#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 -0.12 3.52 -0.04 -1.26 -3.37 135.00 134.48 2nsv n PRO 2 Ca 0.00 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.53 2nsv n PRO 2 Cb 0.00 -1.42 0.40 0.00 -0.04 0.00 0.00 33.50 32.44 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 0.62 0.00 0.54 4.11 -1.95 0.33 114.58 118.23 2nsv h GLU 3 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.39 2nsv h GLU 3 Cb 0.00 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.11 2nsv h GLU 3 CO 0.00 0.41 -0.03 0.22 0.07 0.00 0.00 179.01 179.68 2nsv h ASP 4 N 0.64 0.00 -0.39 3.06 3.58 -2.05 -3.46 116.42 117.80 2nsv h ASP 4 Ca 0.27 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.72 2nsv h ASP 4 Cb 0.26 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.31 2nsv h ASP 4 CO -0.08 0.00 0.00 0.79 -2.88 0.00 0.00 179.24 177.07 2nsv n TRP 5 N -2.59 0.00 -2.08 0.28 8.01 0.12 -5.00 117.44 116.18 2nsv n TRP 5 Ca 0.05 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.24 2nsv n TRP 5 Cb 0.47 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.77 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 -4.59 -3.72 -5.99 7.35 -1.20 -4.89 117.46 104.42 2nsv n PHE 6 Ca 0.00 2.76 -0.37 0.00 -0.76 0.00 0.00 57.45 59.08 2nsv n PHE 6 Cb 0.00 -3.40 -0.10 0.00 0.35 0.00 0.00 39.48 36.33 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 -0.48 3.61 -1.03 -2.13 -4.23 -1.23 -4.90 115.64 105.24 2nsv s THR 7 Ca 0.00 -2.37 0.22 0.00 -1.18 0.00 0.00 61.69 58.36 2nsv s THR 7 Cb 0.00 -3.41 0.20 0.00 1.34 0.00 0.00 72.50 70.63 2nsv s THR 7 CO 0.00 -0.78 1.70 -0.81 -0.54 0.00 0.00 174.62 174.19 2nsv n PRO 8 N 4.21 0.02 0.00 3.99 -0.04 -1.26 -2.24 135.00 139.68 2nsv n PRO 8 Ca 0.01 0.12 0.14 0.00 -0.04 0.00 0.00 63.50 63.74 2nsv n PRO 8 Cb 0.40 -1.50 0.72 0.00 -0.04 0.00 0.00 33.50 33.08 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 -1.48 0.00 -2.81 3.54 -0.08 -1.26 -3.45 116.55 111.01 2nsv n ASP 9 Ca 0.06 -0.02 -0.00 0.00 -1.51 0.00 0.00 54.79 53.31 2nsv n ASP 9 Cb 0.25 -0.32 0.06 0.00 2.34 0.00 0.00 41.12 43.45 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 -1.32 1.04 -4.13 5.18 5.66 -0.95 -5.10 114.28 114.66 2nsv n THR 10 Ca 0.13 -2.58 -0.16 0.00 -3.05 0.00 0.00 64.05 58.39 2nsv n THR 10 Cb 0.25 1.25 -0.05 0.00 -1.55 0.00 0.00 70.33 70.24 2nsv n THR 10 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2nsv n ALA 12 N -0.73 1.37 -2.04 0.00 0.00 -1.26 -4.92 120.51 112.92 2nsv n ALA 12 Ca -0.13 -0.99 -0.37 0.00 0.00 0.00 0.00 53.44 51.95 2nsv n ALA 12 Cb 0.59 -0.45 -0.06 0.00 0.00 0.00 0.00 19.45 19.53 2nsv n ALA 12 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2nsv s TYR 13 N -2.54 3.73 -0.76 0.00 2.02 -1.26 -4.97 117.35 113.57 2nsv s TYR 13 Ca -0.16 1.49 0.21 0.00 -0.37 0.00 0.00 57.07 58.24 2nsv s TYR 13 Cb 0.07 -2.69 -0.26 0.00 -0.40 0.00 0.00 41.96 38.69 2nsv s TYR 13 CO 