#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vm0 n ASN 21 N 0.00 2.78 -4.57 -5.58 6.94 -1.26 -5.01 115.26 108.55 1vm0 n ASN 21 Ca 0.00 -3.83 -0.34 0.00 -0.02 0.00 0.00 54.58 50.39 1vm0 n ASN 21 Cb 0.00 -0.57 -0.11 0.00 -2.36 0.00 0.00 39.78 36.73 1vm0 n ASN 21 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1vm0 s ARG 22 N -3.33 3.10 -0.14 -3.83 0.52 -1.26 -1.28 118.95 112.74 1vm0 s ARG 22 Ca 0.44 -0.51 0.01 0.00 -0.52 0.00 0.00 55.73 55.16 1vm0 s ARG 22 Cb 0.40 -2.74 0.02 0.00 0.52 0.00 0.00 34.95 33.15 1vm0 s ARG 22 CO -0.02 0.53 -0.17 0.42 0.02 0.00 0.00 175.30 176.09 1vm0 s ILE 23 N -0.44 1.69 -0.21 1.52 1.01 0.49 -4.96 121.20 120.30 1vm0 s ILE 23 Ca 0.07 -0.73 -0.05 0.00 0.00 0.00 0.00 60.65 59.94 1vm0 s ILE 23 Cb -0.12 -1.55 -0.02 0.00 0.01 0.00 0.00 42.46 40.78 1vm0 s ILE 23 CO 0.02 0.48 -0.02 -1.10 0.00 0.00 0.00 174.94 174.32 1vm0 s GLN 24 N 1.18 3.49 -0.38 2.79 -0.21 -1.26 -0.74 119.66 124.52 1vm0 s GLN 24 Ca -0.01 -0.58 -0.19 0.00 0.02 0.00 0.00 55.36 54.60 1vm0 s GLN 24 Cb -0.14 -3.06 0.01 0.00 1.00 0.00 0.00 33.01 30.82 1vm0 s GLN 24 CO -0.06 -0.12 0.58 0.08 -2.12 0.00 0.00 175.29 173.65 1vm0 s VAL 25 N 1.31 4.93 0.00 1.09 1.01 -0.42 -4.78 120.40 123.54 1vm0 s VAL 25 Ca 0.04 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.33 1vm0 s VAL 25 Cb -0.14 -4.06 0.00 0.00 0.00 0.00 0.00 36.38 32.17 1vm0 s VAL 25 CO -0.00 -0.36 0.00 -1.54 0.00 0.00 0.00 175.10 173.20 1vm0 n SER 26 N 5.96 0.00 -4.52 3.32 3.41 -1.26 -4.48 113.62 116.05 1vm0 n SER 26 Ca -0.03 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.16 1vm0 n SER 26 Cb 0.48 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.35 1vm0 n SER 26 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1vm0 s ASN 27 N 0.00 6.23 0.00 4.04 3.84 -1.26 -4.93 114.94 122.85 1vm0 s ASN 27 Ca 0.00 -0.39 0.16 0.00 0.21 0.00 0.00 52.86 52.84 1vm0 s ASN 27 Cb 0.00 -2.24 0.69 0.00 -0.55 0.00 0.00 41.25 39.15 1vm0 s ASN 27 CO 0.00 -0.52 1.51 0.35 -2.79 0.00 0.00 177.10 175.65 1vm0 n THR 28 N 5.42 0.88 0.30 -5.21 -2.24 -1.26 -2.48 114.28 109.69 1vm0 n THR 28 Ca -0.07 0.22 0.14 0.00 -2.27 0.00 0.00 64.05 62.07 1vm0 n THR 28 Cb 0.48 -0.95 0.38 0.00 -2.10 0.00 0.00 70.33 68.15 1vm0 n THR 28 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1vm0 h LYS 29 N 0.00 0.00 -6.72 -0.78 1.57 -2.07 -3.46 116.57 105.12 1vm0 h LYS 29 Ca 0.00 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.28 1vm0 h LYS 29 Cb 0.26 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 1vm0 h LYS 29 CO 0.00 0.00 0.36 0.15 -0.57 0.00 0.00 179.45 179.39 1vm0 s LYS 30 N -3.34 4.82 0.57 3.15 -0.14 -1.04 -5.05 119.74 118.71 1vm0 s LYS 30 Ca 0.05 1.50 -0.17 0.00 -1.36 0.00 0.00 55.97 55.99 1vm0 s LYS 30 Cb 0.07 -3.30 -0.04 0.00 -1.68 0.00 0.00 37.83 32.88 1vm0 s LYS 30 CO 0.60 0.44 1.08 -1.25 -0.76 0.00 0.00 175.35 175.46 1vm0 s PRO 31 N -0.95 3.34 0.24 -1.68 0.04 -1.26 -4.95 135.00 129.78 1vm0 s PRO 31 Ca 0.42 1.35 -0.05 0.00 0.04 0.00 0.00 61.00 62.76 1vm0 s PRO 31 Cb -0.26 -2.03 0.41 0.00 0.04 0.00 0.00 34.50 32.66 1vm0 s PRO 31 CO 0.32 -0.81 1.75 1.25 0.04 0.00 0.00 177.00 179.55 1vm0 h LEU 32 N 0.75 0.36 -1.77 -3.56 5.85 -2.00 -1.67 115.31 113.28 1vm0 h LEU 32 Ca -0.48 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.33 1vm0 h LEU 32 Cb 1.23 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.30 1vm0 h LEU 32 CO 0.57 0.17 0.00 -0.26 -0.34 