#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 4.14 0.05 3.17 -2.07 -1.26 -0.80 119.66 122.89 2nr2 s GLN 2 Ca 0.00 0.78 -0.02 0.00 -1.82 0.00 0.00 55.36 54.30 2nr2 s GLN 2 Cb 0.00 -2.69 -0.03 0.00 -1.09 0.00 0.00 33.01 29.20 2nr2 s GLN 2 CO 0.00 0.29 -0.01 0.96 -1.32 0.00 0.00 175.29 175.22 2nr2 s ILE 3 N -1.72 0.19 -0.26 3.63 -4.36 0.54 0.32 121.20 119.54 2nr2 s ILE 3 Ca 0.48 -1.60 -0.04 0.00 -0.26 0.00 0.00 60.65 59.22 2nr2 s ILE 3 Cb -0.14 -1.31 0.01 0.00 1.25 0.00 0.00 42.46 42.28 2nr2 s ILE 3 CO 0.19 -0.89 -0.01 -0.36 0.24 0.00 0.00 174.94 174.12 2nr2 s PHE 4 N -3.52 3.08 -0.38 1.37 0.08 0.16 -0.57 117.98 118.19 2nr2 s PHE 4 Ca 0.03 -1.24 -0.24 0.00 0.12 0.00 0.00 56.93 55.60 2nr2 s PHE 4 Cb 0.05 -2.14 0.01 0.00 -0.57 0.00 0.00 43.02 40.38 2nr2 s PHE 4 CO -0.09 -0.64 0.86 0.08 -0.10 0.00 0.00 175.22 175.33 2nr2 s VAL 5 N 1.41 4.64 -0.24 -0.44 1.01 0.73 -0.10 120.40 127.42 2nr2 s VAL 5 Ca 0.02 0.97 -0.08 0.00 0.00 0.00 0.00 61.98 62.89 2nr2 s VAL 5 Cb -0.16 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.89 2nr2 s VAL 5 CO -0.02 -0.53 0.10 -0.75 0.00 0.00 0.00 175.10 173.90 2nr2 s LYS 6 N 3.33 3.80 0.52 2.72 2.47 0.13 -0.92 119.74 131.79 2nr2 s LYS 6 Ca 0.35 -0.41 -0.10 0.00 -1.56 0.00 0.00 55.97 54.25 2nr2 s LYS 6 Cb -0.12 -3.38 -0.05 0.00 -1.46 0.00 0.00 37.83 32.81 2nr2 s LYS 6 CO 0.19 -0.08 0.90 0.95 0.16 0.00 0.00 175.35 177.46 2nr2 s THR 7 N 1.37 4.76 -0.17 3.43 -4.23 -0.41 -0.98 115.64 119.41 2nr2 s THR 7 Ca 0.06 0.67 0.18 0.00 -1.18 0.00 0.00 61.69 61.42 2nr2 s THR 7 Cb -0.15 -3.82 -0.06 0.00 1.34 0.00 0.00 72.50 69.82 2nr2 s THR 7 CO 0.05 -0.86 0.99 -0.07 -0.54 0.00 0.00 174.62 174.19 2nr2 h LEU 8 N 0.36 0.00 -1.12 4.79 3.38 -1.86 -3.30 115.31 117.56 2nr2 h LEU 8 Ca -0.46 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.50 2nr2 h LEU 8 Cb 1.19 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 2nr2 h LEU 8 CO 0.62 0.39 0.40 0.71 0.09 0.00 0.00 178.44 180.65 2nr2 h THR 9 N 0.00 1.22 0.00 0.22 1.35 -1.94 -3.47 112.91 110.28 2nr2 h THR 9 Ca -0.09 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 2nr2 h THR 9 Cb 1.38 0.