#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vhp n ILE 3 N 0.00 1.93 0.00 1.53 5.41 -1.26 -3.45 119.36 123.52 2vhp n ILE 3 Ca 0.00 -1.93 0.00 0.00 1.00 0.00 0.00 62.75 61.82 2vhp n ILE 3 Cb 0.00 -2.21 0.00 0.00 -0.71 0.00 0.00 39.64 36.72 2vhp n ILE 3 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 2vhp n LYS 4 N 7.92 0.00 0.26 0.38 4.81 -1.26 -5.00 118.16 125.28 2vhp n LYS 4 Ca 0.46 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.96 2vhp n LYS 4 Cb 0.45 0.00 0.29 0.00 0.02 0.00 0.00 35.03 35.79 2vhp n LYS 4 CO 0.00 0.00 0.00 0.77 1.17 0.00 0.00 177.40 179.34 2vhp h SER 5 N 0.00 0.00 0.00 3.14 0.02 -2.07 -2.96 113.55 111.67 2vhp h SER 5 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2vhp h SER 5 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2vhp h SER 5 CO 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 2vhp n ALA 6 N -1.56 1.34 -0.15 3.77 0.00 -1.26 -2.55 120.51 120.09 2vhp n ALA 6 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.31 2vhp n ALA 6 Cb 0.64 -1.00 0.10 0.00 0.00 0.00 0.00 19.45 19.19 2vhp n ALA 6 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2vhp n LYS 7 N 0.59 1.69 -0.18 0.00 2.85 -1.12 -4.51 118.16 117.48 2vhp n LYS 7 Ca 0.00 -1.56 0.24 0.00 -1.05 0.00 0.00 58.31 55.94 2vhp n LYS 7 Cb 0.04 -1.62 0.64 0.00 -0.65 0.00 0.00 35.03 33.44 2vhp n LYS 7 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 177.40 177.13 2vhp h LYS 8 N 0.57 0.15 0.00 -1.58 3.64 -1.84 4.36 116.57 121.87 2vhp h LYS 8 Ca 0.32 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 2vhp h LYS 8 Cb 1.95 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.74 2vhp h LYS 8 CO 0.56 0.10 0.02 0.54 -2.27 0.00 0.00 179.45 178.40 2vhp n ARG 9 N -4.38 0.01 0.00 1.90 3.00 -1.26 -1.51 116.66 114.42 2vhp n ARG 9 Ca 0.18 0.50 0.00 0.00 -0.01 0.00 0.00 57.85 58.51 2vhp n ARG 9 Cb 0.81 -1.56 0.00 0.00 0.00 0.00 0.00 32.46 31.72 2vhp n ARG 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2vhp n ALA 10 N -1.51 0.00 0.39 7.54 0.00 1.43 0.17 120.51 128.54 2vhp n ALA 10 Ca -0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 2vhp n ALA 10 Cb 0.02 0.31 0.17 0.00 0.00 0.00 0.00 19.45 19.95 2vhp n ALA 10 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 2vhp h ILE 11 N 0.00 0.00 -0.03 0.00 -0.00 -1.51 -3.26 117.51 112.71 2vhp h ILE 11 Ca 0.00 -0.72 -0.15 0.00 -0.00 0.00 0.00 64.86 63.99 2vhp h ILE 11 Cb 0.00 1.45 -0.01 0.00 -0.00 0.00 0.00 36.82 38.25 2vhp h ILE 11 CO 0.00 0.00 -0.67 -0.61 -0.00 0.00 0.00 178.15 176.87 2vhp h GLN 12 N 0.00 0.16 0.52 0.16 4.15 -0.94 -2.78 115.11 116.37 2vhp h GLN 12 Ca 0.00 -0.13 -0.03 0.00 0.77 0.00 0.00 58.65 59.27 2vhp h GLN 12 Cb 0.86 0.02 0.01 0.00 0.21 0.00 0.00 27.48 28.58 2vhp h GLN 12 CO 0.00 0.77 -0.25 1.03 -1.93 0.00 0.00 178.83 178.45 2vhp h SER 13 N 0.11 -0.59 -0.79 -0.69 0.87 0.17 -2.43 113.55 110.19 2vhp h SER 13 Ca -0.01 0.02 0.16 0.00 -1.23 