0.00 0.00 178.44 178.58 1vm0 h PHE 33 N 0.51 0.00 -0.34 1.25 -1.00 -1.99 -1.68 116.94 113.70 1vm0 h PHE 33 Ca 0.39 0.00 0.06 0.00 2.81 0.00 0.00 57.97 61.23 1vm0 h PHE 33 Cb 0.52 0.00 -0.06 0.00 3.61 0.00 0.00 35.95 40.02 1vm0 h PHE 33 CO -0.14 0.00 -0.02 0.35 -1.61 0.00 0.00 178.31 176.89 1vm0 h PHE 34 N 0.00 -0.06 -0.25 -0.55 3.57 -1.67 -0.92 116.94 117.06 1vm0 h PHE 34 Ca 0.00 0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.36 1vm0 h PHE 34 Cb 0.32 0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.14 1vm0 h PHE 34 CO 0.00 -0.08 -0.51 1.88 -2.23 0.00 0.00 178.31 177.36 1vm0 h TYR 35 N 0.07 0.88 -0.08 0.41 0.05 -1.43 -1.15 116.97 115.71 1vm0 h TYR 35 Ca 0.16 -0.30 -0.01 0.00 0.05 0.00 0.00 58.73 58.64 1vm0 h TYR 35 Cb 0.23 -0.17 -0.00 0.00 1.01 0.00 0.00 36.73 37.80 1vm0 h TYR 35 CO -0.26 1.07 0.03 0.28 -1.05 0.00 0.00 178.16 178.23 1vm0 h VAL 36 N 0.55 1.16 -0.58 -2.88 2.07 -1.38 -1.00 116.25 114.19 1vm0 h VAL 36 Ca 0.02 -0.49 -0.10 0.00 0.82 0.00 0.00 66.70 66.95 1vm0 h VAL 36 Cb 1.08 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 1vm0 h VAL 36 CO 0.11 0.14 -0.02 0.78 0.02 0.00 0.00 177.57 178.60 1vm0 h ASN 37 N -0.05 1.00 -0.64 0.57 2.35 -1.18 -0.90 115.58 116.72 1vm0 h ASN 37 Ca 0.03 -0.29 -0.04 0.00 -0.55 0.00 0.00 56.30 55.45 1vm0 h ASN 37 Cb 0.20 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.27 1vm0 h ASN 37 CO -0.00 1.06 0.26 0.25 -1.65 0.00 0.00 177.43 177.35 1vm0 h LEU 38 N 0.93 0.89 -0.80 1.61 5.85 -1.12 0.07 115.31 122.74 1vm0 h LEU 38 Ca 0.16 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1vm0 h LEU 38 Cb 0.56 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 1vm0 h LEU 38 CO 0.03 0.81 0.51 0.00 -0.34 0.00 0.00 178.44 179.46 1vm0 h ALA 39 N 1.11 1.01 -0.41 1.25 0.00 -0.94 -0.29 119.26 120.99 1vm0 h ALA 39 Ca 0.22 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1vm0 h ALA 39 Cb 0.20 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1vm0 h ALA 39 CO -0.02 0.44 0.16 0.87 0.00 0.00 0.00 179.25 180.70 1vm0 h LYS 40 N 1.08 0.62 -0.32 0.00 1.57 -0.80 -2.99 116.57 115.72 1vm0 h LYS 40 Ca 0.29 -0.11 0.01 0.00 -1.87 0.00 0.00 60.65 58.97 1vm0 h LYS 40 Cb -0.10 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.09 1vm0 h LYS 40 CO -0.06 0.58 0.19 -0.09 -0.57 0.00 0.00 179.45 179.50 1vm0 h ARG 41 N 0.52 0.39 -1.54 3.15 2.43 -0.61 -0.93 114.38 117.80 1vm0 h ARG 41 Ca 0.14 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1vm0 h ARG 41 Cb 0.20 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1vm0 h ARG 41 CO -0.01 0.26 0.00 0.66 -1.51 0.00 0.00 179.97 179.37 1vm0 n TYR 42 N -4.90 0.00 0.00 2.20 4.01 -0.15 -1.25 117.16 117.08 1vm0 n TYR 42 Ca -0.01 -0.09 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 1vm0 n TYR 42 Cb 0.04 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 38.96 1vm0 n TYR 42 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 1vm0 n GLN 44 N 0.81 0.00 0.09 -0.72 7.27 -0.35 -0.50 117.38 123.98 1vm0 n GLN 44 Ca 0.00 0.00 -0.19 0.00 0.07 0.00 0.00 57.00 56.88 1vm0 n GLN 44 Cb 0.10 0.00 -0.12 0.00 2.41 0.00 0.00 30.24 32.64 1vm0 n GLN 44 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 1vm0 h GLN 45 N 0.00 0.50 0.00 3.69 4.20 -1.44 -3.40 115.11 118.67 1vm0 h GLN 45 Ca 0.00 -0.68 0.00 0.00 0.06 0.00 0.00 58.65 58.03 1vm0 h GLN 45 Cb 0.00 0.23 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1vm0 h