#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vr9 h VAL 3 N 0.00 0.74 -0.83 -0.18 2.07 -1.26 -2.78 116.25 114.00 1vr9 h VAL 3 Ca 0.00 -0.14 0.22 0.00 0.82 0.00 0.00 66.70 67.59 1vr9 h VAL 3 Cb 0.00 0.28 -0.05 0.00 -1.52 0.00 0.00 31.29 30.00 1vr9 h VAL 3 CO 0.00 0.08 0.58 0.50 0.02 0.00 0.00 177.57 178.74 1vr9 h LYS 4 N 0.42 0.17 0.00 1.57 3.64 -1.73 0.11 116.57 120.74 1vr9 h LYS 4 Ca 0.34 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.67 1vr9 h LYS 4 Cb 0.44 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 1vr9 h LYS 4 CO -0.34 0.11 -0.17 -0.22 -2.27 0.00 0.00 179.45 176.56 1vr9 h LYS 5 N 0.17 0.00 -0.14 1.90 3.11 -1.83 -3.19 116.57 116.60 1vr9 h LYS 5 Ca 0.41 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 58.25 1vr9 h LYS 5 Cb 1.36 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.59 1vr9 h LYS 5 CO -0.08 0.17 0.00 0.91 -2.81 0.00 0.00 179.45 177.65 1vr9 n TRP 6 N -3.96 0.17 -2.18 1.91 7.02 0.36 -5.01 117.44 115.76 1vr9 n TRP 6 Ca -0.02 -0.16 -0.41 0.00 -1.02 0.00 0.00 57.50 55.89 1vr9 n TRP 6 Cb 0.26 -0.01 -0.03 0.00 -2.42 0.00 0.00 31.31 29.12 1vr9 n TRP 6 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 1vr9 s VAL 7 N -1.06 2.90 0.17 -0.99 1.01 -1.12 -4.63 120.40 116.68 1vr9 s VAL 7 Ca 0.19 0.87 0.11 0.00 0.00 0.00 0.00 61.98 63.15 1vr9 s VAL 7 Cb 0.12 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.90 1vr9 s VAL 7 CO 0.17 0.19 -0.23 0.28 0.00 0.00 0.00 175.10 175.52 1vr9 s THR 8 N -0.92 2.46 -2.55 3.92 -1.32 0.62 -4.95 115.64 112.91 1vr9 s THR 8 Ca 0.50 -1.90 0.24 0.00 -1.21 0.00 0.00 61.69 59.31 1vr9 s THR 8 Cb -0.38 -2.17 0.12 0.00 -1.51 0.00 0.00 72.50 68.56 1vr9 s THR 8 CO 0.49 -0.06 1.21 0.00 -2.21 0.00 0.00 174.62 174.05 1vr9 n GLN 9 N 0.40 1.80 -3.08 7.08 1.13 -1.26 -1.92 117.38 121.53 1vr9 n GLN 9 Ca -0.14 -1.47 -0.44 0.00 -1.94 0.00 0.00 57.00 53.01 1vr9 n GLN 9 Cb 0.55 -1.47 -0.00 0.00 0.11 0.00 0.00 30.24 29.43 1vr9 n GLN 9 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1vr9 s ASP 10 N -2.22 7.14 0.10 1.08 -1.08 -1.26 -4.94 116.67 115.50 1vr9 s ASP 10 Ca 0.24 -3.17 -0.17 0.00 -0.52 0.00 0.00 52.55 48.94 1vr9 s ASP 10 Cb 0.19 -2.33 0.03 0.00 -1.46 0.00 0.00 42.92 39.35 1vr9 s ASP 10 CO 0.42 -0.60 0.40 0.72 0.52 0.00 0.00 175.17 176.64 1vr9 s PHE 11 N 0.63 -0.22 0.71 -5.34 -0.71 -1.26 -5.04 117.98 106.74 1vr9 s PHE 11 Ca 0.38 -0.01 -0.11 0.00 -1.04 0.00 0.00 56.93 56.15 1vr9 s PHE 11 Cb -0.05 0.24 0.02 0.00 -1.21 0.00 0.00 43.02 42.01 1vr9 s PHE 11 CO -0.03 -0.66 1.06 -1.25 -1.34 0.00 0.00 175.22 173.01 1vr9 s PRO 12 N -3.37 2.83 -0.02 1.99 0.04 -1.26 -5.02 135.00 130.19 1vr9 s PRO 12 Ca 0.00 0.94 -0.30 0.00 0.04 0.00 0.00 61.00 61.68 1vr9 s PRO 12 Cb 0.01 -1.98 0.11 0.00 0.04 0.00 0.00 34.50 32.68 1vr9 s PRO 12 CO -0.09 -1.17 1.09 0.14 0.04 0.00 0.00 177.00 177.01 1vr9 s VAL 14 N -3.05 0.00 0.45 -0.36 -7.23 -0.20 -0.92 120.40 109.10 1vr9 s VAL 14 Ca 0.58 -0.21 -0.10 0.00 -1.81 0.00 0.00 61.98 60.44 1vr9 s VAL 14 Cb -0.14 -1.49 -0.06 0.00 0.56 0.00 0.00 36.38 35.25 1vr9 s VAL 14 CO 0.55 0.00 0.83 -0.70 -0.31 0.00 0.00 175.10 175.47 1vr9 s GLU 15 N -2.80 3.74 0.65 4.82 -6.30 -1.26 -1.87 118.70 115.69 1vr9 s GLU 15 Ca 0.10 0.51 0.37 0.00 -2.50 0.00 0.00 54.97 53.46 1vr9 s GLU 15 Cb 0.00 -2.32 2.04 0.00 0.00 0.00 0.00 34.13 33.85 1vr9 s GLU 15 CO -0.04 -0.15 2.19 1.05 0.02 0.00 0.00 175.26 178.33 1vr9 h GLU 16 N 0.87 0.00 -0.43 4.30 4.11 -1.37 -0.98 114.58 121.08 1vr9 h GLU 16 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1vr9 h GLU 16 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1vr9 h GLU 16 CO 0.63 0.00 0.00 -1.13 0.07 0.00 0.00 179.01 178.58 1vr9 n SER 17 N -3.19 3.48 -4.64 3.06 3.41 -1.26 -2.50 113.62 111.98 1vr9 n SER 17 Ca -0.02 -2.22 -0.38 0.00 -0.26 0.00 0.00 58.87 55.99 1vr9 n SER 17 Cb 0.21 -0.37 0.05 0.00 -0.26 0.00 0.00 64.21 63.84 1vr9 n SER 17 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vr9 n ALA 18 N 0.60 