#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lpe s ARG 2 N 0.00 1.80 -0.01 2.12 0.52 0.55 -4.62 118.95 119.31 3lpe s ARG 2 Ca 0.00 -1.96 0.03 0.00 -0.52 0.00 0.00 55.73 53.27 3lpe s ARG 2 Cb 0.00 -1.50 -0.00 0.00 0.52 0.00 0.00 34.95 33.96 3lpe s ARG 2 CO 0.00 0.03 -0.09 0.00 0.02 0.00 0.00 175.30 175.26 3lpe s ALA 3 N -2.78 0.75 0.29 2.13 0.00 0.67 -0.37 121.76 122.45 3lpe s ALA 3 Ca 0.33 -0.36 -0.30 0.00 0.00 0.00 0.00 51.96 51.63 3lpe s ALA 3 Cb 0.06 -0.21 -0.12 0.00 0.00 0.00 0.00 23.12 22.85 3lpe s ALA 3 CO 0.16 0.17 1.59 0.00 0.00 0.00 0.00 175.76 177.68 3lpe h LEU 5 N 4.82 0.00 0.00 0.00 3.38 -1.58 -1.01 115.31 120.91 3lpe h LEU 5 Ca -0.47 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.06 3lpe h LEU 5 Cb 1.23 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.91 3lpe h LEU 5 CO 0.80 0.08 -2.42 1.17 0.09 0.00 0.00 178.44 178.15 3lpe n LYS 6 N -3.34 0.59 0.00 1.13 4.81 -1.26 -4.73 118.16 115.35 3lpe n LYS 6 Ca -0.01 0.29 0.03 0.00 -0.87 0.00 0.00 58.31 57.75 3lpe n LYS 6 Cb 0.25 -1.52 0.02 0.00 0.02 0.00 0.00 35.03 33.80 3lpe n LYS 6 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3lpe n LYS 8 N 0.08 -0.09 -1.62 0.00 5.02 -0.38 -4.89 118.16 116.28 3lpe n LYS 8 Ca 0.03 0.02 -0.48 0.00 -2.02 0.00 0.00 58.31 55.87 3lpe n LYS 8 Cb 0.13 -3.24 -0.04 0.00 -0.02 0.00 0.00 35.03 31.86 3lpe n LYS 8 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 3lpe n TYR 9 N -2.09 1.67 -3.38 2.13 9.36 -1.26 -0.98 117.16 122.60 3lpe n TYR 9 Ca 0.00 0.57 -0.37 0.00 3.32 0.00 0.00 57.90 61.41 3lpe n TYR 9 Cb 0.02 -2.36 -0.06 0.00 -0.63 0.00 0.00 39.34 36.31 3lpe n TYR 9 CO 0.00 0.00 0.00 -0.51 0.22 0.00 0.00 176.86 176.57 3lpe s LEU 10 N 0.47 4.26 0.06 2.98 1.43 0.38 -0.57 118.68 127.69 3lpe s LEU 10 Ca 0.73 0.72 -0.27 0.00 -1.03 0.00 0.00 54.13 54.28 3lpe s LEU 10 Cb -0.78 -2.60 0.07 0.00 0.03 0.00 0.00 46.19 42.91 3lpe s LEU 10 CO 0.50 0.02 0.66 0.28 0.23 0.00 0.00 176.35 178.04 3lpe s THR 11 N 0.61 0.00 -0.53 5.49 -1.32 0.50 -4.79 115.64 115.60 3lpe s THR 11 Ca 0.23 0.00 0.26 0.00 -1.21 0.00 0.00 61.69 60.97 3lpe s THR 11 Cb -0.14 -1.00 0.30 0.00 -1.51 0.00 0.00 72.50 70.15 3lpe s THR 11 CO 0.08 0.00 1.75 0.78 -2.21 0.00 0.00 174.62 175.02 3lpe h ASN 12 N 2.40 0.00 -3.96 8.08 2.35 -1.94 0.16 115.58 122.68 3lpe h ASN 12 Ca -0.30 0.00 -0.53 0.00 -0.55 0.00 0.00 56.30 54.91 3lpe h ASN 12 Cb 1.24 0.00 0.10 0.00 0.05 0.00 0.00 