#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 4.46 0.18 3.17 2.00 -1.26 -2.24 119.66 125.96 2rmm s GLN 2 Ca 0.00 1.85 0.09 0.00 -2.00 0.00 0.00 55.36 55.30 2rmm s GLN 2 Cb 0.00 -3.28 -0.04 0.00 0.80 0.00 0.00 33.01 30.49 2rmm s GLN 2 CO 0.00 -0.17 -0.18 0.71 -0.50 0.00 0.00 175.29 175.15 2rmm s TYR 3 N 0.42 1.86 0.07 1.67 2.02 -0.05 -4.94 117.35 118.40 2rmm s TYR 3 Ca 0.56 -0.47 0.02 0.00 -0.37 0.00 0.00 57.07 56.81 2rmm s TYR 3 Cb -0.32 -0.91 -0.03 0.00 -0.40 0.00 0.00 41.96 40.30 2rmm s TYR 3 CO 0.33 0.37 -0.07 0.21 -1.57 0.00 0.00 175.55 174.82 2rmm s LYS 4 N -2.96 0.71 -0.03 -0.62 2.20 -1.00 -1.24 119.74 116.80 2rmm s LYS 4 Ca 0.18 -1.07 0.02 0.00 -0.36 0.00 0.00 55.97 54.73 2rmm s LYS 4 Cb -0.05 -0.28 0.01 0.00 -1.51 0.00 0.00 37.83 36.00 2rmm s LYS 4 CO 0.07 0.02 -0.05 -1.17 -0.36 0.00 0.00 175.35 173.86 2rmm s LEU 5 N -2.37 1.62 -0.20 5.43 1.98 0.39 -0.35 118.68 125.18 2rmm s LEU 5 Ca 0.02 -0.12 -0.01 0.00 -2.89 0.00 0.00 54.13 51.12 2rmm s LEU 5 Cb -0.02 -0.40 0.01 0.00 0.66 0.00 0.00 46.19 46.44 2rmm s LEU 5 CO -0.02 0.00 -0.13 -0.63 -1.89 0.00 0.00 176.35 173.69 2rmm s ILE 6 N 0.45 2.68 -0.29 6.68 1.01 -0.02 -1.26 121.20 130.45 2rmm s ILE 6 Ca -0.06 -0.73 -0.12 0.00 0.00 0.00 0.00 60.65 59.74 2rmm s ILE 6 Cb -0.10 -2.18 -0.04 0.00 0.01 0.00 0.00 42.46 40.15 2rmm s ILE 6 CO 0.00 0.49 0.23 -0.22 0.00 0.00 0.00 174.94 175.43 2rmm s LEU 7 N 1.37 4.08 -0.02 2.97 2.96 0.03 -0.77 118.68 129.29 2rmm s LEU 7 Ca 0.05 -0.00 0.07 0.00 -0.22 0.00 0.00 54.13 54.02 2rmm s LEU 7 Cb -0.14 -2.18 -0.02 0.00 0.50 0.00 0.00 46.19 44.35 2rmm s LEU 7 CO -0.08 -0.10 -0.22 0.20 -1.32 0.00 0.00 176.35 174.83 2rmm s ASN 8 N 1.74 3.42 0.00 3.68 0.01 0.05 -1.50 114.94 122.34 2rmm s ASN 8 Ca 0.08 -0.39 0.00 0.00 -0.71 0.00 0.00 52.86 51.85 2rmm s ASN 8 Cb -0.16 -0.52 0.00 0.00 0.41 0.00 0.00 41.25 40.98 2rmm s ASN 8 CO 0.11 0.32 0.00 0.61 -1.51 0.00 0.00 177.10 176.63 2rmm n GLY 9 N 2.29 -0.82 0.12 0.66 0.00 -1.12 -3.00 105.19 103.33 2rmm n GLY 9 Ca -0.16 -1.05 -0.16 0.00 0.00 0.00 0.00 46.02 44.64 2rmm n GLY 9 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2rmm n LYS 10 N -0.22 0.69 0.03 1.61 5.02 -1.26 -4.43 118.16 119.60 2rmm n LYS 10 Ca 0.00 0.17 -0.07 0.00 -2.02 0.00 0.00 58.31 56.39 2rmm n LYS 10 Cb 0.00 -1.61 -0.12 0.00 -0.02 0.00 0.00 35.03 33.28 2rmm n LYS 