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 2nr2 h THR 9 CO 0.03 0.24 0.00 0.61 -0.25 0.00 0.00 175.52 176.16 2nr2 n GLY 10 N -1.20 0.90 3.74 5.82 0.00 -1.24 -5.16 105.19 108.04 2nr2 n GLY 10 Ca 0.07 0.04 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 2nr2 n GLY 10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nr2 s LYS 11 N 0.00 2.62 -0.18 1.61 -2.85 -1.26 -4.73 119.74 114.96 2nr2 s LYS 11 Ca 0.00 1.98 -0.01 0.00 -1.00 0.00 0.00 55.97 56.94 2nr2 s LYS 11 Cb 0.00 -1.86 -0.00 0.00 -2.06 0.00 0.00 37.83 33.90 2nr2 s LYS 11 CO 0.00 -1.52 -0.11 0.99 0.10 0.00 0.00 175.35 174.81 2nr2 s THR 12 N -1.49 2.94 -0.15 3.79 2.01 -1.26 -1.29 115.64 120.19 2nr2 s THR 12 Ca 0.81 -0.66 -0.01 0.00 0.31 0.00 0.00 61.69 62.14 2nr2 s THR 12 Cb -0.35 -2.28 -0.01 0.00 0.01 0.00 0.00 72.50 69.87 2nr2 s THR 12 CO 0.38 0.49 -0.12 -0.63 -0.69 0.00 0.00 174.62 174.05 2nr2 s ILE 13 N 1.04 2.99 -0.45 1.82 1.01 -0.10 -4.96 121.20 122.55 2nr2 s ILE 13 Ca -0.01 -0.67 -0.22 0.00 0.00 0.00 0.00 60.65 59.75 2nr2 s ILE 13 Cb -0.15 -2.27 0.03 0.00 0.01 0.00 0.00 42.46 40.08 2nr2 s ILE 13 CO -0.02 0.51 0.74 -0.89 0.00 0.00 0.00 174.94 175.28 2nr2 s THR 14 N 0.67 4.70 0.21 2.92 2.01 -1.26 -0.19 115.64 124.70 2nr2 s THR 14 Ca -0.06 0.31 0.07 0.00 0.31 0.00 0.00 61.69 62.32 2nr2 s THR 14 Cb -0.15 -4.29 -0.04 0.00 0.01 0.00 0.00 72.50 68.02 2nr2 s THR 14 CO 0.02 -0.70 0.13 -0.76 -0.69 0.00 0.00 174.62 172.63 2nr2 s LEU 15 N 3.16 3.69 -0.14 4.42 1.43 0.26 -4.95 118.68 126.55 2nr2 s LEU 15 Ca 0.27 -0.26 -0.04 0.00 -1.03 0.00 0.00 54.13 53.07 2nr2 s LEU 15 Cb -0.13 -2.26 -0.03 0.00 0.03 0.00 0.00 46.19 43.80 2nr2 s LEU 15 CO 0.21 0.02 0.01 -1.61 0.23 0.00 0.00 176.35 175.21 2nr2 s GLU 16 N -3.45 3.52 0.09 1.70 2.02 -1.26 -0.34 118.70 120.98 2nr2 s GLU 16 Ca 0.31 -0.42 -0.07 0.00 0.02 0.00 0.00 54.97 54.81 2nr2 s GLU 16 Cb -0.09 -2.96 -0.01 0.00 0.10 0.00 0.00 34.13 31.17 2nr2 s GLU 16 CO 0.23 0.42 0.15 0.14 0.02 0.00 0.00 175.26 176.22 2nr2 s VAL 17 N -0.09 0.15 0.24 2.63 -7.23 0.02 -4.94 120.40 111.16 2nr2 s VAL 17 Ca 0.04 -1.37 -0.01 0.00 -1.81 0.00 0.00 61.98 58.83 2nr2 s VAL 17 Cb -0.13 -1.46 -0.04 0.00 0.56 0.00 0.00 36.38 35.31 2nr2 s VAL 17 CO 0.02 -0.68 0.43 -1.61 -0.31 0.00 0.00 175.10 172.96 2nr2 s GLU 18 N -3.89 3.53 0.24 4.82 0.41 -1.26 0.69 118.70 123.23 2nr2 s GLU 18 Ca 0.08 -0.31 0.21 0.00 -0.41 0.00 0.00 54.97 54.53 2nr2 s GLU 18 Cb 0.05 -2.79 0.95 0.00 -1.78 0.00 0.00 34.13 30.56 2nr2 s GLU 18 CO -0.09 0.34 1.63 -2.30 -0.49 0.00 0.00 175.26 174.35 2nr2 n PRO 19 N -0.89 0.15 -0.68 0.39 -0.02 -1.26 -1.77 135.00 130.91 2nr2 n PRO 19 Ca -0.04 0.48 -0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2nr2 n PRO 19 Cb 0.54 -1.84 0.22 0.00 -0.02 0.00 0.00 33.50 32.40 2nr2 n PRO 19 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2nr2 