#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 4.43 0.10 2.12 -0.21 -1.26 -0.67 119.66 124.17 2nr2 s GLN 2 Ca 0.00 0.94 0.06 0.00 0.02 0.00 0.00 55.36 56.38 2nr2 s GLN 2 Cb 0.00 -3.35 -0.03 0.00 1.00 0.00 0.00 33.01 30.63 2nr2 s GLN 2 CO 0.00 0.34 -0.14 0.96 -2.12 0.00 0.00 175.29 174.33 2nr2 s ILE 3 N -0.20 1.25 -0.18 1.08 -4.36 -0.23 -0.49 121.20 118.06 2nr2 s ILE 3 Ca 0.35 -1.58 -0.01 0.00 -0.26 0.00 0.00 60.65 59.16 2nr2 s ILE 3 Cb -0.20 -1.38 0.00 0.00 1.25 0.00 0.00 42.46 42.14 2nr2 s ILE 3 CO 0.21 -0.35 -0.13 -0.36 0.24 0.00 0.00 174.94 174.55 2nr2 s PHE 4 N -1.86 2.84 -0.41 1.37 0.08 -0.49 -0.64 117.98 118.86 2nr2 s PHE 4 Ca 0.05 -1.14 -0.13 0.00 0.12 0.00 0.00 56.93 55.82 2nr2 s PHE 4 Cb -0.06 -1.96 0.04 0.00 -0.57 0.00 0.00 43.02 40.46 2nr2 s PHE 4 CO 0.03 -0.57 0.29 0.08 -0.10 0.00 0.00 175.22 174.94 2nr2 s VAL 5 N 1.12 4.94 -0.24 -0.44 1.01 -0.33 0.17 120.40 126.63 2nr2 s VAL 5 Ca 0.01 -0.89 -0.22 0.00 0.00 0.00 0.00 61.98 60.88 2nr2 s VAL 5 Cb -0.14 -3.82 -0.01 0.00 0.00 0.00 0.00 36.38 32.40 2nr2 s VAL 5 CO -0.04 -0.37 0.71 -0.54 0.00 0.00 0.00 175.10 174.86 2nr2 s LYS 6 N 1.61 4.15 0.81 2.72 1.02 -0.31 -2.22 119.74 127.52 2nr2 s LYS 6 Ca 0.04 0.71 -0.12 0.00 0.02 0.00 0.00 55.97 56.62 2nr2 s LYS 6 Cb -0.21 -3.64 0.08 0.00 -0.52 0.00 0.00 37.83 33.54 2nr2 s LYS 6 CO 0.07 -0.43 1.17 0.95 -0.92 0.00 0.00 175.35 176.19 2nr2 s THR 7 N 2.56 2.17 0.12 2.17 -4.23 -0.36 -0.38 115.64 117.69 2nr2 s THR 7 Ca 0.30 0.05 0.17 0.00 -1.18 0.00 0.00 61.69 61.03 2nr2 s THR 7 Cb -0.15 -3.02 0.10 0.00 1.34 0.00 0.00 72.50 70.76 2nr2 s THR 7 CO 0.08 -0.07 1.66 -0.07 -0.54 0.00 0.00 174.62 175.68 2nr2 h LEU 8 N -1.07 0.00 -0.30 4.79 3.38 -1.89 -3.37 115.31 116.86 2nr2 h LEU 8 Ca -0.46 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.31 2nr2 h LEU 8 Cb 1.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.07 2nr2 h LEU 8 CO 0.65 0.44 -0.85 0.71 0.09 0.00 0.00 178.44 179.48 2nr2 h THR 9 N 0.00 1.44 0.00 0.22 1.35 -1.94 -3.47 112.91 110.50 2nr2 h THR 9 Ca -0.00 -2.43 0.00 0.00 -0.55 0.00 0.00 66.41 63.43 2nr2 h THR 9 Cb 1.03 2.35 0.00 0.00 -1.73 0.00 0.00 68.15 69.80 2nr2 h THR 9 CO 0.06 0.72 0.00 0.61 -0.25 0.00 0.00 175.52 176.65 2nr2 n GLY 10 N 0.80 0.18 3.81 5.82 0.00 -1.26 -5.14 105.19 109.41 2nr2 n GLY 10 Ca -0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 2nr2 n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nr2 s LYS 11 N 0.00 3.83 -0.51 1.61 1.02 -1.26 -4.95 