10 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 2rmm h THR 11 N 0.02 1.39 -2.80 -0.18 2.02 -1.97 -3.47 112.91 107.92 2rmm h THR 11 Ca -0.50 -3.13 -0.11 0.00 0.77 0.00 0.00 66.41 63.44 2rmm h THR 11 Cb 2.01 2.68 -0.20 0.00 -1.74 0.00 0.00 68.15 70.91 2rmm h THR 11 CO 0.00 0.79 -0.18 -0.22 0.37 0.00 0.00 175.52 176.29 2rmm s LEU 12 N -6.48 0.51 0.07 2.58 2.96 -1.26 -5.18 118.68 111.88 2rmm s LEU 12 Ca -0.01 0.27 0.02 0.00 -0.22 0.00 0.00 54.13 54.19 2rmm s LEU 12 Cb 0.09 1.54 -0.03 0.00 0.50 0.00 0.00 46.19 48.29 2rmm s LEU 12 CO 0.82 -0.46 -0.07 -0.54 -1.32 0.00 0.00 176.35 174.78 2rmm s LYS 13 N -1.18 0.70 0.00 1.98 1.02 -1.26 -2.81 119.74 118.19 2rmm s LYS 13 Ca -0.12 -1.08 0.00 0.00 0.02 0.00 0.00 55.97 54.79 2rmm s LYS 13 Cb -0.04 -0.24 0.00 0.00 -0.52 0.00 0.00 37.83 37.03 2rmm s LYS 13 CO 0.05 0.01 0.00 0.41 -0.92 0.00 0.00 175.35 174.90 2rmm n GLY 14 N 0.62 -1.52 3.08 -3.33 0.00 -0.56 -4.99 105.19 98.48 2rmm n GLY 14 Ca -0.17 -1.06 -0.13 0.00 0.00 0.00 0.00 46.02 44.66 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 -1.30 0.24 0.11 1.61 2.02 -1.26 -0.79 118.70 119.33 2rmm s GLU 15 Ca 0.00 0.38 0.02 0.00 0.02 0.00 0.00 54.97 55.39 2rmm s GLU 15 Cb 0.00 0.04 -0.04 0.00 0.10 0.00 0.00 34.13 34.23 2rmm s GLU 15 CO 0.00 -0.08 -0.07 0.95 0.02 0.00 0.00 175.26 176.08 2rmm s THR 16 N 0.50 0.82 -0.07 3.63 -4.23 -0.39 -5.02 115.64 110.89 2rmm s THR 16 Ca -0.03 -1.97 -0.09 0.00 -1.18 0.00 0.00 61.69 58.42 2rmm s THR 16 Cb -0.05 -1.73 0.02 0.00 1.34 0.00 0.00 72.50 72.08 2rmm s THR 16 CO -0.03 -0.83 0.23 -0.89 -0.54 0.00 0.00 174.62 172.56 2rmm s THR 17 N -3.54 0.02 0.16 3.99 2.01 -1.26 -0.46 115.64 116.55 2rmm s THR 17 Ca 0.13 -0.15 -0.05 0.00 0.31 0.00 0.00 61.69 61.94 2rmm s THR 17 Cb 0.05 -0.37 -0.03 0.00 0.01 0.00 0.00 72.50 72.16 2rmm s THR 17 CO -0.03 -0.08 0.18 0.28 -0.69 0.00 0.00 174.62 174.28 2rmm s THR 18 N -0.24 0.07 -0.18 -0.82 -1.32 -0.38 -5.02 115.64 107.77 2rmm s THR 18 Ca -0.03 -1.68 0.01 0.00 -1.21 0.00 0.00 61.69 58.77 2rmm s THR 18 Cb -0.03 -2.02 0.03 0.00 -1.51 0.00 0.00 72.50 68.97 2rmm s THR 18 CO 0.01 -0.32 -0.14 -0.70 -2.21 0.00 0.00 174.62 171.26 2rmm s GLU 19 N -4.03 2.40 0.19 7.08 2.12 -1.26 -0.87 118.70 124.32 2rmm s GLU 19 Ca 0.23 -0.75 0.01 0.00 0.36 0.00 0.00 54.97 54.82 2rmm s GLU 19 Cb 0.05 -2.35 -0.05 0.00 0.26 0.00 