GLN 45 CO 0.00 1.29 0.00 0.66 -0.67 0.00 0.00 178.83 180.11 1vm0 n TYR 46 N -3.72 0.00 0.00 2.96 4.01 0.34 -5.02 117.16 115.73 1vm0 n TYR 46 Ca -0.11 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.63 1vm0 n TYR 46 Cb 0.97 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.00 1vm0 n TYR 46 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1vm0 n ASN 47 N -0.54 0.00 -4.35 7.72 5.15 -1.24 -4.93 115.26 117.08 1vm0 n ASN 47 Ca 0.00 0.00 -0.18 0.00 -0.60 0.00 0.00 54.58 53.80 1vm0 n ASN 47 Cb 0.01 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.16 1vm0 n ASN 47 CO 0.00 0.00 0.00 1.51 1.40 0.00 0.00 177.26 180.17 1vm0 s ASP 48 N 0.03 1.59 -0.07 1.20 -4.77 -1.26 -0.77 116.67 112.62 1vm0 s ASP 48 Ca 0.00 -1.35 -0.13 0.00 -3.30 0.00 0.00 52.55 47.77 1vm0 s ASP 48 Cb 0.00 0.07 0.03 0.00 -1.09 0.00 0.00 42.92 41.93 1vm0 s ASP 48 CO 0.00 -0.66 0.33 0.54 0.70 0.00 0.00 175.17 176.08 1vm0 s VAL 49 N -3.58 0.03 -0.17 2.11 0.11 -0.44 -4.89 120.40 113.57 1vm0 s VAL 49 Ca 0.35 -0.24 -0.02 0.00 -2.93 0.00 0.00 61.98 59.15 1vm0 s VAL 49 Cb 0.08 -0.55 -0.01 0.00 -1.53 0.00 0.00 36.38 34.37 1vm0 s VAL 49 CO 0.13 -0.13 -0.10 -0.70 -3.33 0.00 0.00 175.10 170.97 1vm0 s GLU 50 N -0.56 3.38 -0.11 1.54 2.12 -0.41 -1.37 118.70 123.29 1vm0 s GLU 50 Ca -0.07 -0.66 -0.01 0.00 0.36 0.00 0.00 54.97 54.59 1vm0 s GLU 50 Cb -0.04 -2.78 -0.03 0.00 0.26 0.00 0.00 34.13 31.54 1vm0 s GLU 50 CO 0.02 0.04 -0.06 -0.51 -0.54 0.00 0.00 175.26 174.22 1vm0 s LEU 51 N 0.81 3.18 0.04 2.70 1.43 0.68 -0.38 118.68 127.15 1vm0 s LEU 51 Ca -0.03 -0.08 -0.00 0.00 -1.03 0.00 0.00 54.13 52.98 1vm0 s LEU 51 Cb -0.15 -1.73 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 1vm0 s LEU 51 CO 0.01 0.27 -0.04 -0.94 0.23 0.00 0.00 176.35 175.88 1vm0 s SER 52 N -0.22 0.48 -0.02 2.29 1.04 0.08 -0.50 113.70 116.85 1vm0 s SER 52 Ca 0.03 -0.80 -0.29 0.00 0.48 0.00 0.00 55.95 55.38 1vm0 s SER 52 Cb -0.13 0.15 0.10 0.00 0.10 0.00 0.00 66.02 66.24 1vm0 s SER 52 CO 0.03 -0.46 0.83 0.00 0.98 0.00 0.00 173.24 174.61 1vm0 s ALA 53 N -2.90 -1.80 0.13 5.32 0.00 -0.90 -1.30 121.76 120.32 1vm0 s ALA 53 Ca -0.02 1.13 0.07 0.00 0.00 0.00 0.00 51.96 53.14 1vm0 s ALA 53 Cb 0.01 0.14 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 1vm0 s ALA 53 CO -0.06 -0.55 -0.05 -0.51 0.00 0.00 0.00 175.76 174.59 1vm0 s LEU 54 N -1.94 3.19 0.00 0.00 1.43 -1.26 -1.48 118.68 118.62 1vm0 s LEU 54 Ca -0.00 -0.38 0.00 0.00 -1.03 0.00 0.00 54.13 52.72 1vm0 s LEU 54 Cb -0.01 -1.91 0.00 0.00 0.03 0.00 0.00 46.19 44.30 1vm0 s LEU 54 CO -0.03 0.14 0.00 0.61 0.23 0.00 0.00 176.35 177.30 1vm0 n GLY 55 N 0.35 0.00 1.62 -3.19 0.00 -0.39 -3.79 105.19 99.78 1vm0 n GLY 55 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1vm0 n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vm0 n ALA 57 N 0.00 0.00 -0.25 4.61 0.00 -1.26 -4.45 120.51 119.16 1vm0 n ALA 57 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 1vm0 n ALA 57 Cb 0.00 0.00 0.26 0.00 0.00 0.00 0.00 19.45 19.71 1vm0 n ALA 57 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1vm0 h ILE 58 N 0.00 1.11 -0.81 0.00 2.04 -1.83 -2.17 117.51 115.84 1vm0 h ILE 58 Ca 0.00 -0.34 0.01 0.00 1.00 0.00 0.00 64.86 65.53 1vm0 h ILE 58 Cb 0.00 0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 36.08 1vm0 h ILE 58 CO 0.00 0.18 0.54 0.00 0.00 0.00 0.00 178.15 178.87 1vm0 h ALA 59 N 1.53 1.41 0.09 1.87 0.00 -1.94 -0.16 