#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 2.63 -2.67 0.62 0.00 -1.26 -4.72 120.51 115.11 1ps2 n ALA 2 Ca 0.00 -0.14 -0.41 0.00 0.00 0.00 0.00 53.44 52.88 1ps2 n ALA 2 Cb 0.00 -1.02 -0.11 0.00 0.00 0.00 0.00 19.45 18.33 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 -0.81 3.01 0.65 0.00 1.11 -1.26 -5.01 119.66 117.34 1ps2 s GLN 3 Ca 0.04 -0.97 0.01 0.00 0.01 0.00 0.00 55.36 54.44 1ps2 s GLN 3 Cb 0.03 -3.81 0.09 0.00 -1.01 0.00 0.00 33.01 28.31 1ps2 s GLN 3 CO 0.01 -0.66 0.90 0.95 0.01 0.00 0.00 175.29 176.50 1ps2 s THR 4 N 1.62 2.33 0.36 -0.19 -4.23 -1.26 -4.98 115.64 109.29 1ps2 s THR 4 Ca 0.04 -0.64 -0.25 0.00 -1.18 0.00 0.00 61.69 59.65 1ps2 s THR 4 Cb -0.19 -2.69 -0.10 0.00 1.34 0.00 0.00 72.50 70.87 1ps2 s THR 4 CO 0.08 0.00 1.00 -1.61 -0.54 0.00 0.00 174.62 173.55 1ps2 s GLU 5 N -4.97 4.40 -0.07 3.99 2.02 -1.26 -4.04 118.70 118.78 1ps2 s GLU 5 Ca 0.63 1.42 -0.03 0.00 0.02 0.00 0.00 54.97 57.01 1ps2 s GLU 5 Cb -0.07 -2.69 0.04 0.00 0.10 0.00 0.00 34.13 31.51 1ps2 s GLU 5 CO 0.42 0.09 0.14 0.99 0.02 0.00 0.00 175.26 176.92 1ps2 s THR 6 N -1.63 -0.15 -0.03 3.63 2.01 -1.23 -4.94 115.64 113.30 1ps2 s THR 6 Ca 0.53 0.27 0.16 0.00 0.31 0.00 0.00 61.69 62.96 1ps2 s THR 6 Cb -0.20 -0.25 -0.24 0.00 0.01 0.00 0.00 72.50 71.81 1ps2 s THR 6 CO 0.26 0.11 0.33 0.00 -0.69 0.00 0.00 174.62 174.63 1ps2 s THR 8 N -3.05 3.48 0.30 0.00 -1.32 -1.26 -4.91 115.64 108.87 1ps2 s THR 8 Ca -0.06 0.40 0.02 0.00 -1.21 0.00 0.00 61.69 60.85 1ps2 s THR 8 Cb 0.10 -3.89 -0.05 0.00 -1.51 0.00 0.00 72.50 67.14 1ps2 s THR 8 CO 0.65 -0.73 0.09 -0.69 -2.21 0.00 0.00 174.62 171.72 1ps2 s VAL 9 N 7.77 0.81 0.08 5.08 1.01 -1.26 -5.07 120.40 128.81 1ps2 s VAL 9 Ca 0.70 -2.00 -0.31 0.00 0.00 0.00 0.00 61.98 60.37 1ps2 s VAL 9 Cb -0.16 -2.68 -0.08 0.00 0.00 0.00 0.00 36.38 33.46 1ps2 s VAL 9 CO 0.27 0.00 1.58 0.00 0.00 0.00 0.00 175.10 176.95 1ps2 s ALA 10 N -3.53 3.68 0.33 5.51 0.00 -1.26 -4.86 121.76 121.63 1ps2 s ALA 10 Ca 0.36 1.19 0.19 0.00 0.00 0.00 0.00 51.96 53.70 1ps2 s ALA 10 Cb 0.08 -3.65 1.20 0.00 0.00 0.00 0.00 23.12 20.74 1ps2 s ALA 10 CO 0.15 -0.97 1.40 -2.30 0.00 0.00 0.00 175.76 174.04 1ps2 n PRO 11 N 5.09 -0.05 0.04 0.00 -0.02 -1.26 0.11 135.00 138.91 1ps2 n PRO 11 Ca 0.15 1.22 -0.20 0.00 -2.02 0.00 0.00 63.50 62.65 