#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 0.15 3.52 -0.04 -1.26 -3.31 135.00 134.81 2nsv n PRO 2 Ca 0.00 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.60 2nsv n PRO 2 Cb 0.00 -1.48 0.68 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 0.00 0.54 4.11 -1.95 0.47 114.58 117.75 2nsv h GLU 3 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2nsv h GLU 3 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2nsv h GLU 3 CO 0.00 0.00 -0.51 0.22 0.07 0.00 0.00 179.01 178.79 2nsv h ASP 4 N 0.00 0.00 -0.36 3.06 3.58 -2.04 -3.47 116.42 117.20 2nsv h ASP 4 Ca 0.11 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2nsv h ASP 4 Cb 0.44 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.49 2nsv h ASP 4 CO -0.00 0.05 0.00 0.79 -2.88 0.00 0.00 179.24 177.20 2nsv n TRP 5 N -2.39 0.00 -2.14 0.28 8.01 0.16 -4.98 117.44 116.39 2nsv n TRP 5 Ca 0.03 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.22 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 -4.32 -3.67 -5.99 7.35 -1.22 -4.88 117.46 104.73 2nsv n PHE 6 Ca 0.00 2.60 -0.38 0.00 -0.76 0.00 0.00 57.45 58.90 2nsv n PHE 6 Cb 0.00 -3.34 -0.10 0.00 0.35 0.00 0.00 39.48 36.40 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 3.76 -0.91 -2.13 -4.23 0.56 -4.91 115.64 107.31 2nsv s THR 7 Ca 0.00 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.73 2nsv s THR 7 Cb 0.00 -3.52 0.20 0.00 1.34 0.00 0.00 72.50 70.52 2nsv s THR 7 CO 0.00 -0.75 1.71 -0.81 -0.54 0.00 0.00 174.62 174.23 2nsv n PRO 8 N 4.65 0.05 0.00 3.99 -0.04 -1.26 -2.31 135.00 140.08 2nsv n PRO 8 Ca -0.04 0.17 0.12 0.00 -0.04 0.00 0.00 63.50 63.71 2nsv n PRO 8 Cb 0.41 -1.58 0.59 0.00 -0.04 0.00 0.00 33.50 32.87 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 -1.68 0.00 -2.78 3.54 2.03 -1.26 -3.24 116.55 113.15 2nsv n ASP 9 Ca 0.05 0.10 -0.00 0.00 0.52 0.00 0.00 54.79 55.46 2nsv n ASP 9 Cb 0.27 -0.35 0.07 0.00 -0.72 0.00 0.00 41.12 40.39 2nsv n ASP 9 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 2nsv n THR 10 N -1.35 0.98 -3.79 5.18 5.66 -0.98 -5.10 114.28 114.89 2nsv n THR 10 Ca 0.10 -2.48 -0.10 0.00 -3.05 0.00 0.00 64.05 58.52 2nsv n THR 10 Cb 0.22 1.24 -0.05 0.00 -1.55 0.00 0.00 70.33 70.19 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 -0.28 6.45 -3.11 0.00 0.00 -1.26 -4.87 120.51 117.44 2nsv n ALA 12 Ca -0.10 -3.99 -0.12 0.00 0.00 0.00 0.00 53.44 49.23 2nsv n ALA 12 Cb 0.63 -2.12 -0.11 0.00 0.00 0.00 0.00 19.45 17.85 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 -3.45 -0.17 -0.03 0.00 1.51 -1.26 -5.03 117.35 108.92 2nsv s TYR 13 Ca 0.51 0.39 0.22 0.00 -1.01 0.00 0.00 57.07 57.18 2nsv s TYR 13 Cb 0.37 0.05 -0.33 0.00 -0.11 0.00 0.00 41.96 41.93 2nsv s TYR 13 CO -0.30 -0.18 0.46 0.41 -1.11 0.00 0.00 175.55 174.83 2nsv n GLY 14 N 2.48 -0.99 