#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nsv n PRO 2 N 0.00 0.75 -0.35 1.20 -0.04 -1.26 -3.42 135.00 131.88 2nsv n PRO 2 Ca 0.00 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.50 2nsv n PRO 2 Cb 0.00 -1.48 0.19 0.00 -0.04 0.00 0.00 33.50 32.17 2nsv n PRO 2 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2nsv h GLU 3 N 0.00 1.04 0.08 0.54 -0.00 -1.95 -1.90 114.58 112.39 2nsv h GLU 3 Ca 0.00 -0.06 -0.27 0.00 -0.00 0.00 0.00 59.36 59.03 2nsv h GLU 3 Cb 0.00 -0.24 0.03 0.00 -0.00 0.00 0.00 28.75 28.54 2nsv h GLU 3 CO 0.00 0.69 -1.10 0.22 -0.00 0.00 0.00 179.01 178.82 2nsv h ASP 4 N 1.07 0.82 -0.57 3.06 3.58 -2.05 -3.46 116.42 118.87 2nsv h ASP 4 Ca 0.44 -0.81 0.00 0.00 0.42 0.00 0.00 57.03 57.08 2nsv h ASP 4 Cb 0.26 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.06 2nsv h ASP 4 CO -0.20 1.54 0.00 0.79 -2.88 0.00 0.00 179.24 178.49 2nsv n TRP 5 N -3.88 0.00 -2.13 0.28 8.01 -0.72 -4.99 117.44 114.01 2nsv n TRP 5 Ca -0.13 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.06 2nsv n TRP 5 Cb 0.92 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.22 2nsv n TRP 5 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.69 177.02 2nsv n PHE 6 N 0.00 -4.66 -3.76 -5.99 7.35 -1.23 -4.88 117.46 104.30 2nsv n PHE 6 Ca 0.00 2.80 -0.36 0.00 -0.76 0.00 0.00 57.45 59.14 2nsv n PHE 6 Cb 0.00 -3.50 -0.11 0.00 0.35 0.00 0.00 39.48 36.23 2nsv n PHE 6 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2nsv s THR 7 N -0.50 3.48 -0.67 -2.13 -4.23 -1.23 -4.90 115.64 105.45 2nsv s THR 7 Ca 0.00 -2.67 0.24 0.00 -1.18 0.00 0.00 61.69 58.08 2nsv s THR 7 Cb 0.00 -3.32 0.25 0.00 1.34 0.00 0.00 72.50 70.77 2nsv s THR 7 CO 0.00 -0.81 1.74 -0.81 -0.54 0.00 0.00 174.62 174.20 2nsv n PRO 8 N 3.85 0.19 0.00 3.99 -0.04 -1.26 -2.37 135.00 139.35 2nsv n PRO 8 Ca 0.04 0.29 0.09 0.00 -0.04 0.00 0.00 63.50 63.88 2nsv n PRO 8 Cb 0.39 -1.78 0.39 0.00 -0.04 0.00 0.00 33.50 32.46 2nsv n PRO 8 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2nsv n ASP 9 N -2.12 0.01 -2.81 3.54 -0.08 -1.26 -2.98 116.55 110.85 2nsv n ASP 9 Ca 0.04 0.50 -0.01 0.00 -1.51 0.00 0.00 54.79 53.81 2nsv n ASP 9 Cb 0.32 -0.50 0.05 0.00 2.34 0.00 0.00 41.12 43.32 2nsv n ASP 9 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 2nsv n THR 10 N -1.51 1.17 -4.14 5.18 5.66 -1.00 -5.09 114.28 114.55 2nsv n THR 10 Ca 0.04 -2.83 -0.12 0.00 -3.05 0.00 0.00 64.05 58.09 2nsv n THR 10 Cb 0.22 1.23 -0.08 0.00 -1.55 0.00 0.00 70.33 70.15 2nsv n THR 10 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2nsv h ALA 12 N 2.39 0.09 -2.35 0.00 0.00 -1.92 -3.46 119.26 114.01 2nsv h ALA 12 Ca -0.31 -1.02 -0.50 0.00 0.00 0.00 0.00 54.91 53.08 2nsv h ALA 12 Cb 1.25 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.28 2nsv h ALA 12 CO 0.44 0.96 0.05 0.71 0.00 0.00 0.00 179.25 181.41 2nsv s TYR 13 N -2.61 3.41 -0.46 0.00 2.02 -1.26 -4.99 117.35 113.46 2nsv s TYR 13 Ca -0.10 1.09 0.14 0.00 -0.37 0.00 