#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 2.59 0.11 3.17 1.11 -1.26 -0.35 119.66 125.04 2nr2 s GLN 2 Ca 0.00 -1.35 -0.04 0.00 0.01 0.00 0.00 55.36 53.98 2nr2 s GLN 2 Cb 0.00 -2.36 -0.03 0.00 -1.01 0.00 0.00 33.01 29.62 2nr2 s GLN 2 CO 0.00 0.18 0.11 0.96 0.01 0.00 0.00 175.29 176.54 2nr2 s ILE 3 N -2.32 0.13 -0.23 1.08 -4.36 -0.04 -4.63 121.20 110.82 2nr2 s ILE 3 Ca 0.38 -1.66 0.01 0.00 -0.26 0.00 0.00 60.65 59.11 2nr2 s ILE 3 Cb -0.05 -1.77 0.06 0.00 1.25 0.00 0.00 42.46 41.95 2nr2 s ILE 3 CO 0.24 -0.58 -0.05 -0.36 0.24 0.00 0.00 174.94 174.43 2nr2 s PHE 4 N -3.97 2.34 -0.29 1.37 0.08 -1.15 -1.82 117.98 114.53 2nr2 s PHE 4 Ca 0.16 -1.71 -0.17 0.00 0.12 0.00 0.00 56.93 55.33 2nr2 s PHE 4 Cb 0.06 -1.56 -0.02 0.00 -0.57 0.00 0.00 43.02 40.93 2nr2 s PHE 4 CO -0.03 -0.77 0.46 0.08 -0.10 0.00 0.00 175.22 174.86 2nr2 s VAL 5 N 1.42 5.09 -0.20 -0.44 1.01 -0.25 -1.59 120.40 125.44 2nr2 s VAL 5 Ca -0.06 0.62 -0.08 0.00 0.00 0.00 0.00 61.98 62.47 2nr2 s VAL 5 Cb -0.19 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 2nr2 s VAL 5 CO -0.06 0.03 0.07 -0.54 0.00 0.00 0.00 175.10 174.60 2nr2 s LYS 6 N 2.24 3.93 0.63 2.72 1.02 -0.33 -1.30 119.74 128.65 2nr2 s LYS 6 Ca 0.18 -0.36 -0.07 0.00 0.02 0.00 0.00 55.97 55.74 2nr2 s LYS 6 Cb -0.16 -3.25 0.02 0.00 -0.52 0.00 0.00 37.83 33.92 2nr2 s LYS 6 CO 0.10 0.19 0.95 0.95 -0.92 0.00 0.00 175.35 176.62 2nr2 s THR 7 N 0.60 3.38 0.15 2.17 -4.23 -0.41 -0.11 115.64 117.19 2nr2 s THR 7 Ca 0.04 0.02 -0.17 0.00 -1.18 0.00 0.00 61.69 60.40 2nr2 s THR 7 Cb -0.13 -3.37 0.00 0.00 1.34 0.00 0.00 72.50 70.34 2nr2 s THR 7 CO 0.01 -0.40 1.80 -0.07 -0.54 0.00 0.00 174.62 175.42 2nr2 h LEU 8 N -0.32 0.36 -1.54 4.79 3.38 -1.89 -3.05 115.31 117.03 2nr2 h LEU 8 Ca -0.45 -0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.62 2nr2 h LEU 8 Cb 1.27 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.90 2nr2 h LEU 8 CO 0.61 0.26 0.45 0.71 0.09 0.00 0.00 178.44 180.56 2nr2 h THR 9 N 0.44 0.90 0.00 0.22 1.35 -1.95 -3.45 112.91 110.42 2nr2 h THR 9 Ca 0.14 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.82 2nr2 h THR 9 Cb -0.01 0.34 0.00 0.00 -1.73 0.00 0.00 68.15 66.75 2nr2 h THR 9 CO -0.06 0.09 0.00 0.61 -0.25 0.00 0.00 175.52 175.92 2nr2 n GLY 10 N -1.50 1.55 3.75 5.82 0.00 -1.15 -5.14 105.19 108.52 2nr2 n GLY 10 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 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 2.76 -0.16 1.61 2.20 -1.26 -4.92 119.74 