#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 0.43 -4.60 1.61 3.41 -1.26 -5.05 113.62 108.16 1uqv n SER 25 Ca 0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.18 1uqv n SER 25 Cb 0.00 0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.00 1uqv n SER 25 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1uqv s HIS 26 N -0.30 1.37 0.01 7.33 2.46 -1.26 -4.67 115.29 120.24 1uqv s HIS 26 Ca 0.00 0.59 0.00 0.00 0.47 0.00 0.00 55.06 56.12 1uqv s HIS 26 Cb 0.00 -3.99 0.00 0.00 -0.13 0.00 0.00 32.58 28.46 1uqv s HIS 26 CO 0.00 -3.69 0.00 -0.12 -2.47 0.00 0.00 174.74 168.46 1uqv n MET 27 N 8.66 0.00 0.00 2.88 0.00 -1.26 -5.09 117.12 122.32 1uqv n MET 27 Ca 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.98 1uqv n MET 27 Cb 0.46 -0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.68 1uqv n MET 27 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1uqv n ASN 28 N -2.55 0.02 -1.00 6.12 5.03 -1.26 -5.15 115.26 116.47 1uqv n ASN 28 Ca 0.00 0.01 0.03 0.00 0.87 0.00 0.00 54.58 55.49 1uqv n ASN 28 Cb 0.00 -0.00 -0.01 0.00 -1.02 0.00 0.00 39.78 38.75 1uqv n ASN 28 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1uqv n ASN 29 N -2.54 -6.01 0.00 6.41 3.02 -1.26 -4.58 115.26 110.31 1uqv n ASN 29 Ca 0.00 0.27 0.00 0.00 -0.03 0.00 0.00 54.58 54.82 1uqv n ASN 29 Cb 0.00 -0.78 0.00 0.00 -0.61 0.00 0.00 39.78 38.39 1uqv n ASN 29 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1uqv n GLU 30 N -2.25 0.35 -2.23 3.52 -0.58 -1.26 -5.09 120.64 113.10 1uqv n GLU 30 Ca 0.00 -0.80 0.00 0.00 -0.42 0.00 0.00 57.16 55.94 1uqv n GLU 30 Cb 0.12 -0.97 0.00 0.00 -0.57 0.00 0.00 31.44 30.02 1uqv n GLU 30 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1uqv n ASP 31 N -0.16 -8.93 0.17 1.62 9.92 -1.26 -4.34 116.55 113.57 1uqv n ASP 31 Ca 0.00 1.70 0.19 0.00 -0.53 0.00 0.00 54.79 56.15 1uqv n ASP 31 Cb 0.10 -4.85 0.78 0.00 -0.64 0.00 0.00 41.12 36.52 1uqv n ASP 31 CO 0.00 0.00 0.00 -0.26 0.13 0.00 0.00 177.20 177.07 1uqv h PHE 32 N 3.88 0.00 0.00 1.24 -1.00 -1.97 0.20 116.94 119.30 1uqv h PHE 32 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1uqv h PHE 32 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 1uqv h PHE 32 CO 0.00 0.00 0.00 -1.13 -1.61 0.00 0.00 178.31 175.57 1uqv n SER 33 N -3.53 0.73 -0.00 2.17 3.41 -1.26 -3.02 113.62 112.11 1uqv n SER 33 Ca 0.04 0.63 0.08 0.00 -0.26 0.00 0.00 58.87 59.36 1uqv n SER 33 Cb 0.51 -0.80 -0.10 0.00 -0.26 0.00 0.00 64.21 63.55 1uqv n SER 33 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1uqv n GLN 34 N -2.25 1.24 -1.95 4.33 1.13 0.71 -4.96 117.38 115.62 1uqv n GLN 34 Ca 0.04 -0.05 -0.42 0.00 -1.94 0.00 0.00 57.00 54.63 1uqv n GLN 34 Cb 