#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mpe s GLN 2 N 0.00 4.18 -0.13 0.03 0.74 -1.26 -5.06 119.66 118.16 1mpe s GLN 2 Ca 0.00 0.55 -0.03 0.00 0.05 0.00 0.00 55.36 55.93 1mpe s GLN 2 Cb 0.00 -3.60 -0.03 0.00 1.10 0.00 0.00 33.01 30.48 1mpe s GLN 2 CO 0.00 -0.27 -0.02 0.71 -0.55 0.00 0.00 175.29 175.16 1mpe s TYR 3 N 2.02 3.07 -0.16 1.67 2.02 -1.26 -5.10 117.35 119.61 1mpe s TYR 3 Ca 0.27 -0.11 -0.05 0.00 -0.37 0.00 0.00 57.07 56.81 1mpe s TYR 3 Cb -0.16 -1.90 -0.03 0.00 -0.40 0.00 0.00 41.96 39.47 1mpe s TYR 3 CO 0.10 0.14 0.01 0.15 -1.57 0.00 0.00 175.55 174.38 1mpe s LYS 4 N -0.07 3.70 -0.06 -0.62 -0.14 -1.26 -5.10 119.74 116.19 1mpe s LYS 4 Ca 0.02 -0.43 -0.02 0.00 -1.36 0.00 0.00 55.97 54.18 1mpe s LYS 4 Cb -0.13 -3.02 0.04 0.00 -1.68 0.00 0.00 37.83 33.04 1mpe s LYS 4 CO 0.02 0.33 0.12 0.08 -0.76 0.00 0.00 175.35 175.14 1mpe s VAL 5 N 0.17 -0.10 -0.30 3.17 1.01 -1.26 -5.13 120.40 117.96 1mpe s VAL 5 Ca 0.01 0.24 -0.12 0.00 0.00 0.00 0.00 61.98 62.11 1mpe s VAL 5 Cb -0.13 -0.21 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 1mpe s VAL 5 CO 0.02 0.10 0.21 -0.63 0.00 0.00 0.00 175.10 174.80 1mpe s ILE 6 N 1.44 5.30 -0.17 2.22 1.01 -1.26 -5.07 121.20 124.67 1mpe s ILE 6 Ca -0.06 0.02 0.01 0.00 0.00 0.00 0.00 60.65 60.62 1mpe s ILE 6 Cb -0.12 -3.61 0.02 0.00 0.01 0.00 0.00 42.46 38.76 1mpe s ILE 6 CO -0.05 0.14 -0.20 -0.76 0.00 0.00 0.00 174.94 174.07 1mpe s LEU 7 N 1.75 2.09 -0.25 2.97 1.02 -1.26 -5.07 118.68 119.93 1mpe s LEU 7 Ca 0.07 -0.63 -0.07 0.00 0.02 0.00 0.00 54.13 53.51 1mpe s LEU 7 Cb -0.17 -1.45 0.12 0.00 0.02 0.00 0.00 46.19 44.71 1mpe s LEU 7 CO 0.11 0.00 0.53 0.54 0.02 0.00 0.00 176.35 177.55 1mpe s ASN 8 N 1.26 -0.69 0.05 2.29 4.22 -0.24 -4.61 114.94 117.21 1mpe s ASN 8 Ca 0.04 1.17 -0.26 0.00 -2.14 0.00 0.00 52.86 51.68 1mpe s ASN 8 Cb -0.13 1.81 -0.17 0.00 1.28 0.00 0.00 41.25 44.04 1mpe s ASN 8 CO -0.12 -0.23 1.54 1.23 -2.04 0.00 0.00 177.10 177.48 1mpe h GLY 9 N 8.09 -0.25 -3.34 0.45 0.00 -1.40 -3.45 103.07 103.17 1mpe h GLY 9 Ca -0.18 0.09 0.39 0.00 0.00 0.00 0.00 47.33 47.64 1mpe h GLY 9 CO 0.13 -0.09 -0.71 1.17 0.00 0.00 0.00 176.54 177.04 1mpe n LYS 10 N -5.13 -3.06 -1.75 4.80 4.81 -1.26 -4.67 118.16 111.90 1mpe n LYS 10 Ca -0.09 2.15 -0.42 0.00 -0.87 0.00 0.00 58.31 59.08 1mpe n LYS 10 Cb 0.17 -3.70 -0.03 0.00 0.02 0.00 0.00 35.03 31.50 1mpe n LYS 10 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1mpe s THR 11 N -2.73 2.32 -0.17 3.15 -4.23 -1.26 -4.99 115.64 107.73 1mpe s THR 11 Ca 0.00 0.08 -0.04 0.00 -1.18 0.00 0.00 61.69 60.55 1mpe s THR 11 Cb 0.00 -3.05 0.07 0.00 1.34 0.00 0.00 72.50 70.86 1mpe s THR 11 CO 0.00 0.00 0.14 -0.22 -0.54 0.00 0.00 174.62 174.00 1mpe s LEU 12 N 1.87 0.14 0.34 4.79 2.96 -1.26 -5.14 118.68 122.38 1mpe s LEU 12 Ca 0.77 -0.37 -0.26 0.00 -0.22 0.00 0.00 54.13 54.05 1mpe s LEU 12 Cb -0.47 0.03 -0.09 0.00 0.50 0.00 0.00 46.19 46.15 1mpe s LEU 12 CO 0.34 -0.33 1.00 -1.59 -1.32 0.00 0.00 176.35 174.45 1mpe s LYS 13 N 2.22 4.45 0.00 1.98 -2.85 -1.26 -4.96 119.74 119.33 1mpe s LYS 13 Ca 0.04 1.47 0.00 0.00 -1.00 0.00 0.00 55.97 56.48 1mpe s LYS 13 Cb -0.15 -2.79 0.00 0.00 -2.06 0.00 0.00 37.83 32.83 1mpe s LYS 13 CO -0.10 0.13 0.00 0.41 0.10 0.00 0.00 175.35 175.89 1mpe n GLY 14 N 0.61 0.56 2.77 0.59 0.00 -1.26 -4.99 105.19 103.47 1mpe n GLY 14 Ca 0.02 -1.84 -0.01 0.00 0.00 0.00 0.00 46.02 44.19 1mpe n GLY 14 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1mpe n GLU 15 N -1.03 1.57 -3.74 1.61 0.28 -1.26 -5.09 120.64 112.98 1mpe n GLU 15 Ca 0.00 -2.51 -0.14 0.00 -0.16 0.00 0.00 57.16 54.35 1mpe n GLU 15 Cb 0.00 -0.72 -0.15 0.00 1.43 0.00 0.00 31.44 32.00 1mpe n GLU 15 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 1mpe s THR 16 N -2.09 -0.07 0.39 3.84 2.01 -1.26 -5.12 115.64 113.34 1mpe s THR 16 Ca 0.19 0.20 0.00 0.00 0.31 0.00 0.00 61.69 62.40 1mpe s THR 16 Cb 0.38 -0.23 0.00 0.00 0.01 0.00 0.00 72.50 72.65 1mpe s THR 16 CO -0.08 0.08 0.00 0.35 -0.69 0.00 0.00 174.62 174.29 1mpe n THR 17 N 4.33 0.00 -2.53 -0.82 -2.24 -1.26 -4.84 114.28 106.92 1mpe n THR 17 Ca -0.24 0.38 0.02 0.00 -2.27 0.00 0.00 64.05 61.94 1mpe n THR 17 Cb 0.51 -0.77 0.02 0.00 -2.10 0.00 0.00 70.33 67.99 1mpe n THR 17 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1mpe n THR 18 N -3.83 0.28 -3.70 4.28 -2.24 -1.26 -5.08 114.28 102.74 1mpe n THR 18 Ca -0.03 -1.32 -0.37 0.00 -2.27 0.00 0.00 64.05 60.06 1mpe n THR 18 Cb 0.65 1.02 -0.11 0.00 -2.10 0.00 0.00 70.33 69.78 1mpe n THR 18 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1mpe s GLU 19 N -0.83 3.89 -0.42 -0.78 2.02 -1.26 -4.98 118.70 116.33 1mpe s GLU 19 Ca 0.28 -0.36 0.02 0.00 0.02 0.00 0.00 54.97 54.93 1mpe s GLU 19 Cb 0.34 -3.49 0.25 0.00 0.10 0.00 0.00 34.13 31.33 1mpe s GLU 19 CO -0.12 -0.09 1.03 0.00 0.02 0.00 0.00 175.26 176.10 1mpe n ALA 20 N 4.73 -2.32 -3.45 5.21 0.00 -1.26 -5.04 120.51 118.38 1mpe n