#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pe4 s ASP 2 N 0.00 6.70 0.00 6.15 -1.08 -1.26 -1.30 116.67 125.88 1pe4 s ASP 2 Ca 0.00 -2.14 0.00 0.00 -0.52 0.00 0.00 52.55 49.89 1pe4 s ASP 2 Cb 0.00 -2.44 0.00 0.00 -1.46 0.00 0.00 42.92 39.02 1pe4 s ASP 2 CO 0.00 -1.09 0.00 0.61 0.52 0.00 0.00 175.17 175.21 1pe4 n GLY 3 N 5.48 2.92 2.59 2.66 0.00 -0.87 -4.97 105.19 113.00 1pe4 n GLY 3 Ca 0.29 -1.11 -0.12 0.00 0.00 0.00 0.00 46.02 45.08 1pe4 n GLY 3 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1pe4 n TYR 4 N 0.00 -2.50 0.04 1.61 4.11 -1.26 -2.57 117.16 116.59 1pe4 n TYR 4 Ca 0.00 -2.27 0.16 0.00 -0.00 0.00 0.00 57.90 55.79 1pe4 n TYR 4 Cb 0.00 1.03 0.29 0.00 -0.00 0.00 0.00 39.34 40.66 1pe4 n TYR 4 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.86 175.51 1pe4 h PRO 5 N 3.96 0.00 -6.17 -3.48 0.10 -1.94 -3.45 132.00 121.01 1pe4 h PRO 5 Ca -0.09 0.00 -0.28 0.00 0.10 0.00 0.00 66.00 65.73 1pe4 h PRO 5 Cb 0.99 0.00 0.01 0.00 0.10 0.00 0.00 31.00 32.10 1pe4 h PRO 5 CO 0.36 0.00 -0.81 1.47 0.10 0.00 0.00 178.00 179.13 1pe4 n LEU 6 N -2.95 -4.08 0.00 2.35 -0.00 -1.26 -4.87 117.00 106.19 1pe4 n LEU 6 Ca 0.12 -0.32 0.00 0.00 -0.00 0.00 0.00 56.01 55.82 1pe4 n LEU 6 Cb 1.23 -2.27 0.00 0.00 -0.00 0.00 0.00 43.42 42.39 1pe4 n LEU 6 CO 0.14 -0.49 0.22 0.00 -0.00 0.00 0.00 177.39 177.26 1pe4 n ALA 7 N -1.40 0.00 -1.00 1.47 0.00 -1.18 -4.20 120.51 114.19 1pe4 n ALA 7 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1pe4 n ALA 7 Cb 0.61 0.22 0.00 0.00 0.00 0.00 0.00 19.45 20.29 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 -1.40 0.00 -1.64 0.00 2.88 -1.26 -4.77 113.62 107.42 1pe4 n SER 8 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 1pe4 n SER 8 Cb 0.00 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 63.53 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 4.09 0.00 -3.46 3.02 -1.26 -4.61 115.26 113.04 1pe4 n ASN 9 Ca 0.00 -2.82 0.00 0.00 -0.03 0.00 0.00 54.58 51.73 1pe4 n ASN 9 Cb 0.00 -0.75 0.00 0.00 -0.61 0.00 0.00 39.78 38.42 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 -0.11 0.06 3.64 7.41 0.00 -1.26 -4.49 105.19 110.44 1pe4 n GLY 10 Ca 0.28 -0.46 -0.06 0.00 0.00 0.00 0.00 46.02 45.78 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 3.28 0.00 0.00 0.00 4.76 -1.26 -3.13 118.16 121.81 1pe4 n LYS 12 Ca -0.17 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.27 1pe4 n LYS 12 Cb 0.57 -0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.76 1pe4 n LYS 12 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 1pe4 n PHE 13 N -1.03 0.00 -3.60 2.13 3.01 -1.26 -2.94 117.46 113.76 1pe4 n PHE 13 Ca 0.00 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 58.06 1pe4 n PHE 13 Cb 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.36 1pe4 n PHE 13 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1pe4 s GLY 14 N -0.04 1.93 0.00 1.37 0.00 -1.26 -3.38 107.32 105.94 1pe4 s GLY 14 Ca 