#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 3.53 0.29 3.17 -2.07 -1.26 -0.23 119.66 123.09 2nr2 s GLN 2 Ca 0.00 -0.24 0.03 0.00 -1.82 0.00 0.00 55.36 53.33 2nr2 s GLN 2 Cb 0.00 -2.98 -0.06 0.00 -1.09 0.00 0.00 33.01 28.88 2nr2 s GLN 2 CO 0.00 0.57 0.06 0.96 -1.32 0.00 0.00 175.29 175.56 2nr2 s ILE 3 N -1.51 0.98 -0.17 3.63 -4.36 -0.75 0.00 121.20 119.02 2nr2 s ILE 3 Ca 0.35 -2.01 -0.02 0.00 -0.26 0.00 0.00 60.65 58.71 2nr2 s ILE 3 Cb -0.13 -2.66 -0.01 0.00 1.25 0.00 0.00 42.46 40.91 2nr2 s ILE 3 CO 0.24 -0.07 -0.09 -0.36 0.24 0.00 0.00 174.94 174.90 2nr2 s PHE 4 N -3.45 2.89 -0.24 1.37 0.08 0.91 -2.49 117.98 117.06 2nr2 s PHE 4 Ca 0.35 -0.74 -0.02 0.00 0.12 0.00 0.00 56.93 56.64 2nr2 s PHE 4 Cb 0.08 -1.96 0.02 0.00 -0.57 0.00 0.00 43.02 40.59 2nr2 s PHE 4 CO 0.14 -0.33 -0.07 0.08 -0.10 0.00 0.00 175.22 174.94 2nr2 s VAL 5 N 0.80 2.93 -0.28 -0.44 1.01 0.08 -1.25 120.40 123.26 2nr2 s VAL 5 Ca -0.03 -0.90 -0.18 0.00 0.00 0.00 0.00 61.98 60.87 2nr2 s VAL 5 Cb -0.15 -2.44 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 2nr2 s VAL 5 CO 0.01 0.27 0.54 -0.54 0.00 0.00 0.00 175.10 175.38 2nr2 s LYS 6 N 1.36 3.99 1.11 2.72 -0.14 -0.85 -0.63 119.74 127.30 2nr2 s LYS 6 Ca 0.02 0.27 -0.19 0.00 -1.36 0.00 0.00 55.97 54.72 2nr2 s LYS 6 Cb -0.16 -3.68 0.26 0.00 -1.68 0.00 0.00 37.83 32.57 2nr2 s LYS 6 CO -0.05 -0.42 1.24 0.95 -0.76 0.00 0.00 175.35 176.31 2nr2 s THR 7 N 2.37 1.77 0.23 2.17 -4.23 -1.14 -1.38 115.64 115.43 2nr2 s THR 7 Ca 0.22 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.64 2nr2 s THR 7 Cb -0.15 -2.76 0.20 0.00 1.34 0.00 0.00 72.50 71.13 2nr2 s THR 7 CO 0.10 0.00 1.88 -0.07 -0.54 0.00 0.00 174.62 175.99 2nr2 h LEU 8 N -2.21 1.02 0.16 4.79 3.38 -1.94 -3.15 115.31 117.37 2nr2 h LEU 8 Ca -0.43 -0.05 -0.33 0.00 0.09 0.00 0.00 57.88 57.15 2nr2 h LEU 8 Cb 1.25 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2nr2 h LEU 8 CO 0.31 0.77 -1.66 0.71 0.09 0.00 0.00 178.44 178.66 2nr2 h THR 9 N 1.18 1.03 0.00 0.22 1.35 -1.95 -3.48 112.91 111.25 2nr2 h THR 9 Ca 0.31 -2.63 0.00 0.00 -0.55 0.00 0.00 66.41 63.54 2nr2 h THR 9 Cb -0.08 2.77 0.00 0.00 -1.73 0.00 0.00 68.15 69.11 2nr2 h THR 9 CO -0.06 0.84 0.00 0.61 -0.25 0.00 0.00 175.52 176.65 2nr2 n GLY 10 N 1.78 0.11 3.73 5.82 0.00 -1.19 -5.13 105.19 110.30 2nr2 n GLY 10 Ca -0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 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 4.43 -0.40 1.61 2.20 -1.26 -4.84 119.74 121.47 2nr2 s LYS 11 