0.38 -1.62 7.33 0.00 -0.37 -4.70 120.51 122.14 1vr9 n ALA 18 Ca 0.17 0.02 -0.31 0.00 0.00 0.00 0.00 53.44 53.32 1vr9 n ALA 18 Cb 0.59 -2.15 0.04 0.00 0.00 0.00 0.00 19.45 17.93 1vr9 n ALA 18 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1vr9 s THR 19 N -1.47 4.10 0.25 0.00 -4.23 -1.26 -1.22 115.64 111.80 1vr9 s THR 19 Ca 0.76 0.72 -0.04 0.00 -1.18 0.00 0.00 61.69 61.95 1vr9 s THR 19 Cb -0.42 -3.46 0.22 0.00 1.34 0.00 0.00 72.50 70.18 1vr9 s THR 19 CO 0.47 -0.86 1.77 0.58 -0.54 0.00 0.00 174.62 176.04 1vr9 h VAL 20 N -0.53 0.79 -0.23 2.29 2.07 -0.36 -1.74 116.25 118.54 1vr9 h VAL 20 Ca -0.44 -0.21 0.04 0.00 0.82 0.00 0.00 66.70 66.90 1vr9 h VAL 20 Cb 1.21 0.10 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 1vr9 h VAL 20 CO 0.57 0.11 -0.00 -0.09 0.02 0.00 0.00 177.57 178.19 1vr9 h ARG 21 N 0.63 0.07 -0.80 1.57 2.43 -1.50 -0.43 114.38 116.35 1vr9 h ARG 21 Ca 0.41 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.58 1vr9 h ARG 21 Cb 0.52 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.01 1vr9 h ARG 21 CO -0.32 0.05 0.51 0.93 -1.51 0.00 0.00 179.97 179.62 1vr9 h GLU 22 N 0.07 1.07 -0.30 0.20 5.08 -1.72 -1.67 114.58 117.30 1vr9 h GLU 22 Ca 0.11 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 58.34 1vr9 h GLU 22 Cb 0.14 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1vr9 h GLU 22 CO -0.18 0.73 0.02 0.00 -1.00 0.00 0.00 179.01 178.58 1vr9 h LEU 24 N 0.33 0.96 -0.19 0.00 3.38 -0.96 -2.63 115.31 116.20 1vr9 h LEU 24 Ca 0.09 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1vr9 h LEU 24 Cb 0.40 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1vr9 h LEU 24 CO 0.01 0.67 0.08 -0.74 0.09 0.00 0.00 178.44 178.56 1vr9 h HIS 25 N 1.13 0.28 0.00 1.13 2.76 -1.08 -0.97 115.15 118.39 1vr9 h HIS 25 Ca 0.35 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.50 1vr9 h HIS 25 Cb -0.03 -0.08 0.00 0.00 1.55 0.00 0.00 27.41 28.85 1vr9 h HIS 25 CO -0.02 0.31 0.00 0.54 -1.30 0.00 0.00 177.93 177.46 1vr9 n ARG 26 N -4.86 0.00 0.00 5.26 5.12 -0.73 -1.24 116.66 120.22 1vr9 n ARG 26 Ca -0.04 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.88 1vr9 n ARG 26 Cb 0.11 -1.07 0.00 0.00 -1.16 0.00 0.00 32.46 30.34 1vr9 n ARG 26 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1vr9 n ARG 28 N 0.61 0.00 0.18 5.56 1.74 -0.37 -2.27 116.66 122.11 1vr9 n ARG 28 Ca 0.00 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.10 1vr9 n ARG 28 Cb 0.00 0.00 0.32 0.00 -1.02 0.00 0.00 32.46 31.76 1vr9 n ARG 28 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1vr9 h GLN 29 N 0.00 0.00 -0.43 5.56 1.08 -1.44 -2.27 115.11 117.61 1vr9 h GLN 29 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1vr9 h GLN 29 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1vr9 h GLN 29 CO 0.00 0.42 0.00 0.66 -0.95 0.00 0.00 178.83 178.96 1vr9 n TYR 30 N -3.95 0.55 -3.83 2.96 4.01 -0.96 -4.98 117.16 110.97 1vr9 n TYR 30 Ca -0.02 -0.29 -0.27 0.00 -0.16 0.00 0.00 57.90 57.16 1vr9 n TYR 30 Cb 0.46 -0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.50 1vr9 n TYR 30 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1vr9 n GLN 31 N 1.45 -2.87 -4.15 -0.72 6.02 -0.86 -4.95 117.38 111.30 1vr9 n GLN 31 Ca 0.19 0.45 -0.15 0.00 -0.01 0.00 0.00 57.00 57.48 1vr9 n GLN 31 Cb 0.59 -4.48 -0.06 0.00 1.02 0.00 0.00 30.24 27.31 1vr9 n GLN 31 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1vr9 s THR 32 N -3.76 0.00 -0.10 5.09 -1.32 -1.26 -5.03 115.64 109.26 1vr9 s THR 32 Ca 0.15 -1.75 0.13 0.00 -1.21 0.00 0.00 61.69 59.02 1vr9 s THR 32 Cb -0.06 -2.54 0.24 0.00 -1.51 0.00 0.00 72.50 68.63 1vr9 s THR 32 CO 0.87 0.00 1.12 -0.46 -2.21 0.00 0.00 174.62 173.94 1vr9 n ASN 33 N -1.20 1.53 -4.07 8.08 0.23 -1.26 -4.53 115.26 114.05 1vr9 n ASN 33 Ca 0.03 -2.83 -0.17 0.00 -0.53 0.00 0.00 54.58 51.08 1vr9 n ASN 33 Cb 0.62 -0.37 -0.13 0.00 -2.08 0.00 0.00 39.78 37.82 1vr9 n ASN 33 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1vr9 