#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 0.18 3.52 -0.04 -1.26 -3.30 135.00 134.85 2nsv n PRO 2 Ca 0.00 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.58 2nsv n PRO 2 Cb 0.00 -1.47 0.67 0.00 -0.04 0.00 0.00 33.50 32.66 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 0.00 0.04 0.54 4.11 -1.94 0.64 114.58 117.97 2nsv h GLU 3 Ca 0.00 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.19 2nsv h GLU 3 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2nsv h GLU 3 CO 0.00 0.00 -1.15 -0.44 0.07 0.00 0.00 179.01 177.49 2nsv h ASP 4 N 0.00 0.12 -0.41 3.06 3.32 -2.04 -3.46 116.42 117.01 2nsv h ASP 4 Ca 0.08 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.99 2nsv h ASP 4 Cb 0.33 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.84 2nsv h ASP 4 CO -0.00 1.11 0.00 0.79 -1.72 0.00 0.00 179.24 179.42 2nsv n TRP 5 N -3.37 0.00 -2.01 4.55 8.01 0.22 -5.02 117.44 119.82 2nsv n TRP 5 Ca -0.05 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.14 2nsv n TRP 5 Cb 0.98 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.28 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 -4.75 -3.79 -5.99 7.35 -1.23 -4.91 117.46 104.14 2nsv n PHE 6 Ca 0.00 2.68 -0.36 0.00 -0.76 0.00 0.00 57.45 59.01 2nsv n PHE 6 Cb 0.00 -3.53 -0.12 0.00 0.35 0.00 0.00 39.48 36.18 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 -1.20 3.24 -2.00 -2.13 -4.23 -1.20 -4.89 115.64 103.23 2nsv s THR 7 Ca 0.00 -2.19 0.22 0.00 -1.18 0.00 0.00 61.69 58.54 2nsv s THR 7 Cb 0.00 -3.22 0.63 0.00 1.34 0.00 0.00 72.50 71.25 2nsv s THR 7 CO 0.00 -0.71 1.71 -0.81 -0.54 0.00 0.00 174.62 174.28 2nsv n PRO 8 N 4.44 0.75 0.02 3.99 -0.04 -1.26 -2.08 135.00 140.82 2nsv n PRO 8 Ca -0.01 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.57 2nsv n PRO 8 Cb 0.41 -1.46 0.21 0.00 -0.04 0.00 0.00 33.50 32.62 2nsv n PRO 8 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2nsv n ASP 9 N -0.96 0.57 -2.67 3.54 8.00 -1.26 -4.12 116.55 119.64 2nsv n ASP 9 Ca 0.17 -0.12 -0.09 0.00 0.71 0.00 0.00 54.79 55.46 2nsv n ASP 9 Cb 0.08 0.27 0.03 0.00 -0.02 0.00 0.00 41.12 41.47 2nsv n ASP 9 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 2nsv n THR 10 N -1.74 1.17 -3.50 -3.53 5.66 -0.88 -5.08 114.28 106.39 2nsv n THR 10 Ca 0.04 -3.17 -0.16 0.00 -3.05 0.00 0.00 64.05 57.72 2nsv n THR 10 Cb 0.38 0.63 -0.05 0.00 -1.55 0.00 0.00 70.33 69.75 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 2.66 1.29 -2.27 0.00 0.00 -1.90 -3.43 119.26 115.61 2nsv h ALA 12 Ca -0.30 -0.34 -0.48 0.00 0.00 0.00 0.00 54.91 53.79 2nsv h ALA 12 Cb 1.20 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 2nsv h ALA 12 CO 0.39 0.50 0.14 0.71 0.00 0.00 0.00 179.25 180.99 2nsv s TYR 13 N -4.29 3.37 -0.03 0.00 2.02 -1.26 -4.99 117.35 112.16 2nsv s TYR 13 Ca -0.04 1.28 0.12 0.00 -0.37 0.00 0.00 57.07 58.06 2nsv s TYR 13 Cb 0.14 -2.58 -0.19 