#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pve n SER 2 N 0.00 -6.36 -3.66 1.61 2.88 -1.26 -5.04 113.62 101.79 1pve n SER 2 Ca 0.00 0.65 -0.12 0.00 -1.33 0.00 0.00 58.87 58.07 1pve n SER 2 Cb 0.00 -1.84 -0.06 0.00 -0.75 0.00 0.00 64.21 61.56 1pve n SER 2 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 1pve s HIS 3 N -0.97 -0.23 -0.41 0.66 0.00 -1.26 -5.12 115.29 107.96 1pve s HIS 3 Ca 0.00 0.06 0.08 0.00 -3.00 0.00 0.00 55.06 52.20 1pve s HIS 3 Cb 0.00 0.23 0.26 0.00 -4.00 0.00 0.00 32.58 29.07 1pve s HIS 3 CO 0.00 -0.62 0.65 0.00 -1.00 0.00 0.00 174.74 173.77 1pve n MET 4 N 0.19 0.77 0.00 -0.38 -0.00 -1.26 -5.03 117.12 111.41 1pve n MET 4 Ca -0.17 -2.86 0.05 0.00 -0.00 0.00 0.00 57.70 54.72 1pve n MET 4 Cb 0.61 -1.32 0.27 0.00 -0.00 0.00 0.00 33.22 32.78 1pve n MET 4 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1pve n PRO 5 N 1.29 0.22 -0.37 3.17 -0.04 -1.26 -2.12 135.00 135.89 1pve n PRO 5 Ca 0.18 0.11 0.07 0.00 -0.04 0.00 0.00 63.50 63.82 1pve n PRO 5 Cb 0.57 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.65 1pve n PRO 5 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1pve n LEU 6 N -1.16 1.80 -0.01 1.53 4.77 -1.26 -4.89 117.00 117.78 1pve n LEU 6 Ca 0.06 -2.70 0.23 0.00 -0.03 0.00 0.00 56.01 53.57 1pve n LEU 6 Cb 0.06 -0.32 0.69 0.00 -2.33 0.00 0.00 43.42 41.51 1pve n LEU 6 CO 0.07 0.72 1.21 1.05 -1.33 0.00 0.00 177.39 179.11 1pve h GLU 7 N 0.25 0.00 -0.68 3.23 9.09 -1.87 -1.24 114.58 123.36 1pve h GLU 7 Ca -0.02 0.00 0.19 0.00 0.05 0.00 0.00 59.36 59.58 1pve h GLU 7 Cb 1.15 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 28.22 1pve h GLU 7 CO 0.01 0.00 0.49 0.35 0.05 0.00 0.00 179.01 179.90 1pve h PHE 8 N 0.00 0.08 0.00 2.06 3.57 -1.90 -2.15 116.94 118.60 1pve h PHE 8 Ca 0.29 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.79 1pve h PHE 8 Cb 1.55 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.27 1pve h PHE 8 CO 0.00 0.03 0.00 1.28 -2.23 0.00 0.00 178.31 177.39 1pve n LEU 9 N -4.36 0.00 0.24 0.59 4.77 -0.47 -4.33 117.00 113.44 1pve n LEU 9 Ca 0.13 0.44 0.16 0.00 -0.03 0.00 0.00 56.01 56.71 1pve n LEU 9 Cb 0.71 -0.44 0.60 0.00 -2.33 0.00 0.00 43.42 41.97 1pve n LEU 9 CO 0.37 -0.05 0.95 0.08 -1.33 0.00 0.00 177.39 177.41 1pve h ARG 10 N 0.00 0.00 0.00 3.23 0.11 -1.58 -3.38 114.38 112.76 1pve h ARG 10 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1pve h ARG 10 Cb 0.38 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.46 1pve h ARG 10 CO 0.00 0.00 -0.02 -1.71 0.10 0.00 0.00 179.97 178.34 1pve n ASN 11 N -2.92 0.12 -4.66 0.08 5.15 -1.26 -5.03 115.26 106.74 1pve n ASN 11 Ca 0.01 -0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.57 1pve n ASN 11 Cb 0.32 0.03 -0.03 0.00 -0.53 0.00 0.00 39.78 39.57 