119.26 122.06 1vm0 h ALA 59 Ca 0.33 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1vm0 h ALA 59 Cb 0.08 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.54 1vm0 h ALA 59 CO -0.10 0.54 -0.04 1.15 0.00 0.00 0.00 179.25 180.79 1vm0 h THR 60 N 1.11 0.92 -0.51 0.00 2.02 -1.80 -1.34 112.91 113.32 1vm0 h THR 60 Ca 0.30 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.42 1vm0 h THR 60 Cb -0.12 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.21 1vm0 h THR 60 CO -0.06 0.01 0.27 0.58 0.37 0.00 0.00 175.52 176.68 1vm0 h VAL 61 N -0.15 1.18 -0.68 3.16 2.07 -1.19 0.13 116.25 120.79 1vm0 h VAL 61 Ca -0.01 -0.48 0.08 0.00 0.82 0.00 0.00 66.70 67.11 1vm0 h VAL 61 Cb 0.11 0.57 -0.07 0.00 -1.52 0.00 0.00 31.29 30.39 1vm0 h VAL 61 CO 0.02 0.20 0.33 0.58 0.02 0.00 0.00 177.57 178.72 1vm0 h VAL 62 N 0.67 0.87 -0.25 2.57 2.07 -0.99 -1.31 116.25 119.89 1vm0 h VAL 62 Ca 0.18 -0.20 -0.13 0.00 0.82 0.00 0.00 66.70 67.37 1vm0 h VAL 62 Cb 0.08 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 30.07 1vm0 h VAL 62 CO -0.03 0.11 -0.35 0.74 0.02 0.00 0.00 177.57 178.06 1vm0 h THR 63 N 0.59 1.31 -0.60 2.57 2.02 -0.57 -0.78 112.91 117.44 1vm0 h THR 63 Ca 0.33 -1.54 0.04 0.00 0.77 0.00 0.00 66.41 66.00 1vm0 h THR 63 Cb 0.32 1.70 -0.04 0.00 -1.74 0.00 0.00 68.15 68.39 1vm0 h THR 63 CO -0.25 0.49 0.35 0.58 0.37 0.00 0.00 175.52 177.06 1vm0 h VAL 64 N 0.40 1.03 -0.54 3.16 2.07 -0.83 -0.89 116.25 120.64 1vm0 h VAL 64 Ca 0.03 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 1vm0 h VAL 64 Cb 0.94 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 1vm0 h VAL 64 CO 0.08 0.12 0.20 0.74 0.02 0.00 0.00 177.57 178.74 1vm0 h THR 65 N 0.68 1.22 -0.53 2.57 2.02 -1.03 -1.55 112.91 116.29 1vm0 h THR 65 Ca 0.25 -0.72 -0.01 0.00 0.77 0.00 0.00 66.41 66.71 1vm0 h THR 65 Cb 0.08 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 1vm0 h THR 65 CO -0.13 0.27 0.30 -0.33 0.37 0.00 0.00 175.52 176.00 1vm0 h GLU 66 N 0.74 0.73 -0.05 6.66 5.08 -0.84 -1.21 114.58 125.69 1vm0 h GLU 66 Ca 0.18 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.47 1vm0 h GLU 66 Cb 0.22 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1vm0 h GLU 66 CO -0.01 0.56 -0.02 0.82 -1.00 0.00 0.00 179.01 179.35 1vm0 h ILE 67 N 0.71 0.92 -0.17 3.13 2.04 -0.92 0.19 117.51 123.42 1vm0 h ILE 67 Ca 0.19 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.98 1vm0 h ILE 67 Cb 0.03 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 1vm0 h ILE 67 CO -0.03 0.00 -0.20 -0.07 0.00 0.00 0.00 178.15 177.85 1vm0 h LEU 68 N -0.02 0.28 0.10 1.44 3.38 -1.07 -1.56 115.31 117.86 1vm0 h LEU 68 Ca 0.03 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1vm0 h LEU 68 Cb 0.06 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1vm0 h LEU 68 CO -0.06 0.50 -0.05 0.11 0.09 0.00 0.00 178.44 179.03 1vm0 h LYS 69 N 0.26 -0.13 0.00 1.13 1.79 -0.98 0.12 116.57 118.77 1vm0 h LYS 69 Ca 0.05 0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.52 1vm0 h LYS 69 Cb 0.51 0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.19 1vm0 h LYS 69 CO 0.03 0.39 -0.04 -0.91 -1.08 0.00 0.00 179.45 177.84 1vm0 h ASN 70 N -0.83 0.00 -0.16 0.86 2.35 -0.93 -2.50 115.58 114.37 1vm0 h ASN 70 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1vm0 h ASN 70 Cb 0.58 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.95 1vm0 h ASN 70 CO 0.02 0.04 0.00 0.59 -1.65 0.00 0.00 