1ps2 n PRO 11 Cb 0.41 -2.20 -0.12 0.00 -0.02 0.00 0.00 33.50 31.57 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 0.56 -1.91 -0.52 3.08 -2.05 -3.22 114.38 110.33 1ps2 h ARG 12 Ca 0.75 -0.66 -0.07 0.00 0.07 0.00 0.00 59.98 60.07 1ps2 h ARG 12 Cb 1.99 0.20 -0.03 0.00 0.08 0.00 0.00 29.97 32.21 1ps2 h ARG 12 CO -0.68 1.26 0.07 0.39 -1.07 0.00 0.00 179.97 179.93 1ps2 n GLU 13 N -3.98 1.21 -4.38 0.04 -0.58 0.30 -4.83 120.64 108.42 1ps2 n GLU 13 Ca -0.12 -0.36 -0.34 0.00 -0.42 0.00 0.00 57.16 55.93 1ps2 n GLU 13 Cb 0.83 -1.17 -0.11 0.00 -0.57 0.00 0.00 31.44 30.42 1ps2 n GLU 13 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1ps2 s ARG 14 N -0.31 3.44 -0.30 3.49 0.52 -1.08 -4.57 118.95 120.14 1ps2 s ARG 14 Ca 0.09 -0.48 -0.20 0.00 -0.52 0.00 0.00 55.73 54.63 1ps2 s ARG 14 Cb 0.06 -2.88 -0.01 0.00 0.52 0.00 0.00 34.95 32.64 1ps2 s ARG 14 CO -0.00 0.40 0.61 -0.65 0.02 0.00 0.00 175.30 175.68 1ps2 s GLN 15 N -0.07 3.92 -0.10 3.54 -1.52 -1.26 -5.00 119.66 119.17 1ps2 s GLN 15 Ca 0.03 0.29 -0.29 0.00 -1.95 0.00 0.00 55.36 53.44 1ps2 s GLN 15 Cb -0.13 -3.72 -0.07 0.00 -0.22 0.00 0.00 33.01 28.88 1ps2 s GLN 15 CO 0.02 -0.54 2.03 1.21 -0.25 0.00 0.00 175.29 177.76 1ps2 s ASN 16 N 1.62 6.03 0.11 5.90 2.47 -1.26 -2.52 114.94 127.30 1ps2 s ASN 16 Ca 0.24 2.23 0.22 0.00 0.42 0.00 0.00 52.86 55.97 1ps2 s ASN 16 Cb -0.15 -2.52 -0.12 0.00 -1.45 0.00 0.00 41.25 37.00 1ps2 s ASN 16 CO 0.11 -1.45 0.83 0.00 -3.72 0.00 0.00 177.10 172.88 1ps2 n GLY 18 N 1.22 0.75 3.75 0.00 0.00 -1.08 -4.93 105.19 104.90 1ps2 n GLY 18 Ca -0.02 -0.93 -0.37 0.00 0.00 0.00 0.00 46.02 44.70 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 -2.00 2.43 0.41 1.61 -0.71 -1.26 -4.46 117.98 113.99 1ps2 s PHE 19 Ca 0.00 1.49 0.17 0.00 -1.04 0.00 0.00 56.93 57.55 1ps2 s PHE 19 Cb 0.00 -3.54 1.00 0.00 -1.21 0.00 0.00 43.02 39.27 1ps2 s PHE 19 CO 0.00 -2.27 1.95 -1.00 -1.34 0.00 0.00 175.22 172.56 1ps2 h PRO 20 N 1.16 0.00 0.00 1.99 0.13 -1.94 -2.67 132.00 130.67 1ps2 h PRO 20 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1ps2 h PRO 20 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1ps2 h PRO 20 CO 0.56 0.24 0.19 0.78 -0.23 0.00 0.00 178.00 179.54 1ps2 h GLY 21 N 0.85 0.00 -0.95 1.56 0.00 -2.01 -3.42 103.07 99.10 1ps2 h GLY 21 