119.96 2nr2 s LYS 11 Ca 0.00 -0.80 0.00 0.00 -0.36 0.00 0.00 55.97 54.81 2nr2 s LYS 11 Cb 0.00 -2.63 0.03 0.00 -1.51 0.00 0.00 37.83 33.72 2nr2 s LYS 11 CO 0.00 0.53 -0.11 0.99 -0.36 0.00 0.00 175.35 176.40 2nr2 s THR 12 N -1.47 1.46 -0.11 3.43 2.01 -1.26 -1.28 115.64 118.41 2nr2 s THR 12 Ca 0.29 -0.69 -0.03 0.00 0.31 0.00 0.00 61.69 61.56 2nr2 s THR 12 Cb -0.11 -1.46 -0.03 0.00 0.01 0.00 0.00 72.50 70.90 2nr2 s THR 12 CO 0.21 0.32 0.02 0.27 -0.69 0.00 0.00 174.62 174.75 2nr2 s ILE 13 N 1.51 4.44 -0.41 1.82 -4.36 -0.42 -4.97 121.20 118.81 2nr2 s ILE 13 Ca 0.03 -0.19 -0.12 0.00 -0.26 0.00 0.00 60.65 60.11 2nr2 s ILE 13 Cb -0.14 -2.90 0.05 0.00 1.25 0.00 0.00 42.46 40.72 2nr2 s ILE 13 CO -0.09 0.58 0.27 -0.89 0.24 0.00 0.00 174.94 175.04 2nr2 s THR 14 N -0.61 4.63 0.06 8.37 2.01 -1.26 -1.09 115.64 127.76 2nr2 s THR 14 Ca 0.10 -1.07 0.01 0.00 0.31 0.00 0.00 61.69 61.04 2nr2 s THR 14 Cb -0.12 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.65 2nr2 s THR 14 CO 0.02 -0.40 0.15 -0.76 -0.69 0.00 0.00 174.62 172.94 2nr2 s LEU 15 N 1.54 4.10 -0.17 4.42 1.43 -0.76 -4.91 118.68 124.34 2nr2 s LEU 15 Ca 0.03 0.15 -0.07 0.00 -1.03 0.00 0.00 54.13 53.21 2nr2 s LEU 15 Cb -0.21 -2.71 -0.04 0.00 0.03 0.00 0.00 46.19 43.25 2nr2 s LEU 15 CO 0.05 0.18 0.07 -0.70 0.23 0.00 0.00 176.35 176.18 2nr2 s GLU 16 N -2.39 3.84 0.09 1.70 2.12 -1.26 -0.86 118.70 121.93 2nr2 s GLU 16 Ca 0.32 -0.31 0.01 0.00 0.36 0.00 0.00 54.97 55.34 2nr2 s GLU 16 Cb -0.13 -3.19 -0.04 0.00 0.26 0.00 0.00 34.13 31.03 2nr2 s GLU 16 CO 0.24 0.38 -0.04 0.14 -0.54 0.00 0.00 175.26 175.45 2nr2 s VAL 17 N 0.08 0.49 0.19 3.70 -7.23 0.53 -4.98 120.40 113.17 2nr2 s VAL 17 Ca 0.06 -1.90 0.06 0.00 -1.81 0.00 0.00 61.98 58.39 2nr2 s VAL 17 Cb -0.12 -1.71 -0.04 0.00 0.56 0.00 0.00 36.38 35.07 2nr2 s VAL 17 CO 0.01 -0.83 0.10 -1.61 -0.31 0.00 0.00 175.10 172.45 2nr2 s GLU 18 N -3.89 2.74 0.42 4.82 0.41 -1.26 -1.38 118.70 120.56 2nr2 s GLU 18 Ca 0.13 -0.99 0.18 0.00 -0.41 0.00 0.00 54.97 53.88 2nr2 s GLU 18 Cb 0.06 -2.53 0.93 0.00 -1.78 0.00 0.00 34.13 30.82 2nr2 s GLU 18 CO -0.05 0.46 1.88 -1.00 -0.49 0.00 0.00 175.26 176.06 2nr2 h PRO 19 N 2.31 0.00 -0.18 0.39 0.13 -1.96 -1.17 132.00 131.51 2nr2 h PRO 19 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 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 0.61 0.29 0.00 0.43 -0.23 0.00 0.00 178.00 179.10 2nr2 n SER 20 N -3.84 2.05 -4.73 1.44 7.64 -1.26 -1.73 113.62 113.19 2nr2 n SER 20 Ca -0.01 -1.75 -0.39 0.00 1.01 0.00 0.00 58.87 57.72 2nr2 n SER 20 Cb 0.37 -0.11 0.04 0.00 -1.01 0.00 0.00 64.21 63.50 2nr2 n SER 20 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2nr2 n ASP 21 N 0.58 2.58 -4.86 6.43 8.00 -0.44 -4.78 116.55 124.06 2nr2 n ASP 21 Ca 0.17 0.99 -0.31 0.00 0.71 0.00 0.00 54.79 56.35 2nr2 n ASP 21 Cb 0.40 -1.56 0.01 0.00 -0.02 0.00 0.00 41.12 39.95 2nr2 n ASP 21 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2nr2 s THR 22 N -1.29 4.66 0.24 -3.53 -4.23 -1.26 -2.07 115.64 108.15 2nr2 s THR 22 Ca 0.70 0.90 -0.04 0.00 -1.18 0.00 0.00 61.69 62.08 2nr2 s THR 22 Cb -0.43 -3.83 0.10 0.00 1.34 0.00 0.00 72.50 69.68 2nr2 s THR 22 CO 0.50 -1.09 1.73 0.40 -0.54 0.00 0.00 174.62 175.62 2nr2 h ILE 23 N -0.22 1.25 -0.93 2.99 1.08 -0.84 -2.13 117.51 118.71 2nr2 h ILE 23 Ca -0.44 -1.05 0.21 0.00 -0.39 0.00 0.00 64.86 63.19 2nr2 h ILE 23 Cb 1.19 0.85 -0.12 0.00 -3.07 0.00 0.00 36.82 35.67 2nr2 h ILE 23 CO 0.62 0.37 0.49 -0.08 -0.69 0.00 0.00 178.15 178.86 2nr2 h GLU 24 N 0.81 0.54 0.00 2.37 4.81 -1.72 0.06 114.58 121.45 2nr2 h GLU 24 Ca 0.15 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 2nr2 h GLU 24 Cb 0.48 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.74 2nr2 h GLU 24 CO 0.02 0.36 0.00 0.09 -0.73 0.00 0.00 179.01 178.75 2nr2 n ASN 25 N -4.92 0.00 -0.08 1.04 4.13 -0.82 -1.57 115.26 113.04 2nr2 n ASN 25 Ca 0.23 -0.36 -0.16 0.00 1.68 0.00 0.00 54.58 55.97 2nr2 n ASN 25 Cb 0.62 -0.19 -0.13 0.00 -1.54 0.00 0.00 39.78 38.54 2nr2 n ASN 25 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 2nr2 n VAL 26 N -1.19 1.54 -0.24 2.41 0.31 -0.13 -3.45 118.33 117.58 2nr2 n VAL 26 Ca 0.15 -0.67 -0.01 0.00 -0.01 0.00 0.00 64.34 63.80 2nr2 n VAL 26 Cb 0.17 -1.24 0.19 0.00 -0.91 0.00 0.00 33.84 32.06 2nr2 n VAL 26 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2nr2 h LYS 27 N 0.02 1.05 -0.77 5.55 1.57 -0.99 0.63 116.57 123.63 2nr2 h LYS 27 Ca -0.51 -0.10 0.09 0.00 -1.87 0.00 0.00 60.65 58.26 2nr2 h LYS 27 Cb 2.02 -0.22 -0.05 0.00 0.08 0.00 0.00 32.23 34.06 2nr2 h LYS 27 CO -0.01 0.75 0.50 0.00 -0.57 0.00 0.00 179.45 180.13 2nr2 h ALA 28 N 1.42 1.77 -0.16 3.86 0.00 -1.42 -1.88 119.26 122.85 2nr2 h ALA 28 Ca 0.27 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 2nr2 h ALA 28 Cb -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2nr2 h ALA 28 CO -0.05 0.07 -0.40 0.87 0.00 0.00 0.00 179.25 179.75 2nr2 h LYS 29 N 0.71 0.36 -0.30 0.00 1.57 -0.92 -2.44 116.57 115.55 2nr2 