3.45 0.71 0.00 -1.26 -4.71 105.19 104.87 2nsv n GLY 14 Ca -0.16 -0.51 -0.30 0.00 0.00 0.00 0.00 46.02 45.05 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 -4.51 3.71 0.08 1.61 1.01 -1.26 -5.03 116.67 112.28 2nsv s ASP 15 Ca -0.08 -0.52 0.01 0.00 0.71 0.00 0.00 52.55 52.67 2nsv s ASP 15 Cb 0.14 -0.51 -0.25 0.00 1.01 0.00 0.00 42.92 43.31 2nsv s ASP 15 CO 0.90 0.22 1.16 0.77 0.21 0.00 0.00 175.17 178.43 2nsv h SER 16 N 4.22 0.23 -0.07 0.27 4.64 -1.95 -2.26 113.55 118.64 2nsv h SER 16 Ca -0.49 -0.26 -0.01 0.00 -0.47 0.00 0.00 61.79 60.57 2nsv h SER 16 Cb 1.16 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 63.17 2nsv h SER 16 CO 0.46 1.20 0.01 -1.13 -0.87 0.00 0.00 176.83 176.51 2nsv h ASN 17 N 0.04 0.11 -0.13 4.97 -0.73 -1.96 -0.69 115.58 117.19 2nsv h ASN 17 Ca -0.10 -0.24 -0.09 0.00 1.87 0.00 0.00 56.30 57.75 2nsv h ASN 17 Cb 1.89 -0.03 -0.02 0.00 0.27 0.00 0.00 38.32 40.44 2nsv h ASN 17 CO 0.17 0.32 -0.18 0.00 -0.37 0.00 0.00 177.43 177.36 2nsv h THR 18 N -0.11 1.25 0.94 -3.57 1.03 -1.98 0.34 112.91 110.81 2nsv h THR 18 Ca 0.02 -1.16 -0.05 0.00 -0.01 0.00 0.00 66.41 65.21 2nsv h THR 18 Cb 0.26 1.23 0.01 0.00 -1.07 0.00 0.00 68.15 68.58 2nsv h THR 18 CO 0.00 0.38 -0.45 0.00 -0.01 0.00 0.00 175.52 175.43 2nsv h ALA 19 N 1.33 -1.33 -0.47 0.00 0.00 -1.17 1.10 119.26 118.72 2nsv h ALA 19 Ca 0.08 -0.28 0.06 0.00 0.00 0.00 0.00 54.91 54.77 2nsv h ALA 19 Cb 0.59 0.49 -0.05 0.00 0.00 0.00 0.00 17.79 18.82 2nsv h ALA 19 CO 0.04 -1.24 0.16 2.35 0.00 0.00 0.00 179.25 180.57 2nsv h TRP 20 N -1.28 0.29 0.47 0.00 2.91 -1.09 0.35 115.95 117.60 2nsv h TRP 20 Ca -0.13 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 59.90 2nsv h TRP 20 Cb 0.97 -0.06 -0.02 0.00 -0.51 0.00 0.00 29.16 29.54 2nsv h TRP 20 CO 0.01 0.10 -0.48 1.15 -1.03 0.00 0.00 178.44 178.19 2nsv h THR 21 N 0.34 0.00 0.00 2.65 2.02 -0.72 0.50 112.91 117.70 2nsv h THR 21 Ca 0.22 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.40 2nsv h THR 21 Cb 0.22 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.63 2nsv h THR 21 CO -0.22 0.00 0.08 0.74 0.37 0.00 0.00 175.52 176.49 2nsv h THR 22 N -0.95 0.00 0.23 3.16 2.02 0.16 0.12 112.91 117.65 2nsv h THR 22 Ca -0.06 0.00 -0.30 0.00 0.77 0.00 0.00 66.41 66.82 2nsv h THR 22 Cb 0.83 0.85 0.04 0.00 -1.74 0.00 0.00 68.15 68.12 2nsv h THR 22 CO -0.06 0.00 -1.31 0.00 0.37 0.00 0.00 175.52 174.52 2nsv n THR 24 N -3.83 4.34 -3.91 0.00 -2.24 0.16 -4.57 114.28 104.23 2nsv n THR 24 Ca -0.16 -3.51 -0.09 0.00 -2.27 0.00 0.00 64.05 58.02 2nsv n THR 24 Cb 1.03 -2.43 -0.09 0.00 -2.10 0.00 0.00 70.33 66.75 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 1.21 0.14 0.09 4.28 -4.23 -1.25 -4.80 115.64 111.08 2nsv s THR 25 Ca 0.54 -1.15 -0.30 0.00 -1.18 0.00 0.00 61.69 59.59 2nsv s THR 25 Cb 0.15 -1.08 -0.06 0.00 1.34 0.00 0.00 72.50 72.85 2nsv s THR 25 CO -0.06 -0.63 1.15 -2.16 -0.54 0.00 0.00 174.62 172.38 2nsv s PRO 26 N -3.06 4.49 0.00 3.99 0.04 -1.26 -4.48 135.00 134.71 2nsv s PRO 26 Ca -0.01 1.73 0.00 0.00 0.04 0.00 0.00 61.00 62.76 2nsv s PRO 26 Cb 0.01 -3.33 0.00 0.00 0.04 0.00 0.00 34.50 31.22 2nsv s PRO 26 CO -0.07 -0.14 0.00 0.41 0.04 0.00 0.00 177.00 177.24 2nsv n GLY 27 N 2.83 1.47 0.03 0.56 0.00 -1.26 -4.98 105.19 103.84 2nsv n GLY 27 Ca 0.07 -0.11 -0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 1.36 -2.21 1.61 7.27 -1.26 -4.60 117.38 119.54 2nsv n GLN 28 Ca 0.00 -0.05 -0.19 0.00 0.07 0.00 0.00 57.00 56.82 2nsv n GLN 28 Cb 0.00 -1.28 0.02 0.00 2.41 0.00 0.00 30.24 31.40 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 -2.17 2.26 0.00 1.69 -2.24 -1.26 -4.85 114.28 107.71 2nsv n THR 29 Ca -0.10 -3.99 0.00 0.00 -2.27 0.00 0.00 64.05 57.69 2nsv n THR 29 Cb 0.60 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 68.18 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 0.00 0.00 -0.41 0.00 3.20 -1.88 -2.64 116.97 115.24 2nsv h TYR 31 Ca 0.00 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.83 2nsv h TYR 31 Cb 0.00 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 2nsv h TYR 31 CO 0.00 0.21 0.09 1.15 -1.64 0.00 0.00 178.16 177.97 2nsv h THR 32 N 0.00 1.23 -0.97 1.81 2.02 -1.84 -2.37 112.91 112.79 2nsv h THR 32 Ca -0.00 -0.80 0.12 0.00 0.77 0.00 0.00 66.41 66.49 2nsv h THR 32 Cb 0.43 0.98 -0.08 0.00 -1.74 0.00 0.00 68.15 67.74 2nsv h THR 32 CO 0.03 0.28 0.62 0.00 0.37 0.00 0.00 175.52 176.82 2nsv n SER 35 N -3.85 2.30 -0.19 0.00 3.41 0.34 -2.32 113.62 113.32 2nsv n SER 35 Ca -0.02 -1.77 0.07 0.00 -0.26 0.00 0.00 58.87 56.88 2nsv n SER 35 Cb 0.16 -0.03 0.09 0.00 -0.26 0.00 0.00 64.21 64.17 2nsv n SER 35 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2nsv n SER 36 N 0.79 1.60 0.00 4.04 7.64 0.12 -4.77 113.62 123.04 2nsv n SER 36 Ca 0.17 -2.69 0.00 0.00 1.01 0.00 0.00 58.87 57.35 2nsv n SER 36 Cb 0.48 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.34 2nsv n SER 36 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2nsv s PHE 38 N -1.86 1.63 0.00 0.00 0.08 -0.98 0.21 117.98 117.06 2nsv s PHE 38 Ca 0.00 -0.04 0.00 0.00 0.12 0.00 0.00 56.93 57.01 2nsv s PHE 38 Cb 0.00 -3.40 0.00 0.00 -0.57 0.00 0.00 43.02 39.05 2nsv s PHE 38 CO 0.00 -2.03 0.00 -0.40 -0.10 0.00 0.00 175.22 172.69 2nsv n ASP 39 N -3.17 0.00 -0.11 1.36 5.75 -1.26 -4.72 116.55 114.41 2nsv n ASP 39 Ca 0.15 0.00 -0.18 0.00 -0.01 0.00 0.00 54.79 54.75 2nsv n ASP 39 Cb 0.60 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.62 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 0.00 1.50 0.00 2.12 3.14 -1.26 -4.11 118.33 119.72 2nsv n VAL 40 Ca 0.00 -0.06 0.00 0.00 -2.96 0.00 0.00 64.34 61.32 