#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 -3.36 -3.17 0.55 9.92 -1.26 0.96 116.55 120.18 1pe4 n ASP 2 Ca 0.00 -0.56 -0.26 0.00 -0.53 0.00 0.00 54.79 53.44 1pe4 n ASP 2 Cb 0.00 -0.66 -0.06 0.00 -0.64 0.00 0.00 41.12 39.76 1pe4 n ASP 2 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1pe4 n GLY 3 N -3.54 4.87 1.20 0.44 0.00 0.32 -3.40 105.19 105.08 1pe4 n GLY 3 Ca 0.09 -2.57 0.00 0.00 0.00 0.00 0.00 46.02 43.54 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 0.37 -0.39 -0.28 1.61 9.36 -1.26 -1.34 117.16 125.22 1pe4 n TYR 4 Ca 0.29 0.07 0.34 0.00 3.32 0.00 0.00 57.90 61.92 1pe4 n TYR 4 Cb 0.44 0.09 0.74 0.00 -0.63 0.00 0.00 39.34 39.99 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 0.00 0.00 -1.43 2.98 0.13 -1.97 -3.46 132.00 128.25 1pe4 h PRO 5 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1pe4 h PRO 5 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1pe4 h PRO 5 CO 0.00 0.00 0.00 1.47 -0.23 0.00 0.00 178.00 179.24 1pe4 n LEU 6 N -4.19 -0.95 0.00 1.56 -0.00 -1.26 -4.75 117.00 107.41 1pe4 n LEU 6 Ca 0.24 0.24 0.00 0.00 -0.00 0.00 0.00 56.01 56.49 1pe4 n LEU 6 Cb 1.18 -0.38 0.00 0.00 -0.00 0.00 0.00 43.42 44.22 1pe4 n LEU 6 CO 0.40 -0.64 0.05 0.00 -0.00 0.00 0.00 177.39 177.20 1pe4 n ALA 7 N 1.43 0.00 -2.13 1.47 0.00 -1.26 -3.76 120.51 116.26 1pe4 n ALA 7 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 1pe4 n ALA 7 Cb 0.00 0.05 -0.02 0.00 0.00 0.00 0.00 19.45 19.48 1pe4 n ALA 7 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1pe4 s SER 8 N -0.66 6.09 0.43 0.00 0.15 -1.26 -4.86 113.70 113.58 1pe4 s SER 8 Ca 0.00 1.16 0.09 0.00 0.70 0.00 0.00 55.95 57.91 1pe4 s SER 8 Cb 0.00 -2.53 0.93 0.00 -1.71 0.00 0.00 66.02 62.71 1pe4 s SER 8 CO 0.00 -1.58 2.05 0.78 1.20 0.00 0.00 173.24 175.69 1pe4 h ASN 9 N 11.95 0.41 -0.02 5.45 -0.26 -1.88 -3.25 115.58 127.97 1pe4 h ASN 9 Ca -0.32 -0.01 -0.71 0.00 -0.56 0.00 0.00 56.30 54.71 1pe4 h ASN 9 Cb 1.15 -0.10 -0.04 0.00 -1.06 0.00 0.00 38.32 38.27 1pe4 h ASN 9 CO 1.05 0.28 3.18 0.61 -1.06 0.00 0.00 177.43 181.49 1pe4 n GLY 10 N -1.49 4.41 1.38 2.83 0.00 -1.26 -0.91 105.19 110.15 1pe4 n GLY 10 Ca 0.04 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1pe4 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pe4 h LYS 12 N 2.43 0.00 0.00 0.00 3.64 -1.83 -3.39 116.57 117.42 1pe4 h LYS 12 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1pe4 h LYS 12 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1pe4 h LYS 12 CO 0.00 0.71 0.00 1.19 -2.27 0.00 0.00 179.45 179.08 1pe4 n PHE 13 N -4.49 0.00 0.00 1.91 3.72 -1.26 -3.34 117.46 114.00 1pe4 n PHE 13 Ca -0.24 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.16 1pe4 n PHE 13 Cb 0.55 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.09 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 -0.05 7.00 1.37 0.00 -1.26 -3.51 105.19 113.74 1pe4 n GLY 14 