h LYS 29 Ca 0.35 -0.17 -0.08 0.00 -1.87 0.00 0.00 60.65 58.88 2nr2 h LYS 29 Cb 0.42 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 2nr2 h LYS 29 CO -0.13 0.70 -0.16 0.82 -0.57 0.00 0.00 179.45 180.11 2nr2 h ILE 30 N 0.30 1.24 -0.46 1.86 2.04 -0.81 -0.99 117.51 120.69 2nr2 h ILE 30 Ca 0.03 -1.10 -0.13 0.00 1.00 0.00 0.00 64.86 64.66 2nr2 h ILE 30 Cb 0.83 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 38.09 2nr2 h ILE 30 CO 0.07 0.36 -0.22 -0.61 0.00 0.00 0.00 178.15 177.75 2nr2 h GLN 31 N 0.47 0.94 -0.25 2.37 4.15 -1.25 0.84 115.11 122.38 2nr2 h GLN 31 Ca 0.08 -0.40 -0.01 0.00 0.77 0.00 0.00 58.65 59.10 2nr2 h GLN 31 Cb 0.55 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.20 2nr2 h GLN 31 CO 0.04 1.06 0.12 0.22 -1.93 0.00 0.00 178.83 178.33 2nr2 h ASP 32 N 0.81 0.33 0.16 -0.69 3.58 -1.25 -3.08 116.42 116.28 2nr2 h ASP 32 Ca 0.11 -0.13 -0.01 0.00 0.42 0.00 0.00 57.03 57.41 2nr2 h ASP 32 Cb 0.78 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.75 2nr2 h ASP 32 CO 0.07 0.37 -0.08 0.50 -2.88 0.00 0.00 179.24 177.22 2nr2 h LYS 33 N 0.27 -0.21 0.02 0.28 1.63 -0.88 -3.44 116.57 114.24 2nr2 h LYS 33 Ca 0.09 0.01 -0.35 0.00 -0.85 0.00 0.00 60.65 59.55 2nr2 h LYS 33 Cb 0.13 0.05 -0.05 0.00 -0.60 0.00 0.00 32.23 31.76 2nr2 h LYS 33 CO -0.01 -0.14 -1.92 0.39 -3.45 0.00 0.00 179.45 174.32 2nr2 n GLU 34 N -4.09 0.60 0.00 1.90 -0.58 0.26 -5.03 120.64 113.71 2nr2 n GLU 34 Ca -0.03 0.39 0.00 0.00 -0.42 0.00 0.00 57.16 57.10 2nr2 n GLU 34 Cb 0.08 -1.63 0.00 0.00 -0.57 0.00 0.00 31.44 29.32 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 1.51 0.30 3.72 0.62 0.00 -1.16 -5.02 105.19 105.17 2nr2 n GLY 35 Ca -0.41 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.07 3.54 0.57 -0.61 1.01 -1.26 -4.91 121.20 118.48 2nr2 s ILE 36 Ca 0.00 1.17 -0.04 0.00 0.00 0.00 0.00 60.65 61.78 2nr2 s ILE 36 Cb 0.00 -3.75 0.01 0.00 0.01 0.00 0.00 42.46 38.74 2nr2 s ILE 36 CO 0.00 0.12 0.85 -2.84 0.00 0.00 0.00 174.94 173.08 2nr2 s PRO 37 N 0.63 2.84 0.25 2.79 0.02 -1.26 -3.91 135.00 136.37 2nr2 s PRO 37 Ca 0.59 -0.20 0.24 0.00 0.02 0.00 0.00 61.00 61.66 2nr2 s PRO 37 Cb -0.34 -2.34 0.95 0.00 0.02 0.00 0.00 34.50 32.79 2nr2 s PRO 37 CO 0.32 -0.67 1.73 -0.35 -0.33 0.00 0.00 177.00 177.71 2nr2 n PRO 38 N -2.49 0.22 -0.15 5.54 -0.04 -1.26 -2.22 135.00 134.60 2nr2 n PRO 38 Ca 0.04 0.37 -0.00 0.00 -0.04 0.00 0.00 63.50 63.88 2nr2 n PRO 38 Cb 0.58 -1.86 0.26 0.00 -0.04 0.00 0.00 33.50 32.44 2nr2 n PRO 38 