#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 0.06 1.61 4.64 -2.11 -1.69 113.55 116.06 1pve h SER 2 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1pve h SER 2 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1pve h SER 2 CO 0.00 0.00 -0.00 1.12 -0.87 0.00 0.00 176.83 177.08 1pve h HIS 3 N 0.00 0.00 -2.75 4.77 -0.00 -2.08 -3.49 115.15 111.59 1pve h HIS 3 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 60.37 60.45 1pve h HIS 3 Cb 0.08 0.00 -0.05 0.00 -0.00 0.00 0.00 27.41 27.44 1pve h HIS 3 CO 0.00 0.00 -0.80 -1.33 -0.00 0.00 0.00 177.93 175.80 1pve n MET 4 N -3.29 -2.91 -1.66 5.12 2.00 -0.64 -4.90 117.12 110.84 1pve n MET 4 Ca -0.03 2.30 -0.30 0.00 0.00 0.00 0.00 57.70 59.67 1pve n MET 4 Cb 0.09 -2.99 0.09 0.00 0.00 0.00 0.00 33.22 30.42 1pve n MET 4 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 1pve s PRO 5 N -4.73 1.96 -1.57 0.03 0.04 -1.26 -4.45 135.00 125.02 1pve s PRO 5 Ca 0.00 0.44 -0.11 0.00 0.04 0.00 0.00 61.00 61.37 1pve s PRO 5 Cb 0.00 -1.92 0.09 0.00 0.04 0.00 0.00 34.50 32.71 1pve s PRO 5 CO 0.00 -1.66 0.68 1.28 0.04 0.00 0.00 177.00 177.34 1pve n LEU 6 N -3.43 -2.04 0.10 -3.56 4.77 -1.26 -4.86 117.00 106.72 1pve n LEU 6 Ca 0.07 -0.97 0.17 0.00 -0.03 0.00 0.00 56.01 55.25 1pve n LEU 6 Cb 0.58 -2.21 0.72 0.00 -2.33 0.00 0.00 43.42 40.17 1pve n LEU 6 CO 0.57 0.37 1.16 -0.33 -1.33 0.00 0.00 177.39 177.83 1pve h GLU 7 N -1.72 0.00 0.00 3.23 5.08 -1.91 -1.35 114.58 117.91 1pve h GLU 7 Ca -0.60 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.76 1pve h GLU 7 Cb 1.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.63 1pve h GLU 7 CO 0.71 0.00 0.00 1.97 -1.00 0.00 0.00 179.01 180.69 1pve n PHE 8 N -4.23 0.00 0.02 4.33 -1.74 -1.26 -1.41 117.46 113.16 1pve n PHE 8 Ca 0.06 0.00 0.11 0.00 -0.56 0.00 0.00 57.45 57.05 1pve n PHE 8 Cb 0.46 -0.38 -0.13 0.00 1.52 0.00 0.00 39.48 40.95 1pve n PHE 8 CO 0.00 0.00 0.00 1.28 -0.56 0.00 0.00 176.76 177.48 1pve n LEU 9 N -1.38 0.23 0.00 5.98 4.77 -0.51 -4.80 117.00 121.29 1pve n LEU 9 Ca 0.03 0.09 0.03 0.00 -0.03 0.00 0.00 56.01 56.13 1pve n LEU 9 Cb 0.07 -0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.32 1pve n LEU 9 CO 0.06 -0.04 0.58 -1.14 -1.33 0.00 0.00 177.39 175.53 1pve n ARG 10 N -2.38 0.04 0.00 3.23 0.63 -0.50 -1.21 116.66 116.47 1pve n ARG 10 Ca -0.04 0.32 0.00 0.00 -0.92 0.00 0.00 57.85 57.21 1pve n ARG 10 Cb 0.58 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.99 1pve n ARG 10 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1pve n ASN 11 N -1.41 0.37 -4.74 6.15 2.85 -1.26 -5.02 115.26 112.20 1pve n ASN 11 Ca 0.02 -1.18 -0.41 0.00 -0.11 0.00 0.00 54.58 52.91 1pve n ASN 11 Cb 0.07 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.05 