#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sqb s LEU 2 N 0.00 4.13 -0.14 -0.89 1.02 -1.26 -4.44 118.68 117.11 1sqb s LEU 2 Ca 0.00 -1.04 -0.31 0.00 0.02 0.00 0.00 54.13 52.80 1sqb s LEU 2 Cb 0.00 -2.46 0.13 0.00 0.02 0.00 0.00 46.19 43.88 1sqb s LEU 2 CO 0.00 -1.49 1.04 -0.55 0.02 0.00 0.00 176.35 175.37 1sqb s SER 3 N 3.79 -0.30 0.21 2.29 0.15 -1.26 -5.00 113.70 113.59 1sqb s SER 3 Ca 0.28 0.19 -0.03 0.00 0.70 0.00 0.00 55.95 57.09 1sqb s SER 3 Cb -0.12 0.27 0.18 0.00 -1.71 0.00 0.00 66.02 64.64 1sqb s SER 3 CO 0.07 -0.37 1.58 -0.37 1.20 0.00 0.00 173.24 175.35 1sqb h VAL 4 N 2.26 1.29 -0.06 4.45 -1.51 -1.94 -2.60 116.25 118.14 1sqb h VAL 4 Ca -0.17 -1.54 -0.18 0.00 -1.23 0.00 0.00 66.70 63.58 1sqb h VAL 4 Cb 1.19 1.49 0.01 0.00 -2.13 0.00 0.00 31.29 31.85 1sqb h VAL 4 CO 0.29 0.49 -0.67 0.00 -1.23 0.00 0.00 177.57 176.45 1sqb h ALA 5 N 1.05 0.16 0.00 5.19 0.00 -1.97 -1.68 119.26 122.01 1sqb h ALA 5 Ca 0.05 -0.57 -0.09 0.00 0.00 0.00 0.00 54.91 54.30 1sqb h ALA 5 Cb 0.90 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1sqb h ALA 5 CO 0.08 0.47 -0.43 0.00 0.00 0.00 0.00 179.25 179.37 1sqb h ALA 6 N 0.42 1.12 0.00 0.00 0.00 -1.88 -2.46 119.26 116.46 1sqb h ALA 6 Ca -0.07 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1sqb h ALA 6 Cb 1.34 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1sqb h ALA 6 CO 0.14 0.53 -0.81 0.54 0.00 0.00 0.00 179.25 179.65 1sqb n ARG 7 N -3.77 0.30 -3.14 0.00 5.12 -0.98 -4.98 116.66 109.21 1sqb n ARG 7 Ca -0.01 0.05 -0.01 0.00 -1.93 0.00 0.00 57.85 55.95 1sqb n ARG 7 Cb 0.49 -1.65 0.00 0.00 -1.16 0.00 0.00 32.46 30.14 1sqb n ARG 7 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1sqb n SER 8 N -2.07 -6.73 0.00 0.55 2.88 -0.63 -4.96 113.62 102.66 1sqb n SER 8 Ca 0.03 0.52 0.00 0.00 -1.33 0.00 0.00 58.87 58.09 1sqb n SER 8 Cb 0.44 -2.08 0.00 0.00 -0.75 0.00 0.00 64.21 61.82 1sqb n SER 8 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1sqb n GLY 9 N 1.17 -2.15 3.76 0.46 0.00 -1.23 -4.25 105.19 102.96 1sqb n GLY 9 Ca -0.00 0.67 -0.32 0.00 0.00 0.00 0.00 46.02 46.37 1sqb n GLY 9 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1sqb s PRO 10 N -0.22 2.39 0.34 1.61 0.05 -1.26 -2.48 135.00 135.42 1sqb s PRO 10 Ca 0.00 1.30 -0.26 0.00 0.05 0.00 0.00 61.00 62.09 1sqb s PRO 10 Cb 0.00 -1.91 -0.09 0.00 0.05 0.00 0.00 34.50 32.55 1sqb s PRO 10 CO 0.00 -1.56 1.00 -0.06 0.05 0.00 0.00 177.00 176.43 1sqb s PHE 11 N -2.64 3.54 -0.31 0.56 0.40 -1.26 -3.35 117.98 114.92 1sqb s PHE 11 Ca 0.64 1.73 -0.02 0.00 -0.60 0.00 0.00 56.93 58.68 1sqb s PHE 11 Cb -0.19 -3.04 0.10 0.00 0.51 0.00 0.00 43.02 40.40 1sqb s PHE 11 CO 0.50 -0.17 0.11 0.00 0.70 0.00 0.00 175.22 176.37 1sqb s ALA 12 N -1.56 1.21 0.37 5.36 0.00 -1.26 -4.79 121.76 121.08 1sqb s ALA 12 Ca 0.52 -1.48 -0.25 0.00 0.00 0.00 0.00 51.96 50.75 1sqb s ALA 12 Cb -0.22 -1.54 -0.09 0.00 0.00 0.00 0.00 23.12 21.27 1sqb s ALA 12 CO 0.27 -1.67 1.07 -1.25 0.00 0.00 0.00 175.76 174.18 1sqb s PRO 13 N 1.76 4.26 -0.10 0.00 0.04 -1.26 -1.71 135.00 138.00 1sqb s PRO 13 Ca 0.10 1.60 -0.02 0.00 0.04 0.00 0.00 61.00 62.72 1sqb s PRO 13 Cb -0.17 -2.70 0.04 0.00 0.04 0.00 0.00 34.50 31.71 1sqb s PRO 13 CO -0.29 -0.07 0.02 0.08 0.04 0.00 0.00 177.00 176.78 1sqb s VAL 14 N -1.53 0.35 0.15 -0.36 1.01 -0.50 -4.99 120.40 114.53 1sqb s VAL 14 Ca 0.55 0.00 0.05 0.00 0.00 0.00 0.00 61.98 62.58 1sqb s VAL 14 Cb -0.25 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 1sqb s VAL 14 CO 0.31 0.14 0.13 -0.22 0.00 0.00 0.00 175.10 175.47 1sqb s LEU 15 N 1.97 3.82 0.20 3.92 2.96 -1.26 -1.79 118.68 128.51 1sqb s LEU 15 Ca 0.04 -0.10 -0.13 0.00 -0.22 0.00 0.00 54.13 53.72 1sqb s LEU 15 Cb -0.13 -2.44 0.00 0.00 0.50 0.00 0.00 46.19 44.12 1sqb s LEU 15 CO -0.06 0.08 0.43 -0.94 -1.32 0.00 0.00 176.35 174.54 1sqb s SER 16 N -3.00 -0.10 0.07 3.68 1.04 -1.26 -5.05 113.70 109.08 1sqb s SER 16 Ca 0.31 -0.76 -0.23 0.00 0.48 0.00 0.00 55.95 55.75 1sqb s SER 16 Cb -0.10 0.53 -0.14 0.00 0.10 0.00 0.00 66.02 66.40 1sqb s SER 16 CO 0.23 -1.03 1.63 0.00 0.98 0.00 0.00 173.24 175.06 1sqb h ALA 17 N 2.34 0.06 0.00 5.32 0.00 -2.01 -3.40 119.26 121.56 1sqb h ALA 17 Ca -0.29 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 1sqb h ALA 17 Cb 1.25 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1sqb h ALA 17 CO 0.40 -0.38 -1.43 0.25 0.00 0.00 0.00 179.25 178.09 1sqb n THR 18 N -4.99 0.15 -4.11 0.00 -2.24 -1.26 -5.05 114.28 96.78 1sqb n THR 18 Ca -0.07 -0.23 -0.31 0.00 -2.27 0.00 0.00 64.05 61.17 1sqb n THR 18 Cb 0.09 0.01 -0.07 0.00 -2.10 0.00 0.00 70.33 68.26 1sqb n THR 18 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1sqb s SER 19 N -3.25 5.35 0.73 3.42 0.01 -1.26 -4.99 113.70 113.71 1sqb s SER 19 Ca -0.03 -0.04 -0.15 0.00 1.31 0.00 0.00 55.95 57.03 1sqb s SER 19 Cb 0.05 -1.40 0.04 0.00 0.21 0.00 0.00 66.02 64.92 1sqb s SER 19 CO 0.35 0.20 1.24 -0.13 0.41 0.00 