#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pe4 n ASP 2 N 0.00 -2.57 -3.41 0.55 5.68 -1.26 -0.59 116.55 114.95 1pe4 n ASP 2 Ca 0.00 -0.12 -0.27 0.00 -0.50 0.00 0.00 54.79 53.90 1pe4 n ASP 2 Cb 0.00 -0.82 -0.08 0.00 -1.14 0.00 0.00 41.12 39.07 1pe4 n ASP 2 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1pe4 n GLY 3 N 2.43 4.39 0.82 6.12 0.00 0.62 -3.29 105.19 116.27 1pe4 n GLY 3 Ca 0.00 -2.53 0.05 0.00 0.00 0.00 0.00 46.02 43.53 1pe4 n GLY 3 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1pe4 n TYR 4 N 1.05 0.00 0.26 1.61 9.36 -1.26 -2.60 117.16 125.59 1pe4 n TYR 4 Ca 0.28 -0.76 0.12 0.00 3.32 0.00 0.00 57.90 60.86 1pe4 n TYR 4 Cb 0.43 -0.16 0.73 0.00 -0.63 0.00 0.00 39.34 39.71 1pe4 n TYR 4 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1pe4 h PRO 5 N 0.64 0.00 -6.87 2.98 0.13 -1.95 -3.47 132.00 123.46 1pe4 h PRO 5 Ca -0.08 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.50 1pe4 h PRO 5 Cb 1.40 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.53 1pe4 h PRO 5 CO 0.04 0.11 -1.06 1.47 -0.23 0.00 0.00 178.00 178.32 1pe4 n LEU 6 N -3.73 -0.97 0.00 1.56 -0.00 -1.26 -4.82 117.00 107.77 1pe4 n LEU 6 Ca -0.02 -1.15 0.00 0.00 -0.00 0.00 0.00 56.01 54.84 1pe4 n LEU 6 Cb 0.22 -1.60 0.00 0.00 -0.00 0.00 0.00 43.42 42.04 1pe4 n LEU 6 CO 0.30 0.62 0.00 0.00 -0.00 0.00 0.00 177.39 178.31 1pe4 n ALA 7 N -3.88 0.00 -1.00 1.47 0.00 -0.98 -3.73 120.51 112.38 1pe4 n ALA 7 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1pe4 n ALA 7 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 1pe4 n ALA 7 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1pe4 n SER 8 N 0.00 0.00 -3.12 0.00 2.88 -1.25 -4.69 113.62 107.43 1pe4 n SER 8 Ca 0.00 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.19 1pe4 n SER 8 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 1pe4 n SER 8 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1pe4 n ASN 9 N 0.00 8.09 0.00 -3.46 3.02 -1.26 -4.40 115.26 117.25 1pe4 n ASN 9 Ca 0.00 -2.67 0.00 0.00 -0.03 0.00 0.00 54.58 51.88 1pe4 n ASN 9 Cb 0.00 -1.50 0.00 0.00 -0.61 0.00 0.00 39.78 37.67 1pe4 n ASN 9 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pe4 n GLY 10 N 3.03 0.81 3.41 7.41 0.00 -1.24 -4.42 105.19 114.19 1pe4 n GLY 10 Ca 0.70 -0.74 0.01 0.00 0.00 0.00 0.00 46.02 45.99 1pe4 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pe4 n LYS 12 N 4.66 0.00 -0.43 0.00 5.02 -1.26 -2.32 118.16 123.83 1pe4 n LYS 12 Ca -0.10 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.19 1pe4 n LYS 12 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.55 1pe4 n LYS 12 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1pe4 n PHE 13 N -1.06 -0.61 0.00 2.13 3.72 -1.25 -3.48 117.46 116.91 1pe4 n PHE 13 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1pe4 n PHE 13 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 1pe4 n PHE 13 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pe4 n GLY 14 N 5.00 -3.02 1.97 1.37 0.00 -1.26 -3.81 105.19 105.43 1pe4 n GLY 14 