n SER 20 N -2.13 3.16 -4.76 2.55 7.64 -1.26 0.60 113.62 119.42 2nr2 n SER 20 Ca 0.01 -3.45 -0.40 0.00 1.01 0.00 0.00 58.87 56.05 2nr2 n SER 20 Cb 0.15 -0.61 -0.05 0.00 -1.01 0.00 0.00 64.21 62.68 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 -2.20 7.31 0.95 6.43 1.01 -0.73 -4.87 116.67 124.58 2nr2 s ASP 21 Ca 0.44 1.56 -0.12 0.00 0.71 0.00 0.00 52.55 55.15 2nr2 s ASP 21 Cb 0.38 -2.49 0.16 0.00 1.01 0.00 0.00 42.92 41.98 2nr2 s ASP 21 CO 0.04 0.10 1.09 0.42 0.21 0.00 0.00 175.17 177.04 2nr2 s THR 22 N -0.57 2.46 0.20 -1.27 -4.23 -1.26 -2.10 115.64 108.87 2nr2 s THR 22 Ca 0.38 0.15 -0.06 0.00 -1.18 0.00 0.00 61.69 60.98 2nr2 s THR 22 Cb -0.22 -2.50 0.03 0.00 1.34 0.00 0.00 72.50 71.15 2nr2 s THR 22 CO 0.25 -0.19 1.61 0.40 -0.54 0.00 0.00 174.62 176.14 2nr2 h ILE 23 N -1.79 1.27 -0.93 2.99 1.08 0.11 -0.92 117.51 119.33 2nr2 h ILE 23 Ca -0.51 -1.36 0.25 0.00 -0.39 0.00 0.00 64.86 62.85 2nr2 h ILE 23 Cb 1.29 1.20 -0.13 0.00 -3.07 0.00 0.00 36.82 36.11 2nr2 h ILE 23 CO 0.52 0.46 0.42 -0.08 -0.69 0.00 0.00 178.15 178.78 2nr2 h GLU 24 N 0.71 0.36 0.00 2.37 4.81 -0.98 -1.37 114.58 120.48 2nr2 h GLU 24 Ca 0.10 -0.02 -0.19 0.00 -0.13 0.00 0.00 59.36 59.11 2nr2 h GLU 24 Cb 0.76 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.03 2nr2 h GLU 24 CO 0.06 0.24 -0.92 -0.97 -0.73 0.00 0.00 179.01 176.69 2nr2 h ASN 25 N 0.37 0.00 -0.46 1.04 -0.73 -1.63 -2.78 115.58 111.39 2nr2 h ASN 25 Ca 0.60 0.00 -0.11 0.00 1.87 0.00 0.00 56.30 58.66 2nr2 h ASN 25 Cb 1.21 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.79 2nr2 h ASN 25 CO -0.56 0.91 -0.15 0.58 -0.37 0.00 0.00 177.43 177.83 2nr2 h VAL 26 N 0.00 1.27 0.00 2.57 2.07 -0.64 -0.83 116.25 120.69 2nr2 h VAL 26 Ca -0.01 -1.29 -0.03 0.00 0.82 0.00 0.00 66.70 66.18 2nr2 h VAL 26 Cb 1.70 1.15 -0.00 0.00 -1.52 0.00 0.00 31.29 32.62 2nr2 h VAL 26 CO 0.12 0.44 -0.16 0.11 0.02 0.00 0.00 177.57 178.10 2nr2 h LYS 27 N 0.75 0.00 -0.04 1.57 1.57 -1.31 -1.43 116.57 117.67 2nr2 h LYS 27 Ca 0.11 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.77 2nr2 h LYS 27 Cb 0.71 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 2nr2 h LYS 27 CO 0.05 0.16 -0.50 0.00 -0.57 0.00 0.00 179.45 178.60 2nr2 h ALA 28 N 1.84 1.08 -0.11 3.86 0.00 -1.19 -1.40 119.26 123.34 2nr2 h ALA 28 Ca -0.00 -0.47 -0.20 0.00 0.00 0.00 0.00 54.91 54.24 2nr2 h ALA 28 Cb 0.38 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2nr2 h ALA 28 CO 0.02 0.64 -0.75 -0.22 0.00 0.00 0.00 179.25 178.94 