s GLU 34 N -1.94 0.69 -0.04 -3.83 2.12 -1.26 -1.44 118.70 113.00 1vr9 s GLU 34 Ca 0.24 -0.59 0.01 0.00 0.36 0.00 0.00 54.97 55.00 1vr9 s GLU 34 Cb 0.22 -0.62 0.02 0.00 0.26 0.00 0.00 34.13 34.02 1vr9 s GLU 34 CO -0.01 0.15 -0.04 0.00 -0.54 0.00 0.00 175.26 174.83 1vr9 s ILE 36 N 0.83 4.35 -0.05 0.00 1.01 -0.10 -0.20 121.20 127.05 1vr9 s ILE 36 Ca -0.11 1.70 0.06 0.00 0.00 0.00 0.00 60.65 62.30 1vr9 s ILE 36 Cb -0.13 -4.11 -0.02 0.00 0.01 0.00 0.00 42.46 38.21 1vr9 s ILE 36 CO -0.00 0.44 -0.22 -0.69 0.00 0.00 0.00 174.94 174.47 1vr9 s VAL 37 N -1.25 2.39 0.30 2.92 1.01 0.41 -1.03 120.40 125.15 1vr9 s VAL 37 Ca 0.39 -0.96 0.08 0.00 0.00 0.00 0.00 61.98 61.48 1vr9 s VAL 37 Cb -0.22 -1.88 -0.06 0.00 0.00 0.00 0.00 36.38 34.21 1vr9 s VAL 37 CO 0.26 0.58 -0.08 -1.59 0.00 0.00 0.00 175.10 174.27 1vr9 s LYS 38 N -0.43 1.66 0.23 2.72 -2.85 -0.78 -1.24 119.74 119.05 1vr9 s LYS 38 Ca 0.04 -1.85 0.01 0.00 -1.00 0.00 0.00 55.97 53.17 1vr9 s LYS 38 Cb -0.12 -1.39 0.05 0.00 -2.06 0.00 0.00 37.83 34.31 1vr9 s LYS 38 CO 0.01 0.08 0.32 -0.40 0.10 0.00 0.00 175.35 175.47 1vr9 n ASP 39 N -0.67 0.49 0.27 0.03 5.68 -0.38 -0.97 116.55 121.01 1vr9 n ASP 39 Ca -0.05 -1.40 0.16 0.00 -0.50 0.00 0.00 54.79 52.99 1vr9 n ASP 39 Cb 0.63 -0.20 0.60 0.00 -1.14 0.00 0.00 41.12 41.02 1vr9 n ASP 39 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 1vr9 h ARG 40 N 0.00 0.00 -0.01 0.11 3.08 -2.00 -2.22 114.38 113.34 1vr9 h ARG 40 Ca -0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1vr9 h ARG 40 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1vr9 h ARG 40 CO 0.12 0.03 -0.10 0.39 -1.07 0.00 0.00 179.97 179.33 1vr9 n GLU 41 N -3.13 1.29 -0.34 0.04 -0.58 -1.26 -4.96 120.64 111.71 1vr9 n GLU 41 Ca 0.01 -0.73 0.00 0.00 -0.42 0.00 0.00 57.16 56.02 1vr9 n GLU 41 Cb 0.34 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.73 1vr9 n GLU 41 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1vr9 n GLY 42 N 1.24 0.78 3.80 0.62 0.00 -0.83 -5.00 105.19 105.79 1vr9 n GLY 42 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 1vr9 n GLY 42 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1vr9 s HIS 43 N -2.20 3.10 0.10 1.61 3.76 -1.26 -0.84 115.29 119.55 1vr9 s HIS 43 Ca 0.00 1.60 -0.31 0.00 -0.15 0.00 0.00 55.06 56.20 1vr9 s HIS 43 Cb 0.00 -3.04 -0.07 0.00 1.11 0.00 0.00 32.58 30.59 1vr9 s HIS 43 CO 0.00 -0.67 1.23 0.12 -0.85 0.00 0.00 174.74 174.57 1vr9 s PHE 44 N -1.96 3.41 -0.14 1.40 5.36 -1.26 -1.25 117.98 123.54 1vr9 s PHE 44 Ca 0.65 1.27 0.03 0.00 -0.96 0.00 0.00 56.93 57.92 1vr9 s PHE 44 Cb -0.16 -3.47 -0.10 0.00 -0.34 0.00 0.00 43.02 38.95 1vr9 s PHE 44 CO 0.20 -1.45 -0.09 0.54 -1.46 0.00 0.00 175.22 172.96 1vr9 n ARG 45 N 3.64 0.77 -2.34 10.12 5.12 -0.37 -4.89 116.66 128.71 1vr9 n ARG 45 Ca 0.08 0.06 0.00 0.00 -1.93 0.00 0.00 57.85 56.07 1vr9 n ARG 45 Cb 0.45 -1.29 0.00 0.00 -1.16 0.00 0.00 32.46 30.46 1vr9 n ARG 45 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1vr9 n GLY 46 N 2.69 -0.14 3.21 -0.13 0.00 -1.22 -4.32 105.19 105.29 1vr9 n GLY 46 Ca -0.24 -1.24 -0.18 0.00 0.00 0.00 0.00 46.02 44.37 1vr9 n GLY 46 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1vr9 s VAL 47 N -3.22 1.20 -0.18 1.61 -7.23 0.48 -0.44 120.40 112.62 1vr9 s VAL 47 Ca 0.00 -1.54 -0.05 0.00 -1.81 0.00 0.00 61.98 58.58 1vr9 s VAL 47 Cb 0.00 -1.33 -0.03 0.00 0.56 0.00 0.00 36.38 35.58 1vr9 s VAL 47 CO 0.00 -0.35 -0.00 -0.69 -0.31 0.00 0.00 175.10 173.74 1vr9 s VAL 48 N -1.82 4.11 -0.13 1.32 1.01 0.72 -0.03 120.40 125.58 1vr9 s VAL 48 Ca 0.04 -0.27 -0.15 0.00 0.00 0.00 0.00 61.98 61.60 1vr9 s VAL 48 Cb -0.07 -2.83 -0.05 0.00 0.00 0.00 0.00 36.38 33.44 1vr9 s VAL 48 CO 0.02 0.46 0.37 0.20 0.00 0.00 0.00 175.10 176.15 1vr9 s ASN 49 N 0.59 6.56 0.30 3.32 0.01 -1.26 -1.30 114.94 123.17 1vr9 s ASN 49 Ca -0.01 0.67 0.06 0.00 -0.71 0.00 0.00 52.86 52.87 1vr9 s ASN 49 Cb -0.14 -2.22 0.76 0.00 0.41 0.00 0.00 41.25 40.06 1vr9 s ASN 49 CO 0.02 0.10 