38.32 39.70 3lpe h ASN 12 CO 0.38 0.00 0.67 -0.62 -1.65 0.00 0.00 177.43 176.21 3lpe s ASP 13 N -4.98 6.21 0.01 5.81 -1.08 -1.26 -4.81 116.67 116.57 3lpe s ASP 13 Ca 0.08 2.81 0.21 0.00 -0.52 0.00 0.00 52.55 55.12 3lpe s ASP 13 Cb 0.10 -2.65 0.89 0.00 -1.46 0.00 0.00 42.92 39.80 3lpe s ASP 13 CO 0.57 -0.94 1.67 -0.62 0.52 0.00 0.00 175.17 176.37 3lpe n GLU 14 N 0.13 0.01 -4.51 4.34 1.02 -1.26 -4.69 120.64 115.67 3lpe n GLU 14 Ca 0.03 0.15 -0.22 0.00 -0.02 0.00 0.00 57.16 57.10 3lpe n GLU 14 Cb 0.42 -1.51 -0.16 0.00 -0.02 0.00 0.00 31.44 30.17 3lpe n GLU 14 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3lpe s ILE 15 N -3.01 0.97 0.06 -3.67 1.01 -1.26 -1.81 121.20 113.49 3lpe s ILE 15 Ca 0.10 -0.45 -0.31 0.00 0.00 0.00 0.00 60.65 60.00 3lpe s ILE 15 Cb 0.14 -0.86 -0.08 0.00 0.01 0.00 0.00 42.46 41.67 3lpe s ILE 15 CO 0.38 0.30 1.54 0.00 0.00 0.00 0.00 174.94 177.17 3lpe h PRO 17 N 7.89 0.00 0.00 0.00 0.11 -1.96 -0.18 132.00 137.86 3lpe h PRO 17 Ca -0.41 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.68 3lpe h PRO 17 Cb 1.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 3lpe h PRO 17 CO 0.91 0.00 -0.43 0.82 -0.21 0.00 0.00 178.00 179.10 3lpe h ILE 18 N 0.00 0.16 -0.06 4.15 2.04 -1.98 -3.43 117.51 118.39 3lpe h ILE 18 Ca 0.00 -1.17 0.00 0.00 1.00 0.00 0.00 64.86 64.69 3lpe h ILE 18 Cb 0.43 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 3lpe h ILE 18 CO 0.00 0.05 0.00 0.00 0.00 0.00 0.00 178.15 178.20 3lpe n HIS 20 N 0.31 0.00 -2.25 0.00 8.25 -0.08 -4.97 115.22 116.48 3lpe n HIS 20 Ca 0.05 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.22 3lpe n HIS 20 Cb 0.21 -0.95 0.02 0.00 1.12 0.00 0.00 29.99 30.39 3lpe n HIS 20 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3lpe s SER 21 N -2.04 5.99 0.67 0.41 1.04 -1.26 -4.59 113.70 113.92 3lpe s SER 21 Ca 0.00 1.06 -0.17 0.00 0.48 0.00 0.00 55.95 57.32 3lpe s SER 21 Cb 0.00 -2.15 0.00 0.00 0.10 0.00 0.00 66.02 63.97 3lpe s SER 21 CO 0.00 -0.88 1.24 -2.84 0.98 0.00 0.00 173.24 171.75 3lpe s PRO 22 N -5.01 2.47 0.32 4.02 0.02 -1.26 -0.70 135.00 134.86 3lpe s PRO 22 Ca 0.53 1.90 0.08 0.00 0.02 0.00 0.00 61.00 63.53 3lpe s PRO 22 Cb -0.11 -1.86 -0.04 0.00 0.02 0.00 0.00 34.50 32.52 3lpe s PRO 22 CO 0.49 -1.62 0.18 0.95 -0.33 0.00 0.00 177.00 176.67 3lpe s THR 23 N -1.65 3.42 0.02 0.99 -4.23 -0.75 -1.53 115.64 111.90 3lpe s THR 23 Ca 0.79 -1.57 0.01 0.00 -1.18 