#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ps2 n ALA 2 N 0.00 4.13 -2.49 -1.84 0.00 -1.26 -5.02 120.51 114.03 1ps2 n ALA 2 Ca 0.00 -4.67 -0.12 0.00 0.00 0.00 0.00 53.44 48.66 1ps2 n ALA 2 Cb 0.00 -1.80 -0.08 0.00 0.00 0.00 0.00 19.45 17.57 1ps2 n ALA 2 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ps2 s GLN 3 N -1.76 1.35 0.31 0.00 1.11 -1.26 -5.05 119.66 114.36 1ps2 s GLN 3 Ca 0.30 -1.55 -0.04 0.00 0.01 0.00 0.00 55.36 54.08 1ps2 s GLN 3 Cb -0.02 0.33 -0.00 0.00 -1.01 0.00 0.00 33.01 32.31 1ps2 s GLN 3 CO -0.07 -0.49 0.44 0.95 0.01 0.00 0.00 175.29 176.14 1ps2 s THR 4 N -4.04 0.00 0.04 -0.19 -4.23 -1.26 -5.15 115.64 100.81 1ps2 s THR 4 Ca 0.34 -1.60 -0.18 0.00 -1.18 0.00 0.00 61.69 59.07 1ps2 s THR 4 Cb 0.04 -2.55 -0.06 0.00 1.34 0.00 0.00 72.50 71.27 1ps2 s THR 4 CO 0.12 0.00 0.52 -1.61 -0.54 0.00 0.00 174.62 173.11 1ps2 s GLU 5 N -3.32 4.13 0.05 3.99 2.02 -1.26 -4.24 118.70 120.06 1ps2 s GLU 5 Ca 0.30 0.63 0.00 0.00 0.02 0.00 0.00 54.97 55.93 1ps2 s GLU 5 Cb 0.00 -3.25 -0.03 0.00 0.10 0.00 0.00 34.13 30.95 1ps2 s GLU 5 CO 0.18 0.62 -0.04 0.99 0.02 0.00 0.00 175.26 177.03 1ps2 s THR 6 N -0.99 0.32 -0.25 3.63 2.01 -1.25 -4.98 115.64 114.12 1ps2 s THR 6 Ca 0.27 -1.44 0.11 0.00 0.31 0.00 0.00 61.69 60.94 1ps2 s THR 6 Cb -0.18 -1.01 0.47 0.00 0.01 0.00 0.00 72.50 71.79 1ps2 s THR 6 CO 0.17 -0.73 1.38 0.00 -0.69 0.00 0.00 174.62 174.76 1ps2 s THR 8 N -3.18 5.20 0.20 0.00 -1.32 -1.26 -4.85 115.64 110.42 1ps2 s THR 8 Ca 0.42 0.60 -0.08 0.00 -1.21 0.00 0.00 61.69 61.42 1ps2 s THR 8 Cb 0.38 -3.70 -0.01 0.00 -1.51 0.00 0.00 72.50 67.66 1ps2 s THR 8 CO -0.01 0.21 0.31 -0.69 -2.21 0.00 0.00 174.62 172.23 1ps2 s VAL 9 N 1.65 0.03 -0.08 5.08 1.01 -1.26 -4.70 120.40 122.14 1ps2 s VAL 9 Ca 0.16 -1.53 -0.30 0.00 0.00 0.00 0.00 61.98 60.31 1ps2 s VAL 9 Cb -0.15 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1ps2 s VAL 9 CO 0.08 -0.15 1.15 0.00 0.00 0.00 0.00 175.10 176.19 1ps2 s ALA 10 N -4.02 3.48 0.23 5.51 0.00 -1.26 -4.92 121.76 120.78 1ps2 s ALA 10 Ca 0.23 0.54 -0.07 0.00 0.00 0.00 0.00 51.96 52.66 1ps2 s ALA 10 Cb 0.03 -3.50 0.37 0.00 0.00 0.00 0.00 23.12 20.02 1ps2 s ALA 10 CO 0.05 -0.74 1.32 -2.30 0.00 0.00 0.00 175.76 174.08 1ps2 n PRO 11 N 5.23 -0.09 -0.02 0.00 -0.02 -1.26 -0.03 135.00 138.81 1ps2 n PRO 11 Ca 0.11 1.31 -0.13 0.00 -2.02 0.00 0.00 63.50 62.77 1ps2 