1.75 0.50 -1.51 0.00 0.00 177.10 177.96 1vr9 h LYS 50 N 6.42 0.65 -0.18 -0.60 3.64 -1.63 -1.44 116.57 123.44 1vr9 h LYS 50 Ca -0.43 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 1vr9 h LYS 50 Cb 1.18 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 1vr9 h LYS 50 CO 0.74 0.43 0.12 1.05 -2.27 0.00 0.00 179.45 179.51 1vr9 h GLU 51 N 0.67 0.24 0.00 1.90 4.11 -1.95 -1.46 114.58 118.09 1vr9 h GLU 51 Ca 0.59 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 60.00 1vr9 h GLU 51 Cb 0.98 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1vr9 h GLU 51 CO -0.42 0.16 0.00 -0.25 0.07 0.00 0.00 179.01 178.57 1vr9 n ASP 52 N -4.51 0.16 -0.87 3.06 8.00 -0.54 -3.05 116.55 118.80 1vr9 n ASP 52 Ca -0.00 0.54 0.10 0.00 0.71 0.00 0.00 54.79 56.14 1vr9 n ASP 52 Cb 0.08 -0.57 0.11 0.00 -0.02 0.00 0.00 41.12 40.72 1vr9 n ASP 52 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1vr9 n LEU 53 N -1.67 2.84 -0.11 0.64 4.77 -0.55 -4.72 117.00 118.21 1vr9 n LEU 53 Ca 0.04 -1.11 -0.05 0.00 -0.03 0.00 0.00 56.01 54.85 1vr9 n LEU 53 Cb 0.20 -0.05 0.02 0.00 -2.33 0.00 0.00 43.42 41.27 1vr9 n LEU 53 CO 0.16 0.52 0.88 0.25 -1.33 0.00 0.00 177.39 177.87 1vr9 h LEU 54 N 4.05 -0.07 -3.89 2.23 5.85 -1.62 -2.85 115.31 119.00 1vr9 h LEU 54 Ca 0.00 0.07 -0.58 0.00 0.84 0.00 0.00 57.88 58.21 1vr9 h LEU 54 Cb 0.87 0.12 -0.30 0.00 0.37 0.00 0.00 40.66 41.72 1vr9 h LEU 54 CO 0.00 -0.00 0.46 0.47 -0.34 0.00 0.00 178.44 179.03 1vr9 n ASP 55 N -5.14 6.05 -4.59 1.25 8.00 -1.26 -4.97 116.55 115.89 1vr9 n ASP 55 Ca 0.02 -3.75 -0.31 0.00 0.71 0.00 0.00 54.79 51.45 1vr9 n ASP 55 Cb 0.18 -0.81 -0.10 0.00 -0.02 0.00 0.00 41.12 40.36 1vr9 n ASP 55 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1vr9 s LEU 56 N -3.64 3.13 0.33 0.64 1.43 -1.08 -5.10 118.68 114.39 1vr9 s LEU 56 Ca 0.59 -0.21 -0.29 0.00 -1.03 0.00 0.00 54.13 53.19 1vr9 s LEU 56 Cb 0.48 -1.83 -0.11 0.00 0.03 0.00 0.00 46.19 44.76 1vr9 s LEU 56 CO 0.02 0.25 1.47 -0.62 0.23 0.00 0.00 176.35 177.70 1vr9 s ASP 57 N -1.64 6.48 0.51 2.29 -1.08 -1.26 -4.90 116.67 117.08 1vr9 s ASP 57 Ca 0.18 2.90 0.24 0.00 -0.52 0.00 0.00 52.55 55.36 1vr9 s ASP 57 Cb -0.11 -2.65 1.40 0.00 -1.46 0.00 0.00 42.92 40.10 1vr9 s ASP 57 CO 0.09 -0.79 2.08 -0.07 0.52 0.00 0.00 175.17 177.00 1vr9 h LEU 58 N 3.85 0.00 0.00 -1.34 3.38 -1.96 -2.20 115.31 117.03 1vr9 h LEU 58 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1vr9 h LEU 58 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1vr9 h LEU 58 CO 0.70 0.12 -0.17 0.47 0.09 0.00 0.00 178.44 179.65 1vr9 n ASP 59 N -3.85 0.64 -4.76 -0.43 8.00 -1.26 -1.40 116.55 113.49 1vr9 n ASP 59 Ca -0.02 0.42 -0.30 0.00 0.71 0.00 0.00 54.79 55.60 1vr9 n ASP 59 Cb 0.21 -0.48 0.12 0.00 -0.02 0.00 0.00 41.12 40.95 1vr9 n ASP 59 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1vr9 s SER 60 N -4.13 3.95 0.27 -2.24 1.04 -0.83 -4.74 113.70 107.01 1vr9 s SER 60 Ca 0.10 1.36 -0.04 0.00 0.48 0.00 0.00 55.95 57.85 1vr9 s SER 60 Cb 0.14 -2.05 -0.05 0.00 0.10 0.00 0.00 66.02 64.15 1vr9 s SER 60 CO 0.62 -2.32 0.51 -0.55 0.98 0.00 0.00 173.24 172.49 1vr9 s SER 61 N -3.70 6.44 0.00 7.02 0.15 -1.26 0.05 113.70 122.39 1vr9 s SER 61 Ca 0.62 0.64 0.23 0.00 0.70 0.00 0.00 55.95 58.14 1vr9 s SER 61 Cb -0.16 -2.11 0.89 0.00 -1.71 0.00 0.00 66.02 62.93 1vr9 s SER 61 CO 0.55 -0.15 1.63 1.33 1.20 0.00 0.00 173.24 177.80 1vr9 n VAL 62 N -0.84 0.13 -0.22 4.45 0.24 -0.36 -4.53 118.33 117.21 1vr9 n VAL 62 Ca -0.02 -0.29 0.03 0.00 -2.04 0.00 0.00 64.34 62.02 1vr9 n VAL 62 Cb 0.54 0.33 0.14 0.00 -1.47 0.00 0.00 33.84 33.38 1vr9 n VAL 62 CO 0.00 0.00 0.00 0.15 -2.14 0.00 0.00 176.83 174.84 1vr9 h PHE 63 N 2.03 0.21 -0.12 6.34 3.57 -1.73 -0.07 116.94 127.17 1vr9 h PHE 63 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1vr9 h PHE 63 Cb 0.44 0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.19 1vr9 h PHE 63 CO 0.07 -0.07 0.00 0.09 -2.23 0.00 0.00 178.31 176.17 1vr9 n ASN 64 N -5.16 