#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 4.49 0.14 3.17 0.74 -1.26 -2.32 119.66 124.62 2nr2 s GLN 2 Ca 0.00 1.05 0.04 0.00 0.05 0.00 0.00 55.36 56.50 2nr2 s GLN 2 Cb 0.00 -3.37 -0.04 0.00 1.10 0.00 0.00 33.01 30.70 2nr2 s GLN 2 CO 0.00 0.27 -0.10 0.96 -0.55 0.00 0.00 175.29 175.87 2nr2 s ILE 3 N 0.01 1.14 0.12 -2.34 -4.36 -1.11 0.19 121.20 114.85 2nr2 s ILE 3 Ca 0.38 -2.04 0.10 0.00 -0.26 0.00 0.00 60.65 58.84 2nr2 s ILE 3 Cb -0.20 -1.82 -0.04 0.00 1.25 0.00 0.00 42.46 41.64 2nr2 s ILE 3 CO 0.22 -0.75 -0.26 -0.36 0.24 0.00 0.00 174.94 174.04 2nr2 s PHE 4 N -3.31 2.22 -0.08 1.37 0.08 0.39 -1.72 117.98 116.94 2nr2 s PHE 4 Ca 0.16 -0.39 -0.02 0.00 0.12 0.00 0.00 56.93 56.81 2nr2 s PHE 4 Cb 0.02 -1.22 0.03 0.00 -0.57 0.00 0.00 43.02 41.29 2nr2 s PHE 4 CO 0.00 0.30 0.01 0.08 -0.10 0.00 0.00 175.22 175.52 2nr2 s VAL 5 N -1.05 0.31 -0.16 -0.44 1.01 -0.01 -0.52 120.40 119.53 2nr2 s VAL 5 Ca 0.13 0.11 -0.18 0.00 0.00 0.00 0.00 61.98 62.04 2nr2 s VAL 5 Cb -0.10 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.73 2nr2 s VAL 5 CO 0.05 0.20 0.48 -0.54 0.00 0.00 0.00 175.10 175.29 2nr2 s LYS 6 N 2.00 4.26 0.65 2.72 -0.14 0.07 0.48 119.74 129.78 2nr2 s LYS 6 Ca 0.05 0.39 -0.08 0.00 -1.36 0.00 0.00 55.97 54.97 2nr2 s LYS 6 Cb -0.13 -3.49 0.01 0.00 -1.68 0.00 0.00 37.83 32.55 2nr2 s LYS 6 CO -0.05 0.03 0.99 0.95 -0.76 0.00 0.00 175.35 176.50 2nr2 s THR 7 N 1.06 3.49 0.39 2.17 -4.23 -0.33 -1.02 115.64 117.17 2nr2 s THR 7 Ca 0.24 0.18 0.11 0.00 -1.18 0.00 0.00 61.69 61.04 2nr2 s THR 7 Cb -0.15 -3.43 0.15 0.00 1.34 0.00 0.00 72.50 70.41 2nr2 s THR 7 CO 0.09 -0.50 1.91 -0.07 -0.54 0.00 0.00 174.62 175.52 2nr2 h LEU 8 N -0.40 0.15 -0.04 4.79 3.38 -1.90 -3.27 115.31 118.02 2nr2 h LEU 8 Ca -0.45 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.46 2nr2 h LEU 8 Cb 1.26 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2nr2 h LEU 8 CO 0.62 0.35 -0.08 0.71 0.09 0.00 0.00 178.44 180.13 2nr2 h THR 9 N 0.15 1.44 0.00 0.22 1.35 -1.96 -3.47 112.91 110.64 2nr2 h THR 9 Ca 0.03 -1.42 0.00 0.00 -0.55 0.00 0.00 66.41 64.47 2nr2 h THR 9 Cb 0.41 2.30 0.00 0.00 -1.73 0.00 0.00 68.15 69.13 2nr2 h THR 9 CO 0.03 0.38 0.00 0.61 -0.25 0.00 0.00 175.52 176.29 2nr2 n GLY 10 N 0.47 0.00 3.11 5.82 0.00 -1.23 -5.17 105.19 108.19 2nr2 n GLY 10 Ca -0.08 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 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 0.66 -0.36 1.61 2.20 -1.26 -4.99 119.74 117.60 2nr2 