#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vhk s ARG 3 N 0.00 3.84 -0.02 3.69 3.52 -1.26 0.85 118.95 129.57 1vhk s ARG 3 Ca 0.00 -0.42 0.05 0.00 -0.13 0.00 0.00 55.73 55.23 1vhk s ARG 3 Cb 0.00 -3.08 -0.01 0.00 -1.56 0.00 0.00 34.95 30.30 1vhk s ARG 3 CO 0.00 0.26 -0.16 0.71 -0.81 0.00 0.00 175.30 175.30 1vhk s TYR 4 N 0.36 1.49 -0.33 5.12 1.51 0.66 -4.86 117.35 121.30 1vhk s TYR 4 Ca -0.00 -0.31 -0.19 0.00 -1.01 0.00 0.00 57.07 55.55 1vhk s TYR 4 Cb -0.13 -0.97 -0.01 0.00 -0.11 0.00 0.00 41.96 40.74 1vhk s TYR 4 CO 0.01 -0.06 0.58 -0.06 -1.11 0.00 0.00 175.55 174.92 1vhk s PHE 5 N -0.27 3.19 -0.08 2.71 0.08 -1.26 -1.78 117.98 120.57 1vhk s PHE 5 Ca 0.04 0.40 -0.11 0.00 0.12 0.00 0.00 56.93 57.38 1vhk s PHE 5 Cb -0.07 -2.98 -0.05 0.00 -0.57 0.00 0.00 43.02 39.35 1vhk s PHE 5 CO -0.00 -0.51 0.27 0.42 -0.10 0.00 0.00 175.22 175.30 1vhk s ILE 6 N 2.53 5.28 0.00 0.64 -1.09 -0.68 -4.94 121.20 122.94 1vhk s ILE 6 Ca 0.22 0.52 0.00 0.00 -2.23 0.00 0.00 60.65 59.17 1vhk s ILE 6 Cb -0.15 -3.57 0.00 0.00 -1.58 0.00 0.00 42.46 37.16 1vhk s ILE 6 CO 0.13 0.56 1.32 -0.62 -1.23 0.00 0.00 174.94 175.10 1vhk n GLU 7 N 2.23 0.80 -4.30 2.79 -0.58 -1.26 -3.00 120.64 117.31 1vhk n GLU 7 Ca -0.16 0.00 -0.25 0.00 -0.42 0.00 0.00 57.16 56.33 1vhk n GLU 7 Cb 0.53 -1.10 -0.13 0.00 -0.57 0.00 0.00 31.44 30.18 1vhk n GLU 7 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1vhk s LEU 8 N 0.00 2.31 0.56 -4.62 2.01 -1.26 -4.89 118.68 112.78 1vhk s LEU 8 Ca 0.00 -0.70 -0.11 0.00 0.01 0.00 0.00 54.13 53.33 1vhk s LEU 8 Cb 0.00 -0.94 -0.05 0.00 0.01 0.00 0.00 46.19 45.21 1vhk s LEU 8 CO 0.00 0.08 0.96 0.28 1.01 0.00 0.00 176.35 178.68 1vhk s THR 9 N -1.16 4.71 0.20 5.49 -1.32 -1.26 0.65 115.64 122.96 1vhk s THR 9 Ca 0.08 0.82 -0.12 0.00 -1.21 0.00 0.00 61.69 61.26 1vhk s THR 9 Cb -0.10 -3.83 0.17 0.00 -1.51 0.00 0.00 72.50 67.23 1vhk s THR 9 CO 0.05 -0.96 1.67 0.50 -2.21 0.00 0.00 174.62 173.67 1vhk h LYS 10 N 0.14 0.11 -0.34 7.08 3.64 -1.93 -2.63 116.57 122.64 1vhk h LYS 10 Ca -0.45 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 58.89 1vhk h LYS 10 Cb 1.19 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.97 1vhk h LYS 10 CO 0.62 0.07 0.11 1.96 -2.27 0.00 0.00 179.45 179.94 1vhk h GLN 11 N 0.11 0.53 -0.14 1.90 4.20 -1.98 -2.58 115.11 117.15 1vhk h GLN 11 Ca 0.29 -0.11 0.05 0.00 0.06 0.00 0.00 58.65 58.94 1vhk h GLN 11 Cb 0.46 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 28.11 1vhk h GLN 11 CO -0.48 0.55 -0.21 1.96 -0.67 0.00 0.00 178.83 179.98 1vhk h GLN 12 N 0.40 -0.25 -0.84 1.46 4.20 -1.86 -0.88 115.11 117.33 1vhk h GLN 12 Ca 0.11 0.02 0.18 0.00 0.06 0.00 0.00 58.65 59.02 1vhk h GLN 12 Cb 0.24 0.06 -0.16 0.00 0.30 0.00 0.00 27.48 27.92 1vhk h GLN 12 CO -0.00 -0.17 -0.14 0.82 -0.67 0.00 0.00 178.83 178.66 1vhk h ILE 13 N -0.26 0.17 0.00 2.54 2.04 -1.31 0.81 117.51 121.50 1vhk h ILE 13 Ca 0.10 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.96 1vhk h ILE 13 Cb 0.41 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 1vhk h ILE 13 CO -0.29 0.00 0.00 -0.62 0.00 0.00 0.00 178.15 177.24 1vhk n GLU 14 N -5.50 0.17 0.26 2.37 1.02 -0.45 -3.52 120.64 114.99 1vhk n GLU 14 Ca 0.14 0.39 0.17 0.00 -0.02 0.00 0.00 57.16 57.84 1vhk n GLU 14 Cb 0.47 -1.82 0.78 0.00 -0.02 0.00 0.00 31.44 30.85 1vhk n GLU 14 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1vhk h GLU 15 N 0.00 0.00 -4.73 3.49 4.22 0.18 -3.44 114.58 114.30 1vhk h GLU 15 Ca 0.00 0.00 -0.27 0.00 0.08 0.00 0.00 59.36 59.17 1vhk h GLU 15 Cb 0.37 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.47 1vhk h GLU 15 CO 0.00 0.00 -0.66 0.00 -2.18 0.00 0.00 179.01 176.17 1vhk s ALA 16 N -3.72 1.28 0.42 2.92 0.00 -1.23 -5.05 121.76 116.38 1vhk s ALA 16 Ca -0.00 -1.59 0.08 0.00 0.00 0.00 0.00 51.96 50.45 1vhk s ALA 16 Cb 0.10 0.65 0.88 0.00 0.00 0.00 0.00 23.12 24.75 1vhk s ALA 16 CO 0.46 -0.37 2.03 -1.00 0.00 0.00 0.00 175.76 176.89 1vhk h PRO 17 N 2.70 0.42 -3.76 0.00 0.13 -1.87 -3.43 132.00 126.19 1vhk h PRO 17 Ca -0.36 -0.04 -0.14 0.00 -0.87 0.00 0.00 66.00 64.58 1vhk h PRO 17 Cb 1.21 -0.09 -0.19 0.00 0.13 0.00 0.00 31.00 32.06 1vhk h PRO 17 CO 0.62 0.33 -0.56 0.95 -0.23 0.00 0.00 178.00 179.10 1vhk s THR 18 N -5.27 0.11 0.32 1.56 -4.23 -1.26 -4.73 115.64 102.14 1vhk s THR 18 Ca -0.07 -0.93 0.10 0.00 -1.18 0.00 0.00 61.69 59.60 1vhk s THR 18 Cb 0.17 -0.59 -0.06 0.00 1.34 0.00 0.00 72.50 73.36 1vhk s THR 18 CO 0.73 -0.51 -0.12 0.72 -0.54 0.00 0.00 174.62 174.89 1vhk s PHE 19 N -1.93 2.31 0.22 3.99 -0.71 -0.22 -4.92 117.98 116.70 1vhk s PHE 19 Ca -0.11 -0.47 0.08 0.00 -1.04 0.00 0.00 56.93 55.39 1vhk s PHE 19 Cb -0.05 -1.23 -0.05 0.00 -1.21 0.00 0.00 43.02 40.48 1vhk s PHE 19 CO -0.02 0.59 -0.14 -1.54 -1.34 0.00 0.00 175.22 172.77 1vhk s SER 20 N -3.56 2.66 -0.19 1.98 1.04 -1.26 0.04 113.70 114.42 1vhk s SER 20 Ca 0.31 -1.03 -0.01 0.00 0.48 0.00 0.00 55.95 55.69 1vhk s SER 20 Cb 0.00 -0.15 -0.00 0.00 0.10 0.00 0.00 66.02 65.97 1vhk s SER 20 CO 0.15 -0.17 -0.12 -0.63 0.98 0.00 0.00 173.24 173.46 1vhk s ILE 21 N -2.94 2.85 0.01 -1.02 1.01 0.80 -4.97 121.20 116.93 1vhk s ILE 21 Ca 0.24 -0.68 0.05 0.00 0.00 0.00 0.00 60.65 60.26 1vhk s ILE 21 Cb -0.01 -2.25 -0.02 0.00 0.01 0.00 0.00 42.46 40.20 1vhk s ILE 21 CO 0.08 0.48 -0.17 0.42 0.00 0.00 0.00 174.94 175.75 1vhk s THR 22 N 1.17 1.35 0.00 2.92 -4.23 -1.26 -2.01 115.64 113.57 1vhk s THR 22 Ca 0.02 -0.85 0.00 0.00 -1.18 0.00 0.00 61.69 59.67 1vhk s THR 22 Cb -0.14 -1.15 0.00 0.00 1.34 0.00 0.00 72.50 72.55 1vhk s THR 22 CO -0.04 0.28 0.00 0.61 -0.54 0.00 0.00 174.62 174.92 1vhk n GLY 23 N 2.38 0.30 0.16 3.99 0.00 -1.26 -4.74 105.19 106.02 1vhk n GLY 23 Ca -0.16 -1.71 -0.09 0.00 0.00 0.00 0.00 46.02 44.06 1vhk n GLY 23 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1vhk h GLU 24 N 0.00 0.49 -0.58 1.61 5.08 -2.00 -3.24 114.58 115.94 1vhk h GLU 24 Ca 0.00 -0.08 0.05 0.00 -1.00 0.00 0.00 59.36 58.33 1vhk h GLU 24 Cb 0.00 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.12 1vhk h GLU 24 CO 0.00 0.47 0.31 0.93 -1.00 0.00 0.00 179.01 179.71 1vhk h GLU 25 N 0.39 0.56 -0.12 2.33 3.07 -1.97 -2.76 114.58 116.08 1vhk h GLU 25 Ca 0.11 -0.03 0.04 0.00 -0.50 0.00 0.00 59.36 58.98 1vhk h GLU 25 Cb 0.15 -0.13 -0.05 0.00 -0.84 0.00 0.00 28.75 27.89 1vhk h GLU 25 CO -0.01 0.37 -0.15 -0.24 -1.40 0.00 0.00 179.01 177.58 1vhk h VAL 26 N 0.58 0.60 -0.76 3.13 3.04 -1.84 0.35 116.25 121.35 1vhk h VAL 26 Ca 0.26 0.00 0.14 0.00 -1.01 0.00 0.00 66.70 66.09 1vhk h VAL 26 Cb 0.17 0.60 -0.09 0.00 -2.01 0.00 0.00 31.29 29.95 1vhk h VAL 26 CO -0.17 0.00 0.31 -0.74 -1.01 0.00 0.00 177.57 175.96 1vhk h HIS 27 N -0.19 0.53 -0.31 3.17 -0.00 -1.64 1.72 115.15 118.45 1vhk h HIS 27 Ca 0.09 0.04 -0.04 0.00 -0.00 0.00 0.00 60.37 60.46 1vhk h HIS 27 Cb 0.32 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 27.59 1vhk h HIS 27 CO -0.26 0.08 0.04 1.25 -0.00 0.00 0.00 177.93 179.03 1vhk h HIS 28 N 0.46 0.56 -0.06 5.26 6.17 -0.87 0.45 115.15 127.12 1vhk h HIS 28 Ca 0.41 -0.08 -0.02 0.00 0.71 0.00 0.00 60.37 61.39 1vhk h HIS 28 Cb 0.62 -0.15 -0.00 0.00 2.52 0.00 0.00 27.41 30.40 1vhk h HIS 28 CO -0.16 0.62 -0.04 0.82 0.71 0.00 0.00 177.93 179.88 1vhk h ILE 29 N 0.34 1.34 0.08 6.26 2.04 0.18 -3.20 117.51 124.56 1vhk h ILE 29 Ca 0.09 -1.10 -0.00 0.00 1.00 0.00 0.00 64.86 64.85 1vhk h ILE 29 Cb 0.37 1.95 0.00 0.00 -0.74 0.00 0.00 36.82 38.39 1vhk h ILE 29 CO 0.01 0.30 -0.04 0.58 0.00 0.00 0.00 178.15 179.00 1vhk h VAL 30 N -0.27 0.55 0.07 1.67 2.07 0.25 -2.79 116.25 117.79 1vhk h VAL 30 Ca 0.01 -1.27 -0.19 0.00 0.82 0.00 0.00 66.70 66.08 1vhk h VAL 30 Cb 0.50 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1vhk h VAL 30 CO 0.01 0.17 -0.96 0.78 0.02 0.00 0.00 177.57 177.60 1vhk h ASN 31 N -0.99 0.22 -0.03 0.57 2.35 -0.25 -3.12 115.58 114.32 1vhk h ASN 31 Ca -0.01 -0.83 0.00 0.00 -0.55 0.00 0.00 56.30 54.91 1vhk h ASN 31 Cb 0.37 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.66 1vhk h ASN 31 CO 0.02 1.41 0.00 0.52 -1.65 0.00 0.00 177.43 177.73 1vhk n VAL 32 N -4.23 0.03 0.00 2.81 