0.31 -1.32 -0.03 0.00 0.11 0.00 0.00 30.24 29.32 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 -2.74 2.38 0.04 1.08 0.52 -1.15 -4.99 118.94 114.07 1uqv s TRP 35 Ca 0.03 0.33 0.00 0.00 0.02 0.00 0.00 56.10 56.47 1uqv s TRP 35 Cb 0.12 -3.94 0.00 0.00 -1.15 0.00 0.00 33.47 28.50 1uqv s TRP 35 CO 0.69 -3.79 0.02 0.43 0.02 0.00 0.00 176.95 174.31 1uqv n SER 36 N 5.81 1.58 0.47 2.95 7.64 -1.26 -4.36 113.62 126.45 1uqv n SER 36 Ca 0.16 -1.15 -0.18 0.00 1.01 0.00 0.00 58.87 58.70 1uqv n SER 36 Cb 0.41 0.01 -0.09 0.00 -1.01 0.00 0.00 64.21 63.53 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 0.74 0.00 -0.53 0.44 2.07 -1.94 -1.95 116.25 115.08 1uqv h VAL 37 Ca -0.03 -0.07 0.10 0.00 0.82 0.00 0.00 66.70 67.53 1uqv h VAL 37 Cb 0.09 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.83 1uqv h VAL 37 CO 0.05 0.00 0.36 -2.24 0.02 0.00 0.00 177.57 175.76 1uqv h ASP 38 N -1.27 0.25 0.49 0.57 2.03 -1.99 -1.21 116.42 115.30 1uqv h ASP 38 Ca -0.12 0.01 -0.02 0.00 -0.73 0.00 0.00 57.03 56.16 1uqv h ASP 38 Cb 0.92 -0.05 0.00 0.00 -0.83 0.00 0.00 39.33 39.38 1uqv h ASP 38 CO 0.20 0.15 -0.24 0.44 -1.03 0.00 0.00 179.24 178.77 1uqv h ASP 39 N 0.28 -0.56 -0.01 4.15 3.32 -1.92 -1.90 116.42 119.79 1uqv h ASP 39 Ca 0.25 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 1uqv h ASP 39 Cb 0.60 0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.29 1uqv h ASP 39 CO -0.05 -0.21 0.00 0.58 -1.72 0.00 0.00 179.24 177.84 1uqv h VAL 40 N -0.94 1.06 0.50 -1.35 2.07 -1.04 -2.71 116.25 113.84 1uqv h VAL 40 Ca -0.07 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1uqv h VAL 40 Cb 0.60 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 1uqv h VAL 40 CO 0.11 0.05 -0.35 0.40 0.02 0.00 0.00 177.57 177.80 1uqv h ILE 41 N -0.07 0.00 -0.41 4.57 2.04 -1.31 0.12 117.51 122.45 1uqv h ILE 41 Ca 0.00 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 1uqv h ILE 41 Cb 0.07 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.07 1uqv h ILE 41 CO -0.00 0.00 -0.55 0.74 0.00 0.00 0.00 178.15 178.34 1uqv h THR 42 N -0.81 0.01 -0.63 -0.27 2.02 -1.41 -0.01 112.91 111.82 1uqv h THR 42 Ca -0.07 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.16 1uqv h THR 42 Cb 0.66 0.01 -0.05 0.00 -1.74 0.00 0.00 68.15 67.03 1uqv h THR 42 CO 0.04 0.00 0.35 -0.25 0.37 0.00 0.00 175.52 176.03 1uqv h TRP 43 N -0.39 0.64 0.25 3.16 7.01 -1.51 -1.59 115.95 123.53 1uqv h TRP 43 Ca 0.08 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.09 1uqv h TRP 43 Cb 0.60 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 27.45 1uqv h TRP 43 CO -0.72 0.32 -0.20 0.00 -2.79 0.00 0.00 178.44 175.05 1uqv h ILE 45 N -0.44 0.26 0.00 0.00 2.04 -1.01 