0.00 173.24 175.31 1sqb s ARG 20 N -2.18 2.06 0.06 12.44 0.52 -1.26 -4.06 118.95 126.52 1sqb s ARG 20 Ca 0.26 1.89 -0.31 0.00 -0.52 0.00 0.00 55.73 57.06 1sqb s ARG 20 Cb -0.12 -1.81 -0.06 0.00 0.52 0.00 0.00 34.95 33.48 1sqb s ARG 20 CO 0.18 -1.93 1.26 0.20 0.02 0.00 0.00 175.30 175.03 1sqb s GLY 21 N -1.82 2.24 0.03 -3.53 0.00 -1.26 -4.75 107.32 98.23 1sqb s GLY 21 Ca 0.77 0.90 0.04 0.00 0.00 0.00 0.00 44.72 46.43 1sqb s GLY 21 CO 0.46 2.16 -0.06 0.14 0.00 0.00 0.00 173.10 175.80 1sqb s VAL 22 N 1.28 3.68 -0.10 1.40 1.01 -0.74 -4.97 120.40 121.96 1sqb s VAL 22 Ca 0.60 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.72 1sqb s VAL 22 Cb -0.31 -2.64 0.02 0.00 0.00 0.00 0.00 36.38 33.45 1sqb s VAL 22 CO 0.29 0.31 -0.10 0.00 0.00 0.00 0.00 175.10 175.60 1sqb s ALA 23 N -1.08 1.34 0.15 5.51 0.00 -1.26 -1.41 121.76 125.02 1sqb s ALA 23 Ca 0.19 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.63 1sqb s ALA 23 Cb -0.11 -0.78 0.00 0.00 0.00 0.00 0.00 23.12 22.23 1sqb s ALA 23 CO 0.10 -0.19 0.00 0.41 0.00 0.00 0.00 175.76 176.08 1sqb n GLY 24 N 4.46 -3.08 0.00 0.00 0.00 -0.69 -4.87 105.19 101.00 1sqb n GLY 24 Ca -0.17 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.64 1sqb n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sqb n ALA 25 N -1.89 0.00 -1.77 4.61 0.00 -1.21 -4.66 120.51 115.59 1sqb n ALA 25 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.10 1sqb n ALA 25 Cb 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.55 1sqb n ALA 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1sqb s LEU 26 N 0.00 3.75 0.00 0.00 1.02 -1.03 -4.70 118.68 117.72 1sqb s LEU 26 Ca 0.00 1.84 0.00 0.00 0.02 0.00 0.00 54.13 55.99 1sqb s LEU 26 Cb 0.00 -4.55 0.00 0.00 0.02 0.00 0.00 46.19 41.66 1sqb s LEU 26 CO 0.00 -0.81 0.00 -2.11 0.02 0.00 0.00 176.35 173.45 1sqb n ARG 27 N -1.25 0.00 -2.58 1.70 0.00 -1.26 -3.94 116.66 109.33 1sqb n ARG 27 Ca 0.09 0.00 -0.34 0.00 -0.00 0.00 0.00 57.85 57.60 1sqb n ARG 27 Cb 0.53 0.00 -0.04 0.00 -0.00 0.00 0.00 32.46 32.95 1sqb n ARG 27 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1sqb s PRO 28 N -2.00 3.88 0.00 2.89 0.04 -1.26 -4.81 135.00 133.73 1sqb s PRO 28 Ca 0.00 1.34 0.00 0.00 0.04 0.00 0.00 61.00 62.38 1sqb s PRO 28 Cb 0.00 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.40 1sqb s PRO 28 CO 0.00 -0.36 0.00 -0.11 0.04 0.00 0.00 177.00 176.57 1sqb n LEU 29 N -0.86 0.00 0.03 -3.56 7.94 -1.26 -5.00 117.00 114.29 1sqb n LEU 29 Ca 0.09 0.00 -0.06 0.00 -1.11 0.00 0.00 56.01 54.93 1sqb n LEU 29 Cb 0.52 0.00 0.14 0.00 0.53 0.00 0.00 43.42 44.61 1sqb n LEU 29 CO 0.40 0.00 0.59 0.58 -1.11 0.00 0.00 177.39 177.84 1sqb h VAL 30 N 0.00 1.31 -0.38 1.96 2.07 -2.02 -2.53 116.25 116.67 1sqb h VAL 30 Ca 0.00 -1.61 0.00 0.00 0.82 0.00 0.00 66.70 65.91 1sqb h VAL 30 Cb 0.00 1.