Ca 0.00 0.88 -0.21 0.00 -0.36 0.00 0.00 55.97 56.28 2nr2 s LYS 11 Cb 0.00 -3.42 0.01 0.00 -1.51 0.00 0.00 37.83 32.92 2nr2 s LYS 11 CO 0.00 0.15 0.66 0.99 -0.36 0.00 0.00 175.35 176.79 2nr2 s THR 12 N 0.50 4.83 -0.31 3.43 2.01 -1.26 -2.86 115.64 121.98 2nr2 s THR 12 Ca 0.36 0.37 -0.16 0.00 0.31 0.00 0.00 61.69 62.57 2nr2 s THR 12 Cb -0.18 -4.16 -0.02 0.00 0.01 0.00 0.00 72.50 68.15 2nr2 s THR 12 CO 0.19 -0.48 0.41 -0.63 -0.69 0.00 0.00 174.62 173.42 2nr2 s ILE 13 N 2.83 5.12 -0.47 1.82 -1.09 0.19 -4.93 121.20 124.68 2nr2 s ILE 13 Ca 0.24 0.37 -0.15 0.00 -2.23 0.00 0.00 60.65 58.88 2nr2 s ILE 13 Cb -0.14 -3.81 0.07 0.00 -1.58 0.00 0.00 42.46 37.00 2nr2 s ILE 13 CO 0.18 -0.02 0.39 -0.89 -1.23 0.00 0.00 174.94 173.36 2nr2 s THR 14 N 2.15 5.19 0.01 2.92 2.01 -1.26 -0.74 115.64 125.92 2nr2 s THR 14 Ca 0.15 -1.08 -0.01 0.00 0.31 0.00 0.00 61.69 61.06 2nr2 s THR 14 Cb -0.16 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.21 2nr2 s THR 14 CO 0.11 -0.58 0.11 -0.76 -0.69 0.00 0.00 174.62 172.82 2nr2 s LEU 15 N 1.63 4.04 0.00 4.42 1.43 -1.04 -4.96 118.68 124.20 2nr2 s LEU 15 Ca 0.04 0.19 -0.16 0.00 -1.03 0.00 0.00 54.13 53.17 2nr2 s LEU 15 Cb -0.24 -2.41 -0.06 0.00 0.03 0.00 0.00 46.19 43.51 2nr2 s LEU 15 CO 0.06 0.26 0.44 -0.70 0.23 0.00 0.00 176.35 176.64 2nr2 s GLU 16 N -1.89 4.01 0.26 1.70 2.56 -1.26 -1.81 118.70 122.28 2nr2 s GLU 16 Ca 0.25 0.48 0.03 0.00 0.00 0.00 0.00 54.97 55.73 2nr2 s GLU 16 Cb -0.12 -3.24 -0.01 0.00 2.00 0.00 0.00 34.13 32.75 2nr2 s GLU 16 CO 0.17 0.64 0.28 1.33 -0.56 0.00 0.00 175.26 177.11 2nr2 n VAL 17 N 1.95 0.00 -4.37 3.70 0.24 0.68 -4.94 118.33 115.60 2nr2 n VAL 17 Ca -0.13 -1.73 -0.19 0.00 -2.04 0.00 0.00 64.34 60.25 2nr2 n VAL 17 Cb 0.52 0.92 -0.10 0.00 -1.47 0.00 0.00 33.84 33.71 2nr2 n VAL 17 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2nr2 s GLU 18 N -2.91 1.40 0.60 7.34 0.41 -1.26 -0.33 118.70 123.96 2nr2 s GLU 18 Ca 0.28 -1.64 0.37 0.00 -0.41 0.00 0.00 54.97 53.56 2nr2 s GLU 18 Cb 0.01 -1.17 1.94 0.00 -1.78 0.00 0.00 34.13 33.13 2nr2 s GLU 18 CO 0.20 0.16 2.23 -1.35 -0.49 0.00 0.00 175.26 176.01 2nr2 h PRO 19 N 2.48 0.00 -0.00 0.39 0.11 -1.95 -1.89 132.00 131.13 2nr2 h PRO 19 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2nr2 h PRO 19 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2nr2 h PRO 19 CO 0.63 0.03 -0.10 -1.13 -0.21 0.00 0.00 178.00 177.22 2nr2 n SER 20 N -3.34 0.34 -4.77 -2.05 3.41 -1.26 -1.01 113.62 104.93 2nr2 n SER 20 Ca -0.02 -0.39 -0.38 0.00 -0.26 0.00 0.00 58.87 57.82 2nr2 n SER 20 Cb 0.15 -0.13 -0.06 0.00 -0.26 0.00 0.00 64.21 63.91 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 -2.56 7.41 0.57 4.04 1.01 -0.71 -4.80 116.67 121.62 2nr2 s ASP 21 Ca 0.27 1.79 -0.04 0.00 0.71 0.00 0.00 52.55 55.28 2nr2 s ASP 21 Cb 0.20 -2.56 0.01 0.00 1.01 0.00 0.00 42.92 41.58 2nr2 s ASP 21 CO 0.49 0.06 0.86 0.42 0.21 0.00 0.00 175.17 177.20 2nr2 s THR 22 N -1.40 3.59 0.29 -1.27 -4.23 -1.26 -1.48 115.64 109.87 2nr2 s THR 22 Ca 0.44 -0.14 -0.01 0.00 -1.18 0.00 0.00 61.69 60.80 2nr2 s THR 22 Cb -0.21 -3.41 0.19 0.00 1.34 0.00 0.00 72.50 70.40 2nr2 s THR 22 CO 0.26 -0.39 1.87 0.40 -0.54 0.00 0.00 174.62 176.22 2nr2 h ILE 23 N -0.08 1.22 -0.83 2.99 1.08 -1.41 -2.68 117.51 117.80 2nr2 h ILE 23 Ca -0.45 -0.68 0.10 0.00 -0.39 0.00 0.00 64.86 63.44 2nr2 h ILE 23 Cb 1.26 0.50 -0.07 0.00 -3.07 0.00 0.00 36.82 35.44 2nr2 h ILE 23 CO 0.60 0.27 0.47 -0.08 -0.69 0.00 0.00 178.15 178.72 2nr2 h GLU 24 N 0.87 0.76 -0.53 2.37 4.81 -1.59 -2.48 114.58 118.78 2nr2 h GLU 24 Ca 0.21 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.35 2nr2 h GLU 24 Cb 0.18 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.36 2nr2 h GLU 24 CO -0.02 0.50 0.18 -0.91 -0.73 0.00 0.00 179.01 178.03 2nr2 h ASN 25 N 0.78 0.72 -0.18 1.04 2.35 -1.77 -1.66 115.58 116.86 2nr2 h ASN 25 Ca 0.40 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 56.05 2nr2 h ASN 25 Cb 0.39 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 2nr2 h ASN 25 CO -0.26 0.68 0.11 0.58 -1.65 0.00 0.00 177.43 176.89 2nr2 h VAL 26 N 0.77 1.04 -0.71 2.81 2.07 -1.43 0.25 116.25 121.04 2nr2 h VAL 26 Ca 0.18 -0.08 0.08 0.00 0.82 0.00 0.00 66.70 67.70 2nr2 h VAL 26 Cb 0.20 0.78 -0.06 0.00 -1.52 0.00 0.00 31.29 30.69 2nr2 h VAL 26 CO -0.01 0.04 0.39 0.11 0.02 0.00 0.00 177.57 178.12 2nr2 h LYS 27 N 0.23 0.67 -0.48 1.57 1.57 -0.93 -0.22 116.57 118.99 2nr2 h LYS 27 Ca 0.07 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.74 2nr2 h LYS 27 Cb -0.02 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 2nr2 h LYS 27 CO -0.02 0.44 0.04 0.00 -0.57 0.00 0.00 179.45 179.34 2nr2 h ALA 28 N 1.39 1.17 0.01 3.86 0.00 -0.99 -2.40 119.26 122.29 2nr2 h ALA 28 Ca 0.33 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 55.03 2nr2 h ALA 28 Cb 0.27 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 2nr2 h ALA 28 CO -0.22 0.55 -0.24 0.87 0.00 0.00 0.00 179.25 180.20 2nr2 h LYS 29 N 0.73 -0.37 -0.53 0.00 1.57 -0.61 -1.92 116.57 