#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 2.64 0.02 3.17 0.74 -1.26 -0.94 119.66 124.03 2nr2 s GLN 2 Ca 0.00 -0.64 0.02 0.00 0.05 0.00 0.00 55.36 54.78 2nr2 s GLN 2 Cb 0.00 -2.54 -0.02 0.00 1.10 0.00 0.00 33.01 31.56 2nr2 s GLN 2 CO 0.00 0.63 -0.06 0.96 -0.55 0.00 0.00 175.29 176.27 2nr2 s ILE 3 N -0.91 0.42 -0.38 -2.34 -4.36 0.40 -0.64 121.20 113.40 2nr2 s ILE 3 Ca 0.15 -0.72 -0.10 0.00 -0.26 0.00 0.00 60.65 59.71 2nr2 s ILE 3 Cb -0.11 -0.45 0.03 0.00 1.25 0.00 0.00 42.46 43.18 2nr2 s ILE 3 CO 0.05 -0.21 0.20 -0.36 0.24 0.00 0.00 174.94 174.85 2nr2 s PHE 4 N -0.90 3.25 -0.50 1.37 0.08 -0.35 -1.21 117.98 119.72 2nr2 s PHE 4 Ca -0.06 -1.08 -0.15 0.00 0.12 0.00 0.00 56.93 55.75 2nr2 s PHE 4 Cb -0.07 -2.47 0.10 0.00 -0.57 0.00 0.00 43.02 40.01 2nr2 s PHE 4 CO 0.00 -0.68 0.43 0.08 -0.10 0.00 0.00 175.22 174.95 2nr2 s VAL 5 N 1.52 5.15 -0.09 -0.44 1.01 0.63 0.61 120.40 128.79 2nr2 s VAL 5 Ca 0.01 -1.26 -0.18 0.00 0.00 0.00 0.00 61.98 60.55 2nr2 s VAL 5 Cb -0.20 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 2nr2 s VAL 5 CO 0.06 -0.69 0.48 -0.75 0.00 0.00 0.00 175.10 174.19 2nr2 s LYS 6 N 1.61 4.29 0.43 2.72 2.20 0.04 0.05 119.74 131.08 2nr2 s LYS 6 Ca 0.04 0.47 0.06 0.00 -0.36 0.00 0.00 55.97 56.18 2nr2 s LYS 6 Cb -0.26 -3.40 0.01 0.00 -1.51 0.00 0.00 37.83 32.66 2nr2 s LYS 6 CO 0.05 0.24 0.59 0.95 -0.36 0.00 0.00 175.35 176.82 2nr2 s THR 7 N 0.36 3.19 0.26 3.43 -4.23 -0.43 -0.54 115.64 117.68 2nr2 s THR 7 Ca 0.26 -0.91 0.01 0.00 -1.18 0.00 0.00 61.69 59.87 2nr2 s THR 7 Cb -0.16 -3.10 0.05 0.00 1.34 0.00 0.00 72.50 70.64 2nr2 s THR 7 CO 0.11 -0.05 1.69 -0.07 -0.54 0.00 0.00 174.62 175.76 2nr2 h LEU 8 N 0.57 0.55 -0.54 4.79 3.38 -1.89 -3.16 115.31 119.01 2nr2 h LEU 8 Ca -0.42 -0.20 -0.16 0.00 0.09 0.00 0.00 57.88 57.20 2nr2 h LEU 8 Cb 1.28 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 2nr2 h LEU 8 CO 0.48 0.80 -0.56 0.71 0.09 0.00 0.00 178.44 179.97 2nr2 h THR 9 N 0.48 1.33 0.00 0.22 1.35 -1.96 -3.47 112.91 110.86 2nr2 h THR 9 Ca 0.07 -1.82 0.00 0.00 -0.55 0.00 0.00 66.41 64.10 2nr2 h THR 9 Cb 0.71 1.81 0.00 0.00 -1.73 0.00 0.00 68.15 68.94 2nr2 h THR 9 CO 0.05 0.56 0.00 0.61 -0.25 0.00 0.00 175.52 176.50 2nr2 n GLY 10 N 0.25 0.47 3.73 5.82 0.00 -1.19 -5.14 105.19 109.13 2nr2 n GLY 10 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 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 4.68 -0.22 1.61 2.20 -1.26 -4.86 119.74 121.89 2nr2 s LYS 11 Ca 0.00 1.43 -0.10 0.00 -0.36 0.00 0.00 55.97 