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 10.00 0.00 0.00 0.00 7.64 -1.26 -4.53 113.62 125.48 1pe4 n SER 16 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1pe4 n SER 16 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1pe4 n SER 16 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pe4 n GLY 17 N 0.00 2.13 2.47 0.23 0.00 -1.26 -3.94 105.19 104.82 1pe4 n GLY 17 Ca 0.00 -0.07 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 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 7.63 0.00 0.99 4.77 -1.26 -4.71 117.00 124.42 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 -1.49 0.00 0.00 -2.33 0.00 0.00 43.42 39.60 1pe4 n LEU 18 CO 0.00 1.57 0.00 0.61 -1.33 0.00 0.00 177.39 178.24 1pe4 n GLY 19 N 3.75 2.11 2.34 -0.72 0.00 -1.26 -5.11 105.19 106.30 1pe4 n GLY 19 Ca 0.67 -0.01 -0.17 0.00 0.00 0.00 0.00 46.02 46.51 1pe4 n GLY 19 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1pe4 n GLU 20 N 0.00 -0.54 -2.63 1.61 1.02 -1.26 -4.96 120.64 113.88 1pe4 n GLU 20 Ca 0.00 -1.35 -0.42 0.00 -0.02 0.00 0.00 57.16 55.37 1pe4 n GLU 20 Cb 0.00 -0.72 -0.02 0.00 -0.02 0.00 0.00 31.44 30.68 1pe4 n GLU 20 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1pe4 s ASN 21 N -3.82 6.61 -0.46 1.62 2.20 -1.26 -4.75 114.94 115.08 1pe4 s ASN 21 Ca 0.44 -1.81 0.05 0.00 -0.94 0.00 0.00 52.86 50.61 1pe4 s ASN 21 Cb -0.01 -2.54 0.41 0.00 -2.00 0.00 0.00 41.25 37.10 1pe4 s ASN 21 CO 0.31 -1.35 1.08 0.59 -2.94 0.00 0.00 177.10 174.78 1pe4 n ASN 22 N 8.36 4.62 0.00 3.54 5.03 -1.26 -4.81 115.26 130.73 1pe4 n ASN 22 Ca 0.36 -3.70 0.15 0.00 0.87 0.00 0.00 54.58 52.25 1pe4 n ASN 22 Cb 0.49 -0.48 0.87 0.00 -1.02 0.00 0.00 39.78 39.65 1pe4 n ASN 22 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 1pe4 n PRO 23 N -0.43 0.91 0.29 3.52 -0.04 -1.26 0.12 135.00 138.11 1pe4 n PRO 23 Ca 0.37 0.00 0.18 0.00 -0.04 0.00 0.00 63.50 64.01 1pe4 n PRO 23 Cb 0.61 -1.50 0.93 0.00 -0.04 0.00 0.00 33.50 33.51 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 0.00 0.13 -0.82 0.52 2.02 -1.96 -1.77 112.91 111.04 1pe4 h THR 24 Ca 0.00 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.35 1pe4 h THR 24 Cb 0.01 0.80 -0.06 0.00 -1.74 0.00 0.00 68.15 67.16 1pe4 h THR 24 CO 0.00 0.00 0.55 0.00 0.37 0.00 0.00 175.52 176.44 1pe4 h ASN 26 N 0.42 0.70 -0.13 0.00 2.35 -1.65 -2.61 115.58 114.65 1pe4 h ASN 26 Ca 0.42 -0.41 -0.10 0.00 -0.55 0.00 0.00 56.30 55.65 1pe4 h ASN 26 Cb 0.98 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 39.15 1pe4 h ASN 26 CO -0.15 1.16 -0.32 0.45 -1.65 0.00 0.00 177.43 176.93 1pe4 h HIS 27 N 0.44 0.58 -0.37 1.19 3.86 -1.02 -1.00 115.15 118.83 1pe4 h HIS 27 Ca -0.01 -0.22 0.03 0.00 -1.16 0.00 0.00 60.37 59.01 1pe4 h HIS 27 Cb 1.22 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 29.55 1pe4 h HIS 27 CO 0.06 0.94 0.19 0.28 0.86 0.00 0.00 177.93 180.25 1pe4 h VAL 28 N 0.05 0.98 0.49 