#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 3.37 0.34 3.17 1.11 -1.26 -0.42 119.66 125.97 2nr2 s GLN 2 Ca 0.00 -0.42 0.09 0.00 0.01 0.00 0.00 55.36 55.04 2nr2 s GLN 2 Cb 0.00 -2.91 -0.06 0.00 -1.01 0.00 0.00 33.01 29.02 2nr2 s GLN 2 CO 0.00 0.50 -0.09 0.96 0.01 0.00 0.00 175.29 176.67 2nr2 s ILE 3 N -0.31 2.19 0.08 1.08 -4.36 0.71 -1.30 121.20 119.29 2nr2 s ILE 3 Ca 0.07 -2.19 0.08 0.00 -0.26 0.00 0.00 60.65 58.34 2nr2 s ILE 3 Cb -0.12 -2.64 -0.04 0.00 1.25 0.00 0.00 42.46 40.91 2nr2 s ILE 3 CO 0.02 -0.20 -0.19 -0.36 0.24 0.00 0.00 174.94 174.44 2nr2 s PHE 4 N -2.64 2.51 -0.21 1.37 0.08 0.50 -0.05 117.98 119.54 2nr2 s PHE 4 Ca 0.32 -0.28 0.01 0.00 0.12 0.00 0.00 56.93 57.10 2nr2 s PHE 4 Cb 0.03 -1.39 0.05 0.00 -0.57 0.00 0.00 43.02 41.13 2nr2 s PHE 4 CO 0.16 0.31 -0.11 0.08 -0.10 0.00 0.00 175.22 175.56 2nr2 s VAL 5 N -1.02 1.76 -0.19 -0.44 1.01 0.15 -0.60 120.40 121.07 2nr2 s VAL 5 Ca 0.16 -1.13 -0.11 0.00 0.00 0.00 0.00 61.98 60.90 2nr2 s VAL 5 Cb -0.10 -1.84 -0.05 0.00 0.00 0.00 0.00 36.38 34.39 2nr2 s VAL 5 CO 0.07 0.14 0.16 -0.75 0.00 0.00 0.00 175.10 174.72 2nr2 s LYS 6 N 1.34 4.17 0.55 2.72 2.20 -0.08 -0.37 119.74 130.27 2nr2 s LYS 6 Ca -0.03 -0.15 0.08 0.00 -0.36 0.00 0.00 55.97 55.51 2nr2 s LYS 6 Cb -0.17 -3.41 0.07 0.00 -1.51 0.00 0.00 37.83 32.81 2nr2 s LYS 6 CO -0.08 0.31 0.76 0.95 -0.36 0.00 0.00 175.35 176.93 2nr2 s THR 7 N 0.32 2.39 0.15 3.43 -4.23 -0.54 -1.12 115.64 116.05 2nr2 s THR 7 Ca 0.10 -0.93 0.04 0.00 -1.18 0.00 0.00 61.69 59.72 2nr2 s THR 7 Cb -0.11 -2.46 -0.17 0.00 1.34 0.00 0.00 72.50 71.10 2nr2 s THR 7 CO -0.01 0.00 1.35 0.25 -0.54 0.00 0.00 174.62 175.67 2nr2 h LEU 8 N 0.20 0.15 -2.25 4.79 5.85 -1.90 -3.36 115.31 118.80 2nr2 h LEU 8 Ca -0.34 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.25 2nr2 h LEU 8 Cb 1.28 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 42.26 2nr2 h LEU 8 CO 0.42 0.99 0.03 0.71 -0.34 0.00 0.00 178.44 180.25 2nr2 h THR 9 N 0.05 0.72 0.00 1.05 1.35 -1.96 -3.45 112.91 110.67 2nr2 h THR 9 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.82 2nr2 h THR 9 Cb 1.59 0.