#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 3.77 0.01 3.17 0.74 -1.26 -0.66 119.66 125.43 2nr2 s GLN 2 Ca 0.00 0.19 -0.05 0.00 0.05 0.00 0.00 55.36 55.55 2nr2 s GLN 2 Cb 0.00 -3.23 -0.01 0.00 1.10 0.00 0.00 33.01 30.88 2nr2 s GLN 2 CO 0.00 0.68 0.08 0.96 -0.55 0.00 0.00 175.29 176.46 2nr2 s ILE 3 N -0.93 0.10 -0.12 -2.34 -4.36 0.29 0.12 121.20 113.95 2nr2 s ILE 3 Ca 0.20 -0.80 -0.02 0.00 -0.26 0.00 0.00 60.65 59.77 2nr2 s ILE 3 Cb -0.15 -0.41 -0.03 0.00 1.25 0.00 0.00 42.46 43.12 2nr2 s ILE 3 CO 0.09 -0.44 -0.03 -0.36 0.24 0.00 0.00 174.94 174.44 2nr2 s PHE 4 N -1.51 3.04 -0.16 1.37 0.08 0.31 -1.21 117.98 119.91 2nr2 s PHE 4 Ca -0.14 -0.12 0.02 0.00 0.12 0.00 0.00 56.93 56.80 2nr2 s PHE 4 Cb -0.08 -1.88 0.02 0.00 -0.57 0.00 0.00 43.02 40.51 2nr2 s PHE 4 CO 0.00 0.15 -0.21 0.08 -0.10 0.00 0.00 175.22 175.15 2nr2 s VAL 5 N -0.13 2.01 -0.14 -0.44 1.01 0.28 -0.53 120.40 122.46 2nr2 s VAL 5 Ca 0.03 -0.93 -0.16 0.00 0.00 0.00 0.00 61.98 60.92 2nr2 s VAL 5 Cb -0.13 -1.80 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 2nr2 s VAL 5 CO 0.02 0.54 0.37 -0.75 0.00 0.00 0.00 175.10 175.28 2nr2 s LYS 6 N 1.05 4.29 0.17 2.72 2.47 0.19 0.40 119.74 131.04 2nr2 s LYS 6 Ca -0.01 0.25 -0.01 0.00 -1.56 0.00 0.00 55.97 54.63 2nr2 s LYS 6 Cb -0.14 -3.43 -0.04 0.00 -1.46 0.00 0.00 37.83 32.75 2nr2 s LYS 6 CO -0.07 0.21 0.36 0.95 0.16 0.00 0.00 175.35 176.96 2nr2 s THR 7 N 0.53 5.23 0.54 3.43 -4.23 -0.16 -1.49 115.64 119.48 2nr2 s THR 7 Ca 0.20 -0.32 0.33 0.00 -1.18 0.00 0.00 61.69 60.73 2nr2 s THR 7 Cb -0.14 -3.70 0.37 0.00 1.34 0.00 0.00 72.50 70.36 2nr2 s THR 7 CO 0.07 -0.10 2.22 -0.07 -0.54 0.00 0.00 174.62 176.20 2nr2 h LEU 8 N 2.27 0.00 0.03 4.79 3.38 -1.89 -3.23 115.31 120.66 2nr2 h LEU 8 Ca -0.47 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.50 2nr2 h LEU 8 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2nr2 h LEU 8 CO 0.70 0.03 -0.01 0.71 0.09 0.00 0.00 178.44 179.96 2nr2 h THR 9 N 0.00 1.30 0.00 0.22 1.35 -1.96 -3.48 112.91 110.35 2nr2 h THR 9 Ca -0.00 -1.80 0.00 0.00 -0.55 0.00 0.00 66.41 64.06 2nr2 h THR 9 Cb 0.12 2.38 0.00 0.00 -1.73 0.00 0.00 68.15 68.92 2nr2 h THR 9 CO 0.00 0.41 0.00 0.61 -0.25 0.00 0.00 175.52 176.30 2nr2 n GLY 10 N 1.33 0.00 3.72 5.82 0.00 -1.22 -5.17 105.19 109.67 2nr2 n GLY 10 Ca -0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 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 2.75 -0.25 1.61 2.20 -1.26 -4.94 119.74 119.86 