#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nr2 s GLN 2 N 0.00 3.79 0.38 3.17 -2.07 -1.26 0.75 119.66 124.41 2nr2 s GLN 2 Ca 0.00 0.13 0.05 0.00 -1.82 0.00 0.00 55.36 53.72 2nr2 s GLN 2 Cb 0.00 -3.25 -0.07 0.00 -1.09 0.00 0.00 33.01 28.61 2nr2 s GLN 2 CO 0.00 0.64 0.04 0.96 -1.32 0.00 0.00 175.29 175.61 2nr2 s ILE 3 N -0.77 1.50 0.09 3.63 -4.36 -0.35 -0.55 121.20 120.38 2nr2 s ILE 3 Ca 0.19 -2.00 0.10 0.00 -0.26 0.00 0.00 60.65 58.67 2nr2 s ILE 3 Cb -0.14 -2.83 -0.03 0.00 1.25 0.00 0.00 42.46 40.71 2nr2 s ILE 3 CO 0.08 0.00 -0.25 -0.36 0.24 0.00 0.00 174.94 174.65 2nr2 s PHE 4 N -3.02 2.37 -0.01 1.37 0.08 0.11 -1.20 117.98 117.67 2nr2 s PHE 4 Ca 0.34 -0.36 0.02 0.00 0.12 0.00 0.00 56.93 57.04 2nr2 s PHE 4 Cb 0.09 -1.34 -0.00 0.00 -0.57 0.00 0.00 43.02 41.19 2nr2 s PHE 4 CO 0.16 0.25 -0.07 0.08 -0.10 0.00 0.00 175.22 175.54 2nr2 s VAL 5 N -0.96 0.61 -0.14 -0.44 1.01 -0.37 -1.90 120.40 118.22 2nr2 s VAL 5 Ca 0.14 -0.30 -0.02 0.00 0.00 0.00 0.00 61.98 61.79 2nr2 s VAL 5 Cb -0.10 -0.54 -0.02 0.00 0.00 0.00 0.00 36.38 35.72 2nr2 s VAL 5 CO 0.05 0.19 -0.07 -0.75 0.00 0.00 0.00 175.10 174.52 2nr2 s LYS 6 N 0.02 3.56 0.65 2.72 2.47 -0.20 0.85 119.74 129.80 2nr2 s LYS 6 Ca 0.00 -0.57 -0.10 0.00 -1.56 0.00 0.00 55.97 53.74 2nr2 s LYS 6 Cb -0.05 -2.82 0.15 0.00 -1.46 0.00 0.00 37.83 33.65 2nr2 s LYS 6 CO -0.00 0.25 0.88 0.25 0.16 0.00 0.00 175.35 176.89 2nr2 n THR 7 N 3.48 0.00 -0.09 3.43 -2.24 -0.72 -1.81 114.28 116.34 2nr2 n THR 7 Ca -0.18 -0.73 -0.08 0.00 -2.27 0.00 0.00 64.05 60.79 2nr2 n THR 7 Cb 0.53 -1.57 -0.00 0.00 -2.10 0.00 0.00 70.33 67.18 2nr2 n THR 7 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2nr2 h LEU 8 N 0.00 0.22 0.08 3.22 3.38 -1.92 -3.27 115.31 117.02 2nr2 h LEU 8 Ca -0.29 0.02 -0.33 0.00 0.09 0.00 0.00 57.88 57.37 2nr2 h LEU 8 Cb 0.82 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 2nr2 h LEU 8 CO 0.21 0.17 -1.81 0.71 0.09 0.00 0.00 178.44 177.81 2nr2 h THR 9 N 0.32 0.80 0.00 0.22 1.35 -1.95 -3.48 112.91 110.17 2nr2 h THR 9 Ca 0.13 -2.55 0.00 0.00 -0.55 0.00 0.00 66.41 63.43 2nr2 h THR 9 Cb 0.05 2.53 0.00 0.00 -1.73 0.00 0.00 68.15 69.00 2nr2 h THR 9 CO -0.09 0.74 0.00 0.61 -0.25 0.00 0.00 175.52 176.53 2nr2 n GLY 10 N 1.78 -0.56 3.69 5.82 0.00 -1.23 -5.14 105.19 109.54 2nr2 n GLY 10 Ca -0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 2nr2 n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2nr2 s LYS 11 N 0.00 4.35 -0.36 1.61 2.20 -1.26 -4.75 119.74 121.54 2nr2 s LYS 11 Ca 0.00 0.97 -0.26 