#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1whf n ASN 2 N 0.00 -7.57 -1.72 0.00 4.13 -1.26 -5.04 115.26 103.80 1whf n ASN 2 Ca 0.00 0.91 -0.03 0.00 1.68 0.00 0.00 54.58 57.14 1whf n ASN 2 Cb 0.00 -4.42 -0.01 0.00 -1.54 0.00 0.00 39.78 33.81 1whf n ASN 2 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 1whf n SER 3 N 0.48 0.92 -0.28 6.41 2.88 -1.26 -5.00 113.62 117.76 1whf n SER 3 Ca 0.02 -1.25 0.00 0.00 -1.33 0.00 0.00 58.87 56.31 1whf n SER 3 Cb 0.26 0.12 0.01 0.00 -0.75 0.00 0.00 64.21 63.85 1whf n SER 3 CO 0.00 0.00 0.00 2.22 -1.23 0.00 0.00 175.04 176.03 1whf n PHE 4 N -0.10 0.05 -1.75 0.66 -1.74 -1.26 -5.07 117.46 108.25 1whf n PHE 4 Ca -0.01 -0.02 -0.35 0.00 -0.56 0.00 0.00 57.45 56.51 1whf n PHE 4 Cb 0.07 -0.05 -0.03 0.00 1.52 0.00 0.00 39.48 40.99 1whf n PHE 4 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1whf s LEU 5 N -0.59 3.32 -0.31 5.98 1.02 -1.26 -4.51 118.68 122.34 1whf s LEU 5 Ca 0.02 0.68 -0.03 0.00 0.02 0.00 0.00 54.13 54.82 1whf s LEU 5 Cb 0.01 -2.52 0.19 0.00 0.02 0.00 0.00 46.19 43.90 1whf s LEU 5 CO 0.01 -2.77 0.83 0.68 0.02 0.00 0.00 176.35 175.12 1whf s VAL 8 N 11.20 -0.61 0.28 -1.59 -7.23 -1.26 -5.10 120.40 116.09 1whf s VAL 8 Ca 0.85 0.00 0.26 0.00 -1.81 0.00 0.00 61.98 61.28 1whf s VAL 8 Cb -0.15 -0.52 0.26 0.00 0.56 0.00 0.00 36.38 36.53 1whf s VAL 8 CO 0.22 0.00 1.77 0.11 -0.31 0.00 0.00 175.10 176.89 1whf h LYS 9 N 7.40 0.00 -1.48 4.82 1.79 -1.92 -3.46 116.57 123.72 1whf h LYS 9 Ca -0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 1whf h LYS 9 Cb 1.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 1whf h LYS 9 CO 0.02 0.00 0.00 0.94 -1.08 0.00 0.00 179.45 179.33 1whf n GLN 10 N -2.54 0.00 0.00 3.15 7.27 -1.26 -5.06 117.38 118.94 1whf n GLN 10 Ca -0.02 0.36 0.00 0.00 0.07 0.00 0.00 57.00 57.42 1whf n GLN 10 Cb 0.22 -0.37 0.00 0.00 2.41 0.00 0.00 30.24 32.50 1whf n GLN 10 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1whf n GLY 11 N 0.80 -3.15 0.69 1.69 0.00 -1.26 -5.00 105.19 98.96 1whf n GLY 11 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 1whf n GLY 11 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1whf n ASN 12 N 0.00 0.00 0.00 1.61 5.15 -1.26 -4.94 115.26 115.82 1whf n ASN 12 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1whf n ASN 12 Cb 0.00 0.17 0.00 0.00 -0.53 0.00 0.00 39.78 39.42 1whf n ASN 12 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1whf n LEU 13 N -1.84 0.00 -3.01 1.20 -0.00 -1.26 -5.07 117.00 107.02 1whf n LEU 13 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 56.01 55.99 1whf n LEU 13 Cb 0.00 0.07 -0.00 0.00 -0.00 0.00 0.00 43.42 43.48 1whf n LEU 13 CO 0.00 -0.07 -0.02 0.54 -0.00 0.00 0.00 177.39 177.84 1whf n ARG 15 N -1.39 -1.00 0.00 1.96 1.74 -1.26 -5.01 116.66 111.70 1whf n ARG 15 Ca 0.00 -0.17 0.00 0.00 -0.77 0.00 0.00 