56.93 2nr2 s LYS 11 Cb 0.00 -3.38 -0.05 0.00 -1.51 0.00 0.00 37.83 32.89 2nr2 s LYS 11 CO 0.00 0.21 0.15 0.99 -0.36 0.00 0.00 175.35 176.34 2nr2 s THR 12 N 0.03 5.38 -0.30 3.43 2.01 -1.26 -1.31 115.64 123.62 2nr2 s THR 12 Ca 0.47 0.20 -0.10 0.00 0.31 0.00 0.00 61.69 62.56 2nr2 s THR 12 Cb -0.23 -3.49 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 2nr2 s THR 12 CO 0.29 0.39 0.17 -0.63 -0.69 0.00 0.00 174.62 174.15 2nr2 s ILE 13 N 0.75 4.90 -0.31 1.82 1.01 0.11 -4.94 121.20 124.54 2nr2 s ILE 13 Ca 0.08 -0.16 -0.15 0.00 0.00 0.00 0.00 60.65 60.41 2nr2 s ILE 13 Cb -0.12 -3.42 -0.02 0.00 0.01 0.00 0.00 42.46 38.90 2nr2 s ILE 13 CO 0.02 0.15 0.39 -0.89 0.00 0.00 0.00 174.94 174.61 2nr2 s THR 14 N 1.68 5.15 0.13 2.92 2.01 -1.26 -0.27 115.64 126.00 2nr2 s THR 14 Ca 0.06 0.36 0.11 0.00 0.31 0.00 0.00 61.69 62.52 2nr2 s THR 14 Cb -0.16 -3.78 -0.04 0.00 0.01 0.00 0.00 72.50 68.53 2nr2 s THR 14 CO 0.08 0.02 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.02 2nr2 s LEU 15 N 2.10 2.41 -0.12 4.42 1.43 -0.35 -5.00 118.68 123.57 2nr2 s LEU 15 Ca 0.14 -0.72 -0.06 0.00 -1.03 0.00 0.00 54.13 52.46 2nr2 s LEU 15 Cb -0.16 -1.29 -0.04 0.00 0.03 0.00 0.00 46.19 44.74 2nr2 s LEU 15 CO 0.11 0.18 0.12 -1.61 0.23 0.00 0.00 176.35 175.37 2nr2 s GLU 16 N -2.12 3.38 0.25 1.70 2.02 -1.26 -0.46 118.70 122.21 2nr2 s GLU 16 Ca 0.15 -0.17 -0.12 0.00 0.02 0.00 0.00 54.97 54.85 2nr2 s GLU 16 Cb -0.10 -3.13 -0.01 0.00 0.10 0.00 0.00 34.13 30.99 2nr2 s GLU 16 CO 0.07 0.76 0.46 0.14 0.02 0.00 0.00 175.26 176.71 2nr2 s VAL 17 N -1.00 0.00 0.21 2.63 -7.23 -0.11 -4.96 120.40 109.94 2nr2 s VAL 17 Ca 0.15 -1.45 0.07 0.00 -1.81 0.00 0.00 61.98 58.93 2nr2 s VAL 17 Cb -0.12 -2.25 -0.04 0.00 0.56 0.00 0.00 36.38 34.53 2nr2 s VAL 17 CO 0.04 0.00 0.09 -1.61 -0.31 0.00 0.00 175.10 173.30 2nr2 s GLU 18 N -3.97 2.66 0.55 4.82 0.41 -1.26 0.24 118.70 122.15 2nr2 s GLU 18 Ca 0.24 -1.08 0.33 0.00 -0.41 0.00 0.00 54.97 54.06 2nr2 s GLU 18 Cb -0.00 -2.46 1.50 0.00 -1.78 0.00 0.00 34.13 31.39 2nr2 s GLU 18 CO 0.10 0.44 2.04 -1.35 -0.49 0.00 0.00 175.26 176.00 2nr2 h PRO 19 N 2.19 0.00 0.00 0.39 0.11 -1.94 -1.77 132.00 130.98 2nr2 h PRO 19 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2nr2 h PRO 19 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2nr2 h PRO 19 CO 0.61 0.05 0.00 -1.13 -0.21 0.00 0.00 178.00 177.32 2nr2 n SER 20 N -3.21 0.00 -4.83 -2.05 3.41 -1.26 -1.46 113.62 104.21 2nr2 n SER 20 Ca -0.00 0.14 -0.32 0.00 -0.26 0.00 0.00 58.87 58.43 