1pve n ASN 11 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1pve s GLN 12 N -0.05 4.17 0.33 1.20 -1.52 -1.26 -4.92 119.66 117.61 1pve s GLN 12 Ca 0.00 2.32 0.08 0.00 -1.95 0.00 0.00 55.36 55.81 1pve s GLN 12 Cb 0.00 -4.00 0.78 0.00 -0.22 0.00 0.00 33.01 29.57 1pve s GLN 12 CO 0.00 -0.86 1.82 -1.35 -0.25 0.00 0.00 175.29 174.64 1pve h PRO 13 N 9.71 0.72 0.00 2.91 0.11 -1.98 -0.14 132.00 143.33 1pve h PRO 13 Ca -0.43 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1pve h PRO 13 Cb 1.20 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1pve h PRO 13 CO 0.95 0.48 0.00 -0.56 -0.21 0.00 0.00 178.00 178.65 1pve h GLN 14 N 0.74 0.00 -0.01 1.05 3.07 -1.99 -2.29 115.11 115.68 1pve h GLN 14 Ca 0.52 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.26 1pve h GLN 14 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.39 1pve h GLN 14 CO -0.29 0.00 -0.02 1.19 0.09 0.00 0.00 178.83 179.80 1pve n PHE 15 N -2.75 0.00 -0.04 0.06 3.72 -0.12 -4.03 117.46 114.30 1pve n PHE 15 Ca -0.01 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.17 1pve n PHE 15 Cb 0.12 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.53 1pve n PHE 15 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 1pve h GLN 16 N 1.61 0.15 -0.55 -1.08 1.08 -1.07 -3.42 115.11 111.82 1pve h GLN 16 Ca 0.00 -0.25 -0.09 0.00 -1.45 0.00 0.00 58.65 56.86 1pve h GLN 16 Cb 0.35 0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 27.85 1pve h GLN 16 CO 0.00 1.12 -0.03 1.96 -0.95 0.00 0.00 178.83 180.93 1pve h GLN 17 N -0.45 0.97 -0.49 1.46 4.20 -1.63 -3.07 115.11 116.10 1pve h GLN 17 Ca -0.38 -0.31 0.08 0.00 0.06 0.00 0.00 58.65 58.10 1pve h GLN 17 Cb 1.68 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 29.34 1pve h GLN 17 CO -0.05 0.97 0.33 0.00 -0.67 0.00 0.00 178.83 179.41 1pve h MET 18 N 0.89 0.33 -0.13 1.46 -0.00 -1.81 -1.88 114.93 113.80 1pve h MET 18 Ca 0.16 -0.02 -0.13 0.00 -0.00 0.00 0.00 59.70 59.71 1pve h MET 18 Cb 0.56 -0.07 -0.01 0.00 -0.00 0.00 0.00 31.60 32.07 1pve h MET 18 CO 0.03 0.22 -0.48 0.00 -0.00 0.00 0.00 176.91 176.69 1pve h ARG 19 N 0.34 0.33 -0.28 -0.10 3.08 -1.78 -2.79 114.38 113.18 1pve h ARG 19 Ca 0.22 -0.18 0.01 0.00 0.07 0.00 0.00 59.98 60.09 1pve h ARG 19 Cb 0.42 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 1pve h ARG 19 CO -0.05 0.74 0.19 1.96 -1.07 0.00 0.00 179.97 181.73 1pve h GLN 20 N 0.26 0.36 -0.24 0.04 4.20 -1.43 0.00 115.11 118.30 1pve h GLN 20 Ca 0.01 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.66 1pve h GLN 20 Cb 0.94 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.63 1pve h GLN 20 CO 0.08 0.24 -0.02 0.82 -0.67 0.00 0.00 178.83 179.28 1pve h ILE 21 N 0.37 1.27 -0.07 2.54 2.04 -1.49 -3.26 117.51 118.91 1pve h ILE 21 Ca 0.10 -0.96 -0.19 0.00 1.00 0.00 0.00 64.86 64.82 1pve h ILE 21 Cb -0.03 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 1pve h ILE 21 CO -0.02 0.30 -0.74 0.40 0.00 0.00 0.00 178.15 178.08 1pve h ILE 22 N 0.20 1.39 0.00 -0.67 1.08 -1.37 -0.40 117.51 117.74 1pve h ILE 22 Ca 0.07 -2.18 0.00 0.00 -0.39 0.00 0.00 64.86 62.36 1pve h ILE 22 Cb 0.45 2.14 0.00 0.00 -3.07 0.00 0.00 36.82 36.34 1pve h ILE 22 CO 0.02 0.65 0.00 0.00 -0.69 0.00 0.00 178.15 178.13 1pve n GLN 23 N -3.82 0.35 0.00 2.37 6.02 -0.06 -1.67 117.38 120.56 1pve n GLN 23 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 1pve n GLN 23 Cb 0.72 -1.36 0.00 0.00 1.02 0.00 0.00 30.24 30.62 1pve n GLN 23 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1pve n GLN 24 N -0.86 0.98 -3.73 -1.09 6.02 -1.10 -4.94 117.38 112.65 1pve n GLN 24 Ca 0.06 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.77 1pve n GLN 24 Cb 0.03 -0.79 -0.11 0.00 1.02 0.00 0.00 30.24 30.38 1pve n GLN 24 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1pve n ASN 25 N -1.78 2.00 0.29 1.08 4.13 -0.18 -4.97 115.26 115.84 1pve n ASN 25 Ca 0.00 -2.97 0.18 0.00 1.68 0.00 0.00 54.58 53.46 1pve n ASN 25 Cb 0.29 -0.69 0.89 0.00 -1.54 0.00 0.00 39.78 38.73 1pve n ASN 25 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 1pve h PRO 26 N 5.40 0.00 0.00 3.52 0.13 -1.57 -1.83 132.00 137.64 1pve h PRO 26 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1pve h PRO 26 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1pve h PRO 26 CO 0.62 0.04 0.18 0.66 -0.23 0.00 0.00 178.00 179.27 1pve h SER 27 N 0.00 0.00 -0.34 1.44 4.64 -1.93 -2.31 113.55 115.04 1pve h SER 27 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1pve h SER 27 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1pve h SER 27 CO 0.01 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.15 1pve n LEU 28 N -2.85 3.19 -0.07 5.97 4.77 -0.69 -4.47 117.00 122.86 1pve n LEU 28 Ca -0.02 -1.35 -0.07 0.00 -0.03 0.00 0.00 56.01 54.54 1pve n LEU 28 Cb 0.23 -0.22 -0.01 0.00 -2.33 0.00 0.00 43.42 41.10 1pve n LEU 28 CO 0.15 0.68 0.76 0.25 -1.33 0.00 0.00 177.39 177.90 1pve h LEU 29 N 4.17 -0.47 -0.66 2.23 5.85 -1.59 -0.95 115.31 123.90 1pve h LEU 29 Ca 0.00 0.11 0.13 0.00 0.84 0.00 0.00 57.88 58.96 1pve h LEU 29 Cb 0.92 0.26 -0.10 0.00 0.37 0.00 0.00 40.66 42.11 1pve h LEU 29 CO 0.00 -0.18 0.14 -0.65 -0.34 0.00 0.00 178.44 177.41 1pve h PRO 30 N -0.11 0.24 0.00 5.25 0.11 -1.83 -1.77 132.00 133.89 1pve h PRO 30 Ca 0.15 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1pve h PRO 30 Cb 0.33 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.38 1pve h PRO 30 CO -0.34 0.16 0.00 0.00 -0.21 0.00 0.00 178.00 177.61 1pve n ALA 31 N -2.65 1.55 -0.06 -0.75 0.00 -0.74 -0.74 120.51 