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 47.33 46.93 1ps2 h GLY 21 CO 0.03 0.00 -0.04 -1.34 0.00 0.00 0.00 176.54 175.19 1ps2 s VAL 22 N -3.52 1.34 0.11 4.60 -7.23 -1.01 -5.06 120.40 109.64 1ps2 s VAL 22 Ca -0.02 0.00 0.04 0.00 -1.81 0.00 0.00 61.98 60.19 1ps2 s VAL 22 Cb 0.05 -2.20 -0.04 0.00 0.56 0.00 0.00 36.38 34.76 1ps2 s VAL 22 CO 0.17 0.00 -0.11 0.42 -0.31 0.00 0.00 175.10 175.28 1ps2 s THR 23 N -2.51 1.06 0.36 5.32 -4.23 -1.26 -4.99 115.64 109.40 1ps2 s THR 23 Ca 0.69 -1.76 0.30 0.00 -1.18 0.00 0.00 61.69 59.75 1ps2 s THR 23 Cb -0.12 -1.51 0.46 0.00 1.34 0.00 0.00 72.50 72.66 1ps2 s THR 23 CO 0.57 -0.58 1.14 -2.65 -0.54 0.00 0.00 174.62 172.56 1ps2 n PRO 24 N 0.36 -0.01 -0.03 3.99 -0.01 -1.26 0.11 135.00 138.15 1ps2 n PRO 24 Ca -0.14 0.85 -0.13 0.00 -0.01 0.00 0.00 63.50 64.07 1ps2 n PRO 24 Cb 0.58 -1.82 -0.11 0.00 -0.01 0.00 0.00 33.50 32.15 1ps2 n PRO 24 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 175.50 176.26 1ps2 h SER 25 N 0.00 0.00 -0.01 2.55 0.02 -1.96 -0.74 113.55 113.42 1ps2 h SER 25 Ca 0.67 -0.59 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1ps2 h SER 25 Cb 2.42 -0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.96 1ps2 h SER 25 CO -0.17 0.59 0.00 1.56 -1.14 0.00 0.00 176.83 177.67 1ps2 h GLN 26 N -0.59 0.01 0.00 3.45 1.08 0.37 0.43 115.11 119.87 1ps2 h GLN 26 Ca -0.00 -0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1ps2 h GLN 26 Cb 0.59 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.02 1ps2 h GLN 26 CO 0.00 0.18 -0.02 0.00 -0.95 0.00 0.00 178.83 178.03 1ps2 n ALA 28 N -2.14 4.11 0.01 0.00 0.00 -0.28 -0.80 120.51 121.41 1ps2 n ALA 28 Ca -0.02 -0.49 -0.09 0.00 0.00 0.00 0.00 53.44 52.84 1ps2 n ALA 28 Cb 0.15 -0.91 0.06 0.00 0.00 0.00 0.00 19.45 18.75 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 0.00 0.59 0.08 0.00 -0.00 0.15 -3.31 115.58 113.08 1ps2 h ASN 29 Ca 0.00 -0.32 -0.35 0.00 -0.00 0.00 0.00 56.30 55.63 1ps2 h ASN 29 Cb 0.55 -0.17 -0.03 0.00 -0.00 0.00 0.00 38.32 38.67 1ps2 h ASN 29 CO 0.00 1.03 -1.94 1.17 -0.00 0.00 0.00 177.43 177.69 1ps2 n LYS 30 N -3.95 0.70 0.00 6.67 4.81 -1.21 -5.01 118.16 120.17 1ps2 n LYS 30 Ca -0.03 0.31 0.00 0.00 -0.87 0.00 0.00 58.31 57.72 1ps2 n LYS 30 Cb 0.61 -1.68 0.00 0.00 0.02 0.00 0.00 35.03 33.98 1ps2 n LYS 30 