0.00 -1.69 0.00 0.00 0.00 0.00 0.00 44.72 43.03 1pe4 s GLY 14 CO 0.00 0.84 0.00 0.00 0.00 0.00 0.00 173.10 173.94 1pe4 h SER 16 N 0.00 0.00 0.00 0.00 4.64 -1.74 -3.35 113.55 113.09 1pe4 h SER 16 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1pe4 h SER 16 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1pe4 h SER 16 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1pe4 n GLY 17 N -1.40 3.03 2.43 -0.77 0.00 -1.26 -3.44 105.19 103.77 1pe4 n GLY 17 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 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 0.00 7.79 0.00 0.99 4.77 -1.26 -4.72 117.00 124.57 1pe4 n LEU 18 Ca 0.00 -4.04 0.00 0.00 -0.03 0.00 0.00 56.01 51.94 1pe4 n LEU 18 Cb 0.00 -1.48 0.00 0.00 -2.33 0.00 0.00 43.42 39.61 1pe4 n LEU 18 CO 0.00 1.66 0.00 0.61 -1.33 0.00 0.00 177.39 178.33 1pe4 n GLY 19 N 3.69 3.38 0.68 -0.72 0.00 -1.26 -4.87 105.19 106.09 1pe4 n GLY 19 Ca 0.69 -1.48 0.01 0.00 0.00 0.00 0.00 46.02 45.24 1pe4 n GLY 19 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1pe4 n GLU 20 N 0.37 1.66 -0.02 1.61 2.13 -1.26 -3.99 120.64 121.14 1pe4 n GLU 20 Ca 0.00 -0.57 0.07 0.00 0.66 0.00 0.00 57.16 57.32 1pe4 n GLU 20 Cb 0.00 -1.56 0.37 0.00 0.27 0.00 0.00 31.44 30.52 1pe4 n GLU 20 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1pe4 n ASN 21 N 0.08 0.31 -2.91 4.31 3.02 -1.26 -3.94 115.26 114.87 1pe4 n ASN 21 Ca 0.05 -1.63 -0.13 0.00 -0.03 0.00 0.00 54.58 52.83 1pe4 n ASN 21 Cb 0.38 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.52 1pe4 n ASN 21 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1pe4 n ASN 22 N -0.50 1.10 -1.56 6.41 6.94 -1.26 -4.88 115.26 121.51 1pe4 n ASN 22 Ca 0.11 -2.86 -0.09 0.00 -0.02 0.00 0.00 54.58 51.72 1pe4 n ASN 22 Cb 0.09 -0.54 0.13 0.00 -2.36 0.00 0.00 39.78 37.10 1pe4 n ASN 22 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 1pe4 n PRO 23 N 0.10 2.04 0.13 -0.53 -0.04 -1.25 -2.74 135.00 132.71 1pe4 n PRO 23 Ca 0.16 -1.64 0.03 0.00 -0.04 0.00 0.00 63.50 62.01 1pe4 n PRO 23 Cb 0.74 -1.71 0.02 0.00 -0.04 0.00 0.00 33.50 32.52 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 0.95 0.77 -1.10 0.52 2.02 -1.92 -3.33 112.91 110.82 1pe4 h THR 24 Ca 0.26 -2.11 0.31 0.00 0.77 0.00 0.00 66.41 65.64 1pe4 h THR 24 Cb 1.83 2.35 -0.11 0.00 -1.74 0.00 0.00 68.15 70.48 1pe4 h THR 24 CO 0.51 0.44 0.70 0.00 0.37 0.00 0.00 175.52 177.54 1pe4 h ASN 26 N 0.33 -0.57 0.05 0.00 2.35 -1.82 -2.07 115.58 113.84 1pe4 h ASN 26 Ca 0.66 -0.07 -0.00 0.00 -0.55 0.00 0.00 56.30 56.34 1pe4 h ASN 26 Cb 1.75 0.15 0.00 0.00 0.05 0.00 0.00 38.32 40.27 1pe4 h ASN 26 CO -0.35 -0.23 -0.02 0.45 -1.65 0.00 0.00 177.43 175.63 1pe4 h HIS 27 N -0.95 -0.06 -0.61 1.19 3.86 -1.37 -2.80 115.15 114.41 1pe4 h HIS 27 Ca -0.07 -0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.26 1pe4 h HIS 27 Cb 0.61 0.02 -0.12 0.00 1.06 0.00 0.00 27.41 28.98 1pe4 h HIS 27 CO 0.01 0.23 -0.15 0.28 0.86 0.00 