2nr2 s LYS 11 Ca 0.00 -0.70 -0.03 0.00 -0.36 0.00 0.00 55.97 54.88 2nr2 s LYS 11 Cb 0.00 -2.66 0.01 0.00 -1.51 0.00 0.00 37.83 33.67 2nr2 s LYS 11 CO 0.00 0.58 -0.03 0.99 -0.36 0.00 0.00 175.35 176.54 2nr2 s THR 12 N -1.24 3.26 -0.09 3.43 2.01 -1.26 -0.99 115.64 120.75 2nr2 s THR 12 Ca 0.24 -0.76 -0.24 0.00 0.31 0.00 0.00 61.69 61.24 2nr2 s THR 12 Cb -0.12 -2.60 -0.03 0.00 0.01 0.00 0.00 72.50 69.76 2nr2 s THR 12 CO 0.16 0.26 0.73 -0.63 -0.69 0.00 0.00 174.62 174.45 2nr2 s ILE 13 N 1.42 5.01 -0.54 1.82 1.01 0.16 -4.87 121.20 125.21 2nr2 s ILE 13 Ca 0.03 1.47 -0.16 0.00 0.00 0.00 0.00 60.65 61.99 2nr2 s ILE 13 Cb -0.16 -4.06 0.13 0.00 0.01 0.00 0.00 42.46 38.38 2nr2 s ILE 13 CO -0.03 0.20 0.51 -0.89 0.00 0.00 0.00 174.94 174.73 2nr2 s THR 14 N 1.13 5.21 0.03 2.92 2.01 -1.26 -0.56 115.64 125.12 2nr2 s THR 14 Ca 0.37 -1.50 -0.06 0.00 0.31 0.00 0.00 61.69 60.81 2nr2 s THR 14 Cb -0.17 -4.34 -0.05 0.00 0.01 0.00 0.00 72.50 67.94 2nr2 s THR 14 CO 0.17 -0.88 0.29 -0.76 -0.69 0.00 0.00 174.62 172.75 2nr2 s LEU 15 N 1.61 4.36 -0.15 4.42 1.43 -0.35 -4.94 118.68 125.05 2nr2 s LEU 15 Ca 0.03 0.57 -0.12 0.00 -1.03 0.00 0.00 54.13 53.58 2nr2 s LEU 15 Cb -0.30 -2.78 -0.05 0.00 0.03 0.00 0.00 46.19 43.10 2nr2 s LEU 15 CO 0.03 0.22 0.25 -1.61 0.23 0.00 0.00 176.35 175.47 2nr2 s GLU 16 N -1.89 4.11 0.23 1.70 2.02 -1.26 -0.55 118.70 123.06 2nr2 s GLU 16 Ca 0.30 0.03 0.01 0.00 0.02 0.00 0.00 54.97 55.32 2nr2 s GLU 16 Cb -0.13 -3.38 -0.05 0.00 0.10 0.00 0.00 34.13 30.67 2nr2 s GLU 16 CO 0.18 0.36 0.08 0.14 0.02 0.00 0.00 175.26 176.03 2nr2 s VAL 17 N 0.13 0.49 0.15 2.63 -7.23 0.16 -4.97 120.40 111.76 2nr2 s VAL 17 Ca 0.15 -1.99 0.09 0.00 -1.81 0.00 0.00 61.98 58.42 2nr2 s VAL 17 Cb -0.13 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 2nr2 s VAL 17 CO 0.03 -0.11 -0.16 -1.61 -0.31 0.00 0.00 175.10 172.95 2nr2 s GLU 18 N -4.03 1.85 0.00 4.82 2.02 -1.26 0.11 118.70 122.21 2nr2 s GLU 18 Ca 0.35 -1.26 0.25 0.00 0.02 0.00 0.00 54.97 54.33 2nr2 s GLU 18 Cb 0.07 -2.09 1.35 0.00 0.10 0.00 0.00 34.13 33.56 2nr2 s GLU 18 CO 0.11 0.45 1.85 -0.35 0.02 0.00 0.00 175.26 177.35 2nr2 n PRO 19 N 0.43 0.50 -0.01 0.39 -0.04 -1.26 -1.59 135.00 133.42 2nr2 n PRO 19 Ca -0.13 0.04 0.14 0.00 -0.04 0.00 0.00 63.50 63.50 2nr2 n PRO 19 Cb 0.54 -1.50 0.56 0.00 -0.04 0.00 0.00 33.50 33.06 2nr2 n PRO 19 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2nr2 n SER 20 N -1.19 1.33 -4.81 3.54 7.64 -1.26 -0.52 113.62 118.34 