1.59 -0.90 0.41 3.02 -1.26 -4.17 115.26 108.79 1vr9 n ASN 64 Ca 0.11 -1.64 0.09 0.00 -0.03 0.00 0.00 54.58 53.12 1vr9 n ASN 64 Cb 0.38 -0.07 0.17 0.00 -0.61 0.00 0.00 39.78 39.65 1vr9 n ASN 64 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1vr9 n LYS 65 N 0.26 2.23 -2.52 3.52 4.76 -0.04 -5.00 118.16 121.38 1vr9 n LYS 65 Ca 0.17 -2.04 -0.35 0.00 -2.87 0.00 0.00 58.31 53.22 1vr9 n LYS 65 Cb 0.33 -1.40 -0.03 0.00 -1.84 0.00 0.00 35.03 32.09 1vr9 n LYS 65 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1vr9 s VAL 66 N -1.23 3.70 0.22 -0.18 1.01 -1.22 -4.67 120.40 118.03 1vr9 s VAL 66 Ca 0.30 1.17 0.03 0.00 0.00 0.00 0.00 61.98 63.48 1vr9 s VAL 66 Cb 0.18 -3.54 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 1vr9 s VAL 66 CO 0.24 -0.12 0.02 -0.44 0.00 0.00 0.00 175.10 174.80 1vr9 s SER 67 N -1.76 1.53 -1.18 3.32 0.01 0.96 -4.93 113.70 111.65 1vr9 s SER 67 Ca 0.63 -1.23 -0.05 0.00 1.31 0.00 0.00 55.95 56.61 1vr9 s SER 67 Cb -0.20 0.07 -0.02 0.00 0.21 0.00 0.00 66.02 66.08 1vr9 s SER 67 CO 0.24 -0.57 0.85 0.18 0.41 0.00 0.00 173.24 174.35 1vr9 n LEU 68 N -0.37 -4.06 0.21 2.44 4.77 -1.26 -0.39 117.00 118.34 1vr9 n LEU 68 Ca -0.05 -0.77 0.15 0.00 -0.03 0.00 0.00 56.01 55.31 1vr9 n LEU 68 Cb 0.64 -2.90 0.72 0.00 -2.33 0.00 0.00 43.42 39.56 1vr9 n LEU 68 CO 0.36 0.32 0.94 1.55 -1.33 0.00 0.00 177.39 179.22 1vr9 h PRO 69 N -1.64 0.00 -0.24 3.23 0.13 -1.93 -2.50 132.00 129.05 1vr9 h PRO 69 Ca -0.61 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 1vr9 h PRO 69 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 1vr9 h PRO 69 CO 0.50 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.02 1vr9 n ASP 70 N -2.54 3.01 -4.42 1.44 8.00 -1.26 -4.82 116.55 115.96 1vr9 n ASP 70 Ca -0.01 -1.94 -0.45 0.00 0.71 0.00 0.00 54.79 53.11 1vr9 n ASP 70 Cb 0.12 -0.15 -0.02 0.00 -0.02 0.00 0.00 41.12 41.05 1vr9 n ASP 70 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1vr9 s PHE 71 N -1.70 3.38 0.16 1.24 5.36 -0.94 -4.93 117.98 120.54 1vr9 s PHE 71 Ca 0.35 -1.71 -0.23 0.00 -0.96 0.00 0.00 56.93 54.37 1vr9 s PHE 71 Cb 0.21 -4.17 0.06 0.00 -0.34 0.00 0.00 43.02 38.79 1vr9 s PHE 71 CO 0.31 -1.34 0.69 -0.59 -1.46 0.00 0.00 175.22 172.82 1vr9 s PHE 72 N 1.77 -0.42 0.22 10.12 -0.12 -1.26 -4.18 117.98 124.12 1vr9 s PHE 72 Ca 0.31 0.16 0.04 0.00 -0.05 0.00 0.00 56.93 57.39 1vr9 s PHE 72 Cb -0.06 0.59 -0.05 0.00 -0.63 0.00 0.00 43.02 42.87 1vr9 s PHE 72 CO -0.08 -0.89 -0.03 0.14 -0.05 0.00 0.00 175.22 174.32 1vr9 s VAL 73 N -3.67 1.14 0.28 -2.49 -7.23 -0.40 -4.99 120.40 103.04 1vr9 s VAL 73 Ca 0.04 -2.05 -0.05 0.00 -1.81 0.00 0.00 61.98 58.11 1vr9 s VAL 73 Cb -0.02 -2.28 -0.05 0.00 0.56 0.00 0.00 36.38 34.58 1vr9 s VAL 73 CO -0.07 -0.38 0.55 -1.00 -0.31 0.00 0.00 175.10 173.88 1vr9 s HIS 74 N -3.35 3.48 0.32 2.82 3.76 -1.26 -1.15 115.29 119.90 1vr9 s HIS 74 Ca 0.27 0.64 0.08 0.00 -0.15 0.00 0.00 55.06 55.90 1vr9 s HIS 74 Cb 0.05 -2.10 0.80 0.00 1.11 0.00 0.00 32.58 32.44 1vr9 s HIS 74 CO 0.08 0.18 1.79 0.93 -0.85 0.00 0.00 174.74 176.87 1vr9 h GLU 75 N 1.71 0.69 -0.30 1.40 5.08 -1.61 -2.39 114.58 119.16 1vr9 h GLU 75 Ca -0.48 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1vr9 h GLU 75 Cb 1.19 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1vr9 h GLU 75 CO 0.66 0.45 0.00 0.39 -1.00 0.00 0.00 179.01 179.52 1vr9 n GLU 76 N -4.73 2.05 -1.25 2.33 -0.58 -1.26 -2.53 120.64 114.66 1vr9 n GLU 76 Ca 0.23 -1.59 -0.31 0.00 -0.42 0.00 0.00 57.16 55.08 1vr9 n GLU 76 Cb 0.60 -1.42 0.11 0.00 -0.57 0.00 0.00 31.44 30.16 1vr9 n GLU 76 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1vr9 s ASP 77 N -1.42 4.18 0.29 1.62 1.01 -0.90 -4.88 116.67 116.56 1vr9 s ASP 77 Ca 0.34 1.70 -0.26 0.00 0.71 0.00 0.00 52.55 55.04 1vr9 s ASP 77 Cb 0.19 -2.39 -0.09 0.00 1.01 0.00 0.00 42.92 41.63 1vr9 s ASP 77 CO 0.27 -2.23 0.91 0.20 0.21 0.00 0.00 175.17 174.53 1vr9 s ASN 78 N -3.42 7.37 0.51 0.27 0.01 -1.26 -1.03 114.94 117.38 1vr9 s