0.00 -0.36 0.00 0.00 55.97 56.32 2nr2 s LYS 11 Cb 0.00 -3.53 0.01 0.00 -1.51 0.00 0.00 37.83 32.81 2nr2 s LYS 11 CO 0.00 -0.18 0.93 0.99 -0.36 0.00 0.00 175.35 176.73 2nr2 s THR 12 N 1.63 4.60 -0.32 3.43 2.01 -1.26 -1.75 115.64 123.97 2nr2 s THR 12 Ca 0.38 1.26 -0.14 0.00 0.31 0.00 0.00 61.69 63.51 2nr2 s THR 12 Cb -0.17 -4.33 -0.02 0.00 0.01 0.00 0.00 72.50 67.99 2nr2 s THR 12 CO 0.15 -0.50 0.30 -0.63 -0.69 0.00 0.00 174.62 173.25 2nr2 s ILE 13 N 3.45 5.23 -0.55 1.82 1.01 0.25 -4.92 121.20 127.48 2nr2 s ILE 13 Ca 0.38 0.06 -0.24 0.00 0.00 0.00 0.00 60.65 60.85 2nr2 s ILE 13 Cb -0.12 -3.73 0.04 0.00 0.01 0.00 0.00 42.46 38.66 2nr2 s ILE 13 CO 0.18 0.02 0.93 -0.89 0.00 0.00 0.00 174.94 175.17 2nr2 s THR 14 N 1.90 4.41 -0.25 2.92 2.01 -1.26 -1.24 115.64 124.13 2nr2 s THR 14 Ca 0.10 0.26 -0.03 0.00 0.31 0.00 0.00 61.69 62.33 2nr2 s THR 14 Cb -0.17 -4.53 0.02 0.00 0.01 0.00 0.00 72.50 67.83 2nr2 s THR 14 CO 0.11 -1.09 -0.03 -0.76 -0.69 0.00 0.00 174.62 172.15 2nr2 s LEU 15 N 3.89 3.25 -0.28 4.42 1.43 -0.34 -4.95 118.68 126.10 2nr2 s LEU 15 Ca 0.30 -0.76 -0.29 0.00 -1.03 0.00 0.00 54.13 52.36 2nr2 s LEU 15 Cb -0.13 -1.71 -0.02 0.00 0.03 0.00 0.00 46.19 44.35 2nr2 s LEU 15 CO 0.19 -0.12 1.76 -1.83 0.23 0.00 0.00 176.35 176.59 2nr2 s GLU 16 N 1.38 3.49 0.41 1.70 1.03 -1.26 -1.21 118.70 124.24 2nr2 s GLU 16 Ca 0.02 1.56 0.07 0.00 0.03 0.00 0.00 54.97 56.65 2nr2 s GLU 16 Cb -0.16 -4.15 -0.07 0.00 -0.80 0.00 0.00 34.13 28.95 2nr2 s GLU 16 CO -0.03 -1.66 0.09 0.14 -1.33 0.00 0.00 175.26 172.46 2nr2 s VAL 17 N 6.35 2.16 0.35 1.83 -7.23 0.23 -4.89 120.40 119.20 2nr2 s VAL 17 Ca 0.78 -1.86 0.08 0.00 -1.81 0.00 0.00 61.98 59.18 2nr2 s VAL 17 Cb -0.24 -2.99 -0.05 0.00 0.56 0.00 0.00 36.38 33.66 2nr2 s VAL 17 CO 0.33 -0.01 0.12 -1.61 -0.31 0.00 0.00 175.10 173.62 2nr2 s GLU 18 N -3.80 2.29 0.43 4.82 0.41 -1.26 -0.81 118.70 120.77 2nr2 s GLU 18 Ca 0.38 -1.62 0.17 0.00 -0.41 0.00 0.00 54.97 53.49 2nr2 s GLU 18 Cb 0.07 -2.10 0.96 0.00 -1.78 0.00 0.00 34.13 31.27 2nr2 s GLU 18 CO 0.20 0.09 1.91 -1.35 -0.49 0.00 0.00 175.26 175.62 2nr2 h PRO 19 N 1.59 0.00 0.00 0.39 0.11 -1.96 -2.66 132.00 129.47 2nr2 h PRO 19 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2nr2 h PRO 19 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2nr2 h PRO 19 CO 0.65 0.27 0.00 -1.13 -0.21 0.00 0.00 178.00 177.58 2nr2 n SER 20 N -3.97 0.00 -4.78 -2.05 3.41 -1.26 -1.09 113.62 103.87 2nr2 n SER 20 Ca -0.02 -0.97 -0.37 0.00 -0.26 0.00 0.00 58.87 57.25 2nr2 n SER 20 Cb 0.34 