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.38 1pe4 n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pe4 n SER 16 N 0.93 0.00 -0.11 0.00 2.88 -1.25 -1.09 113.62 114.98 1pe4 n SER 16 Ca 0.00 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.34 1pe4 n SER 16 Cb 0.00 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.34 1pe4 n SER 16 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1pe4 n GLY 17 N -0.03 -0.42 2.47 0.46 0.00 -1.24 -4.58 105.19 101.85 1pe4 n GLY 17 Ca 0.00 -0.17 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 1pe4 n GLY 17 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pe4 n LEU 18 N -3.48 7.68 0.00 0.99 4.32 -1.26 -4.60 117.00 120.66 1pe4 n LEU 18 Ca -0.45 -4.06 0.00 0.00 -0.02 0.00 0.00 56.01 51.49 1pe4 n LEU 18 Cb 0.97 -1.50 0.00 0.00 -1.62 0.00 0.00 43.42 41.28 1pe4 n LEU 18 CO 0.25 1.59 0.00 0.61 -1.22 0.00 0.00 177.39 178.61 1pe4 n GLY 19 N 3.74 3.15 0.20 -0.72 0.00 -1.26 -5.01 105.19 105.29 1pe4 n GLY 19 Ca 0.68 -0.20 0.09 0.00 0.00 0.00 0.00 46.02 46.59 1pe4 n GLY 19 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1pe4 h GLU 20 N 0.00 0.00 0.00 1.61 4.81 -1.87 -3.42 114.58 115.71 1pe4 h GLU 20 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1pe4 h GLU 20 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1pe4 h GLU 20 CO 0.00 0.19 0.00 0.27 -0.73 0.00 0.00 179.01 178.74 1pe4 n ASN 21 N -3.17 0.00 -3.70 1.04 0.23 -1.26 -4.80 115.26 103.60 1pe4 n ASN 21 Ca 0.03 0.00 -0.24 0.00 -0.53 0.00 0.00 54.58 53.84 1pe4 n ASN 21 Cb 0.57 0.00 0.03 0.00 -2.08 0.00 0.00 39.78 38.30 1pe4 n ASN 21 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1pe4 n ASN 22 N 0.00 -2.32 -1.26 0.53 4.13 -1.26 -4.71 115.26 110.37 1pe4 n ASN 22 Ca 0.00 -0.88 -0.04 0.00 1.68 0.00 0.00 54.58 55.34 1pe4 n ASN 22 Cb 0.00 -3.86 0.09 0.00 -1.54 0.00 0.00 39.78 34.47 1pe4 n ASN 22 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1pe4 n PRO 23 N -4.19 1.75 -0.15 3.52 -0.04 -1.26 -2.89 135.00 131.74 1pe4 n PRO 23 Ca -0.24 -1.04 -0.07 0.00 -0.04 0.00 0.00 63.50 62.11 1pe4 n PRO 23 Cb 0.66 -1.53 0.01 0.00 -0.04 0.00 0.00 33.50 32.60 1pe4 n PRO 23 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1pe4 h THR 24 N 0.71 1.11 -0.98 0.52 2.02 -1.96 -2.56 112.91 111.77 1pe4 h THR 24 Ca 0.14 -0.21 0.26 0.00 0.77 0.00 0.00 66.41 67.37 1pe4 h THR 24 Cb 1.41 0.44 -0.13 0.00 -1.74 0.00 0.00 68.15 68.13 1pe4 h THR 24 CO 0.30 0.11 0.54 0.00 0.37 0.00 0.00 175.52 176.85 1pe4 h ASN 26 N 0.47 -0.79 -0.19 0.00 2.35 -1.80 0.12 115.58 115.73 1pe4 h ASN 26 Ca 0.65 0.05 -0.10 0.00 -0.55 0.00 0.00 56.30 56.36 1pe4 h ASN 26 Cb 1.32 0.24 -0.00 0.00 0.05 0.00 0.00 38.32 39.93 1pe4 h ASN 26 CO -0.53 -0.47 -0.26 -0.74 -1.65 0.00 0.00 177.43 173.78 1pe4 h HIS 27 N -0.73 0.64 0.26 1.19 2.76 -1.23 -2.65 115.15 115.38 1pe4 h HIS 27 Ca -0.05 -0.21 0.01 0.00 -2.20 0.00 0.00 60.37 57.92 1pe4 h HIS 27 Cb 0.61 -0.13 -0.03 0.00 1.55 0.00 0.00 27.41 29.42 1pe4 h HIS 27 CO -0.12 0.91 -0.37 0.28 -1.30 0.00 0.00 177.93 177.32 1pe4 