#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vjh n THR 2 N 0.00 0.00 -0.06 2.46 -2.24 -1.26 -4.46 114.28 108.71 1vjh n THR 2 Ca 0.00 -0.21 -0.04 0.00 -2.27 0.00 0.00 64.05 61.54 1vjh n THR 2 Cb 0.00 0.75 -0.13 0.00 -2.10 0.00 0.00 70.33 68.85 1vjh n THR 2 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1vjh n LEU 3 N -0.24 0.00 -4.79 3.22 4.77 -1.26 -4.68 117.00 114.02 1vjh n LEU 3 Ca 0.12 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.72 1vjh n LEU 3 Cb 0.40 0.30 -0.06 0.00 -2.33 0.00 0.00 43.42 41.73 1vjh n LEU 3 CO 0.25 0.30 0.19 -0.54 -1.33 0.00 0.00 177.39 176.26 1vjh s LYS 4 N -2.59 4.16 0.00 3.23 1.02 -1.26 -0.60 119.74 123.70 1vjh s LYS 4 Ca -0.08 0.54 0.00 0.00 0.02 0.00 0.00 55.97 56.46 1vjh s LYS 4 Cb 0.06 -3.30 0.00 0.00 -0.52 0.00 0.00 37.83 34.07 1vjh s LYS 4 CO 0.67 0.48 0.00 0.41 -0.92 0.00 0.00 175.35 176.00 1vjh n GLY 5 N 2.29 1.51 3.32 -3.33 0.00 -0.68 -4.93 105.19 103.36 1vjh n GLY 5 Ca -0.10 -0.82 -0.12 0.00 0.00 0.00 0.00 46.02 44.98 1vjh n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vjh s ALA 6 N -1.00 -0.97 -0.07 4.61 0.00 -1.26 -0.81 121.76 122.26 1vjh s ALA 6 Ca 0.00 0.18 -0.04 0.00 0.00 0.00 0.00 51.96 52.10 1vjh s ALA 6 Cb 0.00 0.46 0.03 0.00 0.00 0.00 0.00 23.12 23.61 1vjh s ALA 6 CO 0.00 -0.52 0.16 -1.17 0.00 0.00 0.00 175.76 174.24 1vjh s LEU 7 N -2.27 0.87 0.00 0.00 2.96 0.13 -4.99 118.68 115.38 1vjh s LEU 7 Ca -0.03 0.34 0.01 0.00 -0.22 0.00 0.00 54.13 54.24 1vjh s LEU 7 Cb 0.00 0.47 -0.01 0.00 0.50 0.00 0.00 46.19 47.16 1vjh s LEU 7 CO -0.05 -0.12 -0.05 -0.55 -1.32 0.00 0.00 176.35 174.25 1vjh s SER 8 N 0.87 0.54 -0.02 3.68 0.15 -1.26 -0.28 113.70 117.39 1vjh s SER 8 Ca -0.06 -0.15 0.04 0.00 0.70 0.00 0.00 55.95 56.47 1vjh s SER 8 Cb -0.08 -0.04 -0.01 0.00 -1.71 0.00 0.00 66.02 64.18 1vjh s SER 8 CO -0.05 0.01 -0.13 0.54 1.20 0.00 0.00 173.24 174.81 1vjh s VAL 9 N -0.30 1.07 -0.06 4.45 0.11 -0.44 -4.99 120.40 120.23 1vjh s VAL 9 Ca -0.00 -0.57 0.06 0.00 -2.93 0.00 0.00 61.98 58.54 1vjh s VAL 9 Cb -0.03 -0.90 -0.01 0.00 -1.53 0.00 0.00 36.38 33.91 1vjh s VAL 9 CO -0.00 0.31 -0.24 -0.75 -3.33 0.00 0.00 175.10 171.08 1vjh s LYS 10 N -0.22 2.57 0.29 1.54 2.20 -1.26 -1.30 119.74 123.56 1vjh s LYS 10 Ca 0.03 -0.88 -0.19 0.00 -0.36 0.00 0.00 55.97 54.57 1vjh s LYS 10 Cb -0.06 -2.14 0.02 0.00 -1.51 0.00 0.00 37.83 34.13 1vjh s LYS 10 CO -0.00 0.34 0.69 -0.59 -0.36 0.00 0.00 175.35 175.43 1vjh s PHE 11 N -0.08 -0.04 0.12 4.03 -0.12 -0.65 -5.00 117.98 116.24 1vjh s PHE 11 Ca -0.06 -0.42 0.09 0.00 -0.05 0.00 0.00 56.93 56.49 1vjh s PHE 11 Cb -0.14 0.63 -0.04 0.00 -0.63 0.00 0.00 43.02 42.84 1vjh s PHE 11 CO 0.04 -1.24 -0.17 -0.51 -0.05 0.00 0.00 175.22 173.29 1vjh s ASP 12 N -2.96 3.93 0.13 1.98 -0.00 -1.26 -0.68 116.67 117.81 1vjh s ASP 12 Ca 0.14 -0.55 0.08 0.00 -0.00 0.00 0.00 52.55 52.22 1vjh s ASP 12 Cb -0.05 -0.57 -0.04 0.00 -0.00 0.00 0.00 42.92 42.27 1vjh s ASP 12 CO 0.08 0.18 -0.18 0.68 -0.00 0.00 0.00 175.17 175.93 1vjh s VAL 13 N -1.16 1.67 0.21 -1.27 -7.23 0.19 -4.94 120.40 107.88 1vjh s VAL 13 Ca 0.18 -1.73 0.02 0.00 -1.81 0.00 0.00 61.98 58.65 1vjh s VAL 13 Cb -0.11 -1.66 -0.06 0.00 0.56 0.00 0.00 36.38 35.12 1vjh s VAL 13 CO 0.10 -0.24 1.52 0.11 -0.31 0.00 0.00 175.10 176.29 1vjh h LYS 14 N 3.63 0.33 -7.05 4.82 1.57 -1.91 0.97 116.57 118.93 1vjh h LYS 14 Ca -0.43 -0.23 -0.54 0.00 -1.87 0.00 0.00 60.65 57.58 1vjh h LYS 14 Cb 1.19 0.04 0.12 0.00 0.08 0.00 0.00 32.23 33.67 1vjh h LYS 14 CO 0.46 0.85 0.57 0.00 -0.57 0.00 0.00 179.45 180.76 1vjh s PRO 16 N -2.95 3.11 0.09 0.00 0.02 -1.26 -3.36 135.00 130.64 1vjh s PRO 16 Ca 0.72 1.67 -0.21 0.00 0.02 0.00 0.00 61.00 63.20 1vjh s PRO 16 Cb -0.37 -1.96 -0.10 0.00 0.02 0.00 0.00 34.50 32.08 1vjh s PRO 16 CO 0.43 -1.06 1.65 0.00 -0.33 0.00 0.00 177.00 177.69 1vjh h ALA 17 N 0.90 0.19 -0.52 -1.55 0.00 -1.91 -1.19 119.26 115.19 1vjh h ALA 17 Ca -0.50 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1vjh h ALA 17 Cb 1.27 