#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vph n MET 1 N 0.00 0.00 -4.36 1.57 0.00 -1.26 -5.11 117.12 107.96 1vph n MET 1 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 57.70 57.51 1vph n MET 1 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 33.22 33.07 1vph n MET 1 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 1vph s LYS 2 N -2.11 0.80 -0.09 3.17 1.02 0.13 -5.00 119.74 117.65 1vph s LYS 2 Ca 0.00 -0.30 0.01 0.00 0.02 0.00 0.00 55.97 55.70 1vph s LYS 2 Cb 0.00 -0.76 0.02 0.00 -0.52 0.00 0.00 37.83 36.56 1vph s LYS 2 CO 0.00 0.16 -0.11 0.54 -0.92 0.00 0.00 175.35 175.02 1vph s VAL 3 N -0.04 1.15 -0.05 3.17 0.11 -1.26 -1.04 120.40 122.44 1vph s VAL 3 Ca 0.01 -0.43 0.04 0.00 -2.93 0.00 0.00 61.98 58.67 1vph s VAL 3 Cb -0.05 -1.10 0.00 0.00 -1.53 0.00 0.00 36.38 33.70 1vph s VAL 3 CO -0.00 0.38 -0.15 -0.47 -3.33 0.00 0.00 175.10 171.52 1vph s TYR 4 N 1.18 1.56 0.03 1.54 5.04 0.38 -4.99 117.35 122.09 1vph s TYR 4 Ca -0.04 -0.47 0.09 0.00 -2.44 0.00 0.00 57.07 54.20 1vph s TYR 4 Cb -0.14 -1.08 -0.03 0.00 0.35 0.00 0.00 41.96 41.07 1vph s TYR 4 CO -0.03 -0.18 -0.25 -0.06 -1.34 0.00 0.00 175.55 173.69 1vph s PHE 5 N 0.20 2.36 0.29 4.97 0.08 -1.26 -0.70 117.98 123.92 1vph s PHE 5 Ca -0.06 -0.39 -0.03 0.00 0.12 0.00 0.00 56.93 56.57 1vph s PHE 5 Cb -0.12 -1.43 -0.01 0.00 -0.57 0.00 0.00 43.02 40.89 1vph s PHE 5 CO 0.02 0.11 0.37 0.34 -0.10 0.00 0.00 175.22 175.96 1vph s ASP 6 N -1.11 0.68 -0.02 1.36 -1.08 -0.29 -5.01 116.67 111.20 1vph s ASP 6 Ca 0.12 -1.40 0.02 0.00 -0.52 0.00 0.00 52.55 50.77 1vph s ASP 6 Cb -0.10 0.57 0.00 0.00 -1.46 0.00 0.00 42.92 41.93 1vph s ASP 6 CO 0.02 -1.14 -0.08 -1.81 0.52 0.00 0.00 175.17 172.68 1vph s ASP 7 N -3.20 1.01 -0.12 -0.34 1.11 -1.26 -0.81 116.67 113.06 1vph s ASP 7 Ca 0.32 -0.15 0.02 0.00 0.18 0.00 0.00 52.55 52.92 1vph s ASP 7 Cb 0.01 -0.22 -0.01 0.00 1.07 0.00 0.00 42.92 43.78 1vph s ASP 7 CO 0.18 0.07 -0.18 -0.63 1.18 0.00 0.00 175.17 175.78 1vph s ILE 8 N 0.08 2.57 -0.11 0.77 1.01 0.13 -4.99 121.20 120.66 1vph s ILE 8 Ca -0.01 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 59.83 1vph s ILE 8 Cb -0.06 -2.04 -0.01 0.00 0.01 0.00 0.00 42.46 40.35 1vph s ILE 8 CO 0.00 0.54 -0.17 -0.31 0.00 0.00 0.00 174.94 175.00 1vph s TYR 9 N 0.39 2.71 -0.04 3.97 2.02 -1.26 -0.24 117.35 124.90 1vph s TYR 9 Ca -0.14 -0.72 0.03 0.00 -0.37 0.00 0.00 57.07 55.87 1vph s TYR 9 Cb -0.17 -1.77 0.00 0.00 -0.40 0.00 0.00 41.96 39.62 1vph s TYR 9 CO 0.07 -0.24 -0.11 0.08 -1.57 0.00 0.00 175.55 173.78 1vph s VAL 10 N 0.23 0.95 -0.12 0.71 1.01 0.29 -4.95 120.40 118.52 1vph s VAL 10 Ca -0.11 -0.44 -0.12 0.00 0.00 0.00 0.00 61.98 61.31 1vph s VAL 10 Cb -0.16 -0.85 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 1vph s VAL 10 CO 0.06 0.29 0.26 -0.55 0.00 0.00 0.00 175.10 175.17 1vph s SER 11 N 0.26 6.48 -0.01 3.32 0.15 -1.26 0.22 113.70 122.86 1vph s SER 11 Ca -0.05 0.56 0.05 0.00 0.70 0.00 0.00 55.95 57.21 1vph s SER 11 Cb -0.10 -2.16 -0.03 0.00 -1.71 0.00 0.00 66.02 62.02 1vph s SER 11 CO 0.01 0.23 -0.13 0.42 1.20 0.00 0.00 173.24 174.97 1vph s THR 12 N -0.25 3.14 -0.20 6.45 -4.23 0.12 -4.98 115.64 115.69 1vph s THR 12 Ca 0.17 -0.88 0.17 0.00 -1.18 0.00 0.00 61.69 59.97 1vph s THR 12 Cb -0.13 -2.29 -0.24 0.00 1.34 0.00 0.00 72.50 71.17 1vph s THR 12 CO 0.05 0.46 0.05 0.00 -0.54 0.00 0.00 174.62 174.65 1vph n ALA 13 N 1.87 1.50 -2.52 3.99 0.00 -1.26 -2.29 120.51 121.80 1vph n ALA 13 Ca -0.16 -1.32 -0.24 0.00 0.00 0.00 0.00 53.44 51.71 1vph n ALA 13 Cb 0.52 -0.17 -0.09 0.00 0.00 0.00 0.00 19.45 19.70 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 -2.49 1.85 0.11 0.00 0.52 -1.26 -4.41 118.95 113.27 1vph s ARG 14 Ca -0.11 -1.74 -0.22 0.00 -0.52 0.00 0.00 55.73 53.14 1vph s ARG 14 Cb 0.06 -1.84 -0.08 0.00 0.52 0.00 0.00 34.95 33.61 1vph s ARG 14 CO 0.81 0.29 1.71 0.37 0.02 0.00 0.00 175.30 178.50 1vph h GLN 15 N 2.12 -0.06 -5.18 3.54 4.15 -1.93 -3.27 115.11 114.47 1vph h GLN 15 Ca -0.41 0.00 -0.66 0.00 0.77 0.00 0.00 58.65 58.35 1vph h GLN 15 Cb 1.26 0.01 -0.28 0.00 0.21 0.00 0.00 27.48 28.68 1vph h GLN 15 CO 0.62 -0.04 -0.75 -0.06 -1.93 0.00 0.00 178.83 176.67 1vph s PHE 16 N -6.18 2.87 -0.08 3.99 0.40 -1.26 -1.29 117.98 116.43 1vph s PHE 16 Ca -0.14 -0.82 -0.19 0.00 -0.60 0.00 0.00 56.93 55.18 1vph s PHE 16 Cb 0.08 -1.95 0.04 0.00 0.51 0.00 0.00 43.02 41.71 1vph s PHE 16 CO 0.67 -0.37 0.45 -2.00 0.70 0.00 0.00 175.22 174.67 1vph s GLU 17 N 0.82 0.72 -0.16 0.44 2.12 -0.33 -4.99 118.70 117.32 1vph s GLU 17 Ca -0.03 0.20 -0.03 0.00 0.36 0.00 0.00 