2nr2 n SER 20 Cb 0.27 -0.33 -0.00 0.00 -0.26 0.00 0.00 64.21 63.89 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 -2.66 6.16 0.56 4.04 1.01 -0.67 -4.82 116.67 120.29 2nr2 s ASP 21 Ca 0.14 1.62 0.01 0.00 0.71 0.00 0.00 52.55 55.03 2nr2 s ASP 21 Cb 0.11 -2.51 0.03 0.00 1.01 0.00 0.00 42.92 41.57 2nr2 s ASP 21 CO 0.27 -0.91 0.79 0.42 0.21 0.00 0.00 175.17 175.95 2nr2 s THR 22 N -2.73 2.72 0.36 -1.27 -4.23 -1.26 -0.87 115.64 108.37 2nr2 s THR 22 Ca 0.59 -0.62 0.11 0.00 -1.18 0.00 0.00 61.69 60.59 2nr2 s THR 22 Cb -0.12 -3.03 0.10 0.00 1.34 0.00 0.00 72.50 70.78 2nr2 s THR 22 CO 0.40 -0.02 1.83 0.40 -0.54 0.00 0.00 174.62 176.68 2nr2 h ILE 23 N 0.04 1.25 -0.97 2.99 1.08 -1.29 -1.95 117.51 118.65 2nr2 h ILE 23 Ca -0.42 -1.19 0.06 0.00 -0.39 0.00 0.00 64.86 62.92 2nr2 h ILE 23 Cb 1.30 1.57 -0.07 0.00 -3.07 0.00 0.00 36.82 36.55 2nr2 h ILE 23 CO 0.53 0.35 0.62 -0.08 -0.69 0.00 0.00 178.15 178.88 2nr2 h GLU 24 N 0.09 1.10 0.00 2.37 4.81 -1.72 -1.12 114.58 120.10 2nr2 h GLU 24 Ca 0.01 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 2nr2 h GLU 24 Cb 0.62 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 2nr2 h GLU 24 CO 0.04 0.73 -0.17 -0.91 -0.73 0.00 0.00 179.01 177.97 2nr2 h ASN 25 N 1.13 0.00 0.08 1.04 2.35 -1.67 -1.10 115.58 117.41 2nr2 h ASN 25 Ca 0.42 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 56.05 2nr2 h ASN 25 Cb 0.17 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.55 2nr2 h ASN 25 CO -0.17 0.17 -0.50 0.58 -1.65 0.00 0.00 177.43 175.85 2nr2 h VAL 26 N 0.00 1.61 0.00 2.81 2.07 -0.94 -2.99 116.25 118.81 2nr2 h VAL 26 Ca -0.00 -2.44 -0.03 0.00 0.82 0.00 0.00 66.70 65.05 2nr2 h VAL 26 Cb 0.60 3.24 -0.00 0.00 -1.52 0.00 0.00 31.29 33.61 2nr2 h VAL 26 CO 0.02 0.67 -0.16 0.11 0.02 0.00 0.00 177.57 178.23 2nr2 h LYS 27 N -0.58 0.00 0.00 1.57 1.57 -1.22 -1.87 116.57 116.03 2nr2 h LYS 27 Ca -0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2nr2 h LYS 27 Cb 1.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.70 2nr2 h LYS 27 CO 0.10 0.16 0.00 0.00 -0.57 0.00 0.00 179.45 179.13 2nr2 h ALA 28 N 1.84 1.00 0.10 3.86 0.00 -1.31 -1.55 119.26 123.20 2nr2 h ALA 28 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.61 2nr2 h ALA 28 Cb 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2nr2 h ALA 28 CO 0.02 0.00 -1.51 -0.22 0.00 0.00 0.00 179.25 177.54 2nr2 h LYS 29 N 0.00 0.20 0.00 0.00 3.64 -1.20 -2.48 116.57 116.74 2nr2 h LYS 29 Ca 0.00 -0.35 -0.04 0.00 -1.27 0.00 0.00 60.65 58.99 2nr2 h