0.31 -0.87 -5.03 118.33 111.36 1vhk n VAL 32 Ca -0.21 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1vhk n VAL 32 Cb 0.74 -0.03 0.00 0.00 -0.91 0.00 0.00 33.84 33.64 1vhk n VAL 32 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1vhk n ARG 34 N -0.47 0.00 -3.68 5.55 3.00 -1.05 -5.03 116.66 114.97 1vhk n ARG 34 Ca 0.04 0.00 -0.06 0.00 -0.00 0.00 0.00 57.85 57.83 1vhk n ARG 34 Cb 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.48 1vhk n ARG 34 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 1vhk s ASN 36 N 0.00 -0.27 0.30 6.15 0.01 -1.26 -5.01 114.94 114.85 1vhk s ASN 36 Ca 0.00 -0.31 -0.29 0.00 -0.71 0.00 0.00 52.86 51.56 1vhk s ASN 36 Cb 0.00 0.51 -0.13 0.00 0.41 0.00 0.00 41.25 42.04 1vhk s ASN 36 CO 0.00 -0.91 1.19 -1.84 -1.51 0.00 0.00 177.10 174.03 1vhk n GLU 37 N -0.41 1.76 0.00 -0.60 0.00 -1.26 -1.83 120.64 118.30 1vhk n GLU 37 Ca -0.07 0.62 0.00 0.00 0.00 0.00 0.00 57.16 57.71 1vhk n GLU 37 Cb 0.61 -2.12 0.00 0.00 0.00 0.00 0.00 31.44 29.93 1vhk n GLU 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1vhk n GLY 38 N 1.21 1.62 3.79 -1.84 0.00 0.27 -4.97 105.19 105.28 1vhk n GLY 38 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 1vhk n GLY 38 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vhk s ASP 39 N -1.91 5.39 -0.06 1.61 -0.00 -0.76 -4.63 116.67 116.29 1vhk s ASP 39 Ca 0.00 1.87 0.01 0.00 -0.00 0.00 0.00 52.55 54.43 1vhk s ASP 39 Cb 0.00 -2.54 -0.03 0.00 -0.00 0.00 0.00 42.92 40.35 1vhk s ASP 39 CO 0.00 -1.44 -0.06 -1.10 -0.00 0.00 0.00 175.17 172.58 1vhk s GLN 40 N -4.24 2.77 0.23 8.23 -0.21 -1.26 -0.45 119.66 124.74 1vhk s GLN 40 Ca 0.64 -0.54 0.00 0.00 0.02 0.00 0.00 55.36 55.48 1vhk s GLN 40 Cb -0.18 -2.61 -0.05 0.00 1.00 0.00 0.00 33.01 31.17 1vhk s GLN 40 CO 0.42 0.67 0.11 0.96 -2.12 0.00 0.00 175.29 175.32 1vhk s ILE 41 N -0.84 0.32 -0.11 1.08 -4.36 -0.54 -4.96 121.20 111.78 1vhk s ILE 41 Ca 0.13 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.53 1vhk s ILE 41 Cb -0.11 -2.58 -0.02 0.00 1.25 0.00 0.00 42.46 41.00 1vhk s ILE 41 CO 0.02 0.00 -0.14 -0.63 0.24 0.00 0.00 174.94 174.43 1vhk s ILE 42 N -3.93 3.01 0.07 8.37 -1.09 0.25 -0.93 121.20 126.94 1vhk s ILE 42 Ca 0.38 -0.69 0.09 0.00 -2.23 0.00 0.00 60.65 58.20 1vhk s ILE 42 Cb 0.07 -2.24 -0.03 0.00 -1.58 0.00 0.00 42.46 38.69 1vhk s ILE 42 CO 0.13 0.54 -0.24 0.00 -1.23 0.00 0.00 174.94 174.14 1vhk s SER 45 N 1.21 0.97 0.45 0.00 1.04 0.05 -1.69 113.70 115.73 1vhk s SER 45 Ca -0.03 0.78 0.15 0.00 0.48 0.00 0.00 55.95 57.33 1vhk s SER 45 Cb -0.14 -1.13 1.02 0.00 0.10 0.00 0.00 66.02 65.88 1vhk s SER 45 CO -0.04 -4.11 1.99 1.56 0.98 0.00 0.00 173.24 173.63 1vhk h GLN 46 N -2.57 0.00 -0.00 4.02 4.20 0.32 -1.30 115.11 119.78 1vhk h GLN 46 Ca -0.47 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.24 1vhk h GLN 46 Cb 1.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.09 1vhk h GLN 46 CO 0.38 0.18 -0.01 -0.40 -0.67 0.00 0.00 178.83 178.32 1vhk n ASP 47 N -4.27 0.28 0.00 1.46 3.85 -1.26 -4.93 116.55 111.67 1vhk n ASP 47 Ca -0.02 -0.95 0.00 0.00 -0.71 0.00 0.00 54.79 53.11 1vhk n ASP 47 Cb 0.25 -0.04 0.00 0.00 -1.35 0.00 0.00 41.12 39.98 1vhk n ASP 47 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1vhk n GLY 48 N 1.09 0.73 3.66 6.12 0.00 -0.49 -5.04 105.19 111.25 1vhk n GLY 48 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 1vhk n GLY 48 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vhk s PHE 49 N -2.28 3.36 0.25 1.61 0.40 -1.26 -4.74 117.98 115.32 1vhk s PHE 49 Ca 0.00 1.21 -0.27 0.00 -0.60 0.00 0.00 56.93 57.27 1vhk s PHE 49 Cb 0.00 -3.05 -0.09 0.00 0.51 0.00 0.00 43.02 40.39 1vhk s PHE 49 CO 0.00 -0.34 0.89 -2.00 0.70 0.00 0.00 175.22 174.48 1vhk s GLU 50 N 2.57 4.66 -0.01 0.44 2.12 -1.26 -0.77 118.70 126.45 1vhk s GLU 50 Ca 0.37 1.32 -0.05 0.00 0.36 0.00 0.00 54.97 56.98 1vhk s GLU 50 Cb -0.16 -3.08 0.00 0.00 0.26 0.00 0.00 34.13 31.16 1vhk s GLU 50 CO 0.09 0.43 0.10 0.00 -0.54 0.00 0.00 175.26 175.35 1vhk s ALA 51 N -1.36 -0.23 -0.10 6.30 0.00 0.94 -2.54 121.76 124.78 1vhk s ALA 51 Ca 0.43 -0.03 -0.18 0.00 0.00 0.00 0.00 51.96 52.18 1vhk s ALA 51 Cb -0.22 -0.00 -0.04 0.00 0.00 0.00 0.00 23.12 22.85 1vhk s ALA 51 CO 0.27 -0.14 0.48 0.21 0.00 0.00 0.00 175.76 176.58 1vhk s LYS 52 N -0.82 4.31 0.23 0.00 2.20 0.97 -1.27 119.74 125.37 1vhk s LYS 52 Ca -0.09 0.46 0.08 0.00 -0.36 0.00 0.00 55.97 56.07 1vhk s LYS 52 Cb -0.05 -3.42 -0.05 0.00 -1.51 0.00 0.00 37.83 32.80 1vhk s LYS 52 CO 0.01 0.21 -0.14 0.00 -0.36 0.00 0.00 175.35 175.06 1vhk s GLU 54 N -3.63 2.40 -0.50 0.00 2.12 0.25 -1.47 118.70 117.86 1vhk s GLU 54 Ca 0.25 -0.81 -0.28 0.00 0.36 0.00 0.00 54.97 54.49 1vhk s GLU 54 Cb -0.01 -2.00 0.02 0.00 0.26 0.00 0.00 34.13 32.40 1vhk s GLU 54 CO 0.09 0.30 1.33 -0.51 -0.54 0.00 0.00 175.26 175.94 1vhk s LEU 55 N -0.01 3.51 -0.05 2.70 1.02 0.41 -1.65 118.68 124.61 1vhk s LEU 55 Ca -0.06 0.47 -0.23 0.00 0.02 0.00 0.00 54.13 54.32 1vhk s LEU 55 Cb -0.14 -3.32 -0.26 0.00 0.02 0.00 0.00 46.19 42.49 1vhk s LEU 55 CO 0.04 -1.51 0.98 -0.61 0.02 0.00 0.00 176.35 175.28 1vhk h GLN 56 N 10.41 0.23 -3.20 1.70 4.15 -1.40 0.79 115.11 127.79 1vhk h GLN 56 Ca -0.26 -0.29 -0.28 0.00 0.77 0.00 0.00 58.65 58.59 1vhk h GLN 56 Cb 1.09 0.09 -0.34 0.00 0.21 0.00 0.00 27.48 28.53 1vhk h GLN 56 CO 1.14 1.05 -0.63 0.45 -1.93 0.00 0.00 178.83 178.91 1vhk s SER 57 N -6.55 0.35 0.05 -0.69 0.15 -1.06 -4.67 113.70 101.27 1vhk s SER 57 Ca -0.15 0.29 0.06 0.00 0.70 0.00 0.00 55.95 56.84 1vhk s SER 57 Cb 0.01 0.19 -0.04 0.00 -1.71 0.00 0.00 66.02 64.48 1vhk s SER 57 CO 0.77 -0.20 -0.11 0.68 1.20 0.00 0.00 173.24 175.59 1vhk s VAL 58 N 1.72 3.29 0.28 4.45 -7.23 -1.26 0.14 120.40 121.79 1vhk s VAL 58 Ca -0.03 -1.05 -0.20 0.00 -1.81 0.00 0.00 61.98 58.88 1vhk s VAL 58 Cb -0.12 -2.45 0.03 0.00 0.56 0.00 0.00 36.38 34.40 1vhk s VAL 58 CO -0.06 0.29 0.77 -0.94 -0.31 0.00 0.00 175.10 174.85 1vhk s SER 59 N -1.67 -0.19 0.00 4.85 1.04 -0.36 -4.97 113.70 112.40 1vhk s SER 59 Ca 0.18 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 55.92 1vhk s SER 59 Cb -0.11 0.72 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1vhk s SER 59 CO 0.09 -1.35 0.38 1.17 0.98 0.00 0.00 173.24 174.50 1vhk n LYS 60 N -0.48 0.42 0.00 4.02 3.00 -1.26 -2.76 118.16 121.10 1vhk n LYS 60 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.26 1vhk n LYS 60 Cb 0.59 -1.04 0.00 0.00 0.00 0.00 0.00 35.03 34.59 1vhk n LYS 60 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1vhk n ASP 61 N -0.36 0.00 -3.79 3.14 3.85 -1.26 -5.00 116.55 113.13 1vhk n ASP 61 Ca 0.00 -0.47 -0.13 0.00 -0.71 0.00 0.00 54.79 53.49 1vhk n ASP 61 Cb 0.02 0.00 -0.10 0.00 -1.35 0.00 0.00 41.12 39.69 1vhk n ASP 61 CO 0.00 0.00 0.00 -0.75 -1.01 0.00 0.00 177.20 175.44 1vhk s LYS 62 N 0.00 0.46 -0.04 0.11 2.20 -1.11 -4.59 119.74 116.76 1vhk s LYS 62 Ca 0.00 0.06 -0.01 0.00 -0.36 0.00 0.00 55.97 55.66 1vhk s LYS 62 Cb 0.00 0.21 0.03 0.00 -1.51 0.00 0.00 37.83 36.56 1vhk s LYS 62 CO 0.00 -0.10 0.03 0.08 -0.36 0.00 0.00 175.35 175.00 1vhk s VAL 63 N -0.58 0.08 -0.21 4.02 1.01 -0.85 -1.22 120.40 122.65 1vhk s VAL 63 Ca -0.07 0.24 -0.10 0.00 0.00 0.00 0.00 61.98 62.05 1vhk s VAL 63 Cb -0.04 -0.26 -0.05 0.00 0.00 0.00 0.00 36.38 36.03 1vhk s VAL 63 CO 0.02 0.18 0.14 -0.44 0.00 0.00 0.00 175.10 174.99 1vhk s SER 64 N 1.65 6.20 0.08 3.32 0.01 0.12 -0.14 113.70 124.93 1vhk s SER 64 Ca -0.01 0.21 0.10 0.00 1.31 0.00 0.00 55.95 57.56 1vhk s SER 64 Cb -0.13 -2.10 -0.03 0.00 0.21 0.00 0.00 66.02 63.97 1vhk s SER 64 CO -0.03 0.16 -0.25 0.00 0.41 0.00 0.00 173.24 173.52 1vhk s LEU 66 N -1.62 2.50 -0.37 0.00 2.96 -0.66 -1.06 118.68 120.44 1vhk s LEU 66 Ca 0.13 -0.40 -0.24 0.00 -0.22 0.00 0.00 54.13 53.39 1vhk s LEU 66 Cb -0.10 -1.54 0.01 0.00 0.50 0.00 0.00 46.19 45.06 1vhk s LEU 66 CO 0.04 0.17 0.85 0.54 -1.32 0.00 0.00 176.35 176.63 1vhk s VAL 67 N 0.32 4.66 -0.64 1.68 0.11 -1.26 -0.59 120.40 124.68 1vhk s VAL 67 Ca -0.13 1.03 0.23 0.00 -2.93 0.00 0.00 61.98 60.18 1vhk s VAL 67 Cb -0.16 -4.27 -0.05 0.00 -1.53 0.00 0.00 36.38 30.36 1vhk