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.99 2nr2 h THR 9 CO 0.13 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.01 2nr2 n GLY 10 N -1.42 0.70 3.20 5.82 0.00 -1.26 -5.14 105.19 107.10 2nr2 n GLY 10 Ca -0.02 -0.54 -0.25 0.00 0.00 0.00 0.00 46.02 45.20 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 -0.64 1.42 -0.24 1.61 2.20 -1.26 -4.98 119.74 117.86 2nr2 s LYS 11 Ca 0.00 -0.76 0.02 0.00 -0.36 0.00 0.00 55.97 54.88 2nr2 s LYS 11 Cb 0.00 -1.43 0.05 0.00 -1.51 0.00 0.00 37.83 34.94 2nr2 s LYS 11 CO 0.00 0.38 -0.13 0.99 -0.36 0.00 0.00 175.35 176.23 2nr2 s THR 12 N -0.58 2.08 0.01 3.43 2.01 -1.26 -1.46 115.64 119.87 2nr2 s THR 12 Ca 0.07 -1.41 -0.13 0.00 0.31 0.00 0.00 61.69 60.52 2nr2 s THR 12 Cb -0.08 -2.12 -0.06 0.00 0.01 0.00 0.00 72.50 70.26 2nr2 s THR 12 CO 0.00 0.12 0.39 -0.63 -0.69 0.00 0.00 174.62 173.80 2nr2 s ILE 13 N 1.18 5.08 -0.28 1.82 1.01 0.50 -4.87 121.20 125.64 2nr2 s ILE 13 Ca -0.05 0.71 -0.09 0.00 0.00 0.00 0.00 60.65 61.22 2nr2 s ILE 13 Cb -0.18 -3.67 -0.02 0.00 0.01 0.00 0.00 42.46 38.60 2nr2 s ILE 13 CO -0.07 0.52 0.13 -0.89 0.00 0.00 0.00 174.94 174.63 2nr2 s THR 14 N -1.14 4.59 -0.13 2.92 2.01 -1.26 0.34 115.64 122.96 2nr2 s THR 14 Ca 0.25 -0.26 0.01 0.00 0.31 0.00 0.00 61.69 62.00 2nr2 s THR 14 Cb -0.16 -3.25 -0.01 0.00 0.01 0.00 0.00 72.50 69.09 2nr2 s THR 14 CO 0.14 0.19 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.33 2nr2 s LEU 15 N 1.63 2.51 -0.31 4.42 1.43 0.92 -4.97 118.68 124.32 2nr2 s LEU 15 Ca 0.06 -0.42 -0.23 0.00 -1.03 0.00 0.00 54.13 52.51 2nr2 s LEU 15 Cb -0.16 -1.55 -0.00 0.00 0.03 0.00 0.00 46.19 44.50 2nr2 s LEU 15 CO 0.06 0.14 0.75 -1.61 0.23 0.00 0.00 176.35 175.92 2nr2 s GLU 16 N 0.48 3.93 0.07 1.70 2.02 -1.26 -0.21 118.70 125.43 2nr2 s GLU 16 Ca -0.11 0.50 0.00 0.00 0.02 0.00 0.00 54.97 55.38 2nr2 s GLU 16 Cb -0.16 -3.73 -0.04 0.00 0.10 0.00 0.00 34.13 30.29 2nr2 s GLU 16 CO 0.05 -0.67 -0.05 0.14 0.02 0.00 0.00 175.26 174.76 2nr2 s VAL 17 N 2.89 0.41 0.34 2.63 -7.23 0.44 -4.93 120.40 114.94 2nr2 s VAL 17 Ca 0.31 -1.80 0.07 0.00 -1.81 0.00 0.00 61.98 58.75 2nr2 s VAL 17 Cb -0.14 -1.51 -0.03 0.00 0.56 0.00 0.00 36.38 35.26 2nr2 s VAL 17 CO 0.13 -0.91 0.29 -1.61 -0.31 0.00 0.00 175.10 172.68 2nr2 s GLU 18 N -3.73 2.72 0.46 4.82 2.02 -1.26 0.50 118.70 124.23 2nr2 s GLU 18 Ca 0.08 -1.30 0.26 0.00 0.02 0.00 0.00 54.97 54.03 2nr2 s GLU 18 Cb 0.06 -2.47 0.92 0.00 0.10 0.00 0.00 34.13 32.74 2nr2 s GLU 18 CO -0.07 0.10 1.82 -1.35 0.02 0.00 0.00 175.26 175.77 2nr2 h PRO 19 N 1.26 0.00 -0.01 0.39 0.11 -1.96 -2.73 132.00 129.05 2nr2 h PRO 19 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 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 0.59 0.15 -0.06 0.43 -0.21 0.00 0.00 178.00 178.90 2nr2 n SER 20 N -3.26 1.21 -4.76 -2.05 7.64 -1.26 -1.40 113.62 109.74 2nr2 n SER 20 Ca 0.01 -1.27 -0.40 0.00 1.01 0.00 0.00 58.87 58.22 2nr2 n SER 20 Cb 0.43 0.02 -0.04 0.00 -1.01 0.00 0.00 64.21 63.61 2nr2 n SER 20 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2nr2 s ASP 21 N -2.13 7.20 0.72 6.43 1.01 -1.03 -4.81 116.67 124.06 2nr2 s ASP 21 Ca 0.35 2.25 -0.11 0.00 0.71 0.00 0.00 52.55 55.75 2nr2 s ASP 21 Cb 0.21 -2.62 0.02 0.00 1.01 0.00 0.00 42.92 41.54 2nr2 s ASP 21 CO 0.38 -0.19 1.07 0.42 0.21 0.00 0.00 175.17 177.07 2nr2 s THR 22 N -1.22 3.70 0.42 -1.27 -4.23 -1.26 -3.25 115.64 108.53 2nr2 s THR 22 Ca 0.46 0.55 0.16 0.00 -1.18 0.00 0.00 61.69 61.69 2nr2 s THR 22 Cb -0.31 -3.37 0.18 0.00 1.34 0.00 0.00 72.50 70.34 2nr2 s THR 22 CO 0.40 -0.72 1.96 0.40 -0.54 0.00 0.00 174.62 176.12 2nr2 h ILE 23 N -0.78 1.06 -0.16 2.99 1.08 -0.83 -1.47 117.51 119.40 2nr2 h ILE 23 Ca -0.45 -0.78 -0.01 0.00 -0.39 0.00 0.00 64.86 63.23 2nr2 h ILE 23 Cb 1.23 1.43 -0.01 0.00 -3.07 0.00 0.00 36.82 36.41 2nr2 h ILE 23 CO 0.59 0.22 0.04 -0.08 -0.69 0.00 0.00 178.15 178.23 2nr2 h GLU 24 N 0.00 0.22 -0.03 2.37 4.81 -1.52 -2.00 114.58 118.43 2nr2 h GLU 24 Ca -0.00 -0.02 -0.26 0.00 -0.13 0.00 0.00 59.36 58.95 2nr2 h GLU 24 Cb 0.41 -0.05 0.02 0.00 0.63 0.00 0.00 28.75 29.77 2nr2 h GLU 24 CO 0.03 0.21 -0.99 -0.97 -0.73 0.00 0.00 179.01 176.56 2nr2 h ASN 25 N 0.23 0.92 -0.77 1.04 -0.73 -1.58 -2.24 115.58 112.45 2nr2 h ASN 25 Ca 0.06 -0.71 -0.05 0.00 1.87 0.00 0.00 56.30 57.47 2nr2 h ASN 25 Cb 0.09 -0.28 -0.03 0.00 0.27 0.00 0.00 38.32 38.37 2nr2 h ASN 25 CO -0.00 1.51 0.27 0.58 -0.37 0.00 0.00 177.43 179.41 2nr2 h VAL 26 N 0.42 1.26 -0.89 2.57 2.07 -1.28 -2.84 116.25 117.57 2nr2 h VAL 26 Ca -0.11 -0.88 -0.01 0.00 0.82 0.00 0.00 66.70 66.52 2nr2 h VAL 26 Cb 1.64 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.75 2nr2 h VAL 26 CO 0.20 0.35 0.51 0.11 0.02 0.00 0.00 177.57 178.76 2nr2 h LYS 27 N 1.13 1.22 -1.00 1.57 1.57 -1.33 -2.73 116.57 117.01 2nr2 h LYS 27 Ca 0.25 -0.13 0.13 0.00 -1.87 0.00 0.00 60.65 59.03 2nr2 h LYS 27 Cb 0.27 -0.25 -0.09 0.00 0.08 0.00 0.00 32.23 32.25 2nr2 h LYS 27 CO -0.01 0.88 0.63 0.00 -0.57 0.00 0.00 179.45 180.37 2nr2 h ALA 28 N 1.28 1.55 0.00 3.86 0.00 -1.33 0.22 119.26 124.84 2nr2 h ALA 28 Ca 0.32 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.17 2nr2 h ALA 28 Cb -0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2nr2 h ALA 28 CO -0.06 0.19 -0.38 0.87 0.00 0.00 0.00 179.25 179.87 2nr2 h LYS 29 N 