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1sqb h VAL 30 CO 0.00 0.50 0.00 0.00 0.02 0.00 0.00 177.57 178.09 1sqb n GLN 31 N -4.01 3.07 -0.02 1.57 10.64 -1.26 -3.93 117.38 123.45 1sqb n GLN 31 Ca -0.02 -1.86 0.02 0.00 -1.83 0.00 0.00 57.00 53.31 1sqb n GLN 31 Cb 0.52 -1.82 -0.08 0.00 -0.86 0.00 0.00 30.24 28.00 1sqb n GLN 31 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1sqb n ALA 32 N 0.49 2.21 1.09 2.61 0.00 -0.97 -4.45 120.51 121.49 1sqb n ALA 32 Ca 0.17 -0.33 0.13 0.00 0.00 0.00 0.00 53.44 53.40 1sqb n ALA 32 Cb 0.72 -0.23 0.37 0.00 0.00 0.00 0.00 19.45 20.31 1sqb n ALA 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sqb n ALA 33 N -1.98 3.20 0.03 0.00 0.00 -1.08 -4.14 120.51 116.54 1sqb n ALA 33 Ca -0.05 -0.32 -0.21 0.00 0.00 0.00 0.00 53.44 52.86 1sqb n ALA 33 Cb 0.40 -1.19 -0.14 0.00 0.00 0.00 0.00 19.45 18.52 1sqb n ALA 33 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1sqb h VAL 34 N 0.30 1.25 -0.74 0.00 2.07 -1.79 -3.31 116.25 114.04 1sqb h VAL 34 Ca 0.00 -2.46 -0.50 0.00 0.82 0.00 0.00 66.70 64.56 1sqb h VAL 34 Cb 0.48 2.93 -0.06 0.00 -1.52 0.00 0.00 31.29 33.12 1sqb h VAL 34 CO 0.00 0.70 1.54 -2.84 0.02 0.00 0.00 177.57 176.99 1sqb s PRO 35 N -2.45 3.24 -0.40 1.57 0.02 -1.26 -4.98 135.00 130.74 1sqb s PRO 35 Ca -0.17 -1.39 -0.29 0.00 0.02 0.00 0.00 61.00 59.17 1sqb s PRO 35 Cb 0.03 -5.36 0.00 0.00 0.02 0.00 0.00 34.50 29.19 1sqb s PRO 35 CO 0.79 -3.00 1.53 0.00 -0.33 0.00 0.00 177.00 176.00 1sqb s ALA 36 N 7.43 2.97 0.00 -1.55 0.00 -1.25 -4.47 121.76 124.89 1sqb s ALA 36 Ca 0.60 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.49 1sqb s ALA 36 Cb 0.01 -3.98 0.00 0.00 0.00 0.00 0.00 23.12 19.15 1sqb s ALA 36 CO 0.06 -2.52 0.00 2.41 0.00 0.00 0.00 175.76 175.72 1sqb n THR 37 N 7.18 0.00 -2.28 0.00 -1.04 -1.26 -5.10 114.28 111.77 1sqb n THR 37 Ca 0.18 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.85 1sqb n THR 37 Cb 0.48 0.16 -0.04 0.00 -1.82 0.00 0.00 70.33 69.11 1sqb n THR 37 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1sqb s SER 38 N 0.00 5.74 0.22 8.00 1.04 -1.26 -4.87 113.70 122.57 1sqb s SER 38 Ca 0.00 -0.83 0.19 0.00 0.48 0.00 0.00 55.95 55.80 1sqb s SER 38 Cb 0.00 -2.56 0.90 0.00 0.10 0.00 0.00 66.02 64.46 1sqb s SER 38 CO 0.00 -2.17 1.59 -0.62 0.98 0.00 0.00 173.24 173.02 1sqb n GLU 39 N 8.95 0.13 -2.32 4.02 1.02 -1.26 -4.97 120.64 126.21 1sqb n GLU 39 Ca 0.32 0.48 0.00 0.00 -0.02 0.00 0.00 57.16 57.94 1sqb n GLU 39 Cb 0.49 -1.82 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 1sqb n GLU 39 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1sqb n SER 40 N -2.08 -9.20 -4.43 1.62 3.41 -1.26 -4.90 113.62 96.77 1sqb n SER 40 Ca 0.01 1.80 -0.55 0.00 -0.26 0.00 0.00 58.87 59.88 1sqb n SER 40 Cb 0.13 -5.10 -0.06 0.00 -0.26 0.00 0.00 64.21 58.92 1sqb n SER 40 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1sqb n PRO 41 N 1.88 0.00 -0.28 4.33 -0.02 -1.26 -4.95 135.00 134.69 1sqb n PRO 41 Ca 0.00 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.18 1sqb n PRO 41 Cb 0.00 -1.31 0.29 0.00 -0.02 0.00 0.00 33.50 32.46 1sqb n PRO 41 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1sqb n VAL 42 N 0.96 0.00 0.94 -1.45 0.31 -1.26 -4.91 118.33 112.92 1sqb n VAL 42 Ca 0.19 -0.11 0.01 0.00 -0.01 0.00 0.00 64.34 64.41 1sqb n VAL 42 Cb 0.14 -0.99 0.03 0.00 -0.91 0.00 0.00 33.84 32.12 1sqb n VAL 42 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1sqb n LEU 43 N -5.59 1.29 -4.39 7.52 4.32 -1.26 -4.89 117.00 113.99 1sqb n LEU 43 Ca 0.11 -0.65 -0.14 0.00 -0.02 0.00 0.00 56.01 55.31 1sqb n LEU 43 Cb 0.59 -0.47 -0.14 0.00 -1.62 0.00 0.00 43.42 41.79 1sqb n LEU 43 CO 0.44 0.26 1.58 0.47 -1.22 0.00 0.00 177.39 178.91 1sqb n ASP 44 N 0.01 -0.82 -3.49 -1.43 9.92 -1.26 -1.93 116.55 117.56 1sqb n ASP 44 Ca 0.02 -1.09 -0.15 0.00 -0.53 0.00 0.00 54.79 53.04 1sqb n ASP 44 Cb 0.30 -0.84 0.00 0.00 -0.64 0.00 0.00 41.12 39.94 1sqb n ASP 44 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1sqb n LEU 45 N 8.74 -3.94 -3.97 0.64 4.77 -1.26 -5.03 117.00 116.96 1sqb n LEU 45 Ca 0.45 -0.61 -0.09 0.00 -0.03 0.00 0.00 56.01 55.73 1sqb n LEU 45 Cb 0.31 -2.36 -0.11 0.00 -2.33 0.00 0.00 43.42 38.93 1sqb n LEU 45 CO 0.81 -0.22 -0.33 -0.75 -1.33 0.00 0.00 177.39 175.56 1sqb s LYS 46 N -4.23 0.36 0.00 3.23 2.20 -0.81 -5.18 119.74 115.31 1sqb s LYS 46 Ca 0.03 -0.64 0.00 0.00 -0.36 0.00 0.00 55.97 55.00 1sqb s LYS 46 Cb -0.01 0.13 0.00 0.00 -1.51 0.00 0.00 37.83 36.44 1sqb s LYS 46 CO 0.84 -0.07 0.00 2.89 -0.36 0.00 0.00 175.35 178.65 