#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1whe n ASN 2 N 0.00 -6.43 -3.25 0.00 3.02 -1.26 -4.09 115.26 103.25 1whe n ASN 2 Ca 0.00 -0.36 -0.25 0.00 -0.03 0.00 0.00 54.58 53.93 1whe n ASN 2 Cb 0.00 -4.61 0.02 0.00 -0.61 0.00 0.00 39.78 34.58 1whe n ASN 2 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1whe n SER 3 N -2.39 -6.51 -0.11 6.41 2.88 -1.26 -4.80 113.62 107.84 1whe n SER 3 Ca -0.03 0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 1whe n SER 3 Cb 0.56 -3.24 0.01 0.00 -0.75 0.00 0.00 64.21 60.79 1whe n SER 3 CO 0.00 0.00 0.00 2.22 -1.23 0.00 0.00 175.04 176.03 1whe n PHE 4 N -0.39 0.05 -2.43 0.66 1.16 -1.26 -5.06 117.46 110.19 1whe n PHE 4 Ca -0.01 -0.02 -0.38 0.00 -1.87 0.00 0.00 57.45 55.16 1whe n PHE 4 Cb 0.59 -0.01 -0.03 0.00 -1.61 0.00 0.00 39.48 38.42 1whe n PHE 4 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1whe s LEU 5 N -0.91 3.35 0.00 5.98 2.01 -1.26 -5.01 118.68 122.85 1whe s LEU 5 Ca 0.02 -0.97 0.00 0.00 0.01 0.00 0.00 54.13 53.19 1whe s LEU 5 Cb 0.01 -2.56 0.00 0.00 0.01 0.00 0.00 46.19 43.65 1whe s LEU 5 CO 0.01 -1.85 0.00 1.33 1.01 0.00 0.00 176.35 176.85 1whe n VAL 8 N 6.97 0.00 -0.28 -1.59 0.24 -1.26 -4.72 118.33 117.68 1whe n VAL 8 Ca 0.27 0.00 -0.02 0.00 -2.04 0.00 0.00 64.34 62.54 1whe n VAL 8 Cb 0.50 0.00 0.01 0.00 -1.47 0.00 0.00 33.84 32.88 1whe n VAL 8 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1whe n LYS 9 N 0.46 1.11 -1.99 7.34 4.76 -1.26 -4.76 118.16 123.82 1whe n LYS 9 Ca 0.00 -0.22 -0.02 0.00 -2.87 0.00 0.00 58.31 55.20 1whe n LYS 9 Cb 0.00 -1.09 0.00 0.00 -1.84 0.00 0.00 35.03 32.11 1whe n LYS 9 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 1whe n GLN 10 N 1.15 -0.70 0.00 1.97 7.27 -1.26 -4.92 117.38 120.89 1whe n GLN 10 Ca 0.04 0.99 0.00 0.00 0.07 0.00 0.00 57.00 58.10 1whe n GLN 10 Cb 0.52 -2.95 0.00 0.00 2.41 0.00 0.00 30.24 30.22 1whe n GLN 10 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1whe n GLY 11 N -0.70 0.22 0.00 1.69 0.00 -1.26 -4.88 105.19 100.26 1whe n GLY 11 Ca 0.03 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.04 1whe n GLY 11 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1whe n ASN 12 N 0.00 0.00 0.00 1.61 5.03 -1.26 -4.84 115.26 115.80 1whe n ASN 12 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 1whe n ASN 12 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 1whe n ASN 12 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 1whe n LEU 13 N 0.00 0.00 -1.76 3.41 -0.00 -1.26 -4.76 117.00 112.63 1whe n LEU 13 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 56.01 56.00 1whe n LEU 13 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1whe n LEU 13 CO 0.00 0.00 -0.02 0.54 -0.00 0.00 0.00 177.39 177.91 1whe n ARG 15 N 10.29 -1.96 0.00 1.96 1.74 -1.26 -4.86 116.66 122.58 1whe n ARG 15 Ca 0.00 