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.23 2nr2 n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2nr2 s ASP 21 N -1.91 7.36 0.85 4.04 1.01 -1.01 -4.90 116.67 122.12 2nr2 s ASP 21 Ca 0.38 1.80 -0.12 0.00 0.71 0.00 0.00 52.55 55.32 2nr2 s ASP 21 Cb 0.17 -2.56 0.10 0.00 1.01 0.00 0.00 42.92 41.64 2nr2 s ASP 21 CO 0.29 -0.01 1.12 0.42 0.21 0.00 0.00 175.17 177.21 2nr2 s THR 22 N -1.52 2.47 0.21 -1.27 -4.23 -1.26 -2.51 115.64 107.53 2nr2 s THR 22 Ca 0.47 0.15 -0.04 0.00 -1.18 0.00 0.00 61.69 61.10 2nr2 s THR 22 Cb -0.20 -2.93 0.02 0.00 1.34 0.00 0.00 72.50 70.73 2nr2 s THR 22 CO 0.25 -0.20 1.61 0.40 -0.54 0.00 0.00 174.62 176.14 2nr2 h ILE 23 N -1.27 1.28 -0.82 2.99 1.08 -0.78 -2.21 117.51 117.77 2nr2 h ILE 23 Ca -0.49 -1.42 0.18 0.00 -0.39 0.00 0.00 64.86 62.75 2nr2 h ILE 23 Cb 1.30 1.32 -0.11 0.00 -3.07 0.00 0.00 36.82 36.27 2nr2 h ILE 23 CO 0.61 0.46 0.33 -0.08 -0.69 0.00 0.00 178.15 178.79 2nr2 h GLU 24 N 0.62 0.41 0.00 2.37 4.81 -1.45 0.27 114.58 121.61 2nr2 h GLU 24 Ca 0.07 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.17 2nr2 h GLU 24 Cb 0.80 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 2nr2 h GLU 24 CO 0.07 0.27 -0.52 -0.91 -0.73 0.00 0.00 179.01 177.18 2nr2 h ASN 25 N 0.42 0.00 0.12 1.04 2.35 -1.69 0.45 115.58 118.28 2nr2 h ASN 25 Ca 0.48 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 56.07 2nr2 h ASN 25 Cb 0.82 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.18 2nr2 h ASN 25 CO -0.47 0.52 -0.58 0.58 -1.65 0.00 0.00 177.43 175.84 2nr2 h VAL 26 N 0.00 1.34 -0.25 2.81 2.07 -1.00 -0.50 116.25 120.71 2nr2 h VAL 26 Ca -0.01 -1.86 -0.12 0.00 0.82 0.00 0.00 66.70 65.53 2nr2 h VAL 26 Cb 1.02 1.85 -0.01 0.00 -1.52 0.00 0.00 31.29 32.63 2nr2 h VAL 26 CO 0.07 0.57 -0.36 0.11 0.02 0.00 0.00 177.57 177.98 2nr2 h LYS 27 N 0.36 0.56 -0.81 1.57 1.57 -0.37 -2.09 116.57 117.36 2nr2 h LYS 27 Ca 0.00 -0.26 -0.03 0.00 -1.87 0.00 0.00 60.65 58.49 2nr2 h LYS 27 Cb 1.12 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.38 2nr2 h LYS 27 CO 0.10 0.84 0.40 0.00 -0.57 0.00 0.00 179.45 180.22 2nr2 h ALA 28 N 1.14 1.04 -0.72 3.86 0.00 0.10 0.20 119.26 124.88 2nr2 h ALA 28 Ca 0.05 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2nr2 h ALA 28 Cb 0.84 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 2nr2 h ALA 28 CO 0.07 0.60 0.42 0.87 0.00 0.00 0.00 179.25 181.21 2nr2 h LYS 29 N 1.14 0.98 -0.68 0.00 1.57 -0.78 -2.16 116.57 116.65 2nr2 h LYS 29 Ca 0.28 -0.10 0.03 0.00 -1.87 0.00 0.00 60.65 58.99 2nr2 h LYS 