h VAL 28 N 0.18 0.23 -0.51 5.26 2.07 0.70 0.52 116.25 124.71 1pe4 h VAL 28 Ca 0.02 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.60 1pe4 h VAL 28 Cb 0.83 0.23 -0.05 0.00 -1.52 0.00 0.00 31.29 30.79 1pe4 h VAL 28 CO 0.06 0.00 0.22 0.00 0.02 0.00 0.00 177.57 177.87 1pe4 n GLU 30 N -4.95 0.81 -0.02 0.00 1.02 -1.00 -0.08 120.64 116.42 1pe4 n GLU 30 Ca 0.05 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.17 1pe4 n GLU 30 Cb 0.18 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.09 1pe4 n GLU 30 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1pe4 n LYS 31 N -1.06 0.17 0.08 3.49 4.76 0.18 -3.73 118.16 122.04 1pe4 n LYS 31 Ca 0.20 0.07 -0.02 0.00 -2.87 0.00 0.00 58.31 55.68 1pe4 n LYS 31 Cb 0.13 -0.73 -0.06 0.00 -1.84 0.00 0.00 35.03 32.53 1pe4 n LYS 31 CO 0.00 0.00 0.00 1.57 -1.37 0.00 0.00 177.40 177.60 1pe4 h LYS 32 N -0.31 0.00 0.00 1.97 2.10 -0.97 -3.27 116.57 116.09 1pe4 h LYS 32 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1pe4 h LYS 32 Cb 0.31 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.64 1pe4 h LYS 32 CO 0.00 0.67 -1.62 0.00 -2.00 0.00 0.00 179.45 176.49 1pe4 n ALA 33 N -2.32 3.00 -2.26 0.07 0.00 -0.60 -4.88 120.51 113.52 1pe4 n ALA 33 Ca -0.02 -0.46 -0.04 0.00 0.00 0.00 0.00 53.44 52.92 1pe4 n ALA 33 Cb 0.85 -0.84 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 1pe4 n ALA 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pe4 n GLY 34 N 1.28 -0.36 3.36 0.00 0.00 0.88 -4.87 105.19 105.48 1pe4 n GLY 34 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 1pe4 n GLY 34 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1pe4 s SER 35 N -1.90 1.77 -0.23 1.61 0.15 -1.16 -4.94 113.70 109.00 1pe4 s SER 35 Ca 0.00 -1.59 0.11 0.00 0.70 0.00 0.00 55.95 55.17 1pe4 s SER 35 Cb 0.00 0.41 0.44 0.00 -1.71 0.00 0.00 66.02 65.16 1pe4 s SER 35 CO 0.00 -0.90 1.30 -0.90 1.20 0.00 0.00 173.24 173.93 1pe4 n ASP 36 N -1.04 2.08 -4.38 5.45 5.75 -1.26 -3.89 116.55 119.24 1pe4 n ASP 36 Ca 0.00 -3.77 -0.44 0.00 -0.01 0.00 0.00 54.79 50.58 1pe4 n ASP 36 Cb 0.65 -0.56 -0.08 0.00 -1.03 0.00 0.00 41.12 40.10 1pe4 n ASP 36 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1pe4 s TYR 37 N -3.20 3.25 0.00 2.11 2.02 -1.26 -5.02 117.35 115.25 1pe4 s TYR 37 Ca 0.40 -0.94 0.00 0.00 -0.37 0.00 0.00 57.07 56.15 1pe4 s TYR 37 Cb 0.37 -3.12 0.00 0.00 -0.40 0.00 0.00 41.96 38.81 1pe4 s TYR 37 CO -0.03 -0.79 0.00 0.41 -1.57 0.00 0.00 175.55 173.57 1pe4 n GLY 38 N 5.18 3.62 3.64 0.71 0.00 -1.26 -0.51 105.19 116.57 1pe4 n GLY 38 Ca -0.12 -1.21 -0.03 0.00 0.00 0.00 0.00 46.02 44.66 1pe4 n GLY 38 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1pe4 s TYR 39 N -3.58 -0.64 -0.06 1.61 5.04 -0.92 -4.84 117.35 113.96 1pe4 s TYR 39 Ca 0.00 1.29 0.04 0.00 -2.44 0.00 0.00 57.07 55.97 1pe4 s TYR 39 Cb 0.00 0.39 -0.00 0.00 0.35 0.00 0.00 41.96 42.69 1pe4 s TYR 39 CO 0.00 -0.32 -0.20 0.00 -1.34 0.00 0.00 175.55 173.69 1pe4 n TYR 41 N 3.26 0.00 0.00 0.00 9.36 -1.26 -5.05 117.16 123.47 1pe4 n TYR 41 Ca -0.19 