s VAL 67 CO 0.07 -0.48 1.14 2.30 -3.33 0.00 0.00 175.10 174.80 1vhk n ILE 68 N 5.87 0.22 -3.64 7.04 -5.35 -0.80 -4.95 119.36 117.76 1vhk n ILE 68 Ca 0.05 -0.24 -0.06 0.00 -0.27 0.00 0.00 62.75 62.23 1vhk n ILE 68 Cb 0.48 0.10 -0.07 0.00 -1.74 0.00 0.00 39.64 38.42 1vhk n ILE 68 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1vhk s GLU 69 N -3.18 0.49 -0.52 6.28 2.12 -1.06 -4.98 118.70 117.86 1vhk s GLU 69 Ca 0.05 0.73 -0.17 0.00 0.36 0.00 0.00 54.97 55.94 1vhk s GLU 69 Cb 0.14 0.16 0.09 0.00 0.26 0.00 0.00 34.13 34.79 1vhk s GLU 69 CO 0.77 -0.08 0.51 -1.58 -0.54 0.00 0.00 175.26 174.34 1vhk s TRP 70 N 0.93 3.18 0.33 5.30 0.52 -1.26 -0.02 118.94 127.92 1vhk s TRP 70 Ca -0.04 -0.99 0.02 0.00 0.02 0.00 0.00 56.10 55.11 1vhk s TRP 70 Cb -0.04 -3.57 0.61 0.00 -1.15 0.00 0.00 33.47 29.32 1vhk s TRP 70 CO -0.12 -0.99 1.96 1.79 0.02 0.00 0.00 176.95 179.62 1vhk h THR 71 N 5.84 1.10 -0.18 2.01 1.35 -1.86 -3.46 112.91 117.71 1vhk h THR 71 Ca -0.29 -0.31 -0.08 0.00 -0.55 0.00 0.00 66.41 65.18 1vhk h THR 71 Cb 1.10 0.11 -0.03 0.00 -1.73 0.00 0.00 68.15 67.60 1vhk h THR 71 CO 0.98 0.17 -0.07 0.59 -0.25 0.00 0.00 175.52 176.94 1vhk n ASN 72 N -4.46 -4.22 -4.70 5.36 3.02 -1.26 -4.96 115.26 104.05 1vhk n ASN 72 Ca 0.10 0.10 -0.42 0.00 -0.03 0.00 0.00 54.58 54.32 1vhk n ASN 72 Cb 0.13 -2.06 -0.03 0.00 -0.61 0.00 0.00 39.78 37.22 1vhk n ASN 72 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1vhk s GLU 73 N -1.68 4.50 -0.20 3.52 0.41 -1.26 -5.01 118.70 118.99 1vhk s GLU 73 Ca 0.00 1.42 0.00 0.00 -0.41 0.00 0.00 54.97 55.98 1vhk s GLU 73 Cb 0.00 -3.49 0.05 0.00 -1.78 0.00 0.00 34.13 28.90 1vhk s GLU 73 CO 0.00 -0.17 -0.07 1.21 -0.49 0.00 0.00 175.26 175.74 1vhk s ASN 74 N 1.05 3.31 -0.36 -0.19 3.84 -1.26 -4.52 114.94 116.81 1vhk s ASN 74 Ca 0.51 -0.88 0.06 0.00 0.21 0.00 0.00 52.86 52.75 1vhk s ASN 74 Cb -0.20 -1.09 0.52 0.00 -0.55 0.00 0.00 41.25 39.92 1vhk s ASN 74 CO 0.24 -0.19 1.56 0.54 -2.79 0.00 0.00 177.10 176.46 1vhk n ARG 75 N 4.76 2.25 -3.94 0.43 1.74 -1.26 -4.98 116.66 115.65 1vhk n ARG 75 Ca -0.13 -3.33 -0.36 0.00 -0.77 0.00 0.00 57.85 53.26 1vhk n ARG 75 Cb 0.46 -1.99 -0.07 0.00 -1.02 0.00 0.00 32.46 29.84 1vhk n ARG 75 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1vhk s GLU 76 N -3.39 3.61 0.66 5.56 0.41 -1.26 -4.80 118.70 119.50 1vhk s GLU 76 Ca 0.50 -0.22 -0.17 0.00 -0.41 0.00 0.00 54.97 54.67 1vhk s GLU 76 Cb 0.43 -3.18 -0.02 0.00 -1.78 0.00 0.00 34.13 29.57 1vhk s GLU 76 CO 0.02 0.60 0.93 1.28 -0.49 0.00 0.00 175.26 177.59 1vhk n LEU 77 N 2.54 3.46 0.10 1.80 4.77 -1.26 -4.89 117.00 123.52 1vhk n LEU 77 Ca -0.18 0.73 0.11 0.00 -0.03 0.00 0.00 56.01 56.63 1vhk n LEU 77 Cb 0.54 -1.38 0.45 0.00 -2.33 0.00 0.00 43.42 40.69 1vhk n LEU 77 CO 0.32 -2.03 0.82 -0.81 -1.33 0.00 0.00 177.39 174.37 1vhk n PRO 78 N -1.37 0.15 -4.39 3.23 -0.04 -1.26 -4.67 135.00 126.65 1vhk n PRO 78 Ca 0.13 0.38 -0.26 0.00 -0.04 0.00 0.00 63.50 63.71 1vhk n PRO 78 Cb 0.49 -1.78 -0.12 0.00 -0.04 0.00 0.00 33.50 32.05 1vhk n PRO 78 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1vhk s ILE 79 N -3.23 2.20 -0.64 0.52 -4.36 -1.26 -1.22 121.20 113.20 1vhk s ILE 79 Ca 0.05 -1.92 -0.21 0.00 -0.26 0.00 0.00 60.65 58.32 1vhk s ILE 79 Cb 0.09 -2.01 0.09 0.00 1.25 0.00 0.00 42.46 41.89 1vhk s ILE 79 CO 0.36 -0.10 0.84 -0.54 0.24 0.00 0.00 174.94 175.75 1vhk s LYS 80 N -2.49 3.10 -0.19 0.37 1.02 -0.67 -4.94 119.74 115.94 1vhk s LYS 80 Ca 0.17 -1.12 -0.07 0.00 0.02 0.00 0.00 55.97 54.98 1vhk s LYS 80 Cb -0.08 -4.27 -0.04 0.00 -0.52 0.00 0.00 37.83 32.92 1vhk s LYS 80 CO 0.08 -1.68 0.05 0.54 -0.92 0.00 0.00 175.35 173.42 1vhk s VAL 81 N 3.31 4.50 -0.26 3.17 0.11 -1.26 -1.01 120.40 128.96 1vhk s VAL 81 Ca 0.17 -0.13 -0.11 0.00 -2.93 0.00 0.00 61.98 58.99 1vhk s VAL 81 Cb -0.20 -3.04 -0.05 0.00 -1.53 0.00 0.00 36.38 31.56 1vhk s VAL 81 CO 0.07 0.44 0.17 -0.31 -3.33 0.00 0.00 175.10 172.14 1vhk s TYR 82 N 0.66 3.26 -0.34 1.54 2.02 0.11 -1.42 117.35 123.19 1vhk s TYR 82 Ca 0.02 0.15 -0.16 0.00 -0.37 0.00 0.00 57.07 56.71 1vhk s TYR 82 Cb -0.13 -2.31 -0.01 0.00 -0.40 0.00 0.00 41.96 39.10 1vhk s TYR 82 CO 0.02 -0.05 0.41 0.42 -1.57 0.00 0.00 175.55 174.78 1vhk s ILE 83 N 1.38 5.12 -0.28 2.71 -1.09 -0.78 -1.19 121.20 127.07 1vhk s ILE 83 Ca 0.07 0.18 -0.10 0.00 -2.23 0.00 0.00 60.65 58.58 1vhk s ILE 83 Cb -0.15 -3.86 -0.04 0.00 -1.58 0.00 0.00 42.46 36.84 1vhk s ILE 83 CO 0.07 -0.11 0.15 0.00 -1.23 0.00 0.00 174.94 173.82 1vhk s ALA 84 N 2.14 3.39 -0.18 9.38 0.00 0.30 -1.55 121.76 135.25 1vhk s ALA 84 Ca 0.14 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 50.97 1vhk s ALA 84 Cb -0.16 -2.36 0.03 0.00 0.00 0.00 0.00 23.12 20.63 1vhk s ALA 84 CO 0.12 -0.58 -0.17 -1.12 0.00 0.00 0.00 175.76 174.02 1vhk s SER 85 N 1.70 3.17 0.09 0.00 0.01 -0.94 -1.19 113.70 116.55 1vhk s SER 85 Ca 0.07 -0.70 -0.31 0.00 1.31 0.00 0.00 55.95 56.31 1vhk s SER 85 Cb -0.16 -1.38 -0.09 0.00 0.21 0.00 0.00 66.02 64.60 1vhk s SER 85 CO 0.08 -0.05 1.73 -0.83 0.41 0.00 0.00 173.24 174.59 1vhk s GLY 86 N 1.33 1.46 -0.41 3.44 0.00 -0.56 -2.07 107.32 110.51 1vhk s GLY 86 Ca 0.03 1.32 -0.31 0.00 0.00 0.00 0.00 44.72 45.76 1vhk s GLY 86 CO -0.11 3.01 1.62 1.04 0.00 0.00 0.00 173.10 178.66 1vhk n LEU 87 N 5.64 0.51 -4.94 0.66 4.32 -0.55 -4.02 117.00 118.63 1vhk n LEU 87 Ca 0.17 0.46 -0.25 0.00 -0.02 0.00 0.00 56.01 56.36 1vhk n LEU 87 Cb 0.39 -0.66 0.07 0.00 -1.62 0.00 0.00 43.42 41.60 1vhk n LEU 87 CO 0.64 -0.56 0.58 -2.16 -1.22 0.00 0.00 177.39 174.67 1vhk s PRO 88 N 4.66 2.17 0.46 3.23 0.04 -1.26 -4.58 135.00 139.73 1vhk s PRO 88 Ca 0.90 -0.38 0.01 0.00 0.04 0.00 0.00 61.00 61.57 1vhk s PRO 88 Cb -1.08 -2.21 0.01 0.00 0.04 0.00 0.00 34.50 31.25 1vhk s PRO 88 CO 0.47 -1.21 0.68 -1.59 0.04 0.00 0.00 177.00 175.39 1vhk s LYS 89 N -5.19 2.93 5.19 4.56 -2.85 -1.26 -4.78 119.74 118.33 1vhk s LYS 89 Ca 0.60 -0.62 0.00 0.00 -1.00 0.00 0.00 55.97 54.95 1vhk s LYS 89 Cb -0.10 -2.57 0.00 0.00 -2.06 0.00 0.00 37.83 33.10 1vhk s LYS 89 CO 0.44 -0.35 0.00 0.41 0.10 0.00 0.00 175.35 175.95 1vhk n GLY 90 N -2.10 1.27 1.32 0.59 0.00 -1.26 -3.19 105.19 101.81 1vhk n GLY 90 Ca 0.03 -0.68 0.03 0.00 0.00 0.00 0.00 46.02 45.40 1vhk n GLY 90 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1vhk n ASP 91 N 3.88 4.14 -0.30 1.61 3.85 -1.26 -4.69 116.55 123.77 1vhk n ASP 91 Ca 0.00 -3.17 -0.05 0.00 -0.71 0.00 0.00 54.79 50.86 1vhk n ASP 91 Cb 0.00 -0.63 0.07 0.00 -1.35 0.00 0.00 41.12 39.22 1vhk n ASP 91 CO 0.00 0.00 0.00 0.11 -1.01 0.00 0.00 177.20 176.30 1vhk h LYS 92 N 2.16 1.19 -0.48 0.11 1.57 -1.87 -2.18 116.57 117.07 1vhk h LYS 92 Ca 0.10 -0.18 0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1vhk h LYS 92 Cb 1.76 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 33.84 1vhk h LYS 92 CO 0.41 0.92 0.31 1.25 -0.57 0.00 0.00 179.45 181.77 1vhk h LEU 93 N 1.17 0.53 -0.54 2.94 6.46 -1.83 -0.24 115.31 123.80 1vhk h LEU 93 Ca 0.28 -0.01 0.08 0.00 -0.12 0.00 0.00 57.88 58.12 1vhk h LEU 93 Cb 0.13 -0.13 -0.07 0.00 -0.73 0.00 0.00 40.66 39.86 1vhk h LEU 93 CO -0.03 0.38 0.18 -0.33 -0.62 0.00 0.00 178.44 178.01 1vhk h GLU 94 N 0.63 0.33 -0.78 1.25 5.08 -1.76 0.33 114.58 119.66 1vhk h GLU 94 Ca 0.18 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1vhk h GLU 94 Cb -0.06 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.08 1vhk h GLU 94 CO -0.05 0.22 0.40 2.35 -1.00 0.00 0.00 179.01 180.93 1vhk h TRP 95 N 0.34 1.09 -0.20 4.33 7.01 -1.21 -0.20 115.95 127.12 1vhk h TRP 95 Ca 0.27 -0.04 -0.03 0.00 2.11 0.00 0.00 58.89 61.20 1vhk h TRP 95 Cb 0.33 -0.35 -0.01 0.00 -2.10 0.00 0.00 29.16 27.04 1vhk h TRP 95 CO -0.18 0.78 -0.01 0.82 -2.79 0.00 0.00 178.44 177.05 1vhk h ILE 96 N 1.10 1.26 -0.67 2.65 2.04 0.13 -0.79 117.51 123.23 1vhk h ILE 96 Ca 0.27 -0.90 -0.08 0.00 1.00 0.00 0.00 64.86 65.15 1vhk h ILE 96 Cb 0.07 1.47 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 1vhk h ILE 96 CO -0.04 0.27 0.12 0.40 0.00 0.00 0.00 178.15 178.90 1vhk h ILE 97 N 0.10 1.26 0.47 -0.67 2.04 -0.18 0.17 117.51 120.70 1vhk h ILE 97 Ca 0.05 -1.02 -0.02 0.00 1.00 0.00 0.00 64.86 64.87 1vhk h ILE 97 Cb 0.41 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 1vhk h ILE 97 CO 0.01 0.39 -0.23 -0.61 0.00 0.00 0.00 178.15 177.71 1vhk h GLN 98 N 1.04 -0.61 0.00 2.37 4.15 -1.04 -0.89 115.11 120.13 1vhk h GLN 98 Ca 0.21 0.04 -0.05 0.00 0.77 0.00 0.00 58.65 59.62 1vhk h GLN 98 Cb 0.42 0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.25 1vhk h GLN 98 CO 0.01 -0.34 -0.23 0.87 -1.93 0.00 0.00 178.83 177.22 1vhk h LYS 99 N -1.09 0.00 -0.51 1.69 1.79 -1.20 -2.21 116.57 115.04 1vhk h LYS 99 Ca -0.06 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.38 1vhk h LYS 99 Cb 0.55 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.18 1vhk h LYS 99 CO 0.11 0.23 0.23 0.78 -1.08 0.00 0.00 179.45 179.72 1vhk h GLY 100 N 0.80 0.79 0.83 3.86 0.00 -0.67 -0.61 103.07 108.07 1vhk h GLY 100 Ca -0.00 -0.40 -0.07 0.00 0.00 0.00 0.00 47.33 46.85 1vhk h GLY 100 CO 0.03 0.38 -0.16 -0.84 0.00 0.00 0.00 176.54 175.96 1vhk h THR 101 N 0.68 1.32 -0.75 4.70 2.02 -0.79 -0.43 112.91 119.65 1vhk h THR 101 Ca 0.17 -1.27 0.15 0.00 0.77 0.00 0.00 66.41 66.22 1vhk h THR 101 Cb 0.14 1.68 -0.10 0.00 -1.74 0.00 0.00 68.15 68.13 1vhk h THR 101 CO -0.02 0.39 0.27 -0.33 0.37 0.00 0.00 175.52 176.20 1vhk h GLU 102 N 0.18 0.39 -0.37 6.66 5.08 -1.05 -1.09 114.58 124.38 1vhk h GLU 102 Ca 0.04 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1vhk h GLU 102 Cb 0.68 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1vhk h GLU 102 CO 0.04 0.26 0.00 1.28 -1.00 0.00 0.00 179.01 179.59 1vhk n LEU 103 N -5.04 1.27 0.00 1.33 4.77 -0.27 -4.91 117.00 114.16 1vhk n LEU 103 Ca 0.14 -0.64 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 1vhk n LEU 103 Cb 0.43 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1vhk n LEU 103 CO 0.17 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1vhk n GLY 104 N 0.62 0.59 3.54 -0.72 0.00 -0.41 -4.66 105.19 104.14 1vhk n GLY 104 Ca 0.06 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.61 1vhk n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vhk n ALA 105 N -1.50 -1.11 0.01 4.61 0.00 -0.19 -4.71 120.51 117.62 1vhk n ALA 105 Ca 0.00 0.43 -0.13 0.00 0.00 0.00 0.00 53.44 53.74 1vhk n ALA 105 Cb 0.00 -1.92 -0.14 0.00 0.00 0.00 0.00 19.45 17.40 1vhk n ALA 105 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1vhk h HIS 106 N 2.14 0.21 -1.70 0.00 2.76 -1.58 -3.43 115.15 113.55 1vhk h HIS 106 Ca -0.38 -0.16 0.13 0.00 -2.20 0.00 0.00 60.37 57.76 1vhk h HIS 106 Cb 1.37 -0.01 -0.21 0.00 1.55 0.00 0.00 27.41 30.11 1vhk h HIS 106 CO 0.48 1.25 0.61 0.00 -1.30 0.00 0.00 177.93 178.97 1vhk s ALA 107 N -2.61 -1.94 -0.04 5.26 0.00 -1.20 -3.53 121.76 117.70 1vhk s ALA 107 Ca -0.09 1.46 0.07 0.00 0.00 0.00 0.00 51.96 53.40 1vhk s ALA 107 Cb 0.08 -0.38 -0.01 0.00 0.00 0.00 0.00 23.12 22.81 1vhk s ALA 107 CO 0.82 -0.45 -0.25 -0.06 0.00 0.00 0.00 175.76 175.82 1vhk s PHE 108 N -1.86 2.37 -0.46 0.00 0.08 0.34 -1.86 117.98 116.59 1vhk s PHE 108 Ca 0.03 -0.62 0.03 0.00 0.12 0.00 0.00 56.93 56.49 1vhk s PHE 108 Cb -0.01 -1.55 0.14 0.00 -0.57 0.00 0.00 43.02 41.03 1vhk s PHE 108 CO -0.03 -0.15 0.25 0.42 -0.10 0.00 0.00 175.22 175.61 1vhk s ILE 109 N -0.31 1.65 0.30 0.64 1.01 -0.59 -4.22 121.20 119.66 1vhk s ILE 109 Ca 0.01 -2.74 -0.29 0.00 0.00 0.00 0.00 60.65 57.63 1vhk s ILE 109 Cb -0.12 -2.15 -0.10 0.00 0.01 0.00 0.00 42.46 40.10 1vhk s ILE 109 CO 0.02 -0.88 1.11 -2.16 0.00 0.00 0.00 174.94 173.02 1vhk s PRO 110 N 0.19 4.57 0.04 2.79 0.04 -1.26 -2.20 135.00 139.17 1vhk s PRO 110 Ca 0.18 1.81 -0.05 0.00 0.04 0.00 0.00 61.00 62.97 1vhk s PRO 110 Cb -0.24 -3.11 -0.01 0.00 0.04 0.00 0.00 34.50 31.17 1vhk s PRO 110 CO -0.00 0.15 0.08 -0.59 0.04 0.00 0.00 177.00 176.67 1vhk s PHE 111 N -1.21 0.24 0.03 0.56 -0.71 -0.88 -0.10 117.98 115.91 1vhk s PHE 111 Ca 0.46 -0.60 -0.30 0.00 -1.04 0.00 0.00 56.93 55.45 1vhk s PHE 111 Cb -0.32 -0.17 -0.05 0.00 -1.21 0.00 0.00 43.02 41.27 1vhk s PHE 111 CO 0.41 -0.38 1.28 -1.14 -1.34 0.00 0.00 175.22 174.04 1vhk s GLN 112 N -2.90 4.36 0.33 1.99 2.00 0.48 -1.48 119.66 124.44 1vhk s GLN 112 Ca -0.02 1.84 0.10 0.00 -2.00 0.00 0.00 55.36 55.28 1vhk s GLN 112 Cb 0.01 -3.43 -0.06 0.00 0.80 0.00 0.00 33.01 30.32 1vhk s GLN 112 CO -0.06 -0.40 -0.11 0.00 -0.50 0.00 0.00 175.29 174.22 1vhk s ALA 113 N 1.65 2.94 0.32 1.58 0.00 -1.26 -3.82 121.76 123.16 1vhk s ALA 113 Ca 0.60 -2.04 0.02 0.00 0.00 0.00 0.00 51.96 50.54 1vhk s ALA 113 Cb -0.30 -0.11 0.58 0.00 0.00 0.00 0.00 23.12 23.29 1vhk s ALA 113 CO 0.27 0.12 1.95 0.00 0.00 0.00 0.00 175.76 178.10 1vhk h ALA 114 N 2.05 1.55 -0.70 0.00 0.00 -1.96 -0.17 119.26 120.03 1vhk h ALA 114 Ca -0.42 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1vhk h ALA 114 Cb 1.25 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1vhk h ALA 114 CO 0.68 0.35 0.00 0.54 0.00 0.00 0.00 179.25 180.83 1vhk n ARG 115 N -4.46 2.62 -2.18 0.00 1.74 -1.26 -4.90 116.66 108.22 1vhk n ARG 115 Ca 0.11 -2.50 -0.43 0.00 -0.77 0.00 0.00 57.85 54.26 1vhk n ARG 115 Cb 0.15 -1.54 -0.02 0.00 -1.02 0.00 0.00 32.46 30.02 1vhk n ARG 115 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1vhk s SER 116 N -1.00 6.62 0.00 0.55 0.01 -0.08 -4.62 113.70 115.18 1vhk s SER 116 Ca 0.46 1.78 0.14 0.00 1.31 0.00 0.00 55.95 59.65 1vhk s SER 116 Cb 0.24 -2.53 0.84 0.00 0.21 0.00 0.00 66.02 64.77 1vhk s SER 116 CO 0.31 -1.03 1.41 1.33 0.41 0.00 0.00 173.24 175.68 1vhk n VAL 117 N 5.88 0.00 -4.41 3.43 0.24 -1.26 -4.80 118.33 117.40 1vhk n VAL 117 Ca 0.17 0.00 -0.26 0.00 -2.04 0.00 0.00 64.34 62.20 1vhk n VAL 117 Cb 0.45 -0.35 -0.12 0.00 -1.47 0.00 0.00 33.84 32.35 1vhk n VAL 117 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1vhk s VAL 118 N -2.00 2.30 0.07 3.34 0.11 -1.26 -5.12 120.40 117.83 1vhk s VAL 118 Ca 0.21 -2.02 0.06 0.00 -2.93 0.00 0.00 61.98 57.30 1vhk s VAL 118 Cb 0.10 -2.09 -0.03 0.00 -1.53 0.00 0.00 36.38 32.83 1vhk s VAL 118 CO 0.16 -0.13 -0.15 -0.54 -3.33 0.00 0.00 175.10 171.11 1vhk s LYS 119 N -2.67 0.91 -0.19 1.54 3.01 -1.26 -5.00 119.74 116.07 1vhk s LYS 119 Ca 0.20 -0.94 -0.14 0.00 -1.01 0.00 0.00 55.97 54.08 1vhk s LYS 119 Cb -0.08 -0.96 0.05 0.00 -1.01 0.00 0.00 37.83 35.84 1vhk s LYS 119 CO 0.09 0.22 0.48 -0.48 0.51 0.00 0.00 175.35 176.18 1vhk s LEU 120 N -1.60 -0.05 0.00 3.17 2.34 -1.26 -5.07 118.68 116.21 1vhk s LEU 120 Ca 0.00 1.00 -0.03 0.00 0.06 0.00 0.00 54.13 55.17 1vhk s LEU 120 Cb -0.09 1.63 0.06 0.00 -0.56 0.00 0.00 46.19 47.23 1vhk s LEU 120 CO 0.02 -0.18 0.39 -0.90 -1.06 0.00 0.00 176.35 174.62 1vhk n ASP 121 N 3.48 0.23 0.10 1.48 5.68 -1.26 -4.77 116.55 121.48 1vhk n ASP 121 Ca -0.18 -1.26 -0.14 0.00 -0.50 0.00 0.00 54.79 52.71 1vhk n ASP 121 Cb 0.56 -0.28 -0.07 0.00 -1.14 0.00 0.00 41.12 40.19 1vhk n ASP 121 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1vhk h ASP 122 N -0.40 -1.25 -0.20 -1.12 3.32 -2.02 -1.37 116.42 113.38 1vhk h ASP 122 Ca -0.13 0.14 0.05 0.00 0.02 0.00 0.00 57.03 57.12 1vhk h ASP 122 Cb 0.40 0.47 -0.06 0.00 0.22 0.00 0.00 39.33 40.37 1vhk h ASP 122 CO 0.11 -0.48 -0.15 0.50 -1.72 0.00 0.00 179.24 177.50 1vhk h LYS 123 N -0.62 -0.15 -0.16 3.56 1.63 -1.99 -1.94 116.57 116.90 1vhk h LYS 123 Ca 0.03 0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.83 1vhk h LYS 123 Cb 0.67 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.33 1vhk h LYS 123 CO -0.27 -0.10 0.05 0.87 -3.45 0.00 0.00 179.45 176.56 1vhk h LYS 124 N -0.15 0.24 -0.79 1.90 1.57 -1.89 -2.45 116.57 114.99 1vhk h LYS 124 Ca 0.12 -0.05 0.11 0.00 -1.87 0.00 0.00 60.65 58.96 1vhk h LYS 124 Cb 0.33 -0.04 -0.08 0.00 0.08 0.00 0.00 32.23 32.52 1vhk h LYS 124 CO -0.29 0.35 0.42 0.00 -0.57 0.00 0.00 179.45 179.35 1vhk h ALA 125 N 0.88 1.14 -0.12 3.86 0.00 -1.22 -1.85 119.26 121.94 1vhk h ALA 125 Ca 0.05 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1vhk h ALA 125 Cb 0.20 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1vhk h ALA 125 CO -0.00 -0.01 0.05 -0.22 0.00 0.00 0.00 179.25 179.07 1vhk h LYS 126 N 0.67 0.17 -0.32 0.00 3.64 -1.21 -1.67 116.57 117.85 1vhk h LYS 