ALA 20 Ca -0.15 -0.94 -0.29 0.00 0.00 0.00 0.00 53.44 52.05 1mpe n ALA 20 Cb 0.52 -2.13 0.02 0.00 0.00 0.00 0.00 19.45 17.86 1mpe n ALA 20 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1mpe n VAL 21 N 1.60 -5.21 -3.96 0.00 0.24 -1.26 -2.99 118.33 106.76 1mpe n VAL 21 Ca 0.06 0.16 -0.32 0.00 -2.04 0.00 0.00 64.34 62.20 1mpe n VAL 21 Cb 0.66 -4.16 -0.05 0.00 -1.47 0.00 0.00 33.84 28.82 1mpe n VAL 21 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1mpe s ASP 22 N -2.05 6.16 0.25 -1.34 2.15 -1.26 -1.08 116.67 119.49 1mpe s ASP 22 Ca 0.26 0.25 -0.03 0.00 0.43 0.00 0.00 52.55 53.46 1mpe s ASP 22 Cb -0.03 -1.87 0.46 0.00 -0.30 0.00 0.00 42.92 41.17 1mpe s ASP 22 CO 0.86 0.23 1.76 0.00 -0.17 0.00 0.00 175.17 177.85 1mpe h ALA 23 N 3.59 1.14 -0.05 3.66 0.00 -1.93 0.57 119.26 126.24 1mpe h ALA 23 Ca -0.48 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.43 1mpe h ALA 23 Cb 1.18 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1mpe h ALA 23 CO 0.70 -0.10 -0.36 0.00 0.00 0.00 0.00 179.25 179.49 1mpe h ALA 24 N 1.52 1.31 -0.75 0.00 0.00 -1.99 -2.85 119.26 116.50 1mpe h ALA 24 Ca 0.42 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1mpe h ALA 24 Cb 0.56 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1mpe h ALA 24 CO -0.34 0.49 0.30 1.15 0.00 0.00 0.00 179.25 180.85 1mpe h THR 25 N 0.09 1.25 -0.24 0.00 2.02 -1.29 -2.25 112.91 112.48 1mpe h THR 25 Ca 0.01 -0.78 -0.04 0.00 0.77 0.00 0.00 66.41 66.37 1mpe h THR 25 Cb 0.68 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 1mpe h THR 25 CO 0.05 0.32 0.00 0.15 0.37 0.00 0.00 175.52 176.41 1mpe h PHE 26 N 1.09 0.46 0.12 3.16 3.57 -1.22 -1.80 116.94 122.32 1mpe h PHE 26 Ca 0.25 -0.08 0.02 0.00 3.53 0.00 0.00 57.97 61.69 1mpe h PHE 26 Cb 0.20 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 1mpe h PHE 26 CO 0.02 0.59 -0.23 1.49 -2.23 0.00 0.00 178.31 177.95 1mpe h GLU 27 N 0.20 -0.41 -0.05 1.11 4.81 -1.35 0.28 114.58 119.17 1mpe h GLU 27 Ca 0.07 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.31 1mpe h GLU 27 Cb 0.41 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.88 1mpe h GLU 27 CO 0.01 -0.28 -0.02 -0.22 -0.73 0.00 0.00 179.01 177.78 1mpe h LYS 28 N -0.43 0.10 -0.39 1.92 3.64 -1.45 -1.75 116.57 118.20 1mpe h LYS 28 Ca 0.03 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1mpe h LYS 28 Cb 0.45 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 1mpe h LYS 28 CO -0.12 0.46 0.12 0.28 -2.27 0.00 0.00 179.45 177.91 1mpe h VAL 29 N -0.27 1.22 -0.13 2.00 2.07 -1.33 -1.40 116.25 118.40 1mpe h VAL 29 Ca 0.01 -0.71 -0.05 0.00 0.82 0.00 0.00 66.70 66.77 1mpe h VAL 29 Cb 0.42 0.95 -0.00 0.00 -1.52 0.00 0.00 31.29 31.14 1mpe h VAL 29 CO 0.01 0.25 -0.11 0.58 0.02 0.00 0.00 177.57 178.32 1mpe h VAL 30 N 0.48 1.34 -0.37 2.57 2.07 -1.01 -0.46 116.25 120.87 1mpe h VAL 30 Ca 0.12 -1.23 -0.02 0.00 0.82 0.00 0.00 66.70 66.39 1mpe h VAL 30 Cb 0.26 1.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 1mpe h VAL 30 CO -0.00 0.36 0.14 0.50 0.02 0.00 0.00 177.57 178.59 1mpe h LYS 31 N -0.06 0.56 -0.52 1.57 3.64 -1.35 0.15 116.57 120.56 1mpe h LYS 31 Ca 0.02 -0.11 -0.05 0.00 -1.27 0.00 0.00 60.65 59.24 1mpe h LYS 31 Cb 0.62 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.33 1mpe h LYS 31 CO 0.03 0.55 0.12 0.37 -2.27 0.00 0.00 179.45 178.25 1mpe h GLN 32 N 0.46 0.84 -0.12 1.90 4.15 -1.29 0.23 115.11 121.28 1mpe h GLN 32 Ca 0.12 -0.21 -0.03 0.00 0.77 0.00 0.00 58.65 59.31 1mpe h GLN 32 Cb 0.20 -0.11 -0.00 0.00 0.21 0.00 0.00 27.48 27.78 1mpe h GLN 32 CO -0.01 0.81 -0.04 0.35 -1.93 0.00 0.00 178.83 178.01 1mpe h PHE 33 N 0.73 0.28 0.03 3.99 3.57 -0.94 -3.27 116.94 121.33 1mpe h PHE 33 Ca 0.16 -0.06 -0.21 0.00 3.53 0.00 0.00 57.97 61.38 1mpe h PHE 33 Cb 0.35 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 1mpe h PHE 33 CO 0.02 0.56 -0.96 0.74 -2.23 0.00 0.00 178.31 176.45 1mpe h PHE 34 N -0.09 0.29 -0.57 0.41 0.04 -0.98 -3.22 116.94 112.83 1mpe h PHE 34 Ca 0.03 -0.18 0.16 0.00 2.80 0.00 0.00 57.97 60.79 1mpe h PHE 34 Cb 0.48 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.58 1mpe h PHE 34 CO 0.06 1.04 0.44 -0.91 -0.60 0.00 0.00 178.31 178.33 1mpe h ASN 35 N 0.09 0.00 0.10 2.17 -0.26 -0.61 0.24 115.58 117.31 1mpe h ASN 35 Ca -0.06 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.68 1mpe h ASN 35 Cb 1.63 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.89 1mpe h ASN 35 CO 0.15 0.00 0.00 0.44 -1.06 0.00 0.00 177.43 176.96 1mpe h ASP 36 N 0.00 0.00 0.00 5.81 3.32 -1.61 -1.77 116.42 122.18 1mpe h ASP 36 Ca 0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.32 1mpe h ASP 36 Cb 1.