#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vph s HIS -5 N 0.00 2.59 0.54 9.51 4.02 -1.26 -5.01 115.29 125.68 1vph s HIS -5 Ca 0.00 -0.57 -0.19 0.00 1.02 0.00 0.00 55.06 55.31 1vph s HIS -5 Cb 0.00 -4.47 -0.06 0.00 -1.02 0.00 0.00 32.58 27.03 1vph s HIS -5 CO 0.00 -1.81 1.11 -1.01 1.02 0.00 0.00 174.74 174.04 1vph s HIS -4 N 4.55 2.74 0.00 1.40 0.09 -1.26 -4.99 115.29 117.83 1vph s HIS -4 Ca 0.32 1.55 0.00 0.00 -0.00 0.00 0.00 55.06 56.93 1vph s HIS -4 Cb -0.09 -3.24 0.00 0.00 -0.00 0.00 0.00 32.58 29.25 1vph s HIS -4 CO 0.05 -1.42 0.49 0.72 -0.00 0.00 0.00 174.74 174.57 1vph n HIS -3 N -1.27 0.00 -4.24 1.40 -0.00 -1.26 -5.04 115.22 104.80 1vph n HIS -3 Ca 0.11 -0.02 -0.16 0.00 -0.00 0.00 0.00 57.72 57.65 1vph n HIS -3 Cb 0.51 -0.00 -0.11 0.00 -0.00 0.00 0.00 29.99 30.39 1vph n HIS -3 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 1vph s HIS -2 N -0.04 1.33 0.36 4.41 4.02 -1.26 -5.11 115.29 119.01 1vph s HIS -2 Ca 0.00 -0.63 -0.28 0.00 1.02 0.00 0.00 55.06 55.17 1vph s HIS -2 Cb 0.00 -0.69 -0.12 0.00 -1.02 0.00 0.00 32.58 30.76 1vph s HIS -2 CO 0.00 0.12 1.35 0.72 1.02 0.00 0.00 174.74 177.95 1vph n HIS -1 N 0.24 2.49 -3.70 1.40 8.25 -1.26 -4.99 115.22 117.64 1vph n HIS -1 Ca -0.13 0.51 -0.11 0.00 -0.26 0.00 0.00 57.72 57.73 1vph n HIS -1 Cb 0.58 -2.45 -0.06 0.00 1.12 0.00 0.00 29.99 29.19 1vph n HIS -1 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 1vph s HIS 0 N -1.12 -0.14 -0.12 4.41 -0.00 -1.26 -5.14 115.29 111.93 1vph s HIS 0 Ca 0.56 -0.09 -0.30 0.00 -0.00 0.00 0.00 55.06 55.23 1vph s HIS 0 Cb -0.53 0.16 -0.01 0.00 -0.00 0.00 0.00 32.58 32.20 1vph s HIS 0 CO 0.62 -0.60 1.07 1.41 -0.00 0.00 0.00 174.74 177.24 1vph s MET 1 N -3.22 4.37 -0.11 -0.38 0.00 -1.26 -4.56 119.30 114.13 1vph s MET 1 Ca -0.00 1.47 -0.04 0.00 0.00 0.00 0.00 55.69 57.11 1vph s MET 1 Cb 0.01 -3.57 -0.04 0.00 0.00 0.00 0.00 34.83 31.23 1vph s MET 1 CO -0.08 -0.42 0.05 0.15 0.00 0.00 0.00 175.02 174.72 1vph s LYS 2 N 2.34 3.27 -0.09 4.11 1.02 0.11 -4.96 119.74 125.55 1vph s LYS 2 Ca 0.50 -0.32 0.02 0.00 0.02 0.00 0.00 55.97 56.18 1vph s LYS 2 Cb -0.19 -2.97 0.02 0.00 -0.52 0.00 0.00 37.83 34.17 1vph s LYS 2 CO 0.17 0.65 -0.12 0.08 -0.92 0.00 0.00 175.35 175.21 1vph s VAL 3 N -0.71 1.19 -0.04 3.17 1.01 -1.26 -1.32 120.40 122.45 1vph s VAL 3 Ca 0.12 -0.47 0.03 0.00 0.00 0.00 0.00 61.98 61.66 1vph s VAL 3 Cb -0.12 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.15 1vph s VAL 3 CO 0.02 0.38 -0.12 -0.47 0.00 0.00 0.00 175.10 174.91 1vph s TYR 4 N 0.98 1.23 -0.01 5.22 5.04 0.42 -4.98 117.35 125.25 1vph s TYR 4 Ca -0.08 -0.34 0.08 0.00 -2.44 0.00 0.00 57.07 54.28 1vph s TYR 4 Cb -0.15 -0.87 -0.02 0.00 0.35 0.00 0.00 41.96 41.27 1vph s TYR 4 CO -0.00 -0.14 -0.24 -0.06 -1.34 0.00 0.00 175.55 173.76 1vph s PHE 5 N 0.22 2.39 0.32 4.97 0.08 -1.26 -0.32 117.98 124.38 1vph s PHE 5 Ca -0.05 -0.39 -0.04 0.00 0.12 0.00 0.00 56.93 56.57 1vph s PHE 5 Cb -0.10 -1.50 -0.00 0.00 -0.57 0.00 0.00 43.02 40.85 1vph s PHE 5 CO 0.01 0.03 0.45 0.34 -0.10 0.00 0.00 175.22 175.95 1vph s ASP 6 N -0.77 0.71 -0.00 1.36 -1.08 -0.14 -5.01 116.67 111.74 1vph s ASP 6 Ca 0.11 -1.39 0.01 0.00 -0.52 0.00 0.00 52.55 50.75 1vph s ASP 6 Cb -0.10 0.63 -0.00 0.00 -1.46 0.00 0.00 42.92 41.99 1vph s ASP 6 CO -0.00 -1.24 -0.03 -1.81 0.52 0.00 0.00 175.17 172.61 1vph s ASP 7 N -3.20 0.40 -0.07 -0.34 1.11 -1.26 -0.57 116.67 112.74 1vph s ASP 7 Ca 0.30 -0.08 0.05 0.00 0.18 0.00 0.00 52.55 53.00 1vph s ASP 7 Cb 0.00 -0.04 -0.00 0.00 1.07 0.00 0.00 42.92 43.95 1vph s ASP 7 CO 0.18 0.03 -0.23 -0.63 1.18 0.00 0.00 175.17 175.70 1vph s ILE 8 N -0.14 1.89 -0.05 0.77 1.01 0.31 -4.98 121.20 120.01 1vph s ILE 8 Ca 0.01 -0.95 0.02 0.00 0.00 0.00 0.00 60.65 59.73 1vph s ILE 8 Cb -0.02 -1.61 -0.03 0.00 0.01 0.00 0.00 42.46 40.81 1vph s ILE 8 CO -0.00 0.53 -0.10 -0.31 0.00 0.00 0.00 174.94 175.06 1vph s TYR 9 N 0.07 2.84 -0.03 3.97 2.02 -1.26 -0.47 117.35 124.49 1vph s TYR 9 Ca -0.09 -0.06 0.01 0.00 -0.37 0.00 0.00 57.07 56.57 1vph s TYR 9 Cb -0.15 -1.66 0.02 0.00 -0.40 0.00 0.00 41.96 39.77 1vph s TYR 9 CO 0.05 0.29 -0.03 0.08 -1.57 0.00 0.00 175.55 174.36 1vph s VAL 10 N -0.81 0.37 -0.19 0.71 1.01 0.41 -4.97 120.40 116.94 1vph s VAL 10 Ca 0.13 -0.07 -0.13 0.00 0.00 0.00 0.00 61.98 61.91 1vph s VAL 10 Cb -0.11 -0.40 -0.05 0.00 0.00 0.00 0.00 36.38 35.82 1vph s VAL 10 CO 0.02 0.17 0.25 -0.55 0.00 0.00 0.00 175.10 174.99 1vph s SER 11 N 0.68 6.34 -0.04 3.32 0.15 -1.26 -0.07 113.70 122.82 1vph s SER 11 Ca -0.08 0.38 -0.00 0.00 0.70 0.00 0.00 55.95 56.95 1vph s SER 11 Cb -0.11 -2.16 -0.03 0.00 -1.71 0.00 0.00 66.02 62.01 1vph s SER 11 CO -0.01 0.08 0.01 0.42 1.20 0.00 0.00 173.24 174.94 1vph s THR 12 N 0.68 4.28 -0.16 6.45 -4.23 0.85 -4.97 115.64 118.54 1vph s THR 12 Ca 0.14 -0.40 0.17 0.00 -1.18 0.00 0.00 61.69 60.41 1vph s THR 12 Cb -0.13 -2.86 -0.24 0.00 1.34 0.00 0.00 72.50 70.61 1vph s THR 12 CO 0.03 0.49 0.12 0.00 -0.54 0.00 0.00 174.62 174.73 1vph n ALA 13 N 1.76 1.73 -2.52 3.99 0.00 -1.26 -2.48 120.51 121.72 1vph n ALA 13 Ca -0.16 -1.11 -0.25 0.00 0.00 0.00 0.00 53.44 51.91 1vph n ALA 13 Cb 0.53 -0.23 -0.10 0.00 0.00 0.00 0.00 19.45 19.65 1vph n ALA 13 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1vph s ARG 14 N -2.60 1.83 0.10 0.00 3.00 -1.26 -4.44 118.95 115.57 1vph s ARG 14 Ca -0.09 -1.84 -0.24 0.00 0.00 0.00 0.00 55.73 53.56 1vph s ARG 14 Cb 0.07 -1.77 -0.13 0.00 0.00 0.00 0.00 34.95 33.11 1vph s ARG 14 CO 0.77 0.21 1.71 0.37 0.00 0.00 0.00 175.30 178.37 1vph h GLN 15 N 2.07 -0.14 -5.21 3.54 4.15 -1.93 -3.27 115.11 114.32 1vph h GLN 15 Ca -0.42 0.01 -0.65 0.00 0.77 0.00 0.00 58.65 58.37 1vph h GLN 15 Cb 1.25 0.03 -0.24 0.00 0.21 0.00 0.00 27.48 28.73 1vph h GLN 15 CO 0.66 -0.09 -0.70 -0.06 -1.93 0.00 0.00 178.83 176.71 1vph s PHE 16 N -6.17 2.96 -0.17 3.99 0.40 -1.26 -1.02 117.98 116.71 1vph s PHE 16 Ca -0.14 -0.54 -0.22 0.00 -0.60 0.00 0.00 56.93 55.42 1vph s PHE 16 Cb 0.06 -1.99 0.06 0.00 0.51 0.00 0.00 43.02 41.67 1vph s PHE 16 CO 0.66 -0.22 0.59 -2.00 0.70 0.00 0.00 175.22 174.95 1vph s GLU 17 N 0.71 0.77 -0.14 0.44 2.12 -0.56 -4.99 118.70 117.05 1vph s GLU 17 Ca -0.03 0.64 -0.03 0.00 0.36 0.00 0.00 54.97 55.92 1vph s GLU 17 Cb -0.15 0.37 -0.03 0.00 0.26 0.00 0.00 34.13 34.59 1vph s GLU 17 CO 0.02 -0.14 -0.06 -0.51 -0.54 0.00 0.00 175.26 174.03 1vph s LEU 18 N -0.11 3.14 -0.17 2.70 1.43 -1.26 -0.26 118.68 124.15 1vph s LEU 18 Ca -0.03 -0.15 0.01 0.00 -1.03 0.00 0.00 54.13 52.92 1vph s LEU 18 Cb -0.03 -1.74 0.02 0.00 0.03 0.00 0.00 46.19 44.47 1vph s LEU 18 CO 0.03 0.19 -0.17 -0.69 0.23 0.00 0.00 176.35 175.94 1vph s VAL 19 N 0.23 1.83 -0.10 -1.59 1.01 -0.19 -4.97 120.40 116.63 1vph s VAL 19 Ca -0.04 -0.85 -0.30 0.00 0.00 0.00 0.00 61.98 60.80 1vph s VAL 19 Cb -0.14 -1.71 -0.03 0.00 0.00 0.00 0.00 36.38 34.50 1vph s VAL 19 CO 0.03 0.46 1.34 -0.62 0.00 0.00 0.00 175.10 176.31 1vph s ASP 20 N 1.37 6.90 -0.02 3.32 -1.08 -1.26 -1.19 116.67 124.72 1vph s ASP 20 Ca 0.04 1.88 0.03 0.00 -0.52 0.00 0.00 52.55 53.97 1vph s ASP 20 Cb -0.13 -2.54 0.04 0.00 -1.46 0.00 0.00 42.92 38.82 1vph s ASP 20 CO -0.11 -0.75 1.02 2.30 0.52 0.00 0.00 175.17 178.15 1vph n ILE 21 N 5.12 1.12 -0.10 4.11 -5.35 0.20 -4.84 119.36 119.62 1vph n ILE 21 Ca 0.14 -1.17 -0.06 0.00 -0.27 0.00 0.00 62.75 61.39 1vph n ILE 21 Cb 0.45 0.40 0.01 0.00 -1.74 0.00 0.00 39.64 38.76 1vph n ILE 21 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1vph h THR 22 N 0.03 0.73 -0.30 7.28 2.02 -1.89 -0.93 112.91 119.85 1vph h THR 22 Ca 0.00 -0.03 -0.08 0.00 0.77 0.00 0.00 66.41 67.07 1vph h THR 22 Cb 0.57 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 1vph h THR 22 CO 0.00 0.02 -0.14 0.44 0.37 0.00 0.00 175.52 176.20 1vph h ASP 23 N 0.09 0.51 -0.33 4.18 3.32 -1.93 -0.19 116.42 122.07 1vph h ASP 23 Ca 0.17 -0.14 -0.10 0.00 0.02 0.00 0.00 57.03 56.98 1vph h ASP 23 Cb 0.24 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 1vph h ASP 23 CO -0.29 0.69 -0.17 -0.61 -1.72 0.00 0.00 179.24 177.13 1vph h GLN 24 N 0.48 0.71 -0.34 3.56 5.75 -1.80 0.10 115.11 123.57 1vph h GLN 24 Ca 0.09 -0.31 -0.01 0.00 -0.15 0.00 0.00 58.65 58.27 1vph h GLN 24 Cb 0.54 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.05 1vph h GLN 24 CO 0.03 0.92 0.19 0.28 -2.65 0.00 0.00 178.83 177.60 1vph h VAL 25 N 0.48 1.13 -0.70 2.39 2.07 -0.80 -2.42 116.25 118.40 1vph h VAL 25 Ca 0.07 -0.34 0.02 0.00 0.82 0.00 0.00 66.70 67.27 1vph h VAL 25 Cb 0.71 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 1vph h VAL 25 CO 0.05 0.14 0.45 -0.33 0.02 0.00 0.00 177.57 177.89 1vph h GLU 26 N 0.43 0.86 -0.83 1.57 4.39 -0.88 0.05 114.58 120.17 1vph h GLU 26 Ca 0.12 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.76 1vph h GLU 26 Cb 0.05 -0.19 -0.04 0.00 -0.10 0.00 0.00 28.75 28.46 1vph h GLU 26 CO -0.02 0.57 0.47 -0.56 -1.16 0.00 0.00 179.01 178.31 1vph h GLN 27 N 0.89 1.15 -0.40 2.33 -0.00 -0.77 -0.91 115.11 117.39 1vph h GLN 27 Ca 0.27 -0.12 -0.12 0.00 -0.00 0.00 0.00 58.65 58.68 1vph h GLN 27 Cb -0.03 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.48 27.20 1vph h GLN 27 CO -0.09 0.83 -0.20 0.82 -0.00 0.00 0.00 178.83 180.19 1vph h ILE 28 N 1.16 1.28 -0.51 1.86 2.04 -0.91 0.13 117.51 122.55 1vph h ILE 28 Ca 0.30 -1.34 0.07 0.00 1.00 0.00 0.00 64.86 64.89 1vph h ILE 28 Cb 0.00 1.28 -0.06 0.00 -0.74 0.00 0.00 36.82 37.30 1vph h ILE 28 CO -0.05 0.45 0.17 0.58 0.00 0.00 0.00 178.15 179.30 1vph h VAL 29 N 0.66 0.81 -0.56 1.67 2.07 -0.70 -0.59 116.25 119.61 1vph h VAL 29 Ca 0.09 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 1vph h VAL 29 Cb 0.76 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1vph h VAL 29 CO 0.06 0.06 0.28 -0.33 0.02 0.00 0.00 