29 Cb 0.11 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.18 2nr2 h LYS 29 CO -0.04 0.71 0.45 0.82 -0.57 0.00 0.00 179.45 180.82 2nr2 h ILE 30 N 0.98 1.10 -0.90 1.86 2.04 -0.95 -2.14 117.51 119.50 2nr2 h ILE 30 Ca 0.26 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 2nr2 h ILE 30 Cb -0.01 0.21 -0.04 0.00 -0.74 0.00 0.00 36.82 36.24 2nr2 h ILE 30 CO -0.05 0.15 0.50 -0.61 0.00 0.00 0.00 178.15 178.15 2nr2 h GLN 31 N 0.81 1.25 -0.88 2.37 4.15 -0.51 0.37 115.11 122.66 2nr2 h GLN 31 Ca 0.27 -0.14 -0.01 0.00 0.77 0.00 0.00 58.65 59.54 2nr2 h GLN 31 Cb 0.06 -0.25 -0.04 0.00 0.21 0.00 0.00 27.48 27.46 2nr2 h GLN 31 CO -0.07 0.90 0.49 -0.44 -1.93 0.00 0.00 178.83 177.78 2nr2 h ASP 32 N 1.25 1.10 0.01 -0.69 5.19 -1.20 -2.45 116.42 119.64 2nr2 h ASP 32 Ca 0.32 -0.09 -0.00 0.00 -0.62 0.00 0.00 57.03 56.63 2nr2 h ASP 32 Cb 0.01 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 39.24 2nr2 h ASP 32 CO -0.05 0.87 -0.01 0.11 -3.12 0.00 0.00 179.24 177.04 2nr2 h LYS 33 N 1.23 -0.02 0.00 3.56 1.79 -0.91 -3.42 116.57 118.80 2nr2 h LYS 33 Ca 0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.78 2nr2 h LYS 33 Cb 0.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.67 2nr2 h LYS 33 CO -0.05 -0.01 -1.85 0.39 -1.08 0.00 0.00 179.45 176.85 2nr2 n GLU 34 N -2.51 0.60 0.00 3.15 -0.58 0.12 -5.00 120.64 116.43 2nr2 n GLU 34 Ca -0.00 -0.17 0.00 0.00 -0.42 0.00 0.00 57.16 56.57 2nr2 n GLU 34 Cb 0.01 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.40 2nr2 n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2nr2 n GLY 35 N 1.36 1.01 3.70 0.62 0.00 -0.92 -5.02 105.19 105.94 2nr2 n GLY 35 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 2nr2 n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nr2 s ILE 36 N -2.00 5.00 0.48 -0.61 1.01 -1.26 -4.96 121.20 118.87 2nr2 s ILE 36 Ca 0.00 1.50 -0.17 0.00 0.00 0.00 0.00 60.65 61.98 2nr2 s ILE 36 Cb 0.00 -4.07 -0.09 0.00 0.01 0.00 0.00 42.46 38.32 2nr2 s ILE 36 CO 0.00 0.20 0.95 -2.16 0.00 0.00 0.00 174.94 173.93 2nr2 s PRO 37 N 1.13 4.01 0.57 2.79 0.04 -1.26 -3.82 135.00 138.46 2nr2 s PRO 37 Ca 0.38 0.95 0.35 0.00 0.04 0.00 0.00 61.00 62.73 2nr2 s PRO 37 Cb -0.18 -2.18 1.53 0.00 0.04 0.00 0.00 34.50 33.72 2nr2 s PRO 37 CO 0.17 -0.17 2.04 -1.00 0.04 0.00 0.00 177.00 178.08 2nr2 h PRO 38 N 1.26 0.00 -0.47 0.56 0.13 -1.92 -1.51 132.00 130.05 2nr2 h PRO 38 Ca -0.47 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.53 2nr2 h PRO 38 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 2nr2 h