ASN 78 Ca 0.62 1.80 0.17 0.00 -0.71 0.00 0.00 52.86 54.73 1vr9 s ASN 78 Cb -0.17 -2.56 1.24 0.00 0.41 0.00 0.00 41.25 40.17 1vr9 s ASN 78 CO 0.56 0.00 2.11 -0.29 -1.51 0.00 0.00 177.10 177.97 1vr9 h ILE 79 N 2.76 0.96 -0.44 0.60 6.09 -1.95 0.17 117.51 125.70 1vr9 h ILE 79 Ca -0.47 -0.02 0.13 0.00 -1.37 0.00 0.00 64.86 63.13 1vr9 h ILE 79 Cb 1.19 0.88 -0.02 0.00 0.47 0.00 0.00 36.82 39.35 1vr9 h ILE 79 CO 0.66 0.01 0.31 0.71 -3.07 0.00 0.00 178.15 176.77 1vr9 h THR 80 N 0.07 0.78 -0.30 2.19 1.35 -1.97 -1.75 112.91 113.29 1vr9 h THR 80 Ca 0.07 -0.00 -0.11 0.00 -0.55 0.00 0.00 66.41 65.82 1vr9 h THR 80 Cb 0.19 0.78 -0.01 0.00 -1.73 0.00 0.00 68.15 67.37 1vr9 h THR 80 CO -0.01 0.00 -0.26 -0.74 -0.25 0.00 0.00 175.52 174.26 1vr9 h HIS 81 N 0.01 0.69 -0.33 4.73 -0.00 -1.04 -2.80 115.15 116.40 1vr9 h HIS 81 Ca 0.21 -0.16 0.10 0.00 -0.00 0.00 0.00 60.37 60.52 1vr9 h HIS 81 Cb 0.83 -0.16 -0.01 0.00 -0.00 0.00 0.00 27.41 28.06 1vr9 h HIS 81 CO -0.00 0.81 0.25 0.00 -0.00 0.00 0.00 177.93 178.99 1vr9 h ALA 82 N 1.18 2.29 -0.79 5.26 0.00 -1.34 -1.44 119.26 124.42 1vr9 h ALA 82 Ca 0.07 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.02 1vr9 h ALA 82 Cb 0.73 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.49 1vr9 h ALA 82 CO 0.06 -0.42 0.49 1.25 0.00 0.00 0.00 179.25 180.63 1vr9 h LEU 83 N 0.00 0.78 -1.02 0.00 5.85 -1.50 -0.70 115.31 118.72 1vr9 h LEU 83 Ca 0.16 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.84 1vr9 h LEU 83 Cb 0.65 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 1vr9 h LEU 83 CO -0.00 0.51 0.18 0.25 -0.34 0.00 0.00 178.44 179.04 1vr9 h LEU 84 N 0.92 0.82 -0.21 2.25 5.85 -1.38 -0.92 115.31 122.63 1vr9 h LEU 84 Ca 0.33 -0.14 -0.11 0.00 0.84 0.00 0.00 57.88 58.81 1vr9 h LEU 84 Cb 0.11 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.92 1vr9 h LEU 84 CO -0.15 0.78 -0.31 -0.07 -0.34 0.00 0.00 178.44 178.34 1vr9 h LEU 85 N 0.86 0.63 -1.47 2.25 -0.00 -1.39 -2.82 115.31 113.37 1vr9 h LEU 85 Ca 0.19 -0.52 -0.05 0.00 -0.00 0.00 0.00 57.88 57.50 1vr9 h LEU 85 Cb 0.26 -0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 40.73 1vr9 h LEU 85 CO -0.01 1.03 -0.20 -0.26 -0.00 0.00 0.00 178.44 179.01 1vr9 h PHE 86 N 0.26 0.10 -0.68 1.13 0.04 -0.99 -0.61 116.94 116.18 1vr9 h PHE 86 Ca 0.02 -0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.72 1vr9 h PHE 86 Cb 0.90 -0.03 -0.03 0.00 2.20 0.00 0.00 35.95 38.99 1vr9 h PHE 86 CO 0.09 0.29 0.21 1.25 -0.60 0.00 0.00 178.31 179.54 1vr9 h LEU 87 N 0.09 0.98 -0.20 1.54 5.85 -1.16 -3.03 115.31 119.38 1vr9 h LEU 87 Ca 0.02 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.52 1vr9 h LEU 87 Cb 0.41 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1vr9 h LEU 87 CO 0.03 0.92 -0.01 -0.33 -0.34 0.00 0.00 178.44 178.70 1vr9 h GLU 88 N 1.01 0.37 -2.95 1.25 5.08 -1.11 -3.44 114.58 114.79 1vr9 h GLU 88 Ca 0.22 -0.12 -0.28 0.00 -1.00 0.00 0.00 59.36 58.18 1vr9 h GLU 88 Cb 0.30 -0.03 -0.35 0.00 0.50 0.00 0.00 28.75 29.17 1vr9 h GLU 88 CO -0.01 0.58 -0.61 -1.01 -1.00 0.00 0.00 179.01 176.97 1vr9 s HIS 89 N -4.91 -0.26 -1.28 4.33 3.76 -0.31 -5.07 115.29 111.55 1vr9 s HIS 89 Ca -0.14 0.66 -0.07 0.00 -0.15 0.00 0.00 55.06 55.36 1vr9 s HIS 89 Cb 0.07 -0.21 0.03 0.00 1.11 0.00 0.00 32.58 33.57 1vr9 s HIS 89 CO 0.74 -0.34 2.67 1.04 -0.85 0.00 0.00 174.74 178.00 1vr9 n GLN 90 N 5.33 4.00 -2.83 1.40 3.00 -1.19 -4.23 117.38 122.85 1vr9 n GLN 90 Ca -0.05 -2.83 -0.33 0.00 -0.01 0.00 0.00 57.00 53.78 1vr9 n GLN 90 Cb 0.50 -2.61 -0.07 0.00 0.00 0.00 0.00 30.24 28.06 1vr9 n GLN 90 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 1vr9 s GLU 91 N -0.01 4.18 0.55 -1.09 0.41 -1.26 -4.96 118.70 116.52 1vr9 s GLU 91 Ca 0.60 1.05 0.32 0.00 -0.41 0.00 0.00 54.97 56.54 1vr9 s GLU 91 Cb 0.21 -2.21 1.55 0.00 -1.78 0.00 0.00 34.13 31.90 1vr9 s GLU 91 CO -0.09 -0.02 2.07 -1.00 -0.49 0.00 0.00 175.26 175.73 1vr9 h PRO 92 N 1.89 0.00 -3.83 0.39 0.13 -1.95 -3.41 132.00 125.21 