0.90 117.51 119.26 1uqv h ILE 45 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1uqv h ILE 45 Cb 0.37 0.26 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 1uqv h ILE 45 CO 0.00 0.00 0.12 -1.54 0.00 0.00 0.00 178.15 176.73 1uqv n SER 46 N -5.41 0.26 0.00 1.72 3.41 -0.60 -1.26 113.62 111.73 1uqv n SER 46 Ca -0.03 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.13 1uqv n SER 46 Cb 0.33 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.72 1uqv n SER 46 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1uqv n THR 47 N -1.83 0.00 -0.01 6.66 -2.24 -0.04 -4.89 114.28 111.92 1uqv n THR 47 Ca -0.01 -0.34 -0.01 0.00 -2.27 0.00 0.00 64.05 61.42 1uqv n THR 47 Cb 0.14 1.28 -0.00 0.00 -2.10 0.00 0.00 70.33 69.64 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 -0.07 0.22 0.04 3.22 0.00 0.29 -5.04 117.00 115.66 1uqv n LEU 48 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 56.01 56.22 1uqv n LEU 48 Cb 0.07 -0.54 0.00 0.00 0.00 0.00 0.00 43.42 42.95 1uqv n LEU 48 CO 0.00 -0.49 0.00 1.21 0.00 0.00 0.00 177.39 178.11 1uqv n GLU 49 N -2.60 0.00 -0.94 1.96 4.07 -1.19 -5.03 120.64 116.92 1uqv n GLU 49 Ca -0.01 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.09 1uqv n GLU 49 Cb 0.04 0.00 0.00 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 -2.73 0.00 -3.20 6.31 0.24 -1.26 -5.02 118.33 112.68 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 -0.89 0.02 0.00 -1.47 0.00 0.00 33.84 31.50 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 -0.75 0.90 -1.90 7.34 0.28 -1.26 -3.71 120.64 121.54 1uqv n GLU 51 Ca 0.00 -1.47 -0.41 0.00 -0.16 0.00 0.00 57.16 55.12 1uqv n GLU 51 Cb 0.00 -0.03 -0.02 0.00 1.43 0.00 0.00 31.44 32.82 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 -1.44 2.51 0.00 3.44 1.02 -1.26 -3.81 120.64 121.10 1uqv n GLU 52 Ca 0.05 -2.62 0.00 0.00 -0.02 0.00 0.00 57.16 54.57 1uqv n GLU 52 Cb 0.28 -3.33 0.00 0.00 -0.02 0.00 0.00 31.44 28.37 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 6.01 0.00 -1.90 2.62 -2.24 -1.26 -5.11 114.28 112.40 1uqv n THR 53 Ca 0.50 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.90 1uqv n THR 53 Cb 0.42 -0.42 0.03 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 -4.57 5.53 0.00 3.42 2.15 -1.25 -4.84 116.67 117.12 1uqv s ASP 54 Ca 0.00 2.66 0.00 0.00 0.43 0.00 0.00 52.55 55.64 1uqv s ASP 54 Cb 0.00 -2.63 0.00 0.00 -0.30 0.00 0.00 42.92 39.99 1uqv s ASP 54 CO 0.00 -1.39 0.57 -0.81 -0.17 0.00 0.00 175.17 173.37 1uqv n PRO 55 N -0.84 0.00 -0.21 4.34 -0.04 -1.26 -2.65 135.00 134.34 1uqv n PRO 55 Ca 0.09 0.16 0.29 0.00 -0.04 0.00 0.00 63.50 64.00 1uqv n PRO 55 Cb 0.46 -1.58 0.71 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 