0.00 0.00 61.79 60.73 2vhp h SER 13 Cb 1.20 0.15 -0.11 0.00 -0.44 0.00 0.00 62.40 63.21 2vhp h SER 13 CO 0.10 -0.30 0.30 -0.33 -0.53 0.00 0.00 176.83 176.07 2vhp h GLU 14 N -0.94 0.39 -0.01 2.24 4.39 -1.65 0.17 114.58 119.17 2vhp h GLU 14 Ca -0.07 -0.02 0.03 0.00 0.34 0.00 0.00 59.36 59.63 2vhp h GLU 14 Cb 0.53 -0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 29.06 2vhp h GLU 14 CO 0.12 0.26 -0.18 0.87 -1.16 0.00 0.00 179.01 178.92 2vhp h LYS 15 N 0.41 -0.28 -0.01 2.33 1.79 -1.53 0.99 116.57 120.26 2vhp h LYS 15 Ca 0.45 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.94 2vhp h LYS 15 Cb 0.75 0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.45 2vhp h LYS 15 CO -0.46 -0.19 -0.07 0.00 -1.08 0.00 0.00 179.45 177.65 2vhp h ALA 16 N 0.63 -0.51 -0.95 3.86 0.00 -0.54 -1.02 119.26 120.72 2vhp h ALA 16 Ca 0.06 -0.01 0.27 0.00 0.00 0.00 0.00 54.91 55.23 2vhp h ALA 16 Cb 0.37 0.61 -0.18 0.00 0.00 0.00 0.00 17.79 18.60 2vhp h ALA 16 CO -0.18 -0.54 0.05 -2.13 0.00 0.00 0.00 179.25 176.46 2vhp n ARG 17 N -2.94 -0.07 0.10 0.00 0.00 0.40 0.73 116.66 114.88 2vhp n ARG 17 Ca -0.01 1.41 -0.01 0.00 -0.00 0.00 0.00 57.85 59.24 2vhp n ARG 17 Cb 0.05 -2.26 0.24 0.00 0.00 0.00 0.00 32.46 30.49 2vhp n ARG 17 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.63 177.41 2vhp h LYS 18 N 0.00 0.22 0.00 -0.14 3.64 -0.29 -1.68 116.57 118.32 2vhp h LYS 18 Ca 0.59 -0.10 -0.00 0.00 -1.27 0.00 0.00 60.65 59.87 2vhp h LYS 18 Cb 1.24 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 2vhp h LYS 18 CO -0.88 0.59 -0.00 1.25 -2.27 0.00 0.00 179.45 178.13 2vhp h HIS 19 N 0.19 -0.01 -0.68 1.91 2.76 0.16 -3.27 115.15 116.21 2vhp h HIS 19 Ca 0.02 -0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.26 2vhp h HIS 19 Cb 0.79 0.00 -0.09 0.00 1.55 0.00 0.00 27.41 29.66 2vhp h HIS 19 CO 0.01 -0.00 -0.36 0.09 -1.30 0.00 0.00 177.93 176.37 2vhp n ASN 20 N -2.20 -0.64 -0.37 3.26 5.03 -0.41 -0.12 115.26 119.81 2vhp n ASN 20 Ca -0.00 1.20 -0.10 0.00 0.87 0.00 0.00 54.58 56.55 2vhp n ASN 20 Cb 0.00 -0.19 -0.09 0.00 -1.02 0.00 0.00 39.78 38.48 2vhp n ASN 20 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2vhp h ALA 21 N 0.52 -0.52 -0.86 5.41 0.00 -1.47 0.13 119.26 122.47 2vhp h ALA 21 Ca 0.15 0.10 0.18 0.00 0.00 0.00 0.00 54.91 55.34 2vhp h ALA 21 Cb 0.32 1.33 -0.11 0.00 0.00 0.00 0.00 17.79 19.33 2vhp h ALA 21 CO -0.65 -0.90 0.41 0.77 0.00 0.00 0.00 179.25 178.88 2vhp h SER 22 N -0.02 0.42 0.44 0.00 0.02 -0.57 0.50 113.55 114.34 2vhp h SER 22 Ca 0.14 0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 61.19 2vhp h SER 22 Cb 0.39 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.00 2vhp h SER 22 CO -0.84 0.11 -0.21 0.03 -1.14 0.00 0.00 176.83 174.78 2vhp h ARG 23 N 0.51 -0.57 0.00 3.45 2.47 -0.53 -2.89 114.38 116.82 2vhp h ARG 23 Ca 0.50 0.04 0.00 0.00 -1.26 0.00 0.00 59.98 59.26 2vhp h ARG 23 Cb 0.84 0.13 0.00 0.00 -1.65 0.00 0.00 