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2nr2 h ASP 39 N 0.00 0.76 -0.00 3.54 3.32 -1.97 -3.21 116.42 118.86 2nr2 h ASP 39 Ca 0.00 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.99 2nr2 h ASP 39 Cb 0.46 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.82 2nr2 h ASP 39 CO 0.00 0.62 -0.68 0.00 -1.72 0.00 0.00 179.24 177.46 2nr2 n GLN 40 N -4.38 2.11 -2.66 3.56 6.02 -0.94 -4.85 117.38 116.24 2nr2 n GLN 40 Ca 0.06 -0.03 -0.42 0.00 -0.01 0.00 0.00 57.00 56.60 2nr2 n GLN 40 Cb 0.11 -1.20 -0.03 0.00 1.02 0.00 0.00 30.24 30.14 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 -2.38 3.32 -0.07 -1.09 -0.21 -1.14 -1.42 119.66 116.68 2nr2 s GLN 41 Ca 0.06 -0.14 0.03 0.00 0.02 0.00 0.00 55.36 55.33 2nr2 s GLN 41 Cb 0.11 -4.10 -0.02 0.00 1.00 0.00 0.00 33.01 30.00 2nr2 s GLN 41 CO 0.60 -1.81 -0.15 1.03 -2.12 0.00 0.00 175.29 172.84 2nr2 s ARG 42 N 4.90 2.69 -0.12 2.91 0.52 -1.14 -4.96 118.95 123.75 2nr2 s ARG 42 Ca 0.35 -0.71 -0.02 0.00 -0.52 0.00 0.00 55.73 54.82 2nr2 s ARG 42 Cb -0.10 -2.41 -0.03 0.00 0.52 0.00 0.00 34.95 32.93 2nr2 s ARG 42 CO 0.19 0.51 -0.03 -0.51 0.02 0.00 0.00 175.30 175.48 2nr2 s LEU 43 N -0.44 3.33 -0.13 2.53 1.43 -1.26 -1.04 118.68 123.10 2nr2 s LEU 43 Ca 0.05 -0.03 0.01 0.00 -1.03 0.00 0.00 54.13 53.13 2nr2 s LEU 43 Cb -0.12 -1.78 -0.01 0.00 0.03 0.00 0.00 46.19 44.32 2nr2 s LEU 43 CO 0.02 0.26 -0.17 -0.63 0.23 0.00 0.00 176.35 176.06 2nr2 s ILE 44 N -0.18 2.65 0.01 -0.59 1.01 0.89 -1.00 121.20 123.99 2nr2 s ILE 44 Ca 0.04 -0.80 0.01 0.00 0.00 0.00 0.00 60.65 59.90 2nr2 s ILE 44 Cb -0.13 -2.09 -0.01 0.00 0.01 0.00 0.00 42.46 40.25 2nr2 s ILE 44 CO 0.02 0.53 -0.04 0.12 0.00 0.00 0.00 174.94 175.57 2nr2 s PHE 45 N 0.45 0.38 -0.84 3.97 5.36 -0.21 -0.61 117.98 126.48 2nr2 s PHE 45 Ca -0.12 -0.16 0.00 0.00 -0.96 0.00 0.00 56.93 55.69 2nr2 s PHE 45 Cb -0.16 -0.24 0.00 0.00 -0.34 0.00 0.00 43.02 42.28 2nr2 s PHE 45 CO 0.05 -0.03 0.00 0.00 -1.46 0.00 0.00 175.22 173.78 2nr2 n ALA 46 N 2.66 -0.12 0.00 11.12 0.00 -1.26 -1.77 120.51 131.14 2nr2 n ALA 46 Ca -0.15 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2nr2 n ALA 46 Cb 0.58 -1.66 0.00 0.00 0.00 0.00 0.00 19.45 18.37 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 0.44 2.40 3.90 0.00 0.00 -1.26 -5.06 105.19 105.61 2nr2 n GLY 47 Ca -0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.67 2nr2 n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nr2 s LYS 48 N -1.00 3.30 0.04 1.61 -2.85 -0.73 -5.07 119.74 115.04 2nr2 s LYS 48 Ca 0.00 -0.64 -0.28 0.00 -1.00 0.00 0.00 55.97 54.05 2nr2 s LYS 48 Cb 0.00 -2.89 -0.05 0.00 -2.06 0.00 0.00 37.83 32.83 2nr2 s LYS 48 CO 0.00 0.52 0.88 -0.65 0.10 0.00 0.00 175.35 176.20 2nr2 s GLN 49 N -3.10 4.57 0.09 1.78 -0.21 -1.26 -1.04 119.66 120.48 2nr2 s GLN 49 Ca 0.34 1.26 -0.19 0.00 0.02 0.00 0.00 55.36 56.79 2nr2 s GLN 49 Cb -0.11 -3.41 -0.07 0.00 1.00 0.00 0.00 33.01 30.43 2nr2 s GLN 49 CO 0.27 0.14 0.57 -0.51 -2.12 0.00 0.00 175.29 173.64 2nr2 s LEU 50 N 0.37 4.50 0.26 2.90 1.43 -0.17 -4.91 118.68 123.06 2nr2 s LEU 50 Ca 0.45 1.25 -0.25 0.00 -1.03 0.00 0.00 54.13 54.54 2nr2 s LEU 50 Cb -0.21 -2.97 -0.09 0.00 0.03 0.00 0.00 46.19 42.95 2nr2 s LEU 50 CO 0.26 0.24 0.87 -1.61 0.23 0.00 0.00 176.35 176.34 2nr2 s GLU 51 N -1.25 4.56 0.06 1.70 2.02 -1.26 -4.67 118.70 119.86 2nr2 s GLU 51 Ca 0.31 1.23 -0.31 0.00 0.02 0.00 0.00 54.97 56.21 2nr2 s GLU 51 Cb -0.19 -2.98 -0.18 0.00 0.10 0.00 0.00 34.13 30.88 2nr2 s GLU 51 CO 0.19 0.40 1.56 -0.44 0.02 0.00 0.00 175.26 176.99 2nr2 h ASP 52 N 3.59 -0.69 -0.12 -0.19 3.32 -1.98 -3.02 116.42 117.32 2nr2 h ASP 52 Ca -0.47 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 56.51 2nr2 h ASP 52 Cb 1.20 0.18 -0.03 0.00 0.22 0.00 0.00 39.33 40.89 2nr2 h ASP 52 CO 0.66 -0.46 0.10 0.61 -1.72 0.00 0.00 179.24 178.42 2nr2 n GLY 53 N -1.30 2.75 3.65 2.75 0.00 -1.26 -2.30 105.19 109.49 2nr2 n GLY 53 Ca -0.13 -0.24 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.44 2.15 0.37 1.61 1.81 -1.14 -5.00 118.95 118.32 2nr2 s ARG 54 Ca 0.07 -1.68 0.08 0.00 -1.72 0.00 0.00 55.73 52.49 2nr2 s ARG 54 Cb 0.06 -2.00 -0.05 0.00 -0.45 0.00 0.00 34.95 32.51 2nr2 s ARG 54 CO 0.00 0.15 0.12 0.95 -0.68 0.00 0.00 175.30 175.85 2nr2 s THR 55 N -2.48 2.59 0.17 0.02 -4.23 -1.26 -1.11 115.64 109.33 2nr2 s THR 55 Ca 0.35 -1.78 -0.12 0.00 -1.18 0.00 0.00 61.69 58.96 2nr2 s THR 55 Cb -0.01 -2.93 0.06 0.00 1.34 0.00 0.00 72.50 70.96 2nr2 s THR 55 CO 0.20 -0.11 1.69 -0.07 -0.54 0.00 0.00 174.62 175.79 2nr2 h LEU 56 N 1.57 0.86 -0.53 4.79 4.07 -1.49 -2.79 115.31 121.79 2nr2 h LEU 56 Ca -0.43 -0.22 -0.15 0.00 0.08 0.00 0.00 57.88 57.16 2nr2 h LEU 56 Cb 1.25 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 42.76 2nr2 h LEU 56 CO 0.67 0.85 -0.43 0.77 -1.08 0.00 0.00 178.44 179.22 2nr2 h SER 57 N 0.83 0.75 -0.75 -0.43 4.64 -1.60 0.37 113.55 117.37 2nr2 h SER 57 Ca 0.19 -0.35 -0.04 0.00 -0.47 0.00 0.00 61.79 61.11 2nr2 h SER 57 Cb 0.31 