#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 4.22 -0.11 2.12 -2.07 -1.26 -5.06 119.66 117.50 1mpe s GLN 2 Ca 0.00 0.42 -0.02 0.00 -1.82 0.00 0.00 55.36 53.94 1mpe s GLN 2 Cb 0.00 -3.53 -0.03 0.00 -1.09 0.00 0.00 33.01 28.36 1mpe s GLN 2 CO 0.00 -0.08 -0.05 0.71 -1.32 0.00 0.00 175.29 174.55 1mpe s TYR 3 N 1.40 2.99 -0.19 9.60 2.02 -1.26 -5.10 117.35 126.81 1mpe s TYR 3 Ca 0.24 -0.15 -0.06 0.00 -0.37 0.00 0.00 57.07 56.73 1mpe s TYR 3 Cb -0.15 -1.84 -0.03 0.00 -0.40 0.00 0.00 41.96 39.53 1mpe s TYR 3 CO 0.10 0.14 0.02 0.21 -1.57 0.00 0.00 175.55 174.45 1mpe s LYS 4 N -0.19 3.76 -0.02 -0.62 2.20 -1.26 -5.10 119.74 118.51 1mpe s LYS 4 Ca 0.03 -0.45 0.00 0.00 -0.36 0.00 0.00 55.97 55.19 1mpe s LYS 4 Cb -0.13 -3.13 0.03 0.00 -1.51 0.00 0.00 37.83 33.09 1mpe s LYS 4 CO 0.03 0.12 0.03 0.08 -0.36 0.00 0.00 175.35 175.25 1mpe s VAL 5 N 0.73 -0.05 -0.14 4.02 1.01 -1.26 -5.14 120.40 119.57 1mpe s VAL 5 Ca 0.01 0.21 -0.12 0.00 0.00 0.00 0.00 61.98 62.08 1mpe s VAL 5 Cb -0.14 -0.08 -0.05 0.00 0.00 0.00 0.00 36.38 36.11 1mpe s VAL 5 CO 0.02 0.09 0.25 -0.63 0.00 0.00 0.00 175.10 174.83 1mpe s ILE 6 N 1.05 5.32 -0.08 2.22 1.01 -1.26 -5.08 121.20 124.38 1mpe s ILE 6 Ca -0.09 0.46 -0.01 0.00 0.00 0.00 0.00 60.65 61.02 1mpe s ILE 6 Cb -0.13 -3.57 0.03 0.00 0.01 0.00 0.00 42.46 38.80 1mpe s ILE 6 CO -0.03 0.46 -0.02 -0.76 0.00 0.00 0.00 174.94 174.60 1mpe s LEU 7 N -0.02 0.73 0.03 2.97 1.02 -1.26 -4.99 118.68 117.16 1mpe s LEU 7 Ca 0.16 -0.13 0.00 0.00 0.02 0.00 0.00 54.13 54.18 1mpe s LEU 7 Cb -0.13 -0.53 0.00 0.00 0.02 0.00 0.00 46.19 45.55 1mpe s LEU 7 CO 0.04 -0.18 0.00 0.59 0.02 0.00 0.00 176.35 176.83 1mpe n ASN 8 N 5.08 -0.21 0.00 2.29 4.13 -0.83 -4.62 115.26 121.11 1mpe n ASN 8 Ca -0.09 0.06 0.00 0.00 1.68 0.00 0.00 54.58 56.23 1mpe n ASN 8 Cb 0.50 0.50 0.00 0.00 -1.54 0.00 0.00 39.78 39.24 1mpe n ASN 8 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1mpe n GLY 9 N -0.45 0.72 3.59 7.41 0.00 -1.25 -4.58 105.19 110.63 1mpe n GLY 9 Ca 0.00 -0.69 -0.15 0.00 0.00 0.00 0.00 46.02 45.18 1mpe n GLY 9 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mpe s LYS 10 N -0.68 0.91 0.32 1.61 -2.85 -1.26 -4.92 119.74 112.87 1mpe s LYS 10 Ca 0.00 0.74 0.09 0.00 -1.00 0.00 0.00 55.97 55.81 1mpe s LYS 10 Cb 0.00 0.44 -0.06 0.00 -2.06 0.00 0.00 37.83 36.15 1mpe s LYS 10 CO 0.00 -0.18 -0.11 0.99 0.10 0.00 0.00 175.35 176.16 1mpe