0.96 0.00 0.00 0.00 1.57 -1.24 -2.89 116.57 114.97 2nr2 h LYS 29 Ca 0.50 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.22 2nr2 h LYS 29 Cb 0.53 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 2nr2 h LYS 29 CO -0.27 0.38 -0.26 0.82 -0.57 0.00 0.00 179.45 179.55 2nr2 h ILE 30 N 0.00 0.67 -0.01 1.86 2.04 -0.35 -2.78 117.51 118.94 2nr2 h ILE 30 Ca -0.00 -1.18 -0.02 0.00 1.00 0.00 0.00 64.86 64.66 2nr2 h ILE 30 Cb 0.73 1.77 -0.00 0.00 -0.74 0.00 0.00 36.82 38.57 2nr2 h ILE 30 CO 0.05 0.26 -0.10 -0.61 0.00 0.00 0.00 178.15 177.75 2nr2 h GLN 31 N 0.00 0.02 0.00 2.37 4.15 -1.25 0.18 115.11 120.57 2nr2 h GLN 31 Ca -0.00 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.41 2nr2 h GLN 31 Cb 0.74 -0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.43 2nr2 h GLN 31 CO 0.03 0.12 -0.00 -0.44 -1.93 0.00 0.00 178.83 176.61 2nr2 h ASP 32 N 0.02 0.00 0.00 -0.69 3.32 -1.55 -1.78 116.42 115.74 2nr2 h ASP 32 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2nr2 h ASP 32 Cb 0.18 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 2nr2 h ASP 32 CO 0.01 0.00 -0.93 0.29 -1.72 0.00 0.00 179.24 176.90 2nr2 n LYS 33 N -3.09 0.45 -0.00 3.56 4.76 -1.01 -4.78 118.16 118.05 2nr2 n LYS 33 Ca 0.01 0.18 0.07 0.00 -2.87 0.00 0.00 58.31 55.70 2nr2 n LYS 33 Cb 0.34 -1.29 -0.09 0.00 -1.84 0.00 0.00 35.03 32.16 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 -4.30 1.92 -3.52 1.97 -0.58 0.59 -5.00 120.64 111.72 2nr2 n GLU 34 Ca -0.14 -0.00 -0.20 0.00 -0.42 0.00 0.00 57.16 56.40 2nr2 n GLU 34 Cb 0.46 -1.22 0.06 0.00 -0.57 0.00 0.00 31.44 30.16 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 -0.63 3.23 0.62 0.00 -0.67 -4.97 105.19 104.13 2nr2 n GLY 35 Ca 0.03 0.29 -0.33 0.00 0.00 0.00 0.00 46.02 46.01 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 -3.50 2.31 0.77 -0.61 1.01 -1.26 -4.99 121.20 114.93 2nr2 s ILE 36 Ca 0.19 -0.91 -0.11 0.00 0.00 0.00 0.00 60.65 59.81 2nr2 s ILE 36 Cb -0.04 -1.93 0.05 0.00 0.01 0.00 0.00 42.46 40.56 2nr2 s ILE 36 CO 0.78 0.54 1.09 -2.16 0.00 0.00 0.00 174.94 175.19 2nr2 s PRO 37 N 0.58 2.33 0.12 2.79 0.04 -1.26 -3.98 135.00 135.62 2nr2 s PRO 37 Ca -0.12 0.67 0.19 0.00 0.04 0.00 0.00 61.00 61.79 2nr2 s PRO 37 Cb -0.16 -1.94 0.81 0.00 0.04 0.00 0.00 34.50 33.24 2nr2 s PRO 37 CO 0.03 -1.46 1.60 -2.30 0.04 0.00 0.00 177.00 174.92 2nr2 n PRO 38 N -3.33 0.10 0.16 0.56 -0.02 -1.26 -1.96 135.00 129.24 2nr2 n PRO 38 Ca 0.07 0.32 0.13 0.00 -2.02 0.00 0.00 63.50 62.00 2nr2 n PRO 38 Cb 0.56 -1.68 0.44 0.00 -0.02 0.00 0.00 33.50 32.80 2nr2 n PRO 38 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2nr2 h ASP 39 N 0.00 0.00 0.52 2.55 3.32 -2.00 -2.91 116.42 117.90 2nr2 h ASP 39 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2nr2 h ASP 39 Cb 0.