54.97 55.46 1vph s GLU 17 Cb -0.15 0.34 -0.02 0.00 0.26 0.00 0.00 34.13 34.55 1vph s GLU 17 CO 0.01 -0.18 -0.05 -0.51 -0.54 0.00 0.00 175.26 173.98 1vph s LEU 18 N -0.77 3.08 -0.22 2.70 1.43 -1.26 -0.67 118.68 122.96 1vph s LEU 18 Ca -0.08 -0.22 0.01 0.00 -1.03 0.00 0.00 54.13 52.81 1vph s LEU 18 Cb -0.03 -1.74 0.04 0.00 0.03 0.00 0.00 46.19 44.48 1vph s LEU 18 CO 0.04 0.13 -0.14 -0.69 0.23 0.00 0.00 176.35 175.92 1vph s VAL 19 N 0.60 2.25 -0.12 -1.59 1.01 -0.06 -4.98 120.40 117.51 1vph s VAL 19 Ca -0.04 -1.22 -0.29 0.00 0.00 0.00 0.00 61.98 60.43 1vph s VAL 19 Cb -0.15 -2.13 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 1vph s VAL 19 CO 0.03 0.26 1.29 -0.62 0.00 0.00 0.00 175.10 176.06 1vph s ASP 20 N 1.22 6.94 -0.07 3.32 -1.08 -1.26 -1.15 116.67 124.60 1vph s ASP 20 Ca -0.01 1.80 0.10 0.00 -0.52 0.00 0.00 52.55 53.91 1vph s ASP 20 Cb -0.16 -2.54 0.21 0.00 -1.46 0.00 0.00 42.92 38.96 1vph s ASP 20 CO -0.08 -0.73 1.14 2.30 0.52 0.00 0.00 175.17 178.31 1vph n ILE 21 N 5.16 1.47 -0.11 4.11 -5.35 0.13 -4.81 119.36 119.96 1vph n ILE 21 Ca 0.13 -1.55 -0.06 0.00 -0.27 0.00 0.00 62.75 61.00 1vph n ILE 21 Cb 0.45 0.15 0.01 0.00 -1.74 0.00 0.00 39.64 38.50 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 0.49 0.39 -0.81 7.28 2.02 -1.89 -0.78 112.91 119.61 1vph h THR 22 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1vph h THR 22 Cb 0.82 0.39 -0.04 0.00 -1.74 0.00 0.00 68.15 67.58 1vph h THR 22 CO 0.03 0.00 0.46 0.44 0.37 0.00 0.00 175.52 176.82 1vph h ASP 23 N -0.15 1.00 -0.40 4.18 3.32 -1.93 0.27 116.42 122.70 1vph h ASP 23 Ca 0.19 -0.08 -0.08 0.00 0.02 0.00 0.00 57.03 57.08 1vph h ASP 23 Cb 0.44 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1vph h ASP 23 CO -0.48 0.79 -0.05 1.56 -1.72 0.00 0.00 179.24 179.34 1vph h GLN 24 N 1.12 0.75 -0.25 3.56 7.50 -1.77 -1.01 115.11 125.00 1vph h GLN 24 Ca 0.29 -0.26 0.00 0.00 0.50 0.00 0.00 58.65 59.18 1vph h GLN 24 Cb 0.00 -0.05 -0.01 0.00 0.05 0.00 0.00 27.48 27.46 1vph h GLN 24 CO -0.05 0.86 0.16 0.28 -1.50 0.00 0.00 178.83 178.58 1vph h VAL 25 N 0.57 1.07 -0.88 -0.54 2.07 -0.78 -2.02 116.25 115.73 1vph h VAL 25 Ca 0.11 -0.14 0.06 0.00 0.82 0.00 0.00 66.70 67.55 1vph h VAL 25 Cb 0.55 0.72 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 1vph h VAL 25 CO 0.03 0.07 0.55 -0.33 0.02 0.00 0.00 177.57 177.91 1vph h GLU 26 N 0.33 0.97 -0.87 1.57 5.08 -0.88 -0.96 114.58 119.82 1vph h GLU 26 Ca 0.09 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.41 1vph h GLU 26 Cb -0.03 -0.22 -0.05 0.00 0.50 0.00 0.00 28.75 28.96 1vph h GLU 26 CO -0.02 0.64 0.58 0.37 -1.00 0.00 0.00 179.01 179.58 1vph h GLN 27 N 1.00 1.13 -0.43 2.33 4.15 -0.78 -0.66 115.11 121.85 1vph h GLN 27 Ca 0.39 -0.07 -0.10 0.00 0.77 0.00 0.00 58.65 59.64 1vph h GLN 27 Cb 0.18 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 27.60 1vph h GLN 27 CO -0.18 0.75 -0.13 0.82 -1.93 0.00 0.00 178.83 178.16 1vph h ILE 28 N 1.16 1.27 -0.30 2.39 2.04 -0.79 0.14 117.51 123.42 1vph h ILE 28 Ca 0.33 -1.25 0.04 0.00 1.00 0.00 0.00 64.86 64.98 1vph h ILE 28 Cb -0.10 1.19 -0.04 0.00 -0.74 0.00 0.00 36.82 37.13 1vph h ILE 28 CO -0.08 0.42 0.06 0.58 0.00 0.00 0.00 178.15 179.13 1vph h VAL 29 N 0.67 0.86 -0.31 1.67 2.07 -0.93 -1.08 116.25 119.20 1vph h VAL 29 Ca 0.11 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 1vph h VAL 29 Cb 0.67 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 1vph h VAL 29 CO 0.05 0.03 0.20 -0.08 0.02 0.00 0.00 177.57 177.78 1vph h GLU 30 N 0.17 0.42 -0.06 1.57 4.81 -0.70 -2.90 114.58 117.90 1vph h GLU 30 Ca 0.14 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.28 1vph h GLU 30 Cb 0.15 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1vph h GLU 30 CO -0.18 0.31 -0.23 0.87 -0.73 0.00 0.00 179.01 179.05 1vph h LYS 31 N 0.41 0.10 0.00 1.92 6.56 -0.52 -2.88 116.57 122.16 1vph h LYS 31 Ca 0.11 -0.03 -0.00 0.00 -1.06 0.00 0.00 60.65 59.67 1vph h LYS 31 Cb -0.01 -0.01 -0.00 0.00 -0.57 0.00 0.00 32.23 31.64 1vph h LYS 31 CO -0.02 0.33 -0.01 0.66 -2.06 0.00 0.00 179.45 178.34 1vph h SER 32 N 0.09 0.00 0.00 0.86 4.64 -0.98 -3.46 113.55 114.70 1vph h SER 32 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1vph h SER 32 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1vph h SER 32 CO 0.03 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.61 1vph n GLY 33 N -1.49 1.10 3.72 -0.77 0.00 -1.09 -4.98 105.19 101.69 1vph n GLY 33 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.30 4.35 -0.21 -0.61 1.01 -1.26 -4.96 121.20 116.21 1vph s ILE 34 Ca 0.00 