#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pve h SER 2 N 0.00 0.00 -0.48 1.61 0.02 -2.08 -2.25 113.55 110.37 1pve h SER 2 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1pve h SER 2 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1pve h SER 2 CO 0.00 0.00 0.00 1.57 -1.14 0.00 0.00 176.83 177.26 1pve n HIS 3 N -2.94 0.90 -1.67 3.45 -0.00 -1.26 -5.02 115.22 108.68 1pve n HIS 3 Ca -0.03 -0.59 -0.46 0.00 -0.00 0.00 0.00 57.72 56.64 1pve n HIS 3 Cb 0.07 -0.13 -0.04 0.00 -0.00 0.00 0.00 29.99 29.89 1pve n HIS 3 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.34 176.22 1pve n MET 4 N 0.72 2.21 -0.51 1.57 0.00 -0.85 -5.01 117.12 115.25 1pve n MET 4 Ca 0.19 0.80 -0.10 0.00 -0.00 0.00 0.00 57.70 58.60 1pve n MET 4 Cb 0.66 -2.60 0.07 0.00 0.00 0.00 0.00 33.22 31.35 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 4.46 -0.95 -3.26 2.12 -0.04 -1.26 -4.73 135.00 131.33 1pve n PRO 5 Ca 0.19 -0.64 -0.12 0.00 -0.04 0.00 0.00 63.50 62.89 1pve n PRO 5 Cb 0.30 -0.49 0.04 0.00 -0.04 0.00 0.00 33.50 33.30 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 0.00 -5.51 -0.05 1.53 4.77 -1.26 -4.72 117.00 111.75 1pve n LEU 6 Ca 0.05 -0.52 0.23 0.00 -0.03 0.00 0.00 56.01 55.75 1pve n LEU 6 Cb 0.19 -3.06 0.71 0.00 -2.33 0.00 0.00 43.42 38.94 1pve n LEU 6 CO 0.14 -0.32 1.21 1.05 -1.33 0.00 0.00 177.39 178.14 1pve h GLU 7 N -0.54 0.00 0.00 3.23 9.09 -1.98 -0.22 114.58 124.16 1pve h GLU 7 Ca -0.38 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.03 1pve h GLU 7 Cb 1.20 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.30 1pve h GLU 7 CO 0.39 0.00 0.00 1.19 0.05 0.00 0.00 179.01 180.64 1pve n PHE 8 N -4.23 0.00 -0.13 2.06 3.72 -1.26 -2.56 117.46 115.06 1pve n PHE 8 Ca 0.13 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.32 1pve n PHE 8 Cb 0.74 -0.17 -0.11 0.00 -0.94 0.00 0.00 39.48 39.00 1pve n PHE 8 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1pve n LEU 9 N -1.17 2.66 0.25 4.37 4.77 -0.14 -4.57 117.00 123.16 1pve n LEU 9 Ca 0.16 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.27 1pve n LEU 9 Cb 0.17 -0.85 0.66 0.00 -2.33 0.00 0.00 43.42 41.07 1pve n LEU 9 CO 0.19 0.82 0.97 -0.09 -1.33 0.00 0.00 177.39 177.94 1pve h ARG 10 N -0.28 0.00 -0.28 3.23 2.43 -1.35 -2.44 114.38 115.70 1pve h ARG 10 Ca -0.59 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.58 1pve h ARG 10 Cb 1.79 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.34 1pve h ARG 10 CO -0.18 0.00 0.00 0.27 -1.51 0.00 0.00 179.97 178.55 1pve n ASN 11 N -2.50 2.81 -4.03 -3.80 6.94 -1.06 -4.98 115.26 108.64 1pve n ASN 11 Ca -0.02 -2.06 -0.28 0.00 -0.02 0.00 0.00 54.58 52.21 1pve n ASN 11 Cb 0.27 -0.21 -0.17 0.00 -2.36 0.00 0.00 39.78 37.31 1pve n ASN 11 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1pve s GLN 12 N -1.11 2.03 0.54 -3.83 -2.07 -0.92 -5.03 119.66 109.26 1pve s GLN 12 Ca 0.20 -0.49 0.28 0.00 -1.82 0.00 0.00 55.36 53.53 1pve s GLN 12 Cb 0.11 -1.75 1.45 0.00 -1.09 0.00 0.00 33.01 31.73 1pve s GLN 12 CO 0.13 -0.07 1.94 -1.35 -1.32 0.00 0.00 175.29 174.62 1pve h PRO 13 N 7.43 0.00 0.00 9.60 0.11 -1.94 -1.56 132.00 145.65 1pve h PRO 13 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1pve h PRO 13 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1pve h PRO 13 CO 0.48 0.00 0.03 0.37 -0.21 0.00 0.00 178.00 178.66 1pve h GLN 14 N 0.00 0.00 0.00 1.05 4.15 -1.96 -1.73 115.11 116.63 1pve h GLN 14 Ca 0.33 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.72 1pve h GLN 14 Cb 1.34 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 29.02 1pve h GLN 14 CO -0.00 0.00 -0.13 0.35 -1.93 0.00 0.00 178.83 177.12 1pve h PHE 15 N 0.00 0.00 -0.17 3.99 3.57 -1.53 -0.17 116.94 122.63 1pve h PHE 15 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1pve h PHE 15 Cb 0.05 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.79 1pve h PHE 15 CO 0.00 0.13 0.00 1.04 -2.23 0.00 0.00 178.31 177.25 1pve n GLN 16 N -3.32 1.52 0.00 1.11 6.02 -0.65 -4.33 117.38 117.73 1pve n GLN 16 Ca -0.00 -0.80 0.00 0.00 -0.01 0.00 0.00 57.00 56.19 1pve n GLN 16 Cb 0.35 -1.27 0.00 0.00 1.02 0.00 0.00 30.24 30.34 1pve n GLN 16 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1pve n GLN 17 N 0.08 0.00 -0.25 -1.09 6.02 -0.47 -4.72 117.38 116.94 1pve n GLN 17 Ca 0.12 0.00 0.06 0.00 -0.01 0.00 0.00 57.00 57.17 1pve n GLN 17 Cb 0.22 -0.47 0.31 0.00 1.02 0.00 0.00 30.24 31.32 1pve n GLN 17 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1pve h MET 18 N 0.00 0.84 -0.12 -1.09 -0.00 -1.29 -1.62 114.93 111.65 1pve h MET 18 Ca 0.00 -0.05 -0.09 0.00 -0.00 0.00 0.00 59.70 59.56 1pve h MET 18 Cb 0.88 -0.19 -0.01 0.00 -0.00 0.00 0.00 31.60 32.28 1pve h MET 18 CO 0.00 0.55 -0.33 0.00 -0.00 0.00 0.00 176.91 177.13 1pve h ARG 19 N 0.86 0.23 -0.41 -0.10 3.08 -1.83 -2.54 114.38 113.67 1pve h ARG 19 Ca 0.37 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.32 1pve h ARG 19 Cb 0.31 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 1pve h ARG 19 CO -0.14 0.54 0.22 1.96 -1.07 0.00 0.00 179.97 181.49 1pve h GLN 20 N 0.20 0.55 -0.25 0.04 4.20 -1.58 -0.26 115.11 118.01 1pve h GLN 20 Ca 0.03 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 1pve h GLN 20 Cb 0.69 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 1pve h GLN 20 CO 0.05 0.40 0.03 0.82 -0.67 0.00 0.00 178.83 179.47 1pve h ILE 21 N 0.56 1.24 -0.04 2.54 