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.03 1pe4 n TYR 41 Cb 0.53 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.24 1pe4 n TYR 41 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1pe4 n ALA 42 N -3.00 0.00 -2.21 2.98 0.00 -1.26 -4.88 120.51 112.13 1pe4 n ALA 42 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1pe4 n ALA 42 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1pe4 n ALA 42 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1pe4 n TRP 43 N 0.00 3.02 -3.84 0.00 8.01 -1.26 -3.62 117.44 119.75 1pe4 n TRP 43 Ca 0.00 -2.82 0.04 0.00 -1.31 0.00 0.00 57.50 53.41 1pe4 n TRP 43 Cb 0.00 -2.05 0.01 0.00 -2.01 0.00 0.00 31.31 27.25 1pe4 n TRP 43 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.69 176.60 1pe4 s THR 44 N 0.86 0.00 0.01 -0.99 -1.32 -0.25 -2.60 115.64 111.36 1pe4 s THR 44 Ca 0.41 -0.06 0.00 0.00 -1.21 0.00 0.00 61.69 60.84 1pe4 s THR 44 Cb 0.11 -2.58 -0.01 0.00 -1.51 0.00 0.00 72.50 68.51 1pe4 s THR 44 CO -0.01 0.00 -0.03 0.00 -2.21 0.00 0.00 174.62 172.37 1pe4 s TYR 46 N -0.83 2.53 0.23 0.00 6.14 0.31 -3.85 117.35 121.89 1pe4 s TYR 46 Ca -0.08 -0.26 -0.11 0.00 0.64 0.00 0.00 57.07 57.26 1pe4 s TYR 46 Cb -0.06 -1.25 -0.01 0.00 0.42 0.00 0.00 41.96 41.06 1pe4 s TYR 46 CO -0.00 0.50 0.41 0.00 0.64 0.00 0.00 175.55 177.10 1pe4 s GLU 48 N -4.04 0.81 -1.04 0.00 2.02 0.33 -0.28 118.70 116.50 1pe4 s GLU 48 Ca 0.25 -0.42 -0.01 0.00 0.02 0.00 0.00 54.97 54.81 1pe4 s GLU 48 Cb 0.01 -0.78 0.00 0.00 0.10 0.00 0.00 34.13 33.46 1pe4 s GLU 48 CO 0.09 0.21 0.12 1.58 0.02 0.00 0.00 175.26 177.28 1pe4 n HIS 49 N 2.66 -0.79 -0.06 1.61 -0.00 0.24 -4.76 115.22 114.12 1pe4 n HIS 49 Ca -0.14 0.10 -0.05 0.00 0.46 0.00 0.00 57.72 58.09 1pe4 n HIS 49 Cb 0.56 -2.91 -0.10 0.00 -0.12 0.00 0.00 29.99 27.42 1pe4 n HIS 49 CO 0.00 0.00 0.00 1.33 0.46 0.00 0.00 176.34 178.13 1pe4 n VAL 50 N -4.01 0.77 1.92 3.57 0.24 -0.87 -4.43 118.33 115.52 1pe4 n VAL 50 Ca -0.12 -0.52 0.00 0.00 -2.04 0.00 0.00 64.34 61.66 1pe4 n VAL 50 Cb 0.60 -0.55 0.00 0.00 -1.47 0.00 0.00 33.84 32.42 1pe4 n VAL 50 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1pe4 n ALA 51 N -2.41 2.46 -1.11 2.33 0.00 -1.17 -3.49 120.51 117.12 1pe4 n ALA 51 Ca -0.19 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.93 1pe4 n ALA 51 Cb 0.85 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.27 1pe4 n ALA 51 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1pe4 n GLU 52 N -0.50 3.12 0.00 0.00 0.28 -1.26 -4.19 120.64 118.09 1pe4 n GLU 52 Ca 0.00 -1.91 0.00 0.00 -0.16 0.00 0.00 57.16 55.09 1pe4 n GLU 52 Cb 0.00 -2.65 0.00 0.00 1.43 0.00 0.00 31.44 30.22 1pe4 n GLU 52 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1pe4 n GLY 53 N 3.59 3.31 3.71 -1.84 0.00 -1.26 -5.01 105.19 107.69 1pe4 n GLY 53 Ca 0.66 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.39 1pe4 n GLY 53 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pe4 s THR 54 N -2.88 1.83 0.07 2.61 2.01 -1.23 -5.09 115.64 112.96 1pe4 s THR 54 Ca 0.00 