0.00 177.93 179.16 1pe4 h VAL 28 N -0.36 0.39 0.16 2.45 2.07 0.63 1.03 116.25 122.62 1pe4 h VAL 28 Ca -0.01 -0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.52 1pe4 h VAL 28 Cb 0.33 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 1pe4 h VAL 28 CO 0.01 0.00 -0.22 0.00 0.02 0.00 0.00 177.57 177.38 1pe4 n GLU 30 N -5.34 0.92 -0.05 0.00 2.13 -0.61 -1.59 120.64 116.10 1pe4 n GLU 30 Ca -0.07 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.72 1pe4 n GLU 30 Cb 0.25 -1.29 -0.01 0.00 0.27 0.00 0.00 31.44 30.66 1pe4 n GLU 30 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1pe4 h LYS 31 N 0.00 0.00 0.00 5.31 1.63 0.27 -3.42 116.57 120.36 1pe4 h LYS 31 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1pe4 h LYS 31 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 1pe4 h LYS 31 CO 0.00 0.00 0.00 1.17 -3.45 0.00 0.00 179.45 177.17 1pe4 n LYS 32 N -3.99 2.37 0.01 1.90 4.81 -1.01 -4.60 118.16 117.65 1pe4 n LYS 32 Ca -0.04 -1.33 0.11 0.00 -0.87 0.00 0.00 58.31 56.18 1pe4 n LYS 32 Cb 0.14 -0.98 -0.11 0.00 0.02 0.00 0.00 35.03 34.10 1pe4 n LYS 32 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1pe4 n ALA 33 N -0.42 3.09 -0.17 3.14 0.00 -0.62 -4.97 120.51 120.56 1pe4 n ALA 33 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.97 1pe4 n ALA 33 Cb 0.23 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 18.84 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 1.29 2.54 3.06 0.00 0.00 -1.22 -4.62 105.19 106.24 1pe4 n GLY 34 Ca -0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 1pe4 n GLY 34 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1pe4 n SER 35 N 0.00 0.28 -2.37 1.61 2.88 -1.25 -5.01 113.62 109.75 1pe4 n SER 35 Ca 0.00 -3.03 -0.09 0.00 -1.33 0.00 0.00 58.87 54.42 1pe4 n SER 35 Cb 0.00 1.26 0.04 0.00 -0.75 0.00 0.00 64.21 64.76 1pe4 n SER 35 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1pe4 n ASP 36 N -1.67 2.80 -4.48 -3.46 -0.08 -1.26 -2.02 116.55 106.37 1pe4 n ASP 36 Ca 0.01 -2.74 -0.41 0.00 -1.51 0.00 0.00 54.79 50.14 1pe4 n ASP 36 Cb 0.57 -0.42 -0.11 0.00 2.34 0.00 0.00 41.12 43.50 1pe4 n ASP 36 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 1pe4 s TYR 37 N -3.50 3.22 0.29 -0.67 1.51 -1.26 -5.01 117.35 111.93 1pe4 s TYR 37 Ca 0.37 -0.42 -0.06 0.00 -1.01 0.00 0.00 57.07 55.94 1pe4 s TYR 37 Cb 0.36 -2.48 0.03 0.00 -0.11 0.00 0.00 41.96 39.76 1pe4 s TYR 37 CO -0.02 -0.45 0.49 0.41 -1.11 0.00 0.00 175.55 174.87 1pe4 n GLY 38 N 5.09 1.79 3.08 0.71 0.00 -1.25 -0.42 105.19 114.20 1pe4 n GLY 38 Ca -0.12 -1.38 -0.10 0.00 0.00 0.00 0.00 46.02 44.42 1pe4 n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1pe4 s TYR 39 N -3.61 0.19 -0.31 1.61 1.13 -0.97 -4.81 117.35 110.57 1pe4 s TYR 39 Ca 0.17 -0.45 -0.01 0.00 -1.41 0.00 0.00 57.07 55.38 1pe4 s TYR 39 Cb -0.02 -0.14 0.13 0.00 -1.10 0.00 0.00 41.96 40.83 1pe4 s TYR 39 CO 0.13 -0.31 0.26 0.00 -2.51 0.00 0.00 175.55 173.11 1pe4 n TYR 