2.04 -1.42 -3.26 117.51 119.16 1pve h ILE 21 Ca 0.15 -0.80 -0.19 0.00 1.00 0.00 0.00 64.86 65.01 1pve h ILE 21 Cb 0.01 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 1pve h ILE 21 CO -0.02 0.25 -0.80 0.40 0.00 0.00 0.00 178.15 177.98 1pve h ILE 22 N 0.22 1.41 0.00 -0.67 1.08 -1.36 -0.01 117.51 118.18 1pve h ILE 22 Ca 0.07 -2.31 0.00 0.00 -0.39 0.00 0.00 64.86 62.24 1pve h ILE 22 Cb 0.35 2.25 0.00 0.00 -3.07 0.00 0.00 36.82 36.35 1pve h ILE 22 CO 0.01 0.69 0.00 0.00 -0.69 0.00 0.00 178.15 178.15 1pve n GLN 23 N -3.78 0.39 0.00 2.37 6.02 -0.15 -1.79 117.38 120.44 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 0.75 -1.36 0.00 0.00 1.02 0.00 0.00 30.24 30.65 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 0.80 -3.74 -1.09 6.02 -1.11 -4.95 117.38 112.45 1pve n GLN 24 Ca 0.07 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.78 1pve n GLN 24 Cb 0.03 -0.76 -0.11 0.00 1.02 0.00 0.00 30.24 30.42 1pve n GLN 24 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1pve s ASN 25 N -2.94 3.75 0.61 1.08 -0.87 -0.03 -4.97 114.94 111.58 1pve s ASN 25 Ca 0.00 -3.62 0.39 0.00 -1.57 0.00 0.00 52.86 48.06 1pve s ASN 25 Cb 0.00 -1.26 1.93 0.00 -0.02 0.00 0.00 41.25 41.90 1pve s ASN 25 CO 0.00 -0.11 2.20 1.55 -2.57 0.00 0.00 177.10 178.17 1pve h PRO 26 N 5.45 0.00 0.00 -0.60 0.13 -1.59 -1.68 132.00 133.72 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 0.61 0.01 0.18 0.66 -0.23 0.00 0.00 178.00 179.23 1pve h SER 27 N 0.00 0.00 -0.33 1.44 4.64 -1.93 -2.10 113.55 115.27 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 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1pve h SER 27 CO 0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 1pve n LEU 28 N -2.83 3.31 -0.07 5.97 4.77 -0.63 -4.45 117.00 123.07 1pve n LEU 28 Ca -0.02 -1.38 -0.07 0.00 -0.03 0.00 0.00 56.01 54.50 1pve n LEU 28 Cb 0.23 -0.21 -0.01 0.00 -2.33 0.00 0.00 43.42 41.11 1pve n LEU 28 CO 0.15 0.69 0.76 0.25 -1.33 0.00 0.00 177.39 177.91 1pve h LEU 29 N 4.40 -0.46 -0.59 2.23 5.85 -1.54 -1.02 115.31 124.18 1pve h LEU 29 Ca 0.00 0.11 0.12 0.00 0.84 0.00 0.00 57.88 58.95 1pve h LEU 29 Cb 0.96 0.26 -0.10 0.00 0.37 0.00 0.00 40.66 42.15 1pve h LEU 29 CO 0.00 -0.17 -0.01 -0.65 -0.34 0.00 0.00 178.44 177.27 1pve h PRO 30 N -0.10 0.10 0.00 5.25 0.11 -1.82 -1.72 132.00 133.82 1pve h PRO 30 Ca 0.15 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1pve h PRO 30 Cb 0.32 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.41 1pve h PRO 30 CO -0.35 0.07 0.00 0.00 -0.21 0.00 0.00 178.00 177.51 1pve n ALA 31 N -2.79 1.49 -0.06 -0.75 0.00 -0.79 -0.72 120.51 116.89 1pve n ALA 31 Ca 0.08 0.07 -0.20 0.00 0.00 0.00 0.00 53.44 53.39 