n PRO 11 Cb 0.47 -1.96 -0.09 0.00 -0.02 0.00 0.00 33.50 31.89 1ps2 n PRO 11 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ps2 h ARG 12 N 0.00 0.08 -1.87 -0.52 3.08 -2.05 -3.04 114.38 110.05 1ps2 h ARG 12 Ca 0.40 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 60.30 1ps2 h ARG 12 Cb 0.61 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.62 1ps2 h ARG 12 CO -0.87 0.57 0.10 0.39 -1.07 0.00 0.00 179.97 179.10 1ps2 n GLU 13 N -4.77 1.25 -3.44 0.04 1.02 0.96 -4.88 120.64 110.82 1ps2 n GLU 13 Ca -0.08 -0.46 -0.38 0.00 -0.02 0.00 0.00 57.16 56.22 1ps2 n GLU 13 Cb 0.29 -1.20 -0.06 0.00 -0.02 0.00 0.00 31.44 30.45 1ps2 n GLU 13 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1ps2 s ARG 14 N -0.47 4.00 -0.50 3.49 0.52 -0.17 -4.37 118.95 121.46 1ps2 s ARG 14 Ca 0.10 0.48 -0.25 0.00 -0.52 0.00 0.00 55.73 55.55 1ps2 s ARG 14 Cb 0.08 -3.24 0.03 0.00 0.52 0.00 0.00 34.95 32.34 1ps2 s ARG 14 CO -0.00 0.65 0.93 -1.14 0.02 0.00 0.00 175.30 175.76 1ps2 s GLN 15 N -0.97 3.46 -0.01 3.54 2.00 -1.26 -4.99 119.66 121.42 1ps2 s GLN 15 Ca 0.25 0.01 -0.30 0.00 -2.00 0.00 0.00 55.36 53.32 1ps2 s GLN 15 Cb -0.17 -3.97 -0.07 0.00 0.80 0.00 0.00 33.01 29.60 1ps2 s GLN 15 CO 0.14 -1.32 1.75 1.21 -0.50 0.00 0.00 175.29 176.57 1ps2 s ASN 16 N 2.47 6.59 0.07 6.67 2.47 -1.26 -2.55 114.94 129.40 1ps2 s ASN 16 Ca 0.35 2.40 0.22 0.00 0.42 0.00 0.00 52.86 56.25 1ps2 s ASN 16 Cb -0.11 -2.54 -0.18 0.00 -1.45 0.00 0.00 41.25 36.98 1ps2 s ASN 16 CO 0.24 -0.96 0.74 0.00 -3.72 0.00 0.00 177.10 173.40 1ps2 n GLY 18 N 1.24 -1.50 3.61 0.00 0.00 -1.19 -4.96 105.19 102.38 1ps2 n GLY 18 Ca -0.02 -1.07 -0.29 0.00 0.00 0.00 0.00 46.02 44.64 1ps2 n GLY 18 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ps2 s PHE 19 N -2.10 1.80 0.09 1.61 -0.71 -1.26 -4.68 117.98 112.74 1ps2 s PHE 19 Ca 0.00 1.17 0.08 0.00 -1.04 0.00 0.00 56.93 57.13 1ps2 s PHE 19 Cb 0.00 -3.18 -0.22 0.00 -1.21 0.00 0.00 43.02 38.41 1ps2 s PHE 19 CO 0.00 -3.20 1.17 -1.00 -1.34 0.00 0.00 175.22 170.85 1ps2 h PRO 20 N -2.13 0.01 0.00 1.99 0.13 -1.95 -3.26 132.00 126.79 1ps2 h PRO 20 Ca -0.56 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.56 1ps2 h PRO 20 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 1ps2 h PRO 20 CO 0.53 0.92 0.09 0.41 -0.23 0.00 0.00 178.00 179.72 1ps2 n GLY 21 N 1.39 -0.59 3.62 1.56 0.00 -1.26 -4.67 105.19 105.25 