0.00 0.00 61.69 59.73 3lpe s THR 23 Cb -0.33 -3.09 -0.01 0.00 1.34 0.00 0.00 72.50 70.41 3lpe s THR 23 CO 0.40 -0.22 -0.04 -0.55 -0.54 0.00 0.00 174.62 173.67 3lpe s SER 24 N -3.88 0.38 0.16 3.99 0.15 0.33 -4.85 113.70 110.00 3lpe s SER 24 Ca 0.37 -0.35 0.25 0.00 0.70 0.00 0.00 55.95 56.93 3lpe s SER 24 Cb -0.05 0.04 0.92 0.00 -1.71 0.00 0.00 66.02 65.22 3lpe s SER 24 CO 0.24 -0.16 1.76 -0.62 1.20 0.00 0.00 173.24 175.66 3lpe n GLU 25 N 2.07 0.17 -2.87 5.44 1.02 -1.26 -0.23 120.64 124.98 3lpe n GLU 25 Ca -0.20 0.23 -0.44 0.00 -0.02 0.00 0.00 57.16 56.73 3lpe n GLU 25 Cb 0.56 -1.74 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 3lpe n GLU 25 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3lpe n ASN 26 N -2.05 5.34 -4.29 1.62 2.85 -1.26 -4.90 115.26 112.57 3lpe n ASN 26 Ca 0.05 -3.05 -0.15 0.00 -0.11 0.00 0.00 54.58 51.31 3lpe n ASN 26 Cb 0.34 -1.49 -0.10 0.00 1.24 0.00 0.00 39.78 39.77 3lpe n ASN 26 CO 0.00 0.00 0.00 -1.66 -2.11 0.00 0.00 177.26 173.49 3lpe s TRP 27 N 0.47 1.40 -0.05 1.20 1.48 -1.26 -1.24 118.94 120.94 3lpe s TRP 27 Ca 0.39 -0.84 -0.04 0.00 -1.06 0.00 0.00 56.10 54.56 3lpe s TRP 27 Cb -0.00 -0.76 0.02 0.00 -1.16 0.00 0.00 33.47 31.56 3lpe s TRP 27 CO -0.00 0.02 0.12 0.42 -4.06 0.00 0.00 176.95 173.44 3lpe s ILE 28 N -3.38 -0.01 0.00 0.66 -1.09 -0.05 -5.00 121.20 112.33 3lpe s ILE 28 Ca 0.22 0.04 0.00 0.00 -2.23 0.00 0.00 60.65 58.69 3lpe s ILE 28 Cb 0.04 -0.18 0.00 0.00 -1.58 0.00 0.00 42.46 40.74 3lpe s ILE 28 CO 0.04 0.02 0.00 0.61 -1.23 0.00 0.00 174.94 174.38 3lpe n GLY 29 N 3.31 -0.56 2.80 6.18 0.00 -1.26 0.02 105.19 115.68 3lpe n GLY 29 Ca -0.16 -1.58 -0.19 0.00 0.00 0.00 0.00 46.02 44.09 3lpe n GLY 29 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3lpe s LEU 30 N -2.03 0.94 -0.21 0.99 2.96 -1.26 -2.96 118.68 117.10 3lpe s LEU 30 Ca 0.00 -0.04 -0.00 0.00 -0.22 0.00 0.00 54.13 53.86 3lpe s LEU 30 Cb 0.00 -0.30 0.06 0.00 0.50 0.00 0.00 46.19 46.45 3lpe s LEU 30 CO 0.00 -0.13 -0.04 -0.22 -1.32 0.00 0.00 176.35 174.64 3lpe s LEU 31 N 1.36 2.10 -0.34 -0.68 2.96 0.40 -4.93 118.68 119.55 3lpe s LEU 31 Ca -0.05 -1.00 -0.13 0.00 -0.22 0.00 0.00 54.13 52.73 3lpe s LEU 31 Cb -0.13 -1.01 -0.02 0.00 0.50 0.00 0.00 46.19 45.53 3lpe s LEU 31 CO -0.02 -0.24 0.25 -0.63 -1.32 0.00 0.00 176.35 174.39 3lpe s ILE 32 N 1.53 5.27 -0.37 6.68 1.01 -1.26 -0.47 121.20 133.59 3lpe s ILE 32 Ca -0.03 -0.16 -0.14 0.00 0.00 