117.12 1pve n ALA 31 Ca 0.11 0.06 -0.21 0.00 0.00 0.00 0.00 53.44 53.41 1pve n ALA 31 Cb 0.38 -1.32 -0.13 0.00 0.00 0.00 0.00 19.45 18.38 1pve n ALA 31 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1pve n LEU 32 N -2.01 2.69 -0.16 0.00 7.94 -0.44 -2.95 117.00 122.08 1pve n LEU 32 Ca 0.02 0.10 -0.05 0.00 -1.11 0.00 0.00 56.01 54.97 1pve n LEU 32 Cb 0.18 -1.02 0.04 0.00 0.53 0.00 0.00 43.42 43.15 1pve n LEU 32 CO 0.16 0.84 1.02 -0.07 -1.11 0.00 0.00 177.39 178.23 1pve h LEU 33 N -0.06 0.36 -1.45 -1.96 3.38 -1.19 0.28 115.31 114.66 1pve h LEU 33 Ca -0.49 0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.52 1pve h LEU 33 Cb 1.92 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 42.60 1pve h LEU 33 CO -0.02 0.25 0.38 -0.61 0.09 0.00 0.00 178.44 178.54 1pve h GLN 34 N 0.49 0.72 -0.02 1.13 4.15 -1.10 -1.27 115.11 119.21 1pve h GLN 34 Ca 0.21 -0.04 -0.20 0.00 0.77 0.00 0.00 58.65 59.39 1pve h GLN 34 Cb 0.11 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.63 1pve h GLN 34 CO -0.14 0.48 -0.85 0.37 -1.93 0.00 0.00 178.83 176.75 1pve h GLN 35 N 0.74 0.30 -0.83 1.69 4.15 -1.13 -1.20 115.11 118.82 1pve h GLN 35 Ca 0.22 -0.30 -0.02 0.00 0.77 0.00 0.00 58.65 59.33 1pve h GLN 35 Cb -0.02 0.08 -0.04 0.00 0.21 0.00 0.00 27.48 27.71 1pve h GLN 35 CO -0.05 0.99 0.46 0.82 -1.93 0.00 0.00 178.83 179.11 1pve h ILE 36 N 0.18 1.25 -0.49 2.39 2.04 -0.78 -2.64 117.51 119.45 1pve h ILE 36 Ca -0.05 -0.61 0.05 0.00 1.00 0.00 0.00 64.86 65.25 1pve h ILE 36 Cb 1.46 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 1pve h ILE 36 CO 0.14 0.27 0.33 1.23 0.00 0.00 0.00 178.15 180.12 1pve h GLY 37 N 1.16 0.57 1.61 5.37 0.00 -0.49 0.32 103.07 111.61 1pve h GLY 37 Ca 0.29 -0.19 -0.11 0.00 0.00 0.00 0.00 47.33 47.33 1pve h GLY 37 CO -0.05 0.15 -0.33 3.21 0.00 0.00 0.00 176.54 179.53 1pve h ARG 38 N 0.48 0.44 0.00 4.80 3.08 -0.89 -3.27 114.38 119.01 1pve h ARG 38 Ca 0.21 -0.19 -0.22 0.00 0.07 0.00 0.00 59.98 59.85 1pve h ARG 38 Cb 0.22 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.21 1pve h ARG 38 CO -0.05 0.72 -1.83 0.39 -1.07 0.00 0.00 179.97 178.12 1pve n GLU 39 N -4.08 1.93 -2.98 0.04 -0.58 -0.94 -4.85 120.64 109.20 1pve n GLU 39 Ca -0.01 -0.00 -0.14 0.00 -0.42 0.00 0.00 57.16 56.59 1pve n GLU 39 Cb 0.45 -1.31 -0.02 0.00 -0.57 0.00 0.00 31.44 29.99 1pve n GLU 39 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1pve n ASN 40 N -2.48 -1.93 0.30 1.62 2.85 0.11 -5.02 115.26 110.72 1pve n ASN 40 Ca -0.20 -2.88 0.20 0.00 -0.11 0.00 0.00 54.58 51.60 1pve n ASN 40 Cb 0.89 0.81 1.08 0.00 1.24 0.00 0.00 39.78 43.79 1pve n ASN 40 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1pve h PRO 41 N 4.62 0.00 0.11 1.20 0.13 -1.61 -1.12 132.00 135.33 1pve h PRO 41 Ca 0.04 