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 1vjh h ALA 17 CO 0.56 -0.24 0.34 -0.44 0.00 0.00 0.00 179.25 179.46 1vjh h ASP 18 N 0.11 0.60 -0.12 0.00 3.32 -1.94 0.14 116.42 118.53 1vjh h ASP 18 Ca 0.05 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1vjh h ASP 18 Cb 0.13 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 1vjh h ASP 18 CO -0.01 0.45 0.02 0.50 -1.72 0.00 0.00 179.24 178.48 1vjh h LYS 19 N 0.70 0.19 0.02 3.56 3.64 -1.93 -1.13 116.57 121.63 1vjh h LYS 19 Ca 0.19 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.52 1vjh h LYS 19 Cb -0.07 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.73 1vjh h LYS 19 CO -0.04 0.38 -0.01 0.35 -2.27 0.00 0.00 179.45 177.85 1vjh h PHE 20 N -0.02 -0.03 -0.25 1.91 3.57 -1.02 -1.36 116.94 119.74 1vjh h PHE 20 Ca 0.04 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1vjh h PHE 20 Cb 0.27 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 1vjh h PHE 20 CO 0.01 -0.02 0.17 0.35 -2.23 0.00 0.00 178.31 176.59 1vjh h PHE 21 N -0.03 0.31 -0.44 0.41 3.04 -0.73 -2.26 116.94 117.25 1vjh h PHE 21 Ca -0.00 0.01 0.02 0.00 3.98 0.00 0.00 57.97 61.97 1vjh h PHE 21 Cb 0.03 -0.11 -0.03 0.00 2.56 0.00 0.00 35.95 38.40 1vjh h PHE 21 CO -0.08 0.20 0.26 0.77 -2.02 0.00 0.00 178.31 177.44 1vjh h SER 22 N 0.34 0.43 -0.66 0.41 0.02 -1.20 -0.66 113.55 112.22 1vjh h SER 22 Ca 0.09 0.00 0.07 0.00 -0.84 0.00 0.00 61.79 61.12 1vjh h SER 22 Cb -0.04 -0.09 -0.06 0.00 0.14 0.00 0.00 62.40 62.35 1vjh h SER 22 CO -0.02 0.31 0.34 0.00 -1.14 0.00 0.00 176.83 176.32 1vjh h ALA 23 N 1.19 0.89 0.09 3.77 0.00 -1.14 -0.88 119.26 123.17 1vjh h ALA 23 Ca 0.17 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1vjh h ALA 23 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1vjh h ALA 23 CO -0.07 -0.02 -0.04 0.35 0.00 0.00 0.00 179.25 179.47 1vjh h PHE 24 N 0.62 -0.11 -0.60 0.00 3.57 -1.08 -0.44 116.94 118.89 1vjh h PHE 24 Ca 0.31 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.91 1vjh h PHE 24 Cb 0.26 0.04 -0.08 0.00 2.79 0.00 0.00 35.95 38.96 1vjh h PHE 24 CO -0.10 0.05 0.19 0.28 -2.23 0.00 0.00 178.31 176.50 1vjh h VAL 25 N -0.25 0.72 -0.63 1.41 2.07 -0.97 -1.41 116.25 117.18 1vjh h VAL 25 Ca -0.01 -0.12 -0.08 0.00 0.82 0.00 0.00 66.70 67.31 1vjh h VAL 25 Cb 0.21 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 1vjh h VAL 25 CO 0.02 0.06 0.07 -0.08 0.02 0.00 0.00 177.57 177.66 1vjh h GLU 26 N 0.35 1.07 0.00 1.57 4.57 -0.95 -2.43 114.58 118.76 1vjh h GLU 26 Ca 0.31 -0.31 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 1vjh h GLU 26 Cb 0.42 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 28.89 1vjh h GLU 26 CO -0.34 1.01 -0.04 0.22 -1.18 0.00 0.00 179.01 178.67 1vjh h ASP 27 N 0.98 0.00 0.25 1.04 3.58 -0.05 -2.14 116.42 120.09 1vjh h ASP 27 Ca 0.19 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.64 1vjh h ASP 27 Cb 0.48 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.53 1vjh h ASP 27 CO 0.02 0.04 0.00 0.35 -2.88 0.00 0.00 179.24 176.77 1vjh n THR 28 N -3.57 1.02 0.31 2.25 -2.24 -0.74 -1.61 114.28 109.71 1vjh n THR 28 Ca -0.02 0.25 0.18 0.00 -2.27 0.00 0.00 64.05 62.20 1vjh n THR 28 Cb 0.15 -1.09 1.05 0.00 -2.10 0.00 0.00 70.33 68.34 1vjh n THR 28 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1vjh h ASN 29 N 0.00 0.00 -3.66 3.42 2.35 -1.53 -3.39 115.58 112.77 1vjh h ASN 29 Ca 0.00 0.00 -0.63 0.00 -0.55 0.00 0.00 56.30 55.12 1vjh h ASN 29 Cb 0.12 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 38.35 1vjh h ASN 29 CO 0.00 0.00 -0.14 -0.13 -1.65 0.00 0.00 177.43 175.51 1vjh s ARG 30 N -4.43 3.96 0.80 0.81 0.52 -0.63 -5.06 118.95 114.92 1vjh s ARG 30 Ca -0.05 0.09 -0.14 0.00 -0.52 0.00 0.00 55.73 55.11 1vjh s ARG 30 Cb 0.14 -3.68 0.05 0.00 0.52 0.00 0.00 34.95 31.98 1vjh s ARG 30 CO 0.49 -0.36 0.96 -2.30 0.02 0.00 0.00 175.30 174.11 1vjh n PRO 31 N 5.46 0.17 0.00 3.54 -0.02 -1.26 -4.91 135.00 137.97 1vjh n PRO 31 Ca -0.06 0.12 0.14 0.00 -2.02 0.00 0.00 63.50 