41 N 4.90 -0.72 -0.85 0.00 9.36 -1.26 -5.07 117.16 123.52 1pe4 n TYR 41 Ca 0.02 0.13 0.00 0.00 3.32 0.00 0.00 57.90 61.36 1pe4 n TYR 41 Cb 0.44 0.17 0.00 0.00 -0.63 0.00 0.00 39.34 39.31 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 -3.48 0.00 -1.69 2.98 0.00 -1.26 -4.94 120.51 112.11 1pe4 n ALA 42 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1pe4 n ALA 42 Cb 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.43 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 2.18 -2.58 0.00 8.01 -1.22 -4.22 117.44 119.60 1pe4 n TRP 43 Ca 0.00 -2.61 0.00 0.00 -1.31 0.00 0.00 57.50 53.58 1pe4 n TRP 43 Cb 0.00 -1.86 0.00 0.00 -2.01 0.00 0.00 31.31 27.44 1pe4 n TRP 43 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.69 174.31 1pe4 n THR 44 N 1.98 0.00 -3.61 -0.99 5.66 -1.26 -3.03 114.28 113.04 1pe4 n THR 44 Ca 0.62 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 61.46 1pe4 n THR 44 Cb 0.35 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.06 1pe4 n THR 44 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1pe4 s TYR 46 N -1.11 3.31 0.00 0.00 1.51 -0.07 -4.35 117.35 116.64 1pe4 s TYR 46 Ca -0.11 0.15 -0.14 0.00 -1.01 0.00 0.00 57.07 55.95 1pe4 s TYR 46 Cb -0.02 -1.68 0.02 0.00 -0.11 0.00 0.00 41.96 40.18 1pe4 s TYR 46 CO 0.08 0.55 0.30 0.00 -1.11 0.00 0.00 175.55 175.37 1pe4 s GLU 48 N -1.68 2.60 -0.05 0.00 -6.30 0.44 -2.06 118.70 111.66 1pe4 s GLU 48 Ca -0.11 -0.82 0.00 0.00 -2.50 0.00 0.00 54.97 51.54 1pe4 s GLU 48 Cb -0.04 -2.57 0.00 0.00 0.00 0.00 0.00 34.13 31.52 1pe4 s GLU 48 CO 0.02 0.54 0.00 1.58 0.02 0.00 0.00 175.26 177.42 1pe4 n HIS 49 N 0.53 0.00 0.00 5.30 -0.00 -0.42 -4.66 115.22 115.97 1pe4 n HIS 49 Ca -0.10 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.08 1pe4 n HIS 49 Cb 0.52 -0.94 0.00 0.00 -0.12 0.00 0.00 29.99 29.44 1pe4 n HIS 49 CO 0.00 0.00 0.00 0.28 0.46 0.00 0.00 176.34 177.08 1pe4 n VAL 50 N -2.56 0.00 1.97 3.57 0.31 -1.20 -4.42 118.33 116.00 1pe4 n VAL 50 Ca -0.00 0.00 0.15 0.00 -0.01 0.00 0.00 64.34 64.48 1pe4 n VAL 50 Cb 0.23 0.25 0.90 0.00 -0.91 0.00 0.00 33.84 34.31 1pe4 n VAL 50 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1pe4 n ALA 51 N -1.49 2.68 -1.23 3.52 0.00 -0.99 -2.62 120.51 120.38 1pe4 n ALA 51 Ca 0.00 -0.21 -0.20 0.00 0.00 0.00 0.00 53.44 53.03 1pe4 n ALA 51 Cb 0.07 -1.49 -0.12 0.00 0.00 0.00 0.00 19.45 17.92 1pe4 n ALA 51 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1pe4 n GLU 52 N -0.92 2.36 -1.80 0.00 0.00 -1.26 -4.57 120.64 114.45 1pe4 n GLU 52 Ca 0.23 -1.64 -0.08 0.00 0.00 0.00 0.00 57.16 55.68 1pe4 n GLU 52 Cb 0.12 -2.13 -0.01 0.00 0.00 0.00 0.00 31.44 29.42 1pe4 n GLU 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1pe4 n GLY 53 N 2.00 0.40 3.94 8.31 0.00 -1.26 -4.97 105.19 113.61 1pe4 n GLY 53 Ca 0.48 -0.61 -0.25 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.35 2.36 0.77 2.61 2.01 -1.08 -5.06 115.64 114.91 1pe4 s THR 54 