#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pi0 s LYS 5 N 0.00 4.53 0.66 0.54 1.02 -1.26 -5.02 119.74 120.21 2pi0 s LYS 5 Ca 0.00 1.16 -0.17 0.00 0.02 0.00 0.00 55.97 56.98 2pi0 s LYS 5 Cb 0.00 -3.06 0.00 0.00 -0.52 0.00 0.00 37.83 34.25 2pi0 s LYS 5 CO 0.00 0.46 1.23 -1.25 -0.92 0.00 0.00 175.35 174.86 2pi0 s PRO 6 N -1.57 2.52 0.23 -1.68 0.04 -1.26 -5.00 135.00 128.29 2pi0 s PRO 6 Ca 0.41 1.85 -0.30 0.00 0.04 0.00 0.00 61.00 63.01 2pi0 s PRO 6 Cb -0.21 -1.87 -0.09 0.00 0.04 0.00 0.00 34.50 32.38 2pi0 s PRO 6 CO 0.25 -1.56 1.01 1.03 0.04 0.00 0.00 177.00 177.77 2pi0 s ARG 7 N -3.60 4.74 0.22 4.56 0.52 -1.26 -5.00 118.95 119.13 2pi0 s ARG 7 Ca 0.77 1.62 -0.00 0.00 -0.52 0.00 0.00 55.73 57.60 2pi0 s ARG 7 Cb -0.31 -3.26 0.22 0.00 0.52 0.00 0.00 34.95 32.12 2pi0 s ARG 7 CO 0.40 0.33 1.58 0.97 0.02 0.00 0.00 175.30 178.60 2pi0 h ILE 8 N 3.29 1.32 -0.10 1.52 2.10 -1.94 -3.26 117.51 120.44 2pi0 h ILE 8 Ca -0.45 -1.67 -0.04 0.00 1.08 0.00 0.00 64.86 63.77 2pi0 h ILE 8 Cb 1.21 1.68 -0.00 0.00 -1.09 0.00 0.00 36.82 38.62 2pi0 h ILE 8 CO 0.69 0.52 -0.11 -0.07 -1.08 0.00 0.00 178.15 178.09 2pi0 h LEU 9 N 0.39 0.27 -0.98 2.19 3.38 -1.95 -1.64 115.31 116.97 2pi0 h LEU 9 Ca 0.02 -0.49 -0.05 0.00 0.09 0.00 0.00 57.88 57.45 2pi0 h LEU 9 Cb 0.97 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 2pi0 h LEU 9 CO 0.09 0.71 0.18 -0.65 0.09 0.00 0.00 178.44 178.85 2pi0 h PRO 10 N -0.16 0.92 -0.97 1.13 0.11 -2.01 -2.10 132.00 128.91 2pi0 h PRO 10 Ca 0.02 -0.18 0.02 0.00 0.11 0.00 0.00 66.00 65.96 2pi0 h PRO 10 Cb 0.63 -0.14 -0.05 0.00 0.11 0.00 0.00 31.00 31.55 2pi0 h PRO 10 CO 0.03 0.80 0.64 2.35 -0.21 0.00 0.00 178.00 181.61 2pi0 h TRP 11 N 0.89 1.22 0.22 0.65 7.01 -1.59 -2.29 115.95 122.06 2pi0 h TRP 11 Ca 0.20 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.22 2pi0 h TRP 11 Cb 0.27 -0.41 0.00 0.00 -2.10 0.00 0.00 29.16 26.92 2pi0 h TRP 11 CO 0.02 0.75 -0.11 -0.07 -2.79 0.00 0.00 178.44 176.25 2pi0 h LEU 12 N 1.30 -0.25 -0.46 0.65 3.38 -0.82 -0.74 115.31 118.38 2pi0 h LEU 12 Ca 0.36 -0.11 0.09 0.00 0.09 0.00 0.00 57.88 58.32 2pi0 h LEU 12 Cb -0.12 0.06 -0.09 0.00 0.09 0.00 0.00 40.66 40.61 2pi0 h LEU 12 CO -0.09 -0.04 -0.11 0.58 0.09 0.00 0.00 178.44 178.87 2pi0 h VAL 13 N -0.45 0.55 -0.62 1.22 2.07 -1.35 0.38 116.25 118.05 2pi0 h VAL 13 Ca -0.03 -0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.59 2pi0 h VAL 13 Cb 0.34 0.54 -0.08 0.00 -1.52 0.00 0.00 31.29 30.58 2pi0 h VAL 13 CO 0.05 0.00 0.22 -1.28 0.02 0.00 0.00 177.57 176.58 2pi0 h SER 14 N 0.01 0.21 -0.53 0.57 0.87 -1.30 -1.00 113.55 112.37 2pi0 h SER 14 Ca 0.22 0.08 -0.09 0.00 -1.23 0.00 0.00 61.79 60.77 2pi0 h SER 14 Cb 0.34 0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.35 2pi0 h SER 14 CO -0.47 0.12 -0.03 1.56 -0.53 0.00 0.00 176.83 177.48 2pi0 h GLN 15 N 0.40 0.96 -0.46 2.24 1.08 0.01 -1.95 115.11 117.38 2pi0 h GLN 15 Ca 0.32 -0.32 0.01 0.00 -1.45 0.00 0.00 58.65 57.20 2pi0 h GLN 15 Cb 0.41 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.74 2pi0 h GLN 15 CO -0.32 0.99 0.31 -0.07 -0.95 0.00 0.00 178.83 178.78 2pi0 h LEU 16 N 0.84 0.53 -0.39 1.46 3.38 -0.33 -2.58 115.31 118.21 2pi0 h LEU 16 Ca 0.15 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 2pi0 h LEU 16 Cb 0.57 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2pi0 h LEU 16 CO 0.03 0.38 0.23 0.44 0.09 0.00 0.00 178.44 179.61 2pi0 h ASP 17 N 0.62 0.47 -0.32 -0.43 5.19 -1.08 -2.28 116.42 118.60 2pi0 h ASP 17 Ca 0.17 -0.06 0.01 0.00 -0.62 0.00 0.00 57.03 56.53 2pi0 h ASP 17 Cb -0.07 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 39.31 