PRO 38 CO 0.62 0.00 -0.22 0.38 -0.23 0.00 0.00 178.00 178.55 2nr2 h ASP 39 N 0.00 0.99 -0.12 1.44 3.04 -1.99 -3.31 116.42 116.48 2nr2 h ASP 39 Ca 0.00 -0.37 -0.14 0.00 -3.24 0.00 0.00 57.03 53.28 2nr2 h ASP 39 Cb 0.43 -0.27 0.01 0.00 -1.04 0.00 0.00 39.33 38.45 2nr2 h ASP 39 CO 0.00 1.16 -0.47 -0.61 -2.04 0.00 0.00 179.24 177.28 2nr2 h GLN 40 N 0.83 0.52 -6.86 4.15 4.15 -1.70 -3.47 115.11 112.74 2nr2 h GLN 40 Ca 0.11 -0.41 -0.53 0.00 0.77 0.00 0.00 58.65 58.59 2nr2 h GLN 40 Cb 0.79 0.08 0.09 0.00 0.21 0.00 0.00 27.48 28.65 2nr2 h GLN 40 CO 0.07 1.03 0.84 -0.65 -1.93 0.00 0.00 178.83 178.19 2nr2 s GLN 41 N -3.74 4.12 0.01 1.69 -0.21 -0.70 -1.26 119.66 119.57 2nr2 s GLN 41 Ca -0.13 2.56 0.06 0.00 0.02 0.00 0.00 55.36 57.88 2nr2 s GLN 41 Cb 0.06 -3.00 -0.03 0.00 1.00 0.00 0.00 33.01 31.04 2nr2 s GLN 41 CO 0.82 -0.58 -0.19 0.50 -2.12 0.00 0.00 175.29 173.73 2nr2 s ARG 42 N -1.18 2.18 -0.13 2.91 3.52 -0.33 -4.77 118.95 121.15 2nr2 s ARG 42 Ca 0.59 -0.90 -0.00 0.00 -0.13 0.00 0.00 55.73 55.28 2nr2 s ARG 42 Cb -0.47 -2.20 0.02 0.00 -1.56 0.00 0.00 34.95 30.74 2nr2 s ARG 42 CO 0.54 0.56 -0.10 -0.51 -0.81 0.00 0.00 175.30 174.99 2nr2 s LEU 43 N -1.09 1.41 -0.12 -0.88 1.43 -1.26 -1.52 118.68 116.65 2nr2 s LEU 43 Ca 0.13 -0.40 -0.01 0.00 -1.03 0.00 0.00 54.13 52.82 2nr2 s LEU 43 Cb -0.10 -0.98 -0.02 0.00 0.03 0.00 0.00 46.19 45.11 2nr2 s LEU 43 CO 0.03 -0.10 -0.09 -0.63 0.23 0.00 0.00 176.35 175.79 2nr2 s ILE 44 N 1.62 3.49 0.00 -0.59 1.01 0.50 -0.75 121.20 126.47 2nr2 s ILE 44 Ca 0.05 -0.52 0.00 0.00 0.00 0.00 0.00 60.65 60.18 2nr2 s ILE 44 Cb -0.13 -2.47 -0.00 0.00 0.01 0.00 0.00 42.46 39.87 2nr2 s ILE 44 CO -0.09 0.53 -0.01 0.12 0.00 0.00 0.00 174.94 175.49 2nr2 s PHE 45 N 0.02 0.12 -0.93 3.97 5.36 -0.45 -0.40 117.98 125.67 2nr2 s PHE 45 Ca -0.02 -0.07 0.00 0.00 -0.96 0.00 0.00 56.93 55.88 2nr2 s PHE 45 Cb -0.14 -0.08 0.00 0.00 -0.34 0.00 0.00 43.02 42.47 2nr2 s PHE 45 CO 0.03 -0.02 0.00 0.00 -1.46 0.00 0.00 175.22 173.78 2nr2 n ALA 46 N 2.90 -0.18 -0.67 11.12 0.00 -1.26 -0.53 120.51 131.88 2nr2 n ALA 46 Ca -0.13 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2nr2 n ALA 46 Cb 0.59 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 19.01 2nr2 n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nr2 n GLY 47 N -0.20 0.73 3.62 0.00 0.00 -1.26 -5.03 105.19 103.04 2nr2 n GLY 47 Ca -0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 2nr2 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nr2 s LYS 48 N -0.33 4.02 -0.08 1.61 1.02 0.31 -5.07 119.74 121.21 2nr2 s LYS 48 Ca 0.00 -0.14 -0.30 0.00 0.02 0.00 0.00 55.97 55.55 2nr2 s LYS 48 Cb 0.00 -3.62 -0.02 0.00 -0.52 0.00 0.00 37.83 33.67 2nr2 s LYS 48 CO 0.00 -0.14 1.11 -1.14 -0.92 0.00 0.00 175.35 174.26 2nr2 s GLN 49 N 1.65 4.38 0.15 1.68 0.74 -1.26 -1.34 119.66 125.66 2nr2 s GLN 49 Ca 0.11 1.53 -0.30 0.00 0.05 0.00 0.00 55.36 56.75 2nr2 s GLN 49 Cb -0.15 -3.55 -0.07 0.00 1.10 0.00 0.00 33.01 30.33 2nr2 s GLN 49 CO 0.09 -0.39 0.95 -0.51 -0.55 0.00 0.00 175.29 174.88 2nr2 s LEU 50 N 2.16 4.55 -0.02 3.68 1.43 0.07 -5.00 118.68 125.55 2nr2 s LEU 50 Ca 0.52 1.85 -0.29 0.00 -1.03 0.00 0.00 54.13 55.18 2nr2 s LEU 50 Cb -0.21 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.38 2nr2 s LEU 50 CO 0.20 0.01 0.93 -1.61 0.23 0.00 0.00 176.35 176.11 2nr2 s GLU 51 N -0.39 4.53 0.15 1.70 2.02 -1.26 -4.80 118.70 120.65 2nr2 s GLU 51 Ca 0.45 1.32 -0.16 0.00 0.02 0.00 0.00 54.97 56.60 2nr2 s GLU 51 Cb -0.24 -3.46 0.02 0.00 0.10 0.00 0.00 34.13 30.54 2nr2 s GLU 51 CO 0.31 -0.05 1.81 -0.44 0.02 0.00 0.00 175.26 176.91 2nr2 h ASP 52 N 6.82 0.45 -1.32 -0.19 3.32 -1.95 -2.66 116.42 120.88 2nr2 h ASP 52 Ca -0.40 -0.01 -0.58 0.00 0.02 0.00 0.00 57.03 56.06 2nr2 h ASP 52 Cb 1.21 -0.11 -0.21 0.00 0.22 0.00 0.00 39.33 40.44 2nr2 h ASP 52 CO 0.76 0.33 0.62 0.61 -1.72 0.00 0.00 179.24 179.84 2nr2 n GLY 53 N -1.21 4.76 3.73 2.75 0.00 -1.26 -1.27 105.19 112.70 2nr2 n GLY 53 Ca 0.01 -2.04 -0.31 0.00 0.00 0.00 0.00 46.02 43.67 2nr2 n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nr2 s ARG 54 N -2.54 2.14 0.32 1.61 1.81 -1.00 -4.96 118.95 116.33 2nr2 s ARG 54 Ca 0.55 -2.31 0.04 0.00 -1.72 0.00 0.00 55.73 52.30 2nr2 s ARG 54 Cb 0.40 -1.59 0.04 0.00 -0.45 0.00 0.00 34.95 33.36 2nr2 s ARG 54 CO -0.26 -0.29 0.36 0.25 -0.68 0.00 0.00 175.30 174.68 2nr2 n THR 55 N -1.21 0.00 0.09 0.02 -2.24 -1.26 -0.79 114.28 108.89 2nr2 n THR 55 Ca -0.15 -1.17 -0.04 0.00 -2.27 0.00 0.00 64.05 60.42 2nr2 n THR 55 Cb 0.67 -0.51 -0.02 0.00 -2.10 0.00 0.00 70.33 68.37 2nr2 n THR 55 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2nr2 h LEU 56 N 0.00 0.00 -0.66 3.22 3.38 -1.13 -3.22 115.31 116.90 2nr2 h LEU 56 Ca -0.17 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.66 2nr2 h LEU 56 Cb 0.72 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 2nr2 h LEU 56 CO 0.26 0.83 -0.64 -1.28 0.09 0.00 0.00 178.44 177.70 2nr2 h SER 57 N 0.00 0.00 -0.10 -0.43 0.87 -1.36 -1.38 113.55 111.15 2nr2 h SER 57 Ca -0.01 0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.58 