29.97 29.29 2vhp h ARG 23 CO -0.44 -0.31 0.00 -2.13 0.56 0.00 0.00 179.97 177.65 2vhp n ARG 24 N -5.29 0.00 0.11 0.04 0.63 0.13 -1.16 116.66 111.13 2vhp n ARG 24 Ca -0.11 0.63 0.20 0.00 -0.92 0.00 0.00 57.85 57.65 2vhp n ARG 24 Cb 0.28 -1.28 0.72 0.00 0.45 0.00 0.00 32.46 32.63 2vhp n ARG 24 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2vhp h SER 25 N 0.00 0.00 0.00 6.15 4.64 -1.58 0.32 113.55 123.08 2vhp h SER 25 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2vhp h SER 25 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2vhp h SER 25 CO 0.00 0.00 0.00 0.80 -0.87 0.00 0.00 176.83 176.76 2vhp n MET 26 N -3.52 0.00 -0.31 4.77 0.00 -0.30 -2.26 117.12 115.50 2vhp n MET 26 Ca 0.07 0.38 0.03 0.00 -0.00 0.00 0.00 57.70 58.18 2vhp n MET 26 Cb 0.66 -1.31 0.10 0.00 0.00 0.00 0.00 33.22 32.68 2vhp n MET 26 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 175.97 177.95 2vhp h MET 27 N 0.00 -0.01 -1.16 2.12 1.85 -0.87 0.30 114.93 117.17 2vhp h MET 27 Ca 0.00 0.00 0.35 0.00 -0.61 0.00 0.00 59.70 59.44 2vhp h MET 27 Cb 0.00 0.00 -0.12 0.00 0.43 0.00 0.00 31.60 31.92 2vhp h MET 27 CO 0.00 -0.00 0.74 0.00 -0.40 0.00 0.00 176.91 177.24 2vhp h ARG 28 N -0.01 0.24 -0.02 0.39 3.08 -0.94 0.18 114.38 117.30 2vhp h ARG 28 Ca 0.41 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.43 2vhp h ARG 28 Cb 0.63 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2vhp h ARG 28 CO -0.89 0.16 -0.05 1.15 -1.07 0.00 0.00 179.97 179.27 2vhp h THR 29 N 0.24 1.47 -0.93 2.04 2.02 0.06 -1.27 112.91 116.54 2vhp h THR 29 Ca 0.71 -1.45 0.27 0.00 0.77 0.00 0.00 66.41 66.72 2vhp h THR 29 Cb 2.00 2.40 -0.15 0.00 -1.74 0.00 0.00 68.15 70.67 2vhp h THR 29 CO -0.39 0.38 0.36 -0.26 0.37 0.00 0.00 175.52 175.99 2vhp h PHE 30 N -0.51 0.57 0.00 3.16 -1.00 -0.44 0.71 116.94 119.43 2vhp h PHE 30 Ca -0.00 0.05 -0.00 0.00 2.81 0.00 0.00 57.97 60.82 2vhp h PHE 30 Cb 0.65 -0.10 0.00 0.00 3.61 0.00 0.00 35.95 40.11 2vhp h PHE 30 CO 0.13 -0.21 -0.00 -0.84 -1.61 0.00 0.00 178.31 175.78 2vhp h ILE 31 N 0.25 1.49 -0.93 -0.55 3.07 -1.39 -3.21 117.51 116.23 2vhp h ILE 31 Ca 0.63 -1.47 0.27 0.00 1.55 0.00 0.00 64.86 65.84 2vhp h ILE 31 Cb 1.36 2.48 -0.15 0.00 -0.27 0.00 0.00 36.82 40.23 2vhp h ILE 31 CO -0.65 0.38 0.31 0.11 -1.05 0.00 0.00 178.15 177.25 2vhp h LYS 32 N -0.64 0.19 -0.41 0.16 1.57 0.32 0.94 116.57 118.70 2vhp h LYS 32 Ca -0.00 -0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.85 2vhp h LYS 32 Cb 0.63 -0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.80 2vhp h LYS 32 CO 0.00 0.13 -0.22 0.87 -0.57 0.00 0.00 179.45 179.66 2vhp h LYS 33 N 0.19 -0.14 -0.17 3.15 1.57 -1.20 0.12 116.57 120.10 2vhp h LYS 33 Ca 0.62 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.43 2vhp h LYS 33 Cb 1.35 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.67 2vhp h LYS 33 CO -0.69 -0.09 0.04 0.28 -0.57 0.00 0.00 179.45 178.43 2vhp h VAL 34 N -0.14 