#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rmm s GLN 2 N 0.00 4.54 0.20 2.12 2.00 -1.26 -2.30 119.66 124.96 2rmm s GLN 2 Ca 0.00 1.84 0.09 0.00 -2.00 0.00 0.00 55.36 55.28 2rmm s GLN 2 Cb 0.00 -3.23 -0.05 0.00 0.80 0.00 0.00 33.01 30.53 2rmm s GLN 2 CO 0.00 -0.00 -0.17 0.71 -0.50 0.00 0.00 175.29 175.33 2rmm s TYR 3 N -0.33 1.84 0.09 1.67 1.51 0.26 -4.91 117.35 117.49 2rmm s TYR 3 Ca 0.50 -0.50 0.04 0.00 -1.01 0.00 0.00 57.07 56.11 2rmm s TYR 3 Cb -0.32 -0.87 -0.04 0.00 -0.11 0.00 0.00 41.96 40.63 2rmm s TYR 3 CO 0.38 0.41 -0.10 0.21 -1.11 0.00 0.00 175.55 175.33 2rmm s LYS 4 N -3.30 0.84 -0.05 -0.62 2.20 -0.96 -1.52 119.74 116.33 2rmm s LYS 4 Ca 0.21 -1.14 0.01 0.00 -0.36 0.00 0.00 55.97 54.70 2rmm s LYS 4 Cb -0.03 -0.55 0.02 0.00 -1.51 0.00 0.00 37.83 35.75 2rmm s LYS 4 CO 0.08 0.09 -0.07 -1.17 -0.36 0.00 0.00 175.35 173.92 2rmm s LEU 5 N -2.38 1.44 -0.20 5.43 1.98 0.56 -0.30 118.68 125.20 2rmm s LEU 5 Ca 0.05 -0.18 -0.04 0.00 -2.89 0.00 0.00 54.13 51.06 2rmm s LEU 5 Cb -0.04 -0.56 -0.02 0.00 0.66 0.00 0.00 46.19 46.24 2rmm s LEU 5 CO 0.00 -0.02 -0.02 -0.63 -1.89 0.00 0.00 176.35 173.79 2rmm s ILE 6 N 0.81 3.70 -0.28 6.68 1.01 -0.11 -1.10 121.20 131.90 2rmm s ILE 6 Ca -0.13 -0.40 -0.08 0.00 0.00 0.00 0.00 60.65 60.04 2rmm s ILE 6 Cb -0.15 -2.67 -0.01 0.00 0.01 0.00 0.00 42.46 39.64 2rmm s ILE 6 CO 0.01 0.43 0.11 -0.22 0.00 0.00 0.00 174.94 175.28 2rmm s LEU 7 N 1.11 3.82 -0.21 2.97 2.96 0.06 -0.63 118.68 128.74 2rmm s LEU 7 Ca 0.02 -0.41 0.02 0.00 -0.22 0.00 0.00 54.13 53.53 2rmm s LEU 7 Cb -0.15 -1.96 0.04 0.00 0.50 0.00 0.00 46.19 44.62 2rmm s LEU 7 CO 0.01 -0.13 -0.16 0.20 -1.32 0.00 0.00 176.35 174.94 2rmm s ASN 8 N 1.60 3.62 0.10 3.68 0.01 0.37 -1.81 114.94 122.51 2rmm s ASN 8 Ca 0.05 -0.93 -0.27 0.00 -0.71 0.00 0.00 52.86 51.00 2rmm s ASN 8 Cb -0.16 -1.50 0.08 0.00 0.41 0.00 0.00 41.25 40.08 2rmm s ASN 8 CO 0.05 -0.07 1.01 -0.83 -1.51 0.00 0.00 177.10 175.74 2rmm s GLY 9 N 1.22 -0.29 0.07 0.66 0.00 -1.13 -2.64 107.32 105.21 2rmm s GLY 9 Ca -0.00 0.35 -0.09 0.00 0.00 0.00 0.00 44.72 44.98 2rmm s GLY 9 CO -0.10 0.07 1.11 0.50 0.00 0.00 0.00 173.10 174.69 2rmm h LYS 10 N 2.00 0.41 0.00 2.90 1.57 -1.94 -3.36 116.57 118.15 2rmm h LYS 10 Ca -0.25 -0.65 -0.23 0.00 -1.87 0.00 0.00 60.65 57.66 2rmm h LYS 10 Cb 1.23 0.23 -0.04 0.00 0.08 0.00 0.00 32.23 33.73 2rmm h LYS 10 CO 0.26 1.30 -1.25 1.79 -0.57 0.00 0.00 179.45 180.98 2rmm h THR 11 N 0.14 1.25 -2.78 -0.16 1.35 -1.99 -3.47 112.91 107.25 2rmm h THR 11 Ca -0.17 -2.98 -0.11 0.00 -0.55 0.00 0.00 66.41 62.60 2rmm h THR 11 Cb 1.98 2.60 -0.22 0.00 -1.73 0.00 0.00 68.15 70.79 2rmm h THR 11 CO 0.23 0.71 -0.20 -0.22 -0.25 0.00 0.00 175.52 175.79 2rmm s LEU 12 N -6.40 0.48 0.08 3.87 2.96 -1.26 -5.13 118.68 113.28 2rmm s LEU 12 Ca -0.01 0.49 0.03 0.00 -0.22 0.00 0.00 54.13 54.41 2rmm s LEU 12 Cb 0.09 1.49 -0.03 0.00 0.50 0.00 0.00 46.19 48.24 2rmm s LEU 12 CO 0.82 -0.34 -0.09 -0.54 -1.32 0.00 0.00 176.35 174.88 2rmm s LYS 13 N -0.64 0.75 0.00 1.98 1.02 -1.26 -2.84 119.74 118.75 2rmm s LYS 13 Ca -0.07 -1.09 0.00 0.00 0.02 0.00 0.00 55.97 54.82 2rmm s LYS 13 Cb -0.04 -0.38 0.00 0.00 -0.52 0.00 0.00 37.83 36.90 2rmm s LYS 13 CO 0.03 0.05 0.00 0.41 -0.92 0.00 0.00 175.35 174.92 2rmm n GLY 14 N 0.66 -0.94 3.04 -3.33 0.00 -0.75 -4.99 105.19 98.88 2rmm n GLY 14 Ca -0.17 -1.13 -0.12 0.00 0.00 0.00 0.00 46.02 44.61 2rmm n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2rmm s GLU 15 N -1.79 0.28 0.06 1.61 2.02 -1.26 -0.76 118.70 118.85 2rmm s GLU 15 Ca 0.00 -0.07 0.00 0.00 0.02 0.00 0.00 54.97 54.93 2rmm s GLU 15 Cb 0.00 0.12 -0.04 0.00 0.10 0.00 0.00 34.13 34.31 2rmm s GLU 15 CO 0.00 -0.05 -0.05 0.95 0.02 0.00 0.00 175.26 176.13 2rmm s THR 16 N -0.53 0.40 -0.05 3.63 -4.23 -0.26 -5.01 115.64 109.59 2rmm s THR 16 Ca -0.06 -1.73 -0.05 0.00 -1.18 0.00 0.00 61.69 58.68 2rmm s THR 16 Cb -0.04 -1.41 0.01 0.00 1.34 0.00 0.00 72.50 72.41 2rmm s THR 16 CO 0.01 -0.87 0.13 -0.89 -0.54 0.00 0.00 174.62 172.46 2rmm s THR 17 N -3.43 0.00 0.17 3.99 2.01 -1.26 -0.33 115.64 116.79 2rmm s THR 17 Ca 0.06 -0.02 -0.07 0.00 0.31 0.00 0.00 61.69 61.97 2rmm s THR 17 Cb 0.04 -0.19 -0.02 0.00 0.01 0.00 0.00 72.50 72.34 2rmm s THR 17 CO -0.07 -0.01 0.23 0.28 -0.69 0.00 0.00 174.62 174.37 2rmm s THR 18 N 0.04 0.06 -0.13 -0.82 -1.32 -0.58 -5.01 115.64 107.88 2rmm s THR 18 Ca -0.00 -1.56 0.02 0.00 -1.21 0.00 0.00 61.69 58.94 2rmm s THR 18 Cb -0.01 -1.97 0.00 0.00 -1.51 0.00 0.00 72.50 69.01 2rmm s THR 18 CO 0.00 -0.29 -0.21 -0.70 -2.21 0.00 0.00 174.62 171.22 2rmm s GLU 19 N -4.01 3.09 0.22 7.08 2.12 -1.26 -0.57 118.70 125.36 2rmm s GLU 19 Ca 0.21 -0.83 0.01 0.00 0.36 0.00 0.00 54.97 54.71 2rmm s GLU 19 Cb 0.04 -2.44 -0.05 0.00 0.26 0.00 0.00 34.13 31.94 2rmm s GLU 19 CO 0.02 0.06 0.09 0.00 -0.54 0.00 0.00 175.26 174.89 2rmm s ALA 20 N 0.65 1.47 0.18 6.30 0.00 -0.97 -4.95 121.76 124.44 2rmm s ALA 20 Ca -0.10 -1.75 -0.10 0.00 0.00 0.00 0.00 51.96 50.00 2rmm s ALA 20 Cb -0.16 1.03 0.07 0.00 0.00 0.00 0.00 23.12 24.05 2rmm s ALA 20 CO 0.02 -0.47 1.65 -0.24 0.00 0.00 0.00 175.76 176.72 2rmm h VAL 21 N 2.53 1.26 -3.63 0.00 3.04 -1.95 -2.59 116.25 114.91 2rmm h VAL 21 Ca -0.37 -1.10 -0.09 0.00 -1.01 0.00 0.00 66.70 64.12 2rmm h VAL 21 Cb 1.24 0.77 -0.07 0.00 -2.01 0.00 0.00 31.29 31.22 2rmm h VAL 21 CO 0.59 0.40 -0.06 1.51 -1.01 0.00 0.00 177.57 179.00 2rmm s ASP 22 N -6.50 0.14 0.44 3.17 -4.77 -1.26 -4.67 116.67 103.20 2rmm s ASP 22 Ca -0.12 -1.06 0.16 0.00 -3.30 0.00 0.00 52.55 48.22 2rmm s ASP 22 Cb 0.13 0.65 1.07 0.00 -1.09 0.00 0.00 42.92 43.68 2rmm s ASP 22 CO 0.85 -1.26 1.95 0.00 0.70 0.00 0.00 175.17 177.41 2rmm h ALA 23 N 2.17 2.10 0.00 2.11 0.00 -1.97 -0.74 119.26 122.93 2rmm h ALA 23 Ca -0.27 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.42 2rmm h ALA 23 Cb 1.25 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 2rmm h ALA 23 CO 0.36 -0.27 -0.92 0.00 0.00 0.00 0.00 179.25 178.41 2rmm h ALA 24 N 1.67 0.41 -0.21 0.00 0.00 -1.97 -0.14 119.26 119.02 2rmm h ALA 24 Ca 0.32 -0.72 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 2rmm h ALA 24 Cb 0.74 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2rmm h ALA 24 CO -0.09 0.85 -0.07 1.15 0.00 0.00 0.00 179.25 181.09 2rmm h THR 25 N 0.19 1.29 -0.55 0.00 2.02 -1.78 0.22 112.91 114.30 2rmm h THR 25 Ca -0.07 -1.08 -0.03 0.00 0.77 0.00 0.00 66.41 66.00 2rmm h THR 25 Cb 1.56 1.58 -0.03 0.00 -1.74 0.00 0.00 68.15 69.52 2rmm h THR 25 CO 0.15 0.33 0.21 0.00 0.37 0.00 0.00 175.52 176.58 2rmm h ALA 26 N 0.73 1.33 -0.72 6.16 0.00 -1.18 0.53 119.26 126.10 2rmm h ALA 26 Ca 0.05 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 2rmm h ALA 26 Cb 0.53 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2rmm h ALA 26 CO 0.02 0.50 0.19 1.49 0.00 0.00 0.00 179.25 181.45 2rmm h GLU 27 N 0.80 1.15 -0.26 0.00 4.81 -1.00 -0.28 114.58 119.80 2rmm h GLU 27 Ca 0.19 -0.27 -0.03 0.00 -0.13 0.00 0.00 59.36 59.12 2rmm h GLU 27 Cb 0.18 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 2rmm h GLU 27 CO -0.02 1.00 0.06 -0.22 -0.73 0.00 0.00 179.01 179.10 2rmm h LYS 28 N 1.09 0.41 -0.04 1.92 3.64 -0.16 0.00 116.57 123.43 2rmm h LYS 28 Ca 0.23 -0.10 0.01 0.00 -1.27 0.00 0.00 60.65 59.52 2rmm h LYS 28 Cb 0.36 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 2rmm h LYS 28 CO -0.00 0.52 -0.04 0.28 -2.27 0.00 0.00 179.45 177.93 2rmm