119.74 119.47 2nr2 s LYS 11 Ca 0.00 0.01 -0.04 0.00 0.02 0.00 0.00 55.97 55.96 2nr2 s LYS 11 Cb 0.00 -3.28 0.13 0.00 -0.52 0.00 0.00 37.83 34.16 2nr2 s LYS 11 CO 0.00 0.57 0.32 0.99 -0.92 0.00 0.00 175.35 176.31 2nr2 s THR 12 N -0.50 3.60 -0.18 2.17 2.01 -1.26 -1.22 115.64 120.25 2nr2 s THR 12 Ca 0.16 -2.39 -0.18 0.00 0.31 0.00 0.00 61.69 59.59 2nr2 s THR 12 Cb -0.13 -3.40 -0.03 0.00 0.01 0.00 0.00 72.50 68.95 2nr2 s THR 12 CO 0.05 -0.78 0.50 0.27 -0.69 0.00 0.00 174.62 173.97 2nr2 s ILE 13 N 0.68 5.13 -0.45 1.82 -4.36 -0.94 -4.89 121.20 118.19 2nr2 s ILE 13 Ca 0.11 0.94 -0.21 0.00 -0.26 0.00 0.00 60.65 61.23 2nr2 s ILE 13 Cb -0.22 -3.83 0.03 0.00 1.25 0.00 0.00 42.46 39.69 2nr2 s ILE 13 CO -0.04 0.21 0.68 -0.89 0.24 0.00 0.00 174.94 175.14 2nr2 s THR 14 N 1.43 4.78 0.24 8.37 2.01 -1.26 -1.18 115.64 130.04 2nr2 s THR 14 Ca 0.24 0.13 -0.05 0.00 0.31 0.00 0.00 61.69 62.32 2nr2 s THR 14 Cb -0.15 -4.24 -0.05 0.00 0.01 0.00 0.00 72.50 68.06 2nr2 s THR 14 CO 0.10 -0.65 0.50 -0.76 -0.69 0.00 0.00 174.62 173.11 2nr2 s LEU 15 N 2.93 4.14 -0.24 4.42 1.43 0.18 -4.89 118.68 126.64 2nr2 s LEU 15 Ca 0.24 0.67 -0.17 0.00 -1.03 0.00 0.00 54.13 53.83 2nr2 s LEU 15 Cb -0.14 -3.46 -0.03 0.00 0.03 0.00 0.00 46.19 42.59 2nr2 s LEU 15 CO 0.19 -0.11 0.49 -1.61 0.23 0.00 0.00 176.35 175.54 2nr2 s GLU 16 N -3.25 4.10 0.27 1.70 2.02 -1.26 -1.07 118.70 121.21 2nr2 s GLU 16 Ca 0.43 0.30 0.02 0.00 0.02 0.00 0.00 54.97 55.74 2nr2 s GLU 16 Cb -0.11 -3.62 -0.04 0.00 0.10 0.00 0.00 34.13 30.46 2nr2 s GLU 16 CO 0.28 -0.26 0.16 0.14 0.02 0.00 0.00 175.26 175.59 2nr2 s VAL 17 N 2.02 0.23 0.19 2.63 -7.23 0.16 -4.87 120.40 113.53 2nr2 s VAL 17 Ca 0.21 -2.00 0.10 0.00 -1.81 0.00 0.00 61.98 58.48 2nr2 s VAL 17 Cb -0.15 -2.52 -0.04 0.00 0.56 0.00 0.00 36.38 34.22 2nr2 s VAL 17 CO 0.09 0.00 -0.22 -1.61 -0.31 0.00 0.00 175.10 173.05 2nr2 s GLU 18 N -3.89 1.44 0.53 4.82 2.02 -1.26 -0.37 118.70 121.99 2nr2 s GLU 18 Ca 0.37 -1.50 0.35 0.00 0.02 0.00 0.00 54.97 54.22 2nr2 s GLU 18 Cb 0.06 -1.66 1.75 0.00 0.10 0.00 0.00 34.13 34.38 2nr2 s GLU 18 CO 0.17 0.35 2.07 -1.00 0.02 0.00 0.00 175.26 176.87 2nr2 h PRO 19 N 3.15 0.00 -0.27 0.39 0.13 -1.97 -2.40 132.00 131.03 2nr2 h PRO 19 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2nr2 h PRO 19 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2nr2 h PRO 19 CO 0.50 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.70 2nr2 n SER 20 N -2.86 1.76 -4.80 1.44 7.64 -1.26 -2.50 113.62 