0.94 -0.78 0.50 2.07 0.87 0.46 116.25 120.17 2vhp h VAL 34 Ca 0.20 -0.04 0.18 0.00 0.82 0.00 0.00 66.70 67.86 2vhp h VAL 34 Cb 0.45 0.81 -0.12 0.00 -1.52 0.00 0.00 31.29 30.91 2vhp h VAL 34 CO -0.50 0.02 0.20 0.22 0.02 0.00 0.00 177.57 177.53 2vhp h TYR 35 N 0.12 0.30 -0.44 1.57 3.20 -0.87 0.20 116.97 121.05 2vhp h TYR 35 Ca 0.08 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 2vhp h TYR 35 Cb 0.06 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 2vhp h TYR 35 CO -0.13 -0.11 0.26 0.00 -1.64 0.00 0.00 178.16 176.55 2vhp h ALA 36 N 1.65 1.64 -0.04 1.82 0.00 0.25 0.24 119.26 124.82 2vhp h ALA 36 Ca 0.45 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2vhp h ALA 36 Cb 0.80 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2vhp h ALA 36 CO -0.55 0.31 0.00 0.00 0.00 0.00 0.00 179.25 179.02 2vhp n ALA 37 N -2.47 -0.40 -0.19 0.00 0.00 0.78 -2.91 120.51 115.32 2vhp n ALA 37 Ca 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.47 2vhp n ALA 37 Cb 0.08 0.10 0.10 0.00 0.00 0.00 0.00 19.45 19.72 2vhp n ALA 37 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2vhp h ILE 38 N 0.00 0.75 0.00 0.00 2.04 -0.91 0.20 117.51 119.59 2vhp h ILE 38 Ca 0.00 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.74 2vhp h ILE 38 Cb 0.00 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 36.45 2vhp h ILE 38 CO 0.00 0.06 0.00 1.21 0.00 0.00 0.00 178.15 179.42 2vhp n GLU 39 N -5.04 0.36 -2.75 2.37 0.00 0.80 -2.39 120.64 113.99 2vhp n GLU 39 Ca 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 57.16 57.21 2vhp n GLU 39 Cb 0.27 -1.18 0.02 0.00 0.00 0.00 0.00 31.44 30.55 2vhp n GLU 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2vhp s ALA 40 N -0.97 -3.46 -0.69 4.31 0.00 0.70 -4.98 121.76 116.67 2vhp s ALA 40 Ca 0.00 0.26 -0.06 0.00 0.00 0.00 0.00 51.96 52.16 2vhp s ALA 40 Cb 0.00 -2.87 -0.23 0.00 0.00 0.00 0.00 23.12 20.01 2vhp s ALA 40 CO 0.00 -2.40 1.59 0.41 0.00 0.00 0.00 175.76 175.36 2vhp n GLY 41 N 2.96 -0.34 2.85 0.00 0.00 -1.00 -4.73 105.19 104.93 2vhp n GLY 41 Ca 0.13 -0.01 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 2vhp n GLY 41 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2vhp s ASP 42 N 0.00 4.31 0.31 1.61 2.15 -1.25 -5.00 116.67 118.80 2vhp s ASP 42 Ca 0.91 -1.83 0.04 0.00 0.43 0.00 0.00 52.55 52.10 2vhp s ASP 42 Cb -0.58 -1.17 0.82 0.00 -0.30 0.00 0.00 42.92 41.68 2vhp s ASP 42 CO 0.39 -0.40 1.58 0.07 -0.17 0.00 0.00 175.17 176.65 2vhp h LYS 43 N 7.90 0.04 0.30 4.34 2.10 -1.92 0.12 116.57 129.45 2vhp h LYS 43 Ca -0.10 -0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.53 2vhp h LYS 43 Cb 1.02 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.34 2vhp h LYS 43 CO 0.49 0.02 -0.16 0.00 -2.00 0.00 0.00 179.45 177.80 2vhp h ALA 44 N 1.95 -1.08 -1.00 0.07 0.00 -1.94 -2.70 119.26 114.56 2vhp h ALA 44 Ca 0.62 -0.09 0.36 0.00 0.00 0.00 0.00 54.91 55.80 2vhp h ALA 44 Cb 1.33 0.20 -0.18 0.00 0.00 0.00 0.00 17.79 19.15 2vhp h ALA 44 CO -0.86 -1.06 0.32 0.00 0.00 0.00 0.00 179.25 177.66 2vhp h ALA 45 N -1.75 1.75 -1.42 0.00 0.00 -1.68 -0.43 119.26 115.73 2vhp h ALA 45 Ca -0.04 0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2vhp h ALA 45 Cb 0.33 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2vhp h ALA 45 CO 0.06 -0.79 0.00 0.00 0.00 0.00 0.00 179.25 178.52 2vhp n ALA 46 N -2.63 -0.17 -0.05 0.00 0.00 0.31 -1.63 120.51 116.34 2vhp n ALA 46 Ca 0.32 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.68 2vhp n ALA 46 Cb 1.06 0.14 -0.01 0.00 0.00 0.00 0.00 19.45 20.64 2vhp n ALA 46 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2vhp h GLN 47 N 0.00 -0.08 -0.12 0.00 1.08 -0.97 -2.30 115.11 112.72 2vhp h GLN 47 Ca 0.00 0.01 0.04 0.00 -1.45 0.00 0.00 58.65 57.25 2vhp h GLN 47 Cb 0.00 0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 27.38 2vhp h GLN 47 CO 0.00 -0.05 -0.38 -0.22 -0.95 0.00 0.00 178.83 177.23 2vhp h LYS 48 N -0.08 -0.44 -0.69 1.46 1.63 -1.16 -2.43 116.57 114.85 2vhp h LYS 48 Ca 0.13 0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.93 2vhp h LYS 48 Cb 0.27 0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 31.97 2vhp h LYS 48 CO -0.29 -0.30 0.34 0.00 -3.45 0.00 0.00 179.45 175.75 2vhp h ALA 49 N 0.23 0.89 -1.77 5.00 0.00 -1.11 -2.36 119.26 120.14 2vhp h ALA 49 Ca 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2vhp h ALA 49 Cb 0.60 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2vhp h ALA 49 CO -0.37 0.45 0.00 0.34 0.00 0.00 0.00 179.25 179.67 2vhp n PHE 50 N -4.45 0.00 0.09 0.00 -0.00 -0.88 -0.96 117.46 111.26 2vhp n PHE 50 Ca 0.05 0.00 0.01 0.00 -0.00 0.00 0.00 57.45 57.51 2vhp n PHE 50 Cb 0.12 -0.20 0.04 0.00 -0.00 0.00 0.00 39.48 39.44 2vhp n PHE 50 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.76 177.03 2vhp n ASN 51 N -1.34 0.00 -0.06 -2.13 0.23 -1.07 -1.68 115.26 109.21 2vhp n ASN 51 Ca 0.00 0.05 -0.05 0.00 -0.53 0.00 0.00 54.58 54.05 2vhp n ASN 51 Cb 0.00 -0.09 -0.04 0.00 -2.08 0.00 0.00 39.78 37.57 2vhp n ASN 51 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2vhp h GLU 52 N 0.00 0.00 -0.00 -3.83 4.81 -0.72 -3.36 114.58 111.48 2vhp h GLU 52 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2vhp h GLU 52 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2vhp h GLU 52 CO 0.00 0.31 0.00 0.00 -0.73 0.00 0.00 179.01 178.59 2vhp n MET 53 N -4.71 1.02 0.18 1.92 0.00 -0.13 -4.40 117.12 110.99 2vhp n MET 53 Ca -0.04 -0.02 -0.07 0.00 0.00 0.00 0.00 57.70 57.56 2vhp n MET 53 Cb 0.17 -1.19 -0.03 0.00 0.00 0.00 0.00 33.22 32.16 2vhp n MET 53 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 175.97 176.34 2vhp h GLN 54 N 0.04 -0.45 0.00 3.17 4.15 -1.66 -1.63 115.11 118.74 2vhp h GLN 54 Ca 0.00 0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.45 2vhp h GLN 54 Cb 0.01 0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.80 