0.77 0.39 0.80 0.41 -1.57 0.00 0.00 175.55 176.34 2nsv n GLY 14 N 1.00 -1.00 3.84 0.71 0.00 -1.26 -4.62 105.19 103.87 2nsv n GLY 14 Ca -0.03 -0.58 -0.35 0.00 0.00 0.00 0.00 46.02 45.06 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 -3.36 6.11 -0.03 1.61 1.01 -1.26 -4.94 116.67 115.81 2nsv s ASP 15 Ca 0.04 0.33 -0.09 0.00 0.71 0.00 0.00 52.55 53.54 2nsv s ASP 15 Cb 0.15 -1.89 -0.30 0.00 1.01 0.00 0.00 42.92 41.89 2nsv s ASP 15 CO 0.88 0.33 0.75 0.77 0.21 0.00 0.00 175.17 178.11 2nsv h SER 16 N 4.46 0.58 -0.01 0.27 4.64 -1.94 -1.60 113.55 119.95 2nsv h SER 16 Ca -0.51 -0.82 -0.00 0.00 -0.47 0.00 0.00 61.79 59.98 2nsv h SER 16 Cb 1.20 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 63.10 2nsv h SER 16 CO 0.62 1.69 0.00 0.78 -0.87 0.00 0.00 176.83 179.05 2nsv h ASN 17 N 0.10 0.02 0.08 4.97 2.35 -1.96 0.49 115.58 121.63 2nsv h ASN 17 Ca -0.31 -0.25 -0.13 0.00 -0.55 0.00 0.00 56.30 55.07 2nsv h ASN 17 Cb 2.09 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 40.44 2nsv h ASN 17 CO 0.18 0.26 -0.43 0.00 -1.65 0.00 0.00 177.43 175.80 2nsv h THR 18 N -0.22 1.31 0.75 2.81 1.03 -1.99 -1.13 112.91 115.48 2nsv h THR 18 Ca 0.00 -1.60 -0.04 0.00 -0.01 0.00 0.00 66.41 64.76 2nsv h THR 18 Cb 0.25 1.64 0.01 0.00 -1.07 0.00 0.00 68.15 68.98 2nsv h THR 18 CO 0.00 0.49 -0.36 0.00 -0.01 0.00 0.00 175.52 175.64 2nsv h ALA 19 N 1.18 -1.01 -0.04 0.00 0.00 -1.12 1.37 119.26 119.64 2nsv h ALA 19 Ca 0.03 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 54.74 2nsv h ALA 19 Cb 0.91 0.39 -0.04 0.00 0.00 0.00 0.00 17.79 19.05 2nsv h ALA 19 CO 0.08 -1.04 -0.18 2.35 0.00 0.00 0.00 179.25 180.45 2nsv h TRP 20 N -1.07 -0.48 0.30 0.00 2.91 -0.90 0.32 115.95 117.04 2nsv h TRP 20 Ca -0.10 0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.94 2nsv h TRP 20 Cb 0.79 0.22 -0.03 0.00 -0.51 0.00 0.00 29.16 29.63 2nsv h TRP 20 CO -0.01 -0.26 -0.43 1.15 -1.03 0.00 0.00 178.44 177.85 2nsv h THR 21 N -0.28 0.13 0.00 2.65 2.02 -1.07 1.21 112.91 117.57 2nsv h THR 21 Ca 0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.25 2nsv h THR 21 Cb 0.37 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.92 2nsv h THR 21 CO -0.20 0.00 0.14 0.74 0.37 0.00 0.00 175.52 176.56 2nsv h THR 22 N -0.79 0.00 0.12 3.16 2.02 0.22 0.22 112.91 117.86 2nsv h THR 22 Ca -0.02 0.00 -0.36 0.00 0.77 0.00 0.00 66.41 66.80 2nsv h THR 22 Cb 0.74 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 2nsv h THR 22 CO -0.14 0.00 -1.96 0.00 0.37 0.00 0.00 175.52 173.79 2nsv n THR 24 N -3.45 4.59 -4.03 0.00 -2.24 0.39 -4.54 114.28 104.99 2nsv n THR 24 Ca -0.30 -3.24 -0.09 0.00 -2.27 0.00 0.00 64.05 58.15 2nsv n THR 24 Cb 1.05 -2.33 -0.09 0.00 -2.10 0.00 0.00 70.33 66.86 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 0.61 0.12 0.00 4.28 -4.23 -1.23 -4.67 115.64 110.52 2nsv s THR 25 Ca 0.63 -1.61 -0.30 0.00 -1.18 0.00 0.00 61.69 59.22 