s LYS 11 Ca 0.00 -0.84 -0.17 0.00 -0.36 0.00 0.00 55.97 54.60 2nr2 s LYS 11 Cb 0.00 -0.54 -0.00 0.00 -1.51 0.00 0.00 37.83 35.78 2nr2 s LYS 11 CO 0.00 0.11 0.45 0.99 -0.36 0.00 0.00 175.35 176.54 2nr2 s THR 12 N -1.32 5.08 -0.25 3.43 2.01 -1.26 -1.19 115.64 122.13 2nr2 s THR 12 Ca -0.06 0.10 -0.27 0.00 0.31 0.00 0.00 61.69 61.77 2nr2 s THR 12 Cb -0.10 -3.94 0.00 0.00 0.01 0.00 0.00 72.50 68.48 2nr2 s THR 12 CO 0.01 -0.23 0.95 -0.63 -0.69 0.00 0.00 174.62 174.03 2nr2 s ILE 13 N 2.23 4.72 -0.36 1.82 1.01 0.18 -4.85 121.20 125.95 2nr2 s ILE 13 Ca 0.15 1.75 -0.11 0.00 0.00 0.00 0.00 60.65 62.44 2nr2 s ILE 13 Cb -0.16 -4.24 0.02 0.00 0.01 0.00 0.00 42.46 38.09 2nr2 s ILE 13 CO 0.13 -0.19 0.20 -0.89 0.00 0.00 0.00 174.94 174.19 2nr2 s THR 14 N 3.11 4.59 0.20 2.92 2.01 -1.26 -0.83 115.64 126.38 2nr2 s THR 14 Ca 0.40 -0.77 0.07 0.00 0.31 0.00 0.00 61.69 61.70 2nr2 s THR 14 Cb -0.15 -3.52 -0.04 0.00 0.01 0.00 0.00 72.50 68.80 2nr2 s THR 14 CO 0.08 -0.18 0.03 -0.76 -0.69 0.00 0.00 174.62 173.11 2nr2 s LEU 15 N 1.57 3.40 -0.42 4.42 1.43 -0.70 -5.01 118.68 123.37 2nr2 s LEU 15 Ca 0.03 -0.39 -0.12 0.00 -1.03 0.00 0.00 54.13 52.61 2nr2 s LEU 15 Cb -0.19 -2.01 0.05 0.00 0.03 0.00 0.00 46.19 44.07 2nr2 s LEU 15 CO 0.07 0.06 0.28 -0.70 0.23 0.00 0.00 176.35 176.29 2nr2 s GLU 16 N -3.17 2.82 0.33 1.70 2.56 -1.26 -2.74 118.70 118.93 2nr2 s GLU 16 Ca 0.29 -1.26 0.09 0.00 0.00 0.00 0.00 54.97 54.09 2nr2 s GLU 16 Cb -0.09 -3.88 -0.06 0.00 2.00 0.00 0.00 34.13 32.10 2nr2 s GLU 16 CO 0.20 -0.87 -0.09 0.14 -0.56 0.00 0.00 175.26 174.08 2nr2 s VAL 17 N 1.55 2.13 0.41 3.70 -7.23 -0.98 -4.93 120.40 115.05 2nr2 s VAL 17 Ca 0.03 -2.20 0.07 0.00 -1.81 0.00 0.00 61.98 58.08 2nr2 s VAL 17 Cb -0.22 -2.60 -0.04 0.00 0.56 0.00 0.00 36.38 34.08 2nr2 s VAL 17 CO 0.06 -0.23 0.23 -1.61 -0.31 0.00 0.00 175.10 173.24 2nr2 s GLU 18 N -3.63 2.33 0.45 4.82 0.41 -1.26 -0.33 118.70 121.48 2nr2 s GLU 18 Ca 0.32 -1.73 0.25 0.00 -0.41 0.00 0.00 54.97 53.40 2nr2 s GLU 18 Cb 0.02 -2.11 0.58 0.00 -1.78 0.00 0.00 34.13 30.84 2nr2 s GLU 18 CO 0.16 -0.12 1.69 -1.35 -0.49 0.00 0.00 175.26 175.15 2nr2 h PRO 19 N 1.33 0.00 -0.04 0.39 0.11 -1.97 -2.83 132.00 128.99 2nr2 h PRO 19 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2nr2 h PRO 19 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2nr2 h PRO 19 CO 0.66 0.05 0.00 0.43 -0.21 0.00 0.00 178.00 178.93 2nr2 n SER 20 N -3.12 0.50 -4.81 -2.05 7.64 -1.26 -2.11 113.62 108.40 2nr2 n SER 