1pve n ASN 11 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1pve s GLN 12 N -0.18 4.55 0.37 1.20 -1.52 -0.35 -4.93 119.66 118.81 1pve s GLN 12 Ca 0.00 1.83 0.13 0.00 -1.95 0.00 0.00 55.36 55.37 1pve s GLN 12 Cb 0.00 -3.23 0.96 0.00 -0.22 0.00 0.00 33.01 30.52 1pve s GLN 12 CO 0.00 0.03 1.81 -1.35 -0.25 0.00 0.00 175.29 175.53 1pve h PRO 13 N 4.73 0.53 0.01 2.91 0.11 -2.00 -1.34 132.00 136.95 1pve h PRO 13 Ca -0.45 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 65.43 1pve h PRO 13 Cb 1.21 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1pve h PRO 13 CO 0.71 0.35 -0.93 -0.56 -0.21 0.00 0.00 178.00 177.36 1pve h GLN 14 N 0.54 0.08 0.00 1.05 -0.00 -1.95 -3.29 115.11 111.54 1pve h GLN 14 Ca 0.54 -0.10 -0.06 0.00 -0.00 0.00 0.00 58.65 59.02 1pve h GLN 14 Cb 1.15 0.03 -0.01 0.00 -0.00 0.00 0.00 27.48 28.65 1pve h GLN 14 CO -0.28 0.95 -0.31 0.35 -0.00 0.00 0.00 178.83 179.54 1pve h PHE 15 N 0.04 0.00 0.00 0.06 3.57 -1.55 -0.45 116.94 118.60 1pve h PHE 15 Ca -0.03 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.47 1pve h PHE 15 Cb 1.61 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.35 1pve h PHE 15 CO 0.01 0.31 0.00 1.04 -2.23 0.00 0.00 178.31 177.44 1pve n GLN 16 N -3.34 0.02 0.00 1.11 6.02 -0.87 -4.38 117.38 115.94 1pve n GLN 16 Ca 0.01 0.27 0.00 0.00 -0.01 0.00 0.00 57.00 57.27 1pve n GLN 16 Cb 0.54 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.30 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 -1.47 0.00 -0.16 -1.09 6.02 -0.77 -4.75 117.38 115.16 1pve n GLN 17 Ca 0.03 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 57.09 1pve n GLN 17 Cb 0.14 -0.47 0.37 0.00 1.02 0.00 0.00 30.24 31.30 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 0.69 -0.21 -1.09 -0.00 -1.31 -1.39 114.93 111.62 1pve h MET 18 Ca 0.00 -0.04 -0.08 0.00 -0.00 0.00 0.00 59.70 59.57 1pve h MET 18 Cb 0.72 -0.15 -0.01 0.00 -0.00 0.00 0.00 31.60 32.15 1pve h MET 18 CO 0.00 0.45 -0.24 0.00 -0.00 0.00 0.00 176.91 177.12 1pve h ARG 19 N 0.71 0.38 -0.13 -0.10 3.08 -1.83 -2.62 114.38 113.87 1pve h ARG 19 Ca 0.30 -0.13 -0.04 0.00 0.07 0.00 0.00 59.98 60.18 1pve h ARG 19 Cb 0.28 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1pve h ARG 19 CO -0.10 0.60 -0.09 1.96 -1.07 0.00 0.00 179.97 181.27 1pve h GLN 20 N 0.34 0.20 -0.22 0.04 4.20 -1.54 -0.74 115.11 117.38 1pve h GLN 20 Ca 0.05 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 1pve h GLN 20 Cb 0.61 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 1pve h GLN 20 CO 0.04 0.30 0.03 0.82 -0.67 0.00 0.00 178.83 179.36 1pve h ILE 21 N 0.19 1.23 -0.12 2.54 2.04 -1.41 -3.22 117.51 118.76 1pve h ILE 21 Ca 0.04 -0.76 -0.14 0.00 1.00 0.00 0.00 64.86 65.00 