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2nr2 h ASP 39 CO 0.00 0.00 -0.55 1.67 -1.72 0.00 0.00 179.24 178.64 2nr2 n GLN 40 N -2.50 0.04 -4.01 3.56 7.27 -0.83 -4.90 117.38 116.02 2nr2 n GLN 40 Ca 0.03 0.01 -0.35 0.00 0.07 0.00 0.00 57.00 56.76 2nr2 n GLN 40 Cb 0.36 -1.52 -0.09 0.00 2.41 0.00 0.00 30.24 31.40 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 -3.03 3.84 -0.24 3.69 -0.21 -1.10 -1.07 119.66 121.55 2nr2 s GLN 41 Ca 0.10 -0.32 0.02 0.00 0.02 0.00 0.00 55.36 55.19 2nr2 s GLN 41 Cb 0.17 -3.19 0.06 0.00 1.00 0.00 0.00 33.01 31.05 2nr2 s GLN 41 CO 0.71 0.37 -0.11 0.50 -2.12 0.00 0.00 175.29 174.65 2nr2 s ARG 42 N 0.09 2.17 -0.06 2.91 3.52 0.27 -4.92 118.95 122.93 2nr2 s ARG 42 Ca 0.06 -1.20 -0.20 0.00 -0.13 0.00 0.00 55.73 54.27 2nr2 s ARG 42 Cb -0.12 -2.77 -0.05 0.00 -1.56 0.00 0.00 34.95 30.46 2nr2 s ARG 42 CO 0.01 -0.53 0.55 -0.51 -0.81 0.00 0.00 175.30 174.00 2nr2 s LEU 43 N 1.20 4.34 -0.12 -0.88 1.43 -1.26 -0.20 118.68 123.19 2nr2 s LEU 43 Ca -0.07 1.00 0.02 0.00 -1.03 0.00 0.00 54.13 54.05 2nr2 s LEU 43 Cb -0.19 -2.82 0.01 0.00 0.03 0.00 0.00 46.19 43.22 2nr2 s LEU 43 CO -0.06 0.04 -0.17 -0.63 0.23 0.00 0.00 176.35 175.76 2nr2 s ILE 44 N 0.26 1.66 -0.26 -0.59 -1.09 -0.43 -2.03 121.20 118.72 2nr2 s ILE 44 Ca 0.29 -0.73 0.01 0.00 -2.23 0.00 0.00 60.65 57.99 2nr2 s ILE 44 Cb -0.17 -1.50 0.07 0.00 -1.58 0.00 0.00 42.46 39.28 2nr2 s ILE 44 CO 0.14 0.47 -0.04 0.12 -1.23 0.00 0.00 174.94 174.40 2nr2 s PHE 45 N 0.98 2.66 0.00 3.97 5.36 -0.73 0.18 117.98 130.40 2nr2 s PHE 45 Ca -0.06 -2.00 0.00 0.00 -0.96 0.00 0.00 56.93 53.92 2nr2 s PHE 45 Cb -0.15 -1.80 0.00 0.00 -0.34 0.00 0.00 43.02 40.73 2nr2 s PHE 45 CO -0.03 -0.82 0.00 0.00 -1.46 0.00 0.00 175.22 172.91 2nr2 n ALA 46 N 4.59 0.00 -0.35 11.12 0.00 -1.26 -0.27 120.51 134.35 2nr2 n ALA 46 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2nr2 n ALA 46 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 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 0.00 0.90 3.64 0.00 0.00 -1.26 -5.11 105.19 103.36 2nr2 n GLY 47 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 4.09 -0.19 1.61 1.02 0.63 -5.06 119.74 121.84 2nr2 s LYS 48 Ca 0.00 0.13 -0.29 0.00 0.02 0.00 0.00 55.97 55.83 2nr2 s LYS 48 Cb 0.00 -3.60 -0.02 0.00 -0.52 0.00 0.00 37.83 33.69 2nr2 s LYS 48 CO 0.00 -0.17 1.39 -1.14 -0.92 0.00 0.00 175.35 174.51 2nr2 s GLN 49 N 1.74 4.08 -0.14 1.68 0.74 -1.26 -1.77 119.66 124.72 2nr2 s GLN 49 Ca 0.17 1.64 -0.18 0.00 0.05 0.00 0.00 55.36 57.04 2nr2 s GLN 49 Cb -0.15 -3.87 -0.04 0.00 1.10 0.00 0.00 33.01 30.05 2nr2 s GLN 49 CO 0.09 -0.92 0.47 -0.51 -0.55 0.00 0.00 175.29 173.86 2nr2 s LEU 50 N 4.07 4.24 0.43 3.68 1.43 -0.86 -5.03 118.68 126.64 2nr2 s LEU 50 Ca 0.61 0.76 -0.23 0.00 -1.03 0.00 0.00 54.13 54.23 2nr2 s LEU 50 Cb -0.23 -2.67 -0.08 0.00 0.03 0.00 0.00 46.19 43.24 2nr2 s LEU 50 CO 0.21 -0.03 1.08 -1.61 0.23 0.00 0.00 176.35 176.23 2nr2 s GLU 51 N 0.84 4.01 0.02 1.70 2.02 -1.26 -4.68 118.70 121.35 2nr2 s GLU 51 Ca 0.25 1.56 -0.25 0.00 0.02 0.00 0.00 54.97 56.55 2nr2 s GLU 51 Cb -0.15 -2.45 -0.18 0.00 0.10 0.00 0.00 34.13 31.45 2nr2 s GLU 51 CO 0.10 -0.28 1.44 -0.44 0.02 0.00 0.00 175.26 176.09 2nr2 h ASP 52 N 2.26 -0.01 -1.55 -0.19 3.32 -1.96 -2.81 116.42 115.48 2nr2 h ASP 52 Ca -0.49 -0.30 -0.67 0.00 0.02 0.00 0.00 57.03 55.60 2nr2 h ASP 52 Cb 1.22 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.56 2nr2 h ASP 52 CO 0.61 0.30 1.00 0.61 -1.72 0.00 0.00 179.24 180.04 2nr2 n GLY 53 N -0.27 5.10 3.63 2.75 0.00 -1.26 -1.44 105.19 113.70 2nr2 n GLY 53 Ca -0.08 -2.20 -0.23 0.00 0.00 0.00 0.00 46.02 43.51 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 -2.76 2.17 0.50 1.61 1.81 -1.06 -4.99 118.95 116.23 2nr2 s ARG 54 Ca 0.53 -1.56 0.07 0.00 -1.72 0.00 0.00 55.73 53.05 2nr2 s ARG 54 Cb 0.35 -2.05 0.02 0.00 -0.45 0.00 0.00 34.95 32.81 2nr2 s ARG 54 CO -0.26 0.28 0.43 0.95 -0.68 0.00 0.00 175.30 176.02 2nr2 s THR 55 N -2.41 2.04 0.37 0.02 -4.23 -1.26 -1.27 115.64 108.90 2nr2 s THR 55 Ca 0.33 -1.40 0.10 0.00 -1.18 0.00 0.00 61.69 59.53 2nr2 s THR 55 Cb -0.04 -2.44 0.13 0.00 1.34 0.00 0.00 72.50 71.49 2nr2 s THR 55 CO 0.19 0.00 1.87 -0.07 -0.54 0.00 0.00 174.62 176.08 2nr2 h LEU 56 N 0.80 0.17 -0.46 4.79 3.38 -1.52 -2.90 115.31 119.59 2nr2 h LEU 56 Ca -0.38 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.53 2nr2 h LEU 56 Cb 1.29 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 2nr2 h LEU 56 CO 0.56 0.41 0.19 -1.28 0.09 0.00 0.00 178.44 178.41 2nr2 h SER 57 N 0.17 0.62 -0.44 -0.43 0.87 -1.49 0.22 113.55 113.06 2nr2 h SER 57 Ca 0.03 -0.16 -0.07 