0.00 57.07 57.83 2nsv s TYR 13 Cb 0.06 -2.45 -0.18 0.00 -0.40 0.00 0.00 41.96 38.99 2nsv s TYR 13 CO 0.88 0.08 0.52 0.41 -1.57 0.00 0.00 175.55 175.87 2nsv n GLY 14 N -0.57 -0.46 3.86 0.71 0.00 -1.26 -4.62 105.19 102.85 2nsv n GLY 14 Ca 0.03 -0.39 -0.36 0.00 0.00 0.00 0.00 46.02 45.30 2nsv n GLY 14 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2nsv s ASP 15 N -2.80 6.65 0.00 1.61 1.11 -1.26 -4.90 116.67 117.09 2nsv s ASP 15 Ca 0.02 0.78 -0.10 0.00 0.18 0.00 0.00 52.55 53.42 2nsv s ASP 15 Cb 0.10 -2.18 -0.32 0.00 1.07 0.00 0.00 42.92 41.60 2nsv s ASP 15 CO 0.60 0.26 0.88 0.77 1.18 0.00 0.00 175.17 178.86 2nsv h SER 16 N 4.19 0.64 0.11 0.27 4.64 -1.93 -1.39 113.55 120.07 2nsv h SER 16 Ca -0.51 -0.79 -0.01 0.00 -0.47 0.00 0.00 61.79 60.02 2nsv h SER 16 Cb 1.21 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 2nsv h SER 16 CO 0.64 1.65 -0.05 0.78 -0.87 0.00 0.00 176.83 178.97 2nsv h ASN 17 N 0.11 -0.12 -0.13 4.97 2.35 -1.96 -0.12 115.58 120.68 2nsv h ASN 17 Ca -0.27 -0.22 -0.10 0.00 -0.55 0.00 0.00 56.30 55.16 2nsv h ASN 17 Cb 2.10 0.03 -0.01 0.00 0.05 0.00 0.00 38.32 40.49 2nsv h ASN 17 CO 0.21 0.16 -0.22 0.00 -1.65 0.00 0.00 177.43 175.93 2nsv h THR 18 N -0.41 1.26 0.92 2.81 1.03 -1.98 0.21 112.91 116.74 2nsv h THR 18 Ca -0.01 -1.25 -0.04 0.00 -0.01 0.00 0.00 66.41 65.09 2nsv h THR 18 Cb 0.34 1.28 0.01 0.00 -1.07 0.00 0.00 68.15 68.70 2nsv h THR 18 CO 0.02 0.40 -0.45 0.00 -0.01 0.00 0.00 175.52 175.49 2nsv h ALA 19 N 1.26 -1.24 -0.28 0.00 0.00 -1.11 1.42 119.26 119.32 2nsv h ALA 19 Ca 0.08 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.76 2nsv h ALA 19 Cb 0.66 0.49 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 2nsv h ALA 19 CO 0.05 -1.20 0.04 2.35 0.00 0.00 0.00 179.25 180.49 2nsv h TRP 20 N -1.24 0.06 0.27 0.00 2.91 -0.97 0.31 115.95 117.30 2nsv h TRP 20 Ca -0.13 0.02 0.01 0.00 1.13 0.00 0.00 58.89 59.92 2nsv h TRP 20 Cb 0.95 0.01 -0.03 0.00 -0.51 0.00 0.00 29.16 29.58 2nsv h TRP 20 CO -0.01 0.00 -0.37 1.15 -1.03 0.00 0.00 178.44 178.18 2nsv h THR 21 N 0.14 0.24 0.00 2.65 2.02 -0.74 0.86 112.91 118.07 2nsv h THR 21 Ca 0.13 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.31 2nsv h THR 21 Cb 0.15 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 66.79 2nsv h THR 21 CO -0.18 0.00 0.00 0.74 0.37 0.00 0.00 175.52 176.45 2nsv h THR 22 N -0.70 0.00 0.15 3.16 2.02 0.24 0.50 112.91 118.28 2nsv h THR 22 Ca -0.01 -0.01 -0.34 0.00 0.77 0.00 0.00 66.41 66.83 2nsv h THR 22 Cb 0.67 0.81 -0.00 0.00 -1.74 0.00 0.00 68.15 67.89 2nsv h THR 22 CO -0.12 0.00 -1.71 0.00 0.37 0.00 0.00 175.52 174.06 2nsv n THR 24 N -3.51 4.21 -3.88 0.00 -2.24 0.27 -4.72 114.28 104.41 2nsv n THR 24 Ca -0.23 -3.57 -0.10 0.00 -2.27 0.00 0.00 64.05 57.89 2nsv n THR 24 Cb 1.06 -2.44 -0.08 0.00 -2.10 0.00 0.00 70.33 66.76 2nsv n THR 24 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2nsv s THR 25 N 1.38 0.13 -0.10 4.28 -4.23 -1.25 -4.92 115.64 110.93 