#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 0.00 0.00 2.89 5.68 -1.26 0.10 116.55 123.96 1pe4 n ASP 2 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1pe4 n ASP 2 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 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 0.00 3.98 2.58 6.12 0.00 -0.08 -4.82 105.19 112.97 1pe4 n GLY 3 Ca 0.00 -0.46 -0.12 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.34 0.16 1.61 4.11 -1.26 -1.56 117.16 117.87 1pe4 n TYR 4 Ca 0.00 -2.38 0.10 0.00 -0.00 0.00 0.00 57.90 55.62 1pe4 n TYR 4 Cb 0.00 1.02 0.19 0.00 -0.00 0.00 0.00 39.34 40.55 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 3.71 0.00 -6.24 -3.48 0.11 -1.93 -3.44 132.00 120.72 1pe4 h PRO 5 Ca -0.07 0.00 -0.38 0.00 0.11 0.00 0.00 66.00 65.66 1pe4 h PRO 5 Cb 1.01 0.00 0.05 0.00 0.11 0.00 0.00 31.00 32.16 1pe4 h PRO 5 CO 0.33 0.00 -0.82 1.47 -0.21 0.00 0.00 178.00 178.77 1pe4 n LEU 6 N -2.77 -3.14 0.00 2.35 -0.00 -1.26 -4.85 117.00 107.32 1pe4 n LEU 6 Ca 0.07 -0.86 0.00 0.00 -0.00 0.00 0.00 56.01 55.22 1pe4 n LEU 6 Cb 1.12 -2.32 0.00 0.00 -0.00 0.00 0.00 43.42 42.22 1pe4 n LEU 6 CO 0.08 0.19 0.03 0.00 -0.00 0.00 0.00 177.39 177.70 1pe4 n ALA 7 N -3.45 0.00 -1.00 1.47 0.00 -1.26 -4.07 120.51 112.20 1pe4 n ALA 7 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1pe4 n ALA 7 Cb 0.60 0.03 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 -0.49 0.00 -4.44 0.00 2.88 -1.26 -4.83 113.62 105.48 1pe4 n SER 8 Ca 0.00 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.11 1pe4 n SER 8 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 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 4.87 -2.27 -3.46 5.03 -1.26 -4.43 115.26 113.73 1pe4 n ASN 9 Ca 0.00 -2.93 -0.01 0.00 0.87 0.00 0.00 54.58 52.52 1pe4 n ASN 9 Cb 0.00 -1.70 0.00 0.00 -1.02 0.00 0.00 39.78 37.06 1pe4 n ASN 9 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1pe4 n GLY 10 N 4.93 -0.81 3.09 7.41 0.00 -1.25 -1.33 105.19 117.23 1pe4 n GLY 10 Ca 0.47 0.21 0.05 0.00 0.00 0.00 0.00 46.02 46.75 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 4.89 0.00 -0.56 0.00 5.02 -1.26 -4.06 118.16 122.18 1pe4 n LYS 12 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 1pe4 n LYS 12 Cb 0.58 -0.14 0.00 0.00 -0.02 0.00 0.00 35.03 35.46 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 -0.50 -0.92 0.00 2.13 3.72 -1.26 -4.32 117.46 116.30 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 -2.50 2.01 1.37 0.00 -1.26 -4.03 105.19 105.79 1pe4 n GLY 14 Ca 0.00 -1.07 -0.00 0.00 0.00 0.00 0.00 46.02 44.95 1pe4 n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pe4 s SER 16 N -2.99 6.46 0.25 0.00 0.15 -1.25 -4.42 113.70 111.90 1pe4 s SER 16 Ca 0.00 2.67 -0.03 0.00 0.70 0.00 0.00 55.95 59.29 1pe4 s SER 16 Cb 0.00 -2.54 0.47 0.00 -1.71 0.00 0.00 66.02 62.24 1pe4 s SER 16 