1.81 0.10 0.00 0.00 0.00 0.00 60.65 62.55 1vph s ILE 34 Cb 0.00 -4.16 -0.21 0.00 0.01 0.00 0.00 42.46 38.10 1vph s ILE 34 CO 0.00 0.21 -0.02 0.29 0.00 0.00 0.00 174.94 175.42 1vph n LYS 35 N 3.34 0.67 -3.87 2.79 4.76 -0.27 -4.51 118.16 121.06 1vph n LYS 35 Ca 0.05 0.09 -0.20 0.00 -2.87 0.00 0.00 58.31 55.38 1vph n LYS 35 Cb 0.48 -1.54 -0.17 0.00 -1.84 0.00 0.00 35.03 31.96 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 -6.04 0.97 0.00 4.39 0.01 -0.65 -0.34 114.94 113.28 1vph s ASN 36 Ca -0.21 -0.04 0.00 0.00 -0.71 0.00 0.00 52.86 51.90 1vph s ASN 36 Cb 0.07 -0.31 0.00 0.00 0.41 0.00 0.00 41.25 41.43 1vph s ASN 36 CO 0.73 -0.15 0.00 0.61 -1.51 0.00 0.00 177.10 176.78 1vph n GLY 37 N 4.61 -0.64 3.24 0.66 0.00 -0.29 -0.38 105.19 112.39 1vph n GLY 37 Ca -0.17 -0.46 -0.14 0.00 0.00 0.00 0.00 46.02 45.26 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 1.02 -0.20 -0.61 -4.36 0.20 -0.96 121.20 112.30 1vph s ILE 38 Ca 0.00 -2.03 -0.00 0.00 -0.26 0.00 0.00 60.65 58.36 1vph s ILE 38 Cb 0.00 -1.87 0.05 0.00 1.25 0.00 0.00 42.46 41.89 1vph s ILE 38 CO 0.00 -0.72 -0.05 0.00 0.24 0.00 0.00 174.94 174.40 1vph s LEU 40 N 1.53 4.14 -0.19 0.00 2.96 0.89 -1.14 118.68 126.86 1vph s LEU 40 Ca -0.02 0.16 0.01 0.00 -0.22 0.00 0.00 54.13 54.06 1vph s LEU 40 Cb -0.17 -2.09 0.02 0.00 0.50 0.00 0.00 46.19 44.45 1vph s LEU 40 CO -0.07 0.12 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.28 1vph s ILE 41 N 0.73 2.24 -0.02 6.68 1.09 -0.40 -0.76 121.20 130.76 1vph s ILE 41 Ca 0.08 -0.96 0.00 0.00 -1.10 0.00 0.00 60.65 58.66 1vph s ILE 41 Cb -0.12 -1.99 0.03 0.00 -1.06 0.00 0.00 42.46 39.32 1vph s ILE 41 CO 0.01 0.46 0.03 0.12 -0.10 0.00 0.00 174.94 175.46 1vph s PHE 42 N 1.29 0.07 -0.21 3.97 5.36 0.07 -1.59 117.98 126.95 1vph s PHE 42 Ca 0.04 0.11 -0.06 0.00 -0.96 0.00 0.00 56.93 56.06 1vph s PHE 42 Cb -0.14 -0.26 -0.03 0.00 -0.34 0.00 0.00 43.02 42.25 1vph s PHE 42 CO -0.11 -0.09 0.02 0.54 -1.46 0.00 0.00 175.22 174.12 1vph s VAL 43 N 1.06 4.13 -1.20 3.12 0.11 -0.12 -0.11 120.40 127.39 1vph s VAL 43 Ca -0.09 -0.25 -0.04 0.00 -2.93 0.00 0.00 61.98 58.67 1vph s VAL 43 Cb -0.13 -2.88 0.17 0.00 -1.53 0.00 0.00 36.38 32.01 1vph s VAL 43 CO -0.03 0.42 2.25 0.00 -3.33 0.00 0.00 175.10 174.41 1vph n ALA 44 N 4.27 6.61 -3.14 1.54 0.00 -1.24 -4.82 120.51 123.73 1vph n ALA 44 Ca -0.17 -4.18 -0.13 0.00 0.00 0.00 0.00 53.44 48.97 1vph n ALA 44 Cb 0.52 -2.58 -0.11 0.00 0.00 0.00 0.00 19.45 17.27 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 -2.05 -0.23 -2.74 0.00 3.76 -1.26 -4.98 115.29 107.79 1vph s HIS 45 Ca 0.50 0.55 0.24 0.00 -0.15 0.00 0.00 55.06 56.20 1vph s HIS 45 Cb 0.20 0.08 0.39 0.00 1.11 0.00 0.00 32.58 34.35 1vph s HIS 45 CO -0.11 -0.17 1.37 -1.13 -0.85 0.00 0.00 174.74 173.85 1vph n SER 46 N 2.65 2.93 -0.15 1.40 3.41 -1.26 -4.11 113.62 118.48 1vph n SER 46 Ca -0.14 -1.93 0.07 0.00 -0.26 0.00 0.00 58.87 56.60 1vph n SER 46 Cb 0.58 -0.09 0.09 0.00 -0.26 0.00 0.00 64.21 64.53 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 1.22 1.33 -4.24 6.66 -2.24 -1.26 -4.13 114.28 111.63 1vph n THR 47 Ca 0.16 -1.58 -0.13 0.00 -2.27 0.00 0.00 64.05 60.23 1vph n THR 47 Cb 0.56 0.04 -0.10 0.00 -2.10 0.00 0.00 70.33 68.73 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 -1.98 1.33 0.25 6.98 0.00 -1.26 -2.48 121.76 124.60 1vph s ALA 48 Ca 0.21 -1.67 -0.08 0.00 0.00 0.00 0.00 51.96 50.42 1vph s ALA 48 Cb 0.18 0.91 -0.01 0.00 0.00 0.00 0.00 23.12 24.20 1vph s ALA 48 CO 0.02 -0.44 0.39 0.00 0.00 0.00 0.00 175.76 175.73 1vph s ALA 49 N -3.85 0.28 -0.11 0.00 0.00 -0.32 -4.73 121.76 113.02 1vph s ALA 49 Ca 0.31 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 51.10 1vph s ALA 49 Cb 0.07 1.16 0.01 0.00 0.00 0.00 0.00 23.12 24.37 1vph s ALA 49 CO 0.08 -0.78 -0.17 0.42 0.00 0.00 0.00 175.76 175.30 1vph s ILE 50 N -3.89 1.66 0.30 0.00 -1.09 -0.84 0.11 121.20 117.45 1vph s ILE 50 Ca 0.28 -0.75 0.02 0.00 -2.23 0.00 0.00 60.65 57.98 1vph s ILE 50 Cb 0.01 -1.50 -0.05 0.00 -1.58 0.00 0.00 42.46 39.35 1vph s ILE 50 CO 0.12 0.47 0.10 0.68 -1.23 0.00 0.00 174.94 175.08 1vph s VAL 51 N 0.87 0.66 -0.03 2.92 -7.23 -0.45 -4.57 120.40 112.57 1vph s VAL 51 Ca -0.08 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.09 1vph s VAL 51 Cb -0.15 -2.62 0.03 0.00 0.56 0.00 0.00 36.38 34.19 1vph s VAL 51 CO -0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 175.10 174.78 1vph s ALA 52 N -3.58 0.38 0.00 1.32 0.00 -1.26 -0.74 121.76 117.88 1vph s ALA 52 Ca 0.36 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.44 1vph s ALA 52 