1pve h ILE 21 Cb 0.29 1.30 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 1pve h ILE 21 CO 0.01 0.24 -0.53 0.40 0.00 0.00 0.00 178.15 178.27 1pve h ILE 22 N 0.17 1.35 0.00 -0.67 1.08 -1.38 -0.09 117.51 117.97 1pve h ILE 22 Ca 0.07 -1.80 0.00 0.00 -0.39 0.00 0.00 64.86 62.74 1pve h ILE 22 Cb 0.33 1.84 0.00 0.00 -3.07 0.00 0.00 36.82 35.92 1pve h ILE 22 CO 0.00 0.54 0.00 0.00 -0.69 0.00 0.00 178.15 178.01 1pve n GLN 23 N -3.94 0.32 0.00 2.37 6.02 -0.32 -1.77 117.38 120.05 1pve n GLN 23 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 1pve n GLN 23 Cb 0.57 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.37 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 -0.97 1.13 -3.70 -1.09 6.02 -0.98 -4.94 117.38 112.85 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 -0.81 -0.11 0.00 1.02 0.00 0.00 30.24 30.37 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 -2.98 3.51 0.60 1.08 -0.87 -0.08 -4.97 114.94 111.23 1pve s ASN 25 Ca 0.00 -3.51 0.38 0.00 -1.57 0.00 0.00 52.86 48.16 1pve s ASN 25 Cb 0.00 -1.16 1.84 0.00 -0.02 0.00 0.00 41.25 41.91 1pve s ASN 25 CO 0.00 -0.12 2.17 1.55 -2.57 0.00 0.00 177.10 178.12 1pve h PRO 26 N 5.55 0.00 0.00 -0.60 0.13 -1.59 -1.66 132.00 133.82 1pve h PRO 26 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1pve h PRO 26 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1pve h PRO 26 CO 0.58 0.02 0.18 0.66 -0.23 0.00 0.00 178.00 179.21 1pve h SER 27 N 0.00 0.00 -0.38 1.44 4.64 -1.93 -2.09 113.55 115.22 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 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 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 -2.81 3.43 -0.04 5.97 4.77 -0.62 -4.45 117.00 123.25 1pve n LEU 28 Ca -0.02 -1.47 -0.08 0.00 -0.03 0.00 0.00 56.01 54.41 1pve n LEU 28 Cb 0.23 -0.25 -0.02 0.00 -2.33 0.00 0.00 43.42 41.06 1pve n LEU 28 CO 0.14 0.74 0.77 0.25 -1.33 0.00 0.00 177.39 177.96 1pve h LEU 29 N 4.45 -0.45 -0.62 2.23 5.85 -1.53 -0.95 115.31 124.29 1pve h LEU 29 Ca 0.00 0.10 0.13 0.00 0.84 0.00 0.00 57.88 58.95 1pve h LEU 29 Cb 0.98 0.24 -0.10 0.00 0.37 0.00 0.00 40.66 42.14 1pve h LEU 29 CO 0.00 -0.18 -0.00 -0.65 -0.34 0.00 0.00 178.44 177.27 1pve h PRO 30 N -0.12 0.11 0.00 5.25 0.11 -1.82 -1.48 132.00 134.05 1pve h PRO 30 Ca 0.13 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.23 1pve h PRO 30 Cb 0.31 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.40 1pve h PRO 30 CO -0.30 0.07 0.00 0.00 -0.21 0.00 0.00 178.00 177.56 1pve n ALA 31 N -2.81 1.68 -0.12 -0.75 0.00 -0.81 -0.83 120.51 116.87 1pve n ALA 31 Ca 0.09 -0.05 -0.16 0.00 0.00 0.00 0.00 53.44 53.31 1pve n ALA 31 Cb 0.35 -1.21 -0.11 0.00 0.00 0.00 0.00 19.45 18.48 