LYS 29 Cb 0.83 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.78 2nr2 h LYS 29 CO 0.00 1.05 -0.17 0.82 -2.27 0.00 0.00 179.45 178.88 2nr2 h ILE 30 N 0.06 0.34 -0.26 2.00 2.04 -1.35 0.14 117.51 120.48 2nr2 h ILE 30 Ca -0.23 -1.21 -0.15 0.00 1.00 0.00 0.00 64.86 64.27 2nr2 h ILE 30 Cb 1.99 1.94 -0.01 0.00 -0.74 0.00 0.00 36.82 40.01 2nr2 h ILE 30 CO 0.15 0.17 -0.46 -0.61 0.00 0.00 0.00 178.15 177.40 2nr2 h GLN 31 N 0.00 0.68 0.62 2.37 4.15 -1.27 -1.18 115.11 120.47 2nr2 h GLN 31 Ca -0.00 -0.38 -0.03 0.00 0.77 0.00 0.00 58.65 59.01 2nr2 h GLN 31 Cb 0.93 0.02 0.01 0.00 0.21 0.00 0.00 27.48 28.65 2nr2 h GLN 31 CO 0.02 0.99 -0.30 0.22 -1.93 0.00 0.00 178.83 177.84 2nr2 h ASP 32 N 0.54 -0.70 0.82 -0.69 1.82 -1.08 -2.94 116.42 114.19 2nr2 h ASP 32 Ca 0.03 0.00 -0.04 0.00 -0.39 0.00 0.00 57.03 56.64 2nr2 h ASP 32 Cb 1.00 0.18 0.00 0.00 0.68 0.00 0.00 39.33 41.20 2nr2 h ASP 32 CO 0.09 -0.32 -0.44 0.50 -1.61 0.00 0.00 179.24 177.47 2nr2 h LYS 33 N -1.18 -1.12 0.00 0.28 3.64 -1.00 -3.40 116.57 113.79 2nr2 h LYS 33 Ca -0.09 0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2nr2 h LYS 33 Cb 0.66 0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.74 2nr2 h LYS 33 CO 0.14 -0.74 0.00 0.39 -2.27 0.00 0.00 179.45 176.97 2nr2 n GLU 34 N -5.60 0.00 0.00 1.90 -0.58 -0.47 -5.05 120.64 110.84 2nr2 n GLU 34 Ca -0.15 0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.68 2nr2 n GLU 34 Cb 0.47 -0.44 0.00 0.00 -0.57 0.00 0.00 31.44 30.90 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 2.06 0.12 3.66 0.62 0.00 -1.05 -4.99 105.19 105.61 2nr2 n GLY 35 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 2nr2 n GLY 35 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2nr2 n ILE 36 N 0.00 0.66 -1.76 -0.61 5.41 -1.25 -4.83 119.36 116.98 2nr2 n ILE 36 Ca 0.00 -0.14 -0.38 0.00 1.00 0.00 0.00 62.75 63.23 2nr2 n ILE 36 Cb 0.00 -2.12 0.05 0.00 -0.71 0.00 0.00 39.64 36.86 2nr2 n ILE 36 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2nr2 s PRO 37 N 4.42 3.00 0.44 0.38 0.04 -1.26 -3.75 135.00 138.27 2nr2 s PRO 37 Ca 0.92 2.22 0.29 0.00 0.04 0.00 0.00 61.00 64.47 2nr2 s PRO 37 Cb -0.55 -2.17 1.08 0.00 0.04 0.00 0.00 34.50 32.90 2nr2 s PRO 37 CO 0.46 -1.30 1.85 -1.00 0.04 0.00 0.00 177.00 177.06 2nr2 h PRO 38 N 1.26 0.00 0.00 0.56 0.13 -1.93 -2.31 132.00 129.71 2nr2 h PRO 38 Ca -0.51 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.59 2nr2 h PRO 38 Cb 1.31 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.44 2nr2 h