61.68 1vjh n PRO 31 Cb 0.50 -2.24 0.50 0.00 -0.02 0.00 0.00 33.50 32.25 1vjh n PRO 31 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1vjh n PHE 32 N -3.11 0.00 -3.71 6.00 3.72 -1.26 -4.88 117.46 114.21 1vjh n PHE 32 Ca 0.12 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.42 1vjh n PHE 32 Cb 0.51 -0.02 -0.04 0.00 -0.94 0.00 0.00 39.48 38.98 1vjh n PHE 32 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 176.76 174.88 1vjh s GLU 33 N -2.09 1.24 0.24 -1.08 -1.05 -1.26 -5.03 118.70 109.67 1vjh s GLU 33 Ca 0.36 -0.83 -0.06 0.00 -0.15 0.00 0.00 54.97 54.28 1vjh s GLU 33 Cb 0.21 0.49 0.43 0.00 -0.44 0.00 0.00 34.13 34.82 1vjh s GLU 33 CO 0.37 -0.51 1.66 -0.22 0.95 0.00 0.00 175.26 177.51 1vjh h LYS 34 N 2.29 0.17 -0.52 -4.83 3.64 -1.99 -0.74 116.57 114.59 1vjh h LYS 34 Ca -0.31 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 1vjh h LYS 34 Cb 1.26 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 1vjh h LYS 34 CO 0.42 0.11 0.00 0.09 -2.27 0.00 0.00 179.45 177.80 1vjh n ASN 35 N -5.25 5.11 -4.91 4.20 3.02 -1.26 -5.02 115.26 111.15 1vjh n ASN 35 Ca 0.13 -2.83 -0.27 0.00 -0.03 0.00 0.00 54.58 51.58 1vjh n ASN 35 Cb 0.46 -0.62 0.01 0.00 -0.61 0.00 0.00 39.78 39.01 1vjh n ASN 35 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1vjh s GLY 36 N -1.06 1.55 -0.01 7.41 0.00 -0.29 -4.49 107.32 110.44 1vjh s GLY 36 Ca 0.51 -0.54 0.00 0.00 0.00 0.00 0.00 44.72 44.69 1vjh s GLY 36 CO 0.16 -0.32 0.01 1.25 0.00 0.00 0.00 173.10 174.20 1vjh s LYS 37 N -4.88 0.01 -0.11 2.90 2.20 0.15 -4.81 119.74 115.20 1vjh s LYS 37 Ca 0.51 0.06 0.03 0.00 -0.36 0.00 0.00 55.97 56.21 1vjh s LYS 37 Cb -0.10 -0.11 0.01 0.00 -1.51 0.00 0.00 37.83 36.11 1vjh s LYS 37 CO 0.46 -0.06 -0.21 0.99 -0.36 0.00 0.00 175.35 176.17 1vjh s THR 38 N 0.39 1.88 -0.10 3.43 2.01 -1.26 -0.81 115.64 121.18 1vjh s THR 38 Ca -0.03 -0.90 0.04 0.00 0.31 0.00 0.00 61.69 61.11 1vjh s THR 38 Cb -0.05 -1.66 0.00 0.00 0.01 0.00 0.00 72.50 70.80 1vjh s THR 38 CO -0.01 0.52 -0.23 -1.61 -0.69 0.00 0.00 174.62 172.59 1vjh s GLU 39 N 0.61 2.97 -0.22 4.92 2.02 -0.02 -4.96 118.70 124.01 1vjh s GLU 39 Ca -0.13 -0.85 -0.29 0.00 0.02 0.00 0.00 54.97 53.72 1vjh s GLU 39 Cb -0.17 -2.25 0.01 0.00 0.10 0.00 0.00 34.13 31.82 1vjh s GLU 39 CO 0.04 0.17 1.02 0.42 0.02 0.00 0.00 175.26 176.93 1vjh s ILE 40 N 0.36 4.70 -0.19 -1.63 1.01 -1.26 -0.31 121.20 123.87 1vjh s ILE 40 Ca -0.19 1.99 0.18 0.00 0.00 0.00 0.00 60.65 62.64 1vjh s ILE 40 Cb -0.18 -4.29 -0.25 0.00 0.01 0.00 0.00 42.46 37.74 1vjh s ILE 40 CO 0.09 -0.16 0.10 -0.62 0.00 0.00 0.00 174.94 174.34 1vjh n GLU 41 N 6.23 0.69 -3.73 2.79 1.02 0.59 -4.96 120.64 123.27 1vjh n GLU 41 Ca 0.11 -0.02 -0.13 0.00 -0.02 0.00 0.00 57.16 57.10 1vjh n GLU 41 Cb 0.46 -1.52 -0.10 0.00 -0.02 0.00 0.00 31.44 30.27 1vjh n GLU 41 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1vjh s ALA 42 N -2.55 -1.02 -0.17 0.62 0.00 -0.91 -4.96 121.76 112.78 1vjh s ALA 42 Ca -0.10 1.03 -0.14 0.00 0.00 0.00 0.00 51.96 52.75 1vjh s ALA 42 Cb 0.06 -0.52 0.05 0.00 0.00 0.00 0.00 23.12 22.71 1vjh s ALA 42 CO 0.83 -0.22 0.43 0.54 0.00 0.00 0.00 175.76 177.35 1vjh s VAL 43 N -0.12 -0.01 -0.18 0.00 0.11 -1.26 -0.74 120.40 118.20 1vjh s VAL 43 Ca -0.03 0.02 -0.04 0.00 -2.93 0.00 0.00 61.98 59.00 1vjh s VAL 43 Cb -0.03 -0.61 0.06 0.00 -1.53 0.00 0.00 36.38 34.27 1vjh s VAL 43 CO 0.02 0.01 0.06 -0.62 -3.33 0.00 0.00 175.10 171.23 1vjh s ASP 44 N 0.50 2.70 0.20 3.54 -1.08 0.07 -5.01 116.67 117.59 1vjh s ASP 44 Ca -0.02 -0.74 0.26 0.00 -0.52 0.00 0.00 52.55 51.53 1vjh s ASP 44 Cb -0.04 -0.46 0.85 0.00 -1.46 0.00 0.00 42.92 41.81 1vjh s ASP 44 CO -0.03 -0.32 1.78 0.18 0.52 0.00 0.00 175.17 177.30 1vjh n LEU 45 N 5.14 0.75 -0.08 -1.34 4.32 -1.26 -0.63 117.00 123.90 1vjh n LEU 45 Ca -0.08 0.58 -0.22 0.00 -0.02 0.00 0.00 56.01 56.27 1vjh n LEU 45 Cb 0.48 -0.36 -0.12 0.00 -1.62 0.00 0.00 43.42 41.80 1vjh n LEU 45 CO 0.12 -0.21 -0.75 0.52 -1.22 0.00 0.00 177.39 175.84 1vjh n VAL 46 