2pi0 h ASP 17 CO -0.04 0.40 0.21 -0.07 -3.12 0.00 0.00 179.24 176.62 2pi0 h LEU 18 N 0.51 0.33 1.38 1.55 3.38 -1.35 -3.46 115.31 117.66 2pi0 h LEU 18 Ca 0.14 -0.01 -0.42 0.00 0.09 0.00 0.00 57.88 57.68 2pi0 h LEU 18 Cb 0.02 -0.08 -0.14 0.00 0.09 0.00 0.00 40.66 40.54 2pi0 h LEU 18 CO -0.03 0.24 -0.42 0.61 0.09 0.00 0.00 178.44 178.94 2pi0 n GLY 19 N -1.50 1.50 0.05 0.83 0.00 -0.86 -4.88 105.19 100.34 2pi0 n GLY 19 Ca 0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.11 2pi0 n GLY 19 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2pi0 n GLN 20 N -2.50 1.07 -4.08 1.61 1.13 -1.26 -4.84 117.38 108.50 2pi0 n GLN 20 Ca -0.22 -0.10 -0.28 0.00 -1.94 0.00 0.00 57.00 54.46 2pi0 n GLN 20 Cb 0.69 -1.23 -0.17 0.00 0.11 0.00 0.00 30.24 29.63 2pi0 n GLN 20 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2pi0 s LEU 21 N -1.44 1.49 -0.17 1.08 1.43 -1.26 -5.09 118.68 114.72 2pi0 s LEU 21 Ca 0.22 -0.39 -0.40 0.00 -1.03 0.00 0.00 54.13 52.52 2pi0 s LEU 21 Cb 0.10 -1.01 -0.17 0.00 0.03 0.00 0.00 46.19 45.14 2pi0 s LEU 21 CO 0.17 -0.06 1.50 -0.62 0.23 0.00 0.00 176.35 177.57 2pi0 n GLU 22 N 4.69 0.79 -0.89 1.70 -0.58 -1.26 -1.19 120.64 123.89 2pi0 n GLU 22 Ca -0.16 0.29 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 2pi0 n GLU 22 Cb 0.50 -1.90 0.00 0.00 -0.57 0.00 0.00 31.44 29.47 2pi0 n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2pi0 n GLY 23 N 3.28 0.34 3.44 0.62 0.00 -1.26 -4.79 105.19 106.81 2pi0 n GLY 23 Ca 0.24 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.82 2pi0 n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2pi0 s VAL 24 N -1.89 5.02 0.05 1.61 1.01 -0.33 -3.91 120.40 121.95 2pi0 s VAL 24 Ca 0.00 -0.64 -0.23 0.00 0.00 0.00 0.00 61.98 61.11 2pi0 s VAL 24 Cb 0.00 -4.20 0.05 0.00 0.00 0.00 0.00 36.38 32.23 2pi0 s VAL 24 CO 0.00 -0.67 0.54 0.00 0.00 0.00 0.00 175.10 174.97 2pi0 s ALA 25 N 2.25 -1.38 0.35 5.51 0.00 -1.07 -4.66 121.76 122.77 2pi0 s ALA 25 Ca 0.11 0.63 -0.28 0.00 0.00 0.00 0.00 51.96 52.42 2pi0 s ALA 25 Cb -0.20 0.40 -0.10 0.00 0.00 0.00 0.00 23.12 23.21 2pi0 s ALA 25 CO 0.11 -0.52 1.37 -1.58 0.00 0.00 0.00 175.76 175.14 2pi0 s TRP 26 N -2.47 2.87 -0.10 0.00 0.52 -1.26 0.19 118.94 118.69 2pi0 s TRP 26 Ca -0.05 1.33 0.14 0.00 0.02 0.00 0.00 56.10 57.54 2pi0 s TRP 26 Cb -0.01 -3.79 0.24 0.00 -1.15 0.00 0.00 33.47 28.76 2pi0 s TRP 26 CO -0.02 -2.26 1.12 1.33 0.02 0.00 0.00 176.95 177.14 2pi0 n VAL 27 N 0.61 1.44 -3.94 4.03 0.24 0.55 -4.87 118.33 116.39 2pi0 n VAL 27 Ca 0.01 -1.82 -0.09 0.00 -2.04 0.00 0.00 64.34 60.40 2pi0 n VAL 27 Cb 0.41 -0.04 -0.04 0.00 -1.47 0.00 0.00 33.84 32.71 2pi0 n VAL 27 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2pi0 s ASN 28 N -2.47 -0.10 0.16 -1.34 4.22 -1.25 -4.97 114.94 109.19 2pi0 s ASN 28 Ca 0.26 -0.86 0.06 0.00 -2.14 0.00 0.00 52.86 50.18 2pi0 s ASN 28 Cb 0.23 0.66 -0.05 0.00 1.28 0.00 0.00 41.25 43.37 2pi0 s ASN 28 CO 0.01 -1.25 1.36 0.50 -2.04 0.00 0.00 177.10 175.68 2pi0 h LYS 29 N 2.14 0.06 -0.01 3.55 1.63 -1.96 -3.06 116.57 118.93 2pi0 h LYS 29 Ca -0.24 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.49 2pi0 h LYS 29 Cb 1.25 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.90 2pi0 h LYS 29 CO 0.31 0.92 -0.16 -1.13 -3.45 0.00 0.00 179.45 175.94 2pi0 n SER 30 N -3.53 1.11 -3.36 4.20 3.41 -1.26 -4.98 113.62 109.22 2pi0 n SER 30 Ca -0.02 -1.05 -0.21 0.00 -0.26 0.00 0.00 58.87 57.33 2pi0 n SER 30 Cb 0.85 0.07 0.01 0.00 -0.26 0.00 0.00 64.21 64.89 2pi0 n SER 30 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2pi0 n ARG 31 N -0.43 -1.82 0.00 4.33 1.74 -1.16 -4.91 116.66 114.41 2pi0 n