0.00 -1.23 0.00 0.00 61.79 60.36 2nr2 h SER 57 Cb 0.48 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.26 2nr2 h SER 57 CO 0.03 0.61 0.05 0.44 -0.53 0.00 0.00 176.83 177.43 2nr2 h ASP 58 N 0.59 0.78 0.08 6.23 3.32 -1.83 -2.98 116.42 122.62 2nr2 h ASP 58 Ca 0.15 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.03 2nr2 h ASP 58 Cb 0.18 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.52 2nr2 h ASP 58 CO -0.01 0.82 -0.94 -1.22 -1.72 0.00 0.00 179.24 176.17 2nr2 n TYR 59 N -4.23 0.00 -3.29 4.55 4.01 -1.13 -4.98 117.16 112.08 2nr2 n TYR 59 Ca 0.03 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.62 2nr2 n TYR 59 Cb 0.28 -0.05 0.08 0.00 -0.31 0.00 0.00 39.34 39.34 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 -1.51 -4.22 -4.23 7.72 4.13 -0.36 -4.98 115.26 111.81 2nr2 n ASN 60 Ca 0.04 -0.64 -0.41 0.00 1.68 0.00 0.00 54.58 55.25 2nr2 n ASN 60 Cb 0.33 -5.02 -0.09 0.00 -1.54 0.00 0.00 39.78 33.47 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 -3.36 4.24 0.49 2.41 1.01 -0.08 -5.04 121.20 120.87 2nr2 s ILE 61 Ca 0.22 -1.67 0.08 0.00 0.00 0.00 0.00 60.65 59.27 2nr2 s ILE 61 Cb -0.03 -3.74 0.03 0.00 0.01 0.00 0.00 42.46 38.73 2nr2 s ILE 61 CO 0.71 -0.71 0.55 -1.10 0.00 0.00 0.00 174.94 174.40 2nr2 s GLN 62 N 1.39 2.46 0.32 2.79 -0.21 -1.26 -4.64 119.66 120.51 2nr2 s GLN 62 Ca 0.05 -1.61 -0.29 0.00 0.02 0.00 0.00 55.36 53.53 2nr2 s GLN 62 Cb -0.25 -2.48 -0.12 0.00 1.00 0.00 0.00 33.01 31.15 2nr2 s GLN 62 CO 0.00 -0.51 1.32 0.36 -2.12 0.00 0.00 175.29 174.35 2nr2 n LYS 63 N -1.87 2.13 -3.09 2.91 2.85 -1.26 -3.21 118.16 116.62 2nr2 n LYS 63 Ca 0.07 0.75 -0.15 0.00 -1.05 0.00 0.00 58.31 57.93 2nr2 n LYS 63 Cb 0.62 -2.35 0.04 0.00 -0.65 0.00 0.00 35.03 32.69 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 0.90 -4.56 -4.56 -1.58 1.02 -0.42 -5.03 120.64 106.42 2nr2 n GLU 64 Ca 0.06 0.52 -0.34 0.00 -0.02 0.00 0.00 57.16 57.38 2nr2 n GLU 64 Cb 0.35 -4.61 -0.11 0.00 -0.02 0.00 0.00 31.44 27.05 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 -3.12 4.72 -0.42 1.62 0.15 -1.20 -4.88 113.70 110.57 2nr2 s SER 65 Ca 0.33 -0.04 -0.17 0.00 0.70 0.00 0.00 55.95 56.77 2nr2 s SER 65 Cb -0.14 -1.36 0.02 0.00 -1.71 0.00 0.00 66.02 62.83 2nr2 s SER 65 CO 0.41 0.31 0.43 -0.89 1.20 0.00 0.00 173.24 174.70 2nr2 s THR 66 N -0.50 5.09 0.10 6.45 2.01 -1.26 -0.37 115.64 127.16 2nr2 s THR 66 Ca 0.08 -0.36 -0.07 0.00 0.31 0.00 0.00 61.69 61.64 2nr2 s THR 66 Cb -0.12 -4.04 -0.06 0.00 0.01 0.00 0.00 72.50 68.30 2nr2 s THR 66 CO 0.02 -0.42 0.38 -0.76 -0.69 0.00 0.00 174.62 173.14 2nr2 s LEU 67 N 2.12 4.31 -0.21 4.42 1.43 0.23 -4.71 118.68 126.27 2nr2 s LEU 67 Ca 0.12 0.68 -0.05 0.00 -1.03 0.00 0.00 54.13 53.85 2nr2 s LEU 67 Cb -0.17 -3.11 -0.02 0.00 0.03 0.00 0.00 46.19 42.92 2nr2 s LEU 67 CO 0.14 0.12 -0.01 -1.00 0.23 0.00 0.00 176.35 175.83 2nr2 s HIS 68 N -1.51 3.01 -0.54 0.29 3.76 0.13 -0.90 115.29 119.53 2nr2 s HIS 68 Ca 0.36 -0.57 -0.27 0.00 -0.15 0.00 0.00 55.06 54.43 2nr2 s HIS 68 Cb -0.13 -2.09 0.03 0.00 1.11 0.00 0.00 32.58 31.50 2nr2 s HIS 68 CO 0.21 -0.32 1.10 -1.17 -0.85 0.00 0.00 174.74 173.71 2nr2 s LEU 69 N 1.13 3.68 -0.01 0.89 2.96 -0.27 -1.32 118.68 125.75 2nr2 s LEU 69 Ca 0.02 0.08 -0.06 0.00 -0.22 0.00 0.00 54.13 53.96 2nr2 s LEU 69 Cb -0.14 -3.17 -0.04 0.00 0.50 0.00 0.00 46.19 43.33 2nr2 s LEU 69 CO 0.01 -1.34 0.24 -0.69 -1.32 0.00 0.00 176.35 173.25 2nr2 s VAL 70 N 4.52 5.35 -0.10 1.68 1.01 0.73 -4.34 120.40 129.25 2nr2 s VAL 70 Ca 0.41 0.08 -0.01 0.00 0.00 0.00 0.00 61.98 62.46 2nr2 s VAL 70 Cb -0.09 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 2nr2 s VAL 70 CO 0.25 0.37 -0.04 -0.76 0.00 0.00 0.00 175.10 174.92 2nr2 s LEU 71 N -1.76 3.29 0.00 3.92 1.43 -1.26 -0.56 118.68 123.74 2nr2 s LEU 71 Ca 0.27 -0.01 -0.05 0.00 -1.03 0.00 0.00 54.13 53.31 2nr2 s LEU 71 Cb -0.13 -1.75 0.09 0.00 0.03 0.00 0.00 46.19 44.44 2nr2 s LEU 71 CO 0.16 0.31 0.57 0.54 0.23 0.00 0.00 176.35 178.16 2nr2 n ARG 72 N 2.58 -0.25 -4.58 1.70 1.74 -0.23 -4.91 116.66 112.71 2nr2 n ARG 72 Ca -0.18 -1.11 -0.27 0.00 -0.77 0.00 0.00 57.85 55.52 2nr2 n ARG 72 Cb 0.53 -0.51 -0.09 0.00 -1.02 0.00 0.00 32.46 31.36 2nr2 n ARG 72 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2nr2 s LEU 73 N 0.00 2.34 0.20 0.55 1.43 -1.26 -5.02 118.68 116.92 2nr2 s LEU 73 Ca 0.34 -1.50 -0.07 0.00 -1.03 0.00 0.00 54.13 51.87 2nr2 s LEU 73 Cb -0.01 -0.54 -0.06 0.00 0.03 0.00 0.00 46.19 45.61 2nr2 s LEU 73 CO 0.23 -0.69 0.48 -0.60 0.23 0.00 0.00 176.35 176.00 2nr2 s ARG 74 N -3.80 3.69 0.00 1.70 3.52 -1.26 -4.65 118.95 118.15 2nr2 s ARG 74 Ca 0.26 0.07 0.00 0.00 -0.13 0.00 0.00 55.73 55.93 2nr2 s ARG 74 Cb 0.06 -2.73 0.00 0.00 -1.56 0.00 0.00 34.95 30.72 2nr2 s ARG 74 CO 0.13 0.36 0.00 0.41 -0.81 0.00 0.00 175.30 175.39 2nr2 n GLY 75 N -0.19 1.32 0.00 8.12 0.00 -1.26 -5.29 105.19 107.90 2nr2 n GLY 75 Ca -0.01 -0.43 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