N -2.21 1.61 0.43 4.08 0.31 -1.26 -4.04 118.33 117.25 1vjh n VAL 46 Ca 0.05 -0.29 0.10 0.00 -0.01 0.00 0.00 64.34 64.20 1vjh n VAL 46 Cb 0.40 -1.90 0.44 0.00 -0.91 0.00 0.00 33.84 31.87 1vjh n VAL 46 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1vjh n LYS 47 N -4.06 0.14 -3.41 5.55 5.02 -1.22 -4.91 118.16 115.26 1vjh n LYS 47 Ca -0.35 0.37 -0.17 0.00 -2.02 0.00 0.00 58.31 56.14 1vjh n LYS 47 Cb 0.83 -1.76 0.09 0.00 -0.02 0.00 0.00 35.03 34.17 1vjh n LYS 47 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1vjh n LYS 48 N -2.02 -6.32 -4.63 1.97 4.01 0.20 -4.58 118.16 106.78 1vjh n LYS 48 Ca 0.03 0.85 -0.29 0.00 -0.51 0.00 0.00 58.31 58.38 1vjh n LYS 48 Cb 0.21 -5.85 -0.08 0.00 -0.51 0.00 0.00 35.03 28.80 1vjh n LYS 48 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 1vjh s THR 49 N -3.36 0.94 -0.12 -0.18 -4.23 -0.67 -1.62 115.64 106.40 1vjh s THR 49 Ca 0.03 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.48 1vjh s THR 49 Cb -0.00 -2.32 0.05 0.00 1.34 0.00 0.00 72.50 71.57 1vjh s THR 49 CO 0.73 0.00 0.28 -0.89 -0.54 0.00 0.00 174.62 174.20 1vjh s THR 51 N -3.04 -0.04 0.06 3.99 2.01 0.08 -0.75 115.64 117.94 1vjh s THR 51 Ca 0.17 0.14 0.08 0.00 0.31 0.00 0.00 61.69 62.39 1vjh s THR 51 Cb 0.03 -0.43 -0.03 0.00 0.01 0.00 0.00 72.50 72.08 1vjh s THR 51 CO 0.10 0.06 -0.22 0.27 -0.69 0.00 0.00 174.62 174.13 1vjh s ILE 52 N 1.31 1.82 0.39 1.82 -4.36 0.38 -0.30 121.20 122.27 1vjh s ILE 52 Ca -0.09 -1.32 0.05 0.00 -0.26 0.00 0.00 60.65 59.03 1vjh s ILE 52 Cb -0.10 -1.58 0.07 0.00 1.25 0.00 0.00 42.46 42.10 1vjh s ILE 52 CO -0.09 0.20 0.54 1.67 0.24 0.00 0.00 174.94 177.50 1vjh n GLN 53 N 1.68 0.66 0.00 0.37 7.27 0.57 -0.30 117.38 127.63 1vjh n GLN 53 Ca -0.17 -2.01 0.00 0.00 0.07 0.00 0.00 57.00 54.89 1vjh n GLN 53 Cb 0.53 -0.20 0.00 0.00 2.41 0.00 0.00 30.24 32.98 1vjh n GLN 53 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 1vjh n SER 55 N -2.62 0.00 0.00 1.69 3.41 0.01 -0.84 113.62 115.27 1vjh n SER 55 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 1vjh n SER 55 Cb 0.39 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 1vjh n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vjh n GLY 56 N -0.73 3.35 0.31 5.00 0.00 -1.26 -0.67 105.19 111.18 1vjh n GLY 56 Ca 0.00 -0.78 0.07 0.00 0.00 0.00 0.00 46.02 45.30 1vjh n GLY 56 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1vjh h SER 57 N 0.00 0.33 0.13 1.61 4.64 -1.99 -1.93 113.55 116.34 1vjh h SER 57 Ca 0.00 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1vjh h SER 57 Cb 0.00 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 1vjh h SER 57 CO 0.00 0.23 -0.06 -0.33 -0.87 0.00 0.00 176.83 175.80 1vjh h GLU 58 N 0.39 -0.17 -0.95 4.77 4.39 -1.96 -3.25 114.58 117.80 1vjh h GLU 58 Ca 0.14 0.01 0.19 0.00 0.34 0.00 0.00 59.36 60.03 1vjh h GLU 58 Cb 0.08 0.04 -0.08 0.00 -0.10 0.00 0.00 28.75 28.68 1vjh h GLU 58 CO -0.03 0.05 0.61 0.97 -1.16 0.00 0.00 179.01 179.44 1vjh h ILE 59 N -1.02 0.72 0.00 3.13 6.09 -1.91 -0.25 117.51 124.28 1vjh h ILE 59 Ca -0.02 -0.21 0.00 0.00 -1.37 0.00 0.00 64.86 63.26 1vjh h ILE 59 Cb 0.29 0.05 0.00 0.00 0.47 0.00 0.00 36.82 37.63 1vjh h ILE 59 CO 0.03 0.11 0.00 0.00 -3.07 0.00 0.00 178.15 175.22 1vjh n GLN 60 N -4.62 0.11 0.25 2.19 3.00 -0.73 -1.21 117.38 116.38 1vjh n GLN 60 Ca 0.21 0.17 0.11 0.00 -0.01 0.00 0.00 57.00 57.48 1vjh n GLN 60 Cb 0.60 -1.50 0.64 0.00 0.00 0.00 0.00 30.24 29.98 1vjh n GLN 60 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.06 177.93 1vjh h LYS 61 N 0.00 0.00 0.00 -1.09 1.57 -1.06 -3.37 116.57 112.61 1vjh h LYS 61 Ca 0.00 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.65 1vjh h LYS 61 Cb 0.22 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 1vjh h LYS 61 CO 0.00 0.16 -1.50 0.66 -0.57 0.00 0.00 179.45 178.20 1vjh n TYR 62 N -3.68 0.00 -4.67 -1.35 4.02 -0.56 -4.83 117.16 106.10 1vjh n TYR 62 Ca -0.02 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.59 1vjh n TYR 62 Cb 0.28 -0.34 -0.17 0.00 -0.02 0.00 0.00 39.34 39.10 1vjh n TYR 62 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1vjh s PHE 63 N -2.18 2.02 0.29 -0.72 0.40 -0.35 -1.07 117.98 116.37 1vjh s PHE 63 Ca -0.12 -0.89 -0.00 0.00 -0.60 0.00 0.00 56.93 55.32 1vjh s PHE 63 Cb 0.03 -1.42 0.44 0.00 0.51 0.00 0.00 43.02 42.57 1vjh s PHE 63 CO 0.20 -0.43 1.84 0.87 0.70 0.00 0.00 175.22 178.40 1vjh h LYS 64 N 7.15 0.78 -3.57 0.44 1.57 -0.87 -3.35 116.57 118.72 1vjh h LYS 64 Ca -0.28 -0.16 -0.32 0.00 -1.87 0.00 0.00 60.65 58.01 1vjh h LYS 64 Cb 1.19 -0.12 -0.35 0.00 0.08 0.00 0.00 32.23 33.04 1vjh h LYS 64 CO 0.49 0.71 -0.74 0.99 -0.57 0.00 0.00 179.45 180.33 1vjh s THR 65 N -5.17 0.02 -0.08 -0.16 2.01 -1.09 -4.99 115.64 106.17 1vjh s THR 65 Ca -0.09 0.20 0.00 0.00 0.31 0.00 0.00 61.69 62.10 1vjh s THR 65 Cb 0.15 -0.15 0.02 0.00 0.01 0.00 0.00 72.50 72.53 1vjh s THR 65 CO 0.79 0.12 -0.06 -0.22 -0.69 0.00 0.00 174.62 174.56 1vjh s LEU 66 N 1.18 1.16 0.11 4.42 2.96 -1.26 -1.42 118.68 125.84 1vjh s LEU 66 Ca -0.08 -0.23 0.10 0.00 -0.22 0.00 0.00 54.13 53.71 1vjh s LEU 66 Cb -0.13 -0.69 -0.04 0.00 0.50 0.00 0.00 46.19 45.83 1vjh s LEU 66 CO -0.03 -0.10 -0.25 -0.54 -1.32 0.00 0.00 176.35 174.11 1vjh s LYS 67 N 1.44 1.39 -0.07 1.98 1.02 0.29 -4.51 119.74 121.29 1vjh s LYS 67 Ca -0.01 -1.27 0.03 0.00 0.02 0.00 0.00 55.97 54.74 1vjh s LYS 67 Cb -0.13 -1.79 0.01 0.00 -0.52 0.00 0.00 37.83 35.39 1vjh s LYS 67 CO -0.04 0.43 -0.17 0.20 -0.92 0.00 0.00 175.35 174.85 1vjh s GLY 68 N -1.90 0.98 -0.09 -3.33 0.00 0.59 -0.26 107.32 103.31 1vjh s GLY 68 Ca 0.12 -0.64 0.03 0.00 0.00 0.00 0.00 44.72 44.23 1vjh s GLY 68 CO 0.05 -0.12 -0.18 -0.56 0.00 0.00 0.00 173.10 172.29 1vjh s SER 69 N 0.43 3.65 0.06 1.64 0.01 0.64 -0.47 113.70 119.66 1vjh s SER 69 Ca -0.13 -0.37 0.04 0.00 1.31 0.00 0.00 55.95 56.79 1vjh s SER 69 Cb -0.16 -1.19 -0.04 0.00 0.21 0.00 0.00 66.02 64.85 1vjh s SER 69 CO 0.05 0.23 -0.02 -0.51 0.41 0.00 0.00 173.24 173.40 1vjh s ILE 70 N -0.06 3.92 -0.04 1.44 2.07 -1.26 -0.76 121.20 126.50 1vjh s ILE 70 Ca -0.04 -0.92 -0.01 0.00 -1.41 0.00 0.00 60.65 58.27 1vjh s ILE 70 Cb -0.14 -2.82 0.03 0.00 0.13 0.00 0.00 42.46 39.65 1vjh s ILE 70 CO 0.04 0.20 0.03 0.00 -1.91 0.00 0.00 174.94 173.30 1vjh s ALA 71 N -1.22 0.37 -0.13 1.50 0.00 -0.09 -4.37 121.76 117.82 1vjh s ALA 71 Ca 0.23 0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.29 1vjh s ALA 71 Cb -0.12 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.45 1vjh s ALA 71 CO 0.15 -0.34 -0.14 0.08 0.00 0.00 0.00 175.76 175.51 1vjh s VAL 72 N 1.72 2.92 0.03 0.00 1.01 -0.64 -1.03 120.40 124.41 1vjh s VAL 72 Ca -0.00 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.31 1vjh s VAL 72 Cb -0.13 -2.22 -0.02 0.00 0.00 0.00 0.00 36.38 34.01 1vjh s VAL 72 CO -0.03 0.52 -0.11 0.42 0.00 0.00 0.00 175.10 175.90 1vjh s THR 73 N 0.45 0.86 0.45 3.92 -4.23 -0.09 -4.71 115.64 112.28 1vjh s THR 73 Ca -0.10 -0.84 -0.25 0.00 -1.18 0.00 0.00 61.69 59.32 1vjh s THR 73 Cb -0.16 -0.79 -0.08 0.00 1.34 0.00 0.00 72.50 72.81 1vjh s THR 73 CO 0.05 -0.03 1.37 -2.84 -0.54 0.00 0.00 174.62 172.63 1vjh s PRO 74 N -0.97 3.73 -0.08 3.99 0.02 -1.26 -0.41 135.00 140.01 1vjh s PRO 74 Ca -0.00 2.28 -0.27 0.00 0.02 0.00 0.00 61.00 63.03 1vjh s PRO 74 Cb -0.07 -2.64 -0.24 0.00 0.02 0.00 0.00 34.50 31.58 1vjh s PRO 74 CO 0.01 -0.74 0.98 0.82 -0.33 0.00 0.00 177.00 177.74 1vjh h ILE 75 N 2.25 1.61 0.00 2.83 2.04 -1.40 -3.43 117.51 121.41 1vjh h ILE 75 Ca -0.50 -1.88 0.00 0.00 1.00 0.00 0.00 64.86 63.47 1vjh h ILE 75 Cb 1.26 2.87 0.00 0.00 -0.74 0.00 0.00 36.82 40.21 1vjh h ILE 75 CO 0.61 0.49 0.00 0.61 0.00 0.00 0.00 178.15 179.87 1vjh n GLY 76 N 1.05 0.95 2.94 5.37 0.00 -1.26 -5.04 105.19 109.20 1vjh n GLY 76 Ca -0.09 0.06 -0.08 0.00 0.00 0.00 0.00 46.02 45.91 1vjh n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vjh s VAL 77 N 1.00 -0.63 -1.40 1.61 1.01 -1.26 -4.85 120.40 115.89 1vjh s VAL 77 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 