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.92 1pve h PRO 41 Cb 1.00 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.15 1pve h PRO 41 CO 0.27 0.00 -1.04 1.96 -0.23 0.00 0.00 178.00 178.96 1pve h GLN 42 N 0.00 0.51 -0.32 0.86 4.20 -1.92 -2.16 115.11 116.30 1pve h GLN 42 Ca 0.00 -0.70 -0.04 0.00 0.06 0.00 0.00 58.65 57.97 1pve h GLN 42 Cb 0.03 0.23 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 1pve h GLN 42 CO 0.00 1.30 0.03 1.25 -0.67 0.00 0.00 178.83 180.75 1pve h LEU 43 N 0.06 0.43 0.05 1.46 5.85 -1.75 -2.10 115.31 119.30 1pve h LEU 43 Ca -0.16 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.49 1pve h LEU 43 Cb 1.76 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.68 1pve h LEU 43 CO 0.20 0.47 -0.02 0.25 -0.34 0.00 0.00 178.44 179.00 1pve h LEU 44 N 0.46 -0.05 -1.04 2.25 7.12 -1.21 0.70 115.31 123.54 1pve h LEU 44 Ca 0.10 -0.40 0.15 0.00 0.13 0.00 0.00 57.88 57.86 1pve h LEU 44 Cb 0.25 0.01 -0.09 0.00 -0.53 0.00 0.00 40.66 40.30 1pve h LEU 44 CO 0.00 0.38 0.62 1.56 -0.13 0.00 0.00 178.44 180.87 1pve h GLN 45 N -0.49 0.87 -0.34 1.25 4.20 -1.42 0.44 115.11 119.61 1pve h GLN 45 Ca -0.01 -0.05 -0.16 0.00 0.06 0.00 0.00 58.65 58.49 1pve h GLN 45 Cb 0.45 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 28.02 1pve h GLN 45 CO 0.01 0.57 -0.44 1.96 -0.67 0.00 0.00 178.83 180.27 1pve h GLN 46 N 0.89 0.88 -0.72 1.46 4.20 -1.08 -1.40 115.11 119.35 1pve h GLN 46 Ca 0.52 -0.49 0.01 0.00 0.06 0.00 0.00 58.65 58.75 1pve h GLN 46 Cb 0.65 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.42 1pve h GLN 46 CO -0.30 1.13 0.47 0.82 -0.67 0.00 0.00 178.83 180.29 1pve h ILE 47 N 0.71 1.18 -0.23 2.54 2.04 -0.51 -3.06 117.51 120.17 1pve h ILE 47 Ca 0.05 -0.33 -0.08 0.00 1.00 0.00 0.00 64.86 65.49 1pve h ILE 47 Cb 1.03 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1pve h ILE 47 CO 0.10 0.18 -0.21 0.28 0.00 0.00 0.00 178.15 178.50 1pve h SER 48 N 0.97 0.41 0.48 1.72 0.02 -0.66 -0.74 113.55 115.75 1pve h SER 48 Ca 0.27 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1pve h SER 48 Cb -0.10 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.33 1pve h SER 48 CO -0.06 0.63 0.00 1.56 -1.14 0.00 0.00 176.83 177.82 1pve h GLN 49 N 0.38 0.00 0.00 3.45 4.20 -1.16 -3.32 115.11 118.66 1pve h GLN 49 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1pve h GLN 49 Cb 0.58 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.36 1pve h GLN 49 CO 0.04 0.00 -0.39 0.72 -0.67 0.00 0.00 178.83 178.52 1pve n HIS 50 N -2.37 0.00 0.32 2.96 8.25 -0.81 -5.02 115.22 118.55 1pve n HIS 50 Ca 0.01 0.00 0.20 0.00 -0.26 0.00 0.00 57.72 57.67 1pve n HIS 50 Cb 0.17 -0.03 1.09 0.00 1.12 0.00 0.00 29.99 32.33 1pve n HIS 50 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 