57.85 56.91 1whf n ARG 15 Cb 0.00 0.10 0.00 0.00 -1.02 0.00 0.00 32.46 31.54 1whf n ARG 15 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1whf n LEU 18 N 0.00 2.94 -2.78 0.00 -0.00 -1.26 -4.79 117.00 111.10 1whf n LEU 18 Ca 0.00 -2.72 -0.18 0.00 -0.00 0.00 0.00 56.01 53.10 1whf n LEU 18 Cb 0.00 -0.37 0.00 0.00 -0.00 0.00 0.00 43.42 43.05 1whf n LEU 18 CO 0.00 0.67 -0.11 0.00 -0.00 0.00 0.00 177.39 177.95 1whf n ALA 21 N -0.65 -0.87 0.00 1.96 0.00 -1.26 -5.06 120.51 114.63 1whf n ALA 21 Ca 0.15 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1whf n ALA 21 Cb 0.64 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.68 1whf n ALA 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1whf n SER 23 N -2.27 0.00 -1.23 0.00 2.88 -1.26 -4.56 113.62 107.19 1whf n SER 23 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1whf n SER 23 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1whf n SER 23 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1whf n LEU 24 N 0.00 -1.63 0.00 2.46 0.00 -1.26 -5.03 117.00 111.53 1whf n LEU 24 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 1whf n LEU 24 Cb 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 43.42 42.60 1whf n LEU 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.39 177.39 1whf n ALA 27 N -0.68 0.00 -0.62 1.96 0.00 -1.26 -5.11 120.51 114.79 1whf n ALA 27 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 1whf n ALA 27 Cb 0.27 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.80 1whf n ALA 27 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1whf n ARG 28 N -0.65 1.86 0.00 0.00 1.85 -1.26 -3.17 116.66 115.29 1whf n ARG 28 Ca 0.00 -1.85 0.00 0.00 -1.00 0.00 0.00 57.85 55.00 1whf n ARG 28 Cb 0.00 -1.73 0.00 0.00 -1.05 0.00 0.00 32.46 29.68 1whf n ARG 28 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1whf n VAL 30 N -0.23 0.00 -3.02 8.89 0.31 -1.26 -5.02 118.33 118.00 1whf n VAL 30 Ca 0.36 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.51 1whf n VAL 30 Cb 0.92 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 33.89 1whf n VAL 30 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1whf s PHE 31 N 0.00 2.09 0.01 3.52 0.40 -1.19 -4.89 117.98 117.92 1whf s PHE 31 Ca 0.00 -0.57 0.00 0.00 -0.60 0.00 0.00 56.93 55.76 1whf s PHE 31 Cb 0.00 -2.29 0.00 0.00 0.51 0.00 0.00 43.02 41.24 1whf s PHE 31 CO 0.00 -0.80 0.00 -0.25 0.70 0.00 0.00 175.22 174.87 1whf n ASP 33 N -2.05 -2.79 -0.50 1.36 9.92 -1.26 -4.77 116.55 116.45 1whf n ASP 33 Ca 0.12 0.19 0.00 0.00 -0.53 0.00 0.00 54.79 54.57 1whf n ASP 33 Cb 0.60 -1.44 0.00 0.00 -0.64 0.00 0.00 41.12 39.64 1whf n ASP 33 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1whf n ALA 34 N 0.19 2.38 0.00 2.24 0.00 -1.26 -0.80 120.51 123.26 1whf n ALA 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1whf n ALA 