2nr2 n SER 20 Ca 0.14 -1.46 -0.35 0.00 1.01 0.00 0.00 58.87 58.22 2nr2 n SER 20 Cb 0.16 -0.01 -0.07 0.00 -1.01 0.00 0.00 64.21 63.29 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 -1.97 7.05 0.50 6.43 1.11 -0.62 -4.83 116.67 124.34 2nr2 s ASP 21 Ca 0.39 1.61 -0.05 0.00 0.18 0.00 0.00 52.55 54.67 2nr2 s ASP 21 Cb 0.21 -2.50 -0.03 0.00 1.07 0.00 0.00 42.92 41.67 2nr2 s ASP 21 CO 0.33 -0.17 0.81 0.42 1.18 0.00 0.00 175.17 177.73 2nr2 s THR 22 N -1.86 4.74 -0.32 -1.27 -4.23 -1.26 -1.27 115.64 110.17 2nr2 s THR 22 Ca 0.54 0.19 0.27 0.00 -1.18 0.00 0.00 61.69 61.50 2nr2 s THR 22 Cb -0.13 -3.81 0.34 0.00 1.34 0.00 0.00 72.50 70.23 2nr2 s THR 22 CO 0.18 -0.81 1.76 0.40 -0.54 0.00 0.00 174.62 175.62 2nr2 h ILE 23 N 0.16 0.00 -0.43 2.99 1.08 -1.12 -0.98 117.51 119.21 2nr2 h ILE 23 Ca -0.47 -0.69 -0.03 0.00 -0.39 0.00 0.00 64.86 63.28 2nr2 h ILE 23 Cb 1.21 1.67 -0.02 0.00 -3.07 0.00 0.00 36.82 36.61 2nr2 h ILE 23 CO 0.61 0.00 0.17 -0.08 -0.69 0.00 0.00 178.15 178.16 2nr2 h GLU 24 N 0.00 0.65 -0.26 2.37 4.81 -1.45 -1.73 114.58 118.97 2nr2 h GLU 24 Ca 0.00 -0.12 0.06 0.00 -0.13 0.00 0.00 59.36 59.17 2nr2 h GLU 24 Cb 0.75 -0.10 -0.07 0.00 0.63 0.00 0.00 28.75 29.95 2nr2 h GLU 24 CO 0.00 0.60 -0.27 -0.91 -0.73 0.00 0.00 179.01 177.71 2nr2 h ASN 25 N 0.56 -0.86 -0.80 1.04 -0.26 -1.50 -1.69 115.58 112.07 2nr2 h ASN 25 Ca 0.14 0.15 0.16 0.00 -0.56 0.00 0.00 56.30 56.20 2nr2 h ASN 25 Cb 0.20 0.40 -0.10 0.00 -1.06 0.00 0.00 38.32 37.76 2nr2 h ASN 25 CO -0.01 -0.30 0.33 0.58 -1.06 0.00 0.00 177.43 176.97 2nr2 h VAL 26 N -0.27 0.61 0.00 2.81 2.07 -1.28 -1.17 116.25 119.02 2nr2 h VAL 26 Ca 0.14 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.51 2nr2 h VAL 26 Cb 0.49 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2nr2 h VAL 26 CO -0.41 0.08 0.00 0.29 0.02 0.00 0.00 177.57 177.55 2nr2 n LYS 27 N -5.01 0.22 0.06 1.57 5.02 -0.65 -2.45 118.16 116.91 2nr2 n LYS 27 Ca 0.16 0.32 -0.09 0.00 -2.02 0.00 0.00 58.31 56.68 2nr2 n LYS 27 Cb 0.48 -1.83 0.02 0.00 -0.02 0.00 0.00 35.03 33.68 2nr2 n LYS 27 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2nr2 h ALA 28 N 2.39 0.58 -0.31 7.82 0.00 -0.29 -2.06 119.26 127.40 2nr2 h ALA 28 Ca 0.00 -0.64 -0.05 0.00 0.00 0.00 0.00 54.91 54.22 2nr2 h ALA 28 Cb 0.53 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2nr2 h ALA 28 CO 0.00 0.80 -0.03 0.87 0.00 0.00 0.00 179.25 180.89 2nr2 h LYS 29 N 0.22 0.48 -0.38 0.00 1.57 -1.07 -0.80 116.57 116.60 2nr2 