2.45 2.07 -0.67 -0.79 116.25 120.83 1pe4 h VAL 28 Ca -0.00 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 1pe4 h VAL 28 Cb 0.92 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 1pe4 h VAL 28 CO 0.07 0.07 -0.23 0.00 0.02 0.00 0.00 177.57 177.49 1pe4 h GLU 30 N -1.13 0.00 0.00 0.00 5.08 -0.42 1.18 114.58 119.29 1pe4 h GLU 30 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1pe4 h GLU 30 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1pe4 h GLU 30 CO 0.11 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.75 1pe4 n LYS 31 N -3.01 0.00 0.04 2.33 5.02 -0.30 -3.98 118.16 118.26 1pe4 n LYS 31 Ca 0.01 0.17 -0.16 0.00 -2.02 0.00 0.00 58.31 56.30 1pe4 n LYS 31 Cb 0.53 -0.59 -0.14 0.00 -0.02 0.00 0.00 35.03 34.81 1pe4 n LYS 31 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 1pe4 h LYS 32 N 0.00 0.22 -0.74 1.97 2.10 -1.40 -3.32 116.57 115.40 1pe4 h LYS 32 Ca 0.00 -0.38 -0.14 0.00 -2.00 0.00 0.00 60.65 58.14 1pe4 h LYS 32 Cb 0.00 0.14 -0.08 0.00 -0.90 0.00 0.00 32.23 31.39 1pe4 h LYS 32 CO 0.00 1.05 0.17 0.00 -2.00 0.00 0.00 179.45 178.67 1pe4 n ALA 33 N -2.70 4.18 -0.78 0.07 0.00 0.13 -5.01 120.51 116.40 1pe4 n ALA 33 Ca -0.19 -1.95 0.10 0.00 0.00 0.00 0.00 53.44 51.41 1pe4 n ALA 33 Cb 1.04 -1.20 -0.03 0.00 0.00 0.00 0.00 19.45 19.27 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 0.11 -1.00 3.87 0.00 0.00 0.36 -4.61 105.19 103.92 1pe4 n GLY 34 Ca 0.33 -0.61 -0.21 0.00 0.00 0.00 0.00 46.02 45.53 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 -4.31 5.59 0.00 1.61 0.15 -1.26 -1.86 113.70 113.63 1pe4 s SER 35 Ca 0.00 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.36 1pe4 s SER 35 Cb 0.00 -1.28 0.00 0.00 -1.71 0.00 0.00 66.02 63.03 1pe4 s SER 35 CO 0.00 -0.21 0.00 0.47 1.20 0.00 0.00 173.24 174.70 1pe4 n ASP 36 N -1.34 0.00 -1.80 5.45 8.00 -1.26 -4.84 116.55 120.76 1pe4 n ASP 36 Ca -0.05 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.28 1pe4 n ASP 36 Cb 0.58 0.00 0.17 0.00 -0.02 0.00 0.00 41.12 41.86 1pe4 n ASP 36 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1pe4 n TYR 37 N -2.00 2.27 -4.62 1.24 4.01 -1.26 -4.96 117.16 111.85 1pe4 n TYR 37 Ca 0.00 -1.89 -0.23 0.00 -0.16 0.00 0.00 57.90 55.63 1pe4 n TYR 37 Cb 0.00 -0.79 -0.15 0.00 -0.31 0.00 0.00 39.34 38.09 1pe4 n TYR 37 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1pe4 s GLY 38 N -1.95 0.77 -0.05 2.72 0.00 -1.26 0.05 107.32 107.60 1pe4 s GLY 38 Ca 0.53 -0.72 -0.05 0.00 0.00 0.00 0.00 44.72 44.48 1pe4 s GLY 38 CO 0.05 -0.63 0.14 -2.52 0.00 0.00 0.00 173.10 170.14 1pe4 s TYR 39 N -0.49 -0.14 -0.05 1.90 -0.85 0.13 -4.97 117.35 112.88 1pe4 s TYR 39 Ca 0.05 0.34 0.05 0.00 -0.52 0.00 0.00 57.07 56.99 1pe4 s TYR 39 Cb -0.06 0.05 -0.00 0.00 0.38 0.00 0.00 41.96 42.32 1pe4 s TYR 39 CO 0.00 -0.08 -0.20 0.00 -1.52 0.00 0.00 175.55 173.75 1pe4 n TYR 41 N 3.14 0.00 -0.36 0.00 4.01 -1.26 -5.04 