0.00 -0.40 0.00 0.00 41.96 38.93 2nsv s TYR 13 CO 0.75 0.04 0.24 0.41 -1.57 0.00 0.00 175.55 175.42 2nsv n GLY 14 N -0.48 -0.58 3.93 0.71 0.00 -1.26 -4.59 105.19 102.92 2nsv n GLY 14 Ca 0.04 -0.29 -0.25 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.63 6.13 -0.24 1.61 1.11 -1.26 -4.79 116.67 115.60 2nsv s ASP 15 Ca -0.05 0.55 -0.00 0.00 0.18 0.00 0.00 52.55 53.22 2nsv s ASP 15 Cb 0.07 -1.94 -0.18 0.00 1.07 0.00 0.00 42.92 41.94 2nsv s ASP 15 CO 0.52 -0.52 -0.12 -1.54 1.18 0.00 0.00 175.17 174.69 2nsv n SER 16 N -2.03 2.01 -0.01 0.27 3.41 -1.26 -2.97 113.62 113.03 2nsv n SER 16 Ca -0.01 -0.06 -0.12 0.00 -0.26 0.00 0.00 58.87 58.42 2nsv n SER 16 Cb 0.56 -0.51 -0.07 0.00 -0.26 0.00 0.00 64.21 63.93 2nsv n SER 16 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2nsv h ASN 17 N -0.03 0.11 -0.09 4.04 4.21 -1.95 0.12 115.58 121.99 2nsv h ASN 17 Ca -0.55 -0.24 -0.15 0.00 1.21 0.00 0.00 56.30 56.56 2nsv h ASN 17 Cb 1.91 -0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 39.07 2nsv h ASN 17 CO -0.07 0.33 -0.47 0.00 -1.29 0.00 0.00 177.43 175.93 2nsv h THR 18 N -0.11 1.30 0.65 2.81 1.03 -1.98 -0.79 112.91 115.82 2nsv h THR 18 Ca 0.02 -1.67 -0.03 0.00 -0.01 0.00 0.00 66.41 64.72 2nsv h THR 18 Cb 0.26 1.62 0.01 0.00 -1.07 0.00 0.00 68.15 68.97 2nsv h THR 18 CO 0.00 0.53 -0.31 0.00 -0.01 0.00 0.00 175.52 175.73 2nsv h ALA 19 N 0.96 -0.87 -0.22 0.00 0.00 -1.42 1.02 119.26 118.72 2nsv h ALA 19 Ca 0.03 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.78 2nsv h ALA 19 Cb 1.02 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 19.11 2nsv h ALA 19 CO 0.10 -0.98 -0.02 2.35 0.00 0.00 0.00 179.25 180.69 2nsv h TRP 20 N -0.89 -0.05 -0.35 0.00 2.91 -0.77 0.82 115.95 117.62 2nsv h TRP 20 Ca -0.09 0.02 0.06 0.00 1.13 0.00 0.00 58.89 60.01 2nsv h TRP 20 Cb 0.67 0.06 -0.05 0.00 -0.51 0.00 0.00 29.16 29.33 2nsv h TRP 20 CO -0.03 -0.06 0.03 1.15 -1.03 0.00 0.00 178.44 178.51 2nsv h THR 21 N 0.04 0.78 0.00 2.65 2.02 -0.90 1.01 112.91 118.51 2nsv h THR 21 Ca 0.10 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 67.22 2nsv h THR 21 Cb 0.14 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 67.18 2nsv h THR 21 CO -0.19 0.03 -0.06 0.74 0.37 0.00 0.00 175.52 176.40 2nsv h THR 22 N 0.14 0.19 0.24 3.16 2.02 0.19 -2.51 112.91 116.34 2nsv h THR 22 Ca 0.17 -0.58 -0.34 0.00 0.77 0.00 0.00 66.41 66.43 2nsv h THR 22 Cb 0.22 1.48 0.03 0.00 -1.74 0.00 0.00 68.15 68.14 2nsv h THR 22 CO -0.25 0.06 -1.55 0.00 0.37 0.00 0.00 175.52 174.15 2nsv n THR 24 N -3.68 4.23 -3.90 0.00 -2.24 0.32 -4.65 114.28 104.37 2nsv n THR 24 Ca -0.19 -3.63 -0.09 0.00 -2.27 0.00 0.00 64.05 57.87 2nsv n THR 24 Cb 1.10 -2.43 -0.09 0.00 -2.10 0.00 0.00 70.33 66.81 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 1.29 0.13 0.05 4.28 -4.23 -1.26 -4.91 115.64 111.01 2nsv s THR 25 Ca 0.50 -1.11 -0.30 0.00 -1.18 0.00 0.00 61.69 