113.03 2nr2 n SER 20 Ca -0.01 -1.88 -0.35 0.00 1.01 0.00 0.00 58.87 57.64 2nr2 n SER 20 Cb 0.16 -0.18 -0.07 0.00 -1.01 0.00 0.00 64.21 63.11 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 -1.22 7.13 0.79 6.43 1.01 -0.91 -4.95 116.67 124.95 2nr2 s ASP 21 Ca 0.27 1.70 -0.11 0.00 0.71 0.00 0.00 52.55 55.11 2nr2 s ASP 21 Cb 0.14 -2.53 0.07 0.00 1.01 0.00 0.00 42.92 41.60 2nr2 s ASP 21 CO 0.20 -0.16 1.10 0.42 0.21 0.00 0.00 175.17 176.93 2nr2 s THR 22 N -1.82 3.08 0.08 -1.27 -4.23 -1.26 -3.30 115.64 106.92 2nr2 s THR 22 Ca 0.54 0.35 -0.06 0.00 -1.18 0.00 0.00 61.69 61.34 2nr2 s THR 22 Cb -0.15 -3.12 -0.27 0.00 1.34 0.00 0.00 72.50 70.31 2nr2 s THR 22 CO 0.19 -0.46 1.17 0.40 -0.54 0.00 0.00 174.62 175.38 2nr2 h ILE 23 N -1.06 1.45 -0.94 2.99 2.04 -1.03 -2.47 117.51 118.49 2nr2 h ILE 23 Ca -0.47 -2.87 0.25 0.00 1.00 0.00 0.00 64.86 62.77 2nr2 h ILE 23 Cb 1.27 2.83 -0.13 0.00 -0.74 0.00 0.00 36.82 40.04 2nr2 h ILE 23 CO 0.60 0.85 0.46 -0.08 0.00 0.00 0.00 178.15 179.97 2nr2 h GLU 24 N 0.12 0.39 -0.58 2.37 4.81 -1.17 -2.13 114.58 118.40 2nr2 h GLU 24 Ca -0.13 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.00 2nr2 h GLU 24 Cb 1.90 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 31.16 2nr2 h GLU 24 CO 0.20 0.26 0.07 -0.97 -0.73 0.00 0.00 179.01 177.84 2nr2 h ASN 25 N 0.40 0.90 0.56 1.04 -1.24 -1.79 -2.05 115.58 113.40 2nr2 h ASN 25 Ca 0.62 -0.21 -0.08 0.00 0.71 0.00 0.00 56.30 57.34 2nr2 h ASN 25 Cb 1.24 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 40.04 2nr2 h ASN 25 CO -0.55 0.92 -0.39 0.58 -1.29 0.00 0.00 177.43 176.70 2nr2 h VAL 26 N 0.89 1.10 -0.01 2.57 2.07 -0.96 -1.41 116.25 120.51 2nr2 h VAL 26 Ca 0.18 -1.42 -0.10 0.00 0.82 0.00 0.00 66.70 66.17 2nr2 h VAL 26 Cb 0.42 1.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 2nr2 h VAL 26 CO 0.01 0.38 -0.49 0.11 0.02 0.00 0.00 177.57 177.61 2nr2 h LYS 27 N 0.00 0.02 0.00 1.57 1.57 -0.87 -2.59 116.57 116.27 2nr2 h LYS 27 Ca -0.00 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.69 2nr2 h LYS 27 Cb 0.77 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.07 2nr2 h LYS 27 CO 0.05 0.51 -0.34 0.00 -0.57 0.00 0.00 179.45 179.09 2nr2 h ALA 28 N 1.49 1.16 -0.12 3.86 0.00 -0.84 0.92 119.26 125.72 2nr2 h ALA 28 Ca -0.00 -0.31 -0.18 0.00 0.00 0.00 0.00 54.91 54.42 2nr2 h ALA 28 Cb 0.87 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2nr2 h ALA 28 CO 0.06 0.43 -0.67 0.87 0.00 0.00 0.00 179.25 179.95 2nr2 h LYS 