1ps2 n GLY 21 Ca -0.03 0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1ps2 n GLY 21 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ps2 s VAL 22 N -3.13 2.12 0.19 1.61 -7.23 -1.23 -5.04 120.40 107.69 1ps2 s VAL 22 Ca -0.01 0.04 0.11 0.00 -1.81 0.00 0.00 61.98 60.31 1ps2 s VAL 22 Cb 0.02 -2.11 -0.04 0.00 0.56 0.00 0.00 36.38 34.82 1ps2 s VAL 22 CO 0.08 -0.05 -0.22 0.42 -0.31 0.00 0.00 175.10 175.01 1ps2 s THR 23 N -2.61 2.19 0.31 5.32 -4.23 -1.26 -4.95 115.64 110.40 1ps2 s THR 23 Ca 0.67 -2.01 0.20 0.00 -1.18 0.00 0.00 61.69 59.36 1ps2 s THR 23 Cb -0.23 -2.04 0.32 0.00 1.34 0.00 0.00 72.50 71.89 1ps2 s THR 23 CO 0.60 -0.19 1.25 -2.65 -0.54 0.00 0.00 174.62 173.09 1ps2 n PRO 24 N 0.24 -0.04 -0.03 3.99 -0.01 -1.26 0.11 135.00 138.00 1ps2 n PRO 24 Ca -0.12 1.06 -0.13 0.00 -0.01 0.00 0.00 63.50 64.30 1ps2 n PRO 24 Cb 0.56 -1.96 -0.09 0.00 -0.01 0.00 0.00 33.50 32.01 1ps2 n PRO 24 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 175.50 176.15 1ps2 h SER 25 N 0.00 0.19 -0.32 2.55 4.64 -1.96 -0.16 113.55 118.49 1ps2 h SER 25 Ca 0.68 -0.49 -0.01 0.00 -0.47 0.00 0.00 61.79 61.50 1ps2 h SER 25 Cb 1.93 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.95 1ps2 h SER 25 CO -0.53 0.65 0.14 1.56 -0.87 0.00 0.00 176.83 177.78 1ps2 h GLN 26 N -0.25 0.47 0.00 4.77 4.20 0.43 0.24 115.11 124.97 1ps2 h GLN 26 Ca 0.01 -0.08 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 1ps2 h GLN 26 Cb 0.59 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.29 1ps2 h GLN 26 CO 0.02 0.45 -0.16 0.00 -0.67 0.00 0.00 178.83 178.48 1ps2 n ALA 28 N -2.36 3.28 0.09 0.00 0.00 -0.07 -1.59 120.51 119.86 1ps2 n ALA 28 Ca -0.02 -0.32 -0.20 0.00 0.00 0.00 0.00 53.44 52.90 1ps2 n ALA 28 Cb 0.25 -1.18 -0.12 0.00 0.00 0.00 0.00 19.45 18.41 1ps2 n ALA 28 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1ps2 h ASN 29 N 0.23 0.75 0.18 0.00 -0.73 0.11 -3.34 115.58 112.79 1ps2 h ASN 29 Ca 0.00 -0.70 -0.31 0.00 1.87 0.00 0.00 56.30 57.16 1ps2 h ASN 29 Cb 0.49 -0.24 0.02 0.00 0.27 0.00 0.00 38.32 38.86 1ps2 h ASN 29 CO 0.00 1.51 -1.50 0.11 -0.37 0.00 0.00 177.43 177.18 1ps2 h LYS 30 N 0.23 0.38 0.00 6.67 1.79 -1.64 -3.49 116.57 120.52 1ps2 h LYS 30 Ca -0.17 -0.66 0.00 0.00 -2.18 0.00 0.00 60.65 57.65 1ps2 h LYS 30 Cb 1.88 0.24 0.00 0.00 -1.58 0.00 0.00 32.23 32.78 1ps2 h LYS 30 CO 0.22 1.31 0.00 0.41 -1.08 