PRO 38 CO 0.56 0.00 -0.14 0.38 -0.23 0.00 0.00 178.00 178.58 2nr2 h ASP 39 N 0.00 0.00 1.16 1.44 2.03 -1.97 -3.01 116.42 116.07 2nr2 h ASP 39 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2nr2 h ASP 39 Cb 0.56 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.06 2nr2 h ASP 39 CO 0.00 0.14 -0.68 -0.61 -1.03 0.00 0.00 179.24 177.06 2nr2 h GLN 40 N 0.00 0.00 -5.06 4.15 4.15 -1.77 -3.45 115.11 113.14 2nr2 h GLN 40 Ca -0.00 0.00 -0.65 0.00 0.77 0.00 0.00 58.65 58.77 2nr2 h GLN 40 Cb 0.77 0.00 -0.16 0.00 0.21 0.00 0.00 27.48 28.30 2nr2 h GLN 40 CO 0.02 0.00 -0.23 -0.65 -1.93 0.00 0.00 178.83 176.04 2nr2 s GLN 41 N -3.27 3.68 -0.26 1.69 -0.21 -1.14 -1.14 119.66 119.00 2nr2 s GLN 41 Ca 0.03 -0.26 -0.09 0.00 0.02 0.00 0.00 55.36 55.06 2nr2 s GLN 41 Cb 0.10 -3.77 -0.04 0.00 1.00 0.00 0.00 33.01 30.30 2nr2 s GLN 41 CO 0.74 -0.49 0.12 0.50 -2.12 0.00 0.00 175.29 174.04 2nr2 s ARG 42 N 2.11 3.76 -0.23 2.91 3.52 -0.24 -4.95 118.95 125.82 2nr2 s ARG 42 Ca 0.14 -0.43 -0.05 0.00 -0.13 0.00 0.00 55.73 55.26 2nr2 s ARG 42 Cb -0.16 -3.47 -0.02 0.00 -1.56 0.00 0.00 34.95 29.74 2nr2 s ARG 42 CO 0.12 -0.20 0.00 -0.51 -0.81 0.00 0.00 175.30 173.90 2nr2 s LEU 43 N 1.67 3.13 -0.20 -0.88 1.43 -1.26 -0.43 118.68 122.14 2nr2 s LEU 43 Ca 0.07 -0.30 -0.07 0.00 -1.03 0.00 0.00 54.13 52.79 2nr2 s LEU 43 Cb -0.16 -1.81 -0.04 0.00 0.03 0.00 0.00 46.19 44.22 2nr2 s LEU 43 CO 0.07 -0.01 0.06 -0.63 0.23 0.00 0.00 176.35 176.06 2nr2 s ILE 44 N 1.44 4.55 -0.05 -0.59 1.01 0.50 -1.43 121.20 126.62 2nr2 s ILE 44 Ca 0.05 -0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.60 2nr2 s ILE 44 Cb -0.15 -3.07 0.02 0.00 0.01 0.00 0.00 42.46 39.28 2nr2 s ILE 44 CO -0.00 0.42 -0.04 0.12 0.00 0.00 0.00 174.94 175.44 2nr2 s PHE 45 N 0.77 0.79 -1.27 3.97 5.36 0.26 -0.97 117.98 126.89 2nr2 s PHE 45 Ca 0.03 -0.24 -0.16 0.00 -0.96 0.00 0.00 56.93 55.60 2nr2 s PHE 45 Cb -0.14 -0.72 0.16 0.00 -0.34 0.00 0.00 43.02 41.98 2nr2 s PHE 45 CO 0.02 -0.23 0.40 0.00 -1.46 0.00 0.00 175.22 173.96 2nr2 n ALA 46 N 4.24 -0.91 0.00 11.12 0.00 -1.26 -1.75 120.51 131.94 2nr2 n ALA 46 Ca -0.22 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.08 2nr2 n ALA 46 Cb 0.51 -1.74 0.00 0.00 0.00 0.00 0.00 19.45 18.21 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 -0.86 3.10 3.77 0.00 0.00 -1.26 -5.05 105.19 104.89 2nr2 n GLY 47 Ca 0.08 -0.94 -0.38 0.00 0.00 0.00 0.00 46.02 44.79 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 0.00 4.17 -0.38 1.61 1.02 -0.72 -5.04 119.74 