2nr2 h SER 57 Cb 1.54 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.50 2nr2 h SER 57 CO 0.11 0.64 0.08 0.44 -0.53 0.00 0.00 176.83 177.57 2nr2 h ASP 58 N 0.00 0.00 -0.67 6.23 3.32 -1.83 -1.37 116.42 122.09 2nr2 h ASP 58 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2nr2 h ASP 58 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2nr2 h ASP 58 CO 0.08 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.38 2nr2 n TYR 59 N -4.35 0.89 -3.71 4.55 4.01 -1.16 -4.99 117.16 112.40 2nr2 n TYR 59 Ca -0.01 -0.45 -0.29 0.00 -0.16 0.00 0.00 57.90 57.00 2nr2 n TYR 59 Cb 0.19 -0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.24 2nr2 n TYR 59 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2nr2 n ASN 60 N 1.64 -5.30 -4.51 7.72 4.13 -0.52 -4.99 115.26 113.42 2nr2 n ASN 60 Ca 0.24 -0.94 -0.36 0.00 1.68 0.00 0.00 54.58 55.20 2nr2 n ASN 60 Cb 0.62 -2.81 -0.12 0.00 -1.54 0.00 0.00 39.78 35.93 2nr2 n ASN 60 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2nr2 s ILE 61 N -3.28 4.59 0.18 2.41 1.01 -0.54 -5.03 121.20 120.54 2nr2 s ILE 61 Ca 0.29 -0.08 0.02 0.00 0.00 0.00 0.00 60.65 60.87 2nr2 s ILE 61 Cb -0.12 -3.14 0.03 0.00 0.01 0.00 0.00 42.46 39.24 2nr2 s ILE 61 CO 0.88 0.34 0.24 0.00 0.00 0.00 0.00 174.94 176.41 2nr2 n GLN 62 N 4.69 0.69 -2.09 2.79 6.02 -1.26 -4.59 117.38 123.63 2nr2 n GLN 62 Ca -0.16 -0.81 -0.33 0.00 -0.01 0.00 0.00 57.00 55.69 2nr2 n GLN 62 Cb 0.52 -0.11 0.01 0.00 1.02 0.00 0.00 30.24 31.67 2nr2 n GLN 62 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 2nr2 s LYS 63 N -2.89 3.31 -1.26 -1.09 0.00 -1.26 -3.98 119.74 112.56 2nr2 s LYS 63 Ca 0.17 1.30 -0.03 0.00 0.00 0.00 0.00 55.97 57.41 2nr2 s LYS 63 Cb -0.01 -2.03 0.01 0.00 0.00 0.00 0.00 37.83 35.80 2nr2 s LYS 63 CO 0.11 -0.83 1.04 0.39 0.00 0.00 0.00 175.35 176.06 2nr2 n GLU 64 N -1.87 -6.95 -4.13 1.78 1.02 0.28 -5.01 120.64 105.77 2nr2 n GLU 64 Ca 0.09 0.83 -0.34 0.00 -0.02 0.00 0.00 57.16 57.72 2nr2 n GLU 64 Cb 0.52 -5.83 -0.07 0.00 -0.02 0.00 0.00 31.44 26.04 2nr2 n GLU 64 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2nr2 s SER 65 N -4.01 5.70 -0.26 1.62 0.15 -1.26 -4.87 113.70 110.78 2nr2 s SER 65 Ca 0.20 0.21 -0.06 0.00 0.70 0.00 0.00 55.95 57.00 2nr2 s SER 65 Cb -0.09 -1.68 -0.01 0.00 -1.71 0.00 0.00 66.02 62.54 2nr2 s SER 65 CO 0.74 0.33 0.04 -0.89 1.20 0.00 0.00 173.24 174.65 2nr2 s THR 66 N -1.08 3.89 0.14 6.45 2.01 -1.25 0.07 115.64 125.86 2nr2 s THR 66 Ca 0.19 -0.47 -0.11 0.00 0.31 0.00 0.00 61.69 61.61 2nr2 s THR 66 Cb -0.12 -2.88 -0.06 0.00 0.01 0.00 0.00 72.50 69.45 2nr2 s THR 66 CO 0.09 0.27 0.47 -0.76 -0.69 0.00 0.00 174.62 174.00 2nr2 s LEU 67 N 1.53 4.30 -0.31 4.42 1.43 -0.80 -4.88 118.68 124.38 2nr2 s LEU 67 Ca 0.05 0.88 -0.09 0.00 -1.03 0.00 0.00 54.13 53.94 2nr2 s LEU 67 Cb -0.16 -3.24 -0.00 0.00 0.03 0.00 0.00 46.19 42.82 2nr2 s LEU 67 CO 0.01 0.09 0.13 -1.00 0.23 0.00 0.00 176.35 175.81 2nr2 s HIS 68 N -1.53 3.17 -0.32 0.29 3.76 0.47 -1.03 115.29 120.09 2nr2 s HIS 68 Ca 0.38 -0.67 -0.22 0.00 -0.15 0.00 0.00 55.06 54.40 2nr2 s HIS 68 Cb -0.14 -2.33 0.00 0.00 1.11 0.00 0.00 32.58 31.23 2nr2 s HIS 68 CO 0.20 -0.49 0.73 -1.17 -0.85 0.00 0.00 174.74 173.16 2nr2 s LEU 69 N 1.58 4.13 0.00 0.89 0.20 -0.75 -0.37 118.68 124.36 2nr2 s LEU 69 Ca 0.04 0.47 0.00 0.00 0.69 0.00 0.00 54.13 55.33 2nr2 s LEU 69 Cb -0.17 -2.96 0.00 0.00 -0.43 0.00 0.00 46.19 42.63 2nr2 s LEU 69 CO 0.05 -0.60 0.01 0.52 -0.29 0.00 0.00 176.35 176.04 2nr2 n VAL 70 N 5.56 0.00 -4.45 1.68 0.31 -0.58 -4.10 118.33 116.75 2nr2 n VAL 70 Ca 0.02 -2.12 -0.23 0.00 -0.01 0.00 0.00 64.34 62.00 2nr2 n VAL 70 Cb 0.48 0.41 -0.13 0.00 -0.91 0.00 0.00 33.84 33.69 2nr2 n VAL 70 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2nr2 s LEU 71 N 0.00 2.20 0.37 7.52 1.43 -1.26 -1.18 118.68 127.75 2nr2 s LEU 71 Ca 0.01 -0.53 -0.25 0.00 -1.03 0.00 0.00 54.13 52.32 2nr2 s LEU 71 Cb -0.00 -0.80 -0.09 0.00 0.03 0.00 0.00 46.19 45.33 2nr2 s LEU 71 CO 0.00 0.08 1.06 -0.60 0.23 0.00 0.00 176.35 177.13 2nr2 s ARG 72 N -1.32 4.29 0.05 1.70 3.52 -0.39 -4.87 118.95 121.93 2nr2 s ARG 72 Ca 0.05 1.59 0.01 0.00 -0.13 0.00 0.00 55.73 57.24 2nr2 s ARG 72 Cb -0.09 -2.72 -0.04 0.00 -1.56 0.00 0.00 34.95 30.55 2nr2 s ARG 72 CO 0.02 -0.04 0.12 -1.17 -0.81 0.00 0.00 175.30 173.41 2nr2 s LEU 73 N -2.32 3.99 0.05 -0.88 2.96 -1.26 -5.02 118.68 116.20 2nr2 s LEU 73 Ca 0.54 0.12 0.05 0.00 -0.22 0.00 0.00 54.13 54.62 2nr2 s LEU 73 Cb -0.25 -2.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.88 2nr2 s LEU 73 CO 0.31 0.21 -0.13 -0.60 -1.32 0.00 0.00 176.35 174.81 2nr2 s ARG 74 N -2.20 0.86 0.00 1.98 3.52 -1.26 -4.85 118.95 116.99 2nr2 s ARG 74 Ca 0.29 -0.79 0.00 0.00 -0.13 0.00 0.00 55.73 55.09 2nr2 s ARG 74 Cb -0.12 -0.85 0.00 0.00 -1.56 0.00 0.00 34.95 32.42 2nr2 s ARG 74 CO 0.21 0.20 0.00 0.41 -0.81 0.00 0.00 175.30 175.31 2nr2 n GLY 75 N 1.73 3.81 0.00 8.12 0.00 -1.26 -5.32 105.19 112.27 2nr2 n GLY 75 Ca -0.19 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.19 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93