2nr2 h LYS 29 N 0.09 0.59 -0.34 0.00 3.64 -0.16 -2.77 116.57 117.62 2nr2 h LYS 29 Ca 0.00 -0.48 -0.07 0.00 -1.27 0.00 0.00 60.65 58.83 2nr2 h LYS 29 Cb 0.92 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.82 2nr2 h LYS 29 CO 0.07 1.10 -0.08 0.82 -2.27 0.00 0.00 179.45 179.09 2nr2 h ILE 30 N 0.40 1.23 -0.75 2.00 2.04 -0.99 -2.44 117.51 119.00 2nr2 h ILE 30 Ca -0.04 -0.99 -0.01 0.00 1.00 0.00 0.00 64.86 64.82 2nr2 h ILE 30 Cb 1.35 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 38.46 2nr2 h ILE 30 CO 0.14 0.33 0.42 -0.61 0.00 0.00 0.00 178.15 178.43 2nr2 h GLN 31 N 0.53 1.04 -0.13 2.37 4.15 -1.12 0.36 115.11 122.31 2nr2 h GLN 31 Ca 0.10 -0.12 -0.10 0.00 0.77 0.00 0.00 58.65 59.30 2nr2 h GLN 31 Cb 0.46 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 2nr2 h GLN 31 CO 0.02 0.77 -0.37 0.22 -1.93 0.00 0.00 178.83 177.54 2nr2 h ASP 32 N 1.03 0.28 0.04 -0.69 3.58 -1.44 -2.61 116.42 116.63 2nr2 h ASP 32 Ca 0.27 -0.11 -0.00 0.00 0.42 0.00 0.00 57.03 57.60 2nr2 h ASP 32 Cb 0.02 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 40.99 2nr2 h ASP 32 CO -0.04 0.64 -0.02 0.50 -2.88 0.00 0.00 179.24 177.43 2nr2 h LYS 33 N 0.23 -0.06 0.00 0.28 1.63 -0.73 -3.42 116.57 114.51 2nr2 h LYS 33 Ca 0.03 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.80 2nr2 h LYS 33 Cb 0.77 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.41 2nr2 h LYS 33 CO 0.06 -0.04 -1.89 0.39 -3.45 0.00 0.00 179.45 174.52 2nr2 n GLU 34 N -4.79 0.62 -0.89 1.90 -0.58 -0.00 -4.98 120.64 111.91 2nr2 n GLU 34 Ca -0.01 -0.16 0.00 0.00 -0.42 0.00 0.00 57.16 56.57 2nr2 n GLU 34 Cb 0.02 -1.45 0.00 0.00 -0.57 0.00 0.00 31.44 29.44 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 1.47 1.27 3.29 0.62 0.00 -0.98 -5.04 105.19 105.81 2nr2 n GLY 35 Ca -0.06 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.02 3.78 0.71 -0.61 1.01 -1.25 -5.03 121.20 117.79 2nr2 s ILE 36 Ca 0.00 -1.01 -0.16 0.00 0.00 0.00 0.00 60.65 59.48 2nr2 s ILE 36 Cb 0.00 -3.08 0.03 0.00 0.01 0.00 0.00 42.46 39.42 2nr2 s ILE 36 CO 0.00 -0.09 1.23 -2.84 0.00 0.00 0.00 174.94 173.24 2nr2 s PRO 37 N 1.42 2.22 0.28 2.79 0.02 -1.26 -3.81 135.00 136.66 2nr2 s PRO 37 Ca -0.01 1.84 0.25 0.00 0.02 0.00 0.00 61.00 63.10 2nr2 s PRO 37 Cb -0.19 -1.83 1.00 0.00 0.02 0.00 0.00 34.50 33.49 2nr2 s PRO 37 CO 0.02 -1.79 1.74 -1.35 -0.33 0.00 0.00 177.00 175.29 2nr2 h PRO 38 N -0.10 0.00 -0.65 5.54 0.11 -1.94 -3.02 132.00 131.95 2nr2 h PRO 38 Ca -0.48 0.00 0.12 0.00 