0.00 0.00 60.65 60.31 3lpe s ILE 32 Cb -0.18 -3.72 -0.00 0.00 0.01 0.00 0.00 42.46 38.57 3lpe s ILE 32 CO -0.07 -0.01 0.29 -0.69 0.00 0.00 0.00 174.94 174.46 3lpe s VAL 33 N 1.76 5.25 -0.16 2.92 1.01 0.40 -4.93 120.40 126.65 3lpe s VAL 33 Ca 0.07 -0.36 -0.13 0.00 0.00 0.00 0.00 61.98 61.56 3lpe s VAL 33 Cb -0.17 -3.82 -0.23 0.00 0.00 0.00 0.00 36.38 32.16 3lpe s VAL 33 CO 0.11 -0.15 0.27 -0.38 0.00 0.00 0.00 175.10 174.94 3lpe n ILE 34 N 5.16 1.67 -3.73 2.22 5.41 -1.26 -1.59 119.36 127.23 3lpe n ILE 34 Ca -0.11 -0.38 -0.30 0.00 1.00 0.00 0.00 62.75 62.96 3lpe n ILE 34 Cb 0.49 -1.86 -0.14 0.00 -0.71 0.00 0.00 39.64 37.41 3lpe n ILE 34 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 3lpe s ASN 35 N -6.97 3.82 0.22 4.38 3.84 -1.26 -4.82 114.94 114.15 3lpe s ASN 35 Ca -0.26 -2.27 -0.08 0.00 0.21 0.00 0.00 52.86 50.46 3lpe s ASN 35 Cb 0.07 -1.00 0.21 0.00 -0.55 0.00 0.00 41.25 39.98 3lpe s ASN 35 CO 0.68 -0.32 1.89 -0.65 -2.79 0.00 0.00 177.10 175.91 3lpe h PRO 36 N 7.23 1.05 -0.69 0.43 0.11 -1.90 -0.18 132.00 138.06 3lpe h PRO 36 Ca -0.05 -0.06 0.03 0.00 0.11 0.00 0.00 66.00 66.03 3lpe h PRO 36 Cb 0.96 -0.24 -0.04 0.00 0.11 0.00 0.00 31.00 31.80 3lpe h PRO 36 CO 0.47 0.70 0.46 0.93 -0.21 0.00 0.00 178.00 180.35 3lpe h GLU 37 N 1.09 0.83 -0.01 1.05 3.07 -1.92 -3.00 114.58 115.68 3lpe h GLU 37 Ca 0.32 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.13 3lpe h GLU 37 Cb -0.07 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 27.65 3lpe h GLU 37 CO -0.09 0.55 -0.52 1.63 -1.40 0.00 0.00 179.01 179.18 3lpe n LYS 38 N -4.45 1.39 -2.97 2.33 5.02 -0.89 -4.91 118.16 113.68 3lpe n LYS 38 Ca 0.08 -0.63 -0.42 0.00 -2.02 0.00 0.00 58.31 55.32 3lpe n LYS 38 Cb 0.11 -1.35 -0.05 0.00 -0.02 0.00 0.00 35.03 33.72 3lpe n LYS 38 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3lpe s SER 39 N -2.30 6.55 0.24 4.39 0.15 -0.13 -4.92 113.70 117.67 3lpe s SER 39 Ca 0.13 0.35 -0.03 0.00 0.70 0.00 0.00 55.95 57.10 3lpe s SER 39 Cb 0.15 -2.39 0.26 0.00 -1.71 0.00 0.00 66.02 62.32 3lpe s SER 39 CO 0.55 -0.72 1.68 -0.08 1.20 0.00 0.00 173.24 175.88 3lpe h GLU 40 N 8.46 0.76 -0.42 5.44 4.81 -1.90 -2.63 114.58 129.10 3lpe h GLU 40 Ca -0.25 -0.26 -0.03 0.00 -0.13 0.00 0.00 59.36 58.69 3lpe h GLU 40 Cb 1.10 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.40 3lpe h GLU 40 CO 0.90 0.86 0.14 0.82 -0.73 0.00 0.00 179.01 181.01 3lpe h ILE 41 N 0.68 