0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 1whe n ARG 15 Cb 0.00 -4.35 0.00 0.00 -1.02 0.00 0.00 32.46 27.09 1whe n ARG 15 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1whe n LEU 18 N 0.00 4.60 -2.31 0.00 -0.00 -1.26 -2.47 117.00 115.56 1whe n LEU 18 Ca 0.00 -5.45 -0.17 0.00 -0.00 0.00 0.00 56.01 50.38 1whe n LEU 18 Cb 0.00 -0.78 0.03 0.00 -0.00 0.00 0.00 43.42 42.66 1whe n LEU 18 CO 0.00 2.06 0.12 0.00 -0.00 0.00 0.00 177.39 179.56 1whe n ALA 21 N 0.65 4.32 -0.52 1.47 0.00 -1.26 -5.27 120.51 119.91 1whe n ALA 21 Ca 0.31 -3.55 -0.18 0.00 0.00 0.00 0.00 53.44 50.02 1whe n ALA 21 Cb 0.38 -0.52 0.01 0.00 0.00 0.00 0.00 19.45 19.33 1whe n ALA 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1whe n SER 23 N 1.52 0.00 -2.69 0.00 3.41 -1.26 -4.77 113.62 109.83 1whe n SER 23 Ca 0.01 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.59 1whe n SER 23 Cb 0.25 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.23 1whe n SER 23 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1whe s LEU 24 N 0.00 -0.29 0.00 1.04 1.98 -1.26 -4.97 118.68 115.19 1whe s LEU 24 Ca 0.00 -0.31 0.00 0.00 -2.89 0.00 0.00 54.13 50.93 1whe s LEU 24 Cb 0.00 0.37 0.00 0.00 0.66 0.00 0.00 46.19 47.22 1whe s LEU 24 CO 0.00 -0.01 0.00 0.00 -1.89 0.00 0.00 176.35 174.45 1whe n ALA 27 N 2.76 0.00 0.09 5.97 0.00 -1.26 -5.01 120.51 123.06 1whe n ALA 27 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1whe n ALA 27 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 1whe n ALA 27 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1whe n ARG 28 N 0.00 0.09 -1.04 0.00 1.85 -1.26 -3.12 116.66 113.18 1whe n ARG 28 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1whe n ARG 28 Cb 0.00 -1.36 0.00 0.00 -1.05 0.00 0.00 32.46 30.05 1whe n ARG 28 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1whe n VAL 30 N 0.83 0.00 0.00 8.89 0.31 -1.26 -4.93 118.33 122.17 1whe n VAL 30 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1whe n VAL 30 Cb 0.04 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.97 1whe n VAL 30 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1whe n PHE 31 N -0.42 0.00 -1.71 3.52 3.01 -1.18 -3.99 117.46 116.69 1whe n PHE 31 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1whe n PHE 31 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 1whe n PHE 31 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1whe n ASP 33 N 0.00 -8.91 -1.11 4.37 9.92 -1.26 -5.05 116.55 114.51 1whe n ASP 33 Ca 0.00 1.26 -0.01 0.00 -0.53 0.00 0.00 54.79 55.51 1whe n ASP 33 Cb 0.00 -4.68 0.01 0.00 -0.64 0.00 0.00 41.12 35.81 1whe n ASP 33 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1whe n ALA 34 N 0.20 2.81 0.00 2.24 0.00 -1.26 -3.19 120.51 121.32 1whe n ALA 34 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1whe