29 N 0.00 0.49 -0.37 0.00 1.79 -0.91 0.93 116.57 118.50 2nr2 h LYS 29 Ca -0.00 -0.36 0.00 0.00 -2.18 0.00 0.00 60.65 58.10 2nr2 h LYS 29 Cb 0.74 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.43 2nr2 h LYS 29 CO 0.04 0.99 0.23 0.82 -1.08 0.00 0.00 179.45 180.45 2nr2 h ILE 30 N 0.35 1.11 -0.51 1.86 2.04 -1.10 -2.80 117.51 118.46 2nr2 h ILE 30 Ca -0.02 -0.24 0.04 0.00 1.00 0.00 0.00 64.86 65.65 2nr2 h ILE 30 Cb 1.23 0.61 -0.04 0.00 -0.74 0.00 0.00 36.82 37.88 2nr2 h ILE 30 CO 0.12 0.11 0.26 -0.61 0.00 0.00 0.00 178.15 178.03 2nr2 h GLN 31 N 0.49 0.49 -0.98 2.37 4.15 -0.56 0.05 115.11 121.12 2nr2 h GLN 31 Ca 0.13 -0.03 0.30 0.00 0.77 0.00 0.00 58.65 59.82 2nr2 h GLN 31 Cb -0.02 -0.11 -0.14 0.00 0.21 0.00 0.00 27.48 27.41 2nr2 h GLN 31 CO -0.03 0.32 0.51 0.22 -1.93 0.00 0.00 178.83 177.93 2nr2 h ASP 32 N 0.51 0.44 0.00 -0.69 3.58 -0.84 -0.40 116.42 119.02 2nr2 h ASP 32 Ca 0.22 0.19 -0.01 0.00 0.42 0.00 0.00 57.03 57.85 2nr2 h ASP 32 Cb 0.13 0.15 -0.00 0.00 1.72 0.00 0.00 39.33 41.33 2nr2 h ASP 32 CO -0.16 -0.11 -0.42 0.50 -2.88 0.00 0.00 179.24 176.17 2nr2 h LYS 33 N 0.33 0.00 0.00 0.28 3.64 -1.00 -3.43 116.57 116.40 2nr2 h LYS 33 Ca 0.69 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.88 2nr2 h LYS 33 Cb 1.52 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.30 2nr2 h LYS 33 CO -0.60 0.08 -2.00 0.39 -2.27 0.00 0.00 179.45 175.04 2nr2 n GLU 34 N -4.65 0.66 -1.74 1.90 -0.58 -0.10 -5.02 120.64 111.11 2nr2 n GLU 34 Ca -0.07 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 2nr2 n GLU 34 Cb 0.23 -1.60 0.00 0.00 -0.57 0.00 0.00 31.44 29.50 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 1.50 0.58 2.83 0.62 0.00 -0.16 -5.03 105.19 105.52 2nr2 n GLY 35 Ca -0.17 -0.41 -0.29 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.89 0.98 0.36 -0.61 1.01 -1.26 -5.04 121.20 113.75 2nr2 s ILE 36 Ca 0.00 -0.87 -0.28 0.00 0.00 0.00 0.00 60.65 59.50 2nr2 s ILE 36 Cb 0.00 -1.38 -0.11 0.00 0.01 0.00 0.00 42.46 40.98 2nr2 s ILE 36 CO 0.00 -0.17 1.50 -2.84 0.00 0.00 0.00 174.94 173.43 2nr2 s PRO 37 N 1.65 4.11 0.56 2.79 0.02 -1.26 -4.07 135.00 138.81 2nr2 s PRO 37 Ca -0.03 2.57 0.30 0.00 0.02 0.00 0.00 61.00 63.85 2nr2 s PRO 37 Cb -0.18 -2.98 1.46 0.00 0.02 0.00 0.00 34.50 32.82 2nr2 s PRO 37 CO -0.07 -0.55 1.89 -1.00 -0.33 0.00 0.00 177.00 176.94 2nr2 h PRO 38 N 3.35 0.00 -0.49 5.54 0.13 -1.91 -0.85 132.00 137.77 2nr2 h PRO 38 Ca -0.50 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.64 