h LYS 29 Ca -0.04 -0.11 -0.14 0.00 -1.87 0.00 0.00 60.65 58.50 2nr2 h LYS 29 Cb 1.36 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.59 2nr2 h LYS 29 CO 0.13 0.53 -0.31 0.82 -0.57 0.00 0.00 179.45 180.05 2nr2 h ILE 30 N 0.46 1.28 -0.65 1.86 2.04 -1.42 -2.23 117.51 118.86 2nr2 h ILE 30 Ca 0.10 -1.47 -0.07 0.00 1.00 0.00 0.00 64.86 64.42 2nr2 h ILE 30 Cb 0.34 1.31 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 2nr2 h ILE 30 CO 0.01 0.49 0.14 -0.61 0.00 0.00 0.00 178.15 178.18 2nr2 h GLN 31 N 0.70 1.05 -0.91 2.37 4.15 -0.67 0.34 115.11 122.15 2nr2 h GLN 31 Ca 0.08 -0.26 0.01 0.00 0.77 0.00 0.00 58.65 59.24 2nr2 h GLN 31 Cb 0.86 -0.13 -0.04 0.00 0.21 0.00 0.00 27.48 28.37 2nr2 h GLN 31 CO 0.08 0.96 0.59 0.22 -1.93 0.00 0.00 178.83 178.74 2nr2 h ASP 32 N 0.97 1.06 0.04 -0.69 3.58 -1.08 -2.28 116.42 118.03 2nr2 h ASP 32 Ca 0.20 -0.04 -0.00 0.00 0.42 0.00 0.00 57.03 57.61 2nr2 h ASP 32 Cb 0.39 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.18 2nr2 h ASP 32 CO 0.01 0.78 -0.02 0.11 -2.88 0.00 0.00 179.24 177.23 2nr2 h LYS 33 N 1.24 -0.05 0.03 0.28 1.79 -0.76 -3.43 116.57 115.66 2nr2 h LYS 33 Ca 0.33 0.00 -0.38 0.00 -2.18 0.00 0.00 60.65 58.43 2nr2 h LYS 33 Cb -0.12 0.01 -0.05 0.00 -1.58 0.00 0.00 32.23 30.49 2nr2 h LYS 33 CO -0.07 -0.04 -2.16 0.39 -1.08 0.00 0.00 179.45 176.50 2nr2 n GLU 34 N -2.68 0.64 0.00 3.15 -0.58 0.05 -5.05 120.64 116.17 2nr2 n GLU 34 Ca -0.01 0.29 0.00 0.00 -0.42 0.00 0.00 57.16 57.03 2nr2 n GLU 34 Cb 0.02 -1.60 0.00 0.00 -0.57 0.00 0.00 31.44 29.30 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 1.73 0.92 3.57 0.62 0.00 -0.86 -5.01 105.19 106.16 2nr2 n GLY 35 Ca -0.43 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.43 4.00 0.71 -0.61 1.01 -1.26 -4.98 121.20 118.65 2nr2 s ILE 36 Ca 0.00 -0.34 -0.15 0.00 0.00 0.00 0.00 60.65 60.15 2nr2 s ILE 36 Cb 0.00 -2.71 0.03 0.00 0.01 0.00 0.00 42.46 39.79 2nr2 s ILE 36 CO 0.00 0.55 1.20 -2.84 0.00 0.00 0.00 174.94 173.85 2nr2 s PRO 37 N -0.25 2.25 0.39 2.79 0.02 -1.26 -3.87 135.00 135.07 2nr2 s PRO 37 Ca 0.05 1.74 0.20 0.00 0.02 0.00 0.00 61.00 63.01 2nr2 s PRO 37 Cb -0.13 -1.85 0.65 0.00 0.02 0.00 0.00 34.50 33.19 2nr2 s PRO 37 CO 0.02 -1.74 1.71 -1.00 -0.33 0.00 0.00 177.00 175.66 2nr2 h PRO 38 N -0.18 0.00 -0.15 5.54 0.13 -1.93 -1.79 132.00 133.62 2nr2 h PRO 38 Ca -0.48 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.58 2nr2 h PRO 38 Cb 1.29 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 