2vhp h GLN 54 CO 0.00 -0.30 -0.02 -1.00 -1.93 0.00 0.00 178.83 175.58 2vhp h PRO 55 N -0.51 0.00 -0.67 -2.39 0.13 -1.86 -1.27 132.00 125.43 2vhp h PRO 55 Ca -0.05 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.05 2vhp h PRO 55 Cb 0.36 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.46 2vhp h PRO 55 CO 0.08 0.02 0.30 0.82 -0.23 0.00 0.00 178.00 178.98 2vhp h ILE 56 N 0.00 1.23 0.10 -3.56 1.08 -1.64 0.51 117.51 115.23 2vhp h ILE 56 Ca -0.00 -0.69 -0.20 0.00 -0.39 0.00 0.00 64.86 63.59 2vhp h ILE 56 Cb 0.10 0.44 0.02 0.00 -3.07 0.00 0.00 36.82 34.31 2vhp h ILE 56 CO 0.00 0.28 -0.83 0.58 -0.69 0.00 0.00 178.15 177.49 2vhp h VAL 57 N 0.93 1.45 -0.10 1.67 2.07 -0.62 -3.29 116.25 118.36 2vhp h VAL 57 Ca 0.23 -2.38 0.03 0.00 0.82 0.00 0.00 66.70 65.39 2vhp h VAL 57 Cb 0.16 2.93 -0.00 0.00 -1.52 0.00 0.00 31.29 32.85 2vhp h VAL 57 CO -0.02 0.69 0.14 0.44 0.02 0.00 0.00 177.57 178.84 2vhp h ASP 58 N -0.18 0.00 0.42 0.57 3.32 -0.89 -1.61 116.42 118.04 2vhp h ASP 58 Ca -0.13 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.90 2vhp h ASP 58 Cb 1.59 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.15 2vhp h ASP 58 CO 0.16 0.00 -0.20 -0.09 -1.72 0.00 0.00 179.24 177.39 2vhp h ARG 59 N 0.00 -0.54 0.00 3.56 2.43 -0.05 -2.76 114.38 117.02 2vhp h ARG 59 Ca 0.05 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2vhp h ARG 59 Cb 0.33 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2vhp h ARG 59 CO -0.00 -0.36 0.00 1.96 -1.51 0.00 0.00 179.97 180.06 2vhp h GLN 60 N -0.81 0.00 0.00 0.20 1.08 -1.68 0.19 115.11 114.09 2vhp h GLN 60 Ca -0.06 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.14 2vhp h GLN 60 Cb 0.43 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.86 2vhp h GLN 60 CO 0.09 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 177.97 2vhp n ALA 61 N -1.92 1.36 -0.02 3.87 0.00 -0.62 -0.90 120.51 122.29 2vhp n ALA 61 Ca -0.01 0.08 0.01 0.00 0.00 0.00 0.00 53.44 53.51 2vhp n ALA 61 Cb 0.11 -1.26 -0.06 0.00 0.00 0.00 0.00 19.45 18.24 2vhp n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vhp n ALA 62 N -1.67 2.08 1.04 0.00 0.00 0.63 -4.38 120.51 118.21 2vhp n ALA 62 Ca 0.01 -0.33 0.12 0.00 0.00 0.00 0.00 53.44 53.24 2vhp n ALA 62 Cb 0.12 -0.11 0.19 0.00 0.00 0.00 0.00 19.45 19.65 2vhp n ALA 62 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2vhp n LYS 63 N -2.01 0.18 -2.86 0.00 4.76 -0.97 -4.98 118.16 112.29 2vhp n LYS 63 Ca -0.06 -0.12 -0.08 0.00 -2.87 0.00 0.00 58.31 55.18 2vhp n LYS 63 Cb 0.45 -1.50 0.03 0.00 -1.84 0.00 0.00 35.03 32.17 2vhp n LYS 63 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2vhp n GLY 64 N 1.47 0.45 0.08 0.72 0.00 -0.07 -4.90 105.19 102.93 2vhp n GLY 64 Ca 0.06 -0.37 0.01 0.00 0.00 0.00 0.00 46.02 45.72 2vhp n GLY 64 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2vhp n LEU 65 N -2.00 0.41 0.01 0.99 -0.00 -1.24 -4.63 117.00 110.54 2vhp n LEU 