20 Ca 0.03 -1.43 -0.35 0.00 1.01 0.00 0.00 58.87 58.14 2nr2 n SER 20 Cb 0.49 -0.02 -0.06 0.00 -1.01 0.00 0.00 64.21 63.60 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 -1.67 7.05 0.78 6.43 1.01 -1.07 -4.89 116.67 124.29 2nr2 s ASP 21 Ca 0.33 1.58 -0.11 0.00 0.71 0.00 0.00 52.55 55.06 2nr2 s ASP 21 Cb 0.16 -2.49 0.06 0.00 1.01 0.00 0.00 42.92 41.66 2nr2 s ASP 21 CO 0.26 -0.15 1.10 0.42 0.21 0.00 0.00 175.17 177.00 2nr2 s THR 22 N -1.83 3.19 0.19 -1.27 -4.23 -1.26 -1.94 115.64 108.49 2nr2 s THR 22 Ca 0.53 0.39 0.11 0.00 -1.18 0.00 0.00 61.69 61.53 2nr2 s THR 22 Cb -0.14 -3.17 -0.05 0.00 1.34 0.00 0.00 72.50 70.48 2nr2 s THR 22 CO 0.19 -0.50 1.53 0.40 -0.54 0.00 0.00 174.62 175.69 2nr2 h ILE 23 N -0.99 1.40 -0.99 2.99 1.08 -0.60 -1.65 117.51 118.74 2nr2 h ILE 23 Ca -0.46 -2.40 0.15 0.00 -0.39 0.00 0.00 64.86 61.75 2nr2 h ILE 23 Cb 1.26 2.33 -0.09 0.00 -3.07 0.00 0.00 36.82 37.25 2nr2 h ILE 23 CO 0.60 0.67 0.62 -0.08 -0.69 0.00 0.00 178.15 179.27 2nr2 h GLU 24 N 0.00 0.86 -0.21 2.37 4.81 -1.69 -1.40 114.58 119.31 2nr2 h GLU 24 Ca -0.01 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2nr2 h GLU 24 Cb 1.27 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 2nr2 h GLU 24 CO 0.09 0.57 0.14 -0.97 -0.73 0.00 0.00 179.01 178.11 2nr2 h ASN 25 N 0.88 0.24 -0.12 1.04 -0.73 -1.63 -0.92 115.58 114.35 2nr2 h ASN 25 Ca 0.52 -0.01 -0.00 0.00 1.87 0.00 0.00 56.30 58.68 2nr2 h ASN 25 Cb 0.66 -0.06 -0.01 0.00 0.27 0.00 0.00 38.32 39.18 2nr2 h ASN 25 CO -0.30 0.18 0.07 0.58 -0.37 0.00 0.00 177.43 177.60 2nr2 h VAL 26 N 0.28 1.05 -0.84 2.57 2.07 -1.09 -2.16 116.25 118.14 2nr2 h VAL 26 Ca 0.08 -0.13 0.01 0.00 0.82 0.00 0.00 66.70 67.48 2nr2 h VAL 26 Cb -0.03 0.93 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 2nr2 h VAL 26 CO -0.02 0.05 0.55 0.11 0.02 0.00 0.00 177.57 178.28 2nr2 h LYS 27 N 0.14 1.11 -0.09 1.57 1.57 -1.25 0.36 116.57 119.98 2nr2 h LYS 27 Ca 0.04 -0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 2nr2 h LYS 27 Cb 0.02 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 2nr2 h LYS 27 CO -0.01 0.74 -0.41 0.00 -0.57 0.00 0.00 179.45 179.20 2nr2 h ALA 28 N 1.47 1.15 -0.22 3.86 0.00 -0.87 0.84 119.26 125.48 2nr2 h ALA 28 Ca 0.31 -0.41 -0.17 0.00 0.00 0.00 0.00 54.91 54.64 2nr2 h ALA 28 Cb -0.12 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2nr2 h ALA 28 CO -0.07 0.58 -0.55 0.87 0.00 0.00 0.00 179.25 180.08 2nr2 h LYS 29 N 0.16 0.66 -0.46 0.00 1.57 -0.84 -2.40 