#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nr5 h LYS 4 N 0.00 0.94 -0.74 1.09 3.64 -2.05 -0.04 116.57 119.41 2nr5 h LYS 4 Ca 0.00 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 2nr5 h LYS 4 Cb 0.00 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 31.59 2nr5 h LYS 4 CO 0.00 0.66 0.42 -0.22 -2.27 0.00 0.00 179.45 178.04 2nr5 h LYS 5 N 0.96 1.02 -0.32 1.90 3.64 -2.04 0.60 116.57 122.32 2nr5 h LYS 5 Ca 0.25 -0.11 -0.08 0.00 -1.27 0.00 0.00 60.65 59.44 2nr5 h LYS 5 Cb -0.04 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.57 2nr5 h LYS 5 CO -0.05 0.74 -0.12 0.93 -2.27 0.00 0.00 179.45 178.69 2nr5 h GLU 6 N 1.01 0.65 -0.57 1.90 5.08 -1.84 -1.23 114.58 119.58 2nr5 h GLU 6 Ca 0.26 -0.27 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 2nr5 h GLU 6 Cb 0.01 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 2nr5 h GLU 6 CO -0.04 0.85 0.13 -0.09 -1.00 0.00 0.00 179.01 178.85 2nr5 h ARG 7 N 0.42 0.90 -0.48 2.33 1.12 -0.73 -1.35 114.38 116.59 2nr5 h ARG 7 Ca 0.08 -0.20 -0.11 0.00 -1.11 0.00 0.00 59.98 58.64 2nr5 h ARG 7 Cb 0.63 -0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 30.45 2nr5 h ARG 7 CO 0.04 0.81 -0.13 0.82 -3.11 0.00 0.00 179.97 178.40 2nr5 h ILE 8 N 0.86 1.27 -0.62 1.20 2.04 -0.77 -1.65 117.51 119.83 2nr5 h ILE 8 Ca 0.18 -1.27 0.04 0.00 1.00 0.00 0.00 64.86 64.82 2nr5 h ILE 8 Cb 0.33 1.10 -0.04 0.00 -0.74 0.00 0.00 36.82 37.46 2nr5 h ILE 8 CO 0.00 0.44 0.36 0.00 0.00 0.00 0.00 178.15 178.95 2nr5 h ALA 9 N 0.88 0.81 -0.43 1.87 0.00 -0.73 -0.20 119.26 121.47 2nr5 h ALA 9 Ca 0.12 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2nr5 h ALA 9 Cb 0.69 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2nr5 h ALA 9 CO 0.05 0.08 0.16 0.82 0.00 0.00 0.00 179.25 180.36 2nr5 h ILE 10 N 0.70 1.20 -0.76 0.00 2.04 -1.11 -0.44 117.51 119.14 2nr5 h ILE 10 Ca 0.26 -0.64 -0.00 0.00 1.00 0.00 0.00 64.86 65.48 2nr5 h ILE 10 Cb 0.09 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 2nr5 h ILE 10 CO -0.13 0.23 0.46 1.56 0.00 0.00 0.00 178.15 180.27 2nr5 h GLN 11 N 0.55 1.03 -0.40 2.37 4.20 -0.86 -2.90 115.11 119.10 2nr5 h GLN 11 Ca 0.14 -0.09 -0.11 0.00 0.06 0.00 0.00 58.65 58.65 2nr5 h GLN 11 Cb 0.20 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 2nr5 h GLN 11 CO -0.01 0.72 -0.20 0.00 -0.67 0.00 0.00 178.83 178.67 2nr5 h ARG 12 N 1.04 0.83 -0.36 1.46 3.08 -0.61 -0.83 114.38 119.00 2nr5 h ARG 12 Ca 0.27 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 59.96 2nr5 h ARG 12 Cb -0.05 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 29.98 2nr5 h ARG 12 CO -0.05 1.00 0.00 0.45 -1.07 0.00 0.00 179.97 180.30 2nr5 n SER 13 N -4.24 0.00 0.00 7.04 2.88 -0.21 -1.94 113.62 117.15 2nr5 n SER 13 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 2nr5 n SER 13 Cb 0.43 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 2nr5 n SER 13 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2nr5 n ALA 15 N 0.58 0.00 -0.31 -1.46 0.00 -0.32 -2.72 120.51 116.29 2nr5 n ALA 15 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 2nr5 n ALA 15 Cb 0.00 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.58 2nr5 n ALA 15 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2nr5 h GLU 16 N 0.00 1.19 -0.38 0.00 4.39 -1.67 0.11 114.58 118.23 2nr5 h GLU 16 Ca 0.00 -0.12 -0.10 0.00 0.34 0.00 0.00 59.36 59.48 2nr5 h GLU 16 Cb 0.00 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 28.39 2nr5 h GLU 16 CO 0.00 0.85 -0.17 0.93 -1.16 0.00 0.00 179.01 179.46 2nr5 h GLU 17 N 1.21 0.79 -0.34 2.33 5.08 -1.81 0.01 114.58 121.85 2nr5 h GLU 17 Ca 0.31 -0.34 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 2nr5 h GLU 17 Cb -0.02 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.17 2nr5 h GLU 17 CO -0.06 0.96 0.12 0.00 -1.00 0.00 0.00 179.01 179.04 2nr5 h ALA 18 N 0.81 0.39 -0.77 3.43 0.00 -1.72 -1.73 119.26 119.67 2nr5 h ALA 18 Ca 0.09 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2nr5 h ALA 18 Cb 0.72 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 2nr5 h ALA 18 CO 0.05 -0.27 0.46 -0.07 0.00 0.00 0.00 179.25 179.42 2nr5 h LEU 19 N 0.27 0.92 -0.78 0.00 3.38 -0.68 -1.79 115.31 116.63 2nr5 h LEU 19 Ca 0.15 -0.06 0.08 0.00 0.09 0.00 0.00 57.88 58.13 2nr5 h LEU 19 Cb 0.12 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 40.57 2nr5 h LEU 19 CO -0.15 0.72 0.45 1.23 0.09 0.00 0.00 178.44 180.77 2nr5 h GLY 20 N 1.05 1.18 0.97 0.83 0.00 -0.66 0.07 103.07 106.52 2nr5 h GLY 20 Ca 0.28 -0.31 -0.10 0.00 0.00 0.00 0.00 47.33 47.19 2nr5 h GLY 20 CO -0.05 0.16 -0.19 1.70 0.00 0.00 0.00 176.54 178.16 2nr5 h LYS 21 N 0.79 0.74 -0.69 4.80 1.63 -0.92 -0.12 116.57 122.79 2nr5 h LYS 21 Ca 0.36 -0.33 -0.02 0.00 -0.85 0.00 0.00 60.65 59.81 2nr5 h LYS 21 Cb 0.27 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.85 2nr5 h LYS 21 CO -0.21 0.94 0.37 -0.07 -3.45 0.00 0.00 179.45 177.03 2nr5 h LEU 22 N 0.51 0.87 -1.14 5.20 3.38 -1.02 -2.46 115.31 120.66 2nr5 h LEU 22 Ca 0.07 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 2nr5 h LEU 22 Cb 0.73 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2nr5 h LEU 22 CO 0.05 0.73 -0.38 0.11 0.09 0.00 0.00 178.44 179.04 2nr5 h LYS 23 N 0.95 0.10 -0.53 1.13 1.57 -0.82 -2.64 116.57 116.33 2nr5 h LYS 23 Ca 0.24 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.97 2nr5 h LYS 23 Cb 0.06 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 