0.00 34.13 32.05 2rmm s GLU 19 CO 0.03 -0.30 0.05 0.00 -0.54 0.00 0.00 175.26 174.49 2rmm s ALA 20 N 1.39 1.34 0.05 6.30 0.00 -0.95 -4.96 121.76 124.92 2rmm s ALA 20 Ca 0.03 -1.65 0.18 0.00 0.00 0.00 0.00 51.96 50.52 2rmm s ALA 20 Cb -0.14 0.80 0.46 0.00 0.00 0.00 0.00 23.12 24.24 2rmm s ALA 20 CO -0.10 -0.41 1.63 -0.24 0.00 0.00 0.00 175.76 176.63 2rmm h VAL 21 N 2.64 0.86 -2.67 0.00 3.04 -1.95 -1.35 116.25 116.83 2rmm h VAL 21 Ca -0.37 -1.79 0.08 0.00 -1.01 0.00 0.00 66.70 63.62 2rmm h VAL 21 Cb 1.22 2.12 -0.10 0.00 -2.01 0.00 0.00 31.29 32.52 2rmm h VAL 21 CO 0.61 0.42 0.35 -0.62 -1.01 0.00 0.00 177.57 177.31 2rmm s ASP 22 N -6.43 -0.34 0.53 3.17 2.15 -1.26 -4.71 116.67 109.78 2rmm s ASP 22 Ca 0.02 -0.26 0.23 0.00 0.43 0.00 0.00 52.55 52.97 2rmm s ASP 22 Cb 0.10 0.56 1.38 0.00 -0.30 0.00 0.00 42.92 44.65 2rmm s ASP 22 CO 0.71 -0.97 2.04 0.00 -0.17 0.00 0.00 175.17 176.78 2rmm h ALA 23 N 2.00 2.32 0.01 3.66 0.00 -1.98 -1.39 119.26 123.89 2rmm h ALA 23 Ca -0.25 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.39 2rmm h ALA 23 Cb 1.26 0.03 0.02 0.00 0.00 0.00 0.00 17.79 19.10 2rmm h ALA 23 CO 0.29 -0.46 -1.00 0.00 0.00 0.00 0.00 179.25 178.09 2rmm h ALA 24 N 1.80 0.10 -0.26 0.00 0.00 -1.97 -1.23 119.26 117.71 2rmm h ALA 24 Ca 0.17 -0.69 -0.03 0.00 0.00 0.00 0.00 54.91 54.37 2rmm h ALA 24 Cb 0.72 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2rmm h ALA 24 CO -0.00 0.63 0.03 1.15 0.00 0.00 0.00 179.25 181.06 2rmm h THR 25 N 0.30 1.24 -0.87 0.00 2.02 -1.81 0.12 112.91 113.92 2rmm h THR 25 Ca -0.13 -0.82 0.01 0.00 0.77 0.00 0.00 66.41 66.24 2rmm h THR 25 Cb 1.66 1.28 -0.04 0.00 -1.74 0.00 0.00 68.15 69.30 2rmm h THR 25 CO 0.20 0.26 0.57 0.00 0.37 0.00 0.00 175.52 176.92 2rmm h ALA 26 N 0.84 1.10 -0.81 6.16 0.00 -1.35 -0.00 119.26 125.20 2rmm h ALA 26 Ca 0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2rmm h ALA 26 Cb 0.36 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 2rmm h ALA 26 CO 0.01 0.49 0.47 1.49 0.00 0.00 0.00 179.25 181.71 2rmm h GLU 27 N 1.17 1.11 -0.20 0.00 4.81 -1.13 -0.82 114.58 119.51 2rmm h GLU 27 Ca 0.32 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.42 2rmm h GLU 27 Cb -0.12 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.02 2rmm h GLU 27 CO -0.07 0.79 0.06 -0.22 -0.73 0.00 0.00 179.01 178.84 2rmm h LYS 28 