116.57 115.27 2nr2 h LYS 29 Ca 0.01 -0.42 -0.09 0.00 -1.87 0.00 0.00 60.65 58.28 2nr2 h LYS 29 Cb 0.80 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.15 2nr2 h LYS 29 CO 0.06 1.04 -0.08 0.82 -0.57 0.00 0.00 179.45 180.72 2nr2 h ILE 30 N 0.51 1.27 -0.88 1.86 2.04 0.36 -2.94 117.51 119.72 2nr2 h ILE 30 Ca 0.01 -1.19 0.22 0.00 1.00 0.00 0.00 64.86 64.90 2nr2 h ILE 30 Cb 1.12 1.10 -0.05 0.00 -0.74 0.00 0.00 36.82 38.25 2nr2 h ILE 30 CO 0.11 0.41 0.60 -0.61 0.00 0.00 0.00 178.15 178.66 2nr2 h GLN 31 N 0.71 0.24 -0.62 2.37 4.15 0.74 0.80 115.11 123.50 2nr2 h GLN 31 Ca 0.12 -0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.48 2nr2 h GLN 31 Cb 0.62 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.23 2nr2 h GLN 31 CO 0.04 0.16 0.23 0.22 -1.93 0.00 0.00 178.83 177.55 2nr2 h ASP 32 N 0.25 0.87 0.00 -0.69 3.58 -1.25 -1.52 116.42 117.66 2nr2 h ASP 32 Ca 0.45 -0.18 -0.11 0.00 0.42 0.00 0.00 57.03 57.60 2nr2 h ASP 32 Cb 1.35 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 42.15 2nr2 h ASP 32 CO -0.11 0.82 -0.62 0.11 -2.88 0.00 0.00 179.24 176.55 2nr2 h LYS 33 N 0.87 0.00 0.00 0.28 1.57 -1.26 -3.41 116.57 114.61 2nr2 h LYS 33 Ca 0.20 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.75 2nr2 h LYS 33 Cb 0.23 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.50 2nr2 h LYS 33 CO -0.01 0.91 -1.84 0.39 -0.57 0.00 0.00 179.45 178.33 2nr2 n GLU 34 N -4.53 0.65 0.00 3.15 -0.58 0.27 -4.98 120.64 114.62 2nr2 n GLU 34 Ca -0.20 0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 2nr2 n GLU 34 Cb 0.54 -1.68 0.00 0.00 -0.57 0.00 0.00 31.44 29.73 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 1.52 2.80 3.68 0.62 0.00 -0.57 -4.99 105.19 108.24 2nr2 n GLY 35 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.58 3.08 0.64 -0.61 1.01 -1.26 -4.89 121.20 116.60 2nr2 s ILE 36 Ca 0.00 0.38 -0.12 0.00 0.00 0.00 0.00 60.65 60.91 2nr2 s ILE 36 Cb 0.00 -3.25 -0.02 0.00 0.01 0.00 0.00 42.46 39.20 2nr2 s ILE 36 CO 0.00 -0.01 1.05 -2.16 0.00 0.00 0.00 174.94 173.81 2nr2 s PRO 37 N 3.31 3.25 0.49 2.79 0.04 -1.26 -4.07 135.00 139.56 2nr2 s PRO 37 Ca 0.78 0.97 0.21 0.00 0.04 0.00 0.00 61.00 62.99 2nr2 s PRO 37 Cb -0.40 -2.03 1.26 0.00 0.04 0.00 0.00 34.50 33.37 2nr2 s PRO 37 CO 0.34 -0.85 1.98 -1.35 0.04 0.00 0.00 177.00 177.16 2nr2 h PRO 38 N -0.24 0.15 -0.78 0.56 0.11 -1.93 -2.54 132.00 127.33 2nr2 h PRO 38 Ca -0.45 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.74 2nr2 h PRO 38 Cb 