2nr2 h PRO 38 Cb 1.24 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.34 2nr2 h PRO 38 CO 0.67 0.00 0.33 -0.44 -0.23 0.00 0.00 178.00 178.32 2nr2 h ASP 39 N 0.00 0.53 0.00 1.44 3.32 -1.94 -2.65 116.42 117.11 2nr2 h ASP 39 Ca 0.31 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.35 2nr2 h ASP 39 Cb 1.40 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.82 2nr2 h ASP 39 CO -0.00 0.38 0.00 0.00 -1.72 0.00 0.00 179.24 177.89 2nr2 n GLN 40 N -4.47 1.00 -3.94 3.56 6.02 -0.32 -4.40 117.38 114.83 2nr2 n GLN 40 Ca 0.05 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.94 2nr2 n GLN 40 Cb 0.09 -1.28 -0.10 0.00 1.02 0.00 0.00 30.24 29.96 2nr2 n GLN 40 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 2nr2 s GLN 41 N -2.00 0.40 0.07 -1.09 -2.07 -1.00 -2.65 119.66 111.32 2nr2 s GLN 41 Ca 0.27 -0.56 0.05 0.00 -1.82 0.00 0.00 55.36 53.30 2nr2 s GLN 41 Cb 0.13 0.15 -0.03 0.00 -1.09 0.00 0.00 33.01 32.17 2nr2 s GLN 41 CO 0.21 -0.08 -0.14 0.50 -1.32 0.00 0.00 175.29 174.45 2nr2 s ARG 42 N -1.58 0.83 0.08 9.60 3.52 -0.42 -4.76 118.95 126.22 2nr2 s ARG 42 Ca -0.14 -0.96 0.03 0.00 -0.13 0.00 0.00 55.73 54.53 2nr2 s ARG 42 Cb -0.08 -0.85 -0.04 0.00 -1.56 0.00 0.00 34.95 32.42 2nr2 s ARG 42 CO -0.01 0.19 0.05 -0.51 -0.81 0.00 0.00 175.30 174.22 2nr2 s LEU 43 N -1.73 3.70 -0.05 -0.88 1.43 -1.26 -1.08 118.68 118.81 2nr2 s LEU 43 Ca -0.02 -0.05 0.03 0.00 -1.03 0.00 0.00 54.13 53.06 2nr2 s LEU 43 Cb -0.10 -2.38 0.01 0.00 0.03 0.00 0.00 46.19 43.74 2nr2 s LEU 43 CO 0.02 0.18 -0.13 -0.63 0.23 0.00 0.00 176.35 176.02 2nr2 s ILE 44 N -1.35 1.16 -0.19 -0.59 1.01 -0.91 -0.13 121.20 120.20 2nr2 s ILE 44 Ca 0.28 -0.53 -0.00 0.00 0.00 0.00 0.00 60.65 60.39 2nr2 s ILE 44 Cb -0.12 -1.03 0.01 0.00 0.01 0.00 0.00 42.46 41.32 2nr2 s ILE 44 CO 0.20 0.35 -0.15 0.12 0.00 0.00 0.00 174.94 175.47 2nr2 s PHE 45 N 0.38 2.83 0.00 3.97 5.36 -0.58 -1.34 117.98 128.59 2nr2 s PHE 45 Ca -0.09 -1.33 0.00 0.00 -0.96 0.00 0.00 56.93 54.55 2nr2 s PHE 45 Cb -0.13 -1.97 0.00 0.00 -0.34 0.00 0.00 43.02 40.58 2nr2 s PHE 45 CO 0.03 -0.67 0.00 0.00 -1.46 0.00 0.00 175.22 173.11 2nr2 n ALA 46 N 4.56 0.00 0.00 11.12 0.00 -1.26 -2.42 120.51 132.51 2nr2 n ALA 46 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2nr2 n ALA 46 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 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 0.00 3.91 0.00 0.00 -1.26 -5.09 105.19 102.75 2nr2 n GLY 47 