2nsv s THR 25 Cb 0.20 -1.76 -0.04 0.00 1.34 0.00 0.00 72.50 72.24 2nsv s THR 25 CO -0.08 -0.56 1.19 -2.16 -0.54 0.00 0.00 174.62 172.47 2nsv s PRO 26 N -3.97 4.40 0.00 3.99 0.04 -1.26 -4.36 135.00 133.84 2nsv s PRO 26 Ca 0.15 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.90 2nsv s PRO 26 Cb 0.06 -3.46 0.00 0.00 0.04 0.00 0.00 34.50 31.14 2nsv s PRO 26 CO -0.03 -0.34 0.00 0.41 0.04 0.00 0.00 177.00 177.08 2nsv n GLY 27 N 3.28 2.09 0.22 0.56 0.00 -1.26 -5.02 105.19 105.06 2nsv n GLY 27 Ca 0.10 -0.14 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 2nsv n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nsv n GLN 28 N 0.00 0.28 -1.88 1.61 10.64 -1.26 -4.68 117.38 122.09 2nsv n GLN 28 Ca 0.00 0.08 -0.29 0.00 -1.83 0.00 0.00 57.00 54.96 2nsv n GLN 28 Cb 0.00 -1.15 0.04 0.00 -0.86 0.00 0.00 30.24 28.27 2nsv n GLN 28 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 2nsv n THR 29 N -3.04 2.92 0.41 -0.39 -2.24 -1.26 -4.75 114.28 105.93 2nsv n THR 29 Ca -0.21 -3.96 -0.16 0.00 -2.27 0.00 0.00 64.05 57.44 2nsv n THR 29 Cb 0.70 -1.17 -0.08 0.00 -2.10 0.00 0.00 70.33 67.68 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 -1.27 0.00 -0.18 0.00 5.03 -1.85 -3.01 116.97 115.70 2nsv h TYR 31 Ca -0.11 0.00 -0.22 0.00 2.58 0.00 0.00 58.73 60.98 2nsv h TYR 31 Cb 0.82 0.00 0.01 0.00 1.55 0.00 0.00 36.73 39.10 2nsv h TYR 31 CO 0.00 0.00 -0.74 1.15 -1.32 0.00 0.00 178.16 177.25 2nsv h THR 32 N 0.00 1.28 0.00 1.81 2.02 -1.83 -2.90 112.91 113.29 2nsv h THR 32 Ca 0.00 -1.93 -0.02 0.00 0.77 0.00 0.00 66.41 65.23 2nsv h THR 32 Cb 0.61 1.92 -0.00 0.00 -1.74 0.00 0.00 68.15 68.94 2nsv h THR 32 CO 0.00 0.62 -0.10 0.00 0.37 0.00 0.00 175.52 176.41 2nsv n SER 35 N -1.77 1.73 -0.04 0.00 2.88 -0.84 -3.59 113.62 111.99 2nsv n SER 35 Ca 0.02 -1.38 -0.05 0.00 -1.33 0.00 0.00 58.87 56.12 2nsv n SER 35 Cb 0.12 -0.01 -0.04 0.00 -0.75 0.00 0.00 64.21 63.53 2nsv n SER 35 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2nsv n SER 36 N 0.41 3.42 -1.66 -3.46 3.41 0.40 -4.55 113.62 111.59 2nsv n SER 36 Ca 0.05 -0.04 -0.05 0.00 -0.26 0.00 0.00 58.87 58.57 2nsv n SER 36 Cb 0.21 -0.08 0.21 0.00 -0.26 0.00 0.00 64.21 64.29 2nsv n SER 36 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nsv s PHE 38 N -2.27 0.02 0.00 0.00 0.08 -1.26 -3.54 117.98 111.01 2nsv s PHE 38 Ca 0.39 -0.46 0.00 0.00 0.12 0.00 0.00 56.93 56.98 2nsv s PHE 38 Cb 0.31 0.54 0.00 0.00 -0.57 0.00 0.00 43.02 43.30 2nsv s PHE 38 CO 0.10 -1.18 0.00 -3.47 -0.10 0.00 0.00 175.22 170.57 2nsv n ASP 39 N -0.50 0.00 -0.10 1.36 2.03 -1.26 -4.73 116.55 113.35 2nsv n ASP 39 Ca -0.03 0.00 -0.18 0.00 0.52 0.00 0.00 54.79 55.09 2nsv n ASP 39 Cb 0.60 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.92 2nsv n ASP 39 CO 0.00 0.00 0.00 0.55 -1.92 0.00 0.00 177.20 175.83 2nsv n VAL 40 N 0.00 1.50 0.08 5.18 3.14 -1.26 -4.05 118.33 122.92 2nsv n VAL 40 Ca 