34 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1whf n ALA 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1whf n GLN 36 N 0.04 0.00 -0.14 0.00 1.13 -1.26 -3.66 117.38 113.50 1whf n GLN 36 Ca 0.00 0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 54.93 1whf n GLN 36 Cb 0.23 0.00 -0.08 0.00 0.11 0.00 0.00 30.24 30.50 1whf n GLN 36 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 1whf h THR 37 N 0.00 0.03 -0.02 5.09 1.35 -1.27 0.33 112.91 118.42 1whf h THR 37 Ca 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1whf h THR 37 Cb 0.00 0.03 -0.00 0.00 -1.73 0.00 0.00 68.15 66.45 1whf h THR 37 CO 0.00 0.00 0.01 -0.67 -0.25 0.00 0.00 175.52 174.61 1whf n ASP 38 N -5.39 1.60 0.00 5.36 2.03 -1.24 -3.10 116.55 115.80 1whf n ASP 38 Ca -0.03 -2.04 0.00 0.00 0.52 0.00 0.00 54.79 53.25 1whf n ASP 38 Cb 0.35 -0.51 0.00 0.00 -0.72 0.00 0.00 41.12 40.24 1whf n ASP 38 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1whf n PHE 40 N 0.12 0.00 -0.01 -0.67 -0.00 0.12 0.06 117.46 117.07 1whf n PHE 40 Ca 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 57.45 57.46 1whf n PHE 40 Cb 0.34 0.00 -0.00 0.00 -0.00 0.00 0.00 39.48 39.82 1whf n PHE 40 CO 0.00 0.00 0.00 -1.49 -0.00 0.00 0.00 176.76 175.27 1whf h TRP 41 N 0.00 0.00 -0.13 -5.13 -0.00 -1.61 -1.56 115.95 107.53 1whf h TRP 41 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 58.89 58.92 1whf h TRP 41 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 29.16 29.13 1whf h TRP 41 CO 0.00 0.00 -0.04 1.03 -0.00 0.00 0.00 178.44 179.43 1whf h SER 42 N -0.25 -0.13 -0.02 -3.49 0.87 -0.65 0.65 113.55 110.53 1whf h SER 42 Ca 0.00 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1whf h SER 42 Cb 0.00 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1whf h SER 42 CO 0.00 -0.05 0.00 1.17 -0.53 0.00 0.00 176.83 177.42 1whf n LYS 43 N -5.17 1.13 0.00 2.24 4.81 -1.25 -4.24 118.16 115.69 1whf n LYS 43 Ca -0.04 -0.20 0.00 0.00 -0.87 0.00 0.00 58.31 57.20 1whf n LYS 43 Cb 0.10 -1.40 0.00 0.00 0.02 0.00 0.00 35.03 33.74 1whf n LYS 43 CO 0.00 0.00 0.00 0.98 1.17 0.00 0.00 177.40 179.55 1whf n TYR 44 N -0.68 0.00 0.00 5.64 4.19 0.22 -4.42 117.16 122.11 1whf n TYR 44 Ca 0.19 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.40 1whf n TYR 44 Cb 0.13 -0.48 0.00 0.00 0.49 0.00 0.00 39.34 39.48 1whf n TYR 44 CO 0.00 0.00 0.00 0.36 0.91 0.00 0.00 176.86 178.13 1whf n LYS 45 N -2.61 0.00 0.00 2.98 2.85 -1.26 -3.73 118.16 116.39 1whf n LYS 45 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1whf n LYS 45 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1whf n LYS 45 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1whf n ASP 46 N 0.00 0.00 0.00 -5.58 -0.08 -1.26 -5.00 116.55 104.63 1whf n ASP 46 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1whf n ASP 46 