n ALA 34 Cb 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1whe n ALA 34 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1whe n GLN 36 N 0.56 0.00 -0.21 0.00 -0.06 -1.26 -2.39 117.38 114.02 1whe n GLN 36 Ca 0.02 0.00 0.26 0.00 -2.00 0.00 0.00 57.00 55.28 1whe n GLN 36 Cb 0.54 0.00 0.66 0.00 -4.06 0.00 0.00 30.24 27.38 1whe n GLN 36 CO 0.00 0.00 0.00 1.79 -0.20 0.00 0.00 177.06 178.65 1whe h THR 37 N 0.00 0.58 -0.03 1.69 1.35 -1.91 0.81 112.91 115.40 1whe h THR 37 Ca 0.00 -0.04 0.00 0.00 -0.55 0.00 0.00 66.41 65.82 1whe h THR 37 Cb 0.00 0.44 0.00 0.00 -1.73 0.00 0.00 68.15 66.86 1whe h THR 37 CO 0.00 0.02 0.00 0.47 -0.25 0.00 0.00 175.52 175.76 1whe n ASP 38 N -4.35 0.29 0.00 5.36 9.92 -1.01 -4.19 116.55 122.57 1whe n ASP 38 Ca 0.19 -1.59 0.00 0.00 -0.53 0.00 0.00 54.79 52.86 1whe n ASP 38 Cb 0.89 -0.02 0.00 0.00 -0.64 0.00 0.00 41.12 41.35 1whe n ASP 38 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 1whe n PHE 40 N -0.54 0.00 0.00 1.24 7.35 0.28 -4.33 117.46 121.47 1whe n PHE 40 Ca 0.11 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.80 1whe n PHE 40 Cb 0.09 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.92 1whe n PHE 40 CO 0.00 0.00 0.00 0.91 -0.76 0.00 0.00 176.76 176.91 1whe n TRP 41 N 0.00 0.00 -3.60 -5.13 5.03 -1.26 -4.47 117.44 108.02 1whe n TRP 41 Ca 0.00 0.00 -0.17 0.00 3.03 0.00 0.00 57.50 60.36 1whe n TRP 41 Cb 0.00 0.00 0.01 0.00 -1.03 0.00 0.00 31.31 30.29 1whe n TRP 41 CO 0.00 0.00 0.00 -1.13 -0.03 0.00 0.00 177.69 176.53 1whe n SER 42 N -0.08 -1.82 -1.84 -0.99 3.41 -1.26 0.49 113.62 111.54 1whe n SER 42 Ca 0.00 -0.51 -0.06 0.00 -0.26 0.00 0.00 58.87 58.04 1whe n SER 42 Cb 0.00 -0.66 0.03 0.00 -0.26 0.00 0.00 64.21 63.32 1whe n SER 42 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1whe n LYS 43 N -2.24 -2.38 -1.11 4.33 4.81 -1.26 -4.71 118.16 115.59 1whe n LYS 43 Ca -0.08 0.30 -0.08 0.00 -0.87 0.00 0.00 58.31 57.58 1whe n LYS 43 Cb 0.26 -3.69 -0.08 0.00 0.02 0.00 0.00 35.03 31.53 1whe n LYS 43 CO 0.00 0.00 0.00 0.98 1.17 0.00 0.00 177.40 179.55 1whe n TYR 44 N -2.21 0.00 0.03 5.64 9.36 0.18 -4.39 117.16 125.78 1whe n TYR 44 Ca -0.09 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.13 1whe n TYR 44 Cb 0.56 -0.47 0.00 0.00 -0.63 0.00 0.00 39.34 38.80 1whe n TYR 44 CO 0.00 0.00 0.00 1.17 0.22 0.00 0.00 176.86 178.25 1whe n LYS 45 N 4.56 0.00 0.00 2.98 3.00 -1.26 -5.10 118.16 122.33 1whe n LYS 45 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.56 1whe n LYS 45 Cb 0.34 -0.49 0.00 0.00 0.00 0.00 0.00 35.03 34.88 1whe n LYS 45 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1whe n ASP 46 N -3.32 0.00 -2.16 3.14 2.03 -1.26 -5.00 116.55 109.98 1whe n ASP 46 Ca 0.00 0.00 -0.19 0.00 0.52 0.00 0.00 54.79 55.12 1whe n ASP 46 Cb 0.17 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.53 