120.41 2nr2 s LYS 48 Ca 0.00 1.74 -0.15 0.00 0.02 0.00 0.00 55.97 57.58 2nr2 s LYS 48 Cb 0.00 -2.71 0.00 0.00 -0.52 0.00 0.00 37.83 34.60 2nr2 s LYS 48 CO 0.00 -0.19 0.31 -0.65 -0.92 0.00 0.00 175.35 173.90 2nr2 s GLN 49 N -2.23 3.27 0.24 1.68 1.11 -1.26 -0.57 119.66 121.90 2nr2 s GLN 49 Ca 0.55 -0.75 -0.30 0.00 0.01 0.00 0.00 55.36 54.87 2nr2 s GLN 49 Cb -0.28 -3.89 -0.09 0.00 -1.01 0.00 0.00 33.01 27.74 2nr2 s GLN 49 CO 0.36 -0.62 0.99 -0.51 0.01 0.00 0.00 175.29 175.52 2nr2 s LEU 50 N 1.81 4.60 0.24 2.90 1.43 -0.52 -4.99 118.68 124.14 2nr2 s LEU 50 Ca 0.07 2.03 -0.26 0.00 -1.03 0.00 0.00 54.13 54.94 2nr2 s LEU 50 Cb -0.18 -3.61 -0.09 0.00 0.03 0.00 0.00 46.19 42.34 2nr2 s LEU 50 CO 0.11 0.04 0.86 -1.61 0.23 0.00 0.00 176.35 175.98 2nr2 s GLU 51 N -1.10 4.61 0.17 1.70 2.02 -1.26 -4.71 118.70 120.13 2nr2 s GLU 51 Ca 0.43 1.26 -0.16 0.00 0.02 0.00 0.00 54.97 56.52 2nr2 s GLU 51 Cb -0.28 -3.09 0.11 0.00 0.10 0.00 0.00 34.13 30.97 2nr2 s GLU 51 CO 0.34 0.45 1.71 -0.44 0.02 0.00 0.00 175.26 177.35 2nr2 h ASP 52 N 3.84 -0.08 -1.84 -0.19 5.19 -1.94 -3.28 116.42 118.11 2nr2 h ASP 52 Ca -0.46 0.08 -0.78 0.00 -0.62 0.00 0.00 57.03 55.25 2nr2 h ASP 52 Cb 1.20 0.13 -0.20 0.00 0.18 0.00 0.00 39.33 40.64 2nr2 h ASP 52 CO 0.66 -0.01 1.64 0.61 -3.12 0.00 0.00 179.24 179.02 2nr2 n GLY 53 N -1.26 5.45 3.20 2.75 0.00 -1.26 -2.15 105.19 111.92 2nr2 n GLY 53 Ca 0.03 -2.33 -0.19 0.00 0.00 0.00 0.00 46.02 43.52 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 -2.23 0.89 0.67 1.61 1.81 -1.24 -5.03 118.95 115.43 2nr2 s ARG 54 Ca 0.43 -1.01 -0.05 0.00 -1.72 0.00 0.00 55.73 53.38 2nr2 s ARG 54 Cb 0.15 -0.93 0.06 0.00 -0.45 0.00 0.00 34.95 33.78 2nr2 s ARG 54 CO -0.06 0.21 0.96 0.95 -0.68 0.00 0.00 175.30 176.68 2nr2 s THR 55 N -1.33 2.36 0.30 0.02 -4.23 -1.26 -1.93 115.64 109.58 2nr2 s THR 55 Ca 0.00 -0.37 0.11 0.00 -1.18 0.00 0.00 61.69 60.25 2nr2 s THR 55 Cb -0.10 -2.99 0.01 0.00 1.34 0.00 0.00 72.50 70.76 2nr2 s THR 55 CO 0.03 0.00 1.68 -0.07 -0.54 0.00 0.00 174.62 175.72 2nr2 h LEU 56 N -0.44 0.01 -0.13 4.79 3.38 -0.98 -3.08 115.31 118.86 2nr2 h LEU 56 Ca -0.44 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.37 2nr2 h LEU 56 Cb 1.31 -0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.06 2nr2 h LEU 56 CO 0.58 0.54 -0.52 0.77 0.09 0.00 0.00 178.44 179.90 2nr2 h SER 57 N 0.01 0.67 -0.56 -0.43 4.64 -1.48 0.15 113.55 116.55 2nr2 h SER 57 Ca -0.00 -0.62 0.06 0.00 -0.47 0.00 0.00 61.79 60.75 2nr2 h SER 57 Cb 0.95 -0.20 -0.09 