177.57 177.66 1vph h GLU 30 N 0.34 0.80 -0.27 1.57 5.08 -0.80 -2.85 114.58 118.45 1vph h GLU 30 Ca 0.25 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1vph h GLU 30 Cb 0.28 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1vph h GLU 30 CO -0.26 0.64 0.07 -0.22 -1.00 0.00 0.00 179.01 178.24 1vph h LYS 31 N 0.76 0.38 -0.19 2.33 1.63 -0.28 -2.86 116.57 118.34 1vph h LYS 31 Ca 0.19 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.95 1vph h LYS 31 Cb 0.10 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.65 1vph h LYS 31 CO -0.03 0.36 0.13 0.66 -3.45 0.00 0.00 179.45 177.12 1vph h SER 32 N 0.38 0.21 0.00 4.20 4.64 -0.87 -3.46 113.55 118.65 1vph h SER 32 Ca 0.09 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1vph h SER 32 Cb 0.15 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1vph h SER 32 CO -0.00 0.15 0.00 0.61 -0.87 0.00 0.00 176.83 176.72 1vph n GLY 33 N -1.51 0.75 3.73 -0.77 0.00 -1.08 -5.00 105.19 101.31 1vph n GLY 33 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1vph n GLY 33 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vph s ILE 34 N -2.98 4.14 -0.21 -0.61 1.01 -1.26 -4.96 121.20 116.33 1vph s ILE 34 Ca 0.00 1.83 0.01 0.00 0.00 0.00 0.00 60.65 62.50 1vph s ILE 34 Cb 0.00 -4.17 -0.20 0.00 0.01 0.00 0.00 42.46 38.10 1vph s ILE 34 CO 0.00 0.31 -0.03 0.29 0.00 0.00 0.00 174.94 175.51 1vph n LYS 35 N 2.51 0.68 -3.74 2.79 4.76 0.99 -4.62 118.16 121.53 1vph n LYS 35 Ca 0.02 0.17 -0.22 0.00 -2.87 0.00 0.00 58.31 55.41 1vph n LYS 35 Cb 0.47 -1.58 -0.18 0.00 -1.84 0.00 0.00 35.03 31.91 1vph n LYS 35 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1vph s ASN 36 N -6.55 1.55 0.00 4.39 0.01 -0.46 -0.45 114.94 113.43 1vph s ASN 36 Ca -0.29 -0.09 0.00 0.00 -0.71 0.00 0.00 52.86 51.77 1vph s ASN 36 Cb 0.08 -0.36 0.00 0.00 0.41 0.00 0.00 41.25 41.38 1vph s ASN 36 CO 0.67 -0.22 0.00 0.61 -1.51 0.00 0.00 177.10 176.65 1vph n GLY 37 N 5.19 -0.79 3.22 0.66 0.00 0.06 -1.19 105.19 112.33 1vph n GLY 37 Ca -0.06 -0.27 -0.15 0.00 0.00 0.00 0.00 46.02 45.54 1vph n GLY 37 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1vph s ILE 38 N -4.00 1.11 -0.18 -0.61 -4.36 0.00 -0.93 121.20 112.23 1vph s ILE 38 Ca 0.00 -1.79 0.00 0.00 -0.26 0.00 0.00 60.65 58.60 1vph s ILE 38 Cb 0.00 -1.56 0.04 0.00 1.25 0.00 0.00 42.46 42.19 1vph s ILE 38 CO 0.00 -0.58 -0.10 0.00 0.24 0.00 0.00 174.94 174.50 1vph s LEU 40 N 1.48 4.16 -0.22 0.00 2.96 0.03 -0.27 118.68 126.82 1vph s LEU 40 Ca 0.01 0.53 0.00 0.00 -0.22 0.00 0.00 54.13 54.45 1vph s LEU 40 Cb -0.15 -2.53 0.03 0.00 0.50 0.00 0.00 46.19 44.04 1vph s LEU 40 CO -0.09 -0.08 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.10 1vph s ILE 41 N 1.33 2.43 -0.02 6.68 1.09 -0.42 -0.81 121.20 131.47 1vph s ILE 41 Ca 0.19 -1.08 0.00 0.00 -1.10 0.00 0.00 60.65 58.67 1vph s ILE 41 Cb -0.15 -2.18 0.02 0.00 -1.06 0.00 0.00 42.46 39.09 1vph s ILE 41 CO 0.08 0.31 -0.00 0.12 -0.10 0.00 0.00 174.94 175.35 1vph s PHE 42 N 1.27 0.22 -0.15 3.97 5.36 -0.31 -1.32 117.98 127.02 1vph s PHE 42 Ca 0.01 0.01 -0.03 0.00 -0.96 0.00 0.00 56.93 55.96 1vph s PHE 42 Cb -0.16 -0.28 -0.02 0.00 -0.34 0.00 0.00 43.02 42.22 1vph s PHE 42 CO -0.08 -0.08 -0.05 0.14 -1.46 0.00 0.00 175.22 173.69 1vph s VAL 43 N 0.67 3.73 -0.54 3.12 -7.23 -0.00 0.01 120.40 120.17 1vph s VAL 43 Ca -0.06 -0.41 -0.04 0.00 -1.81 0.00 0.00 61.98 59.65 1vph s VAL 43 Cb -0.09 -2.63 0.03 0.00 0.56 0.00 0.00 36.38 34.25 1vph s VAL 43 CO -0.01 0.50 2.83 0.00 -0.31 0.00 0.00 175.10 178.10 1vph n ALA 44 N 3.54 6.52 -2.87 1.32 0.00 -1.25 -4.83 120.51 122.94 1vph n ALA 44 Ca -0.17 -3.06 -0.12 0.00 0.00 0.00 0.00 53.44 50.08 1vph n ALA 44 Cb 0.52 -2.27 -0.13 0.00 0.00 0.00 0.00 19.45 17.58 1vph n ALA 44 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1vph s HIS 45 N -1.26 0.35 -2.80 0.00 3.76 -1.26 -5.03 115.29 109.05 1vph s HIS 45 Ca 0.59 -0.28 0.23 0.00 -0.15 0.00 0.00 55.06 55.46 1vph s HIS 45 Cb 0.35 -0.22 0.15 0.00 1.11 0.00 0.00 32.58 33.97 1vph s HIS 45 CO -0.18 -0.07 1.22 -1.13 -0.85 0.00 0.00 174.74 173.73 1vph n SER 46 N 2.27 2.81 -0.16 1.40 3.41 -1.26 -4.31 113.62 117.78 1vph n SER 46 Ca -0.18 -1.91 0.05 0.00 -0.26 0.00 0.00 58.87 56.58 1vph n SER 46 Cb 0.57 0.08 0.08 0.00 -0.26 0.00 0.00 64.21 64.67 1vph n SER 46 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1vph n THR 47 N 1.11 1.18 -4.26 6.66 -2.24 -1.26 -4.13 114.28 111.33 1vph n THR 47 Ca 0.13 -1.38 -0.14 0.00 -2.27 0.00 0.00 64.05 60.38 1vph n THR 47 Cb 0.57 0.13 -0.10 0.00 -2.10 0.00 0.00 70.33 68.83 1vph n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vph s ALA 48 N -1.72 1.47 0.27 6.98 0.00 -1.26 -2.54 121.76 124.97 1vph s ALA 48 Ca 0.17 -1.63 -0.03 0.00 0.00 0.00 0.00 51.96 50.47 1vph s ALA 48 Cb 0.15 0.53 -0.02 0.00 0.00 0.00 0.00 23.12 23.79 1vph s ALA 48 CO 0.02 -0.30 0.33 0.00 0.00 0.00 