0.03 -0.33 1.53 5.85 -1.95 0.21 115.31 120.65 1uqv h LEU 56 Ca 0.00 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.57 1uqv h LEU 56 Cb 0.15 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 1uqv h LEU 56 CO 0.00 0.01 -0.38 0.00 -0.34 0.00 0.00 178.44 177.73 1uqv h GLN 58 N 0.62 0.63 0.45 0.00 4.15 -0.86 -0.48 115.11 119.62 1uqv h GLN 58 Ca 0.04 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.38 1uqv h GLN 58 Cb 0.98 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.53 1uqv h GLN 58 CO 0.09 0.49 -0.31 0.00 -1.93 0.00 0.00 178.83 177.17 1uqv h ARG 59 N 0.60 -0.72 -0.13 1.69 -0.00 -1.43 -0.81 114.38 113.58 1uqv h ARG 59 Ca 0.16 0.05 0.00 0.00 -0.50 0.00 0.00 59.98 59.69 1uqv h ARG 59 Cb 0.04 0.16 -0.01 0.00 0.00 0.00 0.00 29.97 30.17 1uqv h ARG 59 CO -0.03 -0.48 0.09 -0.07 0.00 0.00 0.00 179.97 179.48 1uqv h LEU 60 N -0.75 0.14 -0.57 3.04 3.38 -1.44 -1.99 115.31 117.13 1uqv h LEU 60 Ca -0.05 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 1uqv h LEU 60 Cb 0.63 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1uqv h LEU 60 CO 0.02 0.10 -0.30 -0.09 0.09 0.00 0.00 178.44 178.27 1uqv h ARG 61 N 0.17 0.82 0.47 1.13 2.43 -0.53 -3.30 114.38 115.58 1uqv h ARG 61 Ca 0.05 -0.38 -0.02 0.00 -0.81 0.00 0.00 59.98 58.82 1uqv h ARG 61 Cb -0.01 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1uqv h ARG 61 CO -0.01 1.01 -0.34 0.93 -1.51 0.00 0.00 179.97 180.05 1uqv h GLU 62 N 0.70 -0.75 -5.91 0.20 4.39 -0.38 -3.33 114.58 109.50 1uqv h GLU 62 Ca 0.08 0.05 -0.48 0.00 0.34 0.00 0.00 59.36 59.35 1uqv h GLU 62 Cb 0.85 0.17 -0.08 0.00 -0.10 0.00 0.00 28.75 29.59 1uqv h GLU 62 CO 0.07 -0.50 1.24 -0.80 -1.16 0.00 0.00 179.01 177.86 1uqv s ASN 63 N -3.55 5.94 -0.38 1.42 0.02 -1.19 -4.92 114.94 112.28 1uqv s ASN 63 Ca -0.13 -1.23 -0.28 0.00 -1.02 0.00 0.00 52.86 50.20 1uqv s ASN 63 Cb 0.02 -2.57 -0.07 0.00 0.02 0.00 0.00 41.25 38.66 1uqv s ASN 63 CO 0.41 -2.03 2.33 -0.90 0.02 0.00 0.00 177.10 176.93 1uqv n ASP 64 N 11.03 2.63 -4.03 -1.22 5.75 -1.25 -4.92 116.55 124.54 1uqv n ASP 64 Ca 0.37 -0.12 -0.27 0.00 -0.01 0.00 0.00 54.79 54.76 1uqv n ASP 64 Cb 0.49 -1.53 -0.17 0.00 -1.03 0.00 0.00 41.12 38.88 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 10.14 1.31 0.64 2.12 -1.09 -1.26 -5.14 121.20 127.92 1uqv s ILE 65 Ca 1.01 -0.55 -0.09 0.00 -2.23 0.00 0.00 60.65 58.79 1uqv s ILE 65 Cb -0.33 -1.21 -0.00 0.00 -1.58 0.00 0.00 42.46 39.34 1uqv s ILE 65 CO 0.32 0.40 1.01 0.54 -1.23 0.00 0.00 174.94 175.98 1uqv s VAL 66 N 0.89 3.89 0.59 2.92 0.11 -1.26 -4.80 120.40 122.74 1uqv s VAL 66 Ca -0.09 0.42 0.30 0.00 -2.93 0.00 0.00 61.98 59.67 1uqv s VAL 66 Cb -0.15 -3.58 0.36 0.00 -1.53 0.00 0.00 36.38 31.48 1uqv s VAL 66 CO 0.01 -0.71 2.26 1.23 -3.33 0.00 0.00 175.10 174.56 1uqv h GLY 67 N -0.40 0.00 2.00 6.54 0.00 -1.76 0.01 103.07 109.46 1uqv h GLY 67 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1uqv h GLY 67 CO 0.62 0.00 0.00 -1.80 0.00 0.00 0.00 176.54 175.36 1uqv h ASP 68 N 0.00 0.00 -0.02 0.19 3.58 -1.93 -3.07 116.42 115.17 1uqv h ASP 68 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1uqv h ASP 68 Cb 0.01 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.06 1uqv h ASP 68 CO -0.00 0.00 -0.01 0.18 -2.88 0.00 0.00 179.24 176.53 1uqv n LEU 69 N -2.70 2.59 0.10 2.28 4.32 -0.05 -4.54 117.00 119.00 1uqv n LEU 69 Ca 0.04 -0.99 -0.13 0.00 -0.02 0.00 0.00 56.01 54.90 1uqv n LEU 69 Cb 0.41 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 42.14 1uqv n LEU 69 CO 0.30 0.45 0.81 -0.07 -1.22 0.00 0.00 177.39 177.66 1uqv h LEU 70 N 3.74 -0.15 0.00 2.23 3.38 -1.36 -1.85 115.31 121.30 1uqv h LEU 70 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1uqv h LEU 70 Cb 0.80 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1uqv h LEU 70 CO 0.00 -0.08 0.00 -2.65 0.09 0.00 0.00 178.44 175.80 1uqv n PRO 71 N -5.15 0.06 0.07 1.13 -0.02 -1.26 -1.71 135.00 128.11 1uqv n PRO 71 Ca -0.08 0.27 0.08 0.00 -2.02 0.00 0.00 63.50 61.75 1uqv n PRO 71 Cb 0.11 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.04 1uqv n PRO 71 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1uqv n GLU 72 N -1.41 0.62 0.01 -0.52 -0.58 -0.74 -4.26 120.64 113.75 1uqv n GLU 72 Ca 0.03 0.10 -0.12 0.00 -0.42 0.00 0.00 57.16 56.76 1uqv n GLU 72 Cb 0.10 -1.78 -0.06 0.00 -0.57 0.00 0.00 31.44 29.13 1uqv n GLU 72 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1uqv h LEU 73 N 0.00 0.07 -0.31 -4.62 3.38 -0.86 -3.47 115.31 109.49 1uqv h LEU 73 Ca -0.05 -0.05 0.32 0.00 0.09 0.00 0.00 57.88 58.19 1uqv h LEU 73 Cb 1.16 -0.02 -0.11 0.00 0.09 0.00 0.00 40.66 41.78 1uqv h LEU 73 CO 0.01 0.09 -0.64 0.00 0.09 0.00 0.00 178.44 177.99 1uqv n LEU 75 N -3.90 0.21 0.07 0.00 7.99 -1.26 -1.28 117.00 118.82 1uqv n LEU 75 Ca -0.02 0.59 -0.04 0.00 -0.01 0.00 0.00 56.01 56.54 1uqv n LEU 75 Cb 0.56 -0.61 -0.02 0.00 -0.11 0.00 0.00 43.42 43.24 1uqv n LEU 75 CO 0.02 -0.64 0.13 -0.61 -1.51 0.00 0.00 177.39 174.78 1uqv h GLN 76 N 0.00 -0.24 -0.27 3.23 5.75 -1.97 -2.51 115.11 119.10 1uqv h GLN 76 Ca 0.00 0.02 -0.11 0.00 -0.15 0.00 0.00 58.65 58.41 1uqv h GLN 76 Cb 0.02 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.62 1uqv h GLN 76 CO 0.00 -0.16 -0.30 -0.44 -2.65 0.00 0.00 178.83 175.28 1uqv h ASP 77 N -0.80 0.56 0.44 -0.69 5.19 -1.09 -2.09 116.42 117.95 1uqv h ASP 77 Ca -0.03 -0.21 -0.02 0.00 -0.62 0.00 