ARG 31 Ca 0.15 1.42 0.00 0.00 -0.77 0.00 0.00 57.85 58.64 2pi0 n ARG 31 Cb 0.34 -3.62 0.00 0.00 -1.02 0.00 0.00 32.46 28.16 2pi0 n ARG 31 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2pi0 n THR 32 N -1.17 0.00 -5.14 0.55 -2.24 -1.26 -5.04 114.28 99.98 2pi0 n THR 32 Ca -0.09 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.37 2pi0 n THR 32 Cb 0.60 0.33 -0.16 0.00 -2.10 0.00 0.00 70.33 69.00 2pi0 n THR 32 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2pi0 s ARG 33 N 0.00 2.99 0.08 -0.78 0.52 -1.26 -1.91 118.95 118.59 2pi0 s ARG 33 Ca 0.00 -0.84 -0.04 0.00 -0.52 0.00 0.00 55.73 54.32 2pi0 s ARG 33 Cb 0.00 -2.33 -0.02 0.00 0.52 0.00 0.00 34.95 33.11 2pi0 s ARG 33 CO 0.00 0.25 0.08 -0.59 0.02 0.00 0.00 175.30 175.06 2pi0 s PHE 34 N 0.19 0.40 0.23 -0.53 -0.12 -0.76 -0.33 117.98 117.06 2pi0 s PHE 34 Ca -0.13 -0.87 0.12 0.00 -0.05 0.00 0.00 56.93 55.99 2pi0 s PHE 34 Cb -0.16 -0.25 -0.05 0.00 -0.63 0.00 0.00 43.02 41.93 2pi0 s PHE 34 CO 0.07 -0.48 -0.21 -0.98 -0.05 0.00 0.00 175.22 173.57 2pi0 s ARG 35 N -3.91 1.62 -0.04 1.99 1.70 0.13 -1.60 118.95 118.84 2pi0 s ARG 35 Ca 0.08 -1.62 0.00 0.00 -0.47 0.00 0.00 55.73 53.73 2pi0 s ARG 35 Cb 0.06 -1.83 0.03 0.00 -0.57 0.00 0.00 34.95 32.64 2pi0 s ARG 35 CO -0.09 0.37 -0.01 0.42 -1.08 0.00 0.00 175.30 174.91 2pi0 s ILE 36 N -2.03 0.28 0.43 4.99 -1.09 -0.53 -2.60 121.20 120.65 2pi0 s ILE 36 Ca 0.25 0.05 -0.25 0.00 -2.23 0.00 0.00 60.65 58.47 2pi0 s ILE 36 Cb -0.07 -0.37 -0.08 0.00 -1.58 0.00 0.00 42.46 40.36 2pi0 s ILE 36 CO 0.12 0.18 1.25 -2.84 -1.23 0.00 0.00 174.94 172.43 2pi0 s PRO 37 N 1.13 3.83 -0.35 2.79 0.02 -1.25 -1.32 135.00 139.85 2pi0 s PRO 37 Ca -0.08 2.02 0.15 0.00 0.02 0.00 0.00 61.00 63.11 2pi0 s PRO 37 Cb -0.14 -2.60 0.41 0.00 0.02 0.00 0.00 34.50 32.20 2pi0 s PRO 37 CO -0.02 -0.56 0.90 1.87 -0.33 0.00 0.00 177.00 178.86 2pi0 n TRP 38 N -0.17 0.47 -2.59 6.54 -0.00 -0.66 -4.82 117.44 116.21 2pi0 n TRP 38 Ca 0.05 -3.08 -0.34 0.00 -0.00 0.00 0.00 57.50 54.14 2pi0 n TRP 38 Cb 0.45 -0.21 -0.04 0.00 -0.00 0.00 0.00 31.31 31.51 2pi0 n TRP 38 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 177.69 176.10 2pi0 s LYS 39 N -2.58 3.88 -0.03 5.87 0.00 -1.26 -4.51 119.74 121.12 2pi0 s LYS 39 Ca 0.31 1.29 -0.30 0.00 0.00 0.00 0.00 55.97 57.28 2pi0 s LYS 39 Cb 0.41 -2.11 -0.03 0.00 0.00 0.00 0.00 37.83 36.10 2pi0 s LYS 39 CO -0.01 -0.35 1.01 -1.58 0.00 0.00 0.00 175.35 174.42 2pi0 s HIS 40 N -2.05 3.58 0.42 1.78 2.46 -1.26 -4.94 115.29 115.28 2pi0 s HIS 40 Ca 0.66 1.63 0.23 0.00 0.47 0.00 0.00 55.06 58.04 2pi0 s HIS 40 Cb -0.15 -3.17 1.21 0.00 -0.13 0.00 0.00 32.58 30.35 2pi0 s HIS 40 CO 0.19 -0.19 1.76 0.78 -2.47 0.00 0.00 174.74 174.80 2pi0 h GLY 41 N 7.24 1.05 2.00 1.59 0.00 -1.99 -1.77 103.07 111.20 2pi0 h GLY 41 Ca -0.38 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 46.79 2pi0 h GLY 41 CO 0.79 -0.15 0.00 1.04 0.00 0.00 0.00 176.54 178.22 2pi0 n LEU 42 N -4.57 0.00 -4.74 3.11 4.77 -1.26 -4.77 117.00 109.54 2pi0 n LEU 42 Ca 0.27 0.50 -0.41 0.00 -0.03 0.00 0.00 56.01 56.34 2pi0 n LEU 42 Cb 1.01 -0.50 -0.04 0.00 -2.33 0.00 0.00 43.42 41.56 2pi0 n LEU 42 CO 0.27 -0.21 0.85 -0.13 -1.33 0.00 0.00 177.39 176.84 2pi0 s ARG 43 N -3.00 4.52 0.48 3.23 0.52 -0.67 -4.92 118.95 119.11 2pi0 s ARG 43 Ca 0.08 1.82 0.25 0.00 -0.52 0.00 0.00 55.73 57.35 2pi0 s ARG 43 Cb 0.11 -3.26 1.22 0.00 0.52 0.00 0.00 34.95 33.54 2pi0 s ARG 43 CO 0.31 -0.04 1.98 0.37 0.02 0.00 0.00 175.30 177.93 2pi0 h GLN 44 N 5.28 0.00 -2.55 3.54 -0.00 -1.89 -1.86 115.11 117.63 2pi0 h GLN 44 Ca -0.44 0.00 -0.77 0.00 -0.00 0.00 0.00 58.65 57.43 2pi0 h GLN 44 