2nr5 h LYS 23 CO -0.04 0.47 0.29 0.00 -0.57 0.00 0.00 179.45 179.60 2nr5 h ALA 24 N 1.53 0.68 -0.41 3.86 0.00 -0.71 -2.56 119.26 121.65 2nr5 h ALA 24 Ca 0.01 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 54.89 2nr5 h ALA 24 Cb 0.71 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 2nr5 h ALA 24 CO 0.05 0.20 0.08 0.82 0.00 0.00 0.00 179.25 180.40 2nr5 h ILE 25 N 0.71 0.78 -0.93 0.00 2.04 -1.10 -2.41 117.51 116.61 2nr5 h ILE 25 Ca 0.19 -0.07 0.14 0.00 1.00 0.00 0.00 64.86 66.11 2nr5 h ILE 25 Cb 0.05 0.56 -0.08 0.00 -0.74 0.00 0.00 36.82 36.61 2nr5 h ILE 25 CO -0.03 0.04 0.59 -0.09 0.00 0.00 0.00 178.15 178.66 2nr5 h ARG 26 N 0.21 0.77 0.00 2.37 2.43 -1.23 -1.82 114.38 117.11 2nr5 h ARG 26 Ca 0.20 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 2nr5 h ARG 26 Cb 0.24 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 2nr5 h ARG 26 CO -0.26 0.51 0.00 1.96 -1.51 0.00 0.00 179.97 180.67 2nr5 h GLN 27 N 0.79 0.00 -0.00 0.20 1.08 -1.18 -2.80 115.11 113.21 2nr5 h GLN 27 Ca 0.47 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.67 2nr5 h GLN 27 Cb 0.65 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.08 2nr5 h GLN 27 CO -0.23 0.00 -0.35 1.28 -0.95 0.00 0.00 178.83 178.58 2nr5 n LEU 28 N -2.90 0.62 -4.76 1.46 4.77 -0.68 -4.84 117.00 110.66 2nr5 n LEU 28 Ca -0.02 -0.04 -0.41 0.00 -0.03 0.00 0.00 56.01 55.51 2nr5 n LEU 28 Cb 0.11 -0.22 -0.01 0.00 -2.33 0.00 0.00 43.42 40.97 2nr5 n LEU 28 CO 0.20 0.13 1.15 0.00 -1.33 0.00 0.00 177.39 177.54 2nr5 n GLY 30 N 1.32 -0.46 0.22 0.00 0.00 -1.26 -4.86 105.19 100.14 2nr5 n GLY 30 Ca 0.04 -0.01 0.10 0.00 0.00 0.00 0.00 46.02 46.15 2nr5 n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nr5 h ALA 31 N 0.95 1.00 -2.59 4.61 0.00 -1.84 -3.44 119.26 117.95 2nr5 h ALA 31 Ca -0.48 -0.21 -0.50 0.00 0.00 0.00 0.00 54.91 53.72 2nr5 h ALA 31 Cb 1.35 -0.04 0.05 0.00 0.00 0.00 0.00 17.79 19.15 2nr5 h ALA 31 CO 0.56 0.29 0.45 -1.83 0.00 0.00 0.00 179.25 178.72 2nr5 s GLU 32 N -3.59 3.81 0.00 0.00 1.03 -1.26 -4.95 118.70 113.73 2nr5 s GLU 32 Ca 0.01 1.64 0.22 0.00 0.03 0.00 0.00 54.97 56.87 2nr5 s GLU 32 Cb 0.10 -2.35 0.99 0.00 -0.80 0.00 0.00 34.13 32.07 2nr5 s GLU 32 CO 0.64 -0.48 1.70 -0.25 -1.33 0.00 0.00 175.26 175.55 2nr5 n ASP 33 N -0.55 0.00 -1.34 0.83 8.00 -1.26 -2.12 116.55 120.10 2nr5 n ASP 33 Ca 0.08 0.32 -0.01 0.00 0.71 0.00 0.00 54.79 55.88 2nr5 n ASP 33 Cb 0.49 -0.43 0.17 0.00 -0.02 0.00 0.00 41.12 41.34 2nr5 n ASP 33 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2nr5 n SER 34 N -1.43 3.42 -4.80 -2.24 3.41 -1.26 -4.98 113.62 105.74 2nr5 n SER 34 Ca 0.07 -2.58 -0.35 0.00 -0.26 0.00 0.00 58.87 55.75 2nr5 n SER 34 Cb 0.23 -0.62 -0.05 0.00 -0.26 0.00 0.00 64.21 63.51 2nr5 n SER 34 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2nr5 s SER 35 N -0.32 6.66 0.00 4.04 1.04 -0.90 -5.04 113.70 119.17 2nr5 s SER 35 Ca 0.28 1.89 0.00 0.00 0.48 0.00 0.00 55.95 58.60 2nr5 s SER 35 Cb 0.22 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.78 2nr5 s SER 35 CO 0.07 -0.56 0.00 -0.90 0.98 0.00 0.00 173.24 172.83 2nr5 n ASP 36 N -0.57 0.00 0.28 7.02 5.68 -1.26 -4.99 116.55 122.71 2nr5 n ASP 36 Ca 0.07 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.48 2nr5 n ASP 36 Cb 0.52 0.00 0.79 0.00 -1.14 0.00 0.00 41.12 41.29 2nr5 n ASP 36 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 2nr5 h SER 37 N 0.00 0.00 -0.48 -1.12 4.64 -2.05 -1.59 113.55 112.95 2nr5 h SER 37 Ca 0.00 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 2nr5 h SER 37 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 2nr5 h SER 37 CO 0.00 0.00 -0.07 0.77 -0.87 0.00 0.00 176.83 176.66 2nr5 h SER 38 N 0.00 0.94 0.00 4.97 4.64 -1.99 -1.05 113.55 121.06 2nr5 h SER 38 Ca 0.00 -0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 2nr5 h SER 38 Cb 0.01 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 61.85 2nr5 h SER 38 CO -0.00 1.03 0.00 0.47 -0.87 0.00 0.00 176.83 177.46 2nr5 n ASP 39 N -4.16 1.52 0.00 4.97 8.00 -0.60 -2.05 116.55 124.23 2nr5 n ASP 39 Ca 0.02 -1.02 0.00 0.00 0.71 0.00 0.00 54.79 54.50 2nr5 n ASP 39 Cb 0.37 -0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 2nr5 n ASP 39 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 2nr5 n GLN 41 N 0.74 0.00 -0.06 -1.24 7.27 -0.40 -1.90 117.38 121.79 2nr5 n GLN 41 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 57.00 56.99 2nr5 n GLN 41 Cb 0.25 0.00 -0.01 0.00 2.41 0.00 0.00 30.24 32.89 2nr5 n GLN 41 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 2nr5 h GLU 42 N 0.00 0.12 -0.41 3.69 5.08 -1.69 -0.52 114.58 120.85 2nr5 h GLU 42 Ca 0.00 -0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.43 2nr5 h GLU 42 Cb 0.00 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.15 2nr5 h GLU 42 CO 0.00 0.08 -0.02 0.28 -1.00 0.00 0.00 179.01 178.35 2nr5 h VAL 43 N 0.12 0.66 -0.76 3.13 2.07 -1.68 -0.74 116.25 119.06 2nr5 h VAL 43 Ca 0.12 -0.03 -0.05 0.00 0.82 0.00 0.00 66.70 67.56 2nr5 h VAL 43 Cb 0.13 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 2nr5 h VAL 43 CO -0.17 0.02 0.27 -0.33 0.02 0.00 0.00 177.57 177.37 2nr5 h GLU 44 N 0.08 1.16 -0.46 1.57 5.08 -1.77 0.50 114.58 120.74 2nr5 h GLU 44 Ca 0.20 -0.23 0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2nr5 h GLU 44 Cb 0.30 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 2nr5 h GLU 44 CO -0.36 0.97 0.28 