s THR 11 N -0.15 2.18 -0.07 3.79 2.01 -1.26 -5.06 115.64 117.08 1mpe s THR 11 Ca -0.04 -2.22 0.03 0.00 0.31 0.00 0.00 61.69 59.77 1mpe s THR 11 Cb -0.03 -2.56 -0.25 0.00 0.01 0.00 0.00 72.50 69.67 1mpe s THR 11 CO 0.04 -0.25 0.55 0.25 -0.69 0.00 0.00 174.62 174.52 1mpe h LEU 12 N 2.10 0.22 -7.72 4.42 5.85 -2.02 -3.43 115.31 114.73 1mpe h LEU 12 Ca -0.41 -0.47 -0.74 0.00 0.84 0.00 0.00 57.88 57.09 1mpe h LEU 12 Cb 1.25 -0.07 -0.30 0.00 0.37 0.00 0.00 40.66 41.90 1mpe h LEU 12 CO 0.68 1.42 -0.15 -0.54 -0.34 0.00 0.00 178.44 179.52 1mpe s LYS 13 N -2.58 3.05 0.00 1.25 -0.14 -1.26 -4.97 119.74 115.09 1mpe s LYS 13 Ca -0.13 -2.44 0.00 0.00 -1.36 0.00 0.00 55.97 52.04 1mpe s LYS 13 Cb 0.07 -4.08 0.00 0.00 -1.68 0.00 0.00 37.83 32.15 1mpe s LYS 13 CO 0.80 -1.23 0.00 0.41 -0.76 0.00 0.00 175.35 174.57 1mpe n GLY 14 N 3.83 3.83 3.98 -3.33 0.00 -1.26 -5.13 105.19 107.10 1mpe n GLY 14 Ca 0.09 -1.71 -0.23 0.00 0.00 0.00 0.00 46.02 44.17 1mpe n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mpe s GLU 15 N -3.17 2.08 0.67 1.61 0.41 -1.26 -4.73 118.70 114.30 1mpe s GLU 15 Ca 0.00 -0.92 -0.16 0.00 -0.41 0.00 0.00 54.97 53.48 1mpe s GLU 15 Cb 0.00 -2.39 0.00 0.00 -1.78 0.00 0.00 34.13 29.97 1mpe s GLU 15 CO 0.00 -1.12 1.19 0.99 -0.49 0.00 0.00 175.26 175.83 1mpe s THR 16 N -2.99 2.63 0.07 3.63 2.01 -1.26 -4.92 115.64 114.80 1mpe s THR 16 Ca 0.62 0.33 0.00 0.00 0.31 0.00 0.00 61.69 62.95 1mpe s THR 16 Cb -0.08 -2.95 0.00 0.00 0.01 0.00 0.00 72.50 69.48 1mpe s THR 16 CO 0.42 -0.14 0.00 0.41 -0.69 0.00 0.00 174.62 174.62 1mpe n THR 17 N -2.26 0.00 -3.64 -0.82 -1.04 -1.26 -5.13 114.28 100.13 1mpe n THR 17 Ca 0.13 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 62.07 1mpe n THR 17 Cb 0.50 -0.23 -0.07 0.00 -1.82 0.00 0.00 70.33 68.72 1mpe n THR 17 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1mpe s THR 18 N -2.00 0.00 1.42 12.58 -1.32 -1.26 -5.17 115.64 119.89 1mpe s THR 18 Ca 0.00 0.00 -0.23 0.00 -1.21 0.00 0.00 61.69 60.25 1mpe s THR 18 Cb 0.00 -1.00 0.36 0.00 -1.51 0.00 0.00 72.50 70.35 1mpe s THR 18 CO 0.00 0.00 0.95 -1.61 -2.21 0.00 0.00 174.62 171.75 1mpe s GLU 19 N 1.60 -2.92 0.23 7.08 2.02 -1.26 -4.99 118.70 120.46 1mpe s GLU 19 Ca -0.10 0.03 0.00 0.00 0.02 0.00 0.00 54.97 54.92 1mpe s GLU 19 Cb -0.05 -1.39 0.00 0.00 0.10 0.00 0.00 34.13 32.79 1mpe s GLU 19 CO -0.19 -4.85 0.00 0.00 0.02 0.00 0.00 175.26 170.24 