Cb 0.07 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.82 1vph s ALA 52 CO 0.15 -0.11 0.00 -1.71 0.00 0.00 0.00 175.76 174.09 1vph n ASN 53 N 4.24 0.00 -4.73 0.00 2.85 0.01 -4.84 115.26 112.80 1vph n ASN 53 Ca -0.24 -0.75 -0.41 0.00 -0.11 0.00 0.00 54.58 53.07 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 -1.26 4.64 -1.14 1.20 2.12 -0.88 -0.33 118.70 123.06 1vph s GLU 54 Ca 0.00 1.52 -0.20 0.00 0.36 0.00 0.00 54.97 56.65 1vph s GLU 54 Cb 0.00 -3.37 0.07 0.00 0.26 0.00 0.00 34.13 31.09 1vph s GLU 54 CO 0.00 0.11 1.55 -1.58 -0.54 0.00 0.00 175.26 174.80 1vph s HIS 55 N 0.18 2.72 -0.06 5.30 5.65 -1.26 -4.67 115.29 123.15 1vph s HIS 55 Ca 0.49 -1.26 0.01 0.00 0.25 0.00 0.00 55.06 54.55 1vph s HIS 55 Cb -0.25 -4.68 0.02 0.00 -1.18 0.00 0.00 32.58 26.49 1vph s HIS 55 CO 0.31 -1.83 -0.07 -2.00 -0.65 0.00 0.00 174.74 170.49 1vph s GLU 56 N 4.37 1.17 0.39 2.88 -6.30 -1.26 -5.07 118.70 114.88 1vph s GLU 56 Ca 0.48 -0.21 0.10 0.00 -2.50 0.00 0.00 54.97 52.85 1vph s GLU 56 Cb 0.01 -1.10 0.81 0.00 0.00 0.00 0.00 34.13 33.85 1vph s GLU 56 CO -0.02 -0.07 1.92 0.07 0.02 0.00 0.00 175.26 177.18 1vph h ARG 57 N 7.26 0.19 -0.08 4.30 0.11 -1.99 -0.14 114.38 124.03 1vph h ARG 57 Ca -0.34 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 59.70 1vph h ARG 57 Cb 1.16 -0.03 -0.00 0.00 1.11 0.00 0.00 29.97 32.21 1vph h ARG 57 CO 0.45 0.35 0.05 0.78 0.10 0.00 0.00 179.97 181.70 1vph h GLY 58 N 0.73 0.11 1.02 0.08 0.00 -1.98 -2.15 103.07 100.88 1vph h GLY 58 Ca 0.04 -0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.32 1vph h GLY 58 CO 0.02 0.04 0.54 -2.00 0.00 0.00 0.00 176.54 175.14 1vph h LEU 59 N 0.09 1.06 -1.03 3.11 5.85 -1.69 -0.09 115.31 122.62 1vph h LEU 59 Ca 0.03 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.69 1vph h LEU 59 Cb 0.00 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.72 1vph h LEU 59 CO -0.01 0.82 0.65 0.24 -0.34 0.00 0.00 178.44 179.80 1vph h MET 60 N 1.22 1.30 -0.28 1.25 2.86 -0.89 0.47 114.93 120.86 1vph h MET 60 Ca 0.32 -0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 57.86 1vph h MET 60 Cb -0.05 -0.29 -0.01 0.00 0.06 0.00 0.00 31.60 31.30 1vph h MET 60 CO -0.06 0.86 0.11 1.49 1.06 0.00 0.00 176.91 180.37 1vph h GLU 61 N 1.34 0.42 -0.42 1.72 4.81 -0.72 -2.69 114.58 119.03 1vph h GLU 61 Ca 0.36 -0.08 0.08 0.00 -0.13 0.00 0.00 59.36 59.59 1vph h GLU 61 Cb -0.15 -0.07 -0.07 0.00 0.63 0.00 0.00 28.75 29.10 1vph h GLU 61 CO -0.08 0.45 0.03 -0.44 -0.73 0.00 0.00 179.01 178.24 1vph h ASP 62 N 0.29 -0.12 -0.36 1.04 3.32 -0.49 -0.04 116.42 120.06 1vph h ASP 62 Ca 0.09 0.09 0.04 0.00 0.02 0.00 0.00 57.03 57.27 1vph h ASP 62 Cb 0.19 0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.86 1vph h ASP 62 CO -0.01 -0.03 0.15 0.40 -1.72 0.00 0.00 179.24 178.03 1vph h ILE 63 N 0.14 0.93 -0.26 0.35 2.04 -0.80 0.33 117.51 120.23 1vph h ILE 63 Ca 0.21 -0.11 -0.12 0.00 1.00 0.00 0.00 64.86 65.85 1vph h ILE 63 Cb 0.29 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1vph h ILE 63 CO -0.33 0.06 -0.32 -0.07 0.00 0.00 0.00 178.15 177.49 1vph h LEU 64 N 0.31 0.57 -0.23 1.44 3.38 -1.13 -0.34 115.31 119.31 1vph h LEU 64 Ca 0.16 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1vph h LEU 64 Cb 0.11 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1vph h LEU 64 CO -0.15 0.86 0.08 0.74 0.09 0.00 0.00 178.44 180.06 1vph h THR 65 N 0.47 1.19 0.07 0.22 2.02 -0.63 0.25 112.91 116.50 1vph h THR 65 Ca 0.06 -0.60 -0.00 0.00 0.77 0.00 0.00 66.41 66.63 1vph h THR 65 Cb 0.79 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.35 1vph h THR 65 CO 0.06 0.19 -0.03 0.50 0.37 0.00 0.00 175.52 176.61 1vph h LYS 66 N 0.21 -0.09 -0.57 6.66 1.63 -0.75 -0.66 116.57 122.99 1vph h LYS 66 Ca 0.08 0.01 0.11 0.00 -0.85 0.00 0.00 60.65 59.99 1vph h LYS 66 Cb 0.23 0.02 -0.09 0.00 -0.60 0.00 0.00 32.23 31.79 1vph h LYS 66 CO -0.00 -0.03 0.05 0.82 -3.45 0.00 0.00 179.45 176.84 1vph h ILE 67 N -0.13 0.58 -0.30 2.00 2.04 -0.92 -1.07 117.51 119.73 1vph h ILE 67 Ca -0.01 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 65.80 1vph h ILE 67 Cb 0.10 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 1vph h ILE 67 CO 0.02 0.03 0.19 0.11 0.00 0.00 0.00 178.15 178.49 1vph h LYS 68 N 0.17 0.37 -0.81 2.37 1.57 -0.71 0.16 116.57 119.69 1vph h LYS 68 Ca 0.30 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1vph h LYS 68 Cb 0.46 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.65 1vph h LYS 68 CO -0.45 0.25 0.49 0.93 -0.57 0.00 0.00 179.45 180.10 1vph h GLU 69 N 0.38 1.09 -0.37 3.15 5.08 -0.84 