0.82 -1.00 0.00 0.00 179.01 179.72 2nr5 h ILE 45 N 1.12 1.07 -0.30 3.13 2.04 -0.69 -0.15 117.51 123.71 2nr5 h ILE 45 Ca 0.25 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.91 2nr5 h ILE 45 Cb 0.27 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 2nr5 h ILE 45 CO -0.01 0.10 0.17 -0.50 0.00 0.00 0.00 178.15 177.91 2nr5 h TRP 46 N 0.57 0.41 -0.53 1.37 4.06 -0.70 -2.21 115.95 118.92 2nr5 h TRP 46 Ca 0.18 -0.01 0.05 0.00 2.06 0.00 0.00 58.89 61.17 2nr5 h TRP 46 Cb -0.01 -0.13 -0.05 0.00 -1.00 0.00 0.00 29.16 27.97 2nr5 h TRP 46 CO -0.06 0.33 0.26 1.15 -3.56 0.00 0.00 178.44 176.55 2nr5 h THR 47 N 0.37 0.93 -0.19 1.49 2.02 -0.59 0.32 112.91 117.26 2nr5 h THR 47 Ca 0.11 -0.17 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 2nr5 h THR 47 Cb 0.05 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 2nr5 h THR 47 CO -0.02 0.09 0.06 -1.13 0.37 0.00 0.00 175.52 174.89 2nr5 h ASN 48 N 0.49 0.28 -0.63 4.18 -1.24 -0.99 0.70 115.58 118.38 2nr5 h ASN 48 Ca 0.24 -0.21 -0.07 0.00 0.71 0.00 0.00 56.30 56.97 2nr5 h ASN 48 Cb 0.17 -0.07 -0.02 0.00 0.73 0.00 0.00 38.32 39.12 2nr5 h ASN 48 CO -0.18 0.42 0.11 -0.09 -1.29 0.00 0.00 177.43 176.40 2nr5 h ARG 49 N 0.14 1.04 -0.52 6.67 9.65 -1.11 -1.01 114.38 129.23 2nr5 h ARG 49 Ca 0.06 -0.27 -0.09 0.00 -1.10 0.00 0.00 59.98 58.58 2nr5 h ARG 49 Cb 0.23 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.67 2nr5 h ARG 49 CO -0.00 0.96 -0.04 0.82 2.80 0.00 0.00 179.97 184.51 2nr5 h ILE 50 N 0.95 1.27 -0.93 1.20 2.04 -0.86 -2.34 117.51 118.84 2nr5 h ILE 50 Ca 0.19 -1.15 0.00 0.00 1.00 0.00 0.00 64.86 64.90 2nr5 h ILE 50 Cb 0.42 0.97 -0.05 0.00 -0.74 0.00 0.00 36.82 37.43 2nr5 h ILE 50 CO 0.01 0.41 0.60 0.50 0.00 0.00 0.00 178.15 179.67 2nr5 h LYS 51 N 0.80 1.24 -0.47 2.37 3.64 -0.69 0.15 116.57 123.61 2nr5 h LYS 51 Ca 0.14 -0.09 0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2nr5 h LYS 51 Cb 0.58 -0.27 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 2nr5 h LYS 51 CO 0.03 0.83 0.29 1.49 -2.27 0.00 0.00 179.45 179.83 2nr5 h GLU 52 N 1.27 0.57 -0.22 1.90 4.81 -0.97 0.11 114.58 122.05 2nr5 h GLU 52 Ca 0.34 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.50 2nr5 h GLU 52 Cb -0.12 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.12 2nr5 h GLU 52 CO -0.07 0.38 0.02 1.25 -0.73 0.00 0.00 179.01 179.86 2nr5 h LEU 53 N 0.59 0.36 -0.81 1.64 5.85 -1.12 -1.30 115.31 120.52 2nr5 h LEU 53 Ca 0.18 -0.28 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 2nr5 h LEU 53 Cb -0.02 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 2nr5 h LEU 53 CO -0.07 0.55 0.21 -0.08 -0.34 0.00 0.00 178.44 178.72 2nr5 h GLU 54 N 0.16 1.10 -0.47 1.25 4.81 -0.49 0.29 