1mpe n ALA 20 N -5.59 0.00 -2.84 5.21 0.00 -1.26 -5.05 120.51 110.97 1mpe n ALA 20 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.15 1mpe n ALA 20 Cb 0.60 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.03 1mpe n ALA 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1mpe s VAL 21 N -1.60 4.49 -0.05 0.00 -7.23 -1.26 -4.98 120.40 109.77 1mpe s VAL 21 Ca 0.00 -1.16 -0.03 0.00 -1.81 0.00 0.00 61.98 58.97 1mpe s VAL 21 Cb 0.00 -4.81 -0.04 0.00 0.56 0.00 0.00 36.38 32.09 1mpe s VAL 21 CO 0.00 -1.58 0.12 -0.62 -0.31 0.00 0.00 175.10 172.71 1mpe s ASP 22 N 3.87 6.01 0.27 4.85 -1.08 -1.26 -1.97 116.67 127.37 1mpe s ASP 22 Ca 0.33 0.29 -0.01 0.00 -0.52 0.00 0.00 52.55 52.65 1mpe s ASP 22 Cb -0.06 -1.84 0.57 0.00 -1.46 0.00 0.00 42.92 40.13 1mpe s ASP 22 CO -0.05 0.32 1.73 0.00 0.52 0.00 0.00 175.17 177.69 1mpe h ALA 23 N 4.40 1.25 -0.15 3.66 0.00 -1.91 0.18 119.26 126.70 1mpe h ALA 23 Ca -0.51 0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.44 1mpe h ALA 23 Cb 1.20 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1mpe h ALA 23 CO 0.62 -0.22 -0.27 0.00 0.00 0.00 0.00 179.25 179.38 1mpe h ALA 24 N 1.61 1.27 -0.69 0.00 0.00 -1.99 -2.60 119.26 116.86 1mpe h ALA 24 Ca 0.48 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1mpe h ALA 24 Cb 0.78 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1mpe h ALA 24 CO -0.44 0.49 0.27 1.15 0.00 0.00 0.00 179.25 180.73 1mpe h THR 25 N 0.24 1.24 0.27 0.00 2.02 -1.04 -1.40 112.91 114.25 1mpe h THR 25 Ca 0.04 -0.77 -0.01 0.00 0.77 0.00 0.00 66.41 66.43 1mpe h THR 25 Cb 0.61 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.49 1mpe h THR 25 CO 0.04 0.31 -0.13 0.15 0.37 0.00 0.00 175.52 176.26 1mpe h PHE 26 N 0.98 -0.34 -0.36 3.16 3.04 -1.15 -1.60 116.94 120.68 1mpe h PHE 26 Ca 0.23 -0.01 0.06 0.00 3.98 0.00 0.00 57.97 62.24 1mpe h PHE 26 Cb 0.21 0.11 -0.06 0.00 2.56 0.00 0.00 35.95 38.78 1mpe h PHE 26 CO 0.02 -0.05 -0.00 0.93 -2.02 0.00 0.00 178.31 177.19 1mpe h GLU 27 N -0.62 0.09 0.03 1.11 5.08 -1.39 0.50 114.58 119.38 1mpe h GLU 27 Ca -0.04 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1mpe h GLU 27 Cb 0.44 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1mpe h GLU 27 CO 0.06 0.06 -0.01 -0.22 -1.00 0.00 0.00 179.01 177.90 1mpe h LYS 28 N 0.10 -0.04 -0.86 2.33 3.64 -1.28 -1.45 116.57 119.00 1mpe h LYS 28 Ca 0.18 