0.00 57.03 56.15 1uqv h ASP 77 Cb 0.19 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 39.55 1uqv h ASP 77 CO 0.04 0.84 -0.21 0.00 -3.12 0.00 0.00 179.24 176.78 1uqv h GLN 79 N -0.66 0.04 -0.07 0.00 5.75 -1.44 -0.56 115.11 118.16 1uqv h GLN 79 Ca -0.06 -0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.34 1uqv h GLN 79 Cb 0.49 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.02 1uqv h GLN 79 CO 0.10 0.12 -0.38 0.22 -2.65 0.00 0.00 178.83 176.24 1uqv h ASP 80 N 0.04 0.16 0.79 -0.69 3.58 -0.94 -2.00 116.42 117.35 1uqv h ASP 80 Ca 0.01 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.40 1uqv h ASP 80 Cb 0.17 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.18 1uqv h ASP 80 CO 0.01 0.53 0.00 0.18 -2.88 0.00 0.00 179.24 177.08 1uqv n LEU 81 N -4.06 0.50 -4.72 2.28 4.32 -0.19 -4.74 117.00 110.39 1uqv n LEU 81 Ca -0.01 0.61 -0.23 0.00 -0.02 0.00 0.00 56.01 56.35 1uqv n LEU 81 Cb 0.44 -0.52 -0.06 0.00 -1.62 0.00 0.00 43.42 41.66 1uqv n LEU 81 CO 0.40 -0.41 -0.27 0.00 -1.22 0.00 0.00 177.39 175.90 1uqv h ASP 83 N 1.92 0.00 0.00 0.00 3.04 -1.85 -3.43 116.42 116.10 1uqv h ASP 83 Ca -0.46 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.33 1uqv h ASP 83 Cb 1.23 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.52 1uqv h ASP 83 CO 0.60 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 178.41 1uqv n GLY 84 N -1.18 0.20 2.95 7.15 0.00 -1.26 -5.11 105.19 107.94 1uqv n GLY 84 Ca -0.03 -0.12 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 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 2.41 0.09 1.61 2.15 -1.26 -5.04 116.67 116.63 1uqv s ASP 85 Ca 0.00 -0.39 -0.33 0.00 0.43 0.00 0.00 52.55 52.25 1uqv s ASP 85 Cb 0.00 -0.97 -0.15 0.00 -0.30 0.00 0.00 42.92 41.50 1uqv s ASP 85 CO 0.00 -0.10 1.59 -0.07 -0.17 0.00 0.00 175.17 176.42 1uqv h LEU 86 N 8.13 -1.15 -1.54 -1.34 -0.00 -1.99 -2.17 115.31 115.25 1uqv h LEU 86 Ca -0.32 0.09 0.49 0.00 -0.00 0.00 0.00 57.88 58.14 1uqv h LEU 86 Cb 1.13 0.38 -0.12 0.00 -0.00 0.00 0.00 40.66 42.05 1uqv h LEU 86 CO 0.45 -0.59 1.01 0.78 -0.00 0.00 0.00 178.44 180.09 1uqv h ASN 87 N -0.88 0.16 0.36 -0.43 4.21 -1.98 0.26 115.58 117.27 1uqv h ASN 87 Ca -0.04 0.11 -0.02 0.00 1.21 0.00 0.00 56.30 57.56 1uqv h ASN 87 Cb 0.77 0.11 0.00 0.00 -1.12 0.00 0.00 38.32 38.09 1uqv h ASN 87 CO -0.05 -0.18 -0.17 0.50 -1.29 0.00 0.00 177.43 176.24 1uqv h LYS 88 N 0.02 -0.46 0.27 0.81 1.63 -1.83 -2.65 116.57 114.36 1uqv h LYS 88 Ca 0.88 0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 60.71 1uqv h LYS 88 Cb 3.00 0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 34.73 1uqv h LYS 88 CO -0.35 -0.31 -0.19 0.00 -3.45 0.00 0.00 179.45 175.16 1uqv h