117.16 117.65 1pe4 n TYR 41 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 1pe4 n TYR 41 Cb 0.53 0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.60 1pe4 n TYR 41 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1pe4 n ALA 42 N -1.74 0.00 -2.83 -0.72 0.00 -1.26 -4.93 120.51 109.04 1pe4 n ALA 42 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.00 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 -2.67 0.00 0.00 0.00 177.50 174.83 1pe4 n TRP 43 N 0.00 4.80 0.00 0.00 2.14 -1.25 -4.50 117.44 118.62 1pe4 n TRP 43 Ca 0.00 -3.22 0.00 0.00 2.07 0.00 0.00 57.50 56.35 1pe4 n TRP 43 Cb 0.00 -2.28 0.00 0.00 -0.81 0.00 0.00 31.31 28.22 1pe4 n TRP 43 CO 0.00 0.00 0.00 -2.37 2.07 0.00 0.00 177.69 177.39 1pe4 n THR 44 N 4.92 0.00 -3.99 -1.67 5.66 -1.26 -3.92 114.28 114.02 1pe4 n THR 44 Ca 0.40 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 61.07 1pe4 n THR 44 Cb 0.43 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.07 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 1.02 3.43 0.00 0.00 1.51 0.16 -4.16 117.35 119.30 1pe4 s TYR 46 Ca 0.04 1.25 0.00 0.00 -1.01 0.00 0.00 57.07 57.35 1pe4 s TYR 46 Cb -0.20 -2.55 0.00 0.00 -0.11 0.00 0.00 41.96 39.10 1pe4 s TYR 46 CO -0.06 0.14 0.00 0.00 -1.11 0.00 0.00 175.55 174.52 1pe4 s GLU 48 N 1.13 0.41 -0.73 0.00 -6.30 0.11 0.12 118.70 113.43 1pe4 s GLU 48 Ca 0.00 0.50 -0.02 0.00 -2.50 0.00 0.00 54.97 52.95 1pe4 s GLU 48 Cb 0.00 0.19 0.00 0.00 0.00 0.00 0.00 34.13 34.32 1pe4 s GLU 48 CO 0.00 -0.06 0.25 0.72 0.02 0.00 0.00 175.26 176.19 1pe4 n HIS 49 N 2.97 -0.85 0.00 5.30 8.25 0.27 -4.75 115.22 126.40 1pe4 n HIS 49 Ca -0.14 0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 1pe4 n HIS 49 Cb 0.57 -2.59 0.00 0.00 1.12 0.00 0.00 29.99 29.09 1pe4 n HIS 49 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1pe4 n VAL 50 N -3.85 0.00 -0.35 1.59 0.24 -0.61 -4.66 118.33 110.70 1pe4 n VAL 50 Ca -0.06 -0.08 -0.04 0.00 -2.04 0.00 0.00 64.34 62.12 1pe4 n VAL 50 Cb 0.56 0.56 0.21 0.00 -1.47 0.00 0.00 33.84 33.70 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 -1.32 3.89 -1.73 2.33 0.00 -1.17 -4.26 120.51 118.26 1pe4 n ALA 51 Ca 0.00 -1.54 -0.40 0.00 0.00 0.00 0.00 53.44 51.50 1pe4 n ALA 51 Cb 0.00 -1.17 -0.01 0.00 0.00 0.00 0.00 19.45 18.27 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 0.01 3.72 -2.06 0.00 2.13 -1.26 -4.50 120.64 118.66 1pe4 n GLU 52 Ca 0.27 -2.80 -0.20 0.00 0.66 0.00 0.00 57.16 55.10 1pe4 n GLU 52 Cb 1.05 -2.89 -0.04 0.00 0.27 0.00 0.00 31.44 29.83 1pe4 n GLU 52 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1pe4 n GLY 53 N 3.13 0.47 0.00 8.31 0.00 -1.26 -4.97 105.19 110.86 1pe4 n GLY 53 Ca 0.63 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.59 1pe4 n GLY 53 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1pe4 n THR 54 N -3.40 0.00 -3.80 2.61 -1.04 -1.26 -5.06 114.28 102.33 1pe4 n THR 