177.43 176.43 1vm0 n ASN 71 N -4.38 2.84 0.00 5.81 3.02 -0.59 -4.97 115.26 116.99 1vm0 n ASN 71 Ca -0.03 -1.91 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 1vm0 n ASN 71 Cb 0.13 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.20 1vm0 n ASN 71 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vm0 n GLY 72 N 1.36 0.78 0.07 7.41 0.00 -0.94 -4.97 105.19 108.90 1vm0 n GLY 72 Ca 0.17 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.11 1vm0 n GLY 72 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1vm0 h PHE 73 N 0.00 0.00 -4.14 1.61 0.04 -1.23 -3.37 116.94 109.85 1vm0 h PHE 73 Ca 0.00 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.62 1vm0 h PHE 73 Cb 0.00 0.00 -0.16 0.00 2.20 0.00 0.00 35.95 37.99 1vm0 h PHE 73 CO 0.00 0.99 -0.69 0.00 -0.60 0.00 0.00 178.31 178.02 1vm0 s ALA 74 N -2.69 0.57 -0.06 2.45 0.00 -0.81 -1.85 121.76 119.38 1vm0 s ALA 74 Ca -0.00 -1.18 0.03 0.00 0.00 0.00 0.00 51.96 50.80 1vm0 s ALA 74 Cb 0.10 0.24 0.01 0.00 0.00 0.00 0.00 23.12 23.46 1vm0 s ALA 74 CO 0.82 -0.32 -0.13 0.08 0.00 0.00 0.00 175.76 176.20 1vm0 s VAL 75 N -3.64 1.19 0.44 0.00 1.01 -0.42 -4.46 120.40 114.53 1vm0 s VAL 75 Ca 0.06 -0.54 -0.23 0.00 0.00 0.00 0.00 61.98 61.28 1vm0 s VAL 75 Cb 0.06 -1.07 -0.09 0.00 0.00 0.00 0.00 36.38 35.28 1vm0 s VAL 75 CO -0.08 0.36 1.06 -1.83 0.00 0.00 0.00 175.10 174.61 1vm0 s GLU 76 N 0.48 4.00 -0.05 2.72 1.03 -1.26 -0.88 118.70 124.74 1vm0 s GLU 76 Ca -0.11 1.48 0.03 0.00 0.03 0.00 0.00 54.97 56.40 1vm0 s GLU 76 Cb -0.14 -2.37 -0.05 0.00 -0.80 0.00 0.00 34.13 30.77 1vm0 s GLU 76 CO 0.03 -0.28 -0.01 1.17 -1.33 0.00 0.00 175.26 174.84 1vm0 n LYS 77 N -0.43 2.19 -3.66 -4.83 4.81 -0.16 -4.88 118.16 111.19 1vm0 n LYS 77 Ca 0.07 0.01 -0.08 0.00 -0.87 0.00 0.00 58.31 57.44 1vm0 n LYS 77 Cb 0.50 -1.12 -0.08 0.00 0.02 0.00 0.00 35.03 34.35 1vm0 n LYS 77 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1vm0 s LYS 78 N -2.12 0.57 0.23 1.64 2.20 -1.15 -4.99 119.74 116.13 1vm0 s LYS 78 Ca -0.04 1.06 0.05 0.00 -0.36 0.00 0.00 55.97 56.67 1vm0 s LYS 78 Cb 0.02 0.10 -0.05 0.00 -1.51 0.00 0.00 37.83 36.38 1vm0 s LYS 78 CO 0.18 -0.16 -0.04 0.42 -0.36 0.00 0.00 175.35 175.39 1vm0 s ILE 79 N 1.60 1.26 0.00 5.43 1.01 -1.26 -0.39 121.20 128.85 1vm0 s ILE 79 Ca -0.10 -2.07 0.00 0.00 0.00 0.00 0.00 60.65 58.48 1vm0 s ILE 79 Cb -0.07 -2.31 0.00 0.00 0.01 0.00 0.00 42.46 40.10 1vm0 s ILE 79 CO -0.17 -0.38 0.00 0.41 0.00 0.00 0.00 174.94 174.80 1vm0 n THR 81 N -0.44 0.00 -3.83 2.92 -1.04 -1.26 -4.99 114.28 105.63 1vm0 n THR 81 Ca -0.06 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.86 1vm0 n THR 81 Cb 0.63 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 69.09 1vm0 n THR 81 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1vm0 s SER 82 N 0.00 -0.15 -0.20 8.00 1.04 -0.33 -4.99 113.70 117.07 1vm0 s SER 82 Ca 0.00 -0.64 -0.13 0.00 0.48 0.00 0.00 55.95 55.65 1vm0 s SER 82 Cb 0.00 0.54 -0.04 0.00 0.10 0.00 0.00 66.02 66.61 1vm0 s SER 82 CO 0.00 -1.01 0.29 -0.63 0.98 0.00 0.00 173.24 172.86 1vm0 s ILE 83 N -3.92 5.29 0.22 -1.02 -1.09 -1.26 -0.55 121.20 118.87 1vm0 s ILE 83 Ca 0.13 0.49 0.11 0.00 -2.23 0.00 0.00 60.65 59.15 1vm0 s ILE 83 Cb 0.00 -3.62 -0.05 0.00 -1.58 0.00 0.00 42.46 37.21 1vm0 s ILE 83 CO -0.01 0.33 -0.21 0.68 -1.23 0.00 0.00 174.94 174.50 1vm0 s VAL 84 N 0.90 2.47 0.06 2.92 -7.23 -0.42 -4.95 120.40 114.15 1vm0 s VAL 84 Ca 0.15 -2.10 -0.21 0.00 -1.81 0.00 0.00 61.98 58.01 1vm0 s VAL 84 Cb -0.14 -2.22 -0.06 0.00 0.56 0.00 0.00 36.38 34.52 1vm0 s VAL 84 CO 0.05 -0.20 0.61 -1.81 -0.31 0.00 0.00 175.10 173.44 1vm0 s ASP 85 N -2.92 7.08 -0.13 4.85 1.01 -1.26 -1.51 116.67 123.79 1vm0 s ASP 85 Ca 0.24 1.29 0.02 0.00 0.71 0.00 0.00 52.55 54.81 1vm0 s ASP 85 Cb -0.07 -2.38 0.01 0.00 1.01 0.00 0.00 42.92 41.49 1vm0 s ASP 85 CO 0.12 0.20 -0.20 -0.63 0.21 0.00 0.00 175.17 174.87 1vm0 s ILE 86 N -0.79 1.91 0.26 0.77 -1.09 0.13 -4.95 121.20 117.44 1vm0 s ILE 86 Ca 0.31 -0.89 -0.31 0.00 -2.23 0.00 0.00 60.65 57.53 1vm0 s ILE 86 Cb -0.20 -1.70 -0.12 0.00 -1.58 0.00 0.00 42.46 38.86 1vm0 s ILE 86 CO 0.20 0.52 1.60 0.29 -1.23 0.00 0.00 174.94 176.32 1vm0 n LYS 87 N 4.14 2.60 -3.48 2.79 4.76 -1.26 -1.09 118.16 126.62 1vm0 n LYS 87 Ca -0.20 0.93 -0.25 0.00 -2.87 0.00 0.00 58.31 55.92 1vm0 n LYS 87 Cb 0.51 -2.71 -0.12 0.00 -1.84 0.00 0.00 35.03 30.87 1vm0 n LYS 87 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1vm0 s ASP 88 N 0.66 2.75 0.09 4.39 -1.08 -1.26 -4.84 116.67 117.37 1vm0 s ASP 88 Ca 0.68 -1.29 -0.34 0.00 -0.52 0.00 0.00 52.55 51.07 1vm0 s ASP 88 Cb -0.53 -0.05 -0.16 0.00 -1.46 0.00 0.00 42.92 40.72 1vm0 s ASP 88 CO 0.44 -0.39 1.58 0.44 0.52 0.00 0.00 175.17 177.76 1vm0 h ASP 89 N 8.06 -1.19 -1.00 -0.34 3.32 -1.93 -2.04 116.42 121.30 1vm0 h ASP 89 Ca -0.12 0.09 0.19 0.00 0.02 0.00 0.00 57.03 57.20 1vm0 h ASP 89 Cb 1.03 0.38 -0.10 0.00 0.22 0.00 0.00 39.33 40.86 1vm0 h ASP 89 CO 0.37 -0.63 0.61 0.00 -1.72 0.00 0.00 179.24 177.87 1vm0 h ALA 90 N -0.72 1.72 -0.44 3.45 0.00 -1.96 -1.50 119.26 119.81 1vm0 h ALA 90 Ca -0.06 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1vm0 h ALA 90 Cb 0.82 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1vm0 h ALA 90 CO -0.02 -0.08 -0.04 -0.09 0.00 0.00 0.00 179.25 179.02 1vm0 h ARG 91 N 0.74 0.74 0.00 0.00 9.65 -1.91 -3.47 114.38 120.14 1vm0 h ARG 91 Ca 0.57 -0.21 0.00 0.00 -1.10 0.00 0.00 59.98 59.24 1vm0 h ARG 91 Cb 0.91 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.41 1vm0 h ARG 91 CO -0.36 0.78 0.00 0.41 2.80 0.00 0.00 179.97 183.60 1vm0 n GLY 92 N -0.61 1.15 3.53 2.80 0.00 -0.56 -5.01 105.19 106.49 1vm0 n GLY 92 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 1vm0 n GLY 92 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1vm0 s ARG 93 N -0.45 1.40 0.61 1.61 1.70 -1.25 -5.05 118.95 117.52 1vm0 s ARG 93 Ca 0.00 -0.68 -0.19 0.00 -0.47 0.00 0.00 55.73 54.39 1vm0 s ARG 93 Cb 0.00 0.57 -0.03 0.00 -0.57 0.00 0.00 34.95 34.92 1vm0 s ARG 93 CO 0.00 -0.61 1.25 -2.14 -1.08 0.00 0.00 175.30 172.71 1vm0 s PRO 94 N -3.82 2.85 0.26 3.89 0.02 -1.26 -4.29 135.00 132.65 1vm0 s PRO 94 Ca 0.05 1.93 0.04 0.00 0.02 0.00 0.00 61.00 63.04 1vm0 s PRO 94 Cb -0.02 -1.93 -0.03 0.00 0.02 0.00 0.00 34.50 32.54 1vm0 s PRO 94 CO -0.06 -1.33 0.40 0.14 -0.33 0.00 0.00 177.00 175.82 1vm0 s VAL 95 N -1.50 5.22 -0.14 3.83 -7.23 -0.25 -4.83 120.40 115.50 1vm0 s VAL 95 Ca 0.79 -0.84 -0.03 0.00 -1.81 0.00 0.00 61.98 60.09 1vm0 s VAL 95 Cb -0.33 -3.85 -0.03 0.00 0.56 0.00 0.00 36.38 32.73 1vm0 s VAL 95 CO 0.36 -0.37 -0.04 -1.10 -0.31 0.00 0.00 175.10 173.63 1vm0 s GLN 96 N -4.02 3.57 0.07 4.82 -0.21 -1.26 0.20 119.66 122.83 1vm0 s GLN 96 Ca 0.36 -0.53 0.04 0.00 0.02 0.00 0.00 55.36 55.25 1vm0 s GLN 96 Cb -0.09 -2.87 -0.03 0.00 1.00 0.00 0.00 33.01 31.02 1vm0 s GLN 96 CO 0.31 0.29 -0.12 0.15 -2.12 0.00 0.00 175.29 173.79 1vm0 s LYS 97 N 0.22 0.77 0.29 2.91 -0.14 -0.57 -4.96 119.74 118.26 1vm0 s LYS 97 Ca -0.03 -0.95 -0.28 0.00 -1.36 0.00 0.00 55.97 53.35 1vm0 s LYS 97 Cb -0.14 -0.68 -0.09 0.00 -1.68 0.00 0.00 37.83 35.23 1vm0 s LYS 97 CO 0.03 0.14 1.05 0.00 -0.76 0.00 0.00 175.35 175.81 1vm0 s ALA 98 N -1.47 3.33 -0.04 5.17 0.00 -1.26 -1.30 121.76 126.18 1vm0 s ALA 98 Ca -0.02 0.78 0.03 0.00 0.00 0.00 0.00 51.96 52.75 1vm0 s ALA 98 Cb -0.09 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.75 1vm0 s ALA 98 CO 0.02 -0.07 -0.14 0.21 0.00 0.00 0.00 175.76 175.78 1vm0 s LYS 99 N -1.60 1.54 0.04 0.00 2.20 0.29 -1.27 119.74 120.94 1vm0 s LYS 99 Ca 0.46 -0.47 0.05 0.00 -0.36 0.00 0.00 55.97 55.65 1vm0 s LYS 99 Cb -0.28 -1.34 -0.03 0.00 -1.51 0.00 0.00 37.83 34.67 1vm0 s LYS 99 CO 0.36 0.15 -0.11 -1.50 -0.36 0.00 0.00 175.35 173.89 1vm0 s ILE 100 N 0.25 3.34 -0.07 5.43 2.07 -0.55 -1.19 121.20 130.49 1vm0 s ILE 100 Ca -0.07 -1.00 -0.02 0.00 -1.41 0.00 0.00 60.65 58.15 1vm0 s ILE 100 Cb -0.12 -2.46 0.04 0.00 0.13 0.00 0.00 42.46 40.04 1vm0 s ILE 100 CO 0.02 0.32 0.05 -1.61 -1.91 0.00 0.00 174.94 171.81 1vm0 s GLU 101 N -1.59 0.09 -0.12 3.50 2.02 -1.26 -2.11 118.70 119.23 1vm0 s GLU 101 Ca 0.17 0.23 0.03 0.00 0.02 0.00 0.00 54.97 55.42 1vm0 s GLU 101 Cb -0.11 -0.85 0.01 0.00 0.10 0.00 0.00 34.13 33.28 1vm0 s GLU 101 CO 0.08 -0.39 -0.20 0.42 0.02 0.00 0.00 175.26 175.19 1vm0 s ILE 102 N 2.12 1.88 -0.20 -1.63 1.01 0.35 -4.21 121.20 120.52 1vm0 s ILE 102 Ca 0.04 -0.88 -0.06 0.00 0.00 0.00 0.00 60.65 59.76 1vm0 s ILE 102 Cb -0.13 -1.67 -0.03 0.00 0.01 0.00 0.00 42.46 40.64 1vm0 s ILE 102 CO -0.04 0.52 0.02 -0.89 0.00 0.00 0.00 174.94 174.54 1vm0 s THR 103 N 0.79 4.18 0.06 2.92 2.01 0.48 -0.23 115.64 125.84 1vm0 s THR 103 Ca -0.09 -0.24 0.09 0.00 0.31 0.00 0.00 61.69 61.76 1vm0 s THR 103 Cb -0.16 -2.89 -0.03 0.00 0.01 0.00 0.00 72.50 69.43 1vm0 s THR 103 CO -0.00 0.43 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.37 1vm0 s LEU 104 N 0.88 2.38 0.23 4.42 1.43 -0.47 -0.99 118.68 126.56 1vm0 s LEU 104 Ca 0.02 -0.56 0.12 0.00 -1.03 0.00 0.00 54.13 52.68 1vm0 s LEU 104 Cb -0.14 -1.38 -0.05 0.00 0.03 0.00 0.00 46.19 44.66 1vm0 s LEU 104 CO 0.02 0.24 -0.22 0.68 0.23 0.00 0.00 176.35 177.30 1vm0 s VAL 105 N -0.91 2.42 0.29 -1.59 -7.23 -0.05 -1.32 120.40 112.01 1vm0 s VAL 105 Ca 0.14 -2.19 -0.30 0.00 -1.81 0.00 0.00 61.98 57.82 1vm0 s VAL 105 Cb -0.10 -2.21 -0.12 0.00 0.56 0.00 0.00 36.38 34.51 1vm0 s VAL 105 CO 0.04 -0.24 1.46 0.29 -0.31 0.00 0.00 175.10 176.35 1vm0 n LYS 106 N -0.12 2.36 -1.96 4.82 5.02 0.05 -1.30 118.16 127.03 1vm0 n LYS 106 Ca -0.09 0.84 -0.29 0.00 -2.02 0.00 0.00 58.31 56.75 1vm0 n LYS 106 Cb 0.58 -2.53 0.08 0.00 -0.02 0.00 0.00 35.03 33.13 1vm0 n LYS 106 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1vm0 s SER 107 N 0.21 4.77 0.49 4.39 1.04 -0.77 -4.64 113.70 119.19 1vm0 s SER 107 Ca 0.63 0.79 0.32 0.00 0.48 0.00 0.00 55.95 58.17 1vm0 s SER 107 Cb -0.56 -1.39 1.34 0.00 0.10 0.00 0.00 66.02 65.52 1vm0 s SER 107 CO 0.53 -1.72 1.94 1.05 0.98 0.00 0.00 173.24 176.02 1vm0 h GLU 108 N -0.88 0.00 -0.01 4.02 4.11 -1.89 -2.76 114.58 117.16 1vm0 h GLU 108 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 1vm0 h GLU 108 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 1vm0 h GLU 108 CO 0.65 0.00 -0.47 1.63 0.07 0.00 0.00 179.01 180.89 1vm0 n LYS 109 N -2.89 