1pve h GLN 51 N 0.00 0.00 -0.97 -0.41 4.15 -1.27 -0.54 115.11 116.07 1pve h GLN 51 Ca 0.00 0.00 0.06 0.00 0.77 0.00 0.00 58.65 59.48 1pve h GLN 51 Cb 1.32 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.94 1pve h GLN 51 CO 0.00 0.00 0.63 1.49 -1.93 0.00 0.00 178.83 179.02 1pve h GLU 52 N 0.00 1.11 -0.60 1.69 4.81 -1.93 -0.80 114.58 118.86 1pve h GLU 52 Ca 0.01 -0.07 -0.10 0.00 -0.13 0.00 0.00 59.36 59.07 1pve h GLU 52 Cb 0.11 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 1pve h GLU 52 CO -0.00 0.73 -0.02 0.45 -0.73 0.00 0.00 179.01 179.44 1pve h HIS 53 N 1.14 1.18 0.19 0.92 3.86 -1.47 -1.92 115.15 119.04 1pve h HIS 53 Ca 0.42 -0.21 -0.01 0.00 -1.16 0.00 0.00 60.37 59.40 1pve h HIS 53 Cb 0.16 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 28.33 1pve h HIS 53 CO -0.00 1.04 -0.09 0.35 0.86 0.00 0.00 177.93 180.09 1pve h PHE 54 N 0.97 -0.23 -0.36 2.45 3.57 -1.51 -1.37 116.94 120.46 1pve h PHE 54 Ca 0.17 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 1pve h PHE 54 Cb 0.59 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.39 1pve h PHE 54 CO 0.04 -0.09 0.13 0.82 -2.23 0.00 0.00 178.31 176.99 1pve h ILE 55 N -0.32 1.15 -0.42 1.41 2.04 -1.15 0.52 117.51 120.74 1pve h ILE 55 Ca -0.03 -0.48 -0.11 0.00 1.00 0.00 0.00 64.86 65.25 1pve h ILE 55 Cb 0.25 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 1pve h ILE 55 CO 0.04 0.18 -0.17 -0.61 0.00 0.00 0.00 178.15 177.59 1pve h GLN 56 N 0.51 0.86 -0.35 2.37 5.75 -1.20 -2.43 115.11 120.62 1pve h GLN 56 Ca 0.13 -0.36 -0.05 0.00 -0.15 0.00 0.00 58.65 58.21 1pve h GLN 56 Cb 0.13 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.63 1pve h GLN 56 CO -0.01 1.00 0.01 0.52 -2.65 0.00 0.00 178.83 177.71 1pve h MET 57 N 0.68 0.61 0.00 1.69 2.86 -0.63 -2.38 114.93 117.76 1pve h MET 57 Ca 0.10 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1pve h MET 57 Cb 0.73 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.33 1pve h MET 57 CO 0.06 0.72 0.37 1.25 1.06 0.00 0.00 176.91 180.36 1pve h LEU 58 N 0.42 0.00 -1.54 1.22 7.12 -0.93 -0.82 115.31 120.79 1pve h LEU 58 Ca 0.10 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.11 1pve h LEU 58 Cb 0.43 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.56 1pve h LEU 58 CO 0.02 0.00 -0.10 0.59 -0.13 0.00 0.00 178.44 178.82 1pve n ASN 59 N -2.68 2.39 -4.78 1.25 3.02 -0.91 -4.82 115.26 108.74 1pve n ASN 59 Ca -0.02 -1.70 -0.33 0.00 -0.03 0.00 0.00 54.58 52.51 1pve n ASN 59 Cb 0.41 0.12 0.05 0.00 -0.61 0.00 0.00 39.78 39.75 1pve n ASN 59 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1pve s GLU 60 N -1.73 2.77 -0.10 3.52 2.02 -0.31 -5.01 118.70 119.86 1pve s GLU 60 Ca 0.21 1.31 -0.29 0.00 0.02 0.00 0.00 54.97 56.21 1pve s GLU 60 Cb 0.16 -1.95 -0.05 0.00 0.10 0.00 0.00 34.13 32.39 1pve s GLU 60 CO 0.30 -1.26 1.61 -1.25 0.02 0.00 0.00 175.26 174.67 1pve s PRO 61 N -4.28 4.10 0.55 0.39 0.04 -1.26 -4.92 135.00 129.62 1pve s PRO 61 Ca 0.65 2.04 0.31 0.00 0.04 0.00 0.00 61.00 64.04 1pve s PRO 61 Cb -0.19 -3.98 1.63 0.00 0.04 0.00 0.00 34.50 32.00 1pve s PRO 61 CO 0.44 -0.93 2.13 -0.39 0.04 0.00 0.00 177.00 178.29 1pve h VAL 62 N 5.69 0.42 0.00 -0.36 -1.51 -1.94 -3.38 116.25 115.17 1pve h VAL 62 Ca -0.37 -0.39 0.00 0.00 -1.23 0.00 0.00 66.70 64.71 1pve h VAL 62 Cb 1.17 1.27 0.00 0.00 -2.13 0.00 0.00 31.29 31.60 1pve h VAL 62 CO 0.96 0.07 0.00 0.00 -1.23 0.00 0.00 177.57 177.38 1pve n GLN 63 N -3.52 0.00 -3.75 5.19 6.02 -1.26 -4.95 117.38 115.10 1pve n GLN 63 Ca -0.02 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.84 1pve n GLN 63 Cb 0.20 -0.29 -0.14 0.00 1.02 0.00 0.00 30.24 31.03 1pve n GLN 63 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1pve s GLU 64 N -1.18 0.11 0.00 -1.09 2.02 -1.26 -5.03 118.70 112.27 1pve s GLU 64 Ca 0.00 0.36 0.00 0.00 0.02 0.00 0.00 54.97 55.35 1pve s GLU 64 Cb 0.00 -0.15 0.00 0.00 0.10 0.00 0.00 34.13 34.08 1pve s GLU 64 CO 0.00 -0.15 0.00 0.00 0.02 0.00 0.00 175.26 175.13 1pve n ALA 65 N 4.07 0.00 0.00 5.21 0.00 -1.26 -4.89 120.51 123.64 1pve n ALA 65 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1pve n ALA 65 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1pve n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pve n GLY 66 N 0.00 -0.28 0.00 0.00 0.00 -1.26 -5.03 105.19 98.62 1pve n GLY 66 Ca 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.04 1pve n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pve n GLY 67 N -0.18 -0.61 0.15 -0.02 0.00 -1.26 -4.91 105.19 98.36 1pve n GLY 67 Ca 0.00 -1.12 0.01 0.00 0.00 0.00 0.00 46.02 44.91 1pve n GLY 67 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1pve h GLN 68 N 0.00 0.00 0.00 1.61 -0.00 -2.03 -3.50 115.11 111.19 1pve h GLN 68 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1pve h GLN 68 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.48 1pve h GLN 68 CO 0.00 0.55 0.00 0.41 0.00 0.00 0.00 178.83 179.79 1pve n GLY 69 N 0.39 -0.58 0.00 2.39 0.00 -1.26 -5.10 105.19 101.04 1pve n GLY 69 Ca -0.01 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.88 1pve n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pve n GLY 70 N -0.52 0.79 0.00 -0.02 0.00 -1.26 -4.98 105.19 99.20 1pve n GLY 70 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1pve n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pve n GLY 71 N 0.00 0.02 0.00 -0.02 0.00 -1.26 -5.29 105.19 98.63 1pve n GLY 71 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1pve n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93