0.11 0.00 0.00 66.00 65.75 2nr2 h PRO 38 Cb 1.31 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.33 2nr2 h PRO 38 CO 0.50 0.00 0.19 0.22 -0.21 0.00 0.00 178.00 178.70 2nr2 h ASP 39 N 0.00 0.10 0.46 -2.05 1.82 -1.99 -0.49 116.42 114.27 2nr2 h ASP 39 Ca 0.00 0.11 0.00 0.00 -0.39 0.00 0.00 57.03 56.75 2nr2 h ASP 39 Cb 0.41 0.13 0.00 0.00 0.68 0.00 0.00 39.33 40.55 2nr2 h ASP 39 CO 0.00 0.05 0.00 0.00 -1.61 0.00 0.00 179.24 177.68 2nr2 n GLN 40 N -5.08 0.39 -3.64 0.28 6.02 -1.14 -4.78 117.38 109.42 2nr2 n GLN 40 Ca 0.10 0.04 -0.36 0.00 -0.01 0.00 0.00 57.00 56.77 2nr2 n GLN 40 Cb 0.35 -1.50 -0.09 0.00 1.02 0.00 0.00 30.24 30.02 2nr2 n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2nr2 s GLN 41 N -2.54 4.12 -0.11 -1.09 -0.21 -0.19 -1.20 119.66 118.43 2nr2 s GLN 41 Ca 0.25 -0.19 0.02 0.00 0.02 0.00 0.00 55.36 55.46 2nr2 s GLN 41 Cb 0.17 -3.51 -0.01 0.00 1.00 0.00 0.00 33.01 30.67 2nr2 s GLN 41 CO 0.39 0.11 -0.18 0.50 -2.12 0.00 0.00 175.29 173.99 2nr2 s ARG 42 N 0.90 3.16 -0.14 2.91 3.52 -0.30 -4.96 118.95 124.04 2nr2 s ARG 42 Ca 0.09 -0.78 -0.04 0.00 -0.13 0.00 0.00 55.73 54.88 2nr2 s ARG 42 Cb -0.13 -2.46 -0.03 0.00 -1.56 0.00 0.00 34.95 30.77 2nr2 s ARG 42 CO 0.03 0.23 -0.01 -0.51 -0.81 0.00 0.00 175.30 174.24 2nr2 s LEU 43 N 0.26 3.43 -0.04 -0.88 1.43 -1.26 -1.13 118.68 120.49 2nr2 s LEU 43 Ca -0.13 -0.02 0.01 0.00 -1.03 0.00 0.00 54.13 52.96 2nr2 s LEU 43 Cb -0.16 -1.82 -0.03 0.00 0.03 0.00 0.00 46.19 44.20 2nr2 s LEU 43 CO 0.07 0.22 -0.05 -0.63 0.23 0.00 0.00 176.35 176.19 2nr2 s ILE 44 N 0.06 3.85 -0.08 -0.59 -1.09 0.57 -1.12 121.20 122.80 2nr2 s ILE 44 Ca 0.02 -0.55 -0.03 0.00 -2.23 0.00 0.00 60.65 57.86 2nr2 s ILE 44 Cb -0.13 -2.63 0.04 0.00 -1.58 0.00 0.00 42.46 38.16 2nr2 s ILE 44 CO 0.02 0.51 0.09 0.12 -1.23 0.00 0.00 174.94 174.44 2nr2 s PHE 45 N -0.92 0.04 0.00 3.97 5.36 -0.96 -0.11 117.98 125.36 2nr2 s PHE 45 Ca 0.15 0.20 0.00 0.00 -0.96 0.00 0.00 56.93 56.32 2nr2 s PHE 45 Cb -0.11 -0.48 0.00 0.00 -0.34 0.00 0.00 43.02 42.08 2nr2 s PHE 45 CO 0.05 -0.28 0.00 0.00 -1.46 0.00 0.00 175.22 173.53 2nr2 n ALA 46 N 5.30 0.00 0.00 11.12 0.00 -1.26 -3.06 120.51 132.61 2nr2 n ALA 46 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2nr2 n ALA 46 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 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 0.53 3.81 0.00 0.00 -1.26 -5.14 105.19 103.12 2nr2 n GLY 47 Ca 0.00 -0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 