54 Ca -0.22 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.43 1pe4 n THR 54 Cb 0.67 -1.70 -0.12 0.00 -1.82 0.00 0.00 70.33 67.35 1pe4 n THR 54 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 1pe4 s VAL 55 N 0.29 3.34 -0.07 12.58 -7.23 -1.26 -5.05 120.40 122.99 1pe4 s VAL 55 Ca 0.00 -1.62 -0.03 0.00 -1.81 0.00 0.00 61.98 58.52 1pe4 s VAL 55 Cb 0.00 -3.08 0.04 0.00 0.56 0.00 0.00 36.38 33.90 1pe4 s VAL 55 CO 0.00 -0.39 0.07 -1.48 -0.31 0.00 0.00 175.10 172.99 1pe4 s LEU 56 N 1.24 0.15 0.00 1.32 -0.00 -1.26 -4.97 118.68 115.16 1pe4 s LEU 56 Ca 0.02 -0.01 0.00 0.00 -0.00 0.00 0.00 54.13 54.13 1pe4 s LEU 56 Cb -0.21 -0.12 0.00 0.00 -0.00 0.00 0.00 46.19 45.86 1pe4 s LEU 56 CO -0.01 -0.27 0.00 0.79 -0.00 0.00 0.00 176.35 176.86 1pe4 n TRP 57 N 5.30 -0.07 -3.15 3.48 5.03 -1.26 -4.14 117.44 122.63 1pe4 n TRP 57 Ca -0.04 0.00 0.04 0.00 3.03 0.00 0.00 57.50 60.53 1pe4 n TRP 57 Cb 0.50 0.02 -0.01 0.00 -1.03 0.00 0.00 31.31 30.79 1pe4 n TRP 57 CO 0.00 0.00 0.00 0.20 -0.03 0.00 0.00 177.69 177.86 1pe4 s GLY 58 N -1.80 -1.02 0.00 6.99 0.00 -1.26 -4.54 107.32 105.69 1pe4 s GLY 58 Ca 0.00 1.75 0.00 0.00 0.00 0.00 0.00 44.72 46.47 1pe4 s GLY 58 CO 0.00 3.45 0.00 1.34 0.00 0.00 0.00 173.10 177.89 1pe4 n ASP 59 N 5.43 0.00 -0.00 1.64 2.03 -1.21 -4.94 116.55 119.50 1pe4 n ASP 59 Ca -0.00 0.00 0.01 0.00 0.52 0.00 0.00 54.79 55.32 1pe4 n ASP 59 Cb 0.52 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.80 1pe4 n ASP 59 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1pe4 n SER 60 N 0.00 0.48 -0.12 1.67 7.64 -1.26 -4.21 113.62 117.83 1pe4 n SER 60 Ca 0.00 0.21 0.11 0.00 1.01 0.00 0.00 58.87 60.20 1pe4 n SER 60 Cb 0.00 0.76 0.03 0.00 -1.01 0.00 0.00 64.21 63.99 1pe4 n SER 60 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pe4 n GLY 61 N 1.43 -0.81 2.08 0.23 0.00 -1.23 -4.88 105.19 102.01 1pe4 n GLY 61 Ca -0.13 -0.54 -0.20 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.13 0.00 0.00 2.61 5.66 -1.26 -4.35 114.28 115.81 1pe4 n THR 62 Ca 0.06 -0.02 0.00 0.00 -3.05 0.00 0.00 64.05 61.04 1pe4 n THR 62 Cb 0.36 -0.67 0.00 0.00 -1.55 0.00 0.00 70.33 68.47 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 -3.70 1.04 1.63 1.09 0.00 -1.18 -4.44 105.19 99.62 1pe4 n GLY 63 Ca 0.09 -0.94 -0.08 0.00 0.00 0.00 0.00 46.02 45.09 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 0.65 1.38 0.00 1.61 -0.04 -1.26 -4.82 135.00 132.52 1pe4 n PRO 64 Ca 0.00 -0.76 0.00 0.00 -0.04 0.00 0.00 63.50 62.70 1pe4 n PRO 64 Cb 0.00 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.16 1pe4 n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1pe4 n ARG 66 N 0.00 0.00 -0.53 0.00 5.12 -1.25 -4.83 116.66 115.16 1pe4 n ARG 66 Ca 0.00 0.52 0.00 0.00 -1.93 0.00 0.00 57.85 56.44 1pe4 n ARG 66 Cb 0.00 -1.08 0.00 0.00 -1.16 0.00 0.00 32.46 30.22 1pe4 n ARG 66 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15