1.21 -0.67 2.32 2.04 -1.97 -1.17 117.51 119.95 3lpe h ILE 41 Ca 0.11 -0.68 0.09 0.00 1.00 0.00 0.00 64.86 65.38 3lpe h ILE 41 Cb 0.62 0.87 -0.07 0.00 -0.74 0.00 0.00 36.82 37.51 3lpe h ILE 41 CO 0.04 0.24 0.33 0.00 0.00 0.00 0.00 178.15 178.76 3lpe h ALA 42 N 0.99 0.91 -0.43 1.87 0.00 -1.84 -0.65 119.26 120.11 3lpe h ALA 42 Ca 0.14 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 3lpe h ALA 42 Cb 0.24 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3lpe h ALA 42 CO -0.01 -0.06 0.20 0.87 0.00 0.00 0.00 179.25 180.24 3lpe h LYS 43 N 0.57 0.63 -0.05 0.00 1.57 -1.08 0.16 116.57 118.37 3lpe h LYS 43 Ca 0.33 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.99 3lpe h LYS 43 Cb 0.33 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.53 3lpe h LYS 43 CO -0.26 0.55 -0.04 0.87 -0.57 0.00 0.00 179.45 180.01 3lpe h LYS 44 N 0.55 0.07 -0.01 3.15 1.79 -0.71 -1.83 116.57 119.58 3lpe h LYS 44 Ca 0.15 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 3lpe h LYS 44 Cb 0.14 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.78 3lpe h LYS 44 CO -0.02 0.12 -0.03 0.00 -1.08 0.00 0.00 179.45 178.44 3lpe n ALA 45 N -2.52 2.66 -1.90 3.86 0.00 -0.30 -4.91 120.51 117.40 3lpe n ALA 45 Ca -0.02 -0.36 -0.10 0.00 0.00 0.00 0.00 53.44 52.96 3lpe n ALA 45 Cb 0.15 -1.28 -0.02 0.00 0.00 0.00 0.00 19.45 18.30 3lpe n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3lpe n GLY 46 N 1.15 0.34 3.63 0.00 0.00 -0.35 -5.02 105.19 104.95 3lpe n GLY 46 Ca 0.19 -0.50 -0.36 0.00 0.00 0.00 0.00 46.02 45.35 3lpe n GLY 46 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lpe s ILE 47 N -2.46 5.07 0.00 -0.61 1.01 0.42 -4.96 121.20 119.67 3lpe s ILE 47 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.73 3lpe s ILE 47 Cb 0.00 -3.35 0.00 0.00 0.01 0.00 0.00 42.46 39.12 3lpe s ILE 47 CO 0.00 0.38 0.84 -0.90 0.00 0.00 0.00 174.94 175.25 3lpe n ASP 48 N 4.15 1.45 -4.01 3.58 5.75 -1.26 -4.21 116.55 122.01 3lpe n ASP 48 Ca -0.16 -1.69 -0.19 0.00 -0.01 0.00 0.00 54.79 52.74 3lpe n ASP 48 Cb 0.52 0.00 -0.15 0.00 -1.03 0.00 0.00 41.12 40.46 3lpe n ASP 48 CO 0.00 0.00 0.00 -0.51 -0.11 0.00 0.00 177.20 176.58 3lpe s ILE 49 N -0.69 0.69 0.59 2.12 2.07 -1.26 -4.86 121.20 119.85 3lpe s ILE 49 Ca 0.00 -0.35 -0.20 0.00 -1.41 0.00 0.00 60.65 58.69 3lpe s ILE 49 Cb 0.00 -0.59 -0.03 0.00 0.13 0.00 0.00 42.46 41.96 3lpe s ILE 49 CO 0.00 0.20 1.28 -1.59 -1.91 0.00 0.00 