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 3.05 0.17 1.61 1.02 -1.17 -5.01 119.74 119.41 2nr2 s LYS 48 Ca 0.00 1.09 -0.18 0.00 0.02 0.00 0.00 55.97 56.90 2nr2 s LYS 48 Cb 0.00 -2.00 -0.08 0.00 -0.52 0.00 0.00 37.83 35.23 2nr2 s LYS 48 CO 0.00 -1.02 0.65 -0.65 -0.92 0.00 0.00 175.35 173.41 2nr2 s GLN 49 N -4.58 4.18 0.21 1.68 -0.21 -1.26 -2.27 119.66 117.41 2nr2 s GLN 49 Ca 0.61 0.75 -0.06 0.00 0.02 0.00 0.00 55.36 56.69 2nr2 s GLN 49 Cb -0.15 -2.98 -0.06 0.00 1.00 0.00 0.00 33.01 30.82 2nr2 s GLN 49 CO 0.47 0.47 0.47 -0.51 -2.12 0.00 0.00 175.29 174.07 2nr2 s LEU 50 N -1.77 4.18 0.14 2.90 1.43 -0.28 -4.98 118.68 120.30 2nr2 s LEU 50 Ca 0.39 0.68 -0.09 0.00 -1.03 0.00 0.00 54.13 54.08 2nr2 s LEU 50 Cb -0.17 -3.45 -0.06 0.00 0.03 0.00 0.00 46.19 42.54 2nr2 s LEU 50 CO 0.20 -0.06 0.44 -0.70 0.23 0.00 0.00 176.35 176.47 2nr2 s GLU 51 N -3.02 3.75 0.01 1.70 2.56 -1.26 -4.72 118.70 117.72 2nr2 s GLU 51 Ca 0.43 0.14 -0.25 0.00 0.00 0.00 0.00 54.97 55.29 2nr2 s GLU 51 Cb -0.11 -2.87 -0.17 0.00 2.00 0.00 0.00 34.13 32.98 2nr2 s GLU 51 CO 0.26 0.47 1.33 -0.44 -0.56 0.00 0.00 175.26 176.32 2nr2 h ASP 52 N 3.17 -0.21 -0.06 -1.70 3.32 -1.97 -3.23 116.42 115.74 2nr2 h ASP 52 Ca -0.48 -0.23 -0.18 0.00 0.02 0.00 0.00 57.03 56.17 2nr2 h ASP 52 Cb 1.18 0.05 -0.06 0.00 0.22 0.00 0.00 39.33 40.72 2nr2 h ASP 52 CO 0.69 0.12 -0.28 0.61 -1.72 0.00 0.00 179.24 178.66 2nr2 n GLY 53 N -0.32 3.00 3.29 2.75 0.00 -1.26 -0.42 105.19 112.23 2nr2 n GLY 53 Ca -0.09 -1.05 -0.16 0.00 0.00 0.00 0.00 46.02 44.72 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 0.69 1.19 0.68 1.61 1.81 -1.22 -4.96 118.95 118.75 2nr2 s ARG 54 Ca 0.56 -1.55 0.04 0.00 -1.72 0.00 0.00 55.73 53.06 2nr2 s ARG 54 Cb 0.27 -0.70 0.13 0.00 -0.45 0.00 0.00 34.95 34.20 2nr2 s ARG 54 CO -0.01 0.04 0.94 0.95 -0.68 0.00 0.00 175.30 176.53 2nr2 s THR 55 N -3.30 2.02 0.09 0.02 -4.23 -1.26 0.73 115.64 109.70 2nr2 s THR 55 Ca 0.21 -0.78 -0.15 0.00 -1.18 0.00 0.00 61.69 59.79 2nr2 s THR 55 Cb 0.03 -2.24 -0.14 0.00 1.34 0.00 0.00 72.50 71.50 2nr2 s THR 55 CO 0.04 0.00 1.32 -0.07 -0.54 0.00 0.00 174.62 175.38 2nr2 h LEU 56 N -0.29 0.81 -0.34 4.79 3.38 -1.39 -3.19 115.31 119.08 2nr2 h LEU 56 Ca -0.32 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.07 2nr2 h LEU 56 Cb 1.27 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2nr2 h LEU 56 CO 0.38 1.25 0.00 -0.24 0.09 0.00 0.00 178.44 179.92 2nr2 n SER 57 N -4.11 0.27 0.07 -0.43 2.88 0.20 -1.87 113.62 110.63 2nr2 n SER 57 Ca -0.06 0.58 -0.06 0.00 -1.33 0.00 0.00 58.87 57.99 2nr2 n SER 57 Cb 0.62 -0.63 -0.10 0.00 -0.75 0.00 0.00 64.21 63.35 2nr2 n SER 57 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 2nr2 h ASP 58 N 0.00 0.00 0.28 -3.46 3.58 -1.82 -2.98 116.42 112.02 2nr2 h ASP 58 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2nr2 h ASP 58 Cb 0.