h VAL 29 N 0.24 0.87 -0.68 2.00 2.07 -0.81 -1.28 116.25 118.66 2rmm h VAL 29 Ca 0.08 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.61 2rmm h VAL 29 Cb 0.29 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 2rmm h VAL 29 CO 0.00 0.00 0.45 -0.26 0.02 0.00 0.00 177.57 177.78 2rmm h PHE 30 N -0.06 0.85 0.00 1.57 0.04 -1.02 -1.04 116.94 117.29 2rmm h PHE 30 Ca 0.03 0.02 -0.04 0.00 2.80 0.00 0.00 57.97 60.78 2rmm h PHE 30 Cb 0.10 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 37.96 2rmm h PHE 30 CO -0.14 0.53 -0.19 0.87 -0.60 0.00 0.00 178.31 178.79 2rmm h LYS 31 N 0.91 0.00 -0.58 1.51 1.57 -0.55 -0.51 116.57 118.92 2rmm h LYS 31 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 2rmm h LYS 31 Cb -0.09 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 2rmm h LYS 31 CO -0.06 0.19 0.37 0.37 -0.57 0.00 0.00 179.45 179.75 2rmm h GLN 32 N 0.00 0.77 0.00 3.15 4.15 -0.00 0.37 115.11 123.55 2rmm h GLN 32 Ca -0.00 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.30 2rmm h GLN 32 Cb 0.50 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.01 2rmm h GLN 32 CO 0.02 0.53 -1.30 0.66 -1.93 0.00 0.00 178.83 176.81 2rmm n TYR 33 N -4.43 0.82 -1.80 3.99 4.02 -1.07 -4.65 117.16 114.04 2rmm n TYR 33 Ca 0.06 0.25 0.04 0.00 -0.01 0.00 0.00 57.90 58.24 2rmm n TYR 33 Cb 0.06 -0.94 0.06 0.00 -0.02 0.00 0.00 39.34 38.49 2rmm n TYR 33 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2rmm n PHE 34 N -2.69 0.00 -0.30 -0.72 3.72 -0.22 -4.85 117.46 112.39 2rmm n PHE 34 Ca -0.05 -0.48 0.04 0.00 -0.05 0.00 0.00 57.45 56.92 2rmm n PHE 34 Cb 0.66 -0.11 0.24 0.00 -0.94 0.00 0.00 39.48 39.33 2rmm n PHE 34 CO 0.00 0.00 0.00 -2.95 -0.05 0.00 0.00 176.76 173.76 2rmm h ASN 35 N 0.24 0.91 0.00 4.37 7.08 -1.14 -3.45 115.58 123.59 2rmm h ASN 35 Ca -0.04 0.01 0.00 0.00 -3.08 0.00 0.00 56.30 53.19 2rmm h ASN 35 Cb 1.34 -0.19 0.00 0.00 -2.08 0.00 0.00 38.32 37.39 2rmm h ASN 35 CO 0.02 0.58 0.00 -0.90 -2.08 0.00 0.00 177.43 175.05 2rmm n ASP 36 N -4.49 -0.71 0.00 6.14 5.68 -1.26 -4.75 116.55 117.16 2rmm n ASP 36 Ca 0.14 0.15 0.00 0.00 -0.50 0.00 0.00 54.79 54.58 2rmm n ASP 36 Cb 0.20 1.07 0.00 0.00 -1.14 0.00 0.00 41.12 41.25 2rmm n ASP 36 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2rmm n ASN 37 N -2.66 0.00 0.00 -1.12 3.02 -1.26 -0.95 115.26 112.29 2rmm n ASN 37 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 2rmm n ASN 37 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2rmm