1.21 -0.03 -0.07 0.00 0.11 0.00 0.00 31.00 32.21 2nr2 h PRO 38 CO 0.58 0.10 0.44 -0.44 -0.21 0.00 0.00 178.00 178.47 2nr2 h ASP 39 N 0.15 0.63 0.86 -2.05 3.32 -1.99 -3.09 116.42 114.25 2nr2 h ASP 39 Ca 0.28 0.05 -0.15 0.00 0.02 0.00 0.00 57.03 57.22 2nr2 h ASP 39 Cb 0.89 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.35 2nr2 h ASP 39 CO -0.04 0.37 -1.23 1.56 -1.72 0.00 0.00 179.24 178.17 2nr2 h GLN 40 N 0.75 0.00 -6.73 3.56 4.20 -1.81 -3.46 115.11 111.62 2nr2 h GLN 40 Ca 0.37 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.56 2nr2 h GLN 40 Cb 0.33 0.00 0.06 0.00 0.30 0.00 0.00 27.48 28.17 2nr2 h GLN 40 CO -0.24 0.33 0.79 -0.65 -0.67 0.00 0.00 178.83 178.39 2nr2 s GLN 41 N -2.94 4.24 -0.00 1.46 -0.21 -1.09 -1.86 119.66 119.27 2nr2 s GLN 41 Ca -0.02 2.34 0.06 0.00 0.02 0.00 0.00 55.36 57.76 2nr2 s GLN 41 Cb 0.09 -3.11 -0.02 0.00 1.00 0.00 0.00 33.01 30.97 2nr2 s GLN 41 CO 0.80 -0.47 -0.18 0.50 -2.12 0.00 0.00 175.29 173.82 2nr2 s ARG 42 N -0.17 1.42 -0.21 2.91 3.52 -0.23 -4.88 118.95 121.32 2nr2 s ARG 42 Ca 0.61 -0.69 0.01 0.00 -0.13 0.00 0.00 55.73 55.54 2nr2 s ARG 42 Cb -0.43 -1.39 0.04 0.00 -1.56 0.00 0.00 34.95 31.61 2nr2 s ARG 42 CO 0.42 0.38 -0.13 -0.51 -0.81 0.00 0.00 175.30 174.65 2nr2 s LEU 43 N -0.55 2.55 -0.20 -0.88 1.43 -1.26 -0.62 118.68 119.15 2nr2 s LEU 43 Ca 0.07 -0.96 -0.07 0.00 -1.03 0.00 0.00 54.13 52.14 2nr2 s LEU 43 Cb -0.07 -1.39 -0.04 0.00 0.03 0.00 0.00 46.19 44.72 2nr2 s LEU 43 CO -0.00 -0.12 0.07 -0.63 0.23 0.00 0.00 176.35 175.90 2nr2 s ILE 44 N 1.29 4.68 -0.07 -0.59 1.01 0.04 -1.62 121.20 125.94 2nr2 s ILE 44 Ca -0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.56 2nr2 s ILE 44 Cb -0.16 -3.13 0.03 0.00 0.01 0.00 0.00 42.46 39.20 2nr2 s ILE 44 CO -0.09 0.42 0.01 0.12 0.00 0.00 0.00 174.94 175.40 2nr2 s PHE 45 N 0.74 0.60 0.00 3.97 5.36 0.04 -1.63 117.98 127.06 2nr2 s PHE 45 Ca 0.04 -0.12 0.00 0.00 -0.96 0.00 0.00 56.93 55.89 2nr2 s PHE 45 Cb -0.13 -0.76 0.00 0.00 -0.34 0.00 0.00 43.02 41.79 2nr2 s PHE 45 CO 0.02 -0.31 0.00 0.00 -1.46 0.00 0.00 175.22 173.47 2nr2 n ALA 46 N 5.13 0.00 0.00 11.12 0.00 -1.26 -3.00 120.51 132.50 2nr2 n ALA 46 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2nr2 n ALA 46 Cb 0.50 -0.22 0.00 0.00 0.00 0.00 0.00 19.45 19.73 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 -2.23 1.35 3.86 0.00 0.00 -1.26 -5.02 105.19 101.89 2nr2 n GLY 47 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2nr2 