59.60 2nsv s THR 25 Cb 0.14 -1.06 -0.05 0.00 1.34 0.00 0.00 72.50 72.87 2nsv s THR 25 CO -0.05 -0.61 1.17 -2.16 -0.54 0.00 0.00 174.62 172.42 2nsv s PRO 26 N -3.01 4.45 0.00 3.99 0.04 -1.26 -4.45 135.00 134.76 2nsv s PRO 26 Ca -0.02 1.72 0.00 0.00 0.04 0.00 0.00 61.00 62.75 2nsv s PRO 26 Cb 0.01 -3.36 0.00 0.00 0.04 0.00 0.00 34.50 31.19 2nsv s PRO 26 CO -0.06 -0.23 0.00 0.41 0.04 0.00 0.00 177.00 177.16 2nsv n GLY 27 N 3.16 1.13 0.08 0.56 0.00 -1.26 -4.99 105.19 103.86 2nsv n GLY 27 Ca 0.08 -0.23 -0.05 0.00 0.00 0.00 0.00 46.02 45.82 2nsv n GLY 27 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2nsv n GLN 28 N 0.00 0.86 -2.61 1.61 7.27 -1.26 -4.54 117.38 118.71 2nsv n GLN 28 Ca 0.00 -0.05 -0.25 0.00 0.07 0.00 0.00 57.00 56.77 2nsv n GLN 28 Cb 0.00 -1.48 -0.01 0.00 2.41 0.00 0.00 30.24 31.16 2nsv n GLN 28 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38 2nsv n THR 29 N -2.60 2.34 -0.03 1.69 -2.24 -1.26 -4.80 114.28 107.38 2nsv n THR 29 Ca -0.25 -4.91 -0.13 0.00 -2.27 0.00 0.00 64.05 56.48 2nsv n THR 29 Cb 0.99 -1.10 -0.11 0.00 -2.10 0.00 0.00 70.33 68.01 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 -0.65 0.00 -0.02 0.00 5.03 -1.87 -3.33 116.97 116.12 2nsv h TYR 31 Ca -0.00 0.00 -0.26 0.00 2.58 0.00 0.00 58.73 61.05 2nsv h TYR 31 Cb 0.70 0.00 0.02 0.00 1.55 0.00 0.00 36.73 39.00 2nsv h TYR 31 CO 0.16 0.19 -1.00 1.15 -1.32 0.00 0.00 178.16 177.33 2nsv h THR 32 N 0.00 1.28 -0.63 1.81 2.02 -1.87 -3.07 112.91 112.45 2nsv h THR 32 Ca -0.04 -2.22 0.08 0.00 0.77 0.00 0.00 66.41 65.00 2nsv h THR 32 Cb 1.17 2.33 -0.06 0.00 -1.74 0.00 0.00 68.15 69.85 2nsv h THR 32 CO 0.02 0.69 0.29 0.00 0.37 0.00 0.00 175.52 176.89 2nsv n SER 35 N -4.48 0.00 -0.19 0.00 7.64 0.15 -2.09 113.62 114.65 2nsv n SER 35 Ca 0.04 -1.03 0.01 0.00 1.01 0.00 0.00 58.87 58.90 2nsv n SER 35 Cb 0.22 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.43 2nsv n SER 35 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2nsv n SER 36 N -0.95 0.33 -0.31 6.43 3.41 0.29 -4.73 113.62 118.08 2nsv n SER 36 Ca 0.20 -1.60 0.00 0.00 -0.26 0.00 0.00 58.87 57.21 2nsv n SER 36 Cb 0.09 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 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 0.00 -0.13 0.00 0.00 0.08 -0.89 -3.24 117.98 113.80 2nsv s PHE 38 Ca 0.00 -0.23 0.00 0.00 0.12 0.00 0.00 56.93 56.82 2nsv s PHE 38 Cb 0.00 0.48 0.00 0.00 -0.57 0.00 0.00 43.02 42.93 2nsv s PHE 38 CO 0.00 -1.02 0.00 -0.40 -0.10 0.00 0.00 175.22 173.70 2nsv n ASP 39 N -0.39 0.00 0.00 1.36 5.75 -1.26 -4.72 116.55 117.29 2nsv n ASP 39 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.70 2nsv n ASP 39 Cb 0.62 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.71 2nsv n ASP 39 CO 0.00 0.00 0.00 0.55 -0.11 0.00 0.00 177.20 177.64 2nsv n VAL 40 N -0.89 0.00 -0.02 2.12 3.14 -1.26 -4.60 118.33 116.81 2nsv n VAL 40 Ca 0.00 0.00 -0.15 0.00 -2.96 0.00 0.00 64.34 61.23 2nsv n VAL 40 Cb 0.00 -0.64 -0.10 0.00 -1.06 0.00 0.00 33.84 32.04 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 0.00 1.45 -0.99 1.55 2.07 -1.96 0.18 116.25 118.55 2nsv h VAL 41 Ca 0.00 -1.84 0.01 0.00 0.82 0.00 0.00 66.70 65.70 2nsv h VAL 41 Cb 0.51 2.48 -0.05 0.00 -1.52 0.00 0.00 31.29 32.71 2nsv h VAL 41 CO 0.00 0.52 0.66 1.23 0.02 0.00 0.00 177.57 180.00 2nsv h GLY 42 N -0.24 1.41 0.25 2.17 0.00 -1.92 1.50 103.07 106.24 2nsv h GLY 42 Ca -0.03 -0.52 -0.00 0.00 0.00 0.00 0.00 47.33 46.78 2nsv h GLY 42 CO 0.07 0.50 -0.00 -2.09 0.00 0.00 0.00 176.54 175.02 2nsv h GLU 43 N 1.33 -0.00 0.00 4.80 4.81 -1.75 0.33 114.58 124.10 2nsv h GLU 43 Ca 0.37 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.56 2nsv h GLU 43 Cb -0.13 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 2nsv h GLU 43 CO -0.09 0.74 -0.19 -0.56 -0.73 0.00 0.00 179.01 178.18 2nsv h GLN 44 N -0.76 0.00 0.09 1.92 -0.00 -0.47 0.62 115.11 116.51 2nsv h GLN 44 Ca -0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 58.65 58.36 2nsv h GLN 44 Cb 0.75 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.21 2nsv h GLN 44 CO 0.00 0.19 -1.47 0.00 -0.00 0.00 0.00 178.83 177.56 2nsv h ALA 45 N 1.81 0.34 0.00 0.06 0.00 0.21 -3.28 119.26 118.40 2nsv h ALA 45 Ca -0.00 -1.12 -0.14 0.00 0.00 0.00 0.00 54.91 53.65 2nsv h ALA 45 Cb 0.40 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2nsv h ALA 45 CO 0.03 1.20 -0.69 0.00 0.00 0.00 0.00 179.25 179.79 2nsv h GLN 47 N 0.00 0.29 -0.20 0.00 4.20 0.17 1.46 115.11 121.02 2nsv h GLN 47 Ca -0.01 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.62 2nsv h GLN 47 Cb 1.26 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.96 2nsv h GLN 47 CO 0.09 0.19 -0.16 0.52 -0.67 0.00 0.00 178.83 178.80 2nsv h MET 48 N 0.30 0.34 0.00 1.46 2.86 -1.63 -2.34 114.93 115.92 2nsv h MET 48 Ca 0.25 -0.09 -0.18 0.00 -2.06 0.00 0.00 59.70 57.61 2nsv h MET 48 Cb 0.30 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.90 2nsv h MET 48 CO -0.29 0.50 -0.87 0.77 1.06 0.00 0.00 176.91 178.09 2nsv h SER 49 N 0.32 0.00 -0.42 1.22 0.02 -1.02 -3.44 113.55 110.23 2nsv h SER 49 Ca 0.06 0.00 -0.45 0.00 -0.84 0.00 0.00 61.79 60.56 2nsv h SER 49 Cb 0.47 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.94 2nsv h SER 49 CO 0.03 0.87 1.67 0.00 -1.14 0.00 0.00 176.83 178.26 2nsv n ALA 50 N -2.33 0.51 -2.38 3.77 0.00 0.48 -4.76 120.51 115.81 2nsv n ALA 50 Ca 0.00 -0.57 -0.35 0.00 0.00 0.00 0.00 53.44 52.53 2nsv n ALA 50 Cb 0.87 -2.58 0.01 0.00 0.00 0.00 0.00 19.45 17.76 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 8.30 3.63 0.00 0.00 7.27 -1.26 -5.01 117.38 130.31 2nsv n GLN 51 Ca 0.58 -4.24 0.00 0.00 0.07 0.00 0.00 57.00 53.41 2nsv n GLN 51 Cb 0.19 -2.31 0.00 0.00 2.41 0.00 0.00 30.24 30.54 2nsv n GLN 51 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13