2nsv n VAL 40 Cb 0.00 -2.13 0.00 0.00 -1.06 0.00 0.00 33.84 30.65 2nsv n VAL 40 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 2nsv n VAL 41 N -4.42 0.00 -0.38 1.55 0.31 -1.26 -1.73 118.33 112.40 2nsv n VAL 41 Ca -0.30 0.75 0.31 0.00 -0.01 0.00 0.00 64.34 65.08 2nsv n VAL 41 Cb 0.63 -1.55 0.50 0.00 -0.91 0.00 0.00 33.84 32.51 2nsv n VAL 41 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2nsv n GLY 42 N 0.90 -0.61 0.18 2.92 0.00 -1.26 0.25 105.19 107.57 2nsv n GLY 42 Ca 0.00 0.50 -0.09 0.00 0.00 0.00 0.00 46.02 46.43 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 -0.34 0.00 1.61 4.81 -1.71 0.13 114.58 119.08 2nsv h GLU 43 Ca 0.61 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.87 2nsv h GLU 43 Cb 2.17 0.08 0.00 0.00 0.63 0.00 0.00 28.75 31.63 2nsv h GLU 43 CO -0.20 -0.04 0.00 0.00 -0.73 0.00 0.00 179.01 178.04 2nsv n GLN 44 N -5.01 0.19 0.03 1.92 10.64 0.47 -1.31 117.38 124.31 2nsv n GLN 44 Ca -0.07 0.36 -0.22 0.00 -1.83 0.00 0.00 57.00 55.24 2nsv n GLN 44 Cb 0.23 -1.82 -0.14 0.00 -0.86 0.00 0.00 30.24 27.64 2nsv n GLN 44 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2nsv h ALA 45 N 2.35 0.16 0.00 2.61 0.00 0.34 -3.30 119.26 121.41 2nsv h ALA 45 Ca 0.00 -1.10 -0.02 0.00 0.00 0.00 0.00 54.91 53.80 2nsv h ALA 45 Cb 0.43 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 2nsv h ALA 45 CO 0.00 0.89 -0.08 0.00 0.00 0.00 0.00 179.25 180.06 2nsv h GLN 47 N 0.00 0.06 -0.38 0.00 4.15 -1.27 1.39 115.11 119.05 2nsv h GLN 47 Ca -0.00 -0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.35 2nsv h GLN 47 Cb 0.70 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.36 2nsv h GLN 47 CO 0.01 0.04 -0.03 0.52 -1.93 0.00 0.00 178.83 177.44 2nsv h MET 48 N 0.06 0.62 -0.00 1.69 2.86 -1.67 -1.29 114.93 117.20 2nsv h MET 48 Ca 0.15 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2nsv h MET 48 Cb 0.22 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.80 2nsv h MET 48 CO -0.28 0.67 -0.12 0.43 1.06 0.00 0.00 176.91 178.66 2nsv n SER 49 N -4.23 0.35 -4.55 1.22 7.64 -0.45 -4.78 113.62 108.82 2nsv n SER 49 Ca 0.02 -0.34 -0.36 0.00 1.01 0.00 0.00 58.87 59.20 2nsv n SER 49 Cb 0.29 -0.12 -0.04 0.00 -1.01 0.00 0.00 64.21 63.33 2nsv n SER 49 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2nsv n ALA 50 N -1.13 0.78 -1.74 -0.43 0.00 0.46 -4.80 120.51 113.65 2nsv n ALA 50 Ca 0.12 -0.91 -0.33 0.00 0.00 0.00 0.00 53.44 52.33 2nsv n ALA 50 Cb 0.29 -3.17 -0.03 0.00 0.00 0.00 0.00 19.45 16.54 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 8.98 3.47 0.00 0.00 7.27 -1.26 -5.02 117.38 130.82 2nsv n GLN 51 Ca 0.38 -2.89 0.00 0.00 0.07 0.00 0.00 57.00 54.56 2nsv n GLN 51 Cb 0.52 -2.37 0.00 0.00 2.41 0.00 0.00 30.24 30.80 2nsv n GLN 51 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13