0.00 0.00 179.45 180.32 1ps2 n GLY 31 N 1.78 1.16 3.57 3.86 0.00 -1.14 -5.14 105.19 109.28 1ps2 n GLY 31 Ca -0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 1ps2 n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ps2 s PHE 34 N 2.45 3.58 -0.27 0.00 5.36 -1.26 -1.33 117.98 126.51 1ps2 s PHE 34 Ca 0.66 0.50 -0.04 0.00 -0.96 0.00 0.00 56.93 57.09 1ps2 s PHE 34 Cb -0.33 -1.93 0.15 0.00 -0.34 0.00 0.00 43.02 40.57 1ps2 s PHE 34 CO 0.28 0.67 0.54 0.34 -1.46 0.00 0.00 175.22 175.59 1ps2 s ASP 35 N -1.49 -0.82 -0.77 6.13 2.15 -0.00 -4.97 116.67 116.89 1ps2 s ASP 35 Ca 0.22 0.93 0.02 0.00 0.43 0.00 0.00 52.55 54.16 1ps2 s ASP 35 Cb -0.13 1.86 0.33 0.00 -0.30 0.00 0.00 42.92 44.68 1ps2 s ASP 35 CO 0.12 -0.25 1.32 -0.90 -0.17 0.00 0.00 175.17 175.28 1ps2 n ASP 36 N 5.42 5.69 -0.11 -0.34 5.75 -1.26 -4.12 116.55 127.58 1ps2 n ASP 36 Ca -0.05 -3.68 -0.16 0.00 -0.01 0.00 0.00 54.79 50.88 1ps2 n ASP 36 Cb 0.50 -0.82 -0.05 0.00 -1.03 0.00 0.00 41.12 39.72 1ps2 n ASP 36 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1ps2 n THR 37 N -0.14 1.51 -3.62 2.12 -2.24 -1.26 -5.00 114.28 105.65 1ps2 n THR 37 Ca 0.38 -0.03 -0.21 0.00 -2.27 0.00 0.00 64.05 61.91 1ps2 n THR 37 Cb 0.34 -2.19 -0.01 0.00 -2.10 0.00 0.00 70.33 66.36 1ps2 n THR 37 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1ps2 s VAL 38 N -2.77 4.78 0.48 2.28 1.01 -1.26 -5.12 120.40 119.80 1ps2 s VAL 38 Ca -0.32 -0.84 0.08 0.00 0.00 0.00 0.00 61.98 60.90 1ps2 s VAL 38 Cb 0.08 -3.70 0.02 0.00 0.00 0.00 0.00 36.38 32.78 1ps2 s VAL 38 CO 0.45 -0.33 0.50 -0.13 0.00 0.00 0.00 175.10 175.59 1ps2 s ARG 39 N -4.16 2.47 0.00 2.72 3.00 -1.26 -4.53 118.95 117.20 1ps2 s ARG 39 Ca 0.40 -1.61 0.00 0.00 0.00 0.00 0.00 55.73 54.51 1ps2 s ARG 39 Cb -0.09 -2.44 0.00 0.00 0.00 0.00 0.00 34.95 32.42 1ps2 s ARG 39 CO 0.32 -0.43 0.00 0.41 0.00 0.00 0.00 175.30 175.59 1ps2 n GLY 40 N -1.79 1.30 3.88 -3.53 0.00 -1.26 -4.94 105.19 98.87 1ps2 n GLY 40 Ca 0.06 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1ps2 n GLY 40 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ps2 s VAL 41 N -0.01 2.13 -0.11 1.61 -7.23 -1.26 -5.04 120.40 110.49 1ps2 s VAL 41 Ca 0.00 0.04 -0.23 0.00 -1.81 0.00 0.00 61.98 59.99 1ps2 s VAL 41 Cb 0.00 -3.01 -0.03 0.00 0.56 0.00 0.00 36.38 33.90 1ps2 s VAL 41 CO 0.00 -0.05 0.68 -2.16 -0.31 0.00 0.00 175.10 173.25 1ps2 