.03 -1.11 117.51 118.67 1uqv h ILE 94 Ca 0.05 -0.11 0.21 0.00 1.00 0.00 0.00 64.86 66.02 1uqv h ILE 94 Cb 0.35 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.40 1uqv h ILE 94 CO -0.00 0.00 0.67 -0.07 0.00 0.00 0.00 178.15 178.75 1uqv h LEU 95 N -0.34 0.00 -0.07 1.44 3.38 -1.20 0.46 115.31 118.97 1uqv h LEU 95 Ca -0.02 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.70 1uqv h LEU 95 Cb 0.18 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.95 1uqv h LEU 95 CO 0.04 0.00 -0.96 0.40 0.09 0.00 0.00 178.44 178.01 1uqv h ILE 96 N 0.00 1.29 0.45 1.22 2.04 -1.43 -2.58 117.51 118.50 1uqv h ILE 96 Ca 0.35 -2.19 -0.02 0.00 1.00 0.00 0.00 64.86 64.00 1uqv h ILE 96 Cb 1.68 2.27 0.00 0.00 -0.74 0.00 0.00 36.82 40.04 1uqv h ILE 96 CO -0.00 0.68 -0.21 -1.13 0.00 0.00 0.00 178.15 177.48 1uqv h ASN 97 N 0.42 -0.51 -0.53 1.72 -0.00 0.12 0.14 115.58 116.94 1uqv h ASN 97 Ca -0.10 -0.02 0.03 0.00 -0.00 0.00 0.00 56.30 56.20 1uqv h ASN 97 Cb 1.60 0.13 -0.04 0.00 -0.00 0.00 0.00 38.32 40.02 1uqv h ASN 97 CO 0.19 -0.30 0.31 0.11 -0.00 0.00 0.00 177.43 177.73 1uqv h LYS 98 N -0.68 0.59 -0.23 6.67 6.56 -1.52 -1.62 116.57 126.33 1uqv h LYS 98 Ca -0.06 -0.04 -0.05 0.00 -1.06 0.00 0.00 60.65 59.45 1uqv h LYS 98 Cb 0.50 -0.13 -0.01 0.00 -0.57 0.00 0.00 32.23 32.02 1uqv h LYS 98 CO 0.10 0.39 -0.06 1.98 -2.06 0.00 0.00 179.45 179.80 1uqv h MET 99 N 0.60 0.35 -0.23 3.15 4.05 -1.36 -2.26 114.93 119.23 1uqv h MET 99 Ca 0.22 -0.07 -0.10 0.00 -0.28 0.00 0.00 59.70 59.47 1uqv h MET 99 Cb 0.06 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.79 1uqv h MET 99 CO -0.11 0.43 -0.29 -0.09 0.23 0.00 0.00 176.91 177.07 1uqv h ARG 100 N 0.34 0.47 0.00 0.39 9.65 0.21 -3.35 114.38 122.07 1uqv h ARG 100 Ca 0.07 -0.19 0.00 0.00 -1.10 0.00 0.00 59.98 58.76 1uqv h ARG 100 Cb 0.33 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.89 1uqv h ARG 100 CO 0.01 0.71 0.00 -3.47 2.80 0.00 0.00 179.97 180.03 1uqv n ASP 101 N -4.10 0.00 0.00 -3.80 2.03 -0.82 -5.06 116.55 104.80 1uqv n ASP 101 Ca -0.01 0.45 0.00 0.00 0.52 0.00 0.00 54.79 55.75 1uqv n ASP 101 Cb 0.43 -0.37 0.00 0.00 -0.72 0.00 0.00 41.12 40.46 1uqv n ASP 101 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1uqv n SER 102 N -1.61 0.00 -1.50 1.67 2.88 -0.89 -5.12 113.62 109.04 1uqv n SER 102 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1uqv n SER 102 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1uqv n SER 102 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1uqv n LYS 103 N -0.37 -4.30 0.00 -1.46 5.02 -1.26 -4.85 118.16 110.94 1uqv n LYS 103 Ca 0.00 3.20 0.00 0.00 -2.02 0.00 0.00 58.31 59.49 1uqv n LYS 103 Cb 0.00 -3.59 0.00 0.00 -0.02 0.00 0.00 35.03 31.42 1uqv n LYS 103 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1uqv n LEU 104 N -0.78 0.00 -2.73 -0.35 7.99 -1.26 -4.52 117.00 115.34 1uqv n LEU 104 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 56.01 55.91 1uqv n LEU 104 Cb 0.00 -0.19 0.08 0.00 -0.11 0.00 0.00 43.42 43.20 1uqv n LEU 104 CO 0.00 -0.20 0.31 -1.84 -1.51 0.00 0.00 177.39 174.16 1uqv n GLU 105 N -1.89 0.95 -0.19 3.23 0.28 -1.26 -4.96 120.64 116.80 1uqv n GLU 105 Ca 0.00 -1.86 0.06 0.00 -0.16 0.00 0.00 57.16 55.20 1uqv n GLU 105 Cb 0.00 -1.12 0.15 0.00 1.43 0.00 0.00 31.44 31.91 1uqv n GLU 105 CO 0.00 0.00 0.00 0.91 -0.16 0.00 0.00 177.13 177.88 1uqv n TRP 106 N 0.67 0.48 -3.62 -1.84 8.01 -1.26 -4.85 117.44 115.02 1uqv n TRP 106 Ca 0.07 -0.54 -0.29 0.00 -1.31 0.00 0.00 57.50 55.42 1uqv n TRP 106 Cb 0.68 -0.06 -0.15 0.00 -2.01 0.00 0.00 31.31 29.78 1uqv n TRP 106 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.69 176.83 1uqv s LYS 107 N -1.19 0.51 0.00 -0.99 1.02 -1.26 -5.26 119.74 112.57 1uqv s LYS 107 Ca 0.24 -0.93 0.00 0.00 0.02 0.00 0.00 55.97 55.29 1uqv s LYS 107 Cb 0.14 -1.60 0.00 0.00 -0.52 0.00 0.00 37.83 35.85 1uqv s LYS 107 CO 0.14 -1.03 0.09 -3.47 -0.92 0.00 0.00 175.35 170.16