65 Ca 0.00 0.18 -0.01 0.00 -0.00 0.00 0.00 56.01 56.18 2vhp n LEU 65 Cb 0.52 0.16 -0.00 0.00 -0.00 0.00 0.00 43.42 44.10 2vhp n LEU 65 CO 0.22 0.19 -0.34 -0.38 -0.00 0.00 0.00 177.39 177.08 2vhp n ILE 66 N -2.68 0.60 -1.03 1.47 -0.00 -1.26 -5.07 119.36 111.40 2vhp n ILE 66 Ca -0.14 0.16 0.12 0.00 -0.00 0.00 0.00 62.75 62.88 2vhp n ILE 66 Cb 0.84 -1.57 -0.04 0.00 -0.00 0.00 0.00 39.64 38.87 2vhp n ILE 66 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.55 178.12 2vhp n HIS 67 N -3.29 -2.30 -1.23 1.39 -0.00 -1.16 -4.96 115.22 103.67 2vhp n HIS 67 Ca -0.02 1.18 0.00 0.00 0.46 0.00 0.00 57.72 59.34 2vhp n HIS 67 Cb 0.31 -2.09 0.00 0.00 -0.12 0.00 0.00 29.99 28.10 2vhp n HIS 67 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 2vhp n LYS 68 N -3.22 0.00 0.07 1.57 4.76 -1.26 -4.56 118.16 115.52 2vhp n LYS 68 Ca -0.01 0.00 -0.04 0.00 -2.87 0.00 0.00 58.31 55.39 2vhp n LYS 68 Cb 0.61 0.00 0.18 0.00 -1.84 0.00 0.00 35.03 33.99 2vhp n LYS 68 CO 0.00 0.00 0.00 -0.91 -1.37 0.00 0.00 177.40 175.12 2vhp h ASN 69 N 0.00 0.34 -0.92 4.39 2.35 -1.98 -3.26 115.58 116.50 2vhp h ASN 69 Ca 0.00 -0.15 0.24 0.00 -0.55 0.00 0.00 56.30 55.84 2vhp h ASN 69 Cb 0.00 -0.10 -0.17 0.00 0.05 0.00 0.00 38.32 38.11 2vhp h ASN 69 CO 0.00 0.73 0.00 0.07 -1.65 0.00 0.00 177.43 176.58 2vhp h LYS 70 N 0.27 0.04 -0.04 0.81 2.10 -1.95 -0.31 116.57 117.49 2vhp h LYS 70 Ca 0.02 -0.00 0.01 0.00 -2.00 0.00 0.00 60.65 58.68 2vhp h LYS 70 Cb 0.86 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 32.17 2vhp h LYS 70 CO 0.07 0.03 -0.12 0.00 -2.00 0.00 0.00 179.45 177.43 2vhp h ALA 71 N 1.90 -0.50 -0.71 0.07 0.00 -1.81 -0.67 119.26 117.54 2vhp h ALA 71 Ca 0.53 -0.01 0.26 0.00 0.00 0.00 0.00 54.91 55.70 2vhp h ALA 71 Cb 1.04 0.69 -0.13 0.00 0.00 0.00 0.00 17.79 19.39 2vhp h ALA 71 CO -0.85 -0.55 0.26 0.00 0.00 0.00 0.00 179.25 178.11 2vhp n ALA 72 N -2.69 0.61 0.05 0.00 0.00 -0.14 0.15 120.51 118.49 2vhp n ALA 72 Ca -0.01 0.74 -0.15 0.00 0.00 0.00 0.00 53.44 54.02 2vhp n ALA 72 Cb 0.08 -0.67 -0.05 0.00 0.00 0.00 0.00 19.45 18.81 2vhp n ALA 72 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2vhp h ARG 73 N 0.00 0.53 -0.04 0.00 0.11 -1.05 -2.04 114.38 111.90 2vhp h ARG 73 Ca 0.55 -0.53 0.00 0.00 0.10 0.00 0.00 59.98 60.10 2vhp h ARG 73 Cb 1.36 0.14 -0.00 0.00 1.11 0.00 0.00 29.97 32.57 2vhp h ARG 73 CO -0.59 1.16 0.01 0.45 0.10 0.00 0.00 179.97 181.10 2vhp h HIS 74 N 0.32 0.02 -0.26 4.08 3.86 0.24 1.68 115.15 125.08 2vhp h HIS 74 Ca -0.08 0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.17 2vhp h HIS 74 Cb 1.54 -0.00 -0.07 0.00 1.06 0.00 0.00 27.41 29.94 2vhp h HIS 74 CO 0.07 0.01 -0.51 0.87 0.86 0.00 0.00 177.93 179.23 2vhp h LYS 75 N 0.03 -0.43 0.10 2.45 1.57 -1.46 -2.63 116.57 116.19 2vhp h LYS 75 Ca 0.02 0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2vhp h LYS 75 Cb 0.01 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.42 2vhp