Cb 1.21 0.00 -0.19 0.00 0.00 0.00 0.00 27.48 28.50 2pi0 h GLN 44 CO 0.74 0.18 1.74 -0.40 0.00 0.00 0.00 178.83 181.09 2pi0 n ASP 45 N -3.63 7.48 -4.31 -0.69 5.75 -1.26 -4.99 116.55 114.89 2pi0 n ASP 45 Ca -0.01 -3.37 -0.26 0.00 -0.01 0.00 0.00 54.79 51.13 2pi0 n ASP 45 Cb 0.31 -1.29 -0.13 0.00 -1.03 0.00 0.00 41.12 38.98 2pi0 n ASP 45 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2pi0 s ALA 46 N -2.42 1.99 0.00 2.12 0.00 -0.70 -5.07 121.76 117.69 2pi0 s ALA 46 Ca 0.46 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 51.16 2pi0 s ALA 46 Cb 0.17 -0.33 0.00 0.00 0.00 0.00 0.00 23.12 22.96 2pi0 s ALA 46 CO -0.09 0.44 0.00 1.04 0.00 0.00 0.00 175.76 177.15 2pi0 n GLN 47 N 1.31 0.00 -0.15 0.00 1.13 -1.26 -5.06 117.38 113.36 2pi0 n GLN 47 Ca -0.18 0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 54.77 2pi0 n GLN 47 Cb 0.53 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.87 2pi0 n GLN 47 CO 0.00 0.00 0.00 0.37 -1.44 0.00 0.00 177.06 175.99 2pi0 h GLN 48 N 0.00 0.86 -0.22 -1.09 5.75 -2.01 -3.28 115.11 115.11 2pi0 h GLN 48 Ca 0.00 -0.34 0.00 0.00 -0.15 0.00 0.00 58.65 58.16 2pi0 h GLN 48 Cb 0.00 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.51 2pi0 h GLN 48 CO 0.00 0.98 0.00 -1.91 -2.65 0.00 0.00 178.83 175.25 2pi0 n GLU 49 N -4.25 2.09 0.26 1.69 4.07 -1.26 -2.39 120.64 120.84 2pi0 n GLU 49 Ca -0.01 -1.63 0.16 0.00 -0.06 0.00 0.00 57.16 55.63 2pi0 n GLU 49 Cb 0.40 -1.45 0.61 0.00 -0.06 0.00 0.00 31.44 30.93 2pi0 n GLU 49 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 2pi0 h ASP 50 N 3.37 0.00 -0.73 4.31 3.45 -1.98 -3.16 116.42 121.68 2pi0 h ASP 50 Ca 0.00 0.00 -0.51 0.00 0.43 0.00 0.00 57.03 56.95 2pi0 h ASP 50 Cb 0.73 0.00 -0.33 0.00 -0.56 0.00 0.00 39.33 39.18 2pi0 h ASP 50 CO 0.00 0.00 -0.25 0.49 -1.57 0.00 0.00 179.24 177.91 2pi0 n PHE 51 N -3.00 2.54 0.02 4.55 0.99 -1.00 -4.62 117.46 116.93 2pi0 n PHE 51 Ca 0.01 -2.31 -0.04 0.00 -0.00 0.00 0.00 57.45 55.10 2pi0 n PHE 51 Cb 0.32 -0.66 -0.03 0.00 -1.00 0.00 0.00 39.48 38.12 2pi0 n PHE 51 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 2pi0 h GLY 52 N 1.91 -1.30 2.00 1.37 0.00 -1.65 0.13 103.07 105.53 2pi0 h GLY 52 Ca 0.40 0.61 -0.06 0.00 0.00 0.00 0.00 47.33 48.28 2pi0 h GLY 52 CO 0.90 -0.44 -0.29 0.16 0.00 0.00 0.00 176.54 176.86 2pi0 h ILE 53 N -0.19 0.96 -0.29 2.60 -0.00 -1.91 -1.34 117.51 117.33 2pi0 h ILE 53 Ca 0.00 -1.11 -0.02 0.00 -0.00 0.00 0.00 64.86 63.74 2pi0 h ILE 53 Cb 0.20 1.64 -0.01 0.00 -0.00 0.00 0.00 36.82 38.65 2pi0 h ILE 53 CO -0.10 0.29 0.11 -0.26 -0.00 0.00 0.00 178.15 178.19 2pi0 h PHE 54 N 0.00 0.44 0.03 0.16 0.04 -1.85 0.15 116.94 115.91 2pi0 h PHE 54 Ca -0.00 -0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.73 2pi0 h PHE 54 Cb 0.62 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.64 2pi0 h PHE 54 CO 0.00 0.44 -0.02 0.37 -0.60 0.00 0.00 178.31 178.50 2pi0 h GLN 55 N 0.31 -0.04 -0.87 1.51 4.15 -0.66 -2.28 115.11 117.23 2pi0 h GLN 55 Ca 0.10 0.00 0.20 0.00 0.77 0.00 0.00 58.65 59.71 2pi0 h GLN 55 Cb 0.19 0.01 -0.12 0.00 0.21 0.00 0.00 27.48 27.77 2pi0 h GLN 55 CO -0.01 0.37 0.40 0.00 -1.93 0.00 0.00 178.83 177.66 2pi0 h ALA 56 N 0.48 1.37 -0.62 3.38 0.00 -1.16 0.25 119.26 122.96 2pi0 h ALA 56 Ca -0.00 0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 2pi0 h ALA 56 Cb 0.43 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2pi0 h ALA 56 CO 0.01 -0.27 0.05 2.35 0.00 0.00 0.00 179.25 181.38 2pi0 h TRP 57 N 0.46 1.16 -0.02 0.00 2.91 -0.67 -0.94 115.95 118.84 2pi0 h TRP 57 Ca 0.53 -0.18 -0.08 0.00 1.13 0.00 0.00 58.89 60.29 2pi0 h TRP 57 Cb 0.93 -0.31 -0.01 