n ASN 37 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2rmm n GLY 38 N 0.00 -1.60 0.54 7.41 0.00 -1.26 -4.99 105.19 105.29 2rmm n GLY 38 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2rmm n GLY 38 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2rmm n VAL 39 N 0.00 0.00 -4.47 1.61 3.14 -0.13 -4.42 118.33 114.07 2rmm n VAL 39 Ca 0.00 0.00 -0.39 0.00 -2.96 0.00 0.00 64.34 60.99 2rmm n VAL 39 Cb 0.46 -0.60 -0.08 0.00 -1.06 0.00 0.00 33.84 32.56 2rmm n VAL 39 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2rmm n ASP 40 N -2.36 -1.02 -4.66 6.55 2.03 -0.90 -4.81 116.55 111.38 2rmm n ASP 40 Ca 0.00 -1.25 -0.26 0.00 0.52 0.00 0.00 54.79 53.79 2rmm n ASP 40 Cb 0.30 -1.63 0.11 0.00 -0.72 0.00 0.00 41.12 39.17 2rmm n ASP 40 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2rmm s GLY 41 N -3.60 1.73 -0.15 0.27 0.00 -1.26 -4.98 107.32 99.32 2rmm s GLY 41 Ca 0.58 -1.19 -0.29 0.00 0.00 0.00 0.00 44.72 43.82 2rmm s GLY 41 CO 1.02 -0.65 1.02 1.85 0.00 0.00 0.00 173.10 176.34 2rmm s GLU 42 N -5.39 4.36 0.25 2.90 2.56 0.37 -4.79 118.70 118.96 2rmm s GLU 42 Ca 0.65 1.38 -0.21 0.00 0.00 0.00 0.00 54.97 56.79 2rmm s GLU 42 Cb -0.08 -3.58 -0.09 0.00 2.00 0.00 0.00 34.13 32.39 2rmm s GLU 42 CO 0.47 -0.44 0.78 -1.58 -0.56 0.00 0.00 175.26 173.93 2rmm s TRP 43 N 2.47 3.65 0.04 5.30 0.52 -1.26 -2.44 118.94 127.21 2rmm s TRP 43 Ca 0.47 1.49 0.00 0.00 0.02 0.00 0.00 56.10 58.07 2rmm s TRP 43 Cb -0.17 -2.70 -0.03 0.00 -1.15 0.00 0.00 33.47 29.43 2rmm s TRP 43 CO 0.13 0.29 -0.04 0.99 0.02 0.00 0.00 176.95 178.34 2rmm s THR 44 N -1.57 0.26 -0.06 2.01 2.01 -0.50 -5.01 115.64 112.78 2rmm s THR 44 Ca 0.45 -1.25 -0.05 0.00 0.31 0.00 0.00 61.69 61.15 2rmm s THR 44 Cb -0.17 -0.76 0.02 0.00 0.01 0.00 0.00 72.50 71.61 2rmm s THR 44 CO 0.21 -0.64 0.16 -0.47 -0.69 0.00 0.00 174.62 173.20 2rmm s TYR 45 N -2.25 -0.18 -0.34 4.92 5.04 -1.26 -0.79 117.35 122.49 2rmm s TYR 45 Ca -0.07 0.46 0.02 0.00 -2.44 0.00 0.00 57.07 55.05 2rmm s TYR 45 Cb -0.04 0.01 0.09 0.00 0.35 0.00 0.00 41.96 42.38 2rmm s TYR 45 CO -0.03 -0.12 0.06 -0.51 -1.34 0.00 0.00 175.55 173.60 2rmm s ASP 46 N 0.51 4.84 0.43 4.32 1.01 -0.18 -5.01 116.67 122.59 2rmm s ASP 46 Ca -0.04 -1.96 0.16 0.00 0.71 0.00 0.00 52.55 51.42 2rmm s ASP 46 Cb -0.05 -1.67 0.98 0.00 1.01 0.00 0.00 42.92 43.19 2rmm s ASP 46 CO -0.02 -0.38 1.95 -0.78 0.21 0.00 0.00 175.17 176.15 2rmm h ASP 47 N 7.76 0.00 0.00 0.27 3.58 -1.96 -2.16 