61.98 61.92 1vjh s VAL 77 Cb 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 36.38 35.56 1vjh s VAL 77 CO 0.00 -0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.60 1vjh n GLY 78 N 5.37 0.37 0.29 4.51 0.00 -1.26 -4.90 105.19 109.57 1vjh n GLY 78 Ca -0.04 -0.27 0.06 0.00 0.00 0.00 0.00 46.02 45.77 1vjh n GLY 78 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vjh n ASP 79 N -0.72 1.40 0.00 1.61 8.00 -1.26 -5.11 116.55 120.46 1vjh n ASP 79 Ca -0.17 -1.20 0.00 0.00 0.71 0.00 0.00 54.79 54.13 1vjh n ASP 79 Cb 0.59 0.41 0.00 0.00 -0.02 0.00 0.00 41.12 42.09 1vjh n ASP 79 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vjh n GLY 80 N 0.91 -1.86 2.96 0.44 0.00 -1.24 -4.80 105.19 101.61 1vjh n GLY 80 Ca 0.05 -1.91 -0.10 0.00 0.00 0.00 0.00 46.02 44.06 1vjh n GLY 80 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vjh s SER 81 N -4.00 0.12 0.08 1.61 0.01 0.33 -1.05 113.70 110.81 1vjh s SER 81 Ca 0.00 -0.27 -0.23 0.00 1.31 0.00 0.00 55.95 56.76 1vjh s SER 81 Cb 0.00 0.09 -0.06 0.00 0.21 0.00 0.00 66.02 66.26 1vjh s SER 81 CO 0.00 -0.20 0.71 -1.00 0.41 0.00 0.00 173.24 173.16 1vjh s HIS 82 N -0.92 3.79 -0.13 2.43 3.76 0.46 -0.63 115.29 124.05 1vjh s HIS 82 Ca -0.10 1.44 0.02 0.00 -0.15 0.00 0.00 55.06 56.28 1vjh s HIS 82 Cb -0.06 -2.71 0.01 0.00 1.11 0.00 0.00 32.58 30.93 1vjh s HIS 82 CO -0.00 0.42 -0.21 0.08 -0.85 0.00 0.00 174.74 174.17 1vjh s VAL 83 N -0.60 1.98 -0.21 -0.90 1.01 0.14 -0.92 120.40 120.91 1vjh s VAL 83 Ca 0.35 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 61.35 1vjh s VAL 83 Cb -0.21 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.40 1vjh s VAL 83 CO 0.22 0.53 -0.01 -0.69 0.00 0.00 0.00 175.10 175.15 1vjh s VAL 84 N 0.83 3.77 -0.12 2.92 1.01 -0.19 -1.63 120.40 126.98 1vjh s VAL 84 Ca -0.07 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.56 1vjh s VAL 84 Cb -0.15 -2.71 0.01 0.00 0.00 0.00 0.00 36.38 33.53 1vjh s VAL 84 CO -0.02 0.42 -0.20 0.86 0.00 0.00 0.00 175.10 176.16 1vjh s TRP 85 N 1.16 2.46 -0.08 5.22 -0.11 -0.42 -0.91 118.94 126.26 1vjh s TRP 85 Ca 0.03 -1.18 0.02 0.00 1.22 0.00 0.00 56.10 56.18 1vjh s TRP 85 Cb -0.14 -1.69 0.01 0.00 -1.50 0.00 0.00 33.47 30.15 1vjh s TRP 85 CO 0.01 -0.54 -0.12 0.99 -4.62 0.00 0.00 176.95 172.66 1vjh s THR 86 N 0.78 1.15 -0.19 5.86 2.01 0.06 -1.32 115.64 123.98 1vjh s THR 86 Ca -0.09 -0.47 -0.18 0.00 0.31 0.00 0.00 61.69 61.26 1vjh s THR 86 Cb -0.16 -1.07 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 1vjh s THR 86 CO -0.00 0.36 0.50 -0.36 -0.69 0.00 0.00 174.62 174.44 1vjh s PHE 87 N 0.84 3.39 -0.19 4.92 2.99 0.62 -0.26 117.98 130.29 1vjh s PHE 87 Ca -0.11 0.77 -0.06 0.00 0.00 0.00 0.00 56.93 57.53 1vjh s PHE 87 Cb -0.15 -2.65 -0.03 0.00 0.00 0.00 0.00 43.02 40.19 1vjh s PHE 87 CO 0.02 -0.06 0.03 -1.01 -0.00 0.00 0.00 175.22 174.19 1vjh s HIS 88 N 1.49 3.13 0.05 0.36 3.76 0.64 -0.70 115.29 124.03 1vjh s HIS 88 Ca 0.24 -0.20 -0.05 0.00 -0.15 0.00 0.00 55.06 54.91 1vjh s HIS 88 Cb -0.15 -2.08 -0.02 0.00 1.11 0.00 0.00 32.58 31.44 1vjh s HIS 88 CO 0.10 -0.05 0.08 -0.59 -0.85 0.00 0.00 174.74 173.42 1vjh s PHE 89 N 0.69 0.29 -0.15 1.40 -0.12 0.01 -0.55 117.98 119.55 1vjh s PHE 89 Ca 0.01 -0.70 0.00 0.00 -0.05 0.00 0.00 56.93 56.20 1vjh s PHE 89 Cb -0.14 -0.20 0.02 0.00 -0.63 0.00 0.00 43.02 42.08 1vjh s PHE 89 CO 0.02 -0.41 -0.14 -2.00 -0.05 0.00 0.00 175.22 172.64 1vjh s GLU 90 N -3.29 2.32 0.61 1.99 2.12 -0.50 -1.68 118.70 120.26 1vjh s GLU 90 Ca 0.01 -0.58 -0.16 0.00 0.36 0.00 0.00 54.97 54.61 1vjh s GLU 90 Cb 0.03 -2.13 -0.03 0.00 0.26 0.00 0.00 34.13 32.26 1vjh s GLU 90 CO -0.08 -0.24 1.07 0.15 -0.54 0.00 0.00 175.26 175.62 1vjh s LYS 91 N 1.48 3.17 0.13 4.30 1.02 0.23 -0.30 119.74 129.77 1vjh s LYS 91 Ca 0.05 1.26 -0.16 0.00 0.02 0.00 0.00 55.97 57.14 1vjh s LYS 91 Cb -0.13 -2.01 -0.01 0.00 -0.52 0.00 0.00 37.83 35.17 1vjh s LYS 91 CO -0.11 -0.94 1.67 -0.39 -0.92 0.00 0.00 175.35 174.67 1vjh h VAL 92 N 0.32 1.20 -3.73 