0.00 175.76 175.81 1vph s ALA 49 N -3.60 0.83 -0.11 0.00 0.00 -0.33 -4.72 121.76 113.84 1vph s ALA 49 Ca 0.25 -1.52 0.02 0.00 0.00 0.00 0.00 51.96 50.72 1vph s ALA 49 Cb 0.06 1.26 0.01 0.00 0.00 0.00 0.00 23.12 24.45 1vph s ALA 49 CO 0.05 -0.72 -0.18 0.42 0.00 0.00 0.00 175.76 175.33 1vph s ILE 50 N -3.70 1.66 0.32 0.00 -1.09 -0.98 -0.07 121.20 117.34 1vph s ILE 50 Ca 0.33 -0.75 0.03 0.00 -2.23 0.00 0.00 60.65 58.03 1vph s ILE 50 Cb 0.02 -1.48 -0.05 0.00 -1.58 0.00 0.00 42.46 39.37 1vph s ILE 50 CO 0.16 0.47 0.10 0.68 -1.23 0.00 0.00 174.94 175.12 1vph s VAL 51 N 0.79 0.75 -0.05 2.92 -7.23 -0.55 -4.58 120.40 112.46 1vph s VAL 51 Ca -0.10 -2.00 -0.00 0.00 -1.81 0.00 0.00 61.98 58.07 1vph s VAL 51 Cb -0.16 -2.61 0.03 0.00 0.56 0.00 0.00 36.38 34.20 1vph s VAL 51 CO 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.80 1vph s ALA 52 N -3.46 0.48 0.00 1.32 0.00 -1.26 -0.83 121.76 118.01 1vph s ALA 52 Ca 0.34 0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.34 1vph s ALA 52 Cb 0.07 -0.51 0.00 0.00 0.00 0.00 0.00 23.12 22.68 1vph s ALA 52 CO 0.15 -0.24 0.00 -1.71 0.00 0.00 0.00 175.76 173.96 1vph n ASN 53 N 4.59 0.00 -4.73 0.00 2.85 0.36 -4.84 115.26 113.49 1vph n ASN 53 Ca -0.17 -0.75 -0.40 0.00 -0.11 0.00 0.00 54.58 53.14 1vph n ASN 53 Cb 0.50 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.48 1vph n ASN 53 CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 1vph s GLU 54 N -1.25 4.54 -1.02 1.20 2.12 -0.91 0.79 118.70 124.17 1vph s GLU 54 Ca 0.00 1.17 -0.23 0.00 0.36 0.00 0.00 54.97 56.28 1vph s GLU 54 Cb 0.00 -3.40 0.06 0.00 0.26 0.00 0.00 34.13 31.05 1vph s GLU 54 CO 0.00 0.17 1.43 -1.58 -0.54 0.00 0.00 175.26 174.74 1vph s HIS 55 N 0.31 2.58 -0.02 5.30 5.65 -1.26 -4.70 115.29 123.15 1vph s HIS 55 Ca 0.43 -0.90 0.01 0.00 0.25 0.00 0.00 55.06 54.84 1vph s HIS 55 Cb -0.21 -4.67 0.02 0.00 -1.18 0.00 0.00 32.58 26.54 1vph s HIS 55 CO 0.24 -1.90 -0.01 -2.00 -0.65 0.00 0.00 174.74 170.42 1vph s GLU 56 N 4.79 0.32 0.26 2.88 -6.30 -1.26 -5.07 118.70 114.32 1vph s GLU 56 Ca 0.45 0.02 -0.03 0.00 -2.50 0.00 0.00 54.97 52.91 1vph s GLU 56 Cb -0.00 -0.45 0.32 0.00 0.00 0.00 0.00 34.13 34.00 1vph s GLU 56 CO -0.10 -0.09 1.82 -0.09 0.02 0.00 0.00 175.26 176.82 1vph h ARG 57 N 6.99 0.96 -0.00 4.30 2.43 -1.99 -0.02 114.38 127.04 1vph h ARG 57 Ca -0.39 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 58.60 1vph h ARG 57 Cb 1.15 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 30.54 1vph h ARG 57 CO 0.48 0.82 -0.01 0.78 -1.51 0.00 0.00 179.97 180.53 1vph h GLY 58 N 1.04 -0.01 0.87 2.80 0.00 -1.98 -2.19 103.07 103.59 1vph h GLY 58 Ca 0.21 0.01 0.04 0.00 0.00 0.00 0.00 47.33 47.59 1vph h GLY 58 CO -0.01 -0.01 0.61 -2.00 0.00 0.00 0.00 176.54 175.13 1vph h LEU 59 N -0.02 1.01 -0.88 3.11 5.85 -1.76 0.00 115.31 122.62 1vph h LEU 59 Ca 0.01 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1vph h LEU 59 Cb 0.03 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.79 1vph h LEU 59 CO -0.01 0.69 0.50 0.24 -0.34 0.00 0.00 178.44 179.52 1vph h MET 60 N 1.18 1.22 -0.50 1.25 2.86 -0.81 0.20 114.93 120.33 1vph h MET 60 Ca 0.38 -0.13 -0.07 0.00 -2.06 0.00 0.00 59.70 57.82 1vph h MET 60 Cb 0.01 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.41 1vph h MET 60 CO -0.13 0.88 0.05 0.93 1.06 0.00 0.00 176.91 179.71 1vph h GLU 61 N 1.23 0.84 -0.21 1.72 5.08 -0.72 -2.58 114.58 119.94 1vph h GLU 61 Ca 0.31 -0.24 0.03 0.00 -1.00 0.00 0.00 59.36 58.46 1vph h GLU 61 Cb 0.00 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 1vph h GLU 61 CO -0.05 0.85 0.02 -0.44 -1.00 0.00 0.00 179.01 178.39 1vph h ASP 62 N 0.71 -0.04 -0.45 1.42 3.32 -0.27 -0.08 116.42 121.04 1vph h ASP 62 Ca 0.15 0.04 0.09 0.00 0.02 0.00 0.00 57.03 57.32 1vph h ASP 62 Cb 0.44 0.06 -0.08 0.00 0.22 0.00 0.00 39.33 39.97 1vph h ASP 62 CO 0.01 0.01 -0.04 0.40 -1.72 0.00 0.00 179.24 177.90 1vph h ILE 63 N 0.09 0.61 -0.10 0.35 2.04 -0.56 0.11 117.51 120.05 1vph h ILE 63 Ca 0.10 -0.02 -0.14 0.00 1.00 0.00 0.00 64.86 65.79 1vph h ILE 63 Cb 0.11 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 1vph h ILE 63 CO -0.15 0.01 -0.56 -0.07 0.00 0.00 0.00 178.15 177.38 1vph h LEU 64 N 0.06 0.35 -0.23 1.44 3.38 -1.21 -0.69 115.31 118.41 1vph h LEU 64 Ca 0.22 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1vph h LEU 64 Cb 0.33 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1vph h LEU 64 CO -0.41 0.84 0.02 0.74 0.09 0.00 0.00 178.44 179.73 1vph h THR 65 N 0.24 1.24 -0.44 0.22 2.02 -0.32 -0.64 112.91 115.23 1vph h THR 65 Ca 0.00 -0.81 -0.01 0.00 0.77 0.00 0.00 66.41 66.36 1vph h THR 65 Cb 1.06 1.32 -0.02 0.00 -1.74 0.00 0.00 68.15 68.77 1vph h THR 65 CO 0.09 0.25 0.23 0.50 0.37 0.00 0.00 175.52 176.96 1vph h LYS 66 N 0.18 0.62 -0.50 6.66 1.63 -0.64 -1.13 116.57 123.40 1vph h LYS 66 Ca 0.07 -0.08 0.03 0.00 -0.85 