1whe n ASP 46 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1whe n GLY 47 N 0.00 3.89 1.95 0.27 0.00 -1.26 -4.75 105.19 105.28 1whe n GLY 47 Ca 0.00 -1.40 -0.03 0.00 0.00 0.00 0.00 46.02 44.59 1whe n GLY 47 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1whe n ASP 48 N 1.09 -1.37 -0.53 1.61 9.92 -1.26 -4.64 116.55 121.37 1whe n ASP 48 Ca 0.39 0.27 0.40 0.00 -0.53 0.00 0.00 54.79 55.32 1whe n ASP 48 Cb 0.63 -1.42 0.62 0.00 -0.64 0.00 0.00 41.12 40.30 1whe n ASP 48 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1whe n GLN 49 N -1.99 -0.00 -3.35 -1.24 3.00 -1.26 -1.57 117.38 110.97 1whe n GLN 49 Ca -0.04 0.84 -0.26 0.00 -0.01 0.00 0.00 57.00 57.54 1whe n GLN 49 Cb 0.35 -1.92 -0.09 0.00 0.00 0.00 0.00 30.24 28.58 1whe n GLN 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1whe n GLU 51 N 2.37 1.16 0.00 0.00 -0.58 -0.61 -4.66 120.64 118.32 1whe n GLU 51 Ca 0.27 -0.27 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1whe n GLU 51 Cb 0.49 -1.13 0.00 0.00 -0.57 0.00 0.00 31.44 30.23 1whe n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1whe n GLY 52 N 1.39 3.10 0.00 0.62 0.00 -1.26 -4.75 105.19 104.29 1whe n GLY 52 Ca 0.06 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1whe n GLY 52 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1whe n HIS 53 N 0.00 0.00 0.19 1.61 -0.00 -1.26 -5.01 115.22 110.75 1whe n HIS 53 Ca 0.00 0.00 0.04 0.00 0.46 0.00 0.00 57.72 58.22 1whe n HIS 53 Cb 0.00 0.00 0.38 0.00 -0.12 0.00 0.00 29.99 30.25 1whe n HIS 53 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1whe h PRO 54 N 0.00 0.00 -6.83 1.57 0.13 -1.86 -3.44 132.00 121.57 1whe h PRO 54 Ca 0.00 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.61 1whe h PRO 54 Cb 0.00 0.00 0.06 0.00 0.13 0.00 0.00 31.00 31.19 1whe h PRO 54 CO 0.00 0.36 0.68 0.00 -0.23 0.00 0.00 178.00 178.82 1whe s LEU 56 N -1.29 2.65 -1.34 0.00 1.43 -1.22 -4.20 118.68 114.69 1whe s LEU 56 Ca 0.53 0.44 -0.12 0.00 -1.03 0.00 0.00 54.13 53.94 1whe s LEU 56 Cb -0.41 -2.65 0.10 0.00 0.03 0.00 0.00 46.19 43.26 1whe s LEU 56 CO 0.50 -2.40 0.54 -0.46 0.23 0.00 0.00 176.35 174.76 1whe n ASN 57 N -3.57 -3.36 -0.92 2.29 0.23 -1.26 -1.10 115.26 107.57 1whe n ASN 57 Ca 0.13 -0.54 -0.12 0.00 -0.53 0.00 0.00 54.58 53.52 1whe n ASN 57 Cb 0.60 -2.79 -0.05 0.00 -2.08 0.00 0.00 39.78 35.46 1whe n ASN 57 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1whe n GLN 58 N -3.84 -1.57 -0.10 -3.83 6.02 -1.26 -4.50 117.38 108.30 1whe n GLN 58 Ca 0.02 0.91 -0.10 0.00 -0.01 0.00 0.00 57.00 57.82 1whe n GLN 58 Cb 0.52 -5.27 0.09 0.00 1.02 0.00 0.00 30.24 26.60 1whe n GLN 58 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1whe n GLY 59 N -0.04 -3.39 3.88 1.08 0.00 -0.26 -4.89 105.19 101.56 1whe n GLY 59 Ca -0.12 -1.11 -0.21 0.00 0.00 0.00 