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.67 3.39 0.14 1.61 1.02 -1.02 -5.10 119.74 118.11 2nr2 s LYS 48 Ca 0.00 -0.47 -0.30 0.00 0.02 0.00 0.00 55.97 55.22 2nr2 s LYS 48 Cb 0.00 -3.01 -0.07 0.00 -0.52 0.00 0.00 37.83 34.23 2nr2 s LYS 48 CO 0.00 0.60 1.15 -0.65 -0.92 0.00 0.00 175.35 175.54 2nr2 s GLN 49 N -2.53 4.51 -0.12 1.68 -0.21 -1.26 -1.53 119.66 120.20 2nr2 s GLN 49 Ca 0.34 1.77 -0.25 0.00 0.02 0.00 0.00 55.36 57.24 2nr2 s GLN 49 Cb -0.13 -3.30 -0.02 0.00 1.00 0.00 0.00 33.01 30.56 2nr2 s GLN 49 CO 0.27 -0.08 0.82 -0.51 -2.12 0.00 0.00 175.29 173.67 2nr2 s LEU 50 N 0.18 4.24 0.09 2.90 1.43 0.81 -4.92 118.68 123.40 2nr2 s LEU 50 Ca 0.53 1.24 -0.31 0.00 -1.03 0.00 0.00 54.13 54.57 2nr2 s LEU 50 Cb -0.30 -3.24 -0.09 0.00 0.03 0.00 0.00 46.19 42.60 2nr2 s LEU 50 CO 0.33 -0.31 1.67 -0.70 0.23 0.00 0.00 176.35 177.57 2nr2 s GLU 51 N 1.66 4.19 0.12 1.70 2.12 -1.26 -4.61 118.70 122.62 2nr2 s GLU 51 Ca 0.40 2.37 -0.17 0.00 0.36 0.00 0.00 54.97 57.92 2nr2 s GLU 51 Cb -0.17 -3.55 -0.03 0.00 0.26 0.00 0.00 34.13 30.63 2nr2 s GLU 51 CO 0.16 -0.74 1.65 -0.44 -0.54 0.00 0.00 175.26 175.35 2nr2 h ASP 52 N 8.21 0.48 -0.26 -1.70 3.32 -1.95 -2.98 116.42 121.53 2nr2 h ASP 52 Ca -0.43 -0.18 -0.15 0.00 0.02 0.00 0.00 57.03 56.29 2nr2 h ASP 52 Cb 1.20 -0.12 -0.08 0.00 0.22 0.00 0.00 39.33 40.55 2nr2 h ASP 52 CO 0.93 0.53 0.19 0.61 -1.72 0.00 0.00 179.24 179.78 2nr2 n GLY 53 N -0.70 2.91 3.77 2.75 0.00 -1.26 -0.73 105.19 111.93 2nr2 n GLY 53 Ca -0.01 -0.40 -0.23 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.91 2.40 0.79 1.61 1.81 -1.13 -4.96 118.95 118.56 2nr2 s ARG 54 Ca 0.16 -1.60 -0.06 0.00 -1.72 0.00 0.00 55.73 52.51 2nr2 s ARG 54 Cb 0.13 -2.19 0.14 0.00 -0.45 0.00 0.00 34.95 32.58 2nr2 s ARG 54 CO 0.02 -0.00 1.10 0.95 -0.68 0.00 0.00 175.30 176.68 2nr2 s THR 55 N -2.47 2.12 -0.02 0.02 -4.23 -1.26 -1.00 115.64 108.79 2nr2 s THR 55 Ca 0.41 -0.37 -0.16 0.00 -1.18 0.00 0.00 61.69 60.39 2nr2 s THR 55 Cb -0.01 -2.75 -0.33 0.00 1.34 0.00 0.00 72.50 70.75 2nr2 s THR 55 CO 0.24 0.00 0.83 -0.07 -0.54 0.00 0.00 174.62 175.08 2nr2 h LEU 56 N -0.88 0.66 -0.86 4.79 3.38 -1.52 -3.29 115.31 117.58 2nr2 h LEU 56 Ca -0.40 -0.92 0.02 0.00 0.09 0.00 0.00 57.88 56.67 2nr2 h LEU 56 Cb 1.26 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.75 2nr2 h LEU 56 CO 0.42 1.66 0.56 0.77 0.09 0.00 0.00 178.44 181.94 2nr2 h SER 57 N -0.02 0.95 -0.47 -0.43 4.64 -1.75 -1.60 113.55 114.86 2nr2 h SER 57 Ca -0.27 -0.02 0.10 0.00 -0.47 