s PRO 42 N -5.52 4.36 0.11 4.82 0.05 -1.26 -4.92 135.00 132.64 1ps2 s PRO 42 Ca 0.62 0.80 -0.10 0.00 0.05 0.00 0.00 61.00 62.36 1ps2 s PRO 42 Cb -0.11 -3.49 -0.14 0.00 0.05 0.00 0.00 34.50 30.81 1ps2 s PRO 42 CO 0.50 -0.04 1.29 -1.49 0.05 0.00 0.00 177.00 177.31 1ps2 h TRP 43 N 6.98 0.92 -3.54 0.56 6.55 -1.86 -3.41 115.95 122.14 1ps2 h TRP 43 Ca -0.38 -0.45 -0.64 0.00 0.95 0.00 0.00 58.89 58.38 1ps2 h TRP 43 Cb 1.18 -0.12 -0.14 0.00 -0.86 0.00 0.00 29.16 29.21 1ps2 h TRP 43 CO 0.67 1.27 0.29 0.00 -1.05 0.00 0.00 178.44 179.62 1ps2 n PHE 45 N 6.64 -0.33 -2.64 0.00 -1.74 -0.44 -0.70 117.46 118.25 1ps2 n PHE 45 Ca 0.00 -2.45 -0.23 0.00 -0.56 0.00 0.00 57.45 54.21 1ps2 n PHE 45 Cb 0.48 0.14 0.03 0.00 1.52 0.00 0.00 39.48 41.65 1ps2 n PHE 45 CO 0.00 0.00 0.00 0.71 -0.56 0.00 0.00 176.76 176.91 1ps2 s TYR 46 N -3.09 3.07 0.20 2.97 2.02 -1.06 -0.35 117.35 121.11 1ps2 s TYR 46 Ca 0.28 0.27 -0.10 0.00 -0.37 0.00 0.00 57.07 57.14 1ps2 s TYR 46 Cb 0.01 -2.67 -0.07 0.00 -0.40 0.00 0.00 41.96 38.83 1ps2 s TYR 46 CO 0.20 -0.77 0.53 -1.25 -1.57 0.00 0.00 175.55 172.68 1ps2 s PRO 47 N -4.81 3.82 -0.32 -1.71 0.04 -1.26 -4.68 135.00 126.08 1ps2 s PRO 47 Ca 0.54 0.29 0.02 0.00 0.04 0.00 0.00 61.00 61.89 1ps2 s PRO 47 Cb -0.10 -2.74 0.10 0.00 0.04 0.00 0.00 34.50 31.79 1ps2 s PRO 47 CO 0.41 0.37 0.05 -0.80 0.04 0.00 0.00 177.00 177.07 1ps2 s ASN 48 N -2.19 4.48 -0.56 6.66 -0.87 0.77 -4.98 114.94 118.25 1ps2 s ASN 48 Ca 0.44 -1.91 -0.26 0.00 -1.57 0.00 0.00 52.86 49.56 1ps2 s ASN 48 Cb -0.12 -1.38 -0.07 0.00 -0.02 0.00 0.00 41.25 39.66 1ps2 s ASN 48 CO 0.21 -0.37 2.31 0.42 -2.57 0.00 0.00 177.10 177.10 1ps2 s THR 49 N 1.15 3.07 0.12 1.60 -4.23 -1.26 -3.96 115.64 112.13 1ps2 s THR 49 Ca 0.09 0.02 0.05 0.00 -1.18 0.00 0.00 61.69 60.66 1ps2 s THR 49 Cb -0.19 -3.19 -0.04 0.00 1.34 0.00 0.00 72.50 70.43 1ps2 s THR 49 CO -0.13 -0.18 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.03 1ps2 s ILE 50 N 12.06 1.13 0.10 2.99 1.01 -1.26 -4.97 121.20 132.26 1ps2 s ILE 50 Ca 0.91 -1.77 0.07 0.00 0.00 0.00 0.00 60.65 59.86 1ps2 s ILE 50 Cb -0.15 -1.53 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 1ps2 s ILE 50 CO 0.22 -0.56 -0.17 -0.62 0.00 0.00 0.00 174.94 173.81 1ps2 s ASP 51 N -2.62 2.18 0.05 3.58 -1.08 -1.26 -4.71 116.67 112.80 1ps2 s ASP 51 Ca 0.09 -0.71 0.05 0.00 -0.52 0.00 0.00 52.55 51.46 1ps2 