1sqb n ARG 47 N 1.44 0.76 -4.98 4.03 1.85 -1.26 -5.01 116.66 113.48 1sqb n ARG 47 Ca -0.23 0.00 -0.27 0.00 -1.00 0.00 0.00 57.85 56.35 1sqb n ARG 47 Cb 0.56 0.00 -0.16 0.00 -1.05 0.00 0.00 32.46 31.81 1sqb n ARG 47 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 1sqb s SER 48 N -1.40 2.42 1.09 2.89 1.04 -1.26 -5.07 113.70 113.42 1sqb s SER 48 Ca 0.00 -0.39 -0.18 0.00 0.48 0.00 0.00 55.95 55.86 1sqb s SER 48 Cb 0.00 -0.53 0.25 0.00 0.10 0.00 0.00 66.02 65.84 1sqb s SER 48 CO 0.00 0.20 1.23 1.33 0.98 0.00 0.00 173.24 176.99 1sqb n VAL 49 N 2.91 0.00 -0.10 5.02 0.24 -1.26 -4.33 118.33 120.81 1sqb n VAL 49 Ca -0.17 -0.79 0.00 0.00 -2.04 0.00 0.00 64.34 61.34 1sqb n VAL 49 Cb 0.53 -1.41 0.00 0.00 -1.47 0.00 0.00 33.84 31.49 1sqb n VAL 49 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 1sqb n LEU 50 N 0.00 0.14 0.00 1.34 0.00 -1.26 -4.80 117.00 112.41 1sqb n LEU 50 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.17 1sqb n LEU 50 Cb 0.58 -0.55 0.00 0.00 0.00 0.00 0.00 43.42 43.45 1sqb n LEU 50 CO 0.41 -0.07 0.00 0.00 0.00 0.00 0.00 177.39 177.73 1sqb s ARG 52 N 0.00 0.48 -0.01 0.00 6.06 -1.26 -4.98 118.95 119.24 1sqb s ARG 52 Ca 0.00 0.45 0.00 0.00 -2.50 0.00 0.00 55.73 53.68 1sqb s ARG 52 Cb 0.00 -0.01 0.01 0.00 0.06 0.00 0.00 34.95 35.01 1sqb s ARG 52 CO 0.00 -0.94 0.42 -1.91 -2.50 0.00 0.00 175.30 170.37 1sqb n GLU 53 N 5.39 0.04 -0.11 5.12 4.07 -1.26 -4.91 120.64 128.98 1sqb n GLU 53 Ca 0.02 -0.39 0.09 0.00 -0.06 0.00 0.00 57.16 56.82 1sqb n GLU 53 Cb 0.51 0.48 0.15 0.00 -0.06 0.00 0.00 31.44 32.52 1sqb n GLU 53 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1sqb n SER 54 N -0.04 2.51 -4.69 4.31 3.41 -1.26 -5.06 113.62 112.80 1sqb n SER 54 Ca -0.11 -3.03 -0.42 0.00 -0.26 0.00 0.00 58.87 55.05 1sqb n SER 54 Cb 0.44 -0.42 -0.03 0.00 -0.26 0.00 0.00 64.21 63.94 1sqb n SER 54 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1sqb s LEU 55 N -2.78 4.34 0.97 1.04 1.43 -1.26 -5.01 118.68 117.40 1sqb s LEU 55 Ca 0.32 2.28 -0.12 0.00 -1.03 0.00 0.00 54.13 55.58 1sqb s LEU 55 Cb 0.27 -3.56 0.17 0.00 0.03 0.00 0.00 46.19 43.10 1sqb s LEU 55 CO 0.04 -0.81 1.09 -0.13 0.23 0.00 0.00 176.35 176.77 1sqb s ARG 56 N 2.63 0.68 0.00 1.70 1.81 -1.26 -5.29 118.95 119.22 1sqb s ARG 56 Ca 0.69 0.65 0.01 0.00 -1.72 0.00 0.00 55.73 55.36 1sqb s ARG 56 Cb -0.35 -1.76 0.07 0.00 -0.45 0.00 0.00 34.95 32.46 1sqb s ARG 56 CO 0.29 -2.59 0.56 0.41 -0.68 0.00 0.00 175.30 173.29