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 -1.39 2.75 -0.33 0.00 7.94 -0.43 -3.70 117.00 121.84 1pve n LEU 32 Ca 0.05 -0.12 0.00 0.00 -1.11 0.00 0.00 56.01 54.83 1pve n LEU 32 Cb 0.13 -0.74 0.14 0.00 0.53 0.00 0.00 43.42 43.48 1pve n LEU 32 CO 0.11 0.87 1.22 -0.07 -1.11 0.00 0.00 177.39 178.41 1pve h LEU 33 N 0.00 0.92 -1.23 -1.96 3.38 -1.06 0.80 115.31 116.16 1pve h LEU 33 Ca -0.53 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.45 1pve h LEU 33 Cb 1.86 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 42.38 1pve h LEU 33 CO -0.07 0.60 0.48 1.56 0.09 0.00 0.00 178.44 181.10 1pve h GLN 34 N 1.06 1.00 -0.02 1.13 1.08 -1.19 -0.81 115.11 117.36 1pve h GLN 34 Ca 0.38 -0.07 -0.21 0.00 -1.45 0.00 0.00 58.65 57.30 1pve h GLN 34 Cb 0.11 -0.22 -0.00 0.00 -0.05 0.00 0.00 27.48 27.32 1pve h GLN 34 CO -0.15 0.68 -0.88 1.96 -0.95 0.00 0.00 178.83 179.48 1pve h GLN 35 N 1.03 0.39 -0.96 1.46 4.20 -1.26 -2.52 115.11 117.45 1pve h GLN 35 Ca 0.27 -0.40 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1pve h GLN 35 Cb -0.09 0.11 -0.05 0.00 0.30 0.00 0.00 27.48 27.75 1pve h GLN 35 CO -0.06 1.06 0.62 0.82 -0.67 0.00 0.00 178.83 180.60 1pve h ILE 36 N 0.23 1.25 0.00 2.54 2.04 -0.76 -0.53 117.51 122.28 1pve h ILE 36 Ca -0.06 -0.50 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 1pve h ILE 36 Cb 1.50 -0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 37.44 1pve h ILE 36 CO 0.15 0.25 -0.02 1.23 0.00 0.00 0.00 178.15 179.76 1pve h GLY 37 N 1.31 0.00 0.74 5.37 0.00 -0.80 0.27 103.07 109.95 1pve h GLY 37 Ca 0.35 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.38 1pve h GLY 37 CO -0.07 0.00 -1.46 3.21 0.00 0.00 0.00 176.54 178.21 1pve h ARG 38 N 0.00 0.32 0.04 4.80 2.47 -0.90 -3.34 114.38 117.77 1pve h ARG 38 Ca -0.00 -0.55 -0.30 0.00 -1.26 0.00 0.00 59.98 57.87 1pve h ARG 38 Cb 0.08 0.21 -0.04 0.00 -1.65 0.00 0.00 29.97 28.57 1pve h ARG 38 CO 0.00 1.26 -1.70 0.93 0.56 0.00 0.00 179.97 181.03 1pve h GLU 39 N -0.14 0.08 -0.85 0.04 4.39 -0.90 -3.43 114.58 113.76 1pve h GLU 39 Ca -0.30 -0.14 -0.32 0.00 0.34 0.00 0.00 59.36 58.95 1pve h GLU 39 Cb 1.89 0.05 -0.22 0.00 -0.10 0.00 0.00 28.75 30.37 1pve h GLU 39 CO 0.12 0.74 -0.68 -1.71 -1.16 0.00 0.00 179.01 176.33 1pve n ASN 40 N -3.20 -2.09 0.31 1.42 2.85 0.91 -5.02 115.26 110.45 1pve n ASN 40 Ca -0.19 -3.01 0.20 0.00 -0.11 0.00 0.00 54.58 51.46 1pve n ASN 40 Cb 1.04 1.05 1.04 0.00 1.24 0.00 0.00 39.78 44.15 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 4.32 0.00 0.02 1.20 0.13 -1.66 -0.90 132.00 135.12 1pve h PRO 41 Ca -0.02 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.88 1pve h PRO 41 Cb 1.00 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.15 1pve h PRO 41 CO 0.30 0.00 -0.88 1.96 -0.23 0.00 0.00 178.00 179.16 1pve h GLN 42 N 0.00 0.55 -0.53 0.86 4.20 -1.93 -2.29 115.11 115.97 1pve h GLN 42 Ca 0.00 -0.63 -0.02 0.00 0.06 0.00 0.00 58.65 58.07 1pve h GLN 42 Cb 0.17 0.19 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 1pve h GLN 42 CO 0.00 1.24 0.27 1.25 -0.67 0.00 0.00 178.83 180.92 1pve h LEU 43 N 0.13 0.66 0.09 1.46 5.85 -1.66 -2.28 115.31 119.56 1pve h LEU 43 Ca -0.12 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.54 1pve h LEU 43 Cb 1.57 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.43 1pve h LEU 43 CO 0.17 0.56 -0.05 0.25 -0.34 0.00 0.00 178.44 179.03 1pve h LEU 44 N 0.74 -0.11 -1.58 2.25 7.12 -1.13 0.13 115.31 122.73 1pve h LEU 44 Ca 0.19 -0.29 0.12 0.00 0.13 0.00 0.00 57.88 58.03 1pve h LEU 44 Cb 0.06 0.03 -0.04 0.00 -0.53 0.00 0.00 40.66 40.18 1pve h LEU 44 CO -0.03 0.24 0.45 1.56 -0.13 0.00 0.00 178.44 180.53 1pve h GLN 45 N -0.46 0.44 -0.15 1.25 4.20 -1.46 -0.16 115.11 118.75 1pve h GLN 45 Ca -0.01 -0.03 -0.14 0.00 0.06 0.00 0.00 58.65 58.53 1pve h GLN 45 Cb 0.39 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.07 1pve h GLN 45 CO 0.02 0.29 -0.46 1.96 -0.67 0.00 0.00 178.83 179.97 1pve h GLN 46 N 0.45 0.58 -0.79 1.46 4.20 -0.99 -2.54 115.11 117.48 1pve h GLN 46 Ca 0.32 -0.42 0.01 0.00 0.06 0.00 0.00 58.65 58.62 1pve h GLN 46 Cb 0.64 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.45 1pve h GLN 46 CO -0.10 1.04 0.52 0.82 -0.67 0.00 0.00 178.83 180.44 1pve h ILE 47 N 0.23 1.19 -0.86 2.54 2.04 -0.37 -1.81 117.51 120.46 1pve h ILE 47 Ca -0.01 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 1pve h ILE 47 Cb 1.08 0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 1pve h ILE 47 CO 0.10 0.19 0.42 -1.28 0.00 0.00 0.00 178.15 177.58 1pve h SER 48 N 1.05 1.12 0.96 1.72 0.87 -1.01 -0.17 113.55 118.10 1pve h SER 48 Ca 0.29 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 1pve h SER 48 Cb -0.10 -0.29 0.00 0.00 -0.44 0.00 0.00 62.40 61.57 1pve h SER 48 CO -0.07 0.94 0.00 1.56 -0.53 0.00 0.00 176.83 178.73 1pve h GLN 49 N 1.23 0.00 0.00 2.24 4.20 -0.97 -3.33 115.11 118.47 1pve h GLN 49 Ca 0.30 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.94 1pve h GLN 49 Cb 0.11 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 27.74 1pve h GLN 49 CO -0.04 0.00 -0.64 0.72 -0.67 0.00 0.00 178.83 178.21 1pve n HIS 50 N -2.44 0.00 -0.11 2.96 8.25 -0.73 -4.98 115.22 118.16 1pve n HIS 50 Ca 0.02 -0.54 0.00 0.00 -0.26 0.00 0.00 57.72 56.95 1pve n HIS 50 Cb 0.29 -0.13 0.28 0.00 1.12 0.00 0.00 29.99 31.55 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 0.52 0.77 0.00 -0.41 4.15 -1.16 -0.81 115.11 118.16 1pve h GLN 51 Ca -0.09 -0.09 -0.05 0.00 0.77 0.00 0.00 58.65 