N 1.11 0.32 -0.05 1.92 3.64 0.04 -0.20 116.57 123.35 2rmm h LYS 28 Ca 0.29 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.62 2rmm h LYS 28 Cb -0.02 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.72 2rmm h LYS 28 CO -0.05 0.44 -0.14 0.28 -2.27 0.00 0.00 179.45 177.70 2rmm h VAL 29 N 0.15 0.64 -0.97 2.00 2.07 -0.91 -2.06 116.25 117.15 2rmm h VAL 29 Ca 0.06 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.61 2rmm h VAL 29 Cb 0.25 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 30.61 2rmm h VAL 29 CO -0.00 0.00 0.64 -0.26 0.02 0.00 0.00 177.57 177.97 2rmm h PHE 30 N -0.21 1.21 0.00 1.57 0.04 -1.07 -0.97 116.94 117.50 2rmm h PHE 30 Ca 0.07 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.85 2rmm h PHE 30 Cb 0.30 -0.41 -0.00 0.00 2.20 0.00 0.00 35.95 38.04 2rmm h PHE 30 CO -0.22 0.73 -0.06 0.87 -0.60 0.00 0.00 178.31 179.02 2rmm h LYS 31 N 1.27 0.00 -0.36 1.51 1.57 -0.69 -0.72 116.57 119.15 2rmm h LYS 31 Ca 0.37 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 59.05 2rmm h LYS 31 Cb -0.07 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2rmm h LYS 31 CO -0.10 0.06 -0.17 0.37 -0.57 0.00 0.00 179.45 179.05 2rmm h GLN 32 N 0.00 0.75 0.00 3.15 4.15 -0.47 -3.25 115.11 119.44 2rmm h GLN 32 Ca -0.00 -0.32 0.00 0.00 0.77 0.00 0.00 58.65 59.09 2rmm h GLN 32 Cb 0.28 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.94 2rmm h GLN 32 CO 0.01 0.94 -0.40 1.88 -1.93 0.00 0.00 178.83 179.33 2rmm h TYR 33 N 0.54 0.00 -3.40 3.99 -1.99 -1.45 -3.45 116.97 111.22 2rmm h TYR 33 Ca 0.08 0.00 -0.56 0.00 2.00 0.00 0.00 58.73 60.25 2rmm h TYR 33 Cb 0.71 0.00 -0.39 0.00 2.00 0.00 0.00 36.73 39.04 2rmm h TYR 33 CO 0.06 0.00 -0.77 -0.06 -0.00 0.00 0.00 178.16 177.39 2rmm s PHE 34 N -3.27 1.70 0.00 4.88 0.08 -0.30 -4.98 117.98 116.09 2rmm s PHE 34 Ca 0.04 -1.37 0.00 0.00 0.12 0.00 0.00 56.93 55.72 2rmm s PHE 34 Cb 0.07 -1.37 0.00 0.00 -0.57 0.00 0.00 43.02 41.15 2rmm s PHE 34 CO 0.72 -0.72 0.00 0.27 -0.10 0.00 0.00 175.22 175.39 2rmm n ASN 35 N 4.86 0.00 0.00 1.36 0.23 -1.26 -4.35 115.26 116.10 2rmm n ASN 35 Ca -0.09 0.00 0.01 0.00 -0.53 0.00 0.00 54.58 53.97 2rmm n ASN 35 Cb 0.45 0.00 0.04 0.00 -2.08 0.00 0.00 39.78 38.19 2rmm n ASN 35 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2rmm n ASP 36 N 0.00 0.00 -0.12 0.53 5.75 -1.26 -0.82 116.55 120.63 