115.45 2nr2 h LYS 29 Ca 0.15 0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.98 2nr2 h LYS 29 Cb 0.39 0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 2nr2 h LYS 29 CO 0.01 -0.25 0.35 0.82 -0.57 0.00 0.00 179.45 179.82 2nr2 h ILE 30 N -0.38 1.08 -0.31 1.86 2.04 -0.99 -1.41 117.51 119.39 2nr2 h ILE 30 Ca 0.06 -0.22 -0.14 0.00 1.00 0.00 0.00 64.86 65.57 2nr2 h ILE 30 Cb 0.46 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.93 2nr2 h ILE 30 CO -0.21 0.11 -0.36 -0.61 0.00 0.00 0.00 178.15 177.09 2nr2 h GLN 31 N 0.63 0.71 -0.54 2.37 4.15 -1.29 -1.69 115.11 119.45 2nr2 h GLN 31 Ca 0.21 -0.34 -0.07 0.00 0.77 0.00 0.00 58.65 59.21 2nr2 h GLN 31 Cb 0.06 -0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.73 2nr2 h GLN 31 CO -0.05 0.95 0.06 0.22 -1.93 0.00 0.00 178.83 178.08 2nr2 h ASP 32 N 0.59 0.88 0.00 -0.69 3.58 -0.84 -3.21 116.42 116.72 2nr2 h ASP 32 Ca 0.06 -0.28 0.00 0.00 0.42 0.00 0.00 57.03 57.23 2nr2 h ASP 32 Cb 0.88 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.70 2nr2 h ASP 32 CO 0.08 0.93 0.00 0.29 -2.88 0.00 0.00 179.24 177.66 2nr2 n LYS 33 N -4.34 0.00 0.01 0.28 4.76 -0.58 -4.49 118.16 113.80 2nr2 n LYS 33 Ca 0.02 0.02 0.05 0.00 -2.87 0.00 0.00 58.31 55.52 2nr2 n LYS 33 Cb 0.28 -0.89 -0.11 0.00 -1.84 0.00 0.00 35.03 32.47 2nr2 n LYS 33 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2nr2 n GLU 34 N -0.41 0.64 -0.97 1.97 -0.58 -0.68 -5.01 120.64 115.60 2nr2 n GLU 34 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2nr2 n GLU 34 Cb 0.00 -1.65 0.00 0.00 -0.57 0.00 0.00 31.44 29.22 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 1.37 0.66 3.62 0.62 0.00 -1.01 -5.04 105.19 105.40 2nr2 n GLY 35 Ca -0.10 -0.25 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.09 4.52 0.34 -0.61 1.01 -1.25 -4.99 121.20 118.13 2nr2 s ILE 36 Ca 0.00 -0.14 -0.28 0.00 0.00 0.00 0.00 60.65 60.23 2nr2 s ILE 36 Cb 0.00 -3.00 -0.10 0.00 0.01 0.00 0.00 42.46 39.37 2nr2 s ILE 36 CO 0.00 0.50 1.28 -2.84 0.00 0.00 0.00 174.94 173.88 2nr2 s PRO 37 N 0.09 4.32 0.03 2.79 0.02 -1.26 -3.89 135.00 137.10 2nr2 s PRO 37 Ca 0.03 2.14 0.23 0.00 0.02 0.00 0.00 61.00 63.42 2nr2 s PRO 37 Cb -0.13 -3.02 0.94 0.00 0.02 0.00 0.00 34.50 32.31 2nr2 s PRO 37 CO 0.01 -0.19 1.72 -0.35 -0.33 0.00 0.00 177.00 177.86 2nr2 n PRO 38 N 0.72 0.03 -0.34 5.54 -0.04 -1.26 -1.94 135.00 137.70 2nr2 n PRO 38 Ca 0.01 0.14 0.04 0.00 -0.04 0.00 0.00 63.50 63.64 2nr2 n PRO 38 Cb 0.43 -1.54 0.17 0.00 -0.04 0.00 0.00 33.50 