3.17 -1.51 -1.42 -3.40 116.25 110.88 1vjh h VAL 92 Ca -0.47 -0.62 -0.08 0.00 -1.23 0.00 0.00 66.70 64.30 1vjh h VAL 92 Cb 1.23 0.87 -0.12 0.00 -2.13 0.00 0.00 31.29 31.14 1vjh h VAL 92 CO 0.56 0.22 -0.24 -1.38 -1.23 0.00 0.00 177.57 175.51 1vjh s HIS 93 N -5.52 0.24 0.48 5.19 0.00 -1.26 -4.98 115.29 109.43 1vjh s HIS 93 Ca -0.13 -0.60 0.41 0.00 -3.00 0.00 0.00 55.06 51.74 1vjh s HIS 93 Cb 0.10 0.06 2.09 0.00 -4.00 0.00 0.00 32.58 30.83 1vjh s HIS 93 CO 0.75 -0.75 2.25 1.57 -1.00 0.00 0.00 174.74 177.56 1vjh h LYS 94 N 2.48 0.00 -0.01 -0.38 2.10 -1.88 -2.37 116.57 116.51 1vjh h LYS 94 Ca -0.31 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.34 1vjh h LYS 94 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1vjh h LYS 94 CO 0.46 0.00 -0.16 -0.25 -2.00 0.00 0.00 179.45 177.51 1vjh n ASP 95 N -3.07 0.91 -4.67 7.07 10.43 -1.26 -4.84 116.55 121.12 1vjh n ASP 95 Ca -0.02 -0.91 -0.45 0.00 2.57 0.00 0.00 54.79 55.98 1vjh n ASP 95 Cb 0.14 0.04 -0.03 0.00 1.84 0.00 0.00 41.12 43.12 1vjh n ASP 95 CO 0.00 0.00 0.00 -0.38 -1.07 0.00 0.00 177.20 175.75 1vjh n ILE 96 N -0.60 0.63 -1.81 0.53 2.08 -0.89 -4.98 119.36 114.32 1vjh n ILE 96 Ca 0.15 -0.16 -0.34 0.00 0.56 0.00 0.00 62.75 62.96 1vjh n ILE 96 Cb 0.32 -1.51 0.04 0.00 -0.75 0.00 0.00 39.64 37.74 1vjh n ILE 96 CO 0.00 0.00 0.00 -1.81 0.56 0.00 0.00 176.55 175.30 1vjh s ASP 97 N 0.51 5.11 0.55 4.38 -0.00 -1.26 -5.00 116.67 120.95 1vjh s ASP 97 Ca 0.72 2.08 -0.21 0.00 -0.00 0.00 0.00 52.55 55.14 1vjh s ASP 97 Cb -0.65 -2.56 -0.05 0.00 -0.00 0.00 0.00 42.92 39.66 1vjh s ASP 97 CO 0.46 -1.63 1.26 -1.81 -0.00 0.00 0.00 175.17 173.44 1vjh s ASP 98 N -2.35 5.38 -0.66 0.27 1.01 -1.26 -4.82 116.67 114.24 1vjh s ASP 98 Ca 0.69 2.52 -0.06 0.00 0.71 0.00 0.00 52.55 56.41 1vjh s ASP 98 Cb -0.22 -2.61 -0.13 0.00 1.01 0.00 0.00 42.92 40.96 1vjh s ASP 98 CO 0.39 -1.48 2.69 -0.81 0.21 0.00 0.00 175.17 176.17 1vjh n PRO 99 N -1.18 2.22 -0.12 8.23 -0.04 -1.26 -4.55 135.00 138.30 1vjh n PRO 99 Ca 0.11 -1.32 -0.10 0.00 -0.04 0.00 0.00 63.50 62.16 1vjh n PRO 99 Cb 0.48 -2.27 -0.02 0.00 -0.04 0.00 0.00 33.50 31.65 1vjh n PRO 99 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1vjh h HIS 100 N 4.77 0.61 0.00 0.54 3.86 -1.99 -0.76 115.15 122.18 1vjh h HIS 100 Ca 0.43 -0.07 -0.00 0.00 -1.16 0.00 0.00 60.37 59.57 1vjh h HIS 100 Cb 0.66 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.95 1vjh h HIS 100 CO 1.78 0.59 -0.00 0.77 0.86 0.00 0.00 177.93 181.93 1vjh h SER 101 N 0.45 -0.00 -0.84 2.45 0.02 -1.99 -1.09 113.55 112.55 1vjh h SER 101 Ca 0.12 -0.21 -0.02 0.00 -0.84 0.00 0.00 61.79 60.84 1vjh h SER 101 Cb 0.28 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.78 1vjh h SER 101 CO -0.00 0.21 0.46 0.40 -1.14 0.00 0.00 176.83 176.76 1vjh h ILE 102 N -0.21 1.25 -0.07 3.27 2.04 -1.92 -1.50 117.51 120.36 1vjh h ILE 102 Ca -0.00 -0.62 -0.15 0.00 1.00 0.00 0.00 64.86 65.08 1vjh h ILE 102 Cb 0.21 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 1vjh h ILE 102 CO 0.00 0.28 -0.63 -0.29 0.00 0.00 0.00 178.15 177.52 1vjh h ILE 103 N 1.19 1.39 -0.68 -0.67 2.10 -1.00 0.56 117.51 120.40 1vjh h ILE 103 Ca 0.30 -2.02 -0.03 0.00 1.08 0.00 0.00 64.86 64.19 1vjh h ILE 103 Cb 0.03 2.03 -0.03 0.00 -1.09 0.00 0.00 36.82 37.76 1vjh h ILE 103 CO -0.05 0.60 0.30 -0.78 -1.08 0.00 0.00 178.15 177.14 1vjh h ASP 104 N 0.19 0.91 -0.86 2.19 3.58 -0.86 -1.26 116.42 120.32 1vjh h ASP 104 Ca -0.01 -0.15 0.00 0.00 0.42 0.00 0.00 57.03 57.29 1vjh h ASP 104 Cb 1.14 -0.24 -0.04 0.00 1.72 0.00 0.00 39.33 41.92 1vjh h ASP 104 CO 0.10 0.81 0.55 -0.33 -2.88 0.00 0.00 179.24 177.49 1vjh h GLU 105 N 0.95 1.14 -0.44 0.28 4.39 -1.00 -1.88 114.58 118.03 1vjh h GLU 105 Ca 0.23 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.86 1vjh h GLU 105 Cb 0.16 -0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 28.54 1vjh h GLU 105 CO -0.02 0.77 0.29 0.77 -1.16 0.00 0.00 179.01 179.66 1vjh h SER 106 N 1.17 0.51 -0.45 1.42 0.02 -0.32 0.32 113.55 