174.94 172.92 3lpe s LYS 50 N -0.06 2.94 0.00 3.50 -2.85 -1.26 -4.92 119.74 117.08 3lpe s LYS 50 Ca 0.01 2.02 0.00 0.00 -1.00 0.00 0.00 55.97 57.00 3lpe s LYS 50 Cb -0.05 -2.03 0.00 0.00 -2.06 0.00 0.00 37.83 33.69 3lpe s LYS 50 CO -0.00 -1.29 0.00 0.41 0.10 0.00 0.00 175.35 174.57 3lpe n GLY 51 N 0.70 -1.05 3.53 0.59 0.00 -0.62 -5.01 105.19 103.33 3lpe n GLY 51 Ca 0.13 -1.44 -0.33 0.00 0.00 0.00 0.00 46.02 44.37 3lpe n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3lpe s LYS 52 N -1.92 2.68 0.05 1.61 1.02 -1.26 -0.46 119.74 121.46 3lpe s LYS 52 Ca 0.00 -0.62 0.05 0.00 0.02 0.00 0.00 55.97 55.42 3lpe s LYS 52 Cb 0.00 -2.50 -0.02 0.00 -0.52 0.00 0.00 37.83 34.78 3lpe s LYS 52 CO 0.00 0.62 -0.13 0.71 -0.92 0.00 0.00 175.35 175.63 3lpe s TYR 53 N -0.71 1.14 0.71 3.18 2.02 0.38 -0.47 117.35 123.60 3lpe s TYR 53 Ca 0.11 -0.41 -0.11 0.00 -0.37 0.00 0.00 57.07 56.29 3lpe s TYR 53 Cb -0.11 -0.66 0.02 0.00 -0.40 0.00 0.00 41.96 40.81 3lpe s TYR 53 CO 0.01 0.03 1.07 0.00 -1.57 0.00 0.00 175.55 175.10 3lpe s ALA 54 N -1.08 2.70 -0.06 3.71 0.00 -0.16 -0.45 121.76 126.42 3lpe s ALA 54 Ca -0.01 -0.15 0.10 0.00 0.00 0.00 0.00 51.96 51.90 3lpe s ALA 54 Cb -0.09 -3.10 -0.24 0.00 0.00 0.00 0.00 23.12 19.70 3lpe s ALA 54 CO 0.02 -1.24 0.59 1.28 0.00 0.00 0.00 175.76 176.41 3lpe n LEU 55 N -3.11 1.13 -3.88 0.00 4.77 0.10 -4.74 117.00 111.28 3lpe n LEU 55 Ca 0.07 0.37 -0.10 0.00 -0.03 0.00 0.00 56.01 56.32 3lpe n LEU 55 Cb 0.55 -0.02 -0.09 0.00 -2.33 0.00 0.00 43.42 41.53 3lpe n LEU 55 CO 0.57 0.47 -0.15 -0.94 -1.33 0.00 0.00 177.39 176.01 3lpe s SER 56 N -6.22 0.10 -0.03 -1.43 1.04 -0.39 -5.00 113.70 101.76 3lpe s SER 56 Ca -0.08 -0.45 -0.07 0.00 0.48 0.00 0.00 55.95 55.83 3lpe s SER 56 Cb 0.08 0.27 0.01 0.00 0.10 0.00 0.00 66.02 66.47 3lpe s SER 56 CO 0.82 -0.55 0.17 -0.69 0.98 0.00 0.00 173.24 173.97 3lpe s VAL 57 N -2.66 0.04 0.06 5.02 1.01 -1.26 -0.88 120.40 121.74 3lpe s VAL 57 Ca -0.04 -0.34 -0.03 0.00 0.00 0.00 0.00 61.98 61.57 3lpe s VAL 57 Cb -0.01 -0.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.98 3lpe s VAL 57 CO -0.05 -0.19 0.02 -0.54 0.00 0.00 0.00 175.10 174.35 3lpe s LYS 58 N -0.65 0.67 0.00 2.72 1.02 -0.37 -5.01 119.74 118.11 3lpe s LYS 58 Ca -0.07 -1.18 0.09 0.00 0.02 0.00 0.00 55.97 54.82 3lpe s LYS 58 Cb -0.04 0.24 0.51 0.00 -0.52 0.00 0.00 37.83 38.01 3lpe s LYS 58 CO 0.01 -0.15 0.96 0.39 -0.92 0.00 0.00 175.35 175.64