126 Ca 0.40 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.64 1vhk h LYS 126 Cb 0.46 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 1vhk h LYS 126 CO -0.29 0.25 -0.27 1.57 -2.27 0.00 0.00 179.45 178.44 1vhk h LYS 127 N 0.05 0.65 -0.62 1.90 2.10 -0.89 -2.53 116.57 117.24 1vhk h LYS 127 Ca 0.04 -0.28 -0.05 0.00 -2.00 0.00 0.00 60.65 58.36 1vhk h LYS 127 Cb 0.14 -0.02 -0.03 0.00 -0.90 0.00 0.00 32.23 31.42 1vhk h LYS 127 CO -0.00 0.86 0.17 0.87 -2.00 0.00 0.00 179.45 179.35 1vhk h LYS 128 N 0.56 0.98 0.00 0.07 1.57 -1.36 -2.53 116.57 115.86 1vhk h LYS 128 Ca 0.07 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 1vhk h LYS 128 Cb 0.76 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.93 1vhk h LYS 128 CO 0.06 0.88 -0.04 -0.09 -0.57 0.00 0.00 179.45 179.68 1vhk h ARG 129 N 0.90 0.00 -0.00 3.15 1.12 -0.99 -2.09 114.38 116.46 1vhk h ARG 129 Ca 0.20 0.00 -0.17 0.00 -1.11 0.00 0.00 59.98 58.90 1vhk h ARG 129 Cb 0.32 0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 30.26 1vhk h ARG 129 CO -0.00 0.04 -0.78 0.93 -3.11 0.00 0.00 179.97 177.05 1vhk h GLU 130 N 0.00 0.02 0.06 0.20 5.08 -1.04 -2.33 114.58 116.58 1vhk h GLU 130 Ca -0.00 -0.02 -0.25 0.00 -1.00 0.00 0.00 59.36 58.09 1vhk h GLU 130 Cb 0.61 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.87 1vhk h GLU 130 CO 0.01 0.79 -1.09 -0.09 -1.00 0.00 0.00 179.01 177.62 1vhk h ARG 131 N 0.01 0.40 -0.30 2.33 2.43 -1.36 -3.05 114.38 114.83 1vhk h ARG 131 Ca -0.01 -0.51 -0.02 0.00 -0.81 0.00 0.00 59.98 58.63 1vhk h ARG 131 Cb 1.38 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 31.08 1vhk h ARG 131 CO 0.10 1.19 0.13 -1.49 -1.51 0.00 0.00 179.97 178.39 1vhk h TRP 132 N 0.18 0.45 -0.57 2.20 6.55 -1.31 -0.72 115.95 122.73 1vhk h TRP 132 Ca -0.12 -0.03 0.11 0.00 0.95 0.00 0.00 58.89 59.80 1vhk h TRP 132 Cb 1.76 -0.14 -0.09 0.00 -0.86 0.00 0.00 29.16 29.84 1vhk h TRP 132 CO 0.07 0.43 0.09 1.15 -1.05 0.00 0.00 178.44 179.13 1vhk h THR 133 N 0.34 0.63 -0.46 1.49 2.02 -1.49 -0.74 112.91 114.70 1vhk h THR 133 Ca 0.10 -0.08 -0.07 0.00 0.77 0.00 0.00 66.41 67.13 1vhk h THR 133 Cb 0.16 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 1vhk h THR 133 CO -0.01 0.04 -0.01 0.50 0.37 0.00 0.00 175.52 176.41 1vhk h LYS 134 N 0.22 0.76 -0.31 6.66 3.64 -1.28 0.37 116.57 126.64 1vhk h LYS 134 Ca 0.30 -0.21 -0.11 0.00 -1.27 0.00 0.00 60.65 59.36 1vhk h LYS 134 Cb 0.45 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 1vhk h LYS 134 CO -0.41 0.78 -0.28 0.82 -2.27 0.00 0.00 179.45 178.10 1vhk h ILE 135 N 0.71 1.28 -0.12 2.00 2.04 -0.27 -2.03 117.51 121.12 1vhk h ILE 135 Ca 0.14 -1.37 -0.01 0.00 1.00 0.00 0.00 64.86 64.62 1vhk h ILE 135 Cb 0.46 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 1vhk h ILE 135 CO 0.02 0.44 0.04 0.00 0.00 0.00 0.00 178.15 178.65 1vhk h ALA 136 N 1.15 0.16 -0.28 1.87 0.00 -0.28 -2.24 119.26 119.65 1vhk h ALA 136 Ca 0.07 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 54.91 1vhk h ALA 136 Cb 0.76 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 1vhk h ALA 136 CO 0.06 -0.22 -0.05 -0.22 0.00 0.00 0.00 179.25 178.82 1vhk h LYS 137 N 0.01 0.02 -0.67 0.00 3.64 -0.86 0.66 116.57 119.37 1vhk h LYS 137 Ca 0.04 -0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.36 1vhk h LYS 137 Cb 0.22 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 1vhk h LYS 137 CO -0.00 0.01 0.17 1.49 -2.27 0.00 0.00 179.45 178.85 1vhk h GLU 138 N 0.02 1.06 -0.03 1.90 4.22 -1.35 -2.26 114.58 118.15 1vhk h GLU 138 Ca 0.13 -0.24 -0.12 0.00 0.08 0.00 0.00 59.36 59.21 1vhk h GLU 138 Cb 0.20 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1vhk h GLU 138 CO -0.27 0.93 -0.54 0.00 -2.18 0.00 0.00 179.01 176.96 1vhk h ALA 139 N 1.17 1.05 -0.27 2.92 0.00 -0.88 -2.09 119.26 121.16 1vhk h ALA 139 Ca 0.21 -0.49 -0.15 0.00 0.00 0.00 0.00 54.91 54.48 1vhk h ALA 139 Cb 0.35 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1vhk h ALA 139 CO -0.00 0.68 -0.45 0.00 0.00 0.00 0.00 179.25 179.48 1vhk h ALA 140 N 1.38 0.71 0.08 0.00 0.00 -0.50 -1.66 119.26 119.27 1vhk h ALA 140 Ca -0.00 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1vhk h ALA 140 Cb 0.97 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1vhk h ALA 140 CO 0.07 0.67 -0.04 0.93 0.00 0.00 0.00 179.25 180.89 1vhk h GLU 141 N 0.55 -0.10 -0.00 0.00 5.08 -1.07 -1.60 114.58 117.44 1vhk h GLU 141 Ca 0.04 0.01 -0.13 0.00 -1.00 0.00 0.00 59.36 58.28 1vhk h GLU 141 Cb 0.99 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 1vhk h GLU 141 CO 0.09 0.00 -0.60 1.96 -1.00 0.00 0.00 179.01 179.46 1vhk h GLN 142 N -0.18 0.00 -0.01 2.33 1.08 -1.39 -3.09 115.11 113.86 1vhk h GLN 142 Ca -0.01 -0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1vhk h GLN 142 Cb 0.15 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.58 1vhk h GLN 142 CO 0.02 0.61 -0.19 -1.13 -0.95 0.00 0.00 178.83 177.19 1vhk n SER 143 N -3.82 1.17 -1.76 1.46 3.41 -0.63 -4.95 113.62 108.50 1vhk n SER 143 Ca -0.01 -1.06 -0.11 0.00 -0.26 0.00 0.00 58.87 57.42 1vhk n SER 143 Cb 0.60 0.10 0.03 0.00 -0.26 0.00 0.00 64.21 64.68 1vhk n SER 143 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1vhk n TYR 144 N -0.41 -1.14 -1.12 7.33 0.53 -0.79 -5.01 117.16 116.54 1vhk n TYR 144 Ca 0.14 0.35 -0.32 0.00 -1.02 0.00 0.00 57.90 57.06 1vhk n TYR 144 Cb 0.35 -2.81 0.11 0.00 -1.03 0.00 0.00 39.34 35.96 1vhk n TYR 144 CO 0.00 0.00 0.00 1.03 -1.02 0.00 0.00 176.86 176.87 1vhk s ARG 145 N -5.32 1.86 0.00 -0.72 1.81 -0.67 -4.76 118.95 111.15 1vhk s ARG 145 Ca 0.20 1.38 0.26 0.00 -1.72 0.00 0.00 55.73 55.86 1vhk s ARG 145 Cb -0.09 -1.84 0.77 0.00 -0.45 0.00 0.00 34.95 33.34 1vhk s ARG 145 CO 0.25 -1.98 1.57 0.09 -0.68 0.00 0.00 175.30 174.56 1vhk n ASN 146 N -3.59 1.00 -3.63 0.23 4.13 -1.26 -4.91 115.26 107.22 1vhk n ASN 146 Ca 0.11 -0.87 -0.16 0.00 1.68 0.00 0.00 54.58 55.34 1vhk n ASN 146 Cb 0.52 0.13 -0.07 0.00 -1.54 0.00 0.00 39.78 38.82 1vhk n ASN 146 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1vhk s GLU 147 N -2.51 0.87 -0.19 3.52 2.02 -1.26 -4.01 118.70 117.14 1vhk s GLU 147 Ca 0.24 0.05 -0.14 0.00 0.02 0.00 0.00 54.97 55.14 1vhk s GLU 147 Cb 0.19 0.40 -0.04 0.00 0.10 0.00 0.00 34.13 34.78 1vhk s GLU 147 CO 0.52 -0.26 0.32 0.08 0.02 0.00 0.00 175.26 175.95 1vhk s VAL 148 N -1.24 5.26 0.48 2.63 1.01 -1.26 -4.93 120.40 122.35 1vhk s VAL 148 Ca -0.12 0.57 -0.23 0.00 0.00 0.00 0.00 61.98 62.20 1vhk s VAL 148 Cb -0.02 -3.66 -0.07 0.00 0.00 0.00 0.00 36.38 32.63 1vhk s VAL 148 CO 0.07 0.32 1.22 -2.84 0.00 0.00 0.00 175.10 173.87 1vhk s PRO 149 N 0.95 3.62 -0.13 2.72 0.02 -1.26 -5.00 135.00 135.91 1vhk s PRO 149 Ca 0.16 1.92 -0.23 0.00 0.02 0.00 0.00 61.00 62.88 1vhk s PRO 149 Cb -0.14 -2.40 -0.03 0.00 0.02 0.00 0.00 34.50 31.95 1vhk s PRO 149 CO 0.06 -0.71 0.69 0.50 -0.33 0.00 0.00 177.00 177.21 1vhk s ARG 150 N -2.71 4.33 0.46 5.54 3.52 -1.23 -4.81 118.95 124.05 1vhk s ARG 150 Ca 0.65 0.80 0.08 0.00 -0.13 0.00 0.00 55.73 57.13 1vhk s ARG 150 Cb -0.32 -3.51 0.02 0.00 -1.56 0.00 0.00 34.95 29.57 1vhk s ARG 150 CO 0.39 -0.11 0.57 0.08 -0.81 0.00 0.00 175.30 175.42 1vhk s VAL 151 N 1.43 2.68 0.15 7.11 1.01 -1.26 -0.51 120.40 131.02 1vhk s VAL 151 Ca 0.34 -1.09 -0.15 0.00 0.00 0.00 0.00 61.98 61.08 1vhk s VAL 151 Cb -0.17 -2.77 -0.07 0.00 0.00 0.00 0.00 36.38 33.37 1vhk s VAL 151 CO 0.14 0.00 0.57 -1.81 0.00 0.00 0.00 175.10 174.00 1vhk s ASP 153 N -4.37 6.86 -0.12 3.32 -0.00 -1.26 -4.91 116.67 116.18 1vhk s ASP 153 Ca 0.54 1.12 -0.35 0.00 -0.00 0.00 0.00 52.55 53.87 1vhk s ASP 153 Cb -0.07 -2.31 -0.12 0.00 -0.00 0.00 0.00 42.92 40.42 1vhk s ASP 153 CO 0.33 0.10 1.89 1.33 -0.00 0.00 0.00 175.17 178.81 1vhk n VAL 154 N 0.81 0.55 -3.46 -1.27 0.24 -1.26 -4.64 118.33 109.30 1vhk n VAL 154 Ca -0.05 -0.11 -0.30 0.00 -2.04 0.00 0.00 64.34 61.83 1vhk n VAL 154 Cb 0.52 -1.83 -0.04 0.00 -1.47 0.00 0.00 33.84 31.01 1vhk n VAL 154 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1vhk s HIS 155 N 4.24 3.46 0.78 6.34 3.76 0.85 -4.93 115.29 129.80 1vhk s HIS 155 Ca 0.94 0.69 -0.12 0.00 -0.15 