2nsv s THR 25 Ca 0.51 -1.05 -0.30 0.00 -1.18 0.00 0.00 61.69 59.67 2nsv s THR 25 Cb 0.14 -1.03 -0.03 0.00 1.34 0.00 0.00 72.50 72.93 2nsv s THR 25 CO -0.06 -0.58 1.24 -2.16 -0.54 0.00 0.00 174.62 172.52 2nsv s PRO 26 N -2.93 4.30 0.00 3.99 0.04 -1.26 -4.45 135.00 134.69 2nsv s PRO 26 Ca -0.02 1.69 0.00 0.00 0.04 0.00 0.00 61.00 62.71 2nsv s PRO 26 Cb 0.01 -3.65 0.00 0.00 0.04 0.00 0.00 34.50 30.90 2nsv s PRO 26 CO -0.06 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 176.82 2nsv n GLY 27 N 3.49 1.73 0.08 0.56 0.00 -1.26 -5.00 105.19 104.79 2nsv n GLY 27 Ca 0.12 -0.62 -0.10 0.00 0.00 0.00 0.00 46.02 45.43 2nsv n GLY 27 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2nsv h GLN 28 N 0.00 0.05 -1.63 1.61 7.50 -2.03 -3.37 115.11 117.24 2nsv h GLN 28 Ca 0.00 -0.08 -0.61 0.00 0.50 0.00 0.00 58.65 58.46 2nsv h GLN 28 Cb 0.00 0.03 -0.40 0.00 0.05 0.00 0.00 27.48 27.16 2nsv h GLN 28 CO 0.00 0.73 -0.53 0.25 -1.50 0.00 0.00 178.83 177.78 2nsv n THR 29 N -3.19 2.58 0.12 -0.54 -2.24 -1.26 -4.80 114.28 104.96 2nsv n THR 29 Ca -0.14 -4.94 -0.13 0.00 -2.27 0.00 0.00 64.05 56.57 2nsv n THR 29 Cb 1.03 -1.28 -0.08 0.00 -2.10 0.00 0.00 70.33 67.89 2nsv n THR 29 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nsv h TYR 31 N -0.69 0.00 -0.28 0.00 5.03 -1.87 -3.27 116.97 115.89 2nsv h TYR 31 Ca -0.03 0.00 -0.11 0.00 2.58 0.00 0.00 58.73 61.17 2nsv h TYR 31 Cb 0.48 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.75 2nsv h TYR 31 CO 0.03 0.36 -0.25 1.15 -1.32 0.00 0.00 178.16 178.13 2nsv h THR 32 N 0.00 1.30 0.00 1.81 2.02 -1.87 -2.61 112.91 113.56 2nsv h THR 32 Ca -0.06 -1.41 -0.03 0.00 0.77 0.00 0.00 66.41 65.68 2nsv h THR 32 Cb 1.33 1.57 -0.00 0.00 -1.74 0.00 0.00 68.15 69.31 2nsv h THR 32 CO 0.04 0.45 -0.16 0.00 0.37 0.00 0.00 175.52 176.22 2nsv n SER 35 N -1.42 1.57 -0.10 0.00 2.88 0.60 -3.62 113.62 113.54 2nsv n SER 35 Ca 0.04 -1.33 -0.18 0.00 -1.33 0.00 0.00 58.87 56.08 2nsv n SER 35 Cb 0.12 -0.02 -0.08 0.00 -0.75 0.00 0.00 64.21 63.49 2nsv n SER 35 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2nsv n SER 36 N 0.24 1.88 -1.88 -3.46 2.88 0.06 -4.47 113.62 108.88 2nsv n SER 36 Ca 0.03 0.10 -0.17 0.00 -1.33 0.00 0.00 58.87 57.50 2nsv n SER 36 Cb 0.16 -0.46 0.12 0.00 -0.75 0.00 0.00 64.21 63.28 2nsv n SER 36 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2nsv s PHE 38 N -2.34 0.06 0.00 0.00 0.08 -1.26 -3.56 117.98 110.96 2nsv s PHE 38 Ca 0.40 -0.58 0.00 0.00 0.12 0.00 0.00 56.93 56.88 2nsv s PHE 38 Cb 0.34 0.65 0.00 0.00 -0.57 0.00 0.00 43.02 43.43 2nsv s PHE 38 CO 0.07 -1.32 0.00 -3.47 -0.10 0.00 0.00 175.22 170.40 2nsv n ASP 39 N -0.85 0.00 -0.10 1.36 -0.08 -1.26 -4.65 116.55 110.97 2nsv n ASP 39 Ca -0.05 0.00 -0.16 0.00 -1.51 0.00 0.00 54.79 53.07 2nsv n ASP 39 Cb 0.60 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 44.00 2nsv n ASP 39 CO 0.00 0.00 0.00 0.55 0.12 0.00 0.00 177.20 177.87 2nsv n VAL 40 N 0.00 1.50 -0.04 5.18 3.14 -1.26 -3.92 118.33 122.93 2nsv n VAL 40 Ca 0.00 -0.03 -0.14 0.00 -2.96 0.00 0.00 64.34 61.21 2nsv n VAL 40 Cb 0.00 -2.18 -0.08 0.00 -1.06 0.00 0.00 33.84 30.52 2nsv n VAL 40 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 2nsv h VAL 41 N -1.00 1.40 -0.76 1.55 2.07 -1.96 0.26 116.25 117.81 2nsv h VAL 41 Ca -0.25 -1.56 0.19 0.00 0.82 0.00 0.00 66.70 65.89 2nsv h VAL 41 Cb 1.14 2.15 -0.04 0.00 -1.52 0.00 0.00 31.29 33.02 2nsv h VAL 41 CO -0.15 0.45 0.52 1.23 0.02 0.00 0.00 177.57 179.64 2nsv h GLY 42 N -0.11 0.43 0.00 2.17 0.00 -1.92 1.87 103.07 105.51 2nsv h GLY 42 Ca -0.00 -0.10 -0.08 0.00 0.00 0.00 0.00 47.33 47.15 2nsv h GLY 42 CO 0.05 0.02 -0.43 -2.09 0.00 0.00 0.00 176.54 174.09 2nsv h GLU 43 N 0.23 0.00 0.00 4.80 4.22 -1.59 -1.21 114.58 121.02 2nsv h GLU 43 Ca 0.38 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.80 2nsv h GLU 43 Cb 1.14 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.39 2nsv h GLU 43 CO -0.08 0.97 -0.09 -0.56 -2.18 0.00 0.00 179.01 177.07 2nsv h GLN 44 N -1.00 0.00 0.16 1.92 -0.00 -0.19 1.61 115.11 117.61 2nsv h GLN 44 Ca -0.12 0.00 -0.35 0.00 -0.00 0.00 0.00 58.65 58.19 2nsv h GLN 44 Cb 1.08 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.56 2nsv h GLN 44 CO -0.07 0.09 -1.76 0.00 -0.00 0.00 0.00 178.83 177.10 2nsv h ALA 45 N 1.91 0.24 0.00 0.06 0.00 0.28 -3.30 119.26 118.44 2nsv h ALA 45 Ca -0.00 -1.19 -0.12 0.00 0.00 0.00 0.00 54.91 53.60 2nsv h ALA 45 Cb 0.29 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2nsv h ALA 45 CO 0.01 1.11 -0.58 0.00 0.00 0.00 0.00 179.25 179.79 2nsv h GLN 47 N 0.00 -0.96 0.00 0.00 4.20 0.22 1.92 115.11 120.49 2nsv h GLN 47 Ca -0.01 0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.77 2nsv h GLN 47 Cb 1.28 0.22 0.00 0.00 0.30 0.00 0.00 27.48 29.28 2nsv h GLN 47 CO 0.08 -0.64 0.00 -1.33 -0.67 0.00 0.00 178.83 176.27 2nsv n MET 48 N -5.56 0.02 -0.08 1.46 2.81 -1.24 -1.32 117.12 113.20 2nsv n MET 48 Ca -0.12 0.35 -0.10 0.00 -1.81 0.00 0.00 57.70 56.02 2nsv n MET 48 Cb 0.46 -1.50 -0.15 0.00 -0.71 0.00 0.00 33.22 31.32 2nsv n MET 48 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2nsv n SER 49 N -1.47 0.32 -4.45 7.83 3.41 0.08 -4.89 113.62 114.44 2nsv n SER 49 Ca 0.02 0.08 -0.47 0.00 -0.26 0.00 0.00 58.87 58.24 2nsv n SER 49 Cb 0.08 0.68 -0.09 0.00 -0.26 0.00 0.00 64.21 64.62 2nsv n SER 49 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nsv n ALA 50 N -2.74 0.75 -2.22 7.33 0.00 0.63 -4.79 120.51 119.46 2nsv n ALA 50 Ca -0.31 -0.24 -0.40 0.00 0.00 0.00 0.00 53.44 52.49 2nsv n ALA 50 Cb 1.13 -2.55 0.03 0.00 0.00 0.00 0.00 19.45 18.05 2nsv n ALA 50 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2nsv n GLN 51 N 8.34 3.78 0.00 0.00 0.00 -1.26 -5.01 117.38 123.23 2nsv n GLN 51 Ca 0.48 -4.00 0.13 0.00 -0.00 0.00 0.00 57.00 53.61 2nsv n GLN 51 Cb 0.21 -2.34 0.34 0.00 0.00 0.00 0.00 30.24 28.45 2nsv n GLN 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06