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.69 1mpe h ASP 36 CO -0.00 0.00 -1.29 -0.46 -1.72 0.00 0.00 179.24 175.77 1mpe n ASN 37 N -2.62 0.91 0.00 6.45 0.23 0.83 -4.98 115.26 116.09 1mpe n ASN 37 Ca -0.02 -0.45 0.00 0.00 -0.53 0.00 0.00 54.58 53.58 1mpe n ASN 37 Cb 0.08 1.39 0.00 0.00 -2.08 0.00 0.00 39.78 39.17 1mpe n ASN 37 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1mpe n GLY 38 N 1.46 1.41 3.83 4.83 0.00 -0.66 -5.13 105.19 110.91 1mpe n GLY 38 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1mpe n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mpe s VAL 39 N -1.57 4.76 0.35 1.61 1.01 -1.20 -5.00 120.40 120.35 1mpe s VAL 39 Ca 0.00 1.03 -0.09 0.00 0.00 0.00 0.00 61.98 62.92 1mpe s VAL 39 Cb 0.00 -3.81 0.04 0.00 0.00 0.00 0.00 36.38 32.61 1mpe s VAL 39 CO 0.00 0.31 0.62 0.47 0.00 0.00 0.00 175.10 176.50 1mpe n ASP 40 N 1.00 -1.78 0.00 3.32 8.00 -1.26 -4.21 116.55 121.62 1mpe n ASP 40 Ca -0.06 -2.57 0.00 0.00 0.71 0.00 0.00 54.79 52.87 1mpe n ASP 40 Cb 0.51 3.06 0.00 0.00 -0.02 0.00 0.00 41.12 44.68 1mpe n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mpe n GLY 41 N -0.51 0.27 3.27 0.44 0.00 -1.26 -5.06 105.19 102.34 1mpe n GLY 41 Ca -0.05 -1.86 -0.11 0.00 0.00 0.00 0.00 46.02 44.01 1mpe n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mpe s GLU 42 N 0.00 0.92 -0.10 1.61 2.02 -1.26 -5.13 118.70 116.76 1mpe s GLU 42 Ca 0.00 -0.68 -0.30 0.00 0.02 0.00 0.00 54.97 54.02 1mpe s GLU 42 Cb 0.00 0.40 -0.03 0.00 0.10 0.00 0.00 34.13 34.59 1mpe s GLU 42 CO 0.00 -0.32 1.34 -1.58 0.02 0.00 0.00 175.26 174.72 1mpe s TRP 43 N -3.31 2.76 -0.05 1.61 0.52 -1.26 -5.01 118.94 114.19 1mpe s TRP 43 Ca 0.00 0.87 0.03 0.00 0.02 0.00 0.00 56.10 57.02 1mpe s TRP 43 Cb 0.02 -3.59 -0.03 0.00 -1.15 0.00 0.00 33.47 28.72 1mpe s TRP 43 CO -0.08 -2.14 -0.12 0.95 0.02 0.00 0.00 176.95 175.57 1mpe s THR 44 N 3.17 3.22 0.44 2.01 -4.23 -1.26 -5.11 115.64 113.88 1mpe s THR 44 Ca 0.60 -0.67 -0.23 0.00 -1.18 0.00 0.00 61.69 60.21 1mpe s THR 44 Cb -0.26 -2.28 -0.08 0.00 1.34 0.00 0.00 72.50 71.22 1mpe s THR 44 CO 0.21 0.59 1.14 -0.31 -0.54 0.00 0.00 174.62 175.71 1mpe s TYR 45 N -0.76 2.96 0.68 3.99 2.02 -1.26 -5.01 117.35 119.97 1mpe s TYR 45 Ca 0.12 1.56 -0.13 0.00 -0.37 0.00 0.00 57.07 58.24 1mpe s TYR 45 Cb -0.11 -3.33 0.01 0.00 -0.40 0.00 0.00 41.96 38.13 1mpe s TYR 45 CO 0.01 -1.33 1.08 -0.51 -1.57 0.00 0.00 175.55 173.23 1mpe s ASP 46 N -1.38 5.19 0.19 2.29 1.11 -1.26 -4.97 116.67 117.84 1mpe s ASP 46 Ca 0.62 1.81 -0.31 0.00 0.18 0.00 0.00 52.55 54.86 1mpe s ASP 46 Cb -0.27 -2.52 -0.09 0.00 1.07 0.00 0.00 42.92 41.10 1mpe s ASP 46 CO 0.34 -1.57 1.44 -1.81 1.18 0.00 0.00 175.17 174.75 1mpe s ASP 47 N -3.14 6.71 0.39 0.27 