n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2nr2 s LYS 48 N -0.59 3.84 0.01 1.61 2.20 -1.16 -5.05 119.74 120.60 2nr2 s LYS 48 Ca 0.00 0.29 -0.12 0.00 -0.36 0.00 0.00 55.97 55.78 2nr2 s LYS 48 Cb 0.00 -2.89 -0.05 0.00 -1.51 0.00 0.00 37.83 33.37 2nr2 s LYS 48 CO 0.00 0.47 0.37 1.14 -0.36 0.00 0.00 175.35 176.98 2nr2 s GLN 49 N -2.17 3.80 -0.22 4.03 -2.07 -1.26 -0.78 119.66 120.98 2nr2 s GLN 49 Ca 0.38 0.26 -0.07 0.00 -1.82 0.00 0.00 55.36 54.11 2nr2 s GLN 49 Cb -0.14 -3.14 -0.03 0.00 -1.09 0.00 0.00 33.01 28.61 2nr2 s GLN 49 CO 0.20 0.66 0.06 -0.51 -1.32 0.00 0.00 175.29 174.37 2nr2 s LEU 50 N -1.38 3.54 0.41 2.60 1.43 -0.64 -4.96 118.68 119.69 2nr2 s LEU 50 Ca 0.26 -0.11 -0.25 0.00 -1.03 0.00 0.00 54.13 53.00 2nr2 s LEU 50 Cb -0.15 -1.93 -0.08 0.00 0.03 0.00 0.00 46.19 44.06 2nr2 s LEU 50 CO 0.14 0.04 1.20 -1.61 0.23 0.00 0.00 176.35 176.35 2nr2 s GLU 51 N 1.17 3.97 0.04 1.70 2.02 -1.26 -4.70 118.70 121.63 2nr2 s GLU 51 Ca 0.04 1.91 -0.25 0.00 0.02 0.00 0.00 54.97 56.69 2nr2 s GLU 51 Cb -0.14 -2.65 -0.14 0.00 0.10 0.00 0.00 34.13 31.30 2nr2 s GLU 51 CO 0.03 -0.41 1.35 -0.44 0.02 0.00 0.00 175.26 175.81 2nr2 h ASP 52 N 2.54 -0.77 0.00 -0.19 3.32 -1.98 -3.26 116.42 116.08 2nr2 h ASP 52 Ca -0.49 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.59 2nr2 h ASP 52 Cb 1.24 0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.99 2nr2 h ASP 52 CO 0.62 -0.54 0.00 0.61 -1.72 0.00 0.00 179.24 178.21 2nr2 n GLY 53 N -1.37 0.00 3.44 2.75 0.00 -1.26 -2.12 105.19 106.63 2nr2 n GLY 53 Ca -0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.33 1.58 0.44 1.61 0.52 -1.23 -5.01 118.95 116.52 2nr2 s ARG 54 Ca 0.00 -1.77 -0.13 0.00 -0.52 0.00 0.00 55.73 53.31 2nr2 s ARG 54 Cb 0.00 -1.38 -0.07 0.00 0.52 0.00 0.00 34.95 34.02 2nr2 s ARG 54 CO 0.00 0.15 0.84 0.95 0.02 0.00 0.00 175.30 177.25 2nr2 s THR 55 N -2.82 4.70 0.44 0.02 -4.23 -1.26 -1.07 115.64 111.41 2nr2 s THR 55 Ca 0.29 0.83 0.21 0.00 -1.18 0.00 0.00 61.69 61.84 2nr2 s THR 55 Cb 0.01 -3.72 0.40 0.00 1.34 0.00 0.00 72.50 70.53 2nr2 s THR 55 CO 0.12 -0.56 1.85 -0.07 -0.54 0.00 0.00 174.62 175.42 2nr2 h LEU 56 N 1.19 0.33 -0.02 4.79 3.38 -1.39 -1.93 115.31 121.66 2nr2 h LEU 56 Ca -0.47 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2nr2 h LEU 56 Cb 1.19 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2nr2 h LEU 56 CO 0.63 0.12 0.00 -1.54 0.09 0.00 0.00 178.44 177.74 2nr2 n SER 57 N -4.48 0.38 0.04 -0.43 3.41 -0.90 -1.05 113.62 110.59 