0.00 -0.51 0.00 0.00 29.16 29.26 2pi0 h TRP 57 CO -0.13 1.00 -0.34 0.00 -1.03 0.00 0.00 178.44 177.94 2pi0 h ALA 58 N 1.01 1.39 0.07 2.65 0.00 -0.42 -2.50 119.26 121.46 2pi0 h ALA 58 Ca 0.18 -0.32 -0.27 0.00 0.00 0.00 0.00 54.91 54.51 2pi0 h ALA 58 Cb 0.51 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.25 2pi0 h ALA 58 CO 0.02 0.45 -1.11 0.93 0.00 0.00 0.00 179.25 179.54 2pi0 h GLU 59 N 0.03 0.50 -0.89 0.00 5.08 -1.02 0.41 114.58 118.70 2pi0 h GLU 59 Ca 0.00 -0.62 -0.00 0.00 -1.00 0.00 0.00 59.36 57.73 2pi0 h GLU 59 Cb 0.63 0.20 -0.04 0.00 0.50 0.00 0.00 28.75 30.03 2pi0 h GLU 59 CO 0.05 1.25 0.54 0.00 -1.00 0.00 0.00 179.01 179.84 2pi0 h ALA 60 N 0.51 1.13 -0.01 3.43 0.00 -0.75 -2.80 119.26 120.78 2pi0 h ALA 60 Ca -0.13 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2pi0 h ALA 60 Cb 1.78 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2pi0 h ALA 60 CO 0.20 0.59 -0.08 0.25 0.00 0.00 0.00 179.25 180.21 2pi0 n THR 61 N -4.41 0.00 -0.99 0.00 -2.24 -0.99 -4.78 114.28 100.88 2pi0 n THR 61 Ca 0.09 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2pi0 n THR 61 Cb 0.06 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 2pi0 n THR 61 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2pi0 n GLY 62 N 1.21 0.48 0.18 3.38 0.00 -1.06 -4.88 105.19 104.50 2pi0 n GLY 62 Ca 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 2pi0 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pi0 h ALA 63 N 0.00 0.43 -3.02 4.61 0.00 -0.96 -3.41 119.26 116.92 2pi0 h ALA 63 Ca 0.00 -0.22 -0.66 0.00 0.00 0.00 0.00 54.91 54.03 2pi0 h ALA 63 Cb 0.13 -0.12 -0.29 0.00 0.00 0.00 0.00 17.79 17.51 2pi0 h ALA 63 CO 0.00 0.16 -0.74 -0.47 0.00 0.00 0.00 179.25 178.20 2pi0 s TYR 64 N -5.09 2.94 -0.36 0.00 5.04 0.11 -4.98 117.35 115.01 2pi0 s TYR 64 Ca -0.13 -1.06 -0.03 0.00 -2.44 0.00 0.00 57.07 53.40 2pi0 s TYR 64 Cb 0.09 -2.08 0.08 0.00 0.35 0.00 0.00 41.96 40.39 2pi0 s TYR 64 CO 0.76 -0.59 0.12 0.08 -1.34 0.00 0.00 175.55 174.58 2pi0 s VAL 65 N 1.45 3.28 -0.20 3.14 1.01 -1.26 -4.01 120.40 123.81 2pi0 s VAL 65 Ca 0.05 -1.65 -0.39 0.00 0.00 0.00 0.00 61.98 59.99 2pi0 s VAL 65 Cb -0.14 -3.05 -0.15 0.00 0.00 0.00 0.00 36.38 33.03 2pi0 s VAL 65 CO -0.05 -0.40 1.71 -2.65 0.00 0.00 0.00 175.10 173.72 2pi0 n PRO 66 N 4.65 1.32 0.00 2.72 -0.02 -1.26 -0.08 135.00 142.33 2pi0 n PRO 66 Ca -0.08 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 2pi0 n PRO 66 Cb 0.43 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 2pi0 n PRO 66 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2pi0 n GLY 67 N 4.01 2.96 0.11 -1.23 0.00 -1.26 -4.80 105.19 104.98 2pi0 n GLY 67 Ca 0.25 -0.35 -0.10 0.00 0.00 0.00 0.00 46.02 45.82 2pi0 n GLY 67 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2pi0 h ARG 68 N 0.00 -0.13 -6.17 1.61 2.43 -0.92 -3.47 114.38 107.73 2pi0 h ARG 68 Ca 0.00 0.01 -0.51 0.00 -0.81 0.00 0.00 59.98 58.66 2pi0 h ARG 68 Cb 0.00 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.54 2pi0 h ARG 68 CO 0.00 0.36 -0.50 -0.51 -1.51 0.00 0.00 179.97 177.81 2pi0 s ASP 69 N -5.65 5.85 -0.04 -3.80 -0.00 -0.94 -5.02 116.67 107.08 2pi0 s ASP 69 Ca -0.12 -0.08 -0.24 0.00 -0.00 0.00 0.00 52.55 52.11 2pi0 s ASP 69 Cb -0.00 -1.61 -0.04 0.00 -0.00 0.00 0.00 42.92 41.27 2pi0 s ASP 69 CO 0.45 -0.01 0.72 -1.59 -0.00 0.00 0.00 175.17 174.74 2pi0 s LYS 70 N -3.62 4.44 0.07 8.23 0.00 -1.26 -4.77 119.74 122.84 2pi0 s LYS 70 Ca 0.33 0.93 -0.34 0.00 0.00 0.00 0.00 55.97 56.89 2pi0 s LYS 70 Cb -0.09 -3.42 -0.18 0.00 0.00 0.00 0.00 37.83 34.14 2pi0 s LYS 70 CO 0.26 0.13 0.84 -0.35 0.00 0.00 0.00 175.35 176.23 2pi0 n PRO 