0.00 0.00 60.65 59.82 1vph h LYS 66 Cb 0.35 -0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 31.83 1vph h LYS 66 CO 0.01 0.51 0.28 0.82 -3.45 0.00 0.00 179.45 177.61 1vph h ILE 67 N 0.57 1.02 -0.38 2.00 2.04 -1.03 -0.90 117.51 120.83 1vph h ILE 67 Ca 0.15 -0.19 0.01 0.00 1.00 0.00 0.00 64.86 65.83 1vph h ILE 67 Cb 0.08 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 1vph h ILE 67 CO -0.02 0.10 0.23 0.50 0.00 0.00 0.00 178.15 178.96 1vph h LYS 68 N 0.56 0.45 -0.74 2.37 3.64 -0.91 -0.26 116.57 121.67 1vph h LYS 68 Ca 0.21 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1vph h LYS 68 Cb 0.05 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 1vph h LYS 68 CO -0.11 0.30 0.38 0.93 -2.27 0.00 0.00 179.45 178.67 1vph h GLU 69 N 0.46 1.06 -0.40 1.90 5.08 -0.99 -1.20 114.58 120.49 1vph h GLU 69 Ca 0.15 -0.14 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 1vph h GLU 69 Cb -0.01 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 1vph h GLU 69 CO -0.06 0.81 -0.23 0.35 -1.00 0.00 0.00 179.01 178.88 1vph h PHE 70 N 1.04 0.91 0.00 4.33 3.57 -0.88 -3.31 116.94 122.59 1vph h PHE 70 Ca 0.26 -0.21 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 1vph h PHE 70 Cb 0.09 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 1vph h PHE 70 CO 0.01 0.95 -1.25 0.25 -2.23 0.00 0.00 178.31 176.03 1vph n THR 71 N -4.11 0.65 -3.06 4.41 -2.24 -0.13 -5.04 114.28 104.76 1vph n THR 71 Ca 0.00 -0.57 -0.02 0.00 -2.27 0.00 0.00 64.05 61.18 1vph n THR 71 Cb 0.44 -0.36 0.01 0.00 -2.10 0.00 0.00 70.33 68.32 1vph n THR 71 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1vph n GLU 72 N -2.65 -1.44 0.11 -0.78 1.02 -0.46 -4.40 120.64 112.03 1vph n GLU 72 Ca -0.03 1.37 0.19 0.00 -0.02 0.00 0.00 57.16 58.67 1vph n GLU 72 Cb 0.62 -5.69 0.76 0.00 -0.02 0.00 0.00 31.44 27.11 1vph n GLU 72 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1vph h PRO 73 N 0.20 0.00 -0.00 3.49 0.11 -1.94 -1.44 132.00 132.41 1vph h PRO 73 Ca -0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.01 1vph h PRO 73 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1vph h PRO 73 CO 0.32 0.00 -0.24 0.43 -0.21 0.00 0.00 178.00 178.29 1vph n SER 74 N -3.91 0.72 -4.78 -2.05 7.64 -1.26 -4.88 113.62 105.10 1vph n SER 74 Ca 0.06 -0.62 -0.36 0.00 1.01 0.00 0.00 58.87 58.96 1vph n SER 74 Cb 0.51 0.06 -0.04 0.00 -1.01 0.00 0.00 64.21 63.73 1vph n SER 74 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1vph s ARG 75 N -2.60 4.19 -1.59 1.43 3.52 -0.54 -4.93 118.95 118.42 1vph s ARG 75 Ca 0.23 1.48 -0.10 0.00 -0.13 0.00 0.00 55.73 57.20 1vph s ARG 75 Cb 0.19 -2.53 -0.06 0.00 -1.56 0.00 0.00 34.95 30.99 1vph s ARG 75 CO 0.54 -0.11 2.83 0.43 -0.81 0.00 0.00 175.30 178.18 1vph n SER 76 N -0.07 8.09 -4.69 -2.12 7.64 -1.26 -4.94 113.62 116.27 1vph n SER 76 Ca 0.05 -2.64 -0.38 0.00 1.01 0.00 0.00 58.87 56.91 1vph n SER 76 Cb 0.50 -1.56 0.06 0.00 -1.01 0.00 0.00 64.21 62.19 1vph n SER 76 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 1vph n TRP 77 N 3.79 1.66 -0.04 1.43 7.02 -1.26 -4.92 117.44 125.13 1vph n TRP 77 Ca 0.74 0.43 0.01 0.00 -1.02 0.00 0.00 57.50 57.67 1vph n TRP 77 Cb 0.25 -2.25 0.32 0.00 -2.42 0.00 0.00 31.31 27.21 1vph n TRP 77 CO 0.00 0.00 0.00 0.87 -2.02 0.00 0.00 177.69 176.54 1vph h LYS 78 N 0.77 0.61 0.00 -0.99 6.56 -2.01 -1.55 116.57 119.97 1vph h LYS 78 Ca -0.50 -0.09 -0.01 0.00 -1.06 0.00 0.00 60.65 59.00 1vph h LYS 78 Cb 1.34 -0.11 -0.00 0.00 -0.57 0.00 0.00 32.23 32.89 1vph h LYS 78 CO 0.53 0.52 -0.03 1.25 -2.06 0.00 0.00 179.45 179.66 1vph h HIS 79 N 0.61 0.00 0.00 -1.35 6.17 -1.94 -2.78 115.15 115.86 1vph h HIS 79 Ca 0.15 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.23 1vph h HIS 79 Cb 0.15 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.08 1vph h HIS 79 CO 0.01 0.03 0.00 0.09 0.71 0.00 0.00 177.93 178.77 1vph n ASN 80 N -3.60 0.00 0.23 3.26 3.02 -0.58 -1.39 115.26 116.20 1vph n ASN 80 Ca -0.03 0.47 0.07 0.00 -0.03 0.00 0.00 54.58 55.06 1vph n ASN 80 Cb 0.12 -0.49 0.58 0.00 -0.61 0.00 0.00 39.78 39.39 1vph n ASN 80 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1vph h LEU 81 N 0.00 0.03 0.00 3.41 3.38 -1.63 -3.32 115.31 117.19 1vph h LEU 81 Ca 0.00 -0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.58 1vph h LEU 81 Cb 0.31 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.99 1vph h LEU 81 CO 0.00 0.09 -2.43 -0.38 0.09 0.00 0.00 178.44 175.81 1vph n ILE 82 N -4.46 1.43 -4.44 1.22 5.41 -0.49 -5.03 119.36 113.00 1vph n ILE 82 Ca -0.02 -0.51 -0.24 0.00 1.00 0.00 0.00 62.75 62.98 1vph n ILE 82 Cb 0.14 -1.47 -0.08 0.00 -0.71 0.00 0.00 39.64 37.52 1vph n ILE 82 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1vph s ASP 83 N -6.60 2.40 -0.30 4.38 -1.08 -0.69 -5.07 116.67 109.72 1vph s ASP 83 Ca -0.34 -1.70 0.08 0.00 -0.52 0.00 0.00 52.55 50.07 1vph s ASP 