s ASP 51 Cb -0.02 -0.10 -0.02 0.00 -1.46 0.00 0.00 42.92 41.32 1ps2 s ASP 51 CO 0.01 -0.04 -0.13 0.68 0.52 0.00 0.00 175.17 176.21 1ps2 s VAL 52 N -1.51 1.03 0.14 1.11 -7.23 -1.26 -5.06 120.40 107.62 1ps2 s VAL 52 Ca 0.05 -1.08 -0.28 0.00 -1.81 0.00 0.00 61.98 58.87 1ps2 s VAL 52 Cb -0.08 -0.96 -0.06 0.00 0.56 0.00 0.00 36.38 35.83 1ps2 s VAL 52 CO 0.04 -0.11 1.39 -2.65 -0.31 0.00 0.00 175.10 173.46 1ps2 n PRO 53 N 1.69 -0.39 -0.92 4.82 -0.01 -1.26 -4.66 135.00 134.26 1ps2 n PRO 53 Ca -0.19 1.36 -0.32 0.00 -0.01 0.00 0.00 63.50 64.34 1ps2 n PRO 53 Cb 0.55 -2.01 0.03 0.00 -0.01 0.00 0.00 33.50 32.06 1ps2 n PRO 53 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 175.50 173.19 1ps2 n PRO 54 N -5.10 0.00 -4.52 0.52 -0.01 -1.26 -4.98 135.00 119.65 1ps2 n PRO 54 Ca 0.02 0.00 -0.31 0.00 -0.01 0.00 0.00 63.50 63.20 1ps2 n PRO 54 Cb 0.23 -0.87 -0.12 0.00 -0.01 0.00 0.00 33.50 32.74 1ps2 n PRO 54 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 175.50 174.28 1ps2 s GLU 55 N -1.50 2.20 -0.27 -0.52 0.41 -1.26 -5.11 118.70 112.66 1ps2 s GLU 55 Ca 0.39 -0.93 -0.07 0.00 -0.41 0.00 0.00 54.97 53.95 1ps2 s GLU 55 Cb -0.23 -2.29 -0.01 0.00 -1.78 0.00 0.00 34.13 29.82 1ps2 s GLU 55 CO 0.68 0.55 0.07 -1.21 -0.49 0.00 0.00 175.26 174.86 1ps2 s GLU 56 N -1.59 3.44 0.03 1.61 2.02 -1.26 -5.08 118.70 117.87 1ps2 s GLU 56 Ca 0.17 -0.62 0.01 0.00 0.02 0.00 0.00 54.97 54.54 1ps2 s GLU 56 Cb -0.11 -3.34 -0.02 0.00 0.10 0.00 0.00 34.13 30.76 1ps2 s GLU 56 CO 0.07 -0.29 -0.05 -2.00 0.02 0.00 0.00 175.26 173.02 1ps2 s GLU 57 N 1.57 0.42 0.06 1.61 2.12 -1.26 -5.13 118.70 118.09 1ps2 s GLU 57 Ca 0.05 -0.73 -0.30 0.00 0.36 0.00 0.00 54.97 54.35 1ps2 s GLU 57 Cb -0.16 -0.01 -0.05 0.00 0.26 0.00 0.00 34.13 34.17 1ps2 s GLU 57 CO 0.03 -0.02 1.12 -1.54 -0.54 0.00 0.00 175.26 174.31 1ps2 s SER 58 N -1.68 7.19 0.03 -1.70 1.04 -1.26 -5.03 113.70 112.29 1ps2 s SER 58 Ca -0.11 1.92 -0.04 0.00 0.48 0.00 0.00 55.95 58.20 1ps2 s SER 58 Cb -0.08 -2.58 -0.01 0.00 0.10 0.00 0.00 66.02 63.45 1ps2 s SER 58 CO -0.01 -0.38 0.07 -1.83 0.98 0.00 0.00 173.24 172.07 1ps2 s GLU 59 N 0.85 0.53 0.00 4.02 -1.05 -1.26 -5.34 118.70 116.45 1ps2 s GLU 59 Ca 0.56 -0.72 0.00 0.00 -0.15 0.00 0.00 54.97 54.65 1ps2 s GLU 59 Cb -0.27 0.20 0.00 0.00 -0.44 0.00 0.00 34.13 33.62 1ps2 s GLU 59 CO 0.30 -0.12 0.00 0.34 0.95 0.00 0.00 175.26 176.72