71 N 3.50 0.00 -3.14 1.78 -0.04 -1.26 -4.94 135.00 130.90 2pi0 n PRO 71 Ca -0.02 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.25 2pi0 n PRO 71 Cb 0.51 -1.27 -0.05 0.00 -0.04 0.00 0.00 33.50 32.65 2pi0 n PRO 71 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2pi0 n ASP 72 N 1.61 -1.20 -0.30 3.54 -0.08 -1.26 -5.01 116.55 113.85 2pi0 n ASP 72 Ca 0.18 -2.67 -0.05 0.00 -1.51 0.00 0.00 54.79 50.74 2pi0 n ASP 72 Cb 0.14 0.17 0.07 0.00 2.34 0.00 0.00 41.12 43.84 2pi0 n ASP 72 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 2pi0 h LEU 73 N 4.89 1.05 -0.63 -2.67 4.07 -1.99 -1.04 115.31 118.98 2pi0 h LEU 73 Ca 0.13 -0.11 0.11 0.00 0.08 0.00 0.00 57.88 58.09 2pi0 h LEU 73 Cb 0.96 -0.27 -0.08 0.00 1.08 0.00 0.00 40.66 42.34 2pi0 h LEU 73 CO 0.32 0.86 0.18 1.55 -1.08 0.00 0.00 178.44 180.27 2pi0 h PRO 74 N 1.16 0.31 -0.75 1.13 0.13 -1.99 -1.28 132.00 130.71 2pi0 h PRO 74 Ca 0.29 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.39 2pi0 h PRO 74 Cb 0.06 -0.07 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 2pi0 h PRO 74 CO -0.04 0.21 0.41 1.15 -0.23 0.00 0.00 178.00 179.50 2pi0 h THR 75 N 0.32 1.23 -0.27 1.56 2.02 -1.85 0.18 112.91 116.10 2pi0 h THR 75 Ca 0.33 -0.56 0.03 0.00 0.77 0.00 0.00 66.41 66.98 2pi0 h THR 75 Cb 0.48 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 2pi0 h THR 75 CO -0.38 0.25 0.07 -0.50 0.37 0.00 0.00 175.52 175.33 2pi0 h TRP 76 N 1.04 0.13 -0.47 3.16 6.55 -0.82 0.11 115.95 125.65 2pi0 h TRP 76 Ca 0.26 0.01 -0.07 0.00 0.95 0.00 0.00 58.89 60.04 2pi0 h TRP 76 Cb 0.03 -0.02 -0.02 0.00 -0.86 0.00 0.00 29.16 28.29 2pi0 h TRP 76 CO -0.00 0.05 0.01 -0.22 -1.05 0.00 0.00 178.44 177.22 2pi0 h LYS 77 N 0.19 0.83 -0.18 0.49 3.64 -1.14 0.14 116.57 120.53 2pi0 h LYS 77 Ca 0.12 -0.26 0.05 0.00 -1.27 0.00 0.00 60.65 59.29 2pi0 h LYS 77 Cb 0.11 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 31.79 2pi0 h LYS 77 CO -0.14 0.88 -0.16 -0.09 -2.27 0.00 0.00 179.45 177.66 2pi0 h ARG 78 N 0.69 -0.17 0.01 1.90 2.43 -0.36 -0.43 114.38 118.45 2pi0 h ARG 78 Ca 0.13 0.01 -0.20 0.00 -0.81 0.00 0.00 59.98 59.12 2pi0 h ARG 78 Cb 0.50 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 2pi0 h ARG 78 CO 0.02 -0.12 -0.94 -0.91 -1.51 0.00 0.00 179.97 176.52 2pi0 h ASN 79 N -0.18 0.10 -0.05 -3.80 2.35 -0.54 0.77 115.58 114.23 2pi0 h ASN 79 Ca 0.11 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 2pi0 h ASN 79 Cb 0.35 -0.03 -0.00 0.00 0.05 0.00 0.00 38.32 38.69 2pi0 h ASN 79 CO -0.29 0.98 0.01 0.15 -1.65 0.00 0.00 177.43 176.62 2pi0 h PHE 80 N 0.03 0.09 -0.21 1.19 3.04 -0.61 -1.05 116.94 119.43 2pi0 h PHE 80 Ca -0.03 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.91 2pi0 h PHE 80 Cb 1.63 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 40.10 2pi0 h PHE 80 CO 0.01 0.33 0.13 -0.09 -2.02 0.00 0.00 178.31 176.68 2pi0 h ARG 81 N -0.18 0.28 -0.93 1.11 2.43 -1.05 -2.21 114.38 113.82 2pi0 h ARG 81 Ca 0.01 -0.02 0.11 0.00 -0.81 0.00 0.00 59.98 59.27 2pi0 h ARG 81 Cb 0.29 -0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 29.71 2pi0 h ARG 81 CO 0.00 0.20 0.60 0.77 -1.51 0.00 0.00 179.97 180.03 2pi0 h SER 82 N 0.26 0.83 0.53 -3.80 0.02 -0.87 0.14 113.55 110.68 2pi0 h SER 82 Ca 0.07 0.03 -0.11 0.00 -0.84 0.00 0.00 61.79 60.95 2pi0 h SER 82 Cb -0.00 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.38 2pi0 h SER 82 CO -0.02 0.47 -0.53 0.00 -1.14 0.00 0.00 176.83 175.62 2pi0 h ALA 83 N 1.55 1.12 -0.00 3.77 0.00 -0.75 -2.43 119.26 122.53 2pi0 h ALA 83 Ca 0.44 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2pi0 h ALA 83 Cb 0.46 