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.16 2nr2 h SER 57 CO -0.00 1.08 0.30 -0.78 -0.87 0.00 0.00 176.83 176.56 2nr2 h ASP 58 N 0.57 1.03 1.25 4.97 3.58 -1.85 -2.13 116.42 123.84 2nr2 h ASP 58 Ca 0.04 -0.17 0.00 0.00 0.42 0.00 0.00 57.03 57.32 2nr2 h ASP 58 Cb 0.98 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.76 2nr2 h ASP 58 CO 0.09 0.92 0.00 1.88 -2.88 0.00 0.00 179.24 179.25 2nr2 h TYR 59 N 1.07 0.00 -3.59 0.28 0.05 -1.50 -3.47 116.97 109.82 2nr2 h TYR 59 Ca 0.25 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.88 2nr2 h TYR 59 Cb 0.21 0.00 0.07 0.00 1.01 0.00 0.00 36.73 38.02 2nr2 h TYR 59 CO 0.02 0.00 -0.34 0.09 -1.05 0.00 0.00 178.16 176.88 2nr2 n ASN 60 N -2.53 -2.29 -4.54 3.88 3.02 -0.80 -4.99 115.26 107.01 2nr2 n ASN 60 Ca 0.03 -0.27 -0.43 0.00 -0.03 0.00 0.00 54.58 53.88 2nr2 n ASN 60 Cb 0.36 -2.58 -0.04 0.00 -0.61 0.00 0.00 39.78 36.90 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 -3.16 4.47 0.00 2.41 1.01 0.13 -5.01 121.20 121.04 2nr2 s ILE 61 Ca 0.04 0.43 0.00 0.00 0.00 0.00 0.00 60.65 61.12 2nr2 s ILE 61 Cb -0.02 -4.46 0.00 0.00 0.01 0.00 0.00 42.46 37.99 2nr2 s ILE 61 CO 0.33 -0.95 0.00 0.00 0.00 0.00 0.00 174.94 174.32 2nr2 n GLN 62 N 7.21 2.40 -2.56 2.79 1.13 -1.26 -4.65 117.38 122.43 2nr2 n GLN 62 Ca 0.03 0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.69 2nr2 n GLN 62 Cb 0.48 0.00 -0.05 0.00 0.11 0.00 0.00 30.24 30.78 2nr2 n GLN 62 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 2nr2 s LYS 63 N 1.96 4.68 -0.32 -1.09 2.20 -1.26 -4.36 119.74 121.55 2nr2 s LYS 63 Ca 0.00 1.69 -0.00 0.00 -0.36 0.00 0.00 55.97 57.30 2nr2 s LYS 63 Cb 0.00 -3.25 -0.00 0.00 -1.51 0.00 0.00 37.83 33.07 2nr2 s LYS 63 CO 0.00 0.23 0.30 -1.91 -0.36 0.00 0.00 175.35 173.62 2nr2 n GLU 64 N 1.72 -0.58 -4.69 4.03 2.13 -1.26 -5.04 120.64 116.95 2nr2 n GLU 64 Ca 0.00 0.92 -0.31 0.00 0.66 0.00 0.00 57.16 58.43 2nr2 n GLU 64 Cb 0.46 -3.34 -0.13 0.00 0.27 0.00 0.00 31.44 28.70 2nr2 n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2nr2 s SER 65 N -2.45 3.81 -0.47 4.31 0.01 -1.26 -5.06 113.70 112.60 2nr2 s SER 65 Ca 0.00 -0.40 -0.12 0.00 1.31 0.00 0.00 55.95 56.74 2nr2 s SER 65 Cb -0.00 -0.63 0.10 0.00 0.21 0.00 0.00 66.02 65.70 2nr2 s SER 65 CO 0.32 0.26 0.36 -0.89 0.41 0.00 0.00 173.24 173.70 2nr2 s THR 66 N -0.90 4.62 -0.20 1.44 2.01 -1.26 -2.95 115.64 118.39 2nr2 s THR 66 Ca 0.14 -1.45 -0.19 0.00 0.31 0.00 0.00 61.69 60.50 2nr2 s THR 66 Cb -0.10 -3.89 -0.03 0.00 0.01 