Ca 0.00 -0.36 -0.13 0.00 0.31 0.00 0.00 61.69 61.52 1pe4 s THR 54 Cb 0.00 -3.00 0.06 0.00 0.01 0.00 0.00 72.50 69.57 1pe4 s THR 54 CO 0.00 -0.00 1.15 -0.69 -0.69 0.00 0.00 174.62 174.38 1pe4 s VAL 55 N -3.14 2.65 0.00 3.82 1.01 -1.26 -4.93 120.40 118.55 1pe4 s VAL 55 Ca 0.59 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.84 1pe4 s VAL 55 Cb -0.11 -2.67 0.00 0.00 0.00 0.00 0.00 36.38 33.61 1pe4 s VAL 55 CO 0.43 -0.23 0.00 0.18 0.00 0.00 0.00 175.10 175.49 1pe4 n LEU 56 N -3.22 0.00 -2.87 3.92 4.32 -1.26 -5.01 117.00 112.88 1pe4 n LEU 56 Ca 0.11 0.00 -0.12 0.00 -0.02 0.00 0.00 56.01 55.99 1pe4 n LEU 56 Cb 0.52 0.00 0.05 0.00 -1.62 0.00 0.00 43.42 42.37 1pe4 n LEU 56 CO 0.49 0.00 0.14 0.79 -1.22 0.00 0.00 177.39 177.59 1pe4 n TRP 57 N 0.00 -1.50 -0.89 -1.77 7.02 -1.26 -4.46 117.44 114.57 1pe4 n TRP 57 Ca 0.00 -2.71 0.00 0.00 -1.02 0.00 0.00 57.50 53.77 1pe4 n TRP 57 Cb 0.00 0.80 0.00 0.00 -2.42 0.00 0.00 31.31 29.69 1pe4 n TRP 57 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1pe4 n GLY 58 N 0.18 -2.12 0.00 6.99 0.00 -1.26 -4.97 105.19 104.01 1pe4 n GLY 58 Ca 0.11 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 0.00 0.00 -0.11 1.61 2.03 -1.15 -4.93 116.55 114.00 1pe4 n ASP 59 Ca 0.00 0.00 -0.20 0.00 0.52 0.00 0.00 54.79 55.11 1pe4 n ASP 59 Cb 0.00 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.31 1pe4 n ASP 59 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1pe4 n SER 60 N 0.00 1.88 0.00 1.67 2.88 -1.26 -4.49 113.62 114.29 1pe4 n SER 60 Ca 0.00 0.12 0.14 0.00 -1.33 0.00 0.00 58.87 57.80 1pe4 n SER 60 Cb 0.00 -0.52 0.73 0.00 -0.75 0.00 0.00 64.21 63.66 1pe4 n SER 60 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1pe4 n GLY 61 N 1.96 -1.14 0.00 0.46 0.00 -1.22 -4.67 105.19 100.58 1pe4 n GLY 61 Ca -0.41 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.47 1pe4 n GLY 61 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1pe4 n THR 62 N -1.23 0.00 0.00 2.61 5.66 -1.25 -4.31 114.28 115.76 1pe4 n THR 62 Ca 0.15 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.15 1pe4 n THR 62 Cb 0.20 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.98 1pe4 n THR 62 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1pe4 n GLY 63 N 0.98 1.22 1.43 1.09 0.00 -1.26 -1.73 105.19 106.92 1pe4 n GLY 63 Ca 0.00 0.56 -0.01 0.00 0.00 0.00 0.00 46.02 46.57 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 0.00 1.03 0.00 1.61 -0.04 -1.26 -4.88 135.00 131.46 1pe4 n PRO 64 Ca 0.00 -0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1pe4 n PRO 64 Cb 0.00 -1.02 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 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 0.00 1.26 0.00 0.00 0.52 -0.82 -4.99 118.95 114.92 1pe4 s ARG 66 Ca 0.00 -0.20 0.00 0.00 -0.52 0.00 0.00 55.73 55.01 1pe4 s ARG 66 Cb 0.00 -4.93 0.00 0.00 0.52 0.00 0.00 34.95 30.54 1pe4 s ARG 66 CO 0.00 -5.27 0.00 0.45 0.02 0.00 0.00 175.30 170.50