116.42 123.90 2rmm h ASP 47 Ca -0.09 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.36 2rmm h ASP 47 Cb 1.03 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.08 2rmm h ASP 47 CO 0.55 0.23 0.14 0.00 -2.88 0.00 0.00 179.24 177.28 2rmm h ALA 48 N 1.77 1.12 0.00 -0.78 0.00 -1.96 -2.30 119.26 117.12 2rmm h ALA 48 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2rmm h ALA 48 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2rmm h ALA 48 CO 0.03 -0.12 0.00 -2.37 0.00 0.00 0.00 179.25 176.79 2rmm n THR 49 N -2.71 0.00 -3.80 0.00 5.66 -1.11 -5.05 114.28 107.28 2rmm n THR 49 Ca -0.02 -0.28 -0.23 0.00 -3.05 0.00 0.00 64.05 60.47 2rmm n THR 49 Cb 0.19 1.42 0.02 0.00 -1.55 0.00 0.00 70.33 70.40 2rmm n THR 49 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2rmm n LYS 50 N -0.02 -4.50 -4.61 1.09 4.76 -0.85 -4.91 118.16 109.12 2rmm n LYS 50 Ca 0.00 0.55 -0.22 0.00 -2.87 0.00 0.00 58.31 55.78 2rmm n LYS 50 Cb 0.11 -5.03 -0.15 0.00 -1.84 0.00 0.00 35.03 28.12 2rmm n LYS 50 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 2rmm s THR 51 N -3.71 1.05 0.02 -0.18 2.01 -0.97 -2.26 115.64 111.62 2rmm s THR 51 Ca 0.08 -0.56 0.03 0.00 0.31 0.00 0.00 61.69 61.54 2rmm s THR 51 Cb -0.04 -0.88 -0.04 0.00 0.01 0.00 0.00 72.50 71.55 2rmm s THR 51 CO 0.84 0.30 -0.02 -0.36 -0.69 0.00 0.00 174.62 174.69 2rmm s PHE 52 N -0.26 3.01 0.07 4.92 0.40 0.58 -1.01 117.98 125.68 2rmm s PHE 52 Ca 0.04 0.03 0.07 0.00 -0.60 0.00 0.00 56.93 56.47 2rmm s PHE 52 Cb -0.06 -1.62 -0.03 0.00 0.51 0.00 0.00 43.02 41.82 2rmm s PHE 52 CO -0.00 0.45 -0.19 0.99 0.70 0.00 0.00 175.22 177.16 2rmm s THR 53 N -1.12 1.55 -0.07 0.64 2.01 0.03 -0.94 115.64 117.74 2rmm s THR 53 Ca 0.20 -1.30 -0.00 0.00 0.31 0.00 0.00 61.69 60.91 2rmm s THR 53 Cb -0.11 -1.39 0.02 0.00 0.01 0.00 0.00 72.50 71.03 2rmm s THR 53 CO 0.12 0.05 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.36 2rmm s VAL 54 N -0.97 0.66 -0.01 3.82 1.01 0.19 -1.41 120.40 123.70 2rmm s VAL 54 Ca 0.05 -0.11 0.02 0.00 0.00 0.00 0.00 61.98 61.94 2rmm s VAL 54 Cb -0.09 -0.72 -0.00 0.00 0.00 0.00 0.00 36.38 35.56 2rmm s VAL 54 CO 0.03 0.29 -0.06 -0.89 0.00 0.00 0.00 175.10 174.46 2rmm s THR 55 N 1.48 0.51 -2.45 3.92 2.01 -1.02 -0.48 115.64 119.61 2rmm s THR 55 Ca -0.01 -0.28 0.28 0.00 0.31 0.00 0.00 61.69 61.99 2rmm s THR 55 Cb -0.13 -0.43 0.59 0.00 0.01 0.00 0.00 72.50 72.53 2rmm s THR 55 CO -0.04 0.15 1.79 -0.62 -0.69 0.00 0.00 174.62 175.21