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.30 2nr2 h ASP 58 CO 0.00 0.94 -0.32 -1.22 -2.88 0.00 0.00 179.24 175.76 2nr2 n TYR 59 N -3.34 0.00 -2.36 0.28 4.01 -1.06 -4.96 117.16 109.73 2nr2 n TYR 59 Ca 0.00 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.69 2nr2 n TYR 59 Cb 0.91 -0.14 0.01 0.00 -0.31 0.00 0.00 39.34 39.81 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 -0.80 -2.44 -4.59 7.72 3.02 -1.03 -5.02 115.26 112.12 2nr2 n ASN 60 Ca 0.11 -0.05 -0.42 0.00 -0.03 0.00 0.00 54.58 54.18 2nr2 n ASN 60 Cb 0.35 -1.47 -0.02 0.00 -0.61 0.00 0.00 39.78 38.03 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 -2.58 3.80 0.88 2.41 1.01 -0.78 -4.98 121.20 120.96 2nr2 s ILE 61 Ca 0.05 0.76 -0.10 0.00 0.00 0.00 0.00 60.65 61.36 2nr2 s ILE 61 Cb -0.02 -4.24 0.18 0.00 0.01 0.00 0.00 42.46 38.39 2nr2 s ILE 61 CO 0.07 -0.89 1.20 -1.10 0.00 0.00 0.00 174.94 174.22 2nr2 s GLN 62 N 5.31 0.97 0.55 2.79 -1.52 -1.26 -4.36 119.66 122.15 2nr2 s GLN 62 Ca 0.60 -0.73 -0.21 0.00 -1.95 0.00 0.00 55.36 53.07 2nr2 s GLN 62 Cb -0.13 -2.03 -0.05 0.00 -0.22 0.00 0.00 33.01 30.58 2nr2 s GLN 62 CO 0.29 -2.09 1.32 -1.59 -0.25 0.00 0.00 175.29 172.98 2nr2 s LYS 63 N -5.62 3.15 -1.09 2.91 -2.85 -1.26 -3.71 119.74 111.27 2nr2 s LYS 63 Ca 0.72 2.14 -0.07 0.00 -1.00 0.00 0.00 55.97 57.76 2nr2 s LYS 63 Cb -0.04 -2.22 0.01 0.00 -2.06 0.00 0.00 37.83 33.52 2nr2 s LYS 63 CO 0.50 -1.15 0.88 0.39 0.10 0.00 0.00 175.35 176.07 2nr2 n GLU 64 N -1.08 -6.00 -4.40 1.78 1.02 0.15 -4.99 120.64 107.12 2nr2 n GLU 64 Ca 0.11 0.66 -0.30 0.00 -0.02 0.00 0.00 57.16 57.60 2nr2 n GLU 64 Cb 0.46 -5.17 -0.11 0.00 -0.02 0.00 0.00 31.44 26.60 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 -3.19 4.20 -0.14 1.62 0.15 -1.24 -4.86 113.70 110.23 2nr2 s SER 65 Ca 0.44 -0.38 -0.16 0.00 0.70 0.00 0.00 55.95 56.55 2nr2 s SER 65 Cb -0.19 -0.78 -0.04 0.00 -1.71 0.00 0.00 66.02 63.30 2nr2 s SER 65 CO 0.54 0.22 0.39 -0.89 1.20 0.00 0.00 173.24 174.69 2nr2 s THR 66 N -1.08 5.24 -0.10 6.45 2.01 -1.26 0.35 115.64 127.25 2nr2 s THR 66 Ca 0.18 0.75 0.02 0.00 0.31 0.00 0.00 61.69 62.95 