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.03 1pe4 s THR 54 Cb 0.00 -2.65 -0.03 0.00 0.01 0.00 0.00 72.50 69.83 1pe4 s THR 54 CO 0.00 0.00 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.15 1pe4 s VAL 55 N -3.23 0.71 -0.01 3.82 1.01 -1.26 -4.81 120.40 116.63 1pe4 s VAL 55 Ca 0.69 -1.35 -0.00 0.00 0.00 0.00 0.00 61.98 61.32 1pe4 s VAL 55 Cb -0.11 -0.98 0.01 0.00 0.00 0.00 0.00 36.38 35.29 1pe4 s VAL 55 CO 0.55 -0.48 0.01 -1.48 0.00 0.00 0.00 175.10 173.71 1pe4 s LEU 56 N -2.00 1.81 -0.50 3.92 -0.00 -1.26 -5.10 118.68 115.55 1pe4 s LEU 56 Ca -0.03 0.02 0.06 0.00 -0.00 0.00 0.00 54.13 54.19 1pe4 s LEU 56 Cb -0.06 0.01 0.19 0.00 -0.00 0.00 0.00 46.19 46.33 1pe4 s LEU 56 CO -0.00 -0.03 0.74 0.26 -0.00 0.00 0.00 176.35 177.32 1pe4 s TRP 57 N 0.20 -1.56 -0.02 3.48 0.23 -1.26 -4.62 118.94 115.39 1pe4 s TRP 57 Ca -0.02 -0.49 -0.02 0.00 -2.03 0.00 0.00 56.10 53.54 1pe4 s TRP 57 Cb -0.02 0.31 0.01 0.00 0.03 0.00 0.00 33.47 33.79 1pe4 s TRP 57 CO -0.01 -1.22 0.05 0.41 0.96 0.00 0.00 176.95 177.14 1pe4 n GLY 58 N 3.03 -5.80 0.00 0.98 0.00 -1.26 -5.04 105.19 97.10 1pe4 n GLY 58 Ca 0.17 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.60 1pe4 n GLY 58 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1pe4 n ASP 59 N 1.82 0.00 0.00 1.61 -0.08 -1.23 -4.84 116.55 113.84 1pe4 n ASP 59 Ca -0.08 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.20 1pe4 n ASP 59 Cb 0.12 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.58 1pe4 n ASP 59 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1pe4 n SER 60 N 0.00 0.00 0.19 1.67 7.64 -1.26 -2.52 113.62 119.33 1pe4 n SER 60 Ca 0.00 0.35 0.13 0.00 1.01 0.00 0.00 58.87 60.37 1pe4 n SER 60 Cb 0.00 -0.21 0.66 0.00 -1.01 0.00 0.00 64.21 63.65 1pe4 n SER 60 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1pe4 h GLY 61 N 0.00 0.00 -0.13 0.23 0.00 -1.82 -0.87 103.07 100.48 1pe4 h GLY 61 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1pe4 h GLY 61 CO 0.00 0.00 -0.17 -1.30 0.00 0.00 0.00 176.54 175.07 1pe4 n THR 62 N -2.41 0.00 0.00 4.70 -2.24 -1.25 -4.64 114.28 108.44 1pe4 n THR 62 Ca -0.01 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1pe4 n THR 62 Cb 0.10 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 1pe4 n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pe4 n GLY 63 N 1.29 -1.17 0.14 3.38 0.00 -0.33 0.12 105.19 108.62 1pe4 n GLY 63 Ca 0.14 0.23 0.15 0.00 0.00 0.00 0.00 46.02 46.55 1pe4 n GLY 63 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1pe4 n PRO 64 N -1.71 1.15 -1.19 1.61 -0.04 -1.26 -4.88 135.00 128.68 1pe4 n PRO 64 Ca 0.00 -0.29 0.14 0.00 -0.04 0.00 0.00 63.50 63.32 1pe4 n PRO 64 Cb 0.00 -1.49 -0.05 0.00 -0.04 0.00 0.00 33.50 31.92 1pe4 n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1pe4 s ARG 66 N -2.77 4.16 0.00 0.00 0.52 -0.92 -4.89 118.95 115.05 1pe4 s ARG 66 Ca 0.00 2.45 0.00 0.00 -0.52 0.00 0.00 55.73 57.66 1pe4 s ARG 66 Cb 0.00 -4.05 0.00 0.00 0.52 0.00 0.00 34.95 31.42 1pe4 s ARG 66 CO 0.00 -0.90 0.00 -1.13 0.02 0.00 0.00 175.30 173.29