2nr2 h PRO 38 CO 0.50 0.33 -0.22 0.38 -0.23 0.00 0.00 178.00 178.76 2nr2 h ASP 39 N 0.00 0.25 1.06 1.44 2.03 -1.95 -3.09 116.42 116.17 2nr2 h ASP 39 Ca -0.00 -0.07 -0.07 0.00 -0.73 0.00 0.00 57.03 56.16 2nr2 h ASP 39 Cb 0.94 -0.07 -0.01 0.00 -0.83 0.00 0.00 39.33 39.36 2nr2 h ASP 39 CO 0.04 0.48 -0.32 -0.61 -1.03 0.00 0.00 179.24 177.80 2nr2 h GLN 40 N 0.24 0.00 -6.24 4.15 4.15 -1.70 -3.46 115.11 112.25 2nr2 h GLN 40 Ca 0.04 0.00 -0.57 0.00 0.77 0.00 0.00 58.65 58.89 2nr2 h GLN 40 Cb 0.52 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.17 2nr2 h GLN 40 CO 0.04 0.32 -0.16 -0.65 -1.93 0.00 0.00 178.83 176.44 2nr2 s GLN 41 N -3.47 3.86 -0.04 1.69 -0.21 -1.11 -0.61 119.66 119.76 2nr2 s GLN 41 Ca 0.01 0.32 0.04 0.00 0.02 0.00 0.00 55.36 55.76 2nr2 s GLN 41 Cb 0.10 -2.93 -0.00 0.00 1.00 0.00 0.00 33.01 31.17 2nr2 s GLN 41 CO 0.67 0.50 -0.16 1.03 -2.12 0.00 0.00 175.29 175.21 2nr2 s ARG 42 N -2.03 1.69 -0.22 2.91 0.52 0.07 -4.82 118.95 117.07 2nr2 s ARG 42 Ca 0.37 -0.56 -0.08 0.00 -0.52 0.00 0.00 55.73 54.93 2nr2 s ARG 42 Cb -0.14 -1.47 -0.04 0.00 0.52 0.00 0.00 34.95 33.82 2nr2 s ARG 42 CO 0.19 0.22 0.10 -0.51 0.02 0.00 0.00 175.30 175.31 2nr2 s LEU 43 N 0.09 3.77 -0.20 2.53 1.43 -1.26 -1.63 118.68 123.41 2nr2 s LEU 43 Ca -0.04 -0.01 -0.02 0.00 -1.03 0.00 0.00 54.13 53.02 2nr2 s LEU 43 Cb -0.11 -1.99 0.00 0.00 0.03 0.00 0.00 46.19 44.12 2nr2 s LEU 43 CO 0.02 0.07 -0.10 -0.63 0.23 0.00 0.00 176.35 175.94 2nr2 s ILE 44 N 1.02 2.89 -0.03 -0.59 -1.09 0.13 -1.31 121.20 122.23 2nr2 s ILE 44 Ca 0.05 -0.66 0.03 0.00 -2.23 0.00 0.00 60.65 57.84 2nr2 s ILE 44 Cb -0.14 -2.28 -0.00 0.00 -1.58 0.00 0.00 42.46 38.46 2nr2 s ILE 44 CO 0.03 0.47 -0.12 0.12 -1.23 0.00 0.00 174.94 174.21 2nr2 s PHE 45 N 1.36 1.21 -1.34 3.97 5.36 -0.50 -0.32 117.98 127.71 2nr2 s PHE 45 Ca 0.05 -0.31 -0.02 0.00 -0.96 0.00 0.00 56.93 55.69 2nr2 s PHE 45 Cb -0.14 -0.83 0.01 0.00 -0.34 0.00 0.00 43.02 41.72 2nr2 s PHE 45 CO -0.06 -0.11 0.16 0.00 -1.46 0.00 0.00 175.22 173.75 2nr2 n ALA 46 N 3.17 -0.81 0.00 11.12 0.00 -1.26 -1.02 120.51 131.70 2nr2 n ALA 46 Ca -0.18 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2nr2 n ALA 46 Cb 0.54 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.77 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 -1.02 3.00 3.76 0.00 0.00 -1.26 -5.01 105.19 104.66 2nr2 n GLY 47 Ca -0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.07 4.46 -0.09 1.61 1.02 -0.19 -5.05 