1vr9 h PRO 92 Ca -0.49 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.23 1vr9 h PRO 92 Cb 1.18 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 31.95 1vr9 h PRO 92 CO 0.62 0.07 -0.77 0.71 -0.23 0.00 0.00 178.00 178.40 1vr9 s TYR 93 N -3.94 0.66 -0.32 1.56 2.02 -1.26 -0.26 117.35 115.80 1vr9 s TYR 93 Ca -0.02 -0.17 -0.13 0.00 -0.37 0.00 0.00 57.07 56.39 1vr9 s TYR 93 Cb 0.11 -0.70 -0.03 0.00 -0.40 0.00 0.00 41.96 40.95 1vr9 s TYR 93 CO 0.54 -0.25 0.27 -1.17 -1.57 0.00 0.00 175.55 173.37 1vr9 s LEU 94 N 1.44 4.33 0.37 -1.29 2.96 0.30 -4.94 118.68 121.86 1vr9 s LEU 94 Ca -0.03 -0.20 -0.28 0.00 -0.22 0.00 0.00 54.13 53.39 1vr9 s LEU 94 Cb -0.13 -2.21 -0.11 0.00 0.50 0.00 0.00 46.19 44.23 1vr9 s LEU 94 CO -0.03 -0.21 1.49 -2.65 -1.32 0.00 0.00 176.35 173.63 1vr9 n PRO 95 N 5.19 2.68 -5.01 0.98 -0.02 -1.26 -0.66 135.00 136.89 1vr9 n PRO 95 Ca -0.12 0.94 -0.32 0.00 -2.02 0.00 0.00 63.50 61.98 1vr9 n PRO 95 Cb 0.50 -2.67 -0.15 0.00 -0.02 0.00 0.00 33.50 31.16 1vr9 n PRO 95 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1vr9 s VAL 96 N -1.06 2.57 0.20 -1.45 1.01 -0.42 -1.27 120.40 119.98 1vr9 s VAL 96 Ca 0.54 -0.85 0.05 0.00 0.00 0.00 0.00 61.98 61.72 1vr9 s VAL 96 Cb -0.48 -2.03 -0.05 0.00 0.00 0.00 0.00 36.38 33.83 1vr9 s VAL 96 CO 0.63 0.55 -0.07 0.68 0.00 0.00 0.00 175.10 176.89 1vr9 s VAL 97 N 0.17 1.28 0.16 2.92 -7.23 -0.30 -0.48 120.40 116.92 1vr9 s VAL 97 Ca -0.11 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 57.98 1vr9 s VAL 97 Cb -0.16 -2.10 0.03 0.00 0.56 0.00 0.00 36.38 34.71 1vr9 s VAL 97 CO 0.06 -0.54 0.22 -0.90 -0.31 0.00 0.00 175.10 173.64 1vr9 n ASP 98 N -0.34 0.36 0.21 4.85 5.68 -0.64 -1.45 116.55 125.22 1vr9 n ASP 98 Ca -0.08 -1.29 0.15 0.00 -0.50 0.00 0.00 54.79 53.07 1vr9 n ASP 98 Cb 0.62 -0.14 0.60 0.00 -1.14 0.00 0.00 41.12 41.06 1vr9 n ASP 98 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1vr9 h GLU 99 N 0.00 0.00 0.00 0.11 5.08 -2.01 -3.38 114.58 114.38 1vr9 h GLU 99 Ca -0.07 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.12 1vr9 h GLU 99 Cb 0.29 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 1vr9 h GLU 99 CO 0.09 0.00 -1.46 0.39 -1.00 0.00 0.00 179.01 177.03 1vr9 n GLU 100 N -2.68 0.54 0.00 2.33 4.71 -1.26 -5.24 120.64 119.04 1vr9 n GLU 100 Ca 0.01 0.28 0.00 0.00 -0.01 0.00 0.00 57.16 57.44 1vr9 n GLU 100 Cb 0.26 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.20 1vr9 n GLU 100 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1vr9 n ARG 102 N -4.41 0.00 -2.00 3.49 5.12 -1.26 -4.96 116.66 112.64 1vr9 n ARG 102 Ca -0.27 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.22 1vr9 n ARG 102 Cb 0.62 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.89 1vr9 n ARG 102 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1vr9 s LEU 103 N 0.00 4.34 0.00 0.55 2.96 -0.02 -1.63 118.68 124.89 1vr9 s LEU 103 Ca 0.00 2.32 0.09 0.00 -0.22 0.00 0.00 54.13 56.32 1vr9 s LEU 103 Cb 0.00 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.10 1vr9 s LEU 103 CO 0.00 -0.88 0.51 0.29 -1.32 0.00 0.00 176.35 174.95 1vr9 n LYS 104 N 6.32 2.94 -2.09 1.98 4.76 0.37 -4.95 118.16 127.49 1vr9 n LYS 104 Ca 0.16 -0.34 0.00 0.00 -2.87 0.00 0.00 58.31 55.26 1vr9 n LYS 104 Cb 0.42 -1.00 0.00 0.00 -1.84 0.00 0.00 35.03 32.61 1vr9 n LYS 104 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1vr9 n GLY 105 N 1.00 0.09 3.11 0.72 0.00 -1.21 -4.93 105.19 103.97 1vr9 n GLY 105 Ca 0.03 -1.50 -0.07 0.00 0.00 0.00 0.00 46.02 44.47 1vr9 n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vr9 s ALA 106 N -1.00 0.37 -0.28 4.61 0.00 -0.81 -1.29 121.76 123.37 1vr9 s ALA 106 Ca 0.00 -1.09 -0.08 0.00 0.00 0.00 0.00 51.96 50.78 1vr9 s ALA 106 Cb 0.00 0.30 -0.02 0.00 0.00 0.00 0.00 23.12 23.41 1vr9 s ALA 106 CO 0.00 -0.39 0.10 0.08 0.00 0.00 0.00 175.76 175.55 1vr9 s VAL 107 N -3.86 4.39 0.41 0.00 1.01 0.16 -0.28 120.40 122.23 1vr9 s VAL 107 Ca 0.06 -0.32 -0.25 0.00 0.00 