2nr2 n SER 57 Ca 0.20 0.54 -0.13 0.00 -0.26 0.00 0.00 58.87 59.22 2nr2 n SER 57 Cb 0.79 -0.64 -0.09 0.00 -0.26 0.00 0.00 64.21 64.01 2nr2 n SER 57 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2nr2 h ASP 58 N 0.00 -0.11 0.64 4.04 3.58 -1.65 -3.01 116.42 119.91 2nr2 h ASP 58 Ca 0.00 -0.33 -0.01 0.00 0.42 0.00 0.00 57.03 57.11 2nr2 h ASP 58 Cb 0.59 0.03 -0.00 0.00 1.72 0.00 0.00 39.33 41.67 2nr2 h ASP 58 CO 0.00 0.29 -0.04 1.88 -2.88 0.00 0.00 179.24 178.49 2nr2 h TYR 59 N -0.52 0.00 -3.65 0.28 0.05 -1.60 -3.48 116.97 108.06 2nr2 h TYR 59 Ca -0.01 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.60 2nr2 h TYR 59 Cb 0.43 0.00 0.08 0.00 1.01 0.00 0.00 36.73 38.25 2nr2 h TYR 59 CO 0.05 0.04 -0.36 0.09 -1.05 0.00 0.00 178.16 176.93 2nr2 n ASN 60 N -3.21 -2.59 -4.62 3.88 3.02 -0.69 -5.01 115.26 106.03 2nr2 n ASN 60 Ca -0.01 -0.29 -0.43 0.00 -0.03 0.00 0.00 54.58 53.82 2nr2 n ASN 60 Cb 0.24 -2.72 -0.02 0.00 -0.61 0.00 0.00 39.78 36.67 2nr2 n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2nr2 s ILE 61 N -3.17 4.29 0.55 2.41 -1.09 -0.22 -4.99 121.20 118.98 2nr2 s ILE 61 Ca 0.08 1.42 0.07 0.00 -2.23 0.00 0.00 60.65 59.98 2nr2 s ILE 61 Cb -0.03 -4.40 0.07 0.00 -1.58 0.00 0.00 42.46 36.51 2nr2 s ILE 61 CO 0.35 -0.67 0.76 -1.10 -1.23 0.00 0.00 174.94 173.06 2nr2 s GLN 62 N 4.12 2.37 0.25 2.79 -0.21 -1.26 -4.71 119.66 123.01 2nr2 s GLN 62 Ca 0.50 -1.35 -0.31 0.00 0.02 0.00 0.00 55.36 54.22 2nr2 s GLN 62 Cb -0.12 -2.61 -0.12 0.00 1.00 0.00 0.00 33.01 31.17 2nr2 s GLN 62 CO 0.24 -0.78 1.65 0.36 -2.12 0.00 0.00 175.29 174.63 2nr2 n LYS 63 N -2.25 2.72 -0.72 2.91 2.85 -1.26 -2.63 118.16 119.78 2nr2 n LYS 63 Ca 0.13 0.97 0.00 0.00 -1.05 0.00 0.00 58.31 58.36 2nr2 n LYS 63 Cb 0.60 -2.79 0.00 0.00 -0.65 0.00 0.00 35.03 32.20 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 2.98 0.00 -2.78 -1.58 1.02 0.13 -5.01 120.64 115.40 2nr2 n GLU 64 Ca 0.12 0.25 -0.41 0.00 -0.02 0.00 0.00 57.16 57.10 2nr2 n GLU 64 Cb 0.36 -2.67 -0.03 0.00 -0.02 0.00 0.00 31.44 29.07 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 -2.51 7.28 -0.43 1.62 0.01 -1.08 -4.76 113.70 113.84 2nr2 s SER 65 Ca 0.00 1.55 -0.12 0.00 1.31 0.00 0.00 55.95 58.69 2nr2 s SER 65 Cb 0.00 -2.53 0.06 0.00 0.21 0.00 0.00 66.02 63.76 2nr2 s SER 65 CO 0.00 -0.23 0.30 -0.89 0.41 0.00 0.00 173.24 172.83 2nr2 s THR 66 N 0.99 4.72 0.40 1.44 2.01 -1.26 -0.46 115.64 123.48 2nr2 s THR 66 Ca 0.49 -1.12 -0.09 0.00 0.31 0.00 0.00 61.69 61.27 