0.84 -0.10 1.06 4.76 -1.26 -4.64 118.16 115.94 1vm0 n LYS 109 Ca 0.01 -0.63 -0.06 0.00 -2.87 0.00 0.00 58.31 54.76 1vm0 n LYS 109 Cb 0.27 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.98 1vm0 n LYS 109 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 1vm0 h PHE 110 N 1.53 -0.43 -0.27 2.13 3.57 -1.65 -0.46 116.94 121.37 1vm0 h PHE 110 Ca 0.00 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 1vm0 h PHE 110 Cb 0.62 0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.59 1vm0 h PHE 110 CO 0.00 -0.25 0.07 -0.44 -2.23 0.00 0.00 178.31 175.46 1vm0 h ASP 111 N -0.12 0.40 -0.90 0.41 3.32 -1.82 -2.50 116.42 115.22 1vm0 h ASP 111 Ca 0.18 -0.23 0.05 0.00 0.02 0.00 0.00 57.03 57.05 1vm0 h ASP 111 Cb 0.39 -0.11 -0.06 0.00 0.22 0.00 0.00 39.33 39.77 1vm0 h ASP 111 CO -0.42 0.53 0.57 -0.33 -1.72 0.00 0.00 179.24 177.87 1vm0 h GLU 112 N 0.26 1.04 -1.40 3.56 5.08 -1.80 -1.26 114.58 120.07 1vm0 h GLU 112 Ca 0.08 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1vm0 h GLU 112 Cb 0.28 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1vm0 h GLU 112 CO 0.00 0.69 0.00 1.28 -1.00 0.00 0.00 179.01 179.98 1vm0 n LEU 113 N -4.56 1.57 0.00 1.33 4.77 -0.21 -0.35 117.00 119.56 1vm0 n LEU 113 Ca 0.13 -0.79 0.00 0.00 -0.03 0.00 0.00 56.01 55.32 1vm0 n LEU 113 Cb 0.14 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 1vm0 n LEU 113 CO 0.32 0.27 0.00 0.00 -1.33 0.00 0.00 177.39 176.65 1vm0 n ALA 115 N 0.69 0.00 0.24 -1.18 0.00 -0.48 -1.70 120.51 118.08 1vm0 n ALA 115 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.61 1vm0 n ALA 115 Cb 0.27 0.00 0.87 0.00 0.00 0.00 0.00 19.45 20.58 1vm0 n ALA 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vm0 h ALA 116 N 0.00 1.69 -0.72 0.00 0.00 -0.95 -0.74 119.26 118.54 1vm0 h ALA 116 Ca 0.00 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.00 1vm0 h ALA 116 Cb 0.00 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1vm0 h ALA 116 CO 0.00 -0.22 0.48 0.00 0.00 0.00 0.00 179.25 179.51 1vm0 h ALA 117 N 1.81 1.85 -0.41 0.00 0.00 -1.58 -1.08 119.26 119.86 1vm0 h ALA 117 Ca 0.06 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.77 1vm0 h ALA 117 Cb 0.36 -0.14 -0.11 0.00 0.00 0.00 0.00 17.79 17.90 1vm0 h ALA 117 CO -0.00 -0.00 0.01 0.09 0.00 0.00 0.00 179.25 179.35 1vm0 n ASN 118 N -4.49 2.87 -3.87 0.00 4.13 -0.34 -4.96 115.26 108.60 1vm0 n ASN 118 Ca 0.12 -3.63 -0.26 0.00 1.68 0.00 0.00 54.58 52.49 1vm0 n ASN 118 Cb 0.34 -0.64 0.01 0.00 -1.54 0.00 0.00 39.78 37.94 1vm0 n ASN 118 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1vm0 n GLU 119 N -1.01 -4.42 -0.02 3.52 1.02 -0.41 -4.90 120.64 114.42 1vm0 n GLU 119 Ca 0.34 0.53 0.01 0.00 -0.02 0.00 0.00 57.16 58.02 1vm0 n GLU 119 Cb 1.08 -5.05 0.02 0.00 -0.02 0.00 0.00 31.44 27.48 1vm0 n GLU 119 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1vm0 n GLU 120 N -4.41 1.86 -1.93 3.49 -0.58 -0.88 -4.98 120.64 113.21 1vm0 n GLU 120 Ca -0.19 -1.30 -0.40 0.00 -0.42 0.00 0.00 57.16 54.85 1vm0 n GLU 120 Cb 0.63 -1.04 0.01 0.00 -0.57 0.00 0.00 31.44 30.46 1vm0 n GLU 120 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1vm0 s LYS 121 N -0.75 3.83 0.00 3.49 2.20 -1.26 -4.83 119.74 122.43 1vm0 s LYS 121 Ca 0.03 2.28 0.07 0.00 -0.36 0.00 0.00 55.97 58.00 1vm0 s LYS 121 Cb 0.02 -2.71 0.06 0.00 -1.51 0.00 0.00 37.83 33.69 1vm0 s LYS 121 CO 0.03 -0.65 0.74 0.39 -0.36 0.00 0.00 175.35 175.49