0.00 46.02 44.58 1whe n GLY 59 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1whe s HIS 60 N -1.31 3.13 -0.15 1.61 3.76 -0.44 -4.80 115.29 117.07 1whe s HIS 60 Ca 0.21 -0.15 0.00 0.00 -0.15 0.00 0.00 55.06 54.97 1whe s HIS 60 Cb -0.04 -1.60 -0.00 0.00 1.11 0.00 0.00 32.58 32.05 1whe s HIS 60 CO 0.18 0.36 -0.16 0.00 -0.85 0.00 0.00 174.74 174.27 1whe n LYS 62 N 4.06 0.00 0.00 0.00 4.76 -0.81 -4.93 118.16 121.24 1whe n LYS 62 Ca -0.19 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.25 1whe n LYS 62 Cb 0.52 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.71 1whe n LYS 62 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1whe n GLY 64 N 5.00 1.28 3.51 0.72 0.00 0.78 -4.55 105.19 111.93 1whe n GLY 64 Ca 0.00 0.15 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 1whe n GLY 64 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1whe n ILE 65 N -0.04 -0.02 0.00 -0.61 -0.00 -1.26 0.26 119.36 117.69 1whe n ILE 65 Ca 0.00 -0.28 0.00 0.00 -0.00 0.00 0.00 62.75 62.47 1whe n ILE 65 Cb 0.00 -1.05 0.00 0.00 -0.00 0.00 0.00 39.64 38.59 1whe n ILE 65 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1whe n GLY 66 N 6.27 2.69 3.47 7.39 0.00 -1.26 -3.44 105.19 120.31 1whe n GLY 66 Ca 0.59 -0.67 -0.24 0.00 0.00 0.00 0.00 46.02 45.69 1whe n GLY 66 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1whe s ASP 67 N 0.03 3.58 0.00 1.61 1.11 0.14 -4.46 116.67 118.68 1whe s ASP 67 Ca 0.00 -1.04 0.00 0.00 0.18 0.00 0.00 52.55 51.69 1whe s ASP 67 Cb 0.00 -0.30 0.00 0.00 1.07 0.00 0.00 42.92 43.69 1whe s ASP 67 CO 0.00 0.01 0.00 0.00 1.18 0.00 0.00 175.17 176.36 1whe n TYR 68 N -0.63 -0.57 -3.86 4.23 4.11 -1.26 0.27 117.16 119.45 1whe n TYR 68 Ca -0.05 0.00 -0.02 0.00 -0.00 0.00 0.00 57.90 57.83 1whe n TYR 68 Cb 0.60 0.00 -0.01 0.00 -0.00 0.00 0.00 39.34 39.94 1whe n TYR 68 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.86 177.11 1whe n THR 69 N 0.00 0.00 -3.71 -3.48 -2.24 -1.26 -4.89 114.28 98.70 1whe n THR 69 Ca 0.00 -0.26 -0.13 0.00 -2.27 0.00 0.00 64.05 61.39 1whe n THR 69 Cb 0.00 0.14 -0.07 0.00 -2.10 0.00 0.00 70.33 68.30 1whe n THR 69 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1whe s THR 71 N -2.09 2.07 0.29 0.00 2.01 -0.53 -4.86 115.64 112.53 1whe s THR 71 Ca -0.08 -0.98 -0.12 0.00 0.31 0.00 0.00 61.69 60.82 1whe s THR 71 Cb -0.02 -1.82 -0.08 0.00 0.01 0.00 0.00 72.50 70.59 1whe s THR 71 CO 0.00 0.55 0.66 0.00 -0.69 0.00 0.00 174.62 175.14 1whe n ALA 73 N -0.37 -3.35 -0.13 0.00 0.00 -1.26 -4.78 120.51 110.62 1whe n ALA 73 Ca 0.02 -1.04 -0.06 0.00 0.00 0.00 0.00 53.44 52.35 1whe n ALA 73 Cb 0.53 -0.09 0.02 0.00 0.00 0.00 0.00 19.45 19.91 1whe n ALA 73 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1whe h GLU 74 N 0.00 0.43 -1.45 0.00 4.81 -1.98 -2.72 114.58 113.68 1whe h GLU 74 Ca -0.27 -0.03 -0.52 0.00 -0.13 0.00 0.00 59.36 58.42 1whe h GLU 74 Cb 0.89 -0.10 -0.21 0.00 0.63 0.00 0.00 28.75 29.96 1whe h GLU 74 CO 0.16 0.28 0.64 0.41 -0.73 0.00 0.00 179.01 179.78 1whe n GLY 75 N -1.22 4.92 2.98 1.92 0.00 -1.26 -4.91 105.19 107.62 1whe n GLY 75 Ca 0.02 -1.78 -0.09 0.00 0.00 0.00 0.00 46.02 44.17 1whe n GLY 75 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1whe s PHE 76 N -2.75 0.26 0.27 1.61 0.40 -1.03 -2.59 117.98 114.16 1whe s PHE 76 Ca 0.49 -0.52 -0.18 0.00 -0.60 0.00 0.00 56.93 56.13 1whe s PHE 76 Cb 0.38 -0.19 0.01 0.00 0.51 0.00 0.00 43.02 43.73 1whe s PHE 76 CO -0.08 -0.18 0.63 -1.83 0.70 0.00 0.00 175.22 174.46 1whe s GLU 77 N -1.43 1.72 0.00 0.44 -1.05 -0.96 -4.64 118.70 112.78 1whe s GLU 77 Ca -0.15 -1.11 0.00 0.00 -0.15 0.00 0.00 54.97 53.55 1whe s GLU 77 Cb -0.10 0.56 0.00 0.00 -0.44 0.00 0.00 34.13 34.15 1whe s GLU 77 CO -0.01 -0.77 0.00 0.41 0.95 0.00 0.00 175.26 175.85 1whe n GLY 78 N -0.44 1.98 0.09 -3.83 0.00 -1.26 -2.42 105.19 99.32 1whe n GLY 78 Ca -0.03 -2.01 -0.03 0.00 0.00 0.00 0.00 46.02 43.94 1whe n GLY 78 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1whe h LYS 79 N 0.00 -0.16 -0.01 1.61 3.11 -2.01 -0.72 116.57 118.39 1whe h LYS 79 Ca 0.00 0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.85 1whe h LYS 79 Cb 0.00 0.04 0.00 0.00 -1.00 0.00 0.00 32.23 31.27 1whe h LYS 79 CO 0.00 -0.11 0.00 0.09 -2.81 0.00 0.00 179.45 176.62 1whe n ASN 80 N -2.94 0.03 -1.36 4.20 4.13 -1.26 -4.80 115.26 113.26 1whe n ASN 80 Ca -0.02 -1.95 -0.17 0.00 1.68 0.00 0.00 54.58 54.11 1whe n ASN 80 Cb 0.08 -0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.24 1whe n ASN 80 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1whe n GLU 82 N -1.86 0.45 -3.50 0.00 2.13 -1.23 -4.24 120.64 112.40 1whe n GLU 82 Ca -0.17 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.22 1whe n GLU 82 Cb 0.65 -1.44 -0.05 0.00 0.27 0.00 0.00 31.44 30.87 1whe n GLU 82 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 1whe s PHE 83 N -2.00 3.61 -0.65 4.31 0.08 -1.01 -5.01 117.98 117.30 1whe s PHE 83 Ca 0.19 -2.31 -0.27 0.00 0.12 0.00 0.00 56.93 54.66 1whe s PHE 83 Cb 0.09 -3.55 0.03 0.00 -0.57 0.00 0.00 43.02 39.02 1whe s PHE 83 CO 0.14 -0.92 1.20 -1.54 -0.10 0.00 0.00 175.22 174.00 1whe s SER 84 N 1.52 6.30 0.11 1.36 1.04 -1.26 -2.27 113.70 120.50 1whe s SER 84 Ca 0.17 -0.22 -0.23 0.00 0.48 0.00 0.00 55.95 56.15 1whe s SER 84 Cb -0.15 -2.54 -0.09 0.00 0.10 0.00 0.00 66.02 63.35 1whe s SER 84 CO -0.06 -1.62 1.69 0.71 0.98 0.00 0.00 173.24 174.94 1whe h THR 85 N 6.08 0.74 0.00 2.02 1.35 -1.87 -3.49 112.91 117.74 1whe h THR 85 Ca -0.27 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1whe h THR 85 Cb 1.06 0.74 0.00 0.00 -1.73 0.00 0.00 68.15 68.22 1whe h THR 85 CO 1.22 0.00 0.00 -2.11 -0.25 0.00 0.00 175.52 174.38