0.00 -0.31 0.00 0.00 62.40 62.75 2nr2 h SER 57 CO 0.07 1.18 -0.54 -0.78 -0.87 0.00 0.00 176.83 175.89 2nr2 h ASP 58 N 0.21 -1.88 0.00 4.97 3.58 -1.86 -2.28 116.42 119.16 2nr2 h ASP 58 Ca -0.03 0.26 0.00 0.00 0.42 0.00 0.00 57.03 57.68 2nr2 h ASP 58 Cb 1.15 0.79 0.00 0.00 1.72 0.00 0.00 39.33 42.99 2nr2 h ASP 58 CO 0.11 -0.34 0.00 -1.22 -2.88 0.00 0.00 179.24 174.91 2nr2 n TYR 59 N -5.22 0.00 -3.78 0.28 4.01 -1.17 -4.89 117.16 106.40 2nr2 n TYR 59 Ca -0.02 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.49 2nr2 n TYR 59 Cb 0.30 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.35 2nr2 n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2nr2 n ASN 60 N -0.81 -1.42 -4.66 7.72 5.15 -0.86 -5.00 115.26 115.38 2nr2 n ASN 60 Ca 0.10 -0.85 -0.38 0.00 -0.60 0.00 0.00 54.58 52.85 2nr2 n ASN 60 Cb 0.05 -3.84 -0.08 0.00 -0.53 0.00 0.00 39.78 35.38 2nr2 n ASN 60 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2nr2 s ILE 61 N -3.68 5.21 0.00 -1.44 1.01 0.52 -5.01 121.20 117.81 2nr2 s ILE 61 Ca 0.08 0.65 0.00 0.00 0.00 0.00 0.00 60.65 61.39 2nr2 s ILE 61 Cb -0.04 -3.71 0.00 0.00 0.01 0.00 0.00 42.46 38.72 2nr2 s ILE 61 CO 0.83 0.25 0.00 0.00 0.00 0.00 0.00 174.94 176.02 2nr2 n GLN 62 N 4.54 3.19 -2.16 2.79 6.02 -1.26 -4.51 117.38 125.99 2nr2 n GLN 62 Ca -0.09 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.50 2nr2 n GLN 62 Cb 0.51 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.75 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 0.63 4.39 -0.66 -1.09 -2.85 -1.26 -3.91 119.74 114.98 2nr2 s LYS 63 Ca 0.00 2.16 -0.03 0.00 -1.00 0.00 0.00 55.97 57.10 2nr2 s LYS 63 Cb 0.00 -3.09 0.00 0.00 -2.06 0.00 0.00 37.83 32.68 2nr2 s LYS 63 CO 0.00 -0.15 0.45 0.39 0.10 0.00 0.00 175.35 176.14 2nr2 n GLU 64 N 0.97 -3.19 -3.33 1.78 1.02 0.19 -4.99 120.64 113.10 2nr2 n GLU 64 Ca 0.00 0.40 -0.41 0.00 -0.02 0.00 0.00 57.16 57.13 2nr2 n GLU 64 Cb 0.42 -4.13 -0.09 0.00 -0.02 0.00 0.00 31.44 27.62 2nr2 n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2nr2 s SER 65 N -3.05 6.24 -0.67 1.62 0.01 -1.25 -4.82 113.70 111.78 2nr2 s SER 65 Ca 0.23 -0.13 -0.27 0.00 1.31 0.00 0.00 55.95 57.09 2nr2 s SER 65 Cb -0.10 -2.23 0.03 0.00 0.21 0.00 0.00 66.02 63.93 2nr2 s SER 65 CO 0.28 -0.40 1.23 -0.89 0.41 0.00 0.00 173.24 173.87 2nr2 s THR 66 N 2.19 3.87 0.00 1.44 2.01 -1.26 -1.21 115.64 122.68 2nr2 s THR 66 Ca 0.15 0.57 -0.20 0.00 0.31 0.00 0.00 61.69 62.52 2nr2 s THR 66 Cb -0.16 -4.83 -0.05 0.00 0.01 0.00 0.00 72.50 67.47 2nr2 