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2pi0 h ALA 83 CO -0.21 0.66 -0.27 1.28 0.00 0.00 0.00 179.25 180.71 2pi0 n LEU 84 N -3.90 0.46 -0.02 0.00 4.77 -0.87 -4.71 117.00 112.72 2pi0 n LEU 84 Ca -0.01 0.08 -0.09 0.00 -0.03 0.00 0.00 56.01 55.95 2pi0 n LEU 84 Cb 0.54 -0.27 -0.02 0.00 -2.33 0.00 0.00 43.42 41.33 2pi0 n LEU 84 CO 0.41 0.10 0.74 -1.13 -1.33 0.00 0.00 177.39 176.18 2pi0 h ASN 85 N 0.29 -0.55 -2.23 -1.43 -1.24 -0.20 -3.26 115.58 106.95 2pi0 h ASN 85 Ca 0.00 0.10 -0.58 0.00 0.71 0.00 0.00 56.30 56.53 2pi0 h ASN 85 Cb 0.47 0.26 -0.39 0.00 0.73 0.00 0.00 38.32 39.39 2pi0 h ASN 85 CO 0.00 -0.22 -0.97 0.54 -1.29 0.00 0.00 177.43 175.49 2pi0 n ARG 86 N -5.32 0.76 -3.69 6.67 5.12 -1.26 -5.07 116.66 113.86 2pi0 n ARG 86 Ca -0.02 -3.43 -0.38 0.00 -1.93 0.00 0.00 57.85 52.09 2pi0 n ARG 86 Cb 0.24 -1.56 -0.12 0.00 -1.16 0.00 0.00 32.46 29.86 2pi0 n ARG 86 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2pi0 s LYS 87 N -0.85 3.41 0.20 5.56 -0.14 -1.23 -5.05 119.74 121.63 2pi0 s LYS 87 Ca 0.34 -0.66 -0.32 0.00 -1.36 0.00 0.00 55.97 53.97 2pi0 s LYS 87 Cb 0.10 -3.48 -0.12 0.00 -1.68 0.00 0.00 37.83 32.66 2pi0 s LYS 87 CO -0.14 -0.35 1.70 -1.83 -0.76 0.00 0.00 175.35 173.97 2pi0 s GLU 88 N 1.60 4.14 0.00 1.68 -1.05 -1.26 -2.40 118.70 121.41 2pi0 s GLU 88 Ca 0.05 2.58 0.00 0.00 -0.15 0.00 0.00 54.97 57.44 2pi0 s GLU 88 Cb -0.17 -3.08 0.00 0.00 -0.44 0.00 0.00 34.13 30.44 2pi0 s GLU 88 CO 0.05 -0.73 0.00 0.41 0.95 0.00 0.00 175.26 175.94 2pi0 n GLY 89 N 3.94 1.42 3.10 -3.83 0.00 -1.26 -5.03 105.19 103.54 2pi0 n GLY 89 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 2pi0 n GLY 89 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2pi0 s LEU 90 N 0.00 1.90 0.08 0.99 2.96 -1.01 -0.73 118.68 122.88 2pi0 s LEU 90 Ca 0.00 -0.30 0.06 0.00 -0.22 0.00 0.00 54.13 53.66 2pi0 s LEU 90 Cb 0.00 -0.85 -0.03 0.00 0.50 0.00 0.00 46.19 45.81 2pi0 s LEU 90 CO 0.00 0.14 -0.16 0.00 -1.32 0.00 0.00 176.35 175.01 2pi0 s ARG 91 N 0.01 0.90 -0.48 1.98 1.70 -0.41 -4.60 118.95 118.05 2pi0 s ARG 91 Ca -0.02 -1.02 -0.28 0.00 -0.47 0.00 0.00 55.73 53.94 2pi0 s ARG 91 Cb -0.10 -0.95 0.03 0.00 -0.57 0.00 0.00 34.95 33.36 2pi0 s ARG 91 CO 0.01 0.21 1.08 -1.17 -1.08 0.00 0.00 175.30 174.36 2pi0 s LEU 92 N -1.82 3.73 0.32 -1.89 2.96 -1.26 -1.44 118.68 119.27 2pi0 s LEU 92 Ca 0.00 0.34 0.25 0.00 -0.22 0.00 0.00 54.13 54.51 2pi0 s LEU 92 Cb -0.10 -3.43 0.67 0.00 0.50 0.00 0.00 46.19 43.83 2pi0 s LEU 92 CO 0.03 -1.22 1.72 0.00 -1.32 0.00 0.00 176.35 175.56 2pi0 h ALA 93 N 9.21 1.00 -0.74 5.97 0.00 -0.63 -3.47 119.26 130.61 2pi0 h ALA 93 Ca -0.23 0.00 0.20 0.00 0.00 0.00 0.00 54.91 54.88 2pi0 h ALA 93 Cb 1.06 0.00 -0.26 0.00 0.00 0.00 0.00 17.79 18.59 2pi0 h ALA 93 CO 1.11 0.00 0.39 -2.00 0.00 0.00 0.00 179.25 178.75 2pi0 s GLU 94 N -3.19 0.19 -0.42 0.00 2.12 -1.12 -4.96 118.70 111.32 2pi0 s GLU 94 Ca 0.08 0.44 -0.10 0.00 0.36 0.00 0.00 54.97 55.76 2pi0 s GLU 94 Cb 0.09 0.24 0.08 0.00 0.26 0.00 0.00 34.13 34.80 2pi0 s GLU 94 CO 0.61 -0.06 0.27 0.34 -0.54 0.00 0.00 175.26 175.88 2pi0 s ASP 95 N 2.10 5.69 -0.24 -1.70 3.68 -1.26 -0.91 116.67 124.02 2pi0 s ASP 95 Ca -0.02 -1.50 0.10 0.00 2.13 0.00 0.00 52.55 53.26 2pi0 s ASP 95 Cb -0.04 -2.01 0.46 0.00 -1.45 0.00 0.00 42.92 39.89 2pi0 s ASP 95 CO -0.16 -0.55 1.33 0.54 0.13 0.00 0.00 175.17 176.46 2pi0 n ARG 96 N 4.94 1.71 0.07 4.34 1.74 -0.63 -4.69 116.66 124.14 2pi0 n ARG 96 Ca -0.10 -3.23 0.07 0.00 -0.77 0.00 0.00 57.85 53.82 2pi0 n ARG 96 Cb 0.43 -1.71 0.33 0.00 -1.02 0.00 0.00 32.46 30.49 2pi0 n ARG 96 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2pi0 n SER 97 N -1.12 