CO 0.00 -1.03 1.76 1.23 1.20 0.00 0.00 173.24 176.40 1pe4 h GLY 17 N 9.96 1.26 -5.76 9.45 0.00 -1.82 -3.09 103.07 113.06 1pe4 h GLY 17 Ca -0.48 -0.22 -0.67 0.00 0.00 0.00 0.00 47.33 45.96 1pe4 h GLY 17 CO 0.94 -0.03 3.21 1.04 0.00 0.00 0.00 176.54 181.71 1pe4 n LEU 18 N -4.90 6.97 0.00 3.11 7.99 -1.26 -4.67 117.00 124.24 1pe4 n LEU 18 Ca 0.15 -4.00 0.00 0.00 -0.01 0.00 0.00 56.01 52.15 1pe4 n LEU 18 Cb 0.39 -1.54 0.00 0.00 -0.11 0.00 0.00 43.42 42.16 1pe4 n LEU 18 CO 0.21 1.18 0.00 0.61 -1.51 0.00 0.00 177.39 177.88 1pe4 n GLY 19 N 3.99 2.35 0.23 -0.72 0.00 -1.17 -4.90 105.19 104.97 1pe4 n GLY 19 Ca 0.58 -1.25 0.05 0.00 0.00 0.00 0.00 46.02 45.41 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 1.85 1.29 -1.00 1.61 2.13 -1.26 -4.22 120.64 121.05 1pe4 n GLU 20 Ca 0.00 -0.45 -0.41 0.00 0.66 0.00 0.00 57.16 56.96 1pe4 n GLU 20 Cb 0.00 -1.20 -0.06 0.00 0.27 0.00 0.00 31.44 30.45 1pe4 n GLU 20 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1pe4 n ASN 21 N -0.23 2.42 0.00 4.31 0.23 -1.26 -3.93 115.26 116.81 1pe4 n ASN 21 Ca 0.09 -2.61 0.00 0.00 -0.53 0.00 0.00 54.58 51.52 1pe4 n ASN 21 Cb 0.13 -1.01 0.00 0.00 -2.08 0.00 0.00 39.78 36.82 1pe4 n ASN 21 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1pe4 n ASN 22 N 7.40 0.00 -1.90 0.53 2.04 -1.26 -4.61 115.26 117.46 1pe4 n ASN 22 Ca 0.48 0.00 -0.09 0.00 -0.44 0.00 0.00 54.58 54.53 1pe4 n ASN 22 Cb 0.38 0.00 -0.13 0.00 -2.53 0.00 0.00 39.78 37.50 1pe4 n ASN 22 CO 0.00 0.00 0.00 -0.81 -0.44 0.00 0.00 177.26 176.01 1pe4 n PRO 23 N 0.00 1.77 -0.06 -0.53 -0.04 -1.25 -2.99 135.00 131.90 1pe4 n PRO 23 Ca 0.00 -0.78 -0.03 0.00 -0.04 0.00 0.00 63.50 62.65 1pe4 n PRO 23 Cb 0.00 -1.79 -0.02 0.00 -0.04 0.00 0.00 33.50 31.65 1pe4 n PRO 23 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1pe4 h THR 24 N 1.80 0.24 -1.24 0.52 1.35 -1.94 -3.34 112.91 110.30 1pe4 h THR 24 Ca 0.15 -1.19 0.36 0.00 -0.55 0.00 0.00 66.41 65.18 1pe4 h THR 24 Cb 1.40 0.46 -0.05 0.00 -1.73 0.00 0.00 68.15 68.23 1pe4 h THR 24 CO 0.18 0.08 0.92 0.00 -0.25 0.00 0.00 175.52 176.46 1pe4 n ASN 26 N -4.08 0.00 -0.05 0.00 3.02 -1.25 -1.32 115.26 111.58 1pe4 n ASN 26 Ca 0.27 0.81 -0.15 0.00 -0.03 0.00 0.00 54.58 55.48 1pe4 n ASN 26 Cb 1.33 -0.31 -0.07 0.00 -0.61 0.00 0.00 39.78 40.12 1pe4 n ASN 26 CO 0.00 0.00 0.00 0.45 -2.62 0.00 0.00 177.26 175.09 1pe4 h HIS 27 N 0.00 0.84 -0.21 3.10 3.86 -1.59 -2.34 115.15 118.81 1pe4 h HIS 27 Ca 0.00 -0.33 0.03 0.00 -1.16 0.00 0.00 60.37 58.91 1pe4 h HIS 27 Cb 0.00 -0.14 -0.06 0.00 1.06 0.00 0.00 27.41 28.27 1pe4 h HIS 27 CO -0.04 1.11 -0.43 0.28 0.86 0.00 0.00 177.93 179.71 1pe4 h VAL 28 N 0.32 0.00 -0.40 2.45 2.07 0.27 0.81 116.25 121.77 1pe4 h VAL 28 Ca -0.01 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.45 1pe4 h VAL 28 Cb 1.12 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1pe4 