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1mpe h LYS 28 Cb 0.24 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.03 1mpe h LYS 28 CO -0.30 0.25 0.46 0.28 -2.27 0.00 0.00 179.45 177.87 1mpe h VAL 29 N -0.32 1.25 -0.19 2.00 2.07 -1.15 -0.78 116.25 119.13 1mpe h VAL 29 Ca -0.00 -0.65 -0.06 0.00 0.82 0.00 0.00 66.70 66.80 1mpe h VAL 29 Cb 0.30 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 1mpe h VAL 29 CO 0.01 0.29 -0.13 0.58 0.02 0.00 0.00 177.57 178.33 1mpe h VAL 30 N 1.21 1.32 -0.36 2.57 2.07 -0.88 0.13 116.25 122.31 1mpe h VAL 30 Ca 0.30 -1.24 -0.03 0.00 0.82 0.00 0.00 66.70 66.55 1mpe h VAL 30 Cb 0.05 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 1mpe h VAL 30 CO -0.05 0.37 0.09 0.50 0.02 0.00 0.00 177.57 178.51 1mpe h LYS 31 N 0.10 0.57 -0.49 1.57 3.64 -1.15 0.49 116.57 121.30 1mpe h LYS 31 Ca 0.04 -0.14 -0.04 0.00 -1.27 0.00 0.00 60.65 59.24 1mpe h LYS 31 Cb 0.64 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 1mpe h LYS 31 CO 0.04 0.61 0.14 0.37 -2.27 0.00 0.00 179.45 178.34 1mpe h GLN 32 N 0.43 0.78 -0.13 1.90 5.75 -1.16 0.31 115.11 122.99 1mpe h GLN 32 Ca 0.11 -0.18 -0.03 0.00 -0.15 0.00 0.00 58.65 58.41 1mpe h GLN 32 Cb 0.29 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 28.73 1mpe h GLN 32 CO 0.00 0.74 -0.03 0.35 -2.65 0.00 0.00 178.83 177.24 1mpe h PHE 33 N 0.67 0.28 0.03 3.99 3.57 -0.85 -3.28 116.94 121.36 1mpe h PHE 33 Ca 0.16 -0.06 -0.22 0.00 3.53 0.00 0.00 57.97 61.38 1mpe h PHE 33 Cb 0.30 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 1mpe h PHE 33 CO 0.02 0.55 -1.00 0.74 -2.23 0.00 0.00 178.31 176.38 1mpe h PHE 34 N -0.07 0.23 -0.62 0.41 0.04 -0.90 -3.24 116.94 112.79 1mpe h PHE 34 Ca 0.03 -0.15 0.18 0.00 2.80 0.00 0.00 57.97 60.83 1mpe h PHE 34 Cb 0.46 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.57 1mpe h PHE 34 CO 0.05 1.05 0.48 -0.91 -0.60 0.00 0.00 178.31 178.38 1mpe h ASN 35 N 0.06 0.00 0.11 2.17 -0.26 -0.44 0.24 115.58 117.46 1mpe h ASN 35 Ca -0.05 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.69 1mpe h ASN 35 Cb 1.70 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.96 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 -1.62 -2.11 116.42 121.82 1mpe h ASP 36 Ca 0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 1mpe h ASP 36 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1mpe h ASP 36 CO -0.00 0.00 -1.61 -0.46 -1.72 0.00 0.00 179.24 