0.00 0.00 72.50 68.48 2nr2 s THR 66 CO 0.05 -0.66 0.54 -0.76 -0.69 0.00 0.00 174.62 173.09 2nr2 s LEU 67 N 1.49 4.14 -0.45 4.42 1.43 -0.62 -4.80 118.68 124.29 2nr2 s LEU 67 Ca 0.04 0.69 -0.20 0.00 -1.03 0.00 0.00 54.13 53.63 2nr2 s LEU 67 Cb -0.25 -2.74 0.03 0.00 0.03 0.00 0.00 46.19 43.26 2nr2 s LEU 67 CO 0.02 -0.20 0.62 -1.00 0.23 0.00 0.00 176.35 176.03 2nr2 s HIS 68 N 1.70 3.07 -0.37 0.29 3.76 0.22 -1.18 115.29 122.77 2nr2 s HIS 68 Ca 0.25 -0.17 -0.20 0.00 -0.15 0.00 0.00 55.06 54.78 2nr2 s HIS 68 Cb -0.15 -3.34 0.01 0.00 1.11 0.00 0.00 32.58 30.20 2nr2 s HIS 68 CO 0.10 -0.89 0.64 -1.17 -0.85 0.00 0.00 174.74 172.56 2nr2 s LEU 69 N 2.74 4.30 0.26 0.89 2.96 0.84 -0.08 118.68 130.59 2nr2 s LEU 69 Ca 0.20 0.05 0.06 0.00 -0.22 0.00 0.00 54.13 54.22 2nr2 s LEU 69 Cb -0.15 -2.77 -0.03 0.00 0.50 0.00 0.00 46.19 43.74 2nr2 s LEU 69 CO 0.17 -0.63 0.30 0.68 -1.32 0.00 0.00 176.35 175.55 2nr2 s VAL 70 N 2.73 4.75 -0.33 1.68 -7.23 -0.20 -3.52 120.40 118.27 2nr2 s VAL 70 Ca 0.24 -1.18 -0.16 0.00 -1.81 0.00 0.00 61.98 59.07 2nr2 s VAL 70 Cb -0.14 -3.60 -0.01 0.00 0.56 0.00 0.00 36.38 33.18 2nr2 s VAL 70 CO 0.16 -0.32 0.40 -0.22 -0.31 0.00 0.00 175.10 174.81 2nr2 s LEU 71 N -3.94 4.36 -0.25 1.32 2.96 -1.26 -2.88 118.68 119.00 2nr2 s LEU 71 Ca 0.35 -0.11 -0.15 0.00 -0.22 0.00 0.00 54.13 54.00 2nr2 s LEU 71 Cb -0.08 -2.41 -0.04 0.00 0.50 0.00 0.00 46.19 44.15 2nr2 s LEU 71 CO 0.27 -0.36 0.35 -0.60 -1.32 0.00 0.00 176.35 174.70 2nr2 s ARG 72 N 2.12 4.06 0.60 1.98 6.06 -0.51 -5.00 118.95 128.26 2nr2 s ARG 72 Ca 0.14 0.04 0.05 0.00 -2.50 0.00 0.00 55.73 53.46 2nr2 s ARG 72 Cb -0.16 -3.61 0.08 0.00 0.06 0.00 0.00 34.95 31.32 2nr2 s ARG 72 CO 0.12 -0.18 0.83 -0.51 -2.50 0.00 0.00 175.30 173.06 2nr2 s LEU 73 N 1.76 3.16 -0.55 -0.88 1.43 -1.26 -4.41 118.68 117.93 2nr2 s LEU 73 Ca 0.15 -0.51 -0.25 0.00 -1.03 0.00 0.00 54.13 52.49 2nr2 s LEU 73 Cb -0.15 -2.06 0.04 0.00 0.03 0.00 0.00 46.19 44.04 2nr2 s LEU 73 CO 0.09 -1.41 1.00 -0.13 0.23 0.00 0.00 176.35 176.13 2nr2 s ARG 74 N -4.80 3.39 0.00 1.70 0.52 -1.26 -4.87 118.95 113.62 2nr2 s ARG 74 Ca 0.62 -0.12 0.00 0.00 -0.52 0.00 0.00 55.73 55.71 2nr2 s ARG 74 Cb -0.07 -4.04 0.00 0.00 0.52 0.00 0.00 34.95 31.36 2nr2 s ARG 74 CO 0.40 -1.52 0.00 0.41 0.02 0.00 0.00 175.30 174.61 2nr2 n GLY 75 N 5.10 -0.94 0.00 -3.53 0.00 -1.26 -5.32 105.19 99.24 2nr2 n GLY 75 Ca 0.04 -0.88 0.08 0.00 0.00 0.00 0.00 46.02 45.25 2nr2 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93