59.19 1pve h GLN 51 Cb 1.48 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 29.01 1pve h GLN 51 CO 0.04 0.59 -0.24 0.93 -1.93 0.00 0.00 178.83 178.22 1pve h GLU 52 N 0.77 0.00 0.24 1.69 5.08 -1.93 -0.27 114.58 120.17 1pve h GLU 52 Ca 0.19 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.22 1pve h GLU 52 Cb 0.07 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.35 1pve h GLU 52 CO -0.03 0.24 -1.49 0.45 -1.00 0.00 0.00 179.01 177.19 1pve h HIS 53 N 0.00 0.92 -0.01 4.33 3.86 -1.56 -3.25 115.15 119.44 1pve h HIS 53 Ca -0.00 -0.67 -0.00 0.00 -1.16 0.00 0.00 60.37 58.53 1pve h HIS 53 Cb 0.48 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 28.91 1pve h HIS 53 CO 0.00 1.55 0.00 0.35 0.86 0.00 0.00 177.93 180.69 1pve h PHE 54 N 0.14 0.01 -0.09 2.45 3.57 -1.19 -3.05 116.94 118.78 1pve h PHE 54 Ca -0.25 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.26 1pve h PHE 54 Cb 2.15 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.88 1pve h PHE 54 CO 0.12 0.14 0.06 0.82 -2.23 0.00 0.00 178.31 177.22 1pve h ILE 55 N -0.12 0.99 -0.16 1.41 2.04 -1.18 -0.09 117.51 120.40 1pve h ILE 55 Ca 0.00 -0.02 -0.08 0.00 1.00 0.00 0.00 64.86 65.76 1pve h ILE 55 Cb 0.13 0.92 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 1pve h ILE 55 CO -0.00 0.01 -0.22 1.56 0.00 0.00 0.00 178.15 179.50 1pve h GLN 56 N 0.07 0.43 -0.69 2.37 4.20 -1.58 -1.14 115.11 118.77 1pve h GLN 56 Ca 0.04 -0.25 -0.04 0.00 0.06 0.00 0.00 58.65 58.45 1pve h GLN 56 Cb 0.08 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.85 1pve h GLN 56 CO -0.00 0.84 0.26 0.52 -0.67 0.00 0.00 178.83 179.77 1pve h MET 57 N 0.06 1.03 -0.49 1.46 2.86 -1.24 -1.37 114.93 117.25 1pve h MET 57 Ca 0.02 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.46 1pve h MET 57 Cb 0.79 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 32.26 1pve h MET 57 CO 0.05 0.85 0.25 1.25 1.06 0.00 0.00 176.91 180.37 1pve h LEU 58 N 1.00 0.60 0.11 1.22 7.12 -1.07 -3.22 115.31 121.08 1pve h LEU 58 Ca 0.23 -0.04 -0.29 0.00 0.13 0.00 0.00 57.88 57.91 1pve h LEU 58 Cb 0.22 -0.15 -0.00 0.00 -0.53 0.00 0.00 40.66 40.19 1pve h LEU 58 CO -0.02 0.50 -1.41 0.78 -0.13 0.00 0.00 178.44 178.16 1pve h ASN 59 N 0.68 0.38 -4.01 1.25 2.35 -0.67 -3.44 115.58 112.12 1pve h ASN 59 Ca 0.17 -0.47 -0.53 0.00 -0.55 0.00 0.00 56.30 54.92 1pve h ASN 59 Cb 0.04 -0.12 0.10 0.00 0.05 0.00 0.00 38.32 38.39 1pve h ASN 59 CO -0.03 1.39 0.56 -1.61 -1.65 0.00 0.00 177.43 176.09 1pve s GLU 60 N -2.63 3.55 0.46 0.81 0.41 -0.56 -5.00 118.70 115.74 1pve s GLU 60 Ca -0.07 2.02 -0.23 0.00 -0.41 0.00 0.00 54.97 56.29 1pve s GLU 60 Cb 0.07 -2.41 -0.08 0.00 -1.78 0.00 0.00 34.13 29.94 1pve s GLU 60 CO 0.86 -0.79 1.13 -1.25 -0.49 0.00 