0.00 -0.04 -0.03 0.00 -2.96 0.00 0.00 64.34 61.31 2nsv n VAL 40 Cb 0.00 -2.12 -0.02 0.00 -1.06 0.00 0.00 33.84 30.64 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 0.00 -1.57 1.55 2.07 -1.96 -1.52 116.25 113.82 2nsv h VAL 41 Ca -0.31 -0.18 0.46 0.00 0.82 0.00 0.00 66.70 67.49 2nsv h VAL 41 Cb 1.16 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.86 2nsv h VAL 41 CO -0.19 0.00 1.12 0.61 0.02 0.00 0.00 177.57 179.13 2nsv n GLY 42 N 0.46 -0.80 0.06 2.17 0.00 -1.26 0.29 105.19 106.11 2nsv n GLY 42 Ca -0.03 0.58 -0.01 0.00 0.00 0.00 0.00 46.02 46.56 2nsv n GLY 42 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2nsv h GLU 43 N 0.00 -0.05 0.00 1.61 4.81 -1.60 -0.45 114.58 118.89 2nsv h GLU 43 Ca 0.77 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 60.00 2nsv h GLU 43 Cb 3.01 0.01 0.00 0.00 0.63 0.00 0.00 28.75 32.41 2nsv h GLU 43 CO -0.06 -0.04 0.00 -0.56 -0.73 0.00 0.00 179.01 177.62 2nsv h GLN 44 N -0.89 0.00 0.09 1.92 -0.00 0.11 1.16 115.11 117.50 2nsv h GLN 44 Ca -0.01 0.00 -0.24 0.00 -0.00 0.00 0.00 58.65 58.40 2nsv h GLN 44 Cb 0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.52 2nsv h GLN 44 CO 0.01 0.00 -1.25 0.00 -0.00 0.00 0.00 178.83 177.59 2nsv h ALA 45 N 2.08 0.17 0.00 0.06 0.00 0.41 -3.18 119.26 118.80 2nsv h ALA 45 Ca 0.00 -1.05 -0.08 0.00 0.00 0.00 0.00 54.91 53.78 2nsv h ALA 45 Cb 0.21 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2nsv h ALA 45 CO 0.00 0.72 -0.37 0.00 0.00 0.00 0.00 179.25 179.60 2nsv h GLN 47 N 0.00 -0.41 -0.12 0.00 4.20 0.13 1.48 115.11 120.39 2nsv h GLN 47 Ca -0.00 0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.65 2nsv h GLN 47 Cb 1.10 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.96 2nsv h GLN 47 CO 0.05 -0.20 -0.29 0.00 -0.67 0.00 0.00 178.83 177.72 2nsv h MET 48 N -0.54 0.22 -0.59 1.46 -0.00 -1.57 -1.81 114.93 112.09 2nsv h MET 48 Ca -0.04 -0.08 0.00 0.00 -0.00 0.00 0.00 59.70 59.58 2nsv h MET 48 Cb 0.40 -0.02 0.00 0.00 -0.00 0.00 0.00 31.60 31.99 2nsv h MET 48 CO 0.07 0.50 0.00 0.43 -0.00 0.00 0.00 176.91 177.91 2nsv n SER 49 N -4.13 3.17 -4.58 -0.10 7.64 -0.99 -4.82 113.62 109.81 2nsv n SER 49 Ca -0.01 -2.01 -0.17 0.00 1.01 0.00 0.00 58.87 57.69 2nsv n SER 49 Cb 0.39 -0.40 -0.10 0.00 -1.01 0.00 0.00 64.21 63.09 2nsv n SER 49 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2nsv s ALA 50 N -1.22 0.76 -1.21 -0.43 0.00 0.50 -4.77 121.76 115.40 2nsv s ALA 50 Ca 0.40 -1.48 -0.05 0.00 0.00 0.00 0.00 51.96 50.82 2nsv s ALA 50 Cb 0.21 -4.67 0.21 0.00 0.00 0.00 0.00 23.12 18.86 2nsv s ALA 50 CO 0.27 -6.42 1.98 0.94 0.00 0.00 0.00 175.76 172.53 2nsv n GLN 51 N 8.32 4.51 0.00 0.00 7.27 -1.26 -5.04 117.38 131.18 2nsv n GLN 51 Ca 0.43 -3.92 0.15 0.00 0.07 0.00 0.00 57.00 53.73 2nsv n GLN 51 Cb 0.46 -2.65 0.73 0.00 2.41 0.00 0.00 30.24 31.19 2nsv n GLN 51 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13