1pve n ALA 31 Cb 0.33 -1.30 -0.13 0.00 0.00 0.00 0.00 19.45 18.35 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 2.77 -0.18 0.00 7.94 -0.45 -3.25 117.00 121.82 1pve n LEU 32 Ca 0.02 0.06 -0.06 0.00 -1.11 0.00 0.00 56.01 54.91 1pve n LEU 32 Cb 0.16 -1.02 0.04 0.00 0.53 0.00 0.00 43.42 43.12 1pve n LEU 32 CO 0.15 0.88 1.08 -0.07 -1.11 0.00 0.00 177.39 178.32 1pve h LEU 33 N 0.01 0.56 -2.17 -1.96 3.38 -1.04 0.18 115.31 114.28 1pve h LEU 33 Ca -0.50 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.46 1pve h LEU 33 Cb 1.96 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 42.58 1pve h LEU 33 CO -0.00 0.40 -0.05 1.56 0.09 0.00 0.00 178.44 180.44 1pve h GLN 34 N 0.67 0.00 0.01 1.13 1.08 -1.10 -0.72 115.11 116.18 1pve h GLN 34 Ca 0.21 0.00 -0.29 0.00 -1.45 0.00 0.00 58.65 57.12 1pve h GLN 34 Cb -0.02 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.36 1pve h GLN 34 CO -0.07 0.05 -1.65 0.37 -0.95 0.00 0.00 178.83 176.57 1pve h GLN 35 N 0.00 0.02 -0.98 1.46 4.15 -1.22 -3.18 115.11 115.36 1pve h GLN 35 Ca -0.00 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.40 1pve h GLN 35 Cb 0.26 0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.91 1pve h GLN 35 CO 0.01 0.59 0.65 0.82 -1.93 0.00 0.00 178.83 178.97 1pve h ILE 36 N 0.01 1.25 0.00 2.39 2.04 -0.43 -0.29 117.51 122.48 1pve h ILE 36 Ca -0.27 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.14 1pve h ILE 36 Cb 1.99 -0.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.88 1pve h ILE 36 CO 0.09 0.24 0.00 0.61 0.00 0.00 0.00 178.15 179.09 1pve n GLY 37 N -1.38 -0.15 0.00 5.37 0.00 -0.30 -0.25 105.19 108.48 1pve n GLY 37 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1pve n GLY 37 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1pve n ARG 38 N -0.64 2.59 -0.08 1.61 1.85 -0.26 -4.59 116.66 117.14 1pve n ARG 38 Ca 0.01 0.00 -0.12 0.00 -1.00 0.00 0.00 57.85 56.74 1pve n ARG 38 Cb 0.00 -0.89 -0.15 0.00 -1.05 0.00 0.00 32.46 30.38 1pve n ARG 38 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1pve n GLU 39 N -1.51 0.68 -2.96 2.89 1.02 -0.39 -4.79 120.64 115.57 1pve n GLU 39 Ca 0.00 0.11 -0.14 0.00 -0.02 0.00 0.00 57.16 57.11 1pve n GLU 39 Cb 0.27 -1.60 -0.01 0.00 -0.02 0.00 0.00 31.44 30.09 1pve n GLU 39 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1pve n ASN 40 N -2.97 -1.85 -0.12 1.62 2.85 0.65 -5.02 115.26 110.42 1pve n ASN 40 Ca -0.32 -2.94 0.27 0.00 -0.11 0.00 0.00 54.58 51.49 1pve n ASN 40 Cb 1.10 0.83 0.65 0.00 1.24 0.00 0.00 39.78 43.59 1pve n ASN 40 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1pve h PRO 41 N 4.40 0.00 0.20 1.20 0.11 -1.76 -1.19 132.00 134.96 1pve h PRO 41 Ca 0.01 