2nr2 s THR 66 Cb -0.20 -3.79 -0.06 0.00 0.01 0.00 0.00 72.50 68.46 2nr2 s THR 66 CO 0.26 -0.46 0.75 -0.76 -0.69 0.00 0.00 174.62 173.71 2nr2 s LEU 67 N 1.54 3.82 -0.18 4.42 1.43 0.32 -4.89 118.68 125.14 2nr2 s LEU 67 Ca 0.03 1.05 0.01 0.00 -1.03 0.00 0.00 54.13 54.19 2nr2 s LEU 67 Cb -0.22 -3.94 0.01 0.00 0.03 0.00 0.00 46.19 42.07 2nr2 s LEU 67 CO 0.05 -0.41 -0.18 -1.00 0.23 0.00 0.00 176.35 175.04 2nr2 s HIS 68 N -2.40 2.79 0.05 0.29 3.76 -0.65 -0.75 115.29 118.38 2nr2 s HIS 68 Ca 0.50 -1.50 -0.27 0.00 -0.15 0.00 0.00 55.06 53.63 2nr2 s HIS 68 Cb -0.10 -1.93 -0.05 0.00 1.11 0.00 0.00 32.58 31.61 2nr2 s HIS 68 CO 0.33 -0.74 0.85 -1.17 -0.85 0.00 0.00 174.74 173.16 2nr2 s LEU 69 N 1.23 4.45 0.04 0.89 2.96 -0.19 -0.78 118.68 127.28 2nr2 s LEU 69 Ca 0.03 1.56 -0.01 0.00 -0.22 0.00 0.00 54.13 55.50 2nr2 s LEU 69 Cb -0.14 -3.37 -0.03 0.00 0.50 0.00 0.00 46.19 43.15 2nr2 s LEU 69 CO -0.10 -0.05 -0.03 0.54 -1.32 0.00 0.00 176.35 175.39 2nr2 s VAL 70 N 0.15 0.19 -0.00 1.68 0.11 0.21 -4.18 120.40 118.57 2nr2 s VAL 70 Ca 0.43 -1.59 0.07 0.00 -2.93 0.00 0.00 61.98 57.96 2nr2 s VAL 70 Cb -0.21 -1.22 -0.02 0.00 -1.53 0.00 0.00 36.38 33.39 2nr2 s VAL 70 CO 0.25 -0.88 -0.23 -0.76 -3.33 0.00 0.00 175.10 170.16 2nr2 s LEU 71 N -2.58 2.08 -0.90 2.54 1.43 -1.26 -1.06 118.68 118.92 2nr2 s LEU 71 Ca 0.02 -0.44 -0.16 0.00 -1.03 0.00 0.00 54.13 52.52 2nr2 s LEU 71 Cb 0.04 -1.15 0.19 0.00 0.03 0.00 0.00 46.19 45.29 2nr2 s LEU 71 CO -0.08 0.26 0.96 -0.60 0.23 0.00 0.00 176.35 177.12 2nr2 s ARG 72 N -0.70 3.66 1.29 1.70 3.52 -0.78 -4.96 118.95 122.68 2nr2 s ARG 72 Ca 0.09 -2.23 -0.16 0.00 -0.13 0.00 0.00 55.73 53.29 2nr2 s ARG 72 Cb -0.09 -4.66 0.33 0.00 -1.56 0.00 0.00 34.95 28.97 2nr2 s ARG 72 CO -0.00 -1.50 0.96 1.28 -0.81 0.00 0.00 175.30 175.23 2nr2 n LEU 73 N 5.00 -1.50 -4.78 -0.88 4.77 -1.26 -4.90 117.00 113.44 2nr2 n LEU 73 Ca 0.19 -0.41 -0.38 0.00 -0.03 0.00 0.00 56.01 55.39 2nr2 n LEU 73 Cb 0.47 -1.17 -0.06 0.00 -2.33 0.00 0.00 43.42 40.33 2nr2 n LEU 73 CO 0.42 -3.75 0.60 -0.13 -1.33 0.00 0.00 177.39 173.20 2nr2 s ARG 74 N -4.56 4.60 0.00 3.23 0.52 -1.26 -4.70 118.95 116.77 2nr2 s ARG 74 Ca 0.69 1.29 0.00 0.00 -0.52 0.00 0.00 55.73 57.18 2nr2 s ARG 74 Cb -0.22 -2.95 0.00 0.00 0.52 0.00 0.00 34.95 32.30 2nr2 s ARG 74 CO 0.63 0.37 0.00 0.41 0.02 0.00 0.00 175.30 176.74 2nr2 n GLY 75 N 0.87 0.62 0.00 -3.53 0.00 -1.26 -5.32 105.19 96.57 2nr2 n GLY 75 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93