32.51 2nr2 n PRO 38 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2nr2 n ASP 39 N -1.59 2.78 -0.03 3.54 8.00 -1.26 -3.65 116.55 124.34 2nr2 n ASP 39 Ca 0.05 -2.32 -0.03 0.00 0.71 0.00 0.00 54.79 53.21 2nr2 n ASP 39 Cb 0.27 -0.50 -0.04 0.00 -0.02 0.00 0.00 41.12 40.83 2nr2 n ASP 39 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 2nr2 n GLN 40 N 0.31 2.70 -2.86 -1.24 7.27 -0.82 -4.96 117.38 117.78 2nr2 n GLN 40 Ca 0.12 0.00 -0.42 0.00 0.07 0.00 0.00 57.00 56.78 2nr2 n GLN 40 Cb 0.58 -1.12 -0.04 0.00 2.41 0.00 0.00 30.24 32.07 2nr2 n GLN 40 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 2nr2 s GLN 41 N -2.12 4.25 -0.18 3.69 -0.21 -1.24 -1.15 119.66 122.71 2nr2 s GLN 41 Ca -0.03 1.03 -0.00 0.00 0.02 0.00 0.00 55.36 56.37 2nr2 s GLN 41 Cb 0.02 -3.61 0.00 0.00 1.00 0.00 0.00 33.01 30.42 2nr2 s GLN 41 CO 0.19 -0.43 -0.15 1.03 -2.12 0.00 0.00 175.29 173.81 2nr2 s ARG 42 N 2.52 3.17 -0.30 2.91 0.52 -0.14 -4.99 118.95 122.63 2nr2 s ARG 42 Ca 0.38 -0.75 -0.16 0.00 -0.52 0.00 0.00 55.73 54.68 2nr2 s ARG 42 Cb -0.16 -2.69 -0.02 0.00 0.52 0.00 0.00 34.95 32.60 2nr2 s ARG 42 CO 0.10 -0.12 0.41 -0.51 0.02 0.00 0.00 175.30 175.20 2nr2 s LEU 43 N 1.15 4.21 -0.23 2.53 2.01 -1.26 -0.62 118.68 126.46 2nr2 s LEU 43 Ca 0.01 0.10 -0.09 0.00 0.01 0.00 0.00 54.13 54.16 2nr2 s LEU 43 Cb -0.14 -2.45 -0.05 0.00 0.01 0.00 0.00 46.19 43.56 2nr2 s LEU 43 CO -0.06 -0.29 0.13 -0.63 1.01 0.00 0.00 176.35 176.51 2nr2 s ILE 44 N 2.14 5.09 -0.21 -0.59 -1.09 -0.53 0.04 121.20 126.05 2nr2 s ILE 44 Ca 0.15 0.09 -0.05 0.00 -2.23 0.00 0.00 60.65 58.61 2nr2 s ILE 44 Cb -0.16 -3.36 0.10 0.00 -1.58 0.00 0.00 42.46 37.46 2nr2 s ILE 44 CO 0.11 0.36 0.38 0.12 -1.23 0.00 0.00 174.94 174.68 2nr2 s PHE 45 N 1.02 -0.75 -0.67 3.97 5.36 -0.65 -1.55 117.98 124.73 2nr2 s PHE 45 Ca 0.06 1.13 -0.02 0.00 -0.96 0.00 0.00 56.93 57.15 2nr2 s PHE 45 Cb -0.14 0.12 0.00 0.00 -0.34 0.00 0.00 43.02 42.67 2nr2 s PHE 45 CO 0.04 -0.57 0.57 0.00 -1.46 0.00 0.00 175.22 173.80 2nr2 n ALA 46 N 5.37 -0.94 0.00 11.12 0.00 -1.26 -3.21 120.51 131.59 2nr2 n ALA 46 Ca -0.06 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2nr2 n ALA 46 Cb 0.50 -2.13 0.00 0.00 0.00 0.00 0.00 19.45 17.81 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 -1.16 1.50 3.92 0.00 0.00 -1.26 -5.00 105.19 103.20 2nr2 n GLY 47 Ca -0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 2nr2 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nr2 s LYS 48 N 0.00 3.30 -0.00 1.61 -2.85 -1.20 -5.08 119.74 115.52 2nr2 s LYS 48 Ca 0.00 -0.74 -0.11 0.00 -1.00 0.00 0.00 55.97 54.12 2nr2 s LYS 48 Cb 0.00 -2.85 -0.05 0.00 -2.06 0.00 0.00 37.83 32.87 2nr2 s LYS 48 CO 0.00 0.47 0.33 1.14 0.10 0.00 0.00 175.35 177.40 2nr2 s GLN 49 N -3.52 3.74 0.01 1.78 -2.07 -1.26 -1.63 119.66 116.70 2nr2 s GLN 49 Ca 0.34 0.18 -0.19 0.00 -1.82 0.00 0.00 55.36 53.86 2nr2 s GLN 49 Cb -0.10 -3.14 -0.06 0.00 -1.09 0.00 0.00 33.01 28.62 2nr2 s GLN 49 CO 0.27 0.67 0.55 -0.51 -1.32 0.00 0.00 175.29 174.96 2nr2 s LEU 50 N -1.36 4.44 0.21 2.60 1.43 0.11 -4.96 118.68 121.15 2nr2 s LEU 50 Ca 0.25 1.13 -0.31 0.00 -1.03 0.00 0.00 54.13 54.17 2nr2 s LEU 50 Cb -0.15 -2.85 -0.10 0.00 0.03 0.00 0.00 46.19 43.13 2nr2 s LEU 50 CO 0.13 0.17 1.48 -0.70 0.23 0.00 0.00 176.35 177.66 2nr2 s GLU 51 N -0.49 4.25 0.09 1.70 2.56 -1.26 -4.68 118.70 120.88 2nr2 s GLU 51 Ca 0.29 2.30 -0.22 0.00 0.00 0.00 0.00 54.97 57.34 2nr2 s GLU 51 Cb -0.18 -3.13 -0.14 0.00 2.00 0.00 0.00 34.13 32.68 2nr2 s GLU 51 CO 0.17 -0.48 1.74 -0.44 -0.56 0.00 0.00 175.26 175.69 2nr2 h ASP 52 N 5.73 0.04 -1.55 -1.70 3.32 -1.96 -3.00 116.42 117.29 2nr2 h ASP 52 Ca -0.45 -0.00 -0.72 0.00 0.02 0.00 0.00 57.03 55.88 2nr2 h ASP 52 Cb 1.21 -0.01 -0.28 0.00 0.22 0.00 0.00 39.33 40.47 2nr2 h ASP 52 CO 0.83 0.03 0.92 0.61 -1.72 0.00 0.00 179.24 179.91 2nr2 n GLY 53 N -1.09 5.70 2.96 2.75 0.00 -1.26 -1.70 105.19 112.55 2nr2 n GLY 53 Ca -0.06 -2.42 -0.24 0.00 0.00 0.00 0.00 46.02 43.30 2nr2 n GLY 53 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2nr2 s ARG 54 N -3.95 1.41 1.07 1.61 3.52 -1.13 -5.04 118.95 116.43 2nr2 s ARG 54 Ca 0.57 -0.28 -0.12 0.00 -0.13 0.00 0.00 55.73 55.77 2nr2 s ARG 54 Cb 0.47 -1.29 0.23 0.00 -1.56 0.00 0.00 34.95 32.80 2nr2 s ARG 54 CO -0.23 -0.07 1.06 0.95 -0.81 0.00 0.00 175.30 176.20 2nr2 s THR 55 N 0.99 2.12 0.04 4.11 -4.23 -1.26 -2.49 115.64 114.92 2nr2 s THR 55 Ca -0.09 0.04 -0.18 0.00 -1.18 0.00 0.00 61.69 60.28 2nr2 s THR 55 Cb -0.15 -2.19 -0.19 0.00 1.34 0.00 0.00 72.50 71.31 2nr2 s THR 55 CO -0.00 -0.05 1.21 -0.07 -0.54 0.00 0.00 174.62 175.17 2nr2 h LEU 56 N -2.28 0.64 -0.75 4.79 3.38 -1.15 -3.13 115.31 116.81 2nr2 h LEU 56 Ca -0.56 -0.67 -0.00 0.00 0.09 0.00 0.00 57.88 56.74 2nr2 h LEU 56 Cb 1.31 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 2nr2 h LEU 56 CO 0.50 1.21 0.47 -1.28 0.09 0.00 0.00 178.44 179.43 2nr2 h SER 57 N 0.12 0.89 -0.90 -0.43 0.87 -1.22 0.18 113.55 113.05 2nr2 h SER 57 Ca -0.05 -0.05 0.10 0.00 -1.23 0.00 0.00 