0.35 114.58 123.42 1vph h GLU 69 Ca 0.11 -0.10 -0.13 0.00 -1.00 0.00 0.00 59.36 58.24 1vph h GLU 69 Cb -0.03 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 28.98 1vph h GLU 69 CO -0.04 0.77 -0.28 0.35 -1.00 0.00 0.00 179.01 178.81 1vph h PHE 70 N 1.10 1.00 0.00 4.33 3.57 -0.94 -3.32 116.94 122.69 1vph h PHE 70 Ca 0.29 -0.28 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1vph h PHE 70 Cb -0.05 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.47 1vph h PHE 70 CO -0.01 1.06 -1.07 0.25 -2.23 0.00 0.00 178.31 176.32 1vph n THR 71 N -4.18 0.56 -3.08 4.41 -2.24 0.02 -5.03 114.28 104.74 1vph n THR 71 Ca -0.02 -0.53 -0.05 0.00 -2.27 0.00 0.00 64.05 61.18 1vph n THR 71 Cb 0.48 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 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 -2.61 -1.61 0.03 -0.78 1.02 0.09 -4.39 120.64 112.40 1vph n GLU 72 Ca -0.00 1.59 0.17 0.00 -0.02 0.00 0.00 57.16 58.91 1vph n GLU 72 Cb 0.55 -5.38 0.66 0.00 -0.02 0.00 0.00 31.44 27.25 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 0.82 0.04 -0.00 3.49 0.11 -1.94 -2.38 132.00 132.14 1vph h PRO 73 Ca -0.07 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1vph h PRO 73 Cb 1.04 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1vph h PRO 73 CO 0.28 0.03 -0.15 0.43 -0.21 0.00 0.00 178.00 178.38 1vph n SER 74 N -4.42 0.36 -4.78 -2.05 7.64 -1.26 -4.89 113.62 104.23 1vph n SER 74 Ca 0.08 -0.28 -0.37 0.00 1.01 0.00 0.00 58.87 59.30 1vph n SER 74 Cb 0.50 -0.11 -0.05 0.00 -1.01 0.00 0.00 64.21 63.54 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 -2.67 4.30 -1.57 1.43 3.52 -0.90 -4.94 118.95 118.13 1vph s ARG 75 Ca 0.23 1.50 -0.09 0.00 -0.13 0.00 0.00 55.73 57.24 1vph s ARG 75 Cb 0.19 -2.66 -0.05 0.00 -1.56 0.00 0.00 34.95 30.88 1vph s ARG 75 CO 0.52 -0.02 2.84 -1.13 -0.81 0.00 0.00 175.30 176.71 1vph n SER 76 N 0.18 8.62 -4.70 -2.12 3.41 -1.26 -4.95 113.62 112.80 1vph n SER 76 Ca 0.04 -2.69 -0.39 0.00 -0.26 0.00 0.00 58.87 55.57 1vph n SER 76 Cb 0.49 -1.52 0.04 0.00 -0.26 0.00 0.00 64.21 62.97 1vph n SER 76 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1vph n TRP 77 N 3.20 1.80 -0.02 7.33 7.02 -1.26 -4.90 117.44 130.61 1vph n TRP 77 Ca 0.75 0.45 0.03 0.00 -1.02 0.00 0.00 57.50 57.71 1vph n TRP 77 Cb 0.23 -2.29 0.38 0.00 -2.42 0.00 0.00 31.31 27.21 1vph n TRP 77 CO 0.00 0.00 0.00 -0.22 -2.02 0.00 0.00 177.69 175.45 1vph h LYS 78 N 1.18 0.57 0.00 -0.99 3.64 -2.00 -0.76 116.57 118.20 1vph h LYS 78 Ca -0.49 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 58.83 1vph h LYS 78 Cb 1.32 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1vph h LYS 78 CO 0.55 0.43 -0.02 1.25 -2.27 0.00 0.00 179.45 179.39 1vph h HIS 79 N 0.58 0.00 0.00 1.91 2.76 -1.90 -2.77 115.15 115.73 1vph h HIS 79 Ca 0.15 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 1vph h HIS 79 Cb 0.03 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.99 1vph h HIS 79 CO 0.00 0.02 0.00 0.09 -1.30 0.00 0.00 177.93 176.74 1vph n ASN 80 N -3.83 0.00 0.19 3.26 3.02 -0.29 -1.41 115.26 116.20 1vph n ASN 80 Ca -0.03 0.49 0.05 0.00 -0.03 0.00 0.00 54.58 55.05 1vph n ASN 80 Cb 0.11 -0.49 0.47 0.00 -0.61 0.00 0.00 39.78 39.26 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 0.06 0.00 3.41 3.38 -1.63 -3.33 115.31 117.21 1vph h LEU 81 Ca 0.00 -0.01 -0.40 0.00 0.09 0.00 0.00 57.88 57.56 1vph h LEU 81 Cb 0.26 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 1vph h LEU 81 CO 0.00 0.24 -2.46 2.30 0.09 0.00 0.00 178.44 178.60 1vph n ILE 82 N -4.31 1.46 -3.57 1.22 -0.00 -0.50 -5.01 119.36 108.65 1vph n ILE 82 Ca -0.02 -0.50 -0.09 0.00 -0.00 0.00 0.00 62.75 62.14 1vph n ILE 82 Cb 0.25 -1.54 -0.02 0.00 -0.00 0.00 0.00 39.64 38.33 1vph n ILE 82 CO 0.00 0.00 0.00 1.51 -0.00 0.00 0.00 176.55 178.06 1vph s ASP 83 N -6.76 -0.41 -0.16 7.28 -4.77 -0.57 -5.06 116.67 106.23 1vph s ASP 83 Ca -0.35 -0.18 -0.00 0.00 -3.30 0.00 0.00 52.55 48.72 1vph s ASP 83 Cb 0.11 0.56 0.13 0.00 -1.09 0.00 0.00 42.92 42.63 1vph s ASP 83 CO 0.55 -0.95 1.81 -0.90 0.70 0.00 0.00 175.17 176.37 1vph n ASP 84 N -0.38 5.25 -0.99 2.11 5.68 -1.26 -3.56 116.55 123.39 1vph n ASP 84 Ca -0.11 -2.68 0.04 0.00 -0.50 0.00 0.00 54.79 51.54 1vph n ASP 84 Cb 0.62 -0.96 0.05 0.00 -1.14 0.00 0.00 41.12 39.70 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 0.66 0.95 -0.26 -1.12 0.23 -1.26 -4.86 115.26 109.61 1vph n ASN 85 Ca 0.16 -2.37 0.07 0.00 -0.53 0.00 0.00 54.58 51.90 1vph n ASN 85 Cb 0.61 -0.32 0.19 0.00 -2.08 0.00 0.00 39.78 38.18 1vph n ASN 85 