119.74 121.43 2nr2 s LYS 48 Ca 0.00 1.01 -0.23 0.00 0.02 0.00 0.00 55.97 56.77 2nr2 s LYS 48 Cb 0.00 -3.32 -0.03 0.00 -0.52 0.00 0.00 37.83 33.96 2nr2 s LYS 48 CO 0.00 0.41 0.71 -1.14 -0.92 0.00 0.00 175.35 174.41 2nr2 s GLN 49 N -0.49 4.40 -0.09 1.68 0.74 -1.26 -1.41 119.66 123.23 2nr2 s GLN 49 Ca 0.36 0.87 -0.26 0.00 0.05 0.00 0.00 55.36 56.38 2nr2 s GLN 49 Cb -0.21 -3.48 -0.02 0.00 1.10 0.00 0.00 33.01 30.40 2nr2 s GLN 49 CO 0.23 -0.01 0.84 -0.51 -0.55 0.00 0.00 175.29 175.28 2nr2 s LEU 50 N 1.07 4.27 0.14 3.68 1.43 -0.43 -5.02 118.68 123.83 2nr2 s LEU 50 Ca 0.37 1.32 -0.27 0.00 -1.03 0.00 0.00 54.13 54.52 2nr2 s LEU 50 Cb -0.17 -3.29 -0.07 0.00 0.03 0.00 0.00 46.19 42.69 2nr2 s LEU 50 CO 0.17 -0.28 0.83 -0.70 0.23 0.00 0.00 176.35 176.60 2nr2 s GLU 51 N 1.45 4.62 0.00 1.70 2.12 -1.26 -4.52 118.70 122.81 2nr2 s GLU 51 Ca 0.42 1.24 0.00 0.00 0.36 0.00 0.00 54.97 56.99 2nr2 s GLU 51 Cb -0.18 -3.31 0.00 0.00 0.26 0.00 0.00 34.13 30.90 2nr2 s GLU 51 CO 0.18 0.44 0.76 -0.25 -0.54 0.00 0.00 175.26 175.85 2nr2 n ASP 52 N 2.06 0.00 -2.43 -1.70 8.00 -1.26 -3.21 116.55 118.01 2nr2 n ASP 52 Ca -0.03 0.76 -0.22 0.00 0.71 0.00 0.00 54.79 56.01 2nr2 n ASP 52 Cb 0.49 -0.32 -0.10 0.00 -0.02 0.00 0.00 41.12 41.17 2nr2 n ASP 52 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2nr2 n GLY 53 N -0.98 3.81 3.22 0.44 0.00 -1.26 -1.20 105.19 109.22 2nr2 n GLY 53 Ca 0.00 -1.56 -0.16 0.00 0.00 0.00 0.00 46.02 44.30 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 -0.09 0.97 0.79 1.61 1.81 -1.20 -5.01 118.95 117.84 2nr2 s ARG 54 Ca 0.63 -1.26 -0.11 0.00 -1.72 0.00 0.00 55.73 53.27 2nr2 s ARG 54 Cb 0.32 -0.69 0.08 0.00 -0.45 0.00 0.00 34.95 34.21 2nr2 s ARG 54 CO -0.10 0.11 1.15 0.95 -0.68 0.00 0.00 175.30 176.74 2nr2 s THR 55 N -2.56 2.05 0.05 0.02 -4.23 -1.26 -2.33 115.64 107.38 2nr2 s THR 55 Ca 0.10 -0.04 -0.23 0.00 -1.18 0.00 0.00 61.69 60.33 2nr2 s THR 55 Cb -0.02 -3.00 -0.15 0.00 1.34 0.00 0.00 72.50 70.66 2nr2 s THR 55 CO 0.01 -0.00 1.56 -0.07 -0.54 0.00 0.00 174.62 175.58 2nr2 h LEU 56 N -0.99 0.06 -0.98 4.79 3.38 -1.19 -3.20 115.31 117.18 2nr2 h LEU 56 Ca -0.46 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 57.38 2nr2 h LEU 56 Cb 1.33 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 42.00 2nr2 h LEU 56 CO 0.65 0.24 0.63 -1.28 0.09 0.00 0.00 178.44 178.77 2nr2 h SER 57 N -0.12 1.01 -0.86 -0.43 0.87 -1.08 1.00 113.55 113.94 2nr2 h SER 57 Ca 0.01 0.01 0.25 0.00 -1.23 0.00 0.00 