0.00 0.00 55.06 56.42 1vhk s HIS 155 Cb -0.72 -2.12 0.06 0.00 1.11 0.00 0.00 32.58 30.91 1vhk s HIS 155 CO 0.53 0.28 1.16 -1.54 -0.85 0.00 0.00 174.74 174.31 1vhk s SER 156 N -2.71 4.75 0.10 1.40 1.04 -1.26 -0.39 113.70 116.62 1vhk s SER 156 Ca 0.44 0.88 -0.17 0.00 0.48 0.00 0.00 55.95 57.58 1vhk s SER 156 Cb -0.11 -1.45 -0.06 0.00 0.10 0.00 0.00 66.02 64.49 1vhk s SER 156 CO 0.26 -1.76 1.53 0.15 0.98 0.00 0.00 173.24 174.39 1vhk h PHE 157 N -0.96 0.57 -0.66 5.02 3.04 -1.95 -2.48 116.94 119.53 1vhk h PHE 157 Ca -0.46 -0.10 0.08 0.00 3.98 0.00 0.00 57.97 61.47 1vhk h PHE 157 Cb 1.31 -0.15 -0.11 0.00 2.56 0.00 0.00 35.95 39.56 1vhk h PHE 157 CO 0.36 0.67 -0.50 0.37 -2.02 0.00 0.00 178.31 177.19 1vhk h GLN 158 N 0.31 -0.20 -0.84 1.11 -0.00 -1.93 0.16 115.11 113.72 1vhk h GLN 158 Ca 0.08 0.01 0.16 0.00 -0.00 0.00 0.00 58.65 58.91 1vhk h GLN 158 Cb 0.45 0.05 -0.06 0.00 0.00 0.00 0.00 27.48 27.91 1vhk h GLN 158 CO 0.02 -0.14 0.55 1.96 0.00 0.00 0.00 178.83 181.22 1vhk h GLN 159 N -0.21 0.48 -0.08 1.69 4.20 -1.92 -0.84 115.11 118.44 1vhk h GLN 159 Ca 0.16 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.83 1vhk h GLN 159 Cb 0.54 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.21 1vhk h GLN 159 CO -0.74 0.32 0.03 1.25 -0.67 0.00 0.00 178.83 179.01 1vhk h LEU 160 N 0.50 0.11 -0.53 1.46 5.85 -0.26 -2.09 115.31 120.35 1vhk h LEU 160 Ca 0.42 -0.19 0.07 0.00 0.84 0.00 0.00 57.88 59.03 1vhk h LEU 160 Cb 0.90 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.84 1vhk h LEU 160 CO -0.16 0.27 0.20 -0.07 -0.34 0.00 0.00 178.44 178.33 1vhk h LEU 161 N -0.05 0.21 -1.70 2.25 4.07 -0.08 0.13 115.31 120.14 1vhk h LEU 161 Ca 0.03 0.06 0.08 0.00 0.08 0.00 0.00 57.88 58.13 1vhk h LEU 161 Cb 0.20 0.04 -0.03 0.00 1.08 0.00 0.00 40.66 41.94 1vhk h LEU 161 CO -0.00 0.14 0.35 1.56 -1.08 0.00 0.00 178.44 179.42 1vhk h GLN 162 N 0.38 0.34 -3.82 1.13 4.20 -0.93 -3.39 115.11 113.03 1vhk h GLN 162 Ca 0.25 -0.02 -0.73 0.00 0.06 0.00 0.00 58.65 58.21 1vhk h GLN 162 Cb 0.27 -0.08 -0.10 0.00 0.30 0.00 0.00 27.48 27.87 1vhk h GLN 162 CO -0.25 0.23 2.52 0.54 -0.67 0.00 0.00 178.83 181.19 1vhk n ARG 163 N -4.47 3.26 0.00 1.46 1.74 0.03 -4.75 116.66 113.93 1vhk n ARG 163 Ca 0.08 -3.11 0.00 0.00 -0.77 0.00 0.00 57.85 54.05 1vhk n ARG 163 Cb 0.34 -3.11 0.00 0.00 -1.02 0.00 0.00 32.46 28.67 1vhk n ARG 163 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1vhk n GLN 165 N 5.03 0.00 0.00 5.56 -0.00 -1.26 -4.28 117.38 122.43 1vhk n GLN 165 Ca 0.45 0.00 0.07 0.00 -0.00 0.00 0.00 57.00 57.52 1vhk n GLN 165 Cb 0.38 -0.29 0.35 0.00 -0.00 0.00 0.00 30.24 30.68 1vhk n GLN 165 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1vhk n ASP 166 N 0.00 0.00 -4.57 2.61 10.43 -1.26 -4.81 116.55 118.95 1vhk n ASP 166 Ca 0.00 0.04 -0.31 0.00 2.57 0.00 0.00 54.79 57.10 1vhk n ASP 166 Cb 0.00 -0.26 -0.10 0.00 1.84 0.00 0.00 41.12 42.60 1vhk n ASP 166 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1vhk s PHE 167 N -2.52 2.78 0.20 1.24 0.40 -1.26 -4.98 117.98 113.84 1vhk s PHE 167 Ca 0.14 -0.12 -0.09 0.00 -0.60 0.00 0.00 56.93 56.25 1vhk s PHE 167 Cb 0.09 -1.50 0.13 0.00 0.51 0.00 0.00 43.02 42.26 1vhk s PHE 167 CO 0.20 0.39 1.77 -0.44 0.70 0.00 0.00 175.22 177.84 1vhk h ASP 168 N 4.01 1.00 -5.08 1.36 3.45 -1.56 -3.44 116.42 116.15 1vhk h ASP 168 Ca -0.48 -0.16 -0.10 0.00 0.43 0.00 0.00 57.03 56.72 1vhk h ASP 168 Cb 1.17 -0.26 -0.16 0.00 -0.56 0.00 0.00 39.33 39.51 1vhk h ASP 168 CO 0.53 0.88 -0.35 -0.54 -1.57 0.00 0.00 179.24 178.19 1vhk s LYS 169 N -5.60 0.76 -0.12 3.56 1.02 -1.13 -5.05 119.74 113.18 1vhk s LYS 169 Ca -0.13 -0.67 -0.04 0.00 0.02 0.00 0.00 55.97 55.16 1vhk s LYS 169 Cb 0.15 0.32 0.06 0.00 -0.52 0.00 0.00 37.83 37.83 1vhk s LYS 169 CO 0.82 -0.23 0.15 0.00 -0.92 0.00 0.00 175.35 175.17 1vhk s VAL 171 N 2.27 4.72 -0.38 0.00 0.11 0.47 -1.28 120.40 126.30 1vhk s VAL 171 Ca 0.04 -0.09 -0.08 0.00 -2.93 0.00 0.00 61.98 58.92 1vhk s VAL 171 Cb -0.13 -3.03 0.06 0.00 -1.53 0.00 0.00 36.38 31.74 1vhk s VAL 171 CO -0.07 0.58 0.18 -0.69 -3.33 0.00 0.00 175.10 171.78 1vhk s VAL 172 N -0.68 4.02 -0.56 2.04 1.01 -0.16 -1.42 120.40 124.65 1vhk s VAL 172 Ca 0.12 -1.27 -0.28 0.00 0.00 0.00 0.00 61.98 60.55 1vhk s VAL 172 Cb -0.12 -3.38 0.01 0.00 0.00 0.00 0.00 36.38 32.89 1vhk s VAL 172 CO 0.02 -0.35 1.51 0.00 0.00 0.00 0.00 175.10 176.28 1vhk s ALA 173 N 1.41 2.71 0.31 5.51 0.00 -0.57 -1.50 121.76 129.64 1vhk s ALA 173 Ca 0.01 -0.63 -0.19 0.00 0.00 0.00 0.00 51.96 51.15 1vhk s ALA 173 Cb -0.21 -4.13 0.03 0.00 0.00 0.00 0.00 23.12 18.81 1vhk s ALA 173 CO 0.03 -3.07 0.74 -0.47 0.00 0.00 0.00 175.76 172.98 1vhk s TYR 174 N 6.57 -0.09 -0.05 0.00 5.04 -1.11 -4.60 117.35 123.10 1vhk s TYR 174 Ca 0.56 -0.44 -0.06 0.00 -2.44 0.00 0.00 57.07 54.69 1vhk s TYR 174 Cb -0.12 0.74 0.01 0.00 0.35 0.00 0.00 41.96 42.95 1vhk s TYR 174 CO 0.24 -1.34 0.15 -1.83 -1.34 0.00 0.00 175.55 171.44 1vhk s GLU 175 N -3.42 0.21 -0.66 4.97 -1.05 -1.26 -3.89 118.70 113.60 1vhk s GLU 175 Ca 0.13 0.16 0.06 0.00 -0.15 0.00 0.00 54.97 55.16 1vhk s GLU 175 Cb -0.06 0.10 0.25 0.00 -0.44 0.00 0.00 34.13 33.98 1vhk s GLU 175 CO 0.08 -0.03 0.77 0.43 0.95 0.00 0.00 175.26 177.47 1vhk n SER 184 N 2.85 3.87 0.23 0.83 7.64 -1.26 -5.14 113.62 122.64 1vhk n SER 184 Ca -0.13 -3.44 0.11 0.00 1.01 0.00 0.00 58.87 56.41 1vhk n SER 184 Cb 0.59 -0.70 0.50 0.00 -1.01 0.00 0.00 64.21 63.59 1vhk n SER 184 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1vhk h ALA 185 N 4.27 1.04 0.07 -0.43 0.00 -1.92 -3.36 119.26 118.93 1vhk h ALA 185 Ca 0.20 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1vhk h ALA 185 Cb 0.66 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 1vhk h ALA 185 CO 0.86 0.25 -0.45 0.35 0.00 0.00 0.00 179.25 180.26 1vhk h PHE 186 N 0.00 -1.30 -0.39 0.00 3.57 -1.90 0.77 116.94 117.68 1vhk h PHE 186 Ca -0.00 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.59 1vhk h PHE 186 Cb 0.69 0.56 -0.05 0.00 2.79 0.00 0.00 35.95 39.94 1vhk h PHE 186 CO 0.00 -0.50 0.10 0.66 -2.23 0.00 0.00 178.31 176.35 1vhk h SER 187 N -0.61 0.07 -0.55 0.41 4.64 -1.97 0.31 113.55 115.86 1vhk h SER 187 Ca -0.00 0.06 0.06 0.00 -0.47 0.00 0.00 61.79 61.44 1vhk h SER 187 Cb 0.63 0.06 -0.06 0.00 -0.31 0.00 0.00 62.40 62.72 1vhk h SER 187 CO -0.26 0.07 0.25 0.00 -0.87 0.00 0.00 176.83 176.02 1vhk h ALA 188 N 1.27 0.70 0.02 5.18 0.00 -1.62 0.52 119.26 125.34 1vhk h ALA 188 Ca 0.18 0.05 -0.24 0.00 0.00 0.00 0.00 54.91 54.90 1vhk h ALA 188 Cb 0.19 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.97 1vhk h ALA 188 CO -0.22 -0.13 -1.00 -0.84 0.00 0.00 0.00 179.25 177.06 1vhk h ILE 189 N 0.46 1.38 -0.38 0.00 -0.00 0.12 -3.20 117.51 115.89 1vhk h ILE 189 Ca 0.26 -2.46 -0.16 0.00 -0.00 0.00 0.00 64.86 62.50 1vhk h ILE 189 Cb 0.23 2.47 -0.01 0.00 -0.00 0.00 0.00 36.82 39.52 1vhk h ILE 189 CO -0.22 0.74 -0.40 0.58 -0.00 0.00 0.00 178.15 178.85 1vhk h VAL 190 N 0.25 1.27 0.00 0.16 2.07 -0.02 -3.14 116.25 116.84 1vhk h VAL 190 Ca -0.10 -1.57 -0.01 0.00 0.82 0.00 0.00 66.70 65.84 1vhk h VAL 190 Cb 1.65 1.40 -0.00 0.00 -1.52 0.00 0.00 31.29 32.83 1vhk h VAL 190 CO 0.18 0.53 -0.03 0.77 0.02 0.00 0.00 177.57 179.03 1vhk h SER 191 N 0.75 0.00 1.04 0.57 4.64 -1.02 -3.04 113.55 116.50 1vhk h SER 191 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1vhk h SER 191 Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1vhk h SER 191 CO 0.10 0.03 -0.58 0.77 -0.87 0.00 0.00 176.83 176.28 1vhk h SER 192 N 0.00 0.00 -3.24 4.97 4.64 -1.54 -3.47 113.55 114.92 1vhk h SER 192 Ca -0.00 -0.13 -0.53 0.00 -0.47 0.00 0.00 61.79 60.66 1vhk h SER 192 Cb 0.56 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.66 1vhk h SER 192 CO 0.00 0.07 0.58 -0.76 -0.87 0.00 0.00 176.83 175.85 1vhk s LEU 193 N -4.62 4.39 0.50 5.97 1.43 -1.15 -5.01 118.68 120.18 1vhk s LEU 193 Ca 0.06 2.10 -0.20 0.00 -1.03 0.00 0.00 54.13 55.05 1vhk s LEU 193 Cb 0.12 -3.59 -0.08 0.00 0.03 0.00 0.00 46.19 42.67 1vhk s LEU 193 CO 0.72 -0.47 1.06 -2.84 0.23 0.00 0.00 176.35 175.05 1vhk s PRO 194 N 0.77 3.70 0.25 1.29 