0.00 175.26 174.72 1pve s PRO 61 N -2.70 3.80 0.00 0.39 0.04 -1.26 -4.98 135.00 130.29 1pve s PRO 61 Ca 0.65 1.69 0.02 0.00 0.04 0.00 0.00 61.00 63.40 1pve s PRO 61 Cb -0.35 -2.37 -0.01 0.00 0.04 0.00 0.00 34.50 31.81 1pve s PRO 61 CO 0.42 -0.50 0.19 1.33 0.04 0.00 0.00 177.00 178.48 1pve n VAL 62 N -0.52 0.00 -0.05 -0.36 0.24 -1.26 -4.79 118.33 111.59 1pve n VAL 62 Ca 0.07 -0.47 0.00 0.00 -2.04 0.00 0.00 64.34 61.91 1pve n VAL 62 Cb 0.49 1.01 0.00 0.00 -1.47 0.00 0.00 33.84 33.87 1pve n VAL 62 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1pve n GLN 63 N -0.77 0.49 -3.69 7.34 0.00 -1.26 -5.06 117.38 114.42 1pve n GLN 63 Ca 0.01 -0.00 -0.14 0.00 0.00 0.00 0.00 57.00 56.86 1pve n GLN 63 Cb 0.03 -0.06 -0.08 0.00 0.00 0.00 0.00 30.24 30.13 1pve n GLN 63 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 1pve s GLU 64 N -0.07 0.75 0.08 2.61 2.12 -1.26 -5.18 118.70 117.75 1pve s GLU 64 Ca 0.00 0.03 -0.11 0.00 0.36 0.00 0.00 54.97 55.25 1pve s GLU 64 Cb 0.00 0.34 0.01 0.00 0.26 0.00 0.00 34.13 34.74 1pve s GLU 64 CO 0.00 -0.21 0.24 0.00 -0.54 0.00 0.00 175.26 174.76 1pve s ALA 65 N -1.09 -0.42 0.00 6.30 0.00 -1.26 -4.87 121.76 120.42 1pve s ALA 65 Ca -0.11 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.45 1pve s ALA 65 Cb -0.04 0.48 0.00 0.00 0.00 0.00 0.00 23.12 23.57 1pve s ALA 65 CO 0.05 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.72 1pve n GLY 66 N 0.06 -0.82 3.77 0.00 0.00 -1.26 -5.19 105.19 101.76 1pve n GLY 66 Ca -0.16 -0.92 -0.09 0.00 0.00 0.00 0.00 46.02 44.85 1pve n GLY 66 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pve s GLY 67 N 0.00 0.38 0.40 -0.02 0.00 -1.26 -5.07 107.32 101.75 1pve s GLY 67 Ca 0.00 -0.73 0.28 0.00 0.00 0.00 0.00 44.72 44.28 1pve s GLY 67 CO 0.00 -0.35 1.85 0.06 0.00 0.00 0.00 173.10 174.66 1pve h GLN 68 N 2.03 0.00 0.00 2.90 3.07 -2.10 -3.47 115.11 117.54 1pve h GLN 68 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.46 1pve h GLN 68 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.81 1pve h GLN 68 CO 0.35 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.68 1pve n GLY 69 N -0.44 -1.42 3.94 0.06 0.00 -1.26 -5.20 105.19 100.87 1pve n GLY 69 Ca 0.00 -1.03 0.03 0.00 0.00 0.00 0.00 46.02 45.03 1pve n GLY 69 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pve s GLY 70 N 0.00 -0.21 0.00 -0.02 0.00 -1.26 -5.09 107.32 100.74 1pve s GLY 70 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 44.72 44.92 1pve s GLY 70 CO 0.00 5.23 0.60 0.61 0.00 0.00 0.00 173.10 179.54 1pve n GLY 71 N -0.87 0.37 0.00 0.20 0.00 -1.26 -5.28 105.19 98.36 1pve n GLY 71 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1pve n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93