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1whf n ASP 46 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1whf n GLY 47 N -0.49 0.96 2.26 0.27 0.00 -1.24 -4.00 105.19 102.95 1whf n GLY 47 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 46.02 45.98 1whf n GLY 47 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1whf n ASP 48 N 0.06 -3.79 0.00 1.61 5.68 -1.26 -1.37 116.55 117.47 1whf n ASP 48 Ca 0.00 0.02 0.00 0.00 -0.50 0.00 0.00 54.79 54.31 1whf n ASP 48 Cb 0.00 -1.36 0.00 0.00 -1.14 0.00 0.00 41.12 38.62 1whf n ASP 48 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1whf n GLN 49 N -2.04 0.00 -0.00 0.11 1.13 -1.26 -3.93 117.38 111.39 1whf n GLN 49 Ca -0.01 0.00 0.03 0.00 -1.94 0.00 0.00 57.00 55.08 1whf n GLN 49 Cb 0.14 -2.23 -0.03 0.00 0.11 0.00 0.00 30.24 28.23 1whf n GLN 49 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1whf s GLU 51 N -1.64 3.48 0.00 0.00 2.12 -0.47 -3.34 118.70 118.84 1whf s GLU 51 Ca 0.01 1.29 0.00 0.00 0.36 0.00 0.00 54.97 56.63 1whf s GLU 51 Cb 0.04 -2.05 0.00 0.00 0.26 0.00 0.00 34.13 32.38 1whf s GLU 51 CO 0.23 -0.69 0.00 0.41 -0.54 0.00 0.00 175.26 174.67 1whf n GLY 52 N -0.64 1.88 2.41 -1.50 0.00 -1.26 -4.46 105.19 101.61 1whf n GLY 52 Ca 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.11 1whf n GLY 52 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1whf n HIS 53 N -2.00 -1.72 -0.37 1.61 -0.00 -1.21 -4.92 115.22 106.61 1whf n HIS 53 Ca 0.00 0.65 -0.01 0.00 0.46 0.00 0.00 57.72 58.82 1whf n HIS 53 Cb 0.00 -3.03 0.13 0.00 -0.12 0.00 0.00 29.99 26.96 1whf n HIS 53 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1whf h PRO 54 N 0.23 1.29 -7.54 1.57 0.11 -1.78 -3.43 132.00 122.45 1whf h PRO 54 Ca -0.01 -0.08 -0.46 0.00 0.11 0.00 0.00 66.00 65.56 1whf h PRO 54 Cb 1.01 -0.29 0.13 0.00 0.11 0.00 0.00 31.00 31.96 1whf h PRO 54 CO 0.18 0.85 0.30 0.00 -0.21 0.00 0.00 178.00 179.12 1whf n LEU 56 N -3.39 0.00 -3.81 0.00 4.77 0.14 -4.85 117.00 109.86 1whf n LEU 56 Ca 0.15 -1.75 -0.31 0.00 -0.03 0.00 0.00 56.01 54.08 1whf n LEU 56 Cb 0.60 0.93 0.02 0.00 -2.33 0.00 0.00 43.42 42.64 1whf n LEU 56 CO 0.44 -0.29 -0.14 0.59 -1.33 0.00 0.00 177.39 176.67 1whf n ASN 57 N -2.27 -3.45 -2.49 -1.43 3.02 -1.25 -0.44 115.26 106.96 1whf n ASN 57 Ca 0.04 -1.04 -0.08 0.00 -0.03 0.00 0.00 54.58 53.47 1whf n ASN 57 Cb 0.33 -3.11 -0.00 0.00 -0.61 0.00 0.00 39.78 36.39 1whf n ASN 57 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1whf n GLN 58 N -4.35 -2.55 -2.68 3.52 1.13 -1.26 -4.53 117.38 106.67 1whf n GLN 58 Ca -0.17 0.36 -0.33 0.00 -1.94 0.00 0.00 57.00 54.92 1whf n GLN 58 Cb 0.62 -4.92 -0.06 0.00 0.11 0.00 0.00 30.24 25.99 1whf n GLN 58 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1whf s GLY 59 N -2.04 2.34 0.56 1.08 0.00 0.42 -4.48 107.32 105.20 1whf s GLY 59 Ca 0.01 0.39 -0.15 0.00 0.00 0.00 