ALA 89 N -1.42 -0.44 -0.28 5.00 0.00 -0.87 0.03 119.26 121.28 1uqv h ALA 89 Ca -0.05 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 54.85 1uqv h ALA 89 Cb 0.37 0.24 -0.08 0.00 0.00 0.00 0.00 17.79 18.32 1uqv h ALA 89 CO 0.08 -0.76 -0.32 0.82 0.00 0.00 0.00 179.25 179.07 1uqv h ILE 90 N -0.46 0.27 -0.17 0.00 2.04 -0.72 0.64 117.51 119.11 1uqv h ILE 90 Ca -0.02 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.79 1uqv h ILE 90 Cb 0.39 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 1uqv h ILE 90 CO 0.01 0.00 -0.12 0.11 0.00 0.00 0.00 178.15 178.15 1uqv h LYS 91 N -0.31 0.27 0.49 2.37 1.79 -1.40 -2.44 116.57 117.34 1uqv h LYS 91 Ca 0.14 -0.06 -0.02 0.00 -2.18 0.00 0.00 60.65 58.52 1uqv h LYS 91 Cb 0.53 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 1uqv h LYS 91 CO -0.45 0.40 -0.24 0.35 -1.08 0.00 0.00 179.45 178.43 1uqv h PHE 92 N 0.26 -0.62 -0.94 -1.35 3.57 0.76 -2.12 116.94 116.50 1uqv h PHE 92 Ca 0.05 -0.01 0.18 0.00 3.53 0.00 0.00 57.97 61.72 1uqv h PHE 92 Cb 0.38 0.20 -0.08 0.00 2.79 0.00 0.00 35.95 39.24 1uqv h PHE 92 CO 0.01 -0.38 0.60 -0.22 -2.23 0.00 0.00 178.31 176.09 1uqv h LYS 93 N -0.76 0.62 0.79 1.11 1.63 -0.97 -2.53 116.57 116.47 1uqv h LYS 93 Ca -0.07 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.66 1uqv h LYS 93 Cb 0.51 -0.14 0.01 0.00 -0.60 0.00 0.00 32.23 32.01 1uqv h LYS 93 CO 0.11 0.41 -0.39 0.82 -3.45 0.00 0.00 179.45 176.96 1uqv h ILE 94 N 0.64 0.00 -1.19 2.00 2.04 -1.39 -2.40 117.51 117.21 1uqv h ILE 94 Ca 0.50 0.00 0.34 0.00 1.00 0.00 0.00 64.86 66.71 1uqv h ILE 94 Cb 0.92 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.94 1uqv h ILE 94 CO -0.26 0.00 0.84 -0.07 0.00 0.00 0.00 178.15 178.66 1uqv h LEU 95 N -1.07 0.10 -0.41 1.44 3.38 -0.98 0.49 115.31 118.26 1uqv h LEU 95 Ca -0.11 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 1uqv h LEU 95 Cb 0.82 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1uqv h LEU 95 CO 0.17 0.01 -0.11 0.40 0.09 0.00 0.00 178.44 179.00 1uqv h ILE 96 N 0.08 1.28 -0.72 1.22 2.04 -1.09 -2.38 117.51 117.95 1uqv h ILE 96 Ca 0.59 -1.21 0.03 0.00 1.00 0.00 0.00 64.86 65.27 1uqv h ILE 96 Cb 2.18 1.21 -0.04 0.00 -0.74 0.00 0.00 36.82 39.44 1uqv h ILE 96 CO -0.08 0.41 0.47 -1.13 0.00 0.00 0.00 178.15 177.82 1uqv h ASN 97 N 0.61 0.77 -0.49 1.72 -0.73 0.45 -1.41 115.58 116.50 1uqv h ASN 97 Ca 0.10 -0.01 -0.11 0.00 1.87 0.00 0.00 56.30 58.15 1uqv h ASN 97 Cb 0.64 -0.18 -0.01 0.00 0.27 0.00 0.00 38.32 39.03 1uqv h ASN 97 CO 0.04 0.54 -0.13 0.11 -0.37 0.00 0.00 177.43 177.62 1uqv h LYS 98 N 0.90 0.96 -0.01 6.67 6.56 -1.24 -2.14 116.57 128.26 1uqv h LYS 98 Ca 0.28 -0.37 -0.07 0.00 -1.06 0.00 0.00 60.65 59.43 1uqv