h VAL 28 CO 0.11 0.00 0.04 0.00 0.02 0.00 0.00 177.57 177.74 1pe4 n GLU 30 N -4.49 0.95 0.00 0.00 2.13 -0.88 -3.14 120.64 115.20 1pe4 n GLU 30 Ca -0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.81 1pe4 n GLU 30 Cb 0.25 -1.07 0.00 0.00 0.27 0.00 0.00 31.44 30.89 1pe4 n GLU 30 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1pe4 n LYS 31 N -0.57 0.00 0.23 5.31 4.81 0.28 -4.53 118.16 123.69 1pe4 n LYS 31 Ca 0.03 0.00 0.08 0.00 -0.87 0.00 0.00 58.31 57.55 1pe4 n LYS 31 Cb 0.01 0.00 0.62 0.00 0.02 0.00 0.00 35.03 35.69 1pe4 n LYS 31 CO 0.00 0.00 0.00 1.57 1.17 0.00 0.00 177.40 180.14 1pe4 h LYS 32 N 0.00 0.05 -0.01 1.64 2.10 -1.31 0.10 116.57 119.13 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 0.00 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.32 1pe4 h LYS 32 CO 0.00 0.03 -0.39 0.00 -2.00 0.00 0.00 179.45 177.10 1pe4 n ALA 33 N -2.54 3.36 -1.80 0.07 0.00 -1.22 -4.94 120.51 113.44 1pe4 n ALA 33 Ca -0.02 -0.59 -0.08 0.00 0.00 0.00 0.00 53.44 52.74 1pe4 n ALA 33 Cb 0.10 -0.88 -0.02 0.00 0.00 0.00 0.00 19.45 18.65 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 1.39 0.20 2.99 0.00 0.00 0.02 -4.82 105.19 104.97 1pe4 n GLY 34 Ca 0.10 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.96 1pe4 n GLY 34 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pe4 s SER 35 N -1.85 0.76 -0.46 1.61 1.04 -1.19 -4.94 113.70 108.67 1pe4 s SER 35 Ca 0.00 -0.18 0.03 0.00 0.48 0.00 0.00 55.95 56.29 1pe4 s SER 35 Cb 0.00 -0.07 0.62 0.00 0.10 0.00 0.00 66.02 66.67 1pe4 s SER 35 CO 0.00 0.04 1.90 -0.67 0.98 0.00 0.00 173.24 175.49 1pe4 n ASP 36 N 2.71 4.20 -4.29 7.02 -0.08 -1.26 -3.48 116.55 121.37 1pe4 n ASP 36 Ca -0.14 -3.57 -0.41 0.00 -1.51 0.00 0.00 54.79 49.16 1pe4 n ASP 36 Cb 0.57 -0.85 -0.10 0.00 2.34 0.00 0.00 41.12 43.09 1pe4 n ASP 36 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 1pe4 s TYR 37 N -3.23 3.32 0.33 -0.67 5.04 -1.26 -5.04 117.35 115.84 1pe4 s TYR 37 Ca 0.56 -1.42 -0.07 0.00 -2.44 0.00 0.00 57.07 53.70 1pe4 s TYR 37 Cb 0.47 -2.91 0.03 0.00 0.35 0.00 0.00 41.96 39.89 1pe4 s TYR 37 CO 0.09 -0.82 0.57 0.41 -1.34 0.00 0.00 175.55 174.46 1pe4 n GLY 38 N 4.95 1.65 2.94 8.97 0.00 -1.25 -1.21 105.19 121.24 1pe4 n GLY 38 Ca -0.10 -1.41 -0.11 0.00 0.00 0.00 0.00 46.02 44.39 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 -3.03 0.02 -0.22 1.61 6.14 -0.95 -4.83 117.35 116.10 1pe4 s TYR 39 Ca 0.20 -0.03 -0.02 0.00 0.64 0.00 0.00 57.07 57.87 1pe4 s TYR 39 Cb -0.03 -0.03 0.06 0.00 0.42 0.00 0.00 41.96 42.39 1pe4 s TYR 39 CO 0.15 -0.07 0.02 0.00 0.64 0.00 0.00 175.55 176.29 1pe4 n TYR 41 N 4.93 -0.33 -0.62 0.00 4.19 -1.26 -5.11 117.16 118.96 1pe4 n TYR 41 Ca -0.09 0.06 0.00 0.00 3.31 0.00 0.00 57.90 61.18 1pe4 n TYR 41 Cb 0.46 0.33 0.00 0.00 0.49 0.00 0.00 39.34 40.62 1pe4 n TYR 41 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1pe4 