0.00 0.00 61.79 61.13 2nr2 h SER 57 Cb 2.00 -0.23 -0.10 0.00 -0.31 0.00 0.00 62.40 63.76 2nr2 h SER 57 CO 0.20 0.67 -0.22 -0.78 -0.87 0.00 0.00 176.83 175.83 2nr2 h ASP 58 N 1.12 -0.77 0.24 4.97 3.58 -1.87 -1.50 116.42 122.19 2nr2 h ASP 58 Ca 0.33 0.18 0.00 0.00 0.42 0.00 0.00 57.03 57.95 2nr2 h ASP 58 Cb -0.07 0.41 0.00 0.00 1.72 0.00 0.00 39.33 41.40 2nr2 h ASP 58 CO -0.09 -0.25 -0.13 -1.22 -2.88 0.00 0.00 179.24 174.68 2nr2 n TYR 59 N -5.40 0.00 -2.70 0.28 4.01 -1.05 -4.93 117.16 107.36 2nr2 n TYR 59 Ca 0.04 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.70 2nr2 n TYR 59 Cb 0.31 -0.12 0.02 0.00 -0.31 0.00 0.00 39.34 39.24 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 -0.68 -3.26 -4.71 7.72 4.13 -0.57 -5.00 115.26 112.89 2nr2 n ASN 60 Ca 0.15 -0.14 -0.40 0.00 1.68 0.00 0.00 54.58 55.87 2nr2 n ASN 60 Cb 0.30 -1.98 -0.04 0.00 -1.54 0.00 0.00 39.78 36.52 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 -2.94 4.99 0.32 2.41 1.01 -0.68 -5.00 121.20 121.30 2nr2 s ILE 61 Ca 0.15 1.59 0.01 0.00 0.00 0.00 0.00 60.65 62.40 2nr2 s ILE 61 Cb -0.07 -4.11 0.01 0.00 0.01 0.00 0.00 42.46 38.30 2nr2 s ILE 61 CO 0.19 0.20 0.08 0.00 0.00 0.00 0.00 174.94 175.41 2nr2 n GLN 62 N 4.01 1.17 -1.71 2.79 1.13 -1.26 -4.64 117.38 118.86 2nr2 n GLN 62 Ca 0.01 -2.19 -0.66 0.00 -1.94 0.00 0.00 57.00 52.22 2nr2 n GLN 62 Cb 0.51 0.47 -0.09 0.00 0.11 0.00 0.00 30.24 31.24 2nr2 n GLN 62 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 2nr2 n LYS 63 N -0.94 0.09 -3.42 -1.09 4.81 -1.26 -2.87 118.16 113.48 2nr2 n LYS 63 Ca -0.09 0.03 -0.17 0.00 -0.87 0.00 0.00 58.31 57.22 2nr2 n LYS 63 Cb 0.39 -1.55 0.09 0.00 0.02 0.00 0.00 35.03 33.97 2nr2 n LYS 63 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2nr2 n GLU 64 N 3.70 -6.22 -3.25 1.64 1.02 0.35 -5.00 120.64 112.88 2nr2 n GLU 64 Ca 0.29 0.85 -0.39 0.00 -0.02 0.00 0.00 57.16 57.89 2nr2 n GLU 64 Cb -0.02 -5.85 -0.06 0.00 -0.02 0.00 0.00 31.44 25.49 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 -4.28 6.89 -0.50 1.62 0.01 -1.14 -4.86 113.70 111.45 2nr2 s SER 65 Ca 0.04 1.06 -0.28 0.00 1.31 0.00 0.00 55.95 58.09 2nr2 s SER 65 Cb -0.01 -2.34 0.03 0.00 0.21 0.00 0.00 66.02 63.92 2nr2 s SER 65 CO 0.73 0.08 1.09 -0.89 0.41 0.00 0.00 173.24 174.67 2nr2 s THR 66 N -0.01 4.24 0.41 1.44 2.01 -1.26 -1.40 115.64 121.07 2nr2 s THR 66 Ca 0.30 1.01 0.08 0.00 0.31 0.00 0.00 61.69 63.38 2nr2 s THR 66 Cb -0.17 -4.59 -0.02 0.00 0.01 0.00 0.00 72.50 67.73 