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1vph h ALA 86 N 0.66 0.96 -0.99 -2.53 0.00 -1.88 -0.61 119.26 114.86 1vph h ALA 86 Ca -0.12 0.20 0.16 0.00 0.00 0.00 0.00 54.91 55.15 1vph h ALA 86 Cb 1.56 0.29 -0.10 0.00 0.00 0.00 0.00 17.79 19.55 1vph h ALA 86 CO 0.05 -0.38 0.60 1.12 0.00 0.00 0.00 179.25 180.64 1vph h HIS 87 N 0.21 1.07 -0.45 0.00 2.07 -1.84 -0.77 115.15 115.45 1vph h HIS 87 Ca 0.44 0.03 -0.09 0.00 -2.85 0.00 0.00 60.37 57.89 1vph h HIS 87 Cb 0.78 -0.33 -0.01 0.00 2.57 0.00 0.00 27.41 30.41 1vph h HIS 87 CO -0.30 0.31 -0.09 0.00 -3.07 0.00 0.00 177.93 174.78 1vph h ALA 88 N 1.60 0.61 -0.56 6.11 0.00 -1.35 -1.62 119.26 124.05 1vph h ALA 88 Ca 0.54 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1vph h ALA 88 Cb 0.72 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1vph h ALA 88 CO -0.34 0.49 0.37 0.45 0.00 0.00 0.00 179.25 180.23 1vph h HIS 89 N 0.69 0.70 -0.42 0.00 3.86 -1.14 -1.82 115.15 117.01 1vph h HIS 89 Ca 0.12 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.33 1vph h HIS 89 Cb 0.62 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.84 1vph h HIS 89 CO 0.05 0.44 0.21 -0.07 0.86 0.00 0.00 177.93 179.42 1vph h LEU 90 N 0.76 0.55 -0.67 2.43 3.38 -0.84 0.48 115.31 121.39 1vph h LEU 90 Ca 0.21 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1vph h LEU 90 Cb -0.08 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 1vph h LEU 90 CO -0.05 0.51 0.25 1.23 0.09 0.00 0.00 178.44 180.47 1vph h GLY 91 N 0.54 1.09 1.03 0.83 0.00 -1.19 -1.72 103.07 103.65 1vph h GLY 91 Ca 0.15 -0.61 -0.12 0.00 0.00 0.00 0.00 47.33 46.75 1vph h GLY 91 CO -0.02 0.58 -0.20 0.00 0.00 0.00 0.00 176.54 176.90 1vph h ALA 92 N 1.11 0.57 -0.23 3.60 0.00 -1.18 0.11 119.26 123.23 1vph h ALA 92 Ca 0.22 -0.37 0.05 0.00 0.00 0.00 0.00 54.91 54.81 1vph h ALA 92 Cb 0.24 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1vph h ALA 92 CO -0.01 0.53 -0.06 1.15 0.00 0.00 0.00 179.25 180.85 1vph h THR 93 N 0.67 0.75 -0.40 0.00 2.02 -0.56 -0.08 112.91 115.30 1vph h THR 93 Ca 0.09 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.15 1vph h THR 93 Cb 0.76 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 1vph h THR 93 CO 0.06 0.00 -0.20 -0.26 0.37 0.00 0.00 175.52 175.49 1vph h PHE 94 N -0.01 0.97 0.13 3.16 -1.00 -1.08 -3.33 116.94 115.77 1vph h PHE 94 Ca 0.11 -0.24 -0.28 0.00 2.81 0.00 0.00 57.97 60.37 1vph h PHE 94 Cb 0.18 -0.22 0.01 0.00 3.61 0.00 0.00 35.95 39.53 1vph h PHE 94 CO -0.24 1.01 -1.23 -0.07 -1.61 0.00 0.00 178.31 176.17 1vph h LEU 95 N 0.65 0.56 0.00 1.54 3.38 -0.69 -3.50 115.31 117.25 1vph h LEU 95 Ca 0.09 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1vph h LEU 95 Cb 0.76 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1vph h LEU 95 CO 0.06 1.42 0.00 0.61 0.09 0.00 0.00 178.44 180.62 1vph n GLY 96 N 1.44 1.06 0.02 0.83 0.00 -0.05 -4.81 105.19 103.67 1vph n GLY 96 Ca -0.10 -1.73 0.12 0.00 0.00 0.00 0.00 46.02 44.32 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 1.11 3.11 -2.87 4.61 0.00 -1.26 -1.99 120.51 123.22 1vph n ALA 97 Ca 0.00 -0.26 -0.10 0.00 0.00 0.00 0.00 53.44 53.08 1vph n ALA 97 Cb 0.00 -1.22 -0.09 0.00 0.00 0.00 0.00 19.45 18.14 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 -3.03 0.59 0.10 0.00 1.03 -1.26 -0.95 118.70 115.18 1vph s GLU 98 Ca 0.11 -0.62 0.06 0.00 0.03 0.00 0.00 54.97 54.55 1vph s GLU 98 Cb 0.17 0.24 -0.03 0.00 -0.80 0.00 0.00 34.13 33.70 1vph s GLU 98 CO 0.66 -0.15 -0.16 1.03 -1.33 0.00 0.00 175.26 175.31 1vph s ARG 99 N -2.25 0.99 -0.08 -4.83 1.81 -0.62 -4.86 118.95 109.11 1vph s ARG 99 Ca -0.08 -1.12 0.03 0.00 -1.72 0.00 0.00 55.73 52.85 1vph s ARG 99 Cb -0.03 -1.05 0.00 0.00 -0.45 0.00 0.00 34.95 33.43 1vph s ARG 99 CO -0.03 0.23 -0.19 0.08 -0.68 0.00 0.00 175.30 174.71 1vph s VAL 100 N -1.51 1.67 0.09 3.52 1.01 -1.26 -1.28 120.40 122.64 1vph s VAL 100 Ca 0.04 -0.80 0.09 0.00 0.00 0.00 0.00 61.98 61.32 1vph s VAL 100 Cb -0.08 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 1vph s VAL 100 CO 0.03 0.47 -0.24 -0.36 0.00 0.00 0.00 175.10 175.00 1vph s PHE 101 N 0.43 2.11 0.60 5.22 0.40 -0.29 -4.97 117.98 121.47 1vph s PHE 101 Ca -0.16 -0.40 -0.16 0.00 -0.60 0.00 0.00 56.93 55.61 1vph s PHE 101 Cb -0.17 -1.19 -0.03 0.00 0.51 0.00 0.00 43.02 42.15 1vph s PHE 101 CO 0.06 0.22 1.08 -2.14 0.70 0.00 0.00 175.22 175.15 1vph s PRO 102 N -1.70 3.17 -0.14 0.24 0.02 -1.26 -0.42 135.00 134.91 1vph s PRO 102 Ca 0.11 1.33 0.02 0.00 0.02 0.00 0.00 61.00 62.48 1vph s PRO 102 Cb -0.10 -2.00 0.01 0.00 0.02 0.00 0.00 34.50 32.43 1vph s PRO 102 CO 0.04 -0.95 -0.20 0.08 -0.33 0.00 0.00 177.00 175.64 1vph s VAL 103 N -2.30 1.93 -0.08 3.83 1.01 -0.13 -0.83 120.40 123.83 1vph s VAL 103 Ca 0.66 -0.90 -0.03 0.00 0.00 0.00 0.00 61.98 61.71 1vph s VAL 103 Cb -0.19 -1.72 0.05 0.00 0.00 0.00 0.00 36.38 34.52 1vph s VAL 103 CO 0.36 0.52 0.17 -0.60 0.00 0.00 0.00 175.10 175.56 1vph s ARG 104 N 0.90 0.08 -1.52 2.72 3.52 -0.00 -1.14 118.95 123.50 1vph s ARG 104 Ca -0.06 0.52 -0.11 0.00 -0.13 0.00 0.00 55.73 55.95 1vph s ARG 104 Cb -0.15 -0.21 0.08 0.00 -1.56 0.00 0.00 34.95 33.11 1vph s ARG 104 CO -0.03 -0.25 0.83 0.39 -0.81 0.00 0.00 175.30 175.44 1vph n GLU 105 N 4.88 -4.71 -0.87 5.12 1.02 -0.30 -1.86 120.64 123.93 1vph n GLU 105 Ca -0.14 0.53 0.00 0.00 -0.02 0.00 0.00 57.16 57.54 1vph n GLU 105 Cb 0.51 -5.25 0.00 0.00 -0.02 0.00 0.00 31.44 26.68 1vph n GLU 105 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vph n GLY 106 N -1.65 0.92 3.37 0.62 0.00 0.53 -5.02 105.19 103.97 1vph n GLY 106 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.13 1.92 0.01 1.61 0.00 -0.78 -4.82 119.74 117.56 1vph s LYS 107 Ca 0.00 -1.05 -0.30 0.00 0.00 0.00 0.00 55.97 54.62 1vph s LYS 107 Cb 0.00 -2.05 -0.07 0.00 0.00 0.00 0.00 37.83 35.71 1vph s LYS 107 CO 0.00 0.53 1.73 -1.17 0.00 0.00 0.00 175.35 176.43 1vph s LEU 108 N -1.19 4.36 -0.28 2.77 2.96 -1.26 -0.82 118.68 125.23 1vph s LEU 108 Ca 0.12 2.43 -0.26 0.00 -0.22 0.00 0.00 54.13 56.20 1vph s LEU 108 Cb -0.10 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.05 1vph s LEU 108 CO 0.02 -0.94 0.90 -0.69 -1.32 0.00 0.00 176.35 174.32 1vph s VAL 109 N 3.60 4.73 0.08 1.68 1.01 -0.01 -4.94 120.40 126.56 1vph s VAL 109 Ca 0.77 1.56 -0.26 0.00 0.00 0.00 0.00 61.98 64.05 1vph s VAL 109 Cb -0.38 -4.22 0.07 0.00 0.00 0.00 0.00 36.38 31.86 1vph s VAL 109 CO 0.33 -0.23 0.65 0.00 0.00 0.00 0.00 175.10 175.86 1vph s ARG 110 N 3.10 1.17 0.83 2.72 1.70 -1.26 -4.42 118.95 122.80 1vph s ARG 110 Ca 0.38 -0.23 -0.11 0.00 -0.47 0.00 0.00 55.73 55.29 1vph s ARG 110 Cb -0.14 0.54 0.09 0.00 -0.57 0.00 0.00 34.95 34.87 1vph s ARG 110 CO 0.10 -0.47 1.09 0.20 -1.08 0.00 0.00 175.30 175.15 1vph s GLY 111 N -2.24 1.62 0.39 3.88 0.00 -1.26 -4.93 107.32 104.78 1vph s GLY 111 Ca -0.02 -0.12 0.09 0.00 0.00 0.00 0.00 44.72 44.67 1vph s GLY 111 CO -0.06 0.33 1.95 -0.84 0.00 0.00 0.00 173.10 174.48 1vph h THR 112 N -1.27 0.95 -0.55 0.90 2.02 -2.03 -2.60 112.91 110.33 1vph h THR 112 Ca -0.48 -0.21 -0.36 0.00 0.77 0.00 0.00 66.41 66.14 1vph h THR 112 Cb 1.27 0.28 -0.22 0.00 -1.74 0.00 0.00 68.15 67.74 1vph h THR 112 CO 0.57 0.11 -0.15 0.79 0.37 0.00 0.00 175.52 177.21 1vph n TRP 113 N -4.49 1.85 -3.97 3.16 8.01 -1.26 -4.87 117.44 115.88 1vph n TRP 113 Ca 0.11 -1.99 -0.30 0.00 -1.31 0.00 0.00 57.50 54.00 1vph n TRP 113 Cb 0.31 -0.59 -0.14 0.00 -2.01 0.00 0.00 31.31 28.88 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 -3.44 1.85 0.22 -0.99 0.74 -0.98 -2.06 119.66 115.01 1vph s GLN 114 Ca 0.49 -2.43 0.06 0.00 0.05 0.00 0.00 55.36 53.53 1vph s GLN 114 Cb 0.42 -3.30 -0.03 0.00 1.10 0.00 0.00 33.01 31.20 1vph s GLN 114 CO 0.01 -1.07 0.24 -0.80 -0.55 0.00 0.00 175.29 173.12 1vph s ASN 115 N 0.02 5.83 -0.22 6.67 -0.87 0.55 -4.56 114.94 122.36 1vph s ASN 115 Ca 0.15 -0.10 -0.08 0.00 -1.57 0.00 0.00 52.86 51.27 1vph s ASN 115 Cb -0.24 -1.59 -0.04 0.00 -0.02 0.00 0.00 41.25 39.36 1vph s ASN 115 CO -0.02 -0.02 0.08 -0.63 -2.57 0.00 0.00 177.10 173.93 1vph s ILE 116 N -1.99 4.57 -0.04 0.60 1.01 -1.26 -0.81 121.20 123.28 1vph s ILE 116 Ca 0.33 -0.09 0.06 0.00 0.00 0.00 0.00 60.65 60.95 1vph s ILE 116 Cb -0.09 -3.11 -0.01 0.00 0.01 0.00 0.00 42.46 39.26 1vph s ILE 116 CO 0.26 0.38 -0.23 -0.36 0.00 0.00 0.00 174.94 174.99 1vph s PHE 117 N 1.12 2.20 -0.00 3.97 0.08 0.08 -0.70 117.98 124.73 1vph s PHE 117 Ca 0.05 -0.56 -0.30 0.00 0.12 0.00 0.00 56.93 56.23 1vph s PHE 117 Cb -0.14 -1.44 -0.05 0.00 -0.57 0.00 0.00 43.02 40.83 1vph s PHE 117 CO 0.03 -0.14 1.23 -1.17 -0.10 0.00 0.00 175.22 175.08 1vph s LEU 118 N -0.29 4.32 -0.32 -0.37 2.96 -0.30 -1.34 118.68 123.35 1vph s LEU 118 Ca 0.01 1.94 -0.11 0.00 -0.22 0.00 0.00 54.13 55.75 1vph s LEU 118 Cb -0.12 -3.57 -0.02 0.00 0.50 0.00 0.00 46.19 42.99 1vph s LEU 118 CO 0.02 -0.56 0.20 -0.69 -1.32 0.00 0.00 176.35 173.99 1vph s VAL 119 N 1.80 5.01 -0.26 1.68 1.01 0.12 -0.88 120.40 128.88 1vph s VAL 119 Ca 0.58 -0.26 -0.12 0.00 0.00 0.00 0.00 61.98 62.18 1vph s VAL 119 Cb -0.28 -3.55 -0.05 0.00 0.00 0.00 0.00 36.38 32.51 1vph s VAL 119 CO 0.25 0.05 0.25 -0.70 0.00 0.00 0.00 175.10 174.95 1vph s GLU 120 N 1.68 4.01 0.00 