175.45 1mpe n ASN 37 N -2.63 0.94 0.00 6.45 0.23 0.82 -4.99 115.26 116.09 1mpe n ASN 37 Ca -0.02 -0.18 0.00 0.00 -0.53 0.00 0.00 54.58 53.86 1mpe n ASN 37 Cb 0.08 1.65 0.00 0.00 -2.08 0.00 0.00 39.78 39.42 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 1.48 1.05 3.82 4.83 0.00 -0.79 -5.14 105.19 110.44 1mpe n GLY 38 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.24 4.72 0.36 1.61 1.01 -1.22 -5.01 120.40 120.64 1mpe s VAL 39 Ca 0.00 1.10 -0.08 0.00 0.00 0.00 0.00 61.98 63.00 1mpe s VAL 39 Cb 0.00 -3.83 0.02 0.00 0.00 0.00 0.00 36.38 32.57 1mpe s VAL 39 CO 0.00 0.33 0.60 -1.81 0.00 0.00 0.00 175.10 174.23 1mpe s ASP 40 N -1.51 0.55 0.00 3.32 1.01 -1.26 -4.28 116.67 114.50 1mpe s ASP 40 Ca 0.37 -1.34 0.00 0.00 0.71 0.00 0.00 52.55 52.28 1mpe s ASP 40 Cb -0.17 0.74 0.00 0.00 1.01 0.00 0.00 42.92 44.50 1mpe s ASP 40 CO 0.20 -1.46 0.00 0.61 0.21 0.00 0.00 175.17 174.73 1mpe n GLY 41 N -0.55 0.13 3.26 0.21 0.00 -1.26 -5.07 105.19 101.90 1mpe n GLY 41 Ca -0.03 -1.94 -0.11 0.00 0.00 0.00 0.00 46.02 43.94 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 0.88 -0.10 1.61 2.02 -1.26 -5.13 118.70 116.72 1mpe s GLU 42 Ca 0.00 -0.67 -0.30 0.00 0.02 0.00 0.00 54.97 54.03 1mpe s GLU 42 Cb 0.00 0.38 -0.03 0.00 0.10 0.00 0.00 34.13 34.58 1mpe s GLU 42 CO 0.00 -0.30 1.32 -1.58 0.02 0.00 0.00 175.26 174.72 1mpe s TRP 43 N -3.18 2.82 -0.06 1.61 0.52 -1.26 -5.01 118.94 114.37 1mpe s TRP 43 Ca -0.01 0.92 0.03 0.00 0.02 0.00 0.00 56.10 57.07 1mpe s TRP 43 Cb 0.01 -3.56 -0.02 0.00 -1.15 0.00 0.00 33.47 28.75 1mpe s TRP 43 CO -0.07 -2.00 -0.15 0.95 0.02 0.00 0.00 176.95 175.69 1mpe s THR 44 N 3.08 2.95 0.38 2.01 -4.23 -1.26 -5.11 115.64 113.46 1mpe s THR 44 Ca 0.59 -0.76 -0.26 0.00 -1.18 0.00 0.00 61.69 60.08 1mpe s THR 44 Cb -0.25 -2.16 -0.09 0.00 1.34 0.00 0.00 72.50 71.34 1mpe s THR 44 CO 0.20 0.58 1.14 -0.31 -0.54 0.00 0.00 174.62 175.69 1mpe s TYR 45 N -0.53 3.18 0.68 3.99 2.02 -1.26 -5.01 117.35 120.42 1mpe s TYR 45 Ca 0.07 1.59 -0.14 0.00 -0.37 0.00 0.00 57.07 58.22 1mpe s TYR 45 Cb -0.12 -3.34 0.01 0.00 -0.40 0.00 0.00 41.96 38.11 1mpe s TYR 45 CO 0.01 -1.09 1.09 -0.51 -1.57 0.00 0.00 175.55 173.48 1mpe s ASP 46 N -1.15 5.15 0.36 2.29 1.11 -1.26 -4.99 116.67 118.17 1mpe s ASP 46 Ca 0.55 1.87 -0.27 0.00 0.18 0.00 0.00 52.55 54.88 1mpe s ASP 46 Cb -0.30 -2.53 -0.09 0.00 1.07 0.00 0.00 42.92 41.07 1mpe s ASP 46 CO 