h LYS 75 CO -0.02 -0.29 -0.05 0.00 -0.57 0.00 0.00 179.45 178.52 2vhp h ALA 76 N -0.25 -0.13 -0.14 3.86 0.00 -0.59 -2.17 119.26 119.85 2vhp h ALA 76 Ca 0.05 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.84 2vhp h ALA 76 Cb 0.59 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 2vhp h ALA 76 CO -0.49 -0.43 -0.03 -2.95 0.00 0.00 0.00 179.25 175.34 2vhp h ASN 77 N -0.41 -0.13 -0.94 0.00 -1.07 0.24 0.34 115.58 113.61 2vhp h ASN 77 Ca -0.01 0.04 0.15 0.00 0.07 0.00 0.00 56.30 56.55 2vhp h ASN 77 Cb 0.34 0.08 -0.08 0.00 -2.07 0.00 0.00 38.32 36.60 2vhp h ASN 77 CO 0.02 -0.05 0.60 -0.07 0.07 0.00 0.00 177.43 178.01 2vhp h LEU 78 N -0.00 0.74 -0.54 6.14 3.38 -1.52 -1.25 115.31 122.27 2vhp h LEU 78 Ca 0.07 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 2vhp h LEU 78 Cb 0.10 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2vhp h LEU 78 CO -0.14 0.36 0.16 0.74 0.09 0.00 0.00 178.44 179.65 2vhp h THR 79 N 0.77 1.24 -0.85 0.22 2.02 -0.04 -0.59 112.91 115.68 2vhp h THR 79 Ca 0.49 -0.81 0.22 0.00 0.77 0.00 0.00 66.41 67.07 2vhp h THR 79 Cb 0.71 0.74 -0.13 0.00 -1.74 0.00 0.00 68.15 67.73 2vhp h THR 79 CO -0.25 0.30 0.27 0.00 0.37 0.00 0.00 175.52 176.21 2vhp h ALA 80 N 1.03 1.25 -0.45 6.16 0.00 0.76 -1.13 119.26 126.89 2vhp h ALA 80 Ca 0.17 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.28 2vhp h ALA 80 Cb 0.29 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2vhp h ALA 80 CO -0.00 -0.41 0.00 1.04 0.00 0.00 0.00 179.25 179.88 2vhp n GLN 81 N -5.16 3.85 0.04 0.00 6.02 -0.83 -3.44 117.38 117.84 2vhp n GLN 81 Ca 0.20 -2.94 0.11 0.00 -0.01 0.00 0.00 57.00 54.36 2vhp n GLN 81 Cb 0.63 -2.00 0.04 0.00 1.02 0.00 0.00 30.24 29.94 2vhp n GLN 81 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.06 176.49 2vhp n ILE 82 N 0.22 0.22 0.10 5.09 -5.35 -0.29 -4.25 119.36 115.10 2vhp n ILE 82 Ca 0.24 -0.27 0.09 0.00 -0.27 0.00 0.00 62.75 62.54 2vhp n ILE 82 Cb 0.99 0.12 -0.00 0.00 -1.74 0.00 0.00 39.64 39.01 2vhp n ILE 82 CO 0.00 0.00 0.00 0.78 -1.76 0.00 0.00 176.55 175.57 2vhp h ASN 83 N 0.00 0.00 -0.18 7.28 2.35 -1.56 -3.15 115.58 120.33 2vhp h ASN 83 Ca 0.00 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.58 2vhp h ASN 83 Cb 0.75 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.06 2vhp h ASN 83 CO 0.00 0.14 -0.05 0.29 -1.65 0.00 0.00 177.43 176.16 2vhp n LYS 84 N -2.77 1.63 0.00 0.81 5.02 -1.25 -4.45 118.16 117.15 2vhp n LYS 84 Ca -0.02 -0.83 0.00 0.00 -2.02 0.00 0.00 58.31 55.44 2vhp n LYS 84 Cb 0.62 -1.58 0.00 0.00 -0.02 0.00 0.00 35.03 34.05 2vhp n LYS 84 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2vhp n LEU 85 N 1.66 0.00 0.00 -0.35 7.94 -1.20 -5.07 117.00 119.98 2vhp n LEU 85 Ca 0.25 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.15 2vhp n LEU 85 Cb 0.67 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.62 2vhp n LEU 85 CO 0.13 0.00 0.00 0.00 -1.11 0.00 0.00 177.39 176.41