h LYS 98 Cb 0.01 -0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 31.61 1uqv h LYS 98 CO -0.07 1.04 -0.33 1.98 -2.06 0.00 0.00 179.45 180.01 1uqv h MET 99 N 0.81 0.02 -0.02 3.15 4.05 -0.84 0.28 114.93 122.39 1uqv h MET 99 Ca 0.12 -0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.52 1uqv h MET 99 Cb 0.69 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.49 1uqv h MET 99 CO 0.05 0.34 -0.07 -0.09 0.23 0.00 0.00 176.91 177.38 1uqv h ARG 100 N 0.02 0.07 0.00 0.39 2.43 -1.07 -3.20 114.38 113.03 1uqv h ARG 100 Ca -0.00 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1uqv h ARG 100 Cb 0.59 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 1uqv h ARG 100 CO 0.04 0.71 0.00 0.22 -1.51 0.00 0.00 179.97 179.43 1uqv h ASP 101 N -0.55 0.00 -3.65 -3.80 3.58 -1.31 -3.50 116.42 107.19 1uqv h ASP 101 Ca -0.00 0.00 0.28 0.00 0.42 0.00 0.00 57.03 57.73 1uqv h ASP 101 Cb 0.72 0.00 -0.13 0.00 1.72 0.00 0.00 39.33 41.64 1uqv h ASP 101 CO 0.01 0.00 -0.86 -0.24 -2.88 0.00 0.00 179.24 175.28 1uqv n SER 102 N -2.34 -6.41 -3.17 2.28 2.88 0.98 -4.97 113.62 102.88 1uqv n SER 102 Ca 0.04 0.98 0.03 0.00 -1.33 0.00 0.00 58.87 58.59 1uqv n SER 102 Cb 0.38 -3.76 -0.01 0.00 -0.75 0.00 0.00 64.21 60.07 1uqv n SER 102 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1uqv s LYS 103 N -3.52 0.55 0.00 -1.46 2.20 -1.26 -4.91 119.74 111.34 1uqv s LYS 103 Ca 0.00 0.79 0.00 0.00 -0.36 0.00 0.00 55.97 56.40 1uqv s LYS 103 Cb 0.00 0.35 0.00 0.00 -1.51 0.00 0.00 37.83 36.67 1uqv s LYS 103 CO 0.00 -0.78 0.00 1.28 -0.36 0.00 0.00 175.35 175.49 1uqv n LEU 104 N 5.42 0.00 -2.97 5.43 4.77 -1.26 -5.05 117.00 123.34 1uqv n LEU 104 Ca 0.01 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 56.00 1uqv n LEU 104 Cb 0.52 -0.31 -0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1uqv n LEU 104 CO 0.00 -0.39 0.29 -0.70 -1.33 0.00 0.00 177.39 175.26 1uqv s GLU 105 N -0.77 0.49 -0.00 3.23 -6.30 -1.26 -5.00 118.70 109.08 1uqv s GLU 105 Ca 0.00 -0.17 0.01 0.00 -2.50 0.00 0.00 54.97 52.31 1uqv s GLU 105 Cb 0.00 0.06 0.01 0.00 0.00 0.00 0.00 34.13 34.19 1uqv s GLU 105 CO 0.00 -0.70 0.67 0.91 0.02 0.00 0.00 175.26 176.16 1uqv n TRP 106 N 3.99 0.00 -3.66 5.30 8.01 -1.26 -5.04 117.44 124.78 1uqv n TRP 106 Ca 0.08 -0.09 -0.38 0.00 -1.31 0.00 0.00 57.50 55.80 1uqv n TRP 106 Cb 0.60 -0.02 -0.12 0.00 -2.01 0.00 0.00 31.31 29.77 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 -0.21 3.30 0.00 -0.99 2.20 -1.26 -5.28 119.74 117.50 1uqv s LYS 107 Ca 0.01 -0.74 0.11 0.00 -0.36 0.00 0.00 55.97 54.99 1uqv s LYS 107 Cb 0.01 -3.55 0.09 0.00 -1.51 0.00 0.00 37.83 32.87 1uqv s LYS 107 CO 0.00 -0.43 0.86 -0.25 -0.36 0.00 0.00 175.35 175.18