0.02 -1.26 -4.95 135.00 134.82 1vhk s PRO 194 Ca 0.58 1.40 -0.31 0.00 0.02 0.00 0.00 61.00 62.70 1vhk s PRO 194 Cb -0.31 -2.08 -0.13 0.00 0.02 0.00 0.00 34.50 32.00 1vhk s PRO 194 CO 0.31 -0.52 1.45 1.17 -0.33 0.00 0.00 177.00 179.08 1vhk n LYS 195 N -1.06 2.19 -0.47 5.54 4.81 -1.26 -1.18 118.16 126.74 1vhk n LYS 195 Ca 0.10 0.78 0.00 0.00 -0.87 0.00 0.00 58.31 58.32 1vhk n LYS 195 Cb 0.52 -2.46 0.00 0.00 0.02 0.00 0.00 35.03 33.11 1vhk n LYS 195 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1vhk n GLY 196 N 2.15 0.91 3.88 3.14 0.00 -0.36 -5.03 105.19 109.88 1vhk n GLY 196 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1vhk n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1vhk s SER 197 N -3.02 6.43 -0.19 1.61 1.04 -0.32 -4.77 113.70 114.48 1vhk s SER 197 Ca 0.00 1.20 -0.04 0.00 0.48 0.00 0.00 55.95 57.59 1vhk s SER 197 Cb 0.00 -2.36 -0.02 0.00 0.10 0.00 0.00 66.02 63.74 1vhk s SER 197 CO 0.00 -0.55 -0.03 -0.94 0.98 0.00 0.00 173.24 172.71 1vhk s SER 198 N -3.52 4.66 -0.11 7.02 1.04 -1.26 -1.67 113.70 119.85 1vhk s SER 198 Ca 0.52 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.72 1vhk s SER 198 Cb -0.10 -1.78 -0.02 0.00 0.10 0.00 0.00 66.02 64.21 1vhk s SER 198 CO 0.38 0.08 -0.11 -0.22 0.98 0.00 0.00 173.24 174.35 1vhk s LEU 199 N 0.90 2.84 -0.13 2.42 2.96 -0.18 -1.43 118.68 126.05 1vhk s LEU 199 Ca 0.00 -0.24 -0.05 0.00 -0.22 0.00 0.00 54.13 53.62 1vhk s LEU 199 Cb -0.14 -1.63 -0.04 0.00 0.50 0.00 0.00 46.19 44.88 1vhk s LEU 199 CO 0.01 0.22 0.04 -0.22 -1.32 0.00 0.00 176.35 175.08 1vhk s LEU 200 N 0.03 3.74 -0.11 -0.68 2.96 0.12 0.07 118.68 124.81 1vhk s LEU 200 Ca -0.04 0.14 -0.01 0.00 -0.22 0.00 0.00 54.13 54.01 1vhk s LEU 200 Cb -0.14 -1.90 0.03 0.00 0.50 0.00 0.00 46.19 44.67 1vhk s LEU 200 CO 0.04 0.29 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.67 1vhk s ILE 201 N -0.33 0.86 -0.08 6.68 1.01 -0.34 -0.39 121.20 128.60 1vhk s ILE 201 Ca 0.08 -0.20 0.03 0.00 0.00 0.00 0.00 60.65 60.55 1vhk s ILE 201 Cb -0.12 -0.93 -0.02 0.00 0.01 0.00 0.00 42.46 41.40 1vhk s ILE 201 CO 0.02 0.33 -0.16 0.68 0.00 0.00 0.00 174.94 175.81 1vhk s VAL 202 N 1.77 2.88 -0.00 2.92 -7.23 -0.51 -0.54 120.40 119.69 1vhk s VAL 202 Ca 0.05 -0.76 0.07 0.00 -1.81 0.00 0.00 61.98 59.53 1vhk s VAL 202 Cb -0.13 -2.15 -0.02 0.00 0.56 0.00 0.00 36.38 34.65 1vhk s VAL 202 CO -0.07 0.56 -0.23 -0.36 -0.31 0.00 0.00 175.10 174.68 1vhk s PHE 203 N -0.20 2.08 0.82 2.82 0.40 -0.33 -1.51 117.98 122.06 1vhk s PHE 203 Ca -0.00 -0.39 -0.07 0.00 -0.60 0.00 0.00 56.93 55.86 1vhk s PHE 203 Cb -0.13 -1.32 0.15 0.00 0.51 0.00 0.00 43.02 42.23 1vhk s PHE 203 CO 0.03 -0.00 1.13 0.20 0.70 0.00 0.00 175.22 177.28 1vhk s GLY 204 N -0.69 1.76 0.00 4.36 0.00 -1.26 -1.49 107.32 110.00 1vhk s GLY 204 Ca 0.09 -1.45 0.00 0.00 0.00 0.00 0.00 44.72 43.36 1vhk s GLY 204 CO -0.00 -0.81 0.00 -1.55 0.00 0.00 0.00 173.10 170.73 1vhk n PRO 205 N -3.22 -0.18 -0.26 2.90 -0.04 -1.26 -4.43 135.00 128.52 1vhk n PRO 205 Ca 0.14 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.67 1vhk n PRO 205 Cb 0.60 0.00 0.20 0.00 -0.04 0.00 0.00 33.50 34.26 1vhk n PRO 205 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1vhk h GLU 206 N 0.00 0.28 -0.55 0.54 3.07 -1.87 -0.12 114.58 115.93 1vhk h GLU 206 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 1vhk h GLU 206 Cb 0.00 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 27.85 1vhk h GLU 206 CO 0.00 0.19 0.00 0.41 -1.40 0.00 0.00 179.01 178.21 1vhk n GLY 207 N -1.35 0.47 0.76 -3.84 0.00 -1.26 -4.92 105.19 95.04 1vhk n GLY 207 Ca 0.15 -0.04 0.10 0.00 0.00 0.00 0.00 46.02 46.23 1vhk n GLY 207 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vhk n GLY 208 N 0.27 -2.09 3.87 -0.02 0.00 -0.06 -4.90 105.19 102.25 1vhk n GLY 208 Ca 0.01 -1.31 -0.30 0.00 0.00 0.00 0.00 46.02 44.42 1vhk n GLY 208 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vhk s LEU 209 N -5.72 3.83 0.50 0.99 1.43 -1.26 -4.26 118.68 114.19 1vhk s LEU 209 Ca 0.00 1.15 -0.02 0.00 -1.03 0.00 0.00 54.13 54.23 1vhk s LEU 209 Cb 0.00 -4.03 0.00 0.00 0.03 0.00 0.00 46.19 42.19 1vhk s LEU 209 CO 0.00 -0.40 0.75 0.42 0.23 0.00 0.00 176.35 177.36 1vhk s THR 210 N -2.36 3.88 0.14 5.49 -4.23 -1.26 -4.92 115.64 112.37 1vhk s THR 210 Ca 0.52 -0.31 -0.19 0.00 -1.18 0.00 0.00 61.69 60.52 1vhk s THR 210 Cb -0.10 -3.47 0.00 0.00 1.34 0.00 0.00 72.50 70.27 1vhk s THR 210 CO 0.31 -0.39 1.70 -0.33 -0.54 0.00 0.00 174.62 175.37 1vhk h GLU 211 N 0.19 0.03 -0.68 3.99 5.08 -1.99 0.15 114.58 121.36 1vhk h GLU 211 Ca -0.46 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1vhk h GLU 211 Cb 1.25 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 1vhk h GLU 211 CO 0.58 0.02 0.42 0.00 -1.00 0.00 0.00 179.01 179.03 1vhk h ALA 212 N 1.24 0.86 -0.79 3.43 0.00 -1.99 0.28 119.26 122.29 1vhk h ALA 212 Ca 0.12 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1vhk h ALA 212 Cb 0.18 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1vhk h ALA 212 CO -0.24 0.33 0.48 0.93 0.00 0.00 0.00 179.25 180.74 1vhk h GLU 213 N 0.92 1.08 -0.58 0.00 5.08 -1.44 -1.68 114.58 117.96 1vhk h GLU 213 Ca 0.24 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.47 1vhk h GLU 213 Cb -0.04 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 28.95 1vhk h GLU 213 CO -0.05 0.76 0.23 0.28 -1.00 0.00 0.00 179.01 179.24 1vhk h VAL 214 N 1.09 1.23 -0.27 3.13 2.07 -0.16 -2.12 116.25 121.22 1vhk h VAL 214 Ca 0.28 -0.71 0.04 0.00 0.82 0.00 0.00 66.70 67.14 1vhk h VAL 214 Cb -0.04 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.30 1vhk h VAL 214 CO -0.05 0.28 0.01 -0.33 0.02 0.00 0.00 177.57 177.50 1vhk h GLU 215 N 0.80 0.10 -0.29 1.57 5.08 -0.15 -0.18 114.58 121.51 1vhk h GLU 215 Ca 0.19 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 1vhk h GLU 215 Cb 0.21 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1vhk h GLU 215 CO -0.02 0.06 0.11 0.00 -1.00 0.00 0.00 179.01 178.17 1vhk h ARG 216 N 0.10 0.40 -0.03 2.33 2.47 -1.16 -2.04 114.38 116.45 1vhk h ARG 216 Ca 0.13 -0.04 -0.15 0.00 -1.26 0.00 0.00 59.98 58.66 1vhk h ARG 216 Cb 0.16 -0.08 0.01 0.00 -1.65 0.00 0.00 29.97 28.41 1vhk h ARG 216 CO -0.20 0.33 -0.55 -0.07 0.56 0.00 0.00 179.97 180.04 1vhk h LEU 217 N 0.40 0.54 -1.72 3.04 3.38 -0.55 -3.20 115.31 117.20 1vhk h LEU 217 Ca 0.10 -0.72 -0.03 0.00 0.09 0.00 0.00 57.88 57.32 1vhk h LEU 217 Cb 0.09 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1vhk h LEU 217 CO -0.01 1.19 -0.14 0.71 0.09 0.00 0.00 178.44 180.27 1vhk h THR 218 N -0.06 1.10 -0.07 0.22 1.35 -0.92 0.71 112.91 115.24 1vhk h THR 218 Ca -0.06 -0.49 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 1vhk h THR 218 Cb 1.24 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 68.93 1vhk h THR 218 CO 0.11 0.14 0.00 -1.84 -0.25 0.00 0.00 175.52 173.68 1vhk n GLU 219 N -4.36 1.17 -0.03 4.72 0.28 -0.78 -1.16 120.64 120.47 1vhk n GLU 219 Ca -0.03 -0.26 0.02 0.00 -0.16 0.00 0.00 57.16 56.73 1vhk n GLU 219 Cb 0.21 -1.12 0.03 0.00 1.43 0.00 0.00 31.44 31.99 1vhk n GLU 219 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1vhk n GLN 220 N -0.35 2.13 -0.66 3.44 1.13 -0.62 -4.97 117.38 117.47 1vhk n GLN 220 Ca 0.05 -1.53 0.00 0.00 -1.94 0.00 0.00 57.00 53.58 1vhk n GLN 220 Cb 0.08 -1.00 0.00 0.00 0.11 0.00 0.00 30.24 29.43 1vhk n GLN 220 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1vhk n ASP 221 N -0.58 -1.43 -4.73 1.08 10.43 -0.31 -4.87 116.55 116.15 1vhk n ASP 221 Ca 0.03 0.00 -0.42 0.00 2.57 0.00 0.00 54.79 56.97 1vhk n ASP 221 Cb 0.38 -0.24 -0.03 0.00 1.84 0.00 0.00 41.12 43.07 1vhk n ASP 221 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 1vhk s GLY 222 N -1.91 2.05 -0.32 0.44 0.00 0.15 -4.64 107.32 103.10 1vhk s GLY 222 Ca 0.00 1.21 -0.11 0.00 0.00 0.00 0.00 44.72 45.83 1vhk s GLY 222 CO 0.00 2.34 0.18 0.14 0.00 0.00 0.00 173.10 175.76 1vhk s VAL 223 N 0.69 4.79 0.31 1.40 1.01 -0.41 -3.76 120.40 124.43 1vhk s VAL 223 Ca 0.63 -0.38 -0.29 0.00 0.00 0.00 0.00 61.98 61.94 1vhk s VAL 223 Cb -0.39 -3.46 -0.11 0.00 0.00 0.00 0.00 36.38 