0.37 -1.60 1.24 -1.81 1.18 0.00 0.00 175.17 174.56 1mpe s ASP 47 N -2.96 6.68 0.32 0.27 1.01 -1.26 -4.95 116.67 115.78 1mpe s ASP 47 Ca 0.64 2.54 -0.29 0.00 0.71 0.00 0.00 52.55 56.15 1mpe s ASP 47 Cb -0.18 -2.64 -0.12 0.00 1.01 0.00 0.00 42.92 40.99 1mpe s ASP 47 CO 0.46 -0.59 1.37 0.00 0.21 0.00 0.00 175.17 176.62 1mpe n ALA 48 N 0.53 1.56 -2.42 5.23 0.00 -1.26 -5.01 120.51 119.14 1mpe n ALA 48 Ca 0.02 0.37 -0.18 0.00 0.00 0.00 0.00 53.44 53.64 1mpe n ALA 48 Cb 0.44 -2.30 -0.11 0.00 0.00 0.00 0.00 19.45 17.48 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 -0.81 1.46 -0.06 0.00 2.01 -1.26 -5.15 115.64 111.83 1mpe s THR 49 Ca 0.58 -1.90 0.04 0.00 0.31 0.00 0.00 61.69 60.72 1mpe s THR 49 Cb -0.56 -1.73 -0.02 0.00 0.01 0.00 0.00 72.50 70.20 1mpe s THR 49 CO 0.59 -0.49 -0.18 -0.75 -0.69 0.00 0.00 174.62 173.10 1mpe s LYS 50 N -3.06 2.59 -0.04 4.92 2.20 -1.26 -5.12 119.74 119.97 1mpe s LYS 50 Ca 0.14 -0.77 -0.00 0.00 -0.36 0.00 0.00 55.97 54.98 1mpe s LYS 50 Cb -0.03 -2.33 0.03 0.00 -1.51 0.00 0.00 37.83 33.99 1mpe s LYS 50 CO 0.04 0.51 -0.00 0.99 -0.36 0.00 0.00 175.35 176.52 1mpe s THR 51 N -0.44 0.28 -0.12 3.43 2.01 -1.26 -5.13 115.64 114.41 1mpe s THR 51 Ca 0.05 0.08 -0.29 0.00 0.31 0.00 0.00 61.69 61.84 1mpe s THR 51 Cb -0.12 -0.39 -0.01 0.00 0.01 0.00 0.00 72.50 71.99 1mpe s THR 51 CO 0.02 0.19 0.98 0.12 -0.69 0.00 0.00 174.62 175.24 1mpe s PHE 52 N 1.34 3.49 -0.26 4.92 5.36 -1.26 -5.03 117.98 126.54 1mpe s PHE 52 Ca -0.05 1.53 -0.12 0.00 -0.96 0.00 0.00 56.93 57.33 1mpe s PHE 52 Cb -0.13 -3.16 -0.05 0.00 -0.34 0.00 0.00 43.02 39.34 1mpe s PHE 52 CO -0.02 -0.24 0.21 0.99 -1.46 0.00 0.00 175.22 174.70 1mpe s THR 53 N 2.11 5.31 0.66 0.12 2.01 -1.26 -5.08 115.64 119.51 1mpe s THR 53 Ca 0.46 0.26 -0.14 0.00 0.31 0.00 0.00 61.69 62.58 1mpe s THR 53 Cb -0.18 -3.55 -0.00 0.00 0.01 0.00 0.00 72.50 68.78 1mpe s THR 53 CO 0.16 0.28 1.10 -0.69 -0.69 0.00 0.00 174.62 174.77 1mpe s VAL 54 N 1.50 3.40 0.00 3.82 1.01 -1.26 -4.96 120.40 123.91 1mpe s VAL 54 Ca 0.09 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.69 1mpe s VAL 54 Cb -0.15 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.08 1mpe s VAL 54 CO 0.08 -0.43 0.00 0.41 0.00 0.00 0.00 175.10 175.16 1mpe n THR 55 N -2.49 0.00 -0.49 3.92 -1.04 -1.26 -5.34 114.28 107.57 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 -0.62 -0.64 0.00 0.00 175.07 173.81