2nr2 s THR 66 Cb -0.11 -3.73 -0.02 0.00 0.01 0.00 0.00 72.50 68.66 2nr2 s THR 66 CO 0.10 0.36 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.47 2nr2 s LEU 67 N 0.53 2.62 -0.20 4.42 1.43 0.86 -4.82 118.68 123.52 2nr2 s LEU 67 Ca 0.21 -0.33 -0.16 0.00 -1.03 0.00 0.00 54.13 52.83 2nr2 s LEU 67 Cb -0.14 -1.56 -0.04 0.00 0.03 0.00 0.00 46.19 44.48 2nr2 s LEU 67 CO 0.07 0.22 0.41 -1.00 0.23 0.00 0.00 176.35 176.28 2nr2 s HIS 68 N 0.04 3.38 -0.33 0.29 3.76 0.85 0.18 115.29 123.45 2nr2 s HIS 68 Ca -0.05 0.64 -0.18 0.00 -0.15 0.00 0.00 55.06 55.31 2nr2 s HIS 68 Cb -0.15 -2.54 -0.01 0.00 1.11 0.00 0.00 32.58 31.00 2nr2 s HIS 68 CO 0.05 -0.01 0.53 -1.17 -0.85 0.00 0.00 174.74 173.29 2nr2 s LEU 69 N 1.32 4.26 -0.17 0.89 2.96 -0.15 -0.31 118.68 127.47 2nr2 s LEU 69 Ca 0.20 0.13 -0.03 0.00 -0.22 0.00 0.00 54.13 54.21 2nr2 s LEU 69 Cb -0.15 -2.63 -0.02 0.00 0.50 0.00 0.00 46.19 43.89 2nr2 s LEU 69 CO 0.08 -0.45 -0.07 -0.69 -1.32 0.00 0.00 176.35 173.90 2nr2 s VAL 70 N 2.42 3.42 -0.01 1.68 1.01 -0.29 -4.06 120.40 124.58 2nr2 s VAL 70 Ca 0.20 -0.51 -0.15 0.00 0.00 0.00 0.00 61.98 61.53 2nr2 s VAL 70 Cb -0.15 -2.50 -0.06 0.00 0.00 0.00 0.00 36.38 33.67 2nr2 s VAL 70 CO 0.13 0.47 0.40 -0.76 0.00 0.00 0.00 175.10 175.35 2nr2 s LEU 71 N 0.80 4.46 0.27 3.92 1.02 -1.26 -1.14 118.68 126.74 2nr2 s LEU 71 Ca -0.02 0.94 -0.31 0.00 0.02 0.00 0.00 54.13 54.76 2nr2 s LEU 71 Cb -0.15 -2.58 -0.12 0.00 0.02 0.00 0.00 46.19 43.37 2nr2 s LEU 71 CO 0.01 0.31 1.63 -1.14 0.02 0.00 0.00 176.35 177.18 2nr2 n ARG 72 N 1.96 2.72 -4.04 1.70 0.63 -0.34 -4.94 116.66 114.35 2nr2 n ARG 72 Ca -0.14 0.97 -0.21 0.00 -0.92 0.00 0.00 57.85 57.55 2nr2 n ARG 72 Cb 0.52 -2.77 -0.03 0.00 0.45 0.00 0.00 32.46 30.63 2nr2 n ARG 72 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2nr2 s LEU 73 N 0.01 4.07 -0.01 6.15 1.43 -1.26 -5.06 118.68 124.01 2nr2 s LEU 73 Ca 0.67 -0.09 0.06 0.00 -1.03 0.00 0.00 54.13 53.75 2nr2 s LEU 73 Cb -0.50 -2.61 -0.02 0.00 0.03 0.00 0.00 46.19 43.10 2nr2 s LEU 73 CO 0.44 -0.06 -0.20 -0.13 0.23 0.00 0.00 176.35 176.62 2nr2 s ARG 74 N -3.92 1.62 0.00 1.70 1.81 -1.26 -4.77 118.95 114.13 2nr2 s ARG 74 Ca 0.34 -0.76 0.00 0.00 -1.72 0.00 0.00 55.73 53.59 2nr2 s ARG 74 Cb -0.08 -1.59 0.00 0.00 -0.45 0.00 0.00 34.95 32.83 2nr2 s ARG 74 CO 0.27 0.43 0.00 0.41 -0.68 0.00 0.00 175.30 175.73 2nr2 n GLY 75 N 2.47 0.99 0.00 -3.53 0.00 -1.26 -5.36 105.19 98.50 2nr2 n GLY 75 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93