32.42 1vhk s VAL 223 CO 0.35 0.03 1.55 0.42 0.00 0.00 0.00 175.10 177.45 1vhk s THR 224 N 1.64 2.11 0.02 3.92 -4.23 -1.26 -0.99 115.64 116.85 1vhk s THR 224 Ca 0.05 0.10 0.01 0.00 -1.18 0.00 0.00 61.69 60.67 1vhk s THR 224 Cb -0.17 -3.06 -0.01 0.00 1.34 0.00 0.00 72.50 70.59 1vhk s THR 224 CO 0.07 0.02 -0.04 0.00 -0.54 0.00 0.00 174.62 174.13 1vhk s GLY 226 N -0.98 2.37 -0.32 0.00 0.00 -1.25 -2.76 107.32 104.37 1vhk s GLY 226 Ca -0.08 -0.09 0.09 0.00 0.00 0.00 0.00 44.72 44.65 1vhk s GLY 226 CO -0.00 0.13 1.71 1.04 0.00 0.00 0.00 173.10 175.97 1vhk n LEU 227 N 0.07 5.52 0.00 0.66 4.77 -1.26 -4.79 117.00 121.96 1vhk n LEU 227 Ca 0.00 -3.40 0.00 0.00 -0.03 0.00 0.00 56.01 52.58 1vhk n LEU 227 Cb 0.52 -0.72 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 1vhk n LEU 227 CO 0.43 0.94 0.00 0.61 -1.33 0.00 0.00 177.39 178.04 1vhk n GLY 228 N -0.62 1.85 0.15 -0.72 0.00 -1.26 -4.88 105.19 99.71 1vhk n GLY 228 Ca 0.41 -2.23 0.12 0.00 0.00 0.00 0.00 46.02 44.32 1vhk n GLY 228 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vhk h PRO 229 N 0.00 0.00 -6.51 1.61 0.13 -2.06 -3.46 132.00 121.71 1vhk h PRO 229 Ca 0.00 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.60 1vhk h PRO 229 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 1vhk h PRO 229 CO 0.00 0.00 -0.09 1.03 -0.23 0.00 0.00 178.00 178.71 1vhk s ARG 230 N -3.23 3.76 -0.18 0.86 0.52 -1.26 -5.04 118.95 114.38 1vhk s ARG 230 Ca 0.05 0.24 -0.29 0.00 -0.52 0.00 0.00 55.73 55.21 1vhk s ARG 230 Cb 0.09 -2.61 -0.00 0.00 0.52 0.00 0.00 34.95 32.95 1vhk s ARG 230 CO 0.70 0.24 1.08 0.42 0.02 0.00 0.00 175.30 177.76 1vhk s ILE 231 N -1.96 4.62 -0.13 1.52 -1.09 -1.26 -4.99 121.20 117.91 1vhk s ILE 231 Ca 0.47 1.93 -0.05 0.00 -2.23 0.00 0.00 60.65 60.78 1vhk s ILE 231 Cb -0.11 -4.25 -0.04 0.00 -1.58 0.00 0.00 42.46 36.49 1vhk s ILE 231 CO 0.24 -0.12 0.05 -0.76 -1.23 0.00 0.00 174.94 173.12 1vhk s LEU 232 N 2.93 3.80 0.97 2.97 1.02 -1.26 -5.12 118.68 123.98 1vhk s LEU 232 Ca 0.47 0.17 -0.12 0.00 0.02 0.00 0.00 54.13 54.67 1vhk s LEU 232 Cb -0.17 -1.92 0.17 0.00 0.02 0.00 0.00 46.19 44.29 1vhk s LEU 232 CO 0.11 0.30 1.09 -0.13 0.02 0.00 0.00 176.35 177.74 1vhk s ARG 233 N -0.41 0.69 0.30 1.70 0.52 -1.26 -4.75 118.95 115.73 1vhk s ARG 233 Ca 0.09 0.79 -0.02 0.00 -0.52 0.00 0.00 55.73 56.08 1vhk s ARG 233 Cb -0.12 -1.74 0.45 0.00 0.52 0.00 0.00 34.95 34.06 1vhk s ARG 233 CO 0.02 -2.63 1.96 1.79 0.02 0.00 0.00 175.30 176.46 1vhk h THR 234 N -1.83 1.18 0.00 0.02 1.35 -1.90 -2.60 112.91 109.13 1vhk h THR 234 Ca -0.52 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 64.96 1vhk h THR 234 Cb 1.30 -0.03 0.00 0.00 -1.73 0.00 0.00 68.15 67.70 1vhk h THR 234 CO 0.54 0.20 0.00 -1.84 -0.25 0.00 0.00 175.52 174.17 1vhk n GLU 235 N -4.42 0.25 -0.01 4.72 0.00 -1.26 -4.03 120.64 115.88 1vhk n GLU 235 Ca 0.10 0.27 -0.20 0.00 0.00 0.00 0.00 57.16 57.34 1vhk n GLU 235 Cb 0.06 -1.83 -0.14 0.00 0.00 0.00 0.00 31.44 29.54 1vhk n GLU 235 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 1vhk n THR 236 N -2.27 1.73 -0.09 3.84 -1.04 -1.00 -4.44 114.28 111.02 1vhk n THR 236 Ca 0.05 -0.66 -0.06 0.00 -2.04 0.00 0.00 64.05 61.33 1vhk n THR 236 Cb 0.38 -1.62 0.00 0.00 -1.82 0.00 0.00 70.33 67.27 1vhk n THR 236 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1vhk h ALA 237 N 0.16 0.25 -0.01 2.41 0.00 -1.64 0.57 119.26 121.00 1vhk h ALA 237 Ca -0.43 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1vhk h ALA 237 Cb 2.02 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 20.02 1vhk h ALA 237 CO 0.07 -0.44 0.01 -1.35 0.00 0.00 0.00 179.25 177.54 1vhk h PRO 238 N 0.03 0.00 -0.05 0.00 0.11 -1.81 -0.45 132.00 129.84 1vhk h PRO 238 Ca 0.16 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 66.02 1vhk h PRO 238 Cb 0.23 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.36 1vhk h PRO 238 CO -0.31 0.00 -0.94 -0.07 -0.21 0.00 0.00 178.00 176.47 1vhk h LEU 239 N 0.00 0.89 -0.02 2.35 4.07 -1.19 -2.26 115.31 119.15 1vhk h LEU 239 Ca 0.01 -0.66 0.00 0.00 0.08 0.00 0.00 57.88 57.30 1vhk h LEU 239 Cb 0.02 -0.27 -0.00 0.00 1.08 0.00 0.00 40.66 41.49 1vhk h LEU 239 CO -0.00 1.46 0.01 0.22 -1.08 0.00 0.00 178.44 179.05 1vhk h TYR 240 N 0.43 0.02 0.42 1.13 3.20 0.17 -2.40 116.97 119.93 1vhk h TYR 240 Ca -0.10 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.76 1vhk h TYR 240 Cb 1.58 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 39.83 1vhk h TYR 240 CO 0.09 0.01 -0.41 0.00 -1.64 0.00 0.00 178.16 176.21 1vhk h ALA 241 N 1.01 -1.08 -0.70 1.82 0.00 -1.15 -0.14 119.26 119.01 1vhk h ALA 241 Ca 0.01 -0.16 0.14 0.00 0.00 0.00 0.00 54.91 54.90 1vhk h ALA 241 Cb -0.00 0.64 -0.10 0.00 0.00 0.00 0.00 17.79 18.33 1vhk h ALA 241 CO -0.00 -1.11 0.17 -0.07 0.00 0.00 0.00 179.25 178.24 1vhk h LEU 242 N -0.82 0.02 0.11 0.00 -0.00 -1.49 0.18 115.31 113.31 1vhk h LEU 242 Ca -0.05 0.13 0.00 0.00 -0.00 0.00 0.00 57.88 57.97 1vhk h LEU 242 Cb 0.71 0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 41.54 1vhk h LEU 242 CO -0.05 -0.01 -0.11 0.28 -0.00 0.00 0.00 178.44 178.55 1vhk h SER 243 N 0.28 -0.28 -0.40 -0.43 0.02 -1.15 -1.07 113.55 110.53 1vhk h SER 243 Ca 0.39 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.37 1vhk h SER 243 Cb 0.63 0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.25 1vhk h SER 243 CO -0.47 -0.17 0.26 0.00 -1.14 0.00 0.00 176.83 175.31 1vhk h ALA 244 N 0.64 0.50 -0.92 3.77 0.00 -0.34 -0.65 119.26 122.27 1vhk h ALA 244 Ca 0.00 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 54.99 1vhk h ALA 244 Cb 0.23 -0.16 -0.08 0.00 0.00 0.00 0.00 17.79 17.78 1vhk h ALA 244 CO -0.03 -0.04 0.55 0.82 0.00 0.00 0.00 179.25 180.56 1vhk h ILE 245 N 0.54 0.91 -0.48 0.00 2.04 -0.40 -0.62 117.51 119.50 1vhk h ILE 245 Ca 0.15 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 1vhk h ILE 245 Cb -0.06 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 35.94 1vhk h ILE 245 CO -0.03 0.16 0.25 -1.28 0.00 0.00 0.00 178.15 177.25 1vhk h SER 246 N 0.90 0.62 0.22 1.72 0.87 0.01 -1.42 113.55 116.46 1vhk h SER 246 Ca 0.45 -0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.91 1vhk h SER 246 Cb 0.43 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.21 1vhk h SER 246 CO -0.26 0.55 -0.23 0.22 -0.53 0.00 0.00 176.83 176.58 1vhk h TYR 247 N 0.64 -0.61 -0.15 2.24 3.20 0.26 0.69 116.97 123.24 1vhk h TYR 247 Ca 0.17 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.97 1vhk h TYR 247 Cb 0.08 0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 1vhk h TYR 247 CO -0.01 -0.34 -0.22 0.37 -1.64 0.00 0.00 178.16 176.32 1vhk h GLN 248 N -0.49 0.25 0.00 1.82 5.75 -1.13 0.16 115.11 121.47 1vhk h GLN 248 Ca -0.00 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.42 1vhk h GLN 248 Cb 0.46 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.99 1vhk h GLN 248 CO -0.06 0.47 -1.68 -2.37 -2.65 0.00 0.00 178.83 172.54 1vhk n THR 249 N -4.19 0.00 0.00 2.39 5.66 -0.54 -3.55 114.28 114.05 1vhk n THR 249 Ca -0.01 -0.36 0.00 0.00 -3.05 0.00 0.00 64.05 60.63 1vhk n THR 249 Cb 0.34 0.24 0.00 0.00 -1.55 0.00 0.00 70.33 69.36 1vhk n THR 249 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1vhk n GLU 250 N -2.02 1.75 -0.08 1.09 1.02 0.24 -4.53 120.64 118.10 1vhk n GLU 250 Ca -0.02 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.02 1vhk n GLU 250 Cb 0.46 -0.86 -0.09 0.00 -0.02 0.00 0.00 31.44 30.93 1vhk n GLU 250 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1vhk n LEU 251 N -1.10 2.12 0.03 -4.62 4.32 -0.48 -4.60 117.00 112.67 1vhk n LEU 251 Ca 0.00 -0.06 -0.21 0.00 -0.02 0.00 0.00 56.01 55.71 1vhk n LEU 251 Cb 0.02 -0.33 -0.14 0.00 -1.62 0.00 0.00 43.42 41.35 1vhk n LEU 251 CO 0.00 0.65 -0.24 -0.07 -1.22 0.00 0.00 177.39 176.51 1vhk h LEU 252 N 0.00 0.44 -1.65 2.23 3.38 -1.18 -3.49 115.31 115.04 1vhk h LEU 252 Ca -0.37 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 56.70 1vhk h LEU 252 Cb 1.65 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 42.26 1vhk h LEU 252 CO -0.04 1.54 0.00 0.54 0.09 0.00 0.00 178.44 180.58