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.82 1pve h PRO 41 Cb 0.99 0.00 0.03 0.00 0.11 0.00 0.00 31.00 32.13 1pve h PRO 41 CO 0.31 0.00 -1.26 1.96 -0.21 0.00 0.00 178.00 178.80 1pve h GLN 42 N 0.00 0.51 -0.48 1.05 4.20 -1.95 -2.55 115.11 115.89 1pve h GLN 42 Ca 0.40 -0.81 0.00 0.00 0.06 0.00 0.00 58.65 58.30 1pve h GLN 42 Cb 2.05 0.29 -0.02 0.00 0.30 0.00 0.00 27.48 30.10 1pve h GLN 42 CO -0.00 1.38 0.30 1.25 -0.67 0.00 0.00 178.83 181.09 1pve h LEU 43 N 0.06 0.55 0.07 1.46 5.85 -1.69 -2.29 115.31 119.32 1pve h LEU 43 Ca -0.21 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.48 1pve h LEU 43 Cb 1.98 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.87 1pve h LEU 43 CO 0.24 0.41 -0.03 0.25 -0.34 0.00 0.00 178.44 178.97 1pve h LEU 44 N 0.65 -0.07 -1.79 2.25 7.12 -1.19 0.19 115.31 122.47 1pve h LEU 44 Ca 0.17 -0.28 0.13 0.00 0.13 0.00 0.00 57.88 58.04 1pve h LEU 44 Cb -0.06 0.02 -0.03 0.00 -0.53 0.00 0.00 40.66 40.06 1pve h LEU 44 CO -0.04 0.24 0.40 1.56 -0.13 0.00 0.00 178.44 180.48 1pve h GLN 45 N -0.40 0.21 0.16 1.25 4.20 -1.46 -0.57 115.11 118.50 1pve h GLN 45 Ca -0.01 -0.01 -0.31 0.00 0.06 0.00 0.00 58.65 58.38 1pve h GLN 45 Cb 0.35 -0.05 0.03 0.00 0.30 0.00 0.00 27.48 28.11 1pve h GLN 45 CO 0.01 0.14 -1.31 1.96 -0.67 0.00 0.00 178.83 178.96 1pve h GLN 46 N 0.22 0.58 -0.73 1.46 4.20 -0.97 -3.25 115.11 116.62 1pve h GLN 46 Ca 0.28 -0.84 0.01 0.00 0.06 0.00 0.00 58.65 58.16 1pve h GLN 46 Cb 0.80 0.29 -0.04 0.00 0.30 0.00 0.00 27.48 28.83 1pve h GLN 46 CO -0.05 1.39 0.48 0.82 -0.67 0.00 0.00 178.83 180.80 1pve h ILE 47 N 0.23 1.17 0.00 2.54 2.04 -0.24 -0.75 117.51 122.50 1pve h ILE 47 Ca -0.20 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.32 1pve h ILE 47 Cb 1.99 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.19 1pve h ILE 47 CO 0.25 0.18 0.00 -1.20 0.00 0.00 0.00 178.15 177.37 1pve n SER 48 N -4.43 0.00 -0.21 1.72 7.64 -0.26 -1.14 113.62 116.95 1pve n SER 48 Ca 0.08 0.48 0.03 0.00 1.01 0.00 0.00 58.87 60.48 1pve n SER 48 Cb 0.05 -0.49 0.01 0.00 -1.01 0.00 0.00 64.21 62.77 1pve n SER 48 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1pve n GLN 49 N -1.49 1.34 -1.54 1.43 6.02 -0.35 -4.61 117.38 118.18 1pve n GLN 49 Ca 0.02 -0.67 0.04 0.00 -0.01 0.00 0.00 57.00 56.37 1pve n GLN 49 Cb 0.07 -1.04 0.03 0.00 1.02 0.00 0.00 30.24 30.32 1pve n GLN 49 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1pve n HIS 50 N -0.03 0.09 0.12 1.08 8.25 -0.78 -5.01 115.22 118.94 1pve n HIS 50 Ca 0.03 -0.66 0.02 0.00 -0.26 0.00 0.00 57.72 56.85 1pve n HIS 50 Cb 0.16 -0.16 0.36 0.00 1.12 0.00 0.00 29.99 31.47 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 1.11 0.23 0.00 -0.41 