2nr2 s THR 66 CO 0.15 -1.04 0.38 -0.76 -0.69 0.00 0.00 174.62 172.66 2nr2 s LEU 67 N 4.37 3.41 0.06 4.42 1.02 0.13 -4.64 118.68 127.46 2nr2 s LEU 67 Ca 0.44 -0.72 0.07 0.00 0.02 0.00 0.00 54.13 53.94 2nr2 s LEU 67 Cb -0.08 -2.09 -0.03 0.00 0.02 0.00 0.00 46.19 44.02 2nr2 s LEU 67 CO 0.29 -0.64 -0.20 -1.00 0.02 0.00 0.00 176.35 174.82 2nr2 s HIS 68 N -2.46 1.75 -0.11 0.29 3.76 -0.45 -1.16 115.29 116.91 2nr2 s HIS 68 Ca 0.48 -0.39 0.01 0.00 -0.15 0.00 0.00 55.06 55.01 2nr2 s HIS 68 Cb -0.04 -1.01 -0.02 0.00 1.11 0.00 0.00 32.58 32.62 2nr2 s HIS 68 CO 0.28 0.12 -0.13 -1.17 -0.85 0.00 0.00 174.74 172.99 2nr2 s LEU 69 N -1.41 2.73 0.32 0.89 0.20 0.48 -2.13 118.68 119.76 2nr2 s LEU 69 Ca 0.06 -0.29 0.09 0.00 0.69 0.00 0.00 54.13 54.68 2nr2 s LEU 69 Cb -0.09 -1.60 -0.06 0.00 -0.43 0.00 0.00 46.19 44.00 2nr2 s LEU 69 CO 0.03 0.20 -0.10 0.68 -0.29 0.00 0.00 176.35 176.87 2nr2 s VAL 70 N 0.12 2.14 0.27 1.68 -7.23 -0.24 -4.12 120.40 113.02 2nr2 s VAL 70 Ca -0.06 -2.21 -0.30 0.00 -1.81 0.00 0.00 61.98 57.60 2nr2 s VAL 70 Cb -0.15 -2.55 -0.09 0.00 0.56 0.00 0.00 36.38 34.14 2nr2 s VAL 70 CO 0.05 -0.25 1.08 -0.22 -0.31 0.00 0.00 175.10 175.44 2nr2 s LEU 71 N -3.56 4.57 -0.01 1.32 2.96 -1.26 -1.30 118.68 121.39 2nr2 s LEU 71 Ca 0.31 2.22 0.02 0.00 -0.22 0.00 0.00 54.13 56.46 2nr2 s LEU 71 Cb 0.02 -3.62 -0.00 0.00 0.50 0.00 0.00 46.19 43.08 2nr2 s LEU 71 CO 0.15 -0.10 -0.07 -0.60 -1.32 0.00 0.00 176.35 174.41 2nr2 s ARG 72 N -1.37 0.63 0.16 1.98 3.52 -1.08 -4.68 118.95 118.11 2nr2 s ARG 72 Ca 0.44 -0.23 -0.18 0.00 -0.13 0.00 0.00 55.73 55.63 2nr2 s ARG 72 Cb -0.31 -0.61 -0.07 0.00 -1.56 0.00 0.00 34.95 32.39 2nr2 s ARG 72 CO 0.40 0.12 0.62 -0.51 -0.81 0.00 0.00 175.30 175.11 2nr2 s LEU 73 N 0.01 4.39 0.25 -0.88 1.43 -1.26 -4.12 118.68 118.50 2nr2 s LEU 73 Ca 0.00 1.26 -0.30 0.00 -1.03 0.00 0.00 54.13 54.06 2nr2 s LEU 73 Cb -0.05 -3.29 -0.09 0.00 0.03 0.00 0.00 46.19 42.79 2nr2 s LEU 73 CO -0.00 0.12 1.04 0.00 0.23 0.00 0.00 176.35 177.74 2nr2 s ARG 74 N -1.74 4.71 0.00 1.70 1.70 -1.26 -4.64 118.95 119.42 2nr2 s ARG 74 Ca 0.37 1.68 0.00 0.00 -0.47 0.00 0.00 55.73 57.31 2nr2 s ARG 74 Cb -0.17 -3.24 0.00 0.00 -0.57 0.00 0.00 34.95 30.97 2nr2 s ARG 74 CO 0.20 0.30 0.00 0.41 -1.08 0.00 0.00 175.30 175.13 2nr2 n GLY 75 N 1.45 0.16 0.00 3.88 0.00 -1.26 -5.20 105.19 104.22 2nr2 n GLY 75 Ca -0.01 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.31 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93