0.00 44.72 44.98 1whf s GLY 59 CO 0.01 0.68 1.01 -1.58 0.00 0.00 0.00 173.10 173.22 1whf s HIS 60 N -2.24 3.49 -0.18 1.90 2.46 0.11 -4.70 115.29 116.14 1whf s HIS 60 Ca 0.62 1.41 0.01 0.00 0.47 0.00 0.00 55.06 57.57 1whf s HIS 60 Cb -0.10 -2.78 0.03 0.00 -0.13 0.00 0.00 32.58 29.60 1whf s HIS 60 CO 0.18 -0.53 -0.12 0.00 -2.47 0.00 0.00 174.74 171.80 1whf n LYS 62 N 4.73 0.27 0.00 0.00 4.01 0.37 -4.93 118.16 122.61 1whf n LYS 62 Ca -0.16 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.64 1whf n LYS 62 Cb 0.48 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.00 1whf n LYS 62 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1whf n GLY 64 N 4.78 4.55 0.40 0.72 0.00 -0.61 -3.80 105.19 111.23 1whf n GLY 64 Ca 0.00 -0.83 -0.14 0.00 0.00 0.00 0.00 46.02 45.06 1whf n GLY 64 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1whf h ILE 65 N 0.00 0.00 -0.84 -0.61 1.08 -1.95 -2.05 117.51 113.14 1whf h ILE 65 Ca 0.00 0.00 0.17 0.00 -0.39 0.00 0.00 64.86 64.64 1whf h ILE 65 Cb 0.00 0.00 -0.16 0.00 -3.07 0.00 0.00 36.82 33.59 1whf h ILE 65 CO 0.00 0.00 -0.21 1.23 -0.69 0.00 0.00 178.15 178.48 1whf h GLY 66 N -0.65 0.59 0.00 5.37 0.00 -1.99 -3.45 103.07 102.94 1whf h GLY 66 Ca -0.01 0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.60 1whf h GLY 66 CO -0.20 -0.32 0.00 2.09 0.00 0.00 0.00 176.54 178.11 1whf n ASP 67 N -5.54 0.83 -0.52 0.19 5.75 -0.77 -5.07 116.55 111.43 1whf n ASP 67 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.90 1whf n ASP 67 Cb 0.42 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.51 1whf n ASP 67 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1whf n TYR 68 N 0.00 -0.51 -3.93 2.11 4.11 -1.26 -1.58 117.16 116.11 1whf n TYR 68 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.90 57.79 1whf n TYR 68 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 39.34 39.32 1whf n TYR 68 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.86 177.11 1whf n THR 69 N 0.00 0.00 -4.10 -3.48 -2.24 -1.25 -4.98 114.28 98.24 1whf n THR 69 Ca 0.00 -1.34 -0.07 0.00 -2.27 0.00 0.00 64.05 60.37 1whf n THR 69 Cb 0.00 0.85 -0.03 0.00 -2.10 0.00 0.00 70.33 69.05 1whf n THR 69 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1whf s THR 71 N -2.44 0.00 -0.06 0.00 2.01 0.11 -4.67 115.64 110.59 1whf s THR 71 Ca 0.13 0.00 -0.03 0.00 0.31 0.00 0.00 61.69 62.11 1whf s THR 71 Cb 0.01 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.48 1whf s THR 71 CO 0.09 0.00 0.07 0.00 -0.69 0.00 0.00 174.62 174.09 1whf s ALA 73 N -1.04 1.80 -0.67 0.00 0.00 -1.26 -4.87 121.76 115.71 1whf s ALA 73 Ca 0.17 -1.11 -0.27 0.00 0.00 0.00 0.00 51.96 50.75 1whf s ALA 73 Cb -0.12 -2.81 0.03 0.00 0.00 0.00 0.00 23.12 20.22 1whf s ALA 73 CO 0.07 -2.73 1.22 -2.00 0.00 0.00 0.00 175.76 172.32 1whf s GLU 74 N -5.75 3.30 0.00 0.00 2.12 -1.26 -2.82 