0.00 0.00 61.98 61.48 1vr9 s VAL 107 Cb 0.07 -3.15 -0.08 0.00 0.00 0.00 0.00 36.38 33.22 1vr9 s VAL 107 CO -0.10 0.21 1.18 -0.94 0.00 0.00 0.00 175.10 175.45 1vr9 s SER 108 N 1.60 6.46 0.28 3.32 1.04 -1.26 -0.54 113.70 124.60 1vr9 s SER 108 Ca 0.05 2.36 0.01 0.00 0.48 0.00 0.00 55.95 58.86 1vr9 s SER 108 Cb -0.16 -2.61 0.56 0.00 0.10 0.00 0.00 66.02 63.90 1vr9 s SER 108 CO 0.05 -0.72 1.81 0.25 0.98 0.00 0.00 173.24 175.61 1vr9 h LEU 109 N 2.57 0.81 -0.06 2.42 5.85 -0.86 -0.20 115.31 125.83 1vr9 h LEU 109 Ca -0.49 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.32 1vr9 h LEU 109 Cb 1.24 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 42.14 1vr9 h LEU 109 CO 0.62 0.40 -0.11 -0.74 -0.34 0.00 0.00 178.44 178.27 1vr9 h HIS 110 N 0.87 -0.28 -0.36 1.25 2.76 -1.92 -1.06 115.15 116.42 1vr9 h HIS 110 Ca 0.49 0.01 -0.08 0.00 -2.20 0.00 0.00 60.37 58.59 1vr9 h HIS 110 Cb 0.56 0.13 -0.02 0.00 1.55 0.00 0.00 27.41 29.64 1vr9 h HIS 110 CO -0.03 -0.17 -0.11 -0.44 -1.30 0.00 0.00 177.93 175.89 1vr9 h ASP 111 N -0.16 0.61 -0.55 3.26 3.32 -1.76 -1.37 116.42 119.76 1vr9 h ASP 111 Ca 0.06 -0.17 0.05 0.00 0.02 0.00 0.00 57.03 56.99 1vr9 h ASP 111 Cb 0.25 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.59 1vr9 h ASP 111 CO -0.16 0.76 0.29 0.15 -1.72 0.00 0.00 179.24 178.56 1vr9 h PHE 112 N 0.58 0.54 -0.62 4.55 3.57 -0.72 -0.75 116.94 124.08 1vr9 h PHE 112 Ca 0.10 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.58 1vr9 h PHE 112 Cb 0.53 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.08 1vr9 h PHE 112 CO 0.02 0.27 0.19 -0.07 -2.23 0.00 0.00 178.31 176.49 1vr9 h LEU 113 N 0.56 0.87 -1.23 0.59 3.38 -0.52 -2.14 115.31 116.83 1vr9 h LEU 113 Ca 0.24 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1vr9 h LEU 113 Cb 0.14 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1vr9 h LEU 113 CO -0.16 0.82 0.36 -0.08 0.09 0.00 0.00 178.44 179.48 1vr9 h GLU 114 N 0.91 0.89 -0.34 1.13 4.81 -0.86 0.19 114.58 121.31 1vr9 h GLU 114 Ca 0.20 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1vr9 h GLU 114 Cb 0.27 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 1vr9 h GLU 114 CO -0.01 0.65 0.22 0.00 -0.73 0.00 0.00 179.01 179.15 1vr9 h ALA 115 N 1.50 0.43 -0.11 2.92 0.00 -0.55 -2.01 119.26 121.43 1vr9 h ALA 115 Ca 0.23 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 1vr9 h ALA 115 Cb 0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1vr9 h ALA 115 CO -0.04 -0.11 -0.28 -0.07 0.00 0.00 0.00 179.25 178.75 1vr9 h LEU 116 N 0.46 0.21 -0.75 0.00 4.07 -0.78 -0.56 115.31 117.96 1vr9 h LEU 116 Ca 0.13 -0.06 -0.04 0.00 0.08 0.00 0.00 57.88 57.98 1vr9 h LEU 116 Cb -0.05 -0.06 -0.03 0.00 1.08 0.00 0.00 40.66 41.60 1vr9 h LEU 116 CO -0.03 0.49 0.30 0.40 -1.08 0.00 0.00 178.44 178.52 1vr9 h ILE 117 N 0.19 1.25 -0.11 1.22 2.04 -0.76 -3.02 117.51 118.32 1vr9 h ILE 117 Ca 0.03 -0.81 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 1vr9 h ILE 117 Cb 0.60 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1vr9 h ILE 117 CO 0.04 0.33 0.02 -0.08 0.00 0.00 0.00 178.15 178.46 1vr9 h GLU 118 N 1.08 0.18 -3.43 2.37 4.81 -0.88 -3.31 114.58 115.40 1vr9 h GLU 118 Ca 0.25 -0.05 -0.67 0.00 -0.13 0.00 0.00 59.36 58.76 1vr9 h GLU 118 Cb 0.22 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.58 1vr9 h GLU 118 CO -0.02 0.38 3.51 0.00 -0.73 0.00 0.00 179.01 182.16 1vr9 n ALA 119 N -2.26 6.61 0.00 2.92 0.00 -0.26 -4.62 120.51 122.89 1vr9 n ALA 119 Ca -0.06 -3.61 0.00 0.00 0.00 0.00 0.00 53.44 49.78 1vr9 n ALA 119 Cb 0.17 -3.43 0.00 0.00 0.00 0.00 0.00 19.45 16.19 1vr9 n ALA 119 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1vr9 n LEU 120 N 4.66 0.00 0.00 0.00 4.32 -1.25 -4.88 117.00 119.85 1vr9 n LEU 120 Ca 0.67 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.66 1vr9 n LEU 120 Cb 0.29 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.09 1vr9 n LEU 120 CO 0.87 0.00 0.09 0.00 -1.22 0.00 0.00 177.39 177.13