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ps2 n GLY 31 N 1.87 1.06 3.75 3.14 0.00 -1.18 -5.14 105.19 108.68 1ps2 n GLY 31 Ca -0.35 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 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 1.82 3.25 -0.31 0.00 5.36 -1.26 -1.90 117.98 124.94 1ps2 s PHE 34 Ca 0.66 -0.99 0.03 0.00 -0.96 0.00 0.00 56.93 55.68 1ps2 s PHE 34 Cb -0.36 -2.53 0.09 0.00 -0.34 0.00 0.00 43.02 39.88 1ps2 s PHE 34 CO 0.29 -0.67 0.01 0.34 -1.46 0.00 0.00 175.22 173.73 1ps2 s ASP 35 N 1.65 4.61 -0.84 6.13 2.15 -0.23 -4.99 116.67 125.16 1ps2 s ASP 35 Ca 0.02 -1.90 0.01 0.00 0.43 0.00 0.00 52.55 51.12 1ps2 s ASP 35 Cb -0.20 -1.55 0.33 0.00 -0.30 0.00 0.00 42.92 41.20 1ps2 s ASP 35 CO 0.07 -0.33 1.48 -0.90 -0.17 0.00 0.00 175.17 175.32 1ps2 n ASP 36 N 4.34 6.22 -0.05 -0.34 5.75 -1.26 -4.27 116.55 126.94 1ps2 n ASP 36 Ca -0.02 -3.70 -0.08 0.00 -0.01 0.00 0.00 54.79 50.99 1ps2 n ASP 36 Cb 0.42 -0.92 -0.04 0.00 -1.03 0.00 0.00 41.12 39.55 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 -0.16 0.58 -3.68 2.12 -2.24 -1.26 -5.02 114.28 104.62 1ps2 n THR 37 Ca 0.41 -0.21 -0.27 0.00 -2.27 0.00 0.00 64.05 61.71 1ps2 n THR 37 Cb 0.32 -1.02 -0.03 0.00 -2.10 0.00 0.00 70.33 67.50 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 -2.20 5.20 0.34 2.28 1.01 -1.26 -5.11 120.40 120.65 1ps2 s VAL 38 Ca -0.14 -0.39 0.08 0.00 0.00 0.00 0.00 61.98 61.53 1ps2 s VAL 38 Cb 0.04 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.64 1ps2 s VAL 38 CO 0.22 -0.20 0.24 -0.13 0.00 0.00 0.00 175.10 175.23 1ps2 s ARG 39 N -3.41 2.61 0.00 2.72 3.00 -1.26 -4.48 118.95 118.13 1ps2 s ARG 39 Ca 0.38 -1.38 0.00 0.00 0.00 0.00 0.00 55.73 54.73 1ps2 s ARG 39 Cb -0.11 -2.37 0.00 0.00 0.00 0.00 0.00 34.95 32.47 1ps2 s ARG 39 CO 0.29 0.10 0.00 0.41 0.00 0.00 0.00 175.30 176.10 1ps2 n GLY 40 N -1.30 2.22 3.97 -3.53 0.00 -1.26 -4.96 105.19 100.33 1ps2 n GLY 40 Ca -0.02 -0.03 -0.23 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.30 2.46 0.11 1.61 -7.23 -1.26 -5.08 120.40 110.71 1ps2 s VAL 41 Ca 0.00 -0.57 -0.23 0.00 -1.81 0.00 0.00 61.98 59.37 1ps2 s VAL 41 Cb 0.00 -2.89 -0.07 0.00 0.56 0.00 0.00 36.38 33.98 1ps2 s VAL 41 CO 0.00 0.00 0.70 -2.16 -0.31 0.00 0.00 175.10 173.33 1ps2 s PRO 42 N -4.95 4.44 -0.15 4.82 0.05 -1.26 -4.99 135.00 132.96 1ps2 s PRO 42 Ca 0.60 1.00 -0.18 0.00 0.05 0.00 0.00 61.00 62.47 1ps2 s PRO 42 Cb -0.09 -3.28 -0.24 0.00 0.05 0.00 0.00 34.50 30.94 1ps2 s PRO 42 CO 0.41 0.53 0.43 -1.49 0.05 0.00 0.00 177.00 176.93 1ps2 h TRP 43 N 4.71 0.25 -3.57 0.56 6.55 -1.86 -3.44 115.95 119.14 1ps2 h TRP 43 Ca -0.47 -0.18 -0.63 0.00 0.95 0.00 0.00 58.89 58.55 1ps2 h TRP 43 Cb 1.21 -0.01 -0.13 0.00 -0.86 0.00 0.00 29.16 29.36 1ps2 h TRP 43 CO 0.65 1.51 0.32 0.00 -1.05 0.00 0.00 178.44 179.88 1ps2 n PHE 45 N 6.68 -0.49 -2.71 0.00 -1.74 -0.80 -0.90 117.46 117.49 1ps2 n PHE 45 Ca 0.01 -2.55 -0.24 0.00 -0.56 0.00 0.00 57.45 54.11 1ps2 n PHE 45 Cb 0.48 0.19 0.02 0.00 1.52 0.00 0.00 39.48 41.69 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 -3.18 3.19 0.70 2.97 2.02 -1.05 -0.86 117.35 121.15 1ps2 s TYR 46 Ca 0.32 0.36 -0.02 0.00 -0.37 0.00 0.00 57.07 57.36 1ps2 s TYR 46 Cb 0.02 -2.54 0.11 0.00 -0.40 0.00 0.00 41.96 39.15 1ps2 s TYR 46 CO 0.23 -0.61 0.97 -1.25 -1.57 0.00 0.00 175.55 173.32 1ps2 s PRO 47 N -4.75 1.83 -0.27 -1.71 0.04 -1.26 -4.68 135.00 124.19 1ps2 s PRO 47 Ca 0.52 -0.93 -0.00 0.00 0.04 0.00 0.00 61.00 60.62 1ps2 s PRO 47 Cb -0.10 -2.32 0.15 0.00 0.04 0.00 0.00 34.50 32.28 1ps2 s PRO 47 CO 0.41 -1.35 0.43 -0.80 0.04 0.00 0.00 177.00 175.73 1ps2 s ASN 48 N -4.67 0.02 -0.77 6.66 0.01 -0.33 -5.02 114.94 110.83 1ps2 s ASN 48 Ca 0.64 0.04 -0.25 0.00 -0.71 0.00 0.00 52.86 52.58 1ps2 s ASN 48 Cb -0.07 1.28 -0.07 0.00 0.41 0.00 0.00 41.25 42.80 1ps2 s ASN 48 CO 0.44 -0.32 2.12 0.42 -1.51 0.00 0.00 177.10 178.25 1ps2 s THR 49 N 2.60 3.25 0.09 1.60 -4.23 -1.26 -3.51 115.64 114.17 1ps2 s THR 49 Ca 0.12 -0.12 -0.01 0.00 -1.18 0.00 0.00 61.69 60.50 1ps2 s THR 49 Cb -0.14 -3.60 -0.04 0.00 1.34 0.00 0.00 72.50 70.07 1ps2 s THR 49 CO -0.23 -0.57 0.01 -0.63 -0.54 0.00 0.00 174.62 172.66 1ps2 s ILE 50 N 11.53 0.18 -0.18 2.99 1.01 -1.26 -4.99 121.20 130.48 1ps2 s ILE 50 Ca 0.79 -1.86 -0.08 0.00 0.00 0.00 0.00 60.65 59.50 1ps2 s ILE 50 Cb -0.11 -1.76 -0.04 0.00 0.01 0.00 0.00 42.46 40.56 1ps2 s ILE 50 CO 0.08 -0.75 0.10 -0.62 0.00 0.00 0.00 174.94 173.75 1ps2 s ASP 51 N -2.98 5.94 0.04 3.58 -1.08 -1.26 -4.68 116.67 116.23 1ps2 s ASP 51 Ca 0.15 0.18 -0.06 0.00 -0.52 0.00 0.00 52.55 52.29 1ps2 s ASP 51 Cb 0.08 -2.02 -0.01 0.00 -1.46 