n ALA 42 N -2.69 0.00 -1.86 2.98 0.00 -1.26 -4.67 120.51 113.01 1pe4 n ALA 42 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 1pe4 n ALA 42 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1pe4 n ALA 42 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1pe4 n TRP 43 N 0.00 2.63 -2.23 0.00 -0.00 -1.26 -3.28 117.44 113.31 1pe4 n TRP 43 Ca 0.00 -2.89 0.00 0.00 -0.00 0.00 0.00 57.50 54.61 1pe4 n TRP 43 Cb 0.00 -2.04 0.00 0.00 -0.00 0.00 0.00 31.31 29.27 1pe4 n TRP 43 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 177.69 175.32 1pe4 n THR 44 N 2.52 0.00 -3.64 5.87 5.66 -1.26 -3.79 114.28 119.63 1pe4 n THR 44 Ca 0.63 0.00 -0.03 0.00 -3.05 0.00 0.00 64.05 61.60 1pe4 n THR 44 Cb 0.26 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.98 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 1.13 3.65 -0.05 0.00 5.04 0.44 -4.15 117.35 123.40 1pe4 s TYR 46 Ca -0.07 1.38 -0.09 0.00 -2.44 0.00 0.00 57.07 55.86 1pe4 s TYR 46 Cb -0.04 -2.62 0.02 0.00 0.35 0.00 0.00 41.96 39.67 1pe4 s TYR 46 CO -0.13 0.34 0.21 0.00 -1.34 0.00 0.00 175.55 174.63 1pe4 s GLU 48 N -0.44 3.88 -1.27 0.00 8.01 -0.35 -0.91 118.70 127.64 1pe4 s GLU 48 Ca -0.05 0.35 0.00 0.00 0.01 0.00 0.00 54.97 55.28 1pe4 s GLU 48 Cb -0.04 -3.01 0.00 0.00 -4.31 0.00 0.00 34.13 26.77 1pe4 s GLU 48 CO 0.01 0.55 0.00 1.58 0.01 0.00 0.00 175.26 177.41 1pe4 n HIS 49 N 1.02 0.00 0.00 1.61 -0.00 0.29 -4.75 115.22 113.40 1pe4 n HIS 49 Ca -0.08 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.10 1pe4 n HIS 49 Cb 0.52 -2.57 0.00 0.00 -0.12 0.00 0.00 29.99 27.82 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 -2.40 0.00 0.00 3.57 0.31 -1.26 -4.67 118.33 113.88 1pe4 n VAL 50 Ca -0.12 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 1pe4 n VAL 50 Cb 0.52 0.48 0.00 0.00 -0.91 0.00 0.00 33.84 33.93 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 -1.39 -0.01 -1.24 3.52 0.00 -1.26 -2.57 120.51 117.56 1pe4 n ALA 51 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 1pe4 n ALA 51 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1pe4 n ALA 51 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1pe4 n GLU 52 N -0.54 2.90 0.00 0.00 -0.58 -1.26 -4.21 120.64 116.95 1pe4 n GLU 52 Ca 0.00 -2.06 0.00 0.00 -0.42 0.00 0.00 57.16 54.68 1pe4 n GLU 52 Cb 0.00 -2.83 0.00 0.00 -0.57 0.00 0.00 31.44 28.04 1pe4 n GLU 52 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1pe4 n GLY 53 N 3.83 -2.21 3.32 0.62 0.00 -1.25 -4.71 105.19 104.79 1pe4 n GLY 53 Ca 0.62 0.76 -0.22 0.00 0.00 0.00 0.00 46.02 47.17 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 -0.36 0.00 -4.38 2.61 -1.04 -1.06 -5.09 114.28 104.95 1pe4 n THR 54 Ca 0.00 -1.13 -0.20 0.00 -2.04 0.00 0.00 64.05 60.67 1pe4 n THR 54 Cb 0.00 -1.23 -0.09 0.00 -1.82 0.00 0.00 70.33 67.19 