1.11 -1.26 -4.95 116.67 115.81 1mpe s ASP 47 Ca 0.62 2.53 -0.26 0.00 0.18 0.00 0.00 52.55 55.62 1mpe s ASP 47 Cb -0.17 -2.60 -0.11 0.00 1.07 0.00 0.00 42.92 41.11 1mpe s ASP 47 CO 0.47 -0.70 1.27 0.00 1.18 0.00 0.00 175.17 177.40 1mpe n ALA 48 N 3.21 1.27 -2.39 5.23 0.00 -1.26 -5.02 120.51 121.55 1mpe n ALA 48 Ca 0.10 0.30 -0.09 0.00 0.00 0.00 0.00 53.44 53.75 1mpe n ALA 48 Cb 0.41 -2.26 -0.10 0.00 0.00 0.00 0.00 19.45 17.50 1mpe n ALA 48 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1mpe s THR 49 N -1.17 0.33 0.08 0.00 2.01 -1.26 -5.17 115.64 110.47 1mpe s THR 49 Ca 0.59 -1.56 0.08 0.00 0.31 0.00 0.00 61.69 61.11 1mpe s THR 49 Cb -0.53 -1.17 -0.04 0.00 0.01 0.00 0.00 72.50 70.77 1mpe s THR 49 CO 0.60 -0.80 -0.16 -0.54 -0.69 0.00 0.00 174.62 173.03 1mpe s LYS 50 N -3.10 2.00 -0.04 4.92 1.02 -1.26 -5.13 119.74 118.15 1mpe s LYS 50 Ca 0.01 -1.05 -0.01 0.00 0.02 0.00 0.00 55.97 54.94 1mpe s LYS 50 Cb 0.02 -2.21 0.03 0.00 -0.52 0.00 0.00 37.83 35.15 1mpe s LYS 50 CO -0.06 0.51 0.08 0.99 -0.92 0.00 0.00 175.35 175.96 1mpe s THR 51 N -1.08 -0.07 -0.28 2.17 2.01 -1.26 -5.13 115.64 112.00 1mpe s THR 51 Ca 0.18 0.23 -0.28 0.00 0.31 0.00 0.00 61.69 62.13 1mpe s THR 51 Cb -0.11 -0.16 0.01 0.00 0.01 0.00 0.00 72.50 72.26 1mpe s THR 51 CO 0.09 0.09 1.00 0.12 -0.69 0.00 0.00 174.62 175.24 1mpe s PHE 52 N 1.27 3.23 -0.20 4.92 5.36 -1.26 -5.02 117.98 126.28 1mpe s PHE 52 Ca -0.07 1.22 -0.15 0.00 -0.96 0.00 0.00 56.93 56.97 1mpe s PHE 52 Cb -0.12 -3.43 -0.04 0.00 -0.34 0.00 0.00 43.02 39.08 1mpe s PHE 52 CO -0.04 -0.61 0.34 0.99 -1.46 0.00 0.00 175.22 174.44 1mpe s THR 53 N 3.34 5.24 0.64 0.12 2.01 -1.26 -5.07 115.64 120.66 1mpe s THR 53 Ca 0.42 0.60 -0.15 0.00 0.31 0.00 0.00 61.69 62.88 1mpe s THR 53 Cb -0.14 -3.68 -0.01 0.00 0.01 0.00 0.00 72.50 68.69 1mpe s THR 53 CO 0.11 0.29 1.09 -0.69 -0.69 0.00 0.00 174.62 174.73 1mpe s VAL 54 N 1.11 3.46 0.00 3.82 1.01 -1.26 -4.98 120.40 123.56 1mpe s VAL 54 Ca 0.17 0.66 0.00 0.00 0.00 0.00 0.00 61.98 62.81 1mpe s VAL 54 Cb -0.14 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.05 1mpe s VAL 54 CO 0.07 -0.43 0.00 0.41 0.00 0.00 0.00 175.10 175.14 1mpe n THR 55 N -2.38 0.00 -0.01 3.92 -1.04 -1.26 -5.34 114.28 108.18 1mpe n THR 55 Ca 0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 1mpe n THR 55 Cb 0.52 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 1mpe n THR 55 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59