116.21 1vjh h SER 106 Ca 0.31 -0.01 0.07 0.00 -0.84 0.00 0.00 61.79 61.32 1vjh h SER 106 Cb -0.11 -0.13 -0.06 0.00 0.14 0.00 0.00 62.40 62.25 1vjh h SER 106 CO -0.06 0.37 0.11 0.58 -1.14 0.00 0.00 176.83 176.69 1vjh h VAL 107 N 0.60 0.79 -0.90 2.27 2.07 -0.93 1.00 116.25 121.15 1vjh h VAL 107 Ca 0.16 -0.09 0.01 0.00 0.82 0.00 0.00 66.70 67.60 1vjh h VAL 107 Cb -0.07 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.17 1vjh h VAL 107 CO -0.04 0.05 0.58 0.11 0.02 0.00 0.00 177.57 178.29 1vjh h LYS 108 N 0.26 1.19 -0.32 1.57 1.57 -0.97 0.37 116.57 120.23 1vjh h LYS 108 Ca 0.22 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 1vjh h LYS 108 Cb 0.26 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1vjh h LYS 108 CO -0.26 0.80 0.16 -0.92 -0.57 0.00 0.00 179.45 178.66 1vjh h TYR 109 N 1.22 0.45 -0.51 -1.35 5.03 -0.05 -1.65 116.97 120.12 1vjh h TYR 109 Ca 0.33 -0.02 -0.07 0.00 2.58 0.00 0.00 58.73 61.55 1vjh h TYR 109 Cb -0.12 -0.14 -0.02 0.00 1.55 0.00 0.00 36.73 38.00 1vjh h TYR 109 CO -0.01 0.39 0.02 0.74 -1.32 0.00 0.00 178.16 177.98 1vjh h PHE 110 N 0.38 0.89 -0.21 -3.82 0.04 -0.28 -0.39 116.94 113.55 1vjh h PHE 110 Ca 0.11 -0.12 -0.11 0.00 2.80 0.00 0.00 57.97 60.65 1vjh h PHE 110 Cb 0.10 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 37.99 1vjh h PHE 110 CO -0.02 0.81 -0.33 0.87 -0.60 0.00 0.00 178.31 179.04 1vjh h LYS 111 N 0.78 0.43 -0.21 1.51 1.57 -0.70 -0.87 116.57 119.09 1vjh h LYS 111 Ca 0.15 -0.19 -0.18 0.00 -1.87 0.00 0.00 60.65 58.57 1vjh h LYS 111 Cb 0.45 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 1vjh h LYS 111 CO 0.02 0.71 -0.58 0.87 -0.57 0.00 0.00 179.45 179.90 1vjh h LYS 112 N 0.37 0.67 -0.31 3.15 1.57 -1.06 -2.07 116.57 118.89 1vjh h LYS 112 Ca 0.05 -0.44 0.03 0.00 -1.87 0.00 0.00 60.65 58.42 1vjh h LYS 112 Cb 0.76 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.10 1vjh h LYS 112 CO 0.06 1.06 0.13 1.25 -0.57 0.00 0.00 179.45 181.37 1vjh h LEU 113 N 0.50 0.16 -0.30 2.94 5.85 -0.84 -0.10 115.31 123.52 1vjh h LEU 113 Ca 0.00 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.80 1vjh h LEU 113 Cb 1.15 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.14 1vjh h LEU 113 CO 0.12 0.13 0.01 -0.78 -0.34 0.00 0.00 178.44 177.57 1vjh h ASP 114 N 0.28 -0.10 -0.31 1.25 -0.00 -1.02 -1.70 116.42 114.81 1vjh h ASP 114 Ca 0.14 0.07 -0.09 0.00 -0.00 0.00 0.00 57.03 57.15 1vjh h ASP 114 Cb 0.08 0.11 -0.02 0.00 -0.00 0.00 0.00 39.33 39.51 1vjh h ASP 114 CO -0.12 -0.02 -0.10 -0.33 -0.00 0.00 0.00 179.24 178.68 1vjh h GLU 115 N 0.10 0.72 -0.54 0.28 4.39 -1.23 -0.17 114.58 118.13 1vjh h GLU 115 Ca 0.14 -0.23 -0.01 0.00 0.34 0.00 0.00 59.36 59.60 1vjh h GLU 115 Cb 0.19 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.74 1vjh h GLU 115 CO -0.23 0.80 0.29 0.00 -1.16 0.00 0.00 179.01 178.71 1vjh h ALA 116 N 1.23 0.69 0.00 3.43 0.00 -0.73 -2.94 119.26 120.95 1vjh h ALA 116 Ca 0.12 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 1vjh h ALA 116 Cb 0.55 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1vjh h ALA 116 CO 0.03 0.22 -1.27 -0.84 0.00 0.00 0.00 179.25 177.40 1vjh h ILE 117 N 0.73 0.35 -0.61 0.00 3.07 -1.08 -2.70 117.51 117.27 1vjh h ILE 117 Ca 0.19 -1.69 -0.05 0.00 1.55 0.00 0.00 64.86 64.86 1vjh h ILE 117 Cb 0.06 1.88 -0.03 0.00 -0.27 0.00 0.00 36.82 38.46 1vjh h ILE 117 CO -0.03 0.20 0.18 0.25 -1.05 0.00 0.00 178.15 177.70 1vjh h LEU 118 N 0.00 0.86 0.00 0.16 5.85 -1.07 -3.24 115.31 117.87 1vjh h LEU 118 Ca -0.11 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1vjh h LEU 118 Cb 1.40 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1vjh h LEU 118 CO 0.03 0.82 -0.92 0.59 -0.34 0.00 0.00 178.44 178.62 1vjh n ASN 119 N -4.28 0.85 -0.22 1.25 3.02 -1.11 -5.10 115.26 109.68 1vjh n ASN 119 Ca 0.05 -0.87 0.15 0.00 -0.03 0.00 0.00 54.58 53.87 1vjh n ASN 119 Cb 0.22 1.05 0.76 0.00 -0.61 0.00 0.00 39.78 41.20 1vjh n ASN 119 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97