61.79 60.83 2nr2 h SER 57 Cb 0.20 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 61.92 2nr2 h SER 57 CO -0.00 0.64 0.62 -0.78 -0.53 0.00 0.00 176.83 176.78 2nr2 h ASP 58 N 1.14 0.00 -0.59 6.23 1.82 -1.81 -0.54 116.42 122.67 2nr2 h ASP 58 Ca 0.42 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.06 2nr2 h ASP 58 Cb 0.16 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.17 2nr2 h ASP 58 CO -0.17 0.00 0.00 -1.22 -1.61 0.00 0.00 179.24 176.24 2nr2 n TYR 59 N -4.27 0.78 -3.63 0.28 4.01 0.29 -4.98 117.16 109.65 2nr2 n TYR 59 Ca 0.18 -0.39 -0.27 0.00 -0.16 0.00 0.00 57.90 57.26 2nr2 n TYR 59 Cb 0.93 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 40.00 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 1.61 -4.59 -4.74 7.72 4.13 -0.21 -5.02 115.26 114.16 2nr2 n ASN 60 Ca 0.23 -0.93 -0.36 0.00 1.68 0.00 0.00 54.58 55.19 2nr2 n ASN 60 Cb 0.62 -3.78 -0.07 0.00 -1.54 0.00 0.00 39.78 35.01 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 -3.52 5.31 0.11 2.41 1.01 -0.97 -4.99 121.20 120.57 2nr2 s ILE 61 Ca 0.37 0.51 0.01 0.00 0.00 0.00 0.00 60.65 61.55 2nr2 s ILE 61 Cb -0.11 -3.61 0.02 0.00 0.01 0.00 0.00 42.46 38.77 2nr2 s ILE 61 CO 0.83 0.41 0.16 0.00 0.00 0.00 0.00 174.94 176.35 2nr2 n GLN 62 N 3.40 0.79 -2.89 2.79 6.02 -1.26 -4.67 117.38 121.57 2nr2 n GLN 62 Ca -0.13 -0.55 -0.37 0.00 -0.01 0.00 0.00 57.00 55.94 2nr2 n GLN 62 Cb 0.52 -0.07 -0.06 0.00 1.02 0.00 0.00 30.24 31.65 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 -2.60 4.52 -1.58 -1.09 -2.85 -1.26 -4.12 119.74 110.75 2nr2 s LYS 63 Ca 0.11 1.20 0.00 0.00 -1.00 0.00 0.00 55.97 56.29 2nr2 s LYS 63 Cb -0.01 -2.92 0.00 0.00 -2.06 0.00 0.00 37.83 32.84 2nr2 s LYS 63 CO 0.07 0.37 0.00 0.39 0.10 0.00 0.00 175.35 176.28 2nr2 n GLU 64 N 0.81 -1.08 -3.09 1.78 1.02 0.33 -4.97 120.64 115.43 2nr2 n GLU 64 Ca -0.00 1.00 -0.32 0.00 -0.02 0.00 0.00 57.16 57.81 2nr2 n GLU 64 Cb 0.50 -5.18 -0.06 0.00 -0.02 0.00 0.00 31.44 26.68 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 -2.77 6.78 -0.30 1.62 0.15 -1.26 -4.66 113.70 113.26 2nr2 s SER 65 Ca 0.00 1.32 -0.08 0.00 0.70 0.00 0.00 55.95 57.88 2nr2 s SER 65 Cb 0.00 -2.39 -0.00 0.00 -1.71 0.00 0.00 66.02 61.92 2nr2 s SER 65 CO 0.00 -0.23 0.12 -0.89 1.20 0.00 0.00 173.24 173.43 2nr2 s THR 66 N -2.03 4.32 0.32 6.45 2.01 -1.26 -0.53 115.64 124.93 2nr2 s THR 66 Ca 0.55 -0.51 0.06 0.00 0.31 0.00 0.00 61.69 62.10 2nr2 s THR 66 Cb -0.10 -3.20 -0.02 0.00 0.01 0.00 