0.28 0.02 0.55 3.41 -0.80 -1.78 113.62 114.17 2pi0 n SER 97 Ca 0.25 0.60 0.11 0.00 -0.26 0.00 0.00 58.87 59.58 2pi0 n SER 97 Cb 0.85 -0.65 0.12 0.00 -0.26 0.00 0.00 64.21 64.27 2pi0 n SER 97 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2pi0 n LYS 98 N -1.84 0.13 -1.73 4.33 5.02 -1.26 -4.59 118.16 118.22 2pi0 n LYS 98 Ca 0.01 0.01 -0.42 0.00 -2.02 0.00 0.00 58.31 55.89 2pi0 n LYS 98 Cb 0.10 -1.55 -0.02 0.00 -0.02 0.00 0.00 35.03 33.54 2pi0 n LYS 98 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2pi0 n ASP 99 N -1.73 3.88 -0.30 4.39 9.92 -1.00 -4.89 116.55 126.84 2pi0 n ASP 99 Ca 0.04 1.11 0.05 0.00 -0.53 0.00 0.00 54.79 55.46 2pi0 n ASP 99 Cb 0.38 -1.58 0.26 0.00 -0.64 0.00 0.00 41.12 39.54 2pi0 n ASP 99 CO 0.00 0.00 0.00 -0.65 0.13 0.00 0.00 177.20 176.68 2pi0 h PRO 100 N 5.65 0.95 0.00 -0.24 0.11 -1.93 -3.30 132.00 133.25 2pi0 h PRO 100 Ca -0.45 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2pi0 h PRO 100 Cb 1.22 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2pi0 h PRO 100 CO 0.86 0.63 0.00 0.72 -0.21 0.00 0.00 178.00 180.01 2pi0 n HIS 101 N -4.50 0.00 -3.68 0.65 8.25 -1.26 -4.75 115.22 109.93 2pi0 n HIS 101 Ca 0.14 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.31 2pi0 n HIS 101 Cb 0.23 -0.24 -0.12 0.00 1.12 0.00 0.00 29.99 30.97 2pi0 n HIS 101 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 2pi0 s ASP 102 N -2.43 3.44 0.06 0.41 1.47 -1.26 -5.08 116.67 113.28 2pi0 s ASP 102 Ca 0.00 -2.89 -0.31 0.00 1.18 0.00 0.00 52.55 50.54 2pi0 s ASP 102 Cb 0.00 -1.01 -0.07 0.00 -0.34 0.00 0.00 42.92 41.50 2pi0 s ASP 102 CO 0.00 -0.22 1.53 -2.16 0.68 0.00 0.00 175.17 175.00 2pi0 s PRO 103 N 0.03 4.24 0.24 2.11 0.04 -1.24 -4.84 135.00 135.58 2pi0 s PRO 103 Ca 0.21 2.18 -0.21 0.00 0.04 0.00 0.00 61.00 63.22 2pi0 s PRO 103 Cb -0.16 -3.50 0.03 0.00 0.04 0.00 0.00 34.50 30.91 2pi0 s PRO 103 CO -0.06 -0.63 0.67 -3.38 0.04 0.00 0.00 177.00 173.64 2pi0 s HIS 104 N 2.21 -0.27 0.11 0.56 -3.43 -0.74 -1.65 115.29 112.09 2pi0 s HIS 104 Ca 0.69 -0.12 0.09 0.00 -0.80 0.00 0.00 55.06 54.92 2pi0 s HIS 104 Cb -0.37 0.64 -0.04 0.00 -1.43 0.00 0.00 32.58 31.39 2pi0 s HIS 104 CO 0.30 -1.12 -0.23 0.15 -2.00 0.00 0.00 174.74 171.85 2pi0 s LYS 105 N -3.87 1.22 -0.15 -0.38 1.02 -0.44 -1.60 119.74 115.54 2pi0 s LYS 105 Ca 0.09 -1.21 -0.03 0.00 0.02 0.00 0.00 55.97 54.83 2pi0 s LYS 105 Cb -0.04 -1.56 -0.03 0.00 -0.52 0.00 0.00 37.83 35.68 2pi0 s LYS 105 CO 0.01 0.37 -0.03 0.42 -0.92 0.00 0.00 175.35 175.20 2pi0 s ILE 106 N -1.12 3.96 0.15 2.17 -1.09 -0.09 -1.46 121.20 123.73 2pi0 s ILE 106 Ca 0.09 -0.34 0.09 0.00 -2.23 0.00 0.00 60.65 58.26 2pi0 s ILE 106 Cb -0.10 -2.73 -0.04 0.00 -1.58 0.00 0.00 42.46 38.01 2pi0 s ILE 106 CO 0.05 0.51 -0.21 -0.31 -1.23 0.00 0.00 174.94 173.74 2pi0 s TYR 107 N 0.20 1.94 0.01 3.97 1.51 -0.62 0.14 117.35 124.50 2pi0 s TYR 107 Ca -0.02 -0.42 0.01 0.00 -1.01 0.00 0.00 57.07 55.63 2pi0 s TYR 107 Cb -0.14 -1.01 -0.01 0.00 -0.11 0.00 0.00 41.96 40.70 2pi0 s TYR 107 CO 0.03 0.32 -0.05 -2.00 -1.11 0.00 0.00 175.55 172.74 2pi0 s GLU 108 N -2.41 0.38 -0.05 -0.62 2.12 -0.52 -1.83 118.70 115.78 2pi0 s GLU 108 Ca 0.13 -0.34 -0.26 0.00 0.36 0.00 0.00 54.97 54.86 2pi0 s GLU 108 Cb -0.08 -0.28 -0.03 0.00 0.26 0.00 0.00 34.13 33.99 2pi0 s GLU 108 CO 0.06 0.07 0.83 -0.06 -0.54 0.00 0.00 175.26 175.62 2pi0 s PHE 109 N -0.54 3.60 0.00 5.30 0.08 -0.80 -1.29 117.98 124.34 2pi0 s PHE 109 Ca -0.03 1.44 0.00 0.00 0.12 0.00 0.00 56.93 58.46 2pi0 s PHE 109 Cb -0.04 -2.95 0.00 0.00 -0.57 0.00 0.00 43.02 39.46 2pi0 s PHE 109 CO -0.00 0.03 0.34 1.33 -0.10 0.00 0.00 175.22 176.82