118.70 114.30 1whf s GLU 74 Ca 0.73 -0.10 0.00 0.00 0.36 0.00 0.00 54.97 55.96 1whf s GLU 74 Cb -0.06 -4.12 0.00 0.00 0.26 0.00 0.00 34.13 30.21 1whf s GLU 74 CO 0.54 -1.95 0.00 0.41 -0.54 0.00 0.00 175.26 173.72 1whf n GLY 75 N 5.26 1.27 3.11 -1.50 0.00 -1.26 -4.92 105.19 107.15 1whf n GLY 75 Ca 0.05 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.99 1whf n GLY 75 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1whf s PHE 76 N -1.27 0.44 0.31 1.61 0.40 -1.13 -1.33 117.98 117.01 1whf s PHE 76 Ca 0.00 -0.97 -0.07 0.00 -0.60 0.00 0.00 56.93 55.29 1whf s PHE 76 Cb 0.00 -0.32 0.00 0.00 0.51 0.00 0.00 43.02 43.21 1whf s PHE 76 CO 0.00 -0.41 0.50 -1.21 0.70 0.00 0.00 175.22 174.80 1whf s GLU 77 N -3.88 1.79 0.00 0.44 2.02 0.16 -4.81 118.70 114.42 1whf s GLU 77 Ca 0.06 -1.54 0.00 0.00 0.02 0.00 0.00 54.97 53.51 1whf s GLU 77 Cb 0.07 0.47 0.00 0.00 0.10 0.00 0.00 34.13 34.77 1whf s GLU 77 CO -0.10 -0.75 0.00 0.41 0.02 0.00 0.00 175.26 174.84 1whf n GLY 78 N -0.49 0.70 0.42 -1.39 0.00 -1.26 -0.30 105.19 102.88 1whf n GLY 78 Ca -0.01 -1.87 -0.17 0.00 0.00 0.00 0.00 46.02 43.98 1whf n GLY 78 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1whf h LYS 79 N 0.00 -0.81 -0.87 1.61 3.11 -2.01 -1.57 116.57 116.03 1whf h LYS 79 Ca 0.00 0.06 -0.22 0.00 -2.81 0.00 0.00 60.65 57.68 1whf h LYS 79 Cb 0.00 0.18 -0.13 0.00 -1.00 0.00 0.00 32.23 31.28 1whf h LYS 79 CO 0.00 -0.54 0.28 0.09 -2.81 0.00 0.00 179.45 176.47 1whf n ASN 80 N -5.50 3.92 -0.53 4.20 3.02 -1.26 -4.81 115.26 114.29 1whf n ASN 80 Ca -0.11 -2.96 -0.07 0.00 -0.03 0.00 0.00 54.58 51.41 1whf n ASN 80 Cb 0.40 -0.70 -0.03 0.00 -0.61 0.00 0.00 39.78 38.84 1whf n ASN 80 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1whf h GLU 82 N 0.16 0.33 -5.96 0.00 4.81 -1.24 -3.30 114.58 109.37 1whf h GLU 82 Ca -0.14 -0.02 -0.62 0.00 -0.13 0.00 0.00 59.36 58.45 1whf h GLU 82 Cb 0.80 -0.07 -0.09 0.00 0.63 0.00 0.00 28.75 30.02 1whf h GLU 82 CO 0.21 0.22 1.79 -0.06 -0.73 0.00 0.00 179.01 180.43 1whf s PHE 83 N -5.84 2.60 -0.35 0.92 0.08 0.59 -4.88 117.98 111.10 1whf s PHE 83 Ca -0.11 -1.11 -0.28 0.00 0.12 0.00 0.00 56.93 55.54 1whf s PHE 83 Cb 0.27 -4.68 -0.02 0.00 -0.57 0.00 0.00 43.02 38.02 1whf s PHE 83 CO 0.78 -1.85 1.77 -1.12 -0.10 0.00 0.00 175.22 174.70 1whf s SER 84 N 4.79 5.89 -0.09 1.36 0.01 -1.24 -0.66 113.70 123.75 1whf s SER 84 Ca 0.51 1.21 0.08 0.00 1.31 0.00 0.00 55.95 59.06 1whf s SER 84 Cb 0.02 -2.53 -0.24 0.00 0.21 0.00 0.00 66.02 63.48 1whf s SER 84 CO -0.01 -1.73 0.47 0.35 0.41 0.00 0.00 173.24 172.74 1whf n THR 85 N 7.38 1.62 0.00 1.44 -2.24 -0.93 -4.95 114.28 116.59 1whf n THR 85 Ca 0.22 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 61.24 1whf n THR 85 Cb 0.47 -1.15 0.00 0.00 -2.10 0.00 0.00 70.33 67.55 1whf n THR 85 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04