5.75 -1.38 -0.52 115.11 119.88 1pve h GLN 51 Ca -0.21 -0.06 -0.19 0.00 -0.15 0.00 0.00 58.65 58.04 1pve h GLN 51 Cb 1.81 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 30.32 1pve h GLN 51 CO 0.10 0.41 -0.86 1.05 -2.65 0.00 0.00 178.83 176.88 1pve h GLU 52 N 0.21 0.14 -0.22 1.69 9.09 -1.95 -2.16 114.58 121.39 1pve h GLU 52 Ca 0.04 -0.15 -0.18 0.00 0.05 0.00 0.00 59.36 59.11 1pve h GLU 52 Cb 0.45 0.05 -0.00 0.00 -1.65 0.00 0.00 28.75 27.60 1pve h GLU 52 CO 0.03 0.92 -0.60 0.45 0.05 0.00 0.00 179.01 179.86 1pve h HIS 53 N 0.08 0.92 0.31 2.06 3.86 -1.66 -1.89 115.15 118.82 1pve h HIS 53 Ca -0.03 -0.34 -0.02 0.00 -1.16 0.00 0.00 60.37 58.82 1pve h HIS 53 Cb 1.50 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 29.80 1pve h HIS 53 CO 0.02 1.14 -0.15 0.35 0.86 0.00 0.00 177.93 180.15 1pve h PHE 54 N 0.54 -0.39 -0.30 2.45 3.57 -1.19 -2.47 116.94 119.15 1pve h PHE 54 Ca -0.00 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 1pve h PHE 54 Cb 1.19 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 40.04 1pve h PHE 54 CO 0.06 -0.24 0.18 0.82 -2.23 0.00 0.00 178.31 176.91 1pve h ILE 55 N -0.42 1.08 -0.30 1.41 2.04 -1.36 0.45 117.51 120.41 1pve h ILE 55 Ca -0.04 -0.18 -0.07 0.00 1.00 0.00 0.00 64.86 65.56 1pve h ILE 55 Cb 0.32 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 1pve h ILE 55 CO 0.07 0.09 -0.10 1.56 0.00 0.00 0.00 178.15 179.76 1pve h GLN 56 N 0.40 0.60 -0.24 2.37 4.20 -1.29 -0.92 115.11 120.24 1pve h GLN 56 Ca 0.11 -0.24 -0.11 0.00 0.06 0.00 0.00 58.65 58.47 1pve h GLN 56 Cb -0.02 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 1pve h GLN 56 CO -0.02 0.81 -0.31 0.52 -0.67 0.00 0.00 178.83 179.16 1pve h MET 57 N 0.36 0.49 -0.67 1.46 2.86 -0.87 -0.55 114.93 118.01 1pve h MET 57 Ca 0.07 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.49 1pve h MET 57 Cb 0.61 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.22 1pve h MET 57 CO 0.04 0.75 0.39 1.25 1.06 0.00 0.00 176.91 180.39 1pve h LEU 58 N 0.43 0.81 -0.14 1.22 7.12 -0.95 -3.01 115.31 120.78 1pve h LEU 58 Ca 0.05 -0.05 -0.22 0.00 0.13 0.00 0.00 57.88 57.79 1pve h LEU 58 Cb 0.75 -0.21 -0.00 0.00 -0.53 0.00 0.00 40.66 40.67 1pve h LEU 58 CO 0.06 0.64 -0.98 0.78 -0.13 0.00 0.00 178.44 178.81 1pve h ASN 59 N 0.93 0.37 -4.16 1.25 2.35 -0.72 -3.46 115.58 112.14 1pve h ASN 59 Ca 0.24 -0.33 -0.53 0.00 -0.55 0.00 0.00 56.30 55.13 1pve h ASN 59 Cb -0.01 -0.12 0.15 0.00 0.05 0.00 0.00 38.32 38.40 1pve h ASN 59 CO -0.04 1.16 0.41 -1.61 -1.65 0.00 0.00 177.43 175.70 1pve s GLU 60 N -3.09 2.31 0.77 0.81 0.41 -0.25 -5.01 118.70 114.65 1pve s GLU 60 Ca -0.04 1.77 -0.11 0.00 -0.41 0.00 0.00 54.97 56.18 1pve s GLU 60 Cb 0.09 -1.85 0.06 0.00 -1.78 0.00 0.00 34.13 30.64 1pve s GLU 60 CO 0.85 -1.71 1.10 -1.25 -0.49 0.00 0.00 175.26 173.77 1pve s PRO 61 N -3.82 2.23 0.00 0.39 0.04 -1.26 -4.95 135.00 127.63 1pve s PRO 61 Ca 0.75 1.24 0.28 0.00 0.04 0.00 0.00 61.00 63.30 1pve s PRO 61 Cb -0.29 -1.89 0.97 0.00 0.04 0.00 0.00 34.50 33.33 1pve s PRO 61 CO 0.43 -1.68 1.74 1.33 0.04 0.00 0.00 177.00 178.86 1pve n VAL 62 N -3.42 0.00 -3.72 -0.36 0.24 -1.26 -4.87 118.33 104.93 1pve n VAL 62 Ca 0.10 -0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.27 1pve n VAL 62 Cb 0.53 -0.20 -0.11 0.00 -1.47 0.00 0.00 33.84 32.59 1pve n VAL 62 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1pve s GLN 63 N -2.97 0.39 0.70 7.34 2.00 -1.26 -4.87 119.66 120.99 1pve s GLN 63 Ca 0.14 0.63 -0.09 0.00 -2.00 0.00 0.00 55.36 54.04 1pve s GLN 63 Cb 0.18 0.07 0.04 0.00 0.80 0.00 0.00 33.01 34.11 1pve s GLN 63 CO 0.59 -0.11 1.04 -1.21 -0.50 0.00 0.00 175.29 175.10 1pve s GLU 64 N 0.83 2.51 0.16 1.67 2.02 -1.26 -4.99 118.70 119.65 1pve s GLU 64 Ca -0.05 0.08 0.13 0.00 0.02 0.00 0.00 54.97 55.15 1pve s GLU 64 Cb -0.06 -2.11 0.64 0.00 0.10 0.00 0.00 34.13 32.71 1pve s GLU 64 CO -0.06 -1.12 1.39 0.00 0.02 0.00 0.00 175.26 175.48 1pve n ALA 65 N -2.94 1.14 -3.70 5.21 0.00 -1.26 -4.79 120.51 114.16 1pve n ALA 65 Ca 0.07 0.09 -0.02 0.00 0.00 0.00 0.00 53.44 53.57 1pve n ALA 65 Cb 0.59 -1.19 -0.01 0.00 0.00 0.00 0.00 19.45 18.84 1pve n ALA 65 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1pve s GLY 66 N -3.29 -0.29 -0.04 0.00 0.00 -1.26 -5.10 107.32 97.35 1pve s GLY 66 Ca -0.00 0.35 0.01 0.00 0.00 0.00 0.00 44.72 45.08 1pve s GLY 66 CO 0.14 0.06 0.62 0.61 0.00 0.00 0.00 173.10 174.53 1pve n GLY 67 N -0.46 -0.66 3.27 0.20 0.00 -1.26 -5.18 105.19 101.10 1pve n GLY 67 Ca -0.07 -0.02 -0.15 0.00 0.00 0.00 0.00 46.02 45.79 1pve n GLY 67 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1pve s GLN 68 N 0.01 1.18 -0.01 1.61 1.11 -1.26 -5.17 119.66 117.12 1pve s GLN 68 Ca 0.01 -1.57 -0.18 0.00 0.01 0.00 0.00 55.36 53.62 1pve s GLN 68 Cb 0.05 -0.39 0.06 0.00 -1.01 0.00 0.00 33.01 31.72 1pve s GLN 68 CO -0.01 -0.11 0.84 0.41 0.01 0.00 0.00 175.29 176.42 1pve n GLY 69 N -0.29 0.36 1.08 3.09 0.00 -1.26 -5.05 105.19 103.12 1pve n GLY 69 Ca -0.06 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 44.98 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 -0.60 0.75 0.85 -0.02 0.00 -1.26 -4.89 105.19 100.02 1pve n GLY 70 Ca 0.03 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.41 0.67 0.00 -0.02 0.00 -1.26 -5.40 105.19 96.78 1pve n GLY 71 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1pve n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93