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 -2.99 0.51 0.03 12.58 -7.23 -1.26 -4.63 120.40 117.41 1pe4 s VAL 55 Ca 0.60 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.77 1pe4 s VAL 55 Cb -0.03 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.39 1pe4 s VAL 55 CO 0.41 0.00 0.00 0.18 -0.31 0.00 0.00 175.10 175.38 1pe4 n LEU 56 N -0.65 0.23 0.00 1.32 7.99 -1.26 -5.09 117.00 119.54 1pe4 n LEU 56 Ca -0.01 0.04 0.00 0.00 -0.01 0.00 0.00 56.01 56.03 1pe4 n LEU 56 Cb 0.65 -0.06 0.00 0.00 -0.11 0.00 0.00 43.42 43.90 1pe4 n LEU 56 CO 0.36 -0.56 0.00 0.79 -1.51 0.00 0.00 177.39 176.47 1pe4 n TRP 57 N -2.74 -1.09 -0.69 -1.77 5.03 -1.26 -4.25 117.44 110.67 1pe4 n TRP 57 Ca 0.00 0.00 -0.42 0.00 3.03 0.00 0.00 57.50 60.11 1pe4 n TRP 57 Cb 0.00 0.12 -0.09 0.00 -1.03 0.00 0.00 31.31 30.31 1pe4 n TRP 57 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 1pe4 n GLY 58 N 0.00 1.27 0.00 6.99 0.00 -1.26 -4.82 105.19 107.37 1pe4 n GLY 58 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.01 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 8.27 0.00 -0.03 1.61 2.03 -1.26 -4.85 116.55 122.32 1pe4 n ASP 59 Ca 0.46 0.00 -0.20 0.00 0.52 0.00 0.00 54.79 55.57 1pe4 n ASP 59 Cb 0.39 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 40.66 1pe4 n ASP 59 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 1pe4 h SER 60 N 0.00 0.22 -0.52 1.67 0.87 -1.92 -3.36 113.55 110.50 1pe4 h SER 60 Ca 0.00 -0.81 0.00 0.00 -1.23 0.00 0.00 61.79 59.75 1pe4 h SER 60 Cb 0.00 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 61.89 1pe4 h SER 60 CO 0.00 1.44 0.00 0.61 -0.53 0.00 0.00 176.83 178.35 1pe4 n GLY 61 N 1.63 2.13 0.14 5.77 0.00 -1.26 -4.13 105.19 109.46 1pe4 n GLY 61 Ca -0.22 -0.67 -0.21 0.00 0.00 0.00 0.00 46.02 44.92 1pe4 n GLY 61 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1pe4 n THR 62 N 0.89 1.74 0.00 2.61 -2.24 -1.26 -3.77 114.28 112.25 1pe4 n THR 62 Ca 0.20 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1pe4 n THR 62 Cb 0.71 -1.73 0.00 0.00 -2.10 0.00 0.00 70.33 67.21 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 1.98 0.79 0.33 3.38 0.00 -1.26 -0.30 105.19 110.11 1pe4 n GLY 63 Ca -0.34 -0.16 0.18 0.00 0.00 0.00 0.00 46.02 45.70 1pe4 n GLY 63 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1pe4 h PRO 64 N 0.00 0.00 -1.06 1.61 0.11 -1.97 -3.48 132.00 127.21 1pe4 h PRO 64 Ca 0.00 0.00 0.12 0.00 0.11 0.00 0.00 66.00 66.23 1pe4 h PRO 64 Cb 0.00 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.07 1pe4 h PRO 64 CO 0.00 0.00 -0.21 0.00 -0.21 0.00 0.00 178.00 177.58 1pe4 s ARG 66 N -1.74 1.67 0.00 0.00 1.81 0.00 -4.93 118.95 115.76 1pe4 s ARG 66 Ca 0.00 -0.43 0.00 0.00 -1.72 0.00 0.00 55.73 53.58 1pe4 s ARG 66 Cb 0.00 -1.87 0.00 0.00 -0.45 0.00 0.00 34.95 32.63 1pe4 s ARG 66 CO 0.00 -0.33 0.00 0.45 -0.68 0.00 0.00 175.30 174.74