83 Cb 0.10 0.53 0.46 0.00 -1.46 0.00 0.00 42.92 42.54 1vph s ASP 83 CO 0.55 -0.97 1.30 -0.90 0.52 0.00 0.00 175.17 175.67 1vph n ASP 84 N -1.36 3.98 -0.98 -0.34 5.68 -1.26 -3.89 116.55 118.38 1vph n ASP 84 Ca -0.02 -3.80 0.03 0.00 -0.50 0.00 0.00 54.79 50.50 1vph n ASP 84 Cb 0.64 -0.48 0.03 0.00 -1.14 0.00 0.00 41.12 40.18 1vph n ASP 84 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 1vph n ASN 85 N -0.89 0.71 -0.26 -1.12 6.94 -1.26 -4.85 115.26 114.53 1vph n ASN 85 Ca 0.38 -2.16 0.07 0.00 -0.02 0.00 0.00 54.58 52.84 1vph n ASN 85 Cb 0.88 -0.28 0.20 0.00 -2.36 0.00 0.00 39.78 38.23 1vph n ASN 85 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1vph h ALA 86 N 0.56 1.08 -0.98 -2.53 0.00 -1.88 -0.15 119.26 115.35 1vph h ALA 86 Ca -0.11 0.15 0.12 0.00 0.00 0.00 0.00 54.91 55.06 1vph h ALA 86 Cb 1.61 0.16 -0.08 0.00 0.00 0.00 0.00 17.79 19.48 1vph h ALA 86 CO 0.05 -0.29 0.62 1.12 0.00 0.00 0.00 179.25 180.76 1vph h HIS 87 N 0.36 1.10 -0.44 0.00 2.07 -1.85 -1.41 115.15 114.98 1vph h HIS 87 Ca 0.44 0.03 -0.09 0.00 -2.85 0.00 0.00 60.37 57.90 1vph h HIS 87 Cb 0.73 -0.35 -0.01 0.00 2.57 0.00 0.00 27.41 30.35 1vph h HIS 87 CO -0.20 0.45 -0.09 0.00 -3.07 0.00 0.00 177.93 175.01 1vph h ALA 88 N 1.54 0.60 -0.79 6.11 0.00 -1.28 -1.30 119.26 124.15 1vph h ALA 88 Ca 0.48 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1vph h ALA 88 Cb 0.49 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1vph h ALA 88 CO -0.25 0.48 0.35 0.45 0.00 0.00 0.00 179.25 180.29 1vph h HIS 89 N 0.67 1.16 -0.22 0.00 3.86 -1.06 -1.84 115.15 117.73 1vph h HIS 89 Ca 0.11 -0.07 -0.01 0.00 -1.16 0.00 0.00 60.37 59.25 1vph h HIS 89 Cb 0.63 -0.36 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 1vph h HIS 89 CO 0.05 0.86 0.11 -0.07 0.86 0.00 0.00 177.93 179.74 1vph h LEU 90 N 1.13 0.29 -0.37 2.43 3.38 -1.01 -0.53 115.31 120.63 1vph h LEU 90 Ca 0.27 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.14 1vph h LEU 90 Cb 0.16 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 1vph h LEU 90 CO -0.03 0.32 0.21 1.23 0.09 0.00 0.00 178.44 180.26 1vph h GLY 91 N 0.23 0.51 1.15 0.83 0.00 -1.15 -2.25 103.07 102.40 1vph h GLY 91 Ca 0.08 -0.16 -0.09 0.00 0.00 0.00 0.00 47.33 47.16 1vph h GLY 91 CO -0.01 0.14 0.02 0.00 0.00 0.00 0.00 176.54 176.68 1vph h ALA 92 N 1.17 0.91 -0.33 3.60 0.00 -1.24 0.24 119.26 123.61 1vph h ALA 92 Ca 0.15 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.79 1vph h ALA 92 Cb 0.01 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1vph h ALA 92 CO -0.07 0.65 0.16 1.15 0.00 0.00 0.00 179.25 181.14 1vph h THR 93 N 0.94 0.98 -0.32 0.00 2.02 -0.81 0.35 112.91 116.06 1vph h THR 93 Ca 0.17 -0.11 -0.13 0.00 0.77 0.00 0.00 66.41 67.11 1vph h THR 93 Cb 0.52 0.61 -0.00 0.00 -1.74 0.00 0.00 68.15 67.54 1vph h THR 93 CO 0.03 0.06 -0.31 -0.26 0.37 0.00 0.00 175.52 175.40 1vph h PHE 94 N 0.33 0.93 0.02 3.16 -1.00 -1.21 -3.34 116.94 115.83 1vph h PHE 94 Ca 0.14 -0.28 -0.26 0.00 2.81 0.00 0.00 57.97 60.38 1vph h PHE 94 Cb 0.06 -0.20 0.02 0.00 3.61 0.00 0.00 35.95 39.44 1vph h PHE 94 CO -0.10 1.05 -1.04 -0.07 -1.61 0.00 0.00 178.31 176.54 1vph h LEU 95 N 0.54 0.76 0.00 1.54 3.38 -0.71 -3.50 115.31 117.33 1vph h LEU 95 Ca 0.05 -0.63 0.00 0.00 0.09 0.00 0.00 57.88 57.39 1vph h LEU 95 Cb 0.89 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1vph h LEU 95 CO 0.08 1.43 0.00 0.61 0.09 0.00 0.00 178.44 180.65 1vph n GLY 96 N 1.09 1.81 0.07 0.83 0.00 0.09 -4.82 105.19 104.26 1vph n GLY 96 Ca -0.10 -1.68 0.13 0.00 0.00 0.00 0.00 46.02 44.37 1vph n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vph n ALA 97 N 1.75 2.23 -2.66 4.61 0.00 -1.26 -2.32 120.51 122.86 1vph n ALA 97 Ca 0.00 -0.04 -0.09 0.00 0.00 0.00 0.00 53.44 53.31 1vph n ALA 97 Cb 0.00 -1.46 -0.10 0.00 0.00 0.00 0.00 19.45 17.89 1vph n ALA 97 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1vph s GLU 98 N -3.08 0.49 0.06 0.00 1.03 -1.26 -0.82 118.70 115.11 1vph s GLU 98 Ca 0.11 -0.82 0.04 0.00 0.03 0.00 0.00 54.97 54.33 1vph s GLU 98 Cb 0.14 0.18 -0.03 0.00 -0.80 0.00 0.00 34.13 33.62 1vph s GLU 98 CO 0.55 -0.10 -0.12 1.03 -1.33 0.00 0.00 175.26 175.29 1vph s ARG 99 N -2.50 0.71 -0.12 -4.83 1.81 -0.43 -4.85 118.95 108.74 1vph s ARG 99 Ca -0.06 -0.85 0.03 0.00 -1.72 0.00 0.00 55.73 53.12 1vph s ARG 99 Cb -0.02 -0.63 0.01 0.00 -0.45 0.00 0.00 34.95 33.86 1vph s ARG 99 CO -0.05 0.14 -0.20 0.08 -0.68 0.00 0.00 175.30 174.59 1vph s VAL 100 N -1.26 1.84 0.13 3.52 1.01 -1.26 -1.30 120.40 123.07 1vph s VAL 100 Ca -0.05 -0.86 0.09 0.00 0.00 0.00 0.00 61.98 61.16 1vph s VAL 100 Cb -0.10 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 1vph s VAL 100 CO 0.01 0.51 -0.18 -0.36 0.00 0.00 0.00 175.10 175.09 1vph s PHE 101 N 0.75 2.53 0.53 5.22 0.40 0.63 -4.96 117.98 123.08 1vph s PHE 101 Ca -0.10 -0.27 -0.18 0.00 -0.60 0.00 0.00 