2.72 2.56 0.15 -1.18 118.70 128.65 1vph s GLU 120 Ca 0.06 -0.18 0.06 0.00 0.00 0.00 0.00 54.97 54.91 1vph s GLU 120 Cb -0.17 -3.63 0.03 0.00 2.00 0.00 0.00 34.13 32.36 1vph s GLU 120 CO 0.09 -0.15 0.63 1.28 -0.56 0.00 0.00 175.26 176.55 1vph n LEU 121 N 4.94 1.33 -2.75 2.70 4.77 -1.04 -1.19 117.00 125.77 1vph n LEU 121 Ca -0.12 -0.92 -0.03 0.00 -0.03 0.00 0.00 56.01 54.91 1vph n LEU 121 Cb 0.52 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.67 1vph n LEU 121 CO 0.35 0.28 0.08 -0.67 -1.33 0.00 0.00 177.39 176.10 1vph n ASP 122 N 0.12 0.86 -4.33 -1.43 2.03 -0.81 -4.54 116.55 108.44 1vph n ASP 122 Ca 0.03 -2.28 -0.27 0.00 0.52 0.00 0.00 54.79 52.79 1vph n ASP 122 Cb 0.15 -0.22 0.16 0.00 -0.72 0.00 0.00 41.12 40.49 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 -3.05 1.78 0.37 0.27 0.00 -0.41 -4.62 107.32 101.65 1vph s GLY 123 Ca 0.24 -1.52 -0.26 0.00 0.00 0.00 0.00 44.72 43.18 1vph s GLY 123 CO -0.03 -0.81 1.09 2.56 0.00 0.00 0.00 173.10 175.91 1vph s PRO 124 N -5.57 4.26 0.04 2.90 0.04 -1.25 -3.63 135.00 131.80 1vph s PRO 124 Ca 0.72 1.67 0.06 0.00 0.04 0.00 0.00 61.00 63.49 1vph s PRO 124 Cb -0.04 -2.75 -0.02 0.00 0.04 0.00 0.00 34.50 31.73 1vph s PRO 124 CO 0.49 -0.09 -0.18 1.03 0.04 0.00 0.00 177.00 178.29 1vph s ARG 125 N -2.16 1.22 0.13 4.56 1.81 -0.97 -4.97 118.95 118.58 1vph s ARG 125 Ca 0.54 -0.87 -0.01 0.00 -1.72 0.00 0.00 55.73 53.68 1vph s ARG 125 Cb -0.27 -1.30 -0.11 0.00 -0.45 0.00 0.00 34.95 32.83 1vph s ARG 125 CO 0.34 0.33 1.30 0.66 -0.68 0.00 0.00 175.30 177.25 1vph h SER 126 N 4.91 0.35 -2.74 0.23 4.64 -1.87 0.36 113.55 119.43 1vph h SER 126 Ca -0.41 -0.31 -0.49 0.00 -0.47 0.00 0.00 61.79 60.11 1vph h SER 126 Cb 1.17 -0.11 -0.39 0.00 -0.31 0.00 0.00 62.40 62.76 1vph h SER 126 CO 0.44 1.14 -0.76 -1.61 -0.87 0.00 0.00 176.83 175.18 1vph s GLU 127 N -3.06 0.19 -0.19 4.77 8.01 -1.26 -3.99 118.70 123.17 1vph s GLU 127 Ca -0.04 -0.41 -0.14 0.00 0.01 0.00 0.00 54.97 54.40 1vph s GLU 127 Cb 0.09 -1.19 -0.04 0.00 -4.31 0.00 0.00 34.13 28.68 1vph s GLU 127 CO 0.85 -0.97 0.31 1.03 0.01 0.00 0.00 175.26 176.49 1vph s ARG 128 N 2.14 4.19 -0.31 1.61 1.81 0.13 -4.93 118.95 123.59 1vph s ARG 128 Ca 0.08 0.06 -0.08 0.00 -1.72 0.00 0.00 55.73 54.07 1vph s ARG 128 Cb -0.16 -3.49 0.01 0.00 -0.45 0.00 0.00 34.95 30.86 1vph s ARG 128 CO -0.32 0.10 0.11 -1.58 -0.68 0.00 0.00 175.30 172.92 1vph s HIS 129 N 0.91 3.17 -0.20 -0.53 5.65 -1.26 -0.55 115.29 122.48 1vph s HIS 129 Ca 0.16 -0.89 -0.08 0.00 0.25 0.00 0.00 55.06 54.49 1vph s HIS 129 Cb -0.14 -2.30 -0.04 0.00 -1.18 0.00 0.00 32.58 28.93 1vph s HIS 129 CO 0.05 -0.56 0.07 0.42 -0.65 0.00 0.00 174.74 174.08 1vph s ILE 130 N 1.53 4.77 -0.08 0.89 1.01 0.66 -3.62 121.20 126.36 1vph s ILE 130 Ca 0.03 -0.04 -0.15 0.00 0.00 0.00 0.00 60.65 60.49 1vph s ILE 130 Cb -0.17 -3.17 -0.05 0.00 0.01 0.00 0.00 42.46 39.08 1vph s ILE 130 CO 0.04 0.43 0.37 -0.89 0.00 0.00 0.00 174.94 174.89 1vph s THR 131 N 0.62 5.18 -0.17 2.92 2.01 0.84 -0.70 115.64 126.35 1vph s THR 131 Ca 0.04 0.74 0.01 0.00 0.31 0.00 0.00 61.69 62.78 1vph s THR 131 Cb -0.13 -3.69 0.02 0.00 0.01 0.00 0.00 72.50 68.71 1vph s THR 131 CO 0.01 0.47 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.54 1vph s VAL 132 N -0.25 1.94 -0.09 3.82 1.01 0.01 -0.75 120.40 126.10 1vph s VAL 132 Ca 0.22 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.36 1vph s VAL 132 Cb -0.15 -1.76 0.00 0.00 0.00 0.00 0.00 36.38 34.48 1vph s VAL 132 CO 0.09 0.52 -0.20 -0.70 0.00 0.00 0.00 175.10 174.81 1vph s GLU 133 N 1.26 2.63 -0.16 2.72 2.12 0.07 -1.14 118.70 126.20 1vph s GLU 133 Ca 0.03 -0.74 -0.02 0.00 0.36 0.00 0.00 54.97 54.60 1vph s GLU 133 Cb -0.13 -2.03 -0.02 0.00 0.26 0.00 0.00 34.13 32.21 1vph s GLU 133 CO -0.11 0.13 -0.07 0.42 -0.54 0.00 0.00 175.26 175.09 1vph s ILE 134 N 0.44 3.54 -0.05 -3.70 1.09 0.12 -0.08 121.20 122.57 1vph s ILE 134 Ca -0.18 -0.48 0.01 0.00 -1.10 0.00 0.00 60.65 58.91 1vph s ILE 134 Cb -0.17 -2.54 0.02 0.00 -1.06 0.00 0.00 42.46 38.71 1vph s ILE 134 CO 0.07 0.49 -0.06 -0.22 -0.10 0.00 0.00 174.94 175.13 1vph s LEU 135 N 0.51 1.39 0.00 2.97 2.96 -0.65 -0.47 118.68 125.39 1vph s LEU 135 Ca -0.05 -0.15 0.00 0.00 -0.22 0.00 0.00 54.13 53.70 1vph s LEU 135 Cb -0.15 -0.50 0.00 0.00 0.50 0.00 0.00 46.19 46.04 1vph s LEU 135 CO 0.03 -0.04 0.00 0.61 -1.32 0.00 0.00 176.35 175.63 1vph n GLY 136 N 3.99 -0.54 0.18 7.98 0.00 -0.21 -0.62 105.19 115.97 1vph n GLY 136 Ca -0.25 -0.85 0.02 0.00 0.00 0.00 0.00 46.02 44.94 1vph n GLY 136 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48