114.58 121.24 2nr5 h GLU 54 Ca 0.07 -0.23 -0.07 0.00 -0.13 0.00 0.00 59.36 58.99 2nr5 h GLU 54 Cb 0.35 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 2nr5 h GLU 54 CO 0.01 0.94 0.01 -0.44 -0.73 0.00 0.00 179.01 178.80 2nr5 h ASP 55 N 1.06 0.81 -0.08 1.04 3.32 -0.70 -1.88 116.42 119.99 2nr5 h ASP 55 Ca 0.23 -0.30 0.02 0.00 0.02 0.00 0.00 57.03 57.00 2nr5 h ASP 55 Cb 0.31 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 2nr5 h ASP 55 CO -0.01 0.91 -0.07 -0.25 -1.72 0.00 0.00 179.24 178.10 2nr5 h TRP 56 N 0.68 -0.18 -0.23 4.55 7.01 -0.94 0.14 115.95 126.98 2nr5 h TRP 56 Ca 0.13 0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.19 2nr5 h TRP 56 Cb 0.50 0.09 -0.04 0.00 -2.10 0.00 0.00 29.16 27.60 2nr5 h TRP 56 CO 0.04 -0.12 -0.07 -0.07 -2.79 0.00 0.00 178.44 175.44 2nr5 h LEU 57 N -0.09 -0.24 0.00 0.65 3.38 -0.63 0.10 115.31 118.48 2nr5 h LEU 57 Ca 0.06 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2nr5 h LEU 57 Cb 0.17 0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2nr5 h LEU 57 CO -0.13 -0.09 -0.81 0.79 0.09 0.00 0.00 178.44 178.29 2nr5 n TRP 58 N -5.22 0.34 -0.10 1.13 5.03 -0.73 -3.36 117.44 114.52 2nr5 n TRP 58 Ca -0.02 0.10 -0.13 0.00 3.03 0.00 0.00 57.50 60.48 2nr5 n TRP 58 Cb 0.15 -0.49 -0.10 0.00 -1.03 0.00 0.00 31.31 29.84 2nr5 n TRP 58 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 2nr5 n GLY 59 N 1.38 -0.34 0.00 6.99 0.00 0.48 -4.70 105.19 109.00 2nr5 n GLY 59 Ca 0.03 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2nr5 n GLY 59 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2nr5 n GLU 60 N -3.03 3.49 -1.53 1.61 1.02 0.14 -4.94 120.64 117.41 2nr5 n GLU 60 Ca -0.34 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.51 2nr5 n GLU 60 Cb 0.89 -0.50 0.15 0.00 -0.02 0.00 0.00 31.44 31.96 2nr5 n GLU 60 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2nr5 s SER 61 N -0.84 3.30 0.38 1.62 1.04 0.03 -4.88 113.70 114.35 2nr5 s SER 61 Ca 0.00 0.90 0.25 0.00 0.48 0.00 0.00 55.95 57.58 2nr5 s SER 61 Cb 0.00 -1.42 1.37 0.00 0.10 0.00 0.00 66.02 66.07 2nr5 s SER 61 CO 0.00 -2.68 1.77 -0.65 0.98 0.00 0.00 173.24 172.66 2nr5 h PRO 62 N -1.59 0.00 -0.40 4.02 0.11 -1.91 -2.07 132.00 130.16 2nr5 h PRO 62 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2nr5 h PRO 62 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2nr5 h PRO 62 CO 0.59 0.00 0.00 0.44 -0.21 0.00 0.00 178.00 178.82 2nr5 n ILE 63 N -2.39 0.80 1.21 4.15 -5.35 -1.26 -5.09 119.36 111.43 2nr5 n ILE 63 Ca -0.02 -0.90 0.10 0.00 -0.27 0.00 0.00 62.75 61.66 2nr5 n ILE 63 Cb 0.06 0.67 0.57 0.00 -1.74 0.00 0.00 39.64 39.20 2nr5 n ILE 63 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79