56.93 55.78 1vph s PHE 101 Cb -0.16 -1.33 -0.07 0.00 0.51 0.00 0.00 43.02 41.98 1vph s PHE 101 CO 0.01 0.40 1.04 -2.14 0.70 0.00 0.00 175.22 175.23 1vph s PRO 102 N -2.23 3.64 -0.15 0.24 0.02 -1.26 -0.36 135.00 134.91 1vph s PRO 102 Ca 0.19 1.27 0.01 0.00 0.02 0.00 0.00 61.00 62.49 1vph s PRO 102 Cb -0.10 -2.08 0.02 0.00 0.02 0.00 0.00 34.50 32.36 1vph s PRO 102 CO 0.10 -0.55 -0.18 0.08 -0.33 0.00 0.00 177.00 176.12 1vph s VAL 103 N -2.20 1.81 -0.05 3.83 1.01 -0.11 -0.77 120.40 123.92 1vph s VAL 103 Ca 0.65 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.80 1vph s VAL 103 Cb -0.16 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.61 1vph s VAL 103 CO 0.27 0.50 0.12 -0.60 0.00 0.00 0.00 175.10 175.39 1vph s ARG 104 N 1.15 0.10 -1.70 2.72 3.52 0.13 -0.76 118.95 124.11 1vph s ARG 104 Ca -0.01 0.25 -0.11 0.00 -0.13 0.00 0.00 55.73 55.74 1vph s ARG 104 Cb -0.14 -0.07 0.11 0.00 -1.56 0.00 0.00 34.95 33.29 1vph s ARG 104 CO -0.07 -0.09 0.27 0.39 -0.81 0.00 0.00 175.30 174.98 1vph n GLU 105 N 3.63 -0.84 -0.53 5.12 -0.58 -0.82 0.23 120.64 126.85 1vph n GLU 105 Ca -0.20 0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 1vph n GLU 105 Cb 0.55 -4.09 0.00 0.00 -0.57 0.00 0.00 31.44 27.33 1vph n GLU 105 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1vph n GLY 106 N -1.91 1.48 3.44 0.62 0.00 0.40 -5.04 105.19 104.19 1vph n GLY 106 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 1vph n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vph s LYS 107 N -0.17 1.76 0.16 1.61 0.00 0.13 -4.74 119.74 118.49 1vph s LYS 107 Ca 0.00 -1.17 -0.32 0.00 0.00 0.00 0.00 55.97 54.49 1vph s LYS 107 Cb 0.00 -2.06 -0.10 0.00 0.00 0.00 0.00 37.83 35.66 1vph s LYS 107 CO 0.00 0.49 1.62 -1.17 0.00 0.00 0.00 175.35 176.29 1vph s LEU 108 N -1.87 4.37 -0.25 2.77 2.96 -1.26 -0.69 118.68 124.71 1vph s LEU 108 Ca 0.16 2.66 -0.23 0.00 -0.22 0.00 0.00 54.13 56.50 1vph s LEU 108 Cb -0.10 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 42.99 1vph s LEU 108 CO 0.07 -0.87 0.75 -0.69 -1.32 0.00 0.00 176.35 174.29 1vph s VAL 109 N 1.37 4.89 0.06 1.68 1.01 0.05 -4.90 120.40 124.56 1vph s VAL 109 Ca 0.72 1.38 -0.26 0.00 0.00 0.00 0.00 61.98 63.82 1vph s VAL 109 Cb -0.45 -4.05 0.09 0.00 0.00 0.00 0.00 36.38 31.97 1vph s VAL 109 CO 0.32 -0.04 0.75 0.00 0.00 0.00 0.00 175.10 176.12 1vph s ARG 110 N 2.72 1.04 0.81 2.72 1.70 -1.26 -4.38 118.95 122.30 1vph s ARG 110 Ca 0.31 -0.32 -0.11 0.00 -0.47 0.00 0.00 55.73 55.14 1vph s ARG 110 Cb -0.15 0.48 0.08 0.00 -0.57 0.00 0.00 34.95 34.78 1vph s ARG 110 CO 0.08 -0.44 1.09 0.20 -1.08 0.00 0.00 175.30 175.15 1vph s GLY 111 N -2.46 1.64 0.34 3.88 0.00 -1.26 -4.92 107.32 104.54 1vph s GLY 111 Ca 0.02 -0.03 0.08 0.00 0.00 0.00 0.00 44.72 44.79 1vph s GLY 111 CO -0.09 0.38 1.83 -0.84 0.00 0.00 0.00 173.10 174.38 1vph h THR 112 N -1.18 0.78 -0.38 0.90 2.02 -2.03 -2.71 112.91 110.32 1vph h THR 112 Ca -0.47 -0.25 -0.22 0.00 0.77 0.00 0.00 66.41 66.25 1vph h THR 112 Cb 1.26 -0.01 -0.13 0.00 -1.74 0.00 0.00 68.15 67.53 1vph h THR 112 CO 0.56 0.13 -0.15 0.79 0.37 0.00 0.00 175.52 177.22 1vph n TRP 113 N -4.63 1.21 -3.80 3.16 8.01 -1.26 -4.86 117.44 115.27 1vph n TRP 113 Ca 0.20 -1.71 -0.34 0.00 -1.31 0.00 0.00 57.50 54.33 1vph n TRP 113 Cb 0.52 -0.50 -0.11 0.00 -2.01 0.00 0.00 31.31 29.21 1vph n TRP 113 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.69 175.54 1vph s GLN 114 N -3.31 2.31 0.23 -0.99 0.74 -1.02 -2.14 119.66 115.48 1vph s GLN 114 Ca 0.45 -2.49 0.06 0.00 0.05 0.00 0.00 55.36 53.44 1vph s GLN 114 Cb 0.41 -3.58 -0.03 0.00 1.10 0.00 0.00 33.01 30.91 1vph s GLN 114 CO -0.01 -1.14 0.23 -0.80 -0.55 0.00 0.00 175.29 173.02 1vph s ASN 115 N 0.48 5.75 -0.19 6.67 -0.87 0.24 -4.58 114.94 122.43 1vph s ASN 115 Ca 0.16 -0.13 -0.08 0.00 -1.57 0.00 0.00 52.86 51.24 1vph s ASN 115 Cb -0.22 -1.54 -0.04 0.00 -0.02 0.00 0.00 41.25 39.43 1vph s ASN 115 CO -0.03 -0.02 0.08 -0.63 -2.57 0.00 0.00 177.10 173.93 1vph s ILE 116 N -2.02 4.89 -0.03 0.60 1.01 -1.26 -0.49 121.20 123.91 1vph s ILE 116 Ca 0.33 0.00 0.05 0.00 0.00 0.00 0.00 60.65 61.03 1vph s ILE 116 Cb -0.09 -3.22 -0.01 0.00 0.01 0.00 0.00 42.46 39.16 1vph s ILE 116 CO 0.26 0.44 -0.18 -0.36 0.00 0.00 0.00 174.94 175.11 1vph s PHE 117 N 0.48 1.65 -0.03 3.97 0.08 -0.01 -0.63 117.98 123.48 1vph s PHE 117 Ca 0.04 -0.38 -0.30 0.00 0.12 0.00 0.00 56.93 56.41 1vph s PHE 117 Cb -0.12 -1.08 -0.03 0.00 -0.57 0.00 0.00 43.02 41.21 1vph s PHE 117 CO 0.00 -0.09 1.10 -1.17 -0.10 0.00 0.00 175.22 174.97 1vph s LEU 118 N -0.22 4.31 -0.32 -0.37 2.96 -0.33 -1.48 118.68 123.23 1vph s LEU 118 Ca 0.02 1.75 -0.10 0.00 -0.22 0.00 0.00 54.13 55.58 1vph s LEU 118 Cb -0.09 -3.56 -0.00 0.00 0.50 0.00 0.00 46.19 43.03 1vph s LEU 118 CO 0.01 -0.45 0.17 -0.69 -1.32 0.00 0.00 176.35 174.06 1vph s VAL 119 N 1.66 4.63 -0.18 1.68 1.01 0.90 -1.02 