0.00 72.50 69.19 2nr2 s THR 66 CO 0.18 0.09 0.41 -0.76 -0.69 0.00 0.00 174.62 173.85 2nr2 s LEU 67 N 1.57 3.95 -0.05 4.42 1.43 0.31 -4.79 118.68 125.52 2nr2 s LEU 67 Ca 0.04 -0.20 0.05 0.00 -1.03 0.00 0.00 54.13 52.99 2nr2 s LEU 67 Cb -0.17 -2.66 -0.01 0.00 0.03 0.00 0.00 46.19 43.39 2nr2 s LEU 67 CO 0.04 -0.34 -0.20 -1.00 0.23 0.00 0.00 176.35 175.08 2nr2 s HIS 68 N -2.16 1.98 -0.15 0.29 3.76 0.56 -0.64 115.29 118.92 2nr2 s HIS 68 Ca 0.42 -0.57 -0.12 0.00 -0.15 0.00 0.00 55.06 54.64 2nr2 s HIS 68 Cb -0.09 -1.32 -0.05 0.00 1.11 0.00 0.00 32.58 32.24 2nr2 s HIS 68 CO 0.30 -0.18 0.24 -1.17 -0.85 0.00 0.00 174.74 173.08 2nr2 s LEU 69 N -0.06 4.28 0.09 0.89 2.96 -0.55 0.20 118.68 126.48 2nr2 s LEU 69 Ca -0.03 0.47 -0.05 0.00 -0.22 0.00 0.00 54.13 54.30 2nr2 s LEU 69 Cb -0.12 -2.27 -0.02 0.00 0.50 0.00 0.00 46.19 44.28 2nr2 s LEU 69 CO 0.03 0.19 0.10 0.68 -1.32 0.00 0.00 176.35 176.03 2nr2 s VAL 70 N 0.08 0.16 0.44 1.68 -7.23 -0.65 -4.26 120.40 110.63 2nr2 s VAL 70 Ca 0.15 -1.52 0.03 0.00 -1.81 0.00 0.00 61.98 58.82 2nr2 s VAL 70 Cb -0.13 -1.55 0.01 0.00 0.56 0.00 0.00 36.38 35.27 2nr2 s VAL 70 CO 0.03 -0.71 0.64 -0.76 -0.31 0.00 0.00 175.10 173.98 2nr2 s LEU 71 N -2.92 3.63 0.13 1.32 1.43 -1.26 -0.75 118.68 120.26 2nr2 s LEU 71 Ca 0.09 0.01 -0.30 0.00 -1.03 0.00 0.00 54.13 52.90 2nr2 s LEU 71 Cb 0.06 -2.93 -0.07 0.00 0.03 0.00 0.00 46.19 43.28 2nr2 s LEU 71 CO -0.08 -0.76 1.27 -0.60 0.23 0.00 0.00 176.35 176.42 2nr2 s ARG 72 N -4.49 4.41 -1.18 1.70 3.52 0.22 -4.72 118.95 118.40 2nr2 s ARG 72 Ca 0.51 1.94 -0.11 0.00 -0.13 0.00 0.00 55.73 57.93 2nr2 s ARG 72 Cb -0.10 -3.26 0.21 0.00 -1.56 0.00 0.00 34.95 30.24 2nr2 s ARG 72 CO 0.36 -0.27 1.41 1.28 -0.81 0.00 0.00 175.30 177.28 2nr2 n LEU 73 N 3.34 5.62 -0.08 -0.88 4.77 -1.26 -4.73 117.00 123.78 2nr2 n LEU 73 Ca 0.08 -4.72 -0.08 0.00 -0.03 0.00 0.00 56.01 51.26 2nr2 n LEU 73 Cb 0.44 -1.53 -0.03 0.00 -2.33 0.00 0.00 43.42 39.97 2nr2 n LEU 73 CO 0.57 1.09 -0.46 -1.14 -1.33 0.00 0.00 177.39 176.12 2nr2 n ARG 74 N 4.15 0.48 0.00 3.23 3.00 -1.26 -5.09 116.66 121.17 2nr2 n ARG 74 Ca 0.33 0.48 0.00 0.00 -0.00 0.00 0.00 57.85 58.65 2nr2 n ARG 74 Cb 0.40 -1.65 0.00 0.00 0.00 0.00 0.00 32.46 31.20 2nr2 n ARG 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2nr2 n GLY 75 N 1.56 -2.14 0.00 5.14 0.00 -1.26 -5.34 105.19 103.15 2nr2 n GLY 75 Ca -0.13 0.79 0.00 0.00 0.00 0.00 0.00 46.02 46.68 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93