61.79 60.56 2nr2 h SER 57 Cb 1.22 -0.22 -0.07 0.00 -0.44 0.00 0.00 62.40 62.89 2nr2 h SER 57 CO 0.12 0.68 0.58 -0.78 -0.53 0.00 0.00 176.83 176.89 2nr2 h ASP 58 N 1.03 0.82 1.51 6.23 1.82 -1.81 -2.45 116.42 123.56 2nr2 h ASP 58 Ca 0.27 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.93 2nr2 h ASP 58 Cb -0.06 -0.15 0.00 0.00 0.68 0.00 0.00 39.33 39.80 2nr2 h ASP 58 CO -0.05 0.48 -0.08 1.88 -1.61 0.00 0.00 179.24 179.86 2nr2 h TYR 59 N 0.90 0.00 -0.86 0.28 0.05 -1.42 -3.48 116.97 112.44 2nr2 h TYR 59 Ca 0.42 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 59.15 2nr2 h TYR 59 Cb 0.40 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.14 2nr2 h TYR 59 CO -0.00 0.00 -0.06 0.09 -1.05 0.00 0.00 178.16 177.14 2nr2 n ASN 60 N -2.42 -1.95 -4.60 3.88 5.03 -0.56 -5.07 115.26 109.58 2nr2 n ASN 60 Ca 0.05 -0.03 -0.41 0.00 0.87 0.00 0.00 54.58 55.06 2nr2 n ASN 60 Cb 0.45 -0.96 -0.06 0.00 -1.02 0.00 0.00 39.78 38.19 2nr2 n ASN 60 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2nr2 s ILE 61 N -2.54 4.92 0.46 2.41 1.01 0.52 -4.97 121.20 123.01 2nr2 s ILE 61 Ca 0.03 0.92 0.04 0.00 0.00 0.00 0.00 60.65 61.64 2nr2 s ILE 61 Cb -0.01 -4.02 0.04 0.00 0.01 0.00 0.00 42.46 38.48 2nr2 s ILE 61 CO 0.03 -0.15 0.33 0.00 0.00 0.00 0.00 174.94 175.16 2nr2 n GLN 62 N 5.92 0.81 -1.35 2.79 6.02 -1.26 -4.12 117.38 126.19 2nr2 n GLN 62 Ca -0.00 -2.93 -0.35 0.00 -0.01 0.00 0.00 57.00 53.71 2nr2 n GLN 62 Cb 0.49 0.34 0.10 0.00 1.02 0.00 0.00 30.24 32.19 2nr2 n GLN 62 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 2nr2 n LYS 63 N -1.57 0.54 -2.45 -1.09 2.85 -1.26 -3.71 118.16 111.48 2nr2 n LYS 63 Ca -0.03 0.25 -0.16 0.00 -1.05 0.00 0.00 58.31 57.32 2nr2 n LYS 63 Cb 0.53 -2.42 0.00 0.00 -0.65 0.00 0.00 35.03 32.50 2nr2 n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2nr2 n GLU 64 N -2.54 -1.93 -3.71 -1.58 1.02 0.10 -4.97 120.64 107.02 2nr2 n GLU 64 Ca 0.14 0.74 -0.30 0.00 -0.02 0.00 0.00 57.16 57.73 2nr2 n GLU 64 Cb 0.49 -5.12 -0.04 0.00 -0.02 0.00 0.00 31.44 26.76 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 -2.43 6.43 -0.34 1.62 0.15 -1.24 -4.85 113.70 113.03 2nr2 s SER 65 Ca 0.06 0.46 -0.06 0.00 0.70 0.00 0.00 55.95 57.12 2nr2 s SER 65 Cb -0.03 -2.04 0.04 0.00 -1.71 0.00 0.00 66.02 62.29 2nr2 s SER 65 CO 0.08 0.02 0.10 -0.89 1.20 0.00 0.00 173.24 173.76 2nr2 s THR 66 N -1.74 3.72 0.00 6.45 2.01 -1.26 -0.06 115.64 124.77 2nr2 s THR 66 Ca 0.39 -1.18 0.01 0.00 0.31 0.00 0.00 61.69 61.22 2nr2 s THR 66 Cb -0.12 -3.13 -0.04 0.00 0.01 0.00 0.00 72.50 69.23 2nr2 s THR 66 CO 0.27 -0.20 0.04 -0.76 -0.69 0.00 0.00 174.62 173.28 2nr2 s LEU 67 N 1.39 3.68 -0.17 4.42 1.43 -0.38 -4.93 118.68 124.11 2nr2 s LEU 67 Ca -0.02 0.05 -0.04 0.00 -1.03 0.00 0.00 54.13 53.10 2nr2 s LEU 67 Cb -0.20 -2.14 -0.02 0.00 0.03 0.00 0.00 46.19 43.86 2nr2 s LEU 67 CO 0.02 0.27 -0.03 -1.00 0.23 0.00 0.00 176.35 175.84 2nr2 s HIS 68 N -1.15 3.01 -0.25 0.29 3.76 -0.59 -2.01 115.29 118.35 2nr2 s HIS 68 Ca 0.21 -0.42 -0.17 0.00 -0.15 0.00 0.00 55.06 54.54 2nr2 s HIS 68 Cb -0.12 -2.00 -0.03 0.00 1.11 0.00 0.00 32.58 31.54 2nr2 s HIS 68 CO 0.12 -0.15 0.45 -1.17 -0.85 0.00 0.00 174.74 173.14 2nr2 s LEU 69 N 0.65 4.06 0.09 0.89 2.96 -0.48 -1.46 118.68 125.39 2nr2 s LEU 69 Ca -0.02 0.44 0.06 0.00 -0.22 0.00 0.00 54.13 54.39 2nr2 s LEU 69 Cb -0.14 -2.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.95 2nr2 s LEU 69 CO 0.02 -0.22 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.10 2nr2 s VAL 70 N 2.06 3.72 -0.07 1.68 1.01 0.21 -4.10 120.40 124.91 2nr2 s VAL 70 Ca 0.19 -1.08 0.04 0.00 0.00 0.00 0.00 61.98 61.12 2nr2 s VAL 70 Cb -0.16 -2.75 0.00 0.00 0.00 0.00 0.00 36.38 33.48 2nr2 s VAL 70 CO 0.09 0.14 -0.19 -0.76 0.00 0.00 0.00 175.10 174.38 2nr2 s LEU 71 N -2.19 1.91 0.77 3.92 1.43 -1.26 -0.97 118.68 122.30 2nr2 s LEU 71 Ca 0.23 -0.43 -0.11 0.00 -1.03 0.00 0.00 54.13 52.79 2nr2 s LEU 71 Cb -0.11 -1.13 0.05 0.00 0.03 0.00 0.00 46.19 45.03 2nr2 s LEU 71 CO 0.15 0.13 1.08 0.00 0.23 0.00 0.00 176.35 177.94 2nr2 s ARG 72 N 0.33 2.29 -0.20 1.70 1.70 -0.30 -4.92 118.95 119.55 2nr2 s ARG 72 Ca -0.13 0.91 -0.29 0.00 -0.47 0.00 0.00 55.73 55.75 2nr2 s ARG 72 Cb -0.16 -1.92 -0.04 0.00 -0.57 0.00 0.00 34.95 32.26 2nr2 s ARG 72 CO 0.05 -1.54 1.94 -0.51 -1.08 0.00 0.00 175.30 174.16 2nr2 s LEU 73 N -5.80 3.72 0.37 -1.89 1.43 -1.26 -4.96 118.68 110.28 2nr2 s LEU 73 Ca 0.60 1.82 -0.25 0.00 -1.03 0.00 0.00 54.13 55.27 2nr2 s LEU 73 Cb -0.16 -3.52 -0.09 0.00 0.03 0.00 0.00 46.19 42.45 2nr2 s LEU 73 CO 0.55 -1.60 1.05 0.00 0.23 0.00 0.00 176.35 176.59 2nr2 s ARG 74 N 5.51 4.27 0.00 1.70 1.70 -1.26 -4.72 118.95 126.15 2nr2 s ARG 74 Ca 0.87 1.56 0.00 0.00 -0.47 0.00 0.00 55.73 57.69 2nr2 s ARG 74 Cb -0.30 -2.67 0.00 0.00 -0.57 0.00 0.00 34.95 31.41 2nr2 s ARG 74 CO 0.34 -0.06 0.00 0.41 -1.08 0.00 0.00 175.30 174.91 2nr2 n GLY 75 N 0.51 -0.08 1.33 3.88 0.00 -1.26 -5.30 105.19 104.26 2nr2 n GLY 75 Ca 0.04 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93