0.00 0.00 42.92 39.51 1ps2 s ASP 51 CO -0.05 0.20 0.12 0.68 0.52 0.00 0.00 175.17 176.64 1ps2 s VAL 52 N 0.25 0.13 0.94 1.11 -7.23 -1.26 -5.15 120.40 109.19 1ps2 s VAL 52 Ca 0.06 -1.09 -0.18 0.00 -1.81 0.00 0.00 61.98 58.96 1ps2 s VAL 52 Cb -0.12 -0.97 -0.15 0.00 0.56 0.00 0.00 36.38 35.70 1ps2 s VAL 52 CO -0.01 -0.60 -0.93 -2.65 -0.31 0.00 0.00 175.10 170.61 1ps2 n PRO 53 N 0.64 0.00 0.00 4.82 -0.01 -1.26 -5.00 135.00 134.18 1ps2 n PRO 53 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.31 1ps2 n PRO 53 Cb 0.59 -0.94 0.00 0.00 -0.01 0.00 0.00 33.50 33.14 1ps2 n PRO 53 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 175.50 175.14 1ps2 n PRO 54 N 2.36 0.00 -2.60 0.52 -0.04 -1.26 -4.89 135.00 129.08 1ps2 n PRO 54 Ca -0.02 0.17 -0.42 0.00 -0.04 0.00 0.00 63.50 63.18 1ps2 n PRO 54 Cb 0.57 -0.59 -0.03 0.00 -0.04 0.00 0.00 33.50 33.42 1ps2 n PRO 54 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1ps2 s GLU 55 N -0.71 4.46 -0.06 0.54 2.02 -1.26 -5.01 118.70 118.68 1ps2 s GLU 55 Ca 0.00 1.52 -0.24 0.00 0.02 0.00 0.00 54.97 56.28 1ps2 s GLU 55 Cb 0.00 -3.48 -0.04 0.00 0.10 0.00 0.00 34.13 30.71 1ps2 s GLU 55 CO 0.00 -0.24 0.72 -2.00 0.02 0.00 0.00 175.26 173.76 1ps2 s GLU 56 N 1.53 4.44 0.76 1.61 2.12 -1.26 -5.05 118.70 122.85 1ps2 s GLU 56 Ca 0.53 0.91 -0.11 0.00 0.36 0.00 0.00 54.97 56.66 1ps2 s GLU 56 Cb -0.22 -3.45 0.05 0.00 0.26 0.00 0.00 34.13 30.76 1ps2 s GLU 56 CO 0.24 0.05 1.09 -2.00 -0.54 0.00 0.00 175.26 174.11 1ps2 s GLU 57 N 0.83 2.41 0.08 4.30 2.12 -1.26 -5.08 118.70 122.09 1ps2 s GLU 57 Ca 0.38 0.59 -0.07 0.00 0.36 0.00 0.00 54.97 56.23 1ps2 s GLU 57 Cb -0.18 -1.96 -0.01 0.00 0.26 0.00 0.00 34.13 32.24 1ps2 s GLU 57 CO 0.19 -1.38 0.15 -1.12 -0.54 0.00 0.00 175.26 172.55 1ps2 s SER 58 N -4.06 0.18 0.01 -1.70 0.01 -1.26 -5.16 113.70 101.72 1ps2 s SER 58 Ca 0.60 -0.69 0.01 0.00 1.31 0.00 0.00 55.95 57.17 1ps2 s SER 58 Cb -0.13 0.31 -0.04 0.00 0.21 0.00 0.00 66.02 66.37 1ps2 s SER 58 CO 0.53 -0.69 0.06 -1.61 0.41 0.00 0.00 173.24 171.94 1ps2 s GLU 59 N -3.78 2.97 0.00 12.44 0.41 -1.26 -5.36 118.70 124.13 1ps2 s GLU 59 Ca 0.05 -0.55 0.25 0.00 -0.41 0.00 0.00 54.97 54.30 1ps2 s GLU 59 Cb 0.05 -2.79 0.39 0.00 -1.78 0.00 0.00 34.13 30.00 1ps2 s GLU 59 CO -0.10 0.63 1.37 1.19 -0.49 0.00 0.00 175.26 177.86