s THR 66 CO 0.12 -1.63 0.58 -0.76 -0.69 0.00 0.00 174.62 172.24 2nr2 s LEU 67 N 5.34 4.43 -0.49 4.42 1.43 0.20 -4.76 118.68 129.24 2nr2 s LEU 67 Ca 0.37 1.15 -0.17 0.00 -1.03 0.00 0.00 54.13 54.45 2nr2 s LEU 67 Cb -0.08 -2.90 0.07 0.00 0.03 0.00 0.00 46.19 43.31 2nr2 s LEU 67 CO 0.19 0.13 0.51 -1.00 0.23 0.00 0.00 176.35 176.40 2nr2 s HIS 68 N -0.31 3.15 -0.30 0.29 3.76 -0.14 -0.78 115.29 120.96 2nr2 s HIS 68 Ca 0.30 -0.78 -0.29 0.00 -0.15 0.00 0.00 55.06 54.15 2nr2 s HIS 68 Cb -0.18 -3.37 0.00 0.00 1.11 0.00 0.00 32.58 30.14 2nr2 s HIS 68 CO 0.17 -0.92 1.27 -1.17 -0.85 0.00 0.00 174.74 173.23 2nr2 s LEU 69 N 2.09 3.90 -0.17 0.89 2.96 0.30 -0.37 118.68 128.29 2nr2 s LEU 69 Ca 0.09 1.20 -0.04 0.00 -0.22 0.00 0.00 54.13 55.16 2nr2 s LEU 69 Cb -0.22 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.90 2nr2 s LEU 69 CO 0.09 -1.04 -0.02 -0.69 -1.32 0.00 0.00 176.35 173.37 2nr2 s VAL 70 N 4.23 3.98 0.32 1.68 1.01 0.43 -3.74 120.40 128.30 2nr2 s VAL 70 Ca 0.55 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 62.23 2nr2 s VAL 70 Cb -0.16 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.43 2nr2 s VAL 70 CO 0.22 0.48 0.49 -0.76 0.00 0.00 0.00 175.10 175.52 2nr2 s LEU 71 N 0.50 4.08 -0.64 3.92 1.43 -1.26 -1.08 118.68 125.63 2nr2 s LEU 71 Ca -0.02 0.23 -0.18 0.00 -1.03 0.00 0.00 54.13 53.13 2nr2 s LEU 71 Cb -0.14 -3.08 0.12 0.00 0.03 0.00 0.00 46.19 43.13 2nr2 s LEU 71 CO 0.02 -0.27 0.72 -0.60 0.23 0.00 0.00 176.35 176.45 2nr2 s ARG 72 N -4.21 3.14 0.06 1.70 3.52 -0.29 -4.91 118.95 117.97 2nr2 s ARG 72 Ca 0.39 -1.54 -0.04 0.00 -0.13 0.00 0.00 55.73 54.42 2nr2 s ARG 72 Cb -0.09 -4.34 -0.05 0.00 -1.56 0.00 0.00 34.95 28.91 2nr2 s ARG 72 CO 0.33 -1.51 0.28 -0.51 -0.81 0.00 0.00 175.30 173.08 2nr2 s LEU 73 N 2.26 4.34 -0.18 -0.88 1.43 -1.26 -4.92 118.68 119.47 2nr2 s LEU 73 Ca 0.13 0.47 -0.23 0.00 -1.03 0.00 0.00 54.13 53.46 2nr2 s LEU 73 Cb -0.22 -2.93 -0.02 0.00 0.03 0.00 0.00 46.19 43.05 2nr2 s LEU 73 CO 0.03 0.17 0.75 -0.13 0.23 0.00 0.00 176.35 177.40 2nr2 s ARG 74 N -2.23 4.26 0.00 1.70 1.81 -1.26 -4.48 118.95 118.75 2nr2 s ARG 74 Ca 0.33 0.86 0.00 0.00 -1.72 0.00 0.00 55.73 55.20 2nr2 s ARG 74 Cb -0.13 -3.57 0.00 0.00 -0.45 0.00 0.00 34.95 30.80 2nr2 s ARG 74 CO 0.22 -0.29 0.00 0.41 -0.68 0.00 0.00 175.30 174.96 2nr2 n GLY 75 N 3.59 1.46 0.00 -3.53 0.00 -1.26 -5.32 105.19 100.13 2nr2 n GLY 75 Ca 0.02 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.58 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93