120.40 129.08 1vph s VAL 119 Ca 0.54 -0.48 -0.13 0.00 0.00 0.00 0.00 61.98 61.91 1vph s VAL 119 Cb -0.23 -3.40 -0.05 0.00 0.00 0.00 0.00 36.38 32.70 1vph s VAL 119 CO 0.24 0.02 0.27 -0.70 0.00 0.00 0.00 175.10 174.93 1vph s GLU 120 N 1.61 4.21 0.00 2.72 2.56 0.64 -1.18 118.70 129.25 1vph s GLU 120 Ca 0.04 0.03 0.00 0.00 0.00 0.00 0.00 54.97 55.04 1vph s GLU 120 Cb -0.17 -3.46 0.00 0.00 2.00 0.00 0.00 34.13 32.50 1vph s GLU 120 CO 0.07 0.17 0.20 1.28 -0.56 0.00 0.00 175.26 176.41 1vph n LEU 121 N 3.83 0.40 -2.73 2.70 4.77 -1.05 -1.49 117.00 123.42 1vph n LEU 121 Ca -0.12 -0.69 -0.05 0.00 -0.03 0.00 0.00 56.01 55.12 1vph n LEU 121 Cb 0.52 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.65 1vph n LEU 121 CO 0.39 0.10 -0.07 -0.67 -1.33 0.00 0.00 177.39 175.81 1vph n ASP 122 N -0.58 1.57 -4.38 -1.43 2.03 -0.92 -4.59 116.55 108.25 1vph n ASP 122 Ca 0.00 -2.43 -0.28 0.00 0.52 0.00 0.00 54.79 52.60 1vph n ASP 122 Cb 0.00 -0.51 0.15 0.00 -0.72 0.00 0.00 41.12 40.05 1vph n ASP 122 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1vph s GLY 123 N -3.43 1.76 0.37 0.27 0.00 -0.19 -4.59 107.32 101.51 1vph s GLY 123 Ca 0.27 -1.28 -0.26 0.00 0.00 0.00 0.00 44.72 43.46 1vph s GLY 123 CO 0.00 -0.60 1.10 2.56 0.00 0.00 0.00 173.10 176.16 1vph s PRO 124 N -5.63 4.24 -0.02 2.90 0.04 -1.25 -3.73 135.00 131.55 1vph s PRO 124 Ca 0.70 1.70 0.04 0.00 0.04 0.00 0.00 61.00 63.48 1vph s PRO 124 Cb -0.05 -2.75 -0.01 0.00 0.04 0.00 0.00 34.50 31.73 1vph s PRO 124 CO 0.50 -0.12 -0.15 1.03 0.04 0.00 0.00 177.00 178.30 1vph s ARG 125 N -2.17 1.36 0.19 4.56 1.81 -1.04 -4.96 118.95 118.71 1vph s ARG 125 Ca 0.54 -0.52 0.02 0.00 -1.72 0.00 0.00 55.73 54.06 1vph s ARG 125 Cb -0.28 -1.26 0.10 0.00 -0.45 0.00 0.00 34.95 33.07 1vph s ARG 125 CO 0.35 0.26 1.45 0.66 -0.68 0.00 0.00 175.30 177.34 1vph h SER 126 N 6.04 0.31 -2.58 0.23 4.64 -1.87 0.24 113.55 120.57 1vph h SER 126 Ca -0.34 -0.21 -0.48 0.00 -0.47 0.00 0.00 61.79 60.28 1vph h SER 126 Cb 1.16 -0.09 -0.38 0.00 -0.31 0.00 0.00 62.40 62.78 1vph h SER 126 CO 0.48 0.95 -0.75 -0.70 -0.87 0.00 0.00 176.83 175.94 1vph s GLU 127 N -3.49 0.28 -0.19 4.77 2.12 -1.26 -4.00 118.70 116.94 1vph s GLU 127 Ca -0.04 -0.55 -0.16 0.00 0.36 0.00 0.00 54.97 54.59 1vph s GLU 127 Cb 0.11 -1.04 -0.04 0.00 0.26 0.00 0.00 34.13 33.42 1vph s GLU 127 CO 0.82 -1.05 0.38 1.03 -0.54 0.00 0.00 175.26 175.90 1vph s ARG 128 N 2.01 4.21 -0.24 4.30 1.81 0.90 -4.94 118.95 127.01 1vph s ARG 128 Ca 0.10 0.19 -0.07 0.00 -1.72 0.00 0.00 55.73 54.24 1vph s ARG 128 Cb -0.16 -3.50 -0.03 0.00 -0.45 0.00 0.00 34.95 30.81 1vph s ARG 128 CO -0.30 0.04 0.05 -1.58 -0.68 0.00 0.00 175.30 172.83 1vph s HIS 129 N 1.06 3.07 -0.19 -0.53 5.65 -1.26 -0.44 115.29 122.64 1vph s HIS 129 Ca 0.19 -0.48 -0.05 0.00 0.25 0.00 0.00 55.06 54.97 1vph s HIS 129 Cb -0.14 -2.20 -0.02 0.00 -1.18 0.00 0.00 32.58 29.03 1vph s HIS 129 CO 0.07 -0.36 -0.00 0.42 -0.65 0.00 0.00 174.74 174.22 1vph s ILE 130 N 1.49 3.95 0.00 0.89 1.01 0.38 -3.96 121.20 124.97 1vph s ILE 130 Ca 0.06 -0.32 -0.19 0.00 0.00 0.00 0.00 60.65 60.19 1vph s ILE 130 Cb -0.15 -2.78 -0.06 0.00 0.01 0.00 0.00 42.46 39.49 1vph s ILE 130 CO 0.02 0.44 0.56 -0.89 0.00 0.00 0.00 174.94 175.07 1vph s THR 131 N 0.91 4.90 -0.18 2.92 2.01 0.10 -0.53 115.64 125.77 1vph s THR 131 Ca 0.01 1.18 0.01 0.00 0.31 0.00 0.00 61.69 63.19 1vph s THR 131 Cb -0.14 -3.89 0.02 0.00 0.01 0.00 0.00 72.50 68.49 1vph s THR 131 CO 0.02 0.46 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.53 1vph s VAL 132 N -0.42 2.15 -0.11 3.82 1.01 0.27 -1.16 120.40 125.95 1vph s VAL 132 Ca 0.29 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.39 1vph s VAL 132 Cb -0.18 -1.90 0.01 0.00 0.00 0.00 0.00 36.38 34.30 1vph s VAL 132 CO 0.17 0.53 -0.20 -0.70 0.00 0.00 0.00 175.10 174.90 1vph s GLU 133 N 1.26 2.71 -0.13 2.72 2.12 0.01 -0.96 118.70 126.42 1vph s GLU 133 Ca 0.04 -0.75 -0.03 0.00 0.36 0.00 0.00 54.97 54.59 1vph s GLU 133 Cb -0.13 -2.16 -0.03 0.00 0.26 0.00 0.00 34.13 32.07 1vph s GLU 133 CO -0.11 0.04 -0.02 0.42 -0.54 0.00 0.00 175.26 175.04 1vph s ILE 134 N 0.69 4.04 -0.04 -3.70 1.09 0.57 -0.79 121.20 123.06 1vph s ILE 134 Ca -0.12 -0.32 0.01 0.00 -1.10 0.00 0.00 60.65 59.12 1vph s ILE 134 Cb -0.16 -2.74 0.02 0.00 -1.06 0.00 0.00 42.46 38.52 1vph s ILE 134 CO 0.02 0.53 -0.02 -0.22 -0.10 0.00 0.00 174.94 175.15 1vph s LEU 135 N -0.12 1.24 0.00 2.97 0.20 -0.60 -0.43 118.68 121.94 1vph s LEU 135 Ca 0.03 -0.08 0.00 0.00 0.69 0.00 0.00 54.13 54.77 1vph s LEU 135 Cb -0.13 -0.34 0.00 0.00 -0.43 0.00 0.00 46.19 45.29 1vph s LEU 135 CO 0.02 -0.08 0.00 0.61 -0.29 0.00 0.00 176.35 176.62 1vph n GLY 136 N 4.11 -0.39 0.07 7.98 0.00 -0.43 -0.82 105.19 115.71 1vph n GLY 136 Ca -0.25 -0.93 0.01 0.00 0.00 0.00 0.00 46.02 44.85 1vph n GLY 136 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48