2rmm n ASP 36 Ca 0.00 0.15 0.12 0.00 -0.01 0.00 0.00 54.79 55.05 2rmm n ASP 36 Cb 0.00 -0.18 0.48 0.00 -1.03 0.00 0.00 41.12 40.39 2rmm n ASP 36 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2rmm h ASN 37 N 0.00 0.41 0.00 -1.12 -1.07 -1.95 -3.43 115.58 108.42 2rmm h ASN 37 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 56.30 56.38 2rmm h ASN 37 Cb 0.01 -0.07 0.00 0.00 -2.07 0.00 0.00 38.32 36.19 2rmm h ASN 37 CO 0.00 0.24 0.00 0.61 0.07 0.00 0.00 177.43 178.35 2rmm n GLY 38 N -1.51 0.19 1.16 9.14 0.00 -1.10 -5.08 105.19 107.99 2rmm n GLY 38 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 0.05 -3.89 1.61 3.14 -0.50 -4.95 118.33 113.80 2rmm n VAL 39 Ca 0.00 0.02 -0.31 0.00 -2.96 0.00 0.00 64.34 61.09 2rmm n VAL 39 Cb 0.00 -1.35 -0.07 0.00 -1.06 0.00 0.00 33.84 31.37 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 -2.95 -0.83 -4.66 6.55 2.03 0.00 -4.75 116.55 111.94 2rmm n ASP 40 Ca 0.00 -0.98 -0.29 0.00 0.52 0.00 0.00 54.79 54.04 2rmm n ASP 40 Cb 0.40 -1.24 0.12 0.00 -0.72 0.00 0.00 41.12 39.68 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 -3.11 1.65 -0.24 0.27 0.00 -1.26 -4.98 107.32 99.65 2rmm s GLY 41 Ca 0.48 -0.84 -0.29 0.00 0.00 0.00 0.00 44.72 44.07 2rmm s GLY 41 CO 0.80 -0.26 1.40 1.85 0.00 0.00 0.00 173.10 176.89 2rmm s GLU 42 N -5.67 3.95 0.28 2.90 2.12 0.10 -4.82 118.70 117.56 2rmm s GLU 42 Ca 0.66 1.48 -0.27 0.00 0.36 0.00 0.00 54.97 57.19 2rmm s GLU 42 Cb -0.09 -3.91 -0.09 0.00 0.26 0.00 0.00 34.13 30.30 2rmm s GLU 42 CO 0.50 -1.09 0.93 -1.58 -0.54 0.00 0.00 175.26 173.48 2rmm s TRP 43 N 4.45 3.82 0.04 5.30 0.52 -1.26 -2.71 118.94 129.10 2rmm s TRP 43 Ca 0.61 1.82 0.00 0.00 0.02 0.00 0.00 56.10 58.55 2rmm s TRP 43 Cb -0.21 -2.93 -0.03 0.00 -1.15 0.00 0.00 33.47 29.16 2rmm s TRP 43 CO 0.24 0.33 -0.04 0.99 0.02 0.00 0.00 176.95 178.49 2rmm s THR 44 N -1.41 0.26 -0.06 2.01 2.01 -0.08 -5.01 115.64 113.35 2rmm s THR 44 Ca 0.45 -1.23 -0.04 0.00 0.31 0.00 0.00 61.69 61.19 2rmm s THR 44 Cb -0.22 -0.72 0.03 0.00 0.01 0.00 0.00 72.50 71.60 2rmm s THR 44 CO 0.27 -0.62 0.15 -0.47 -0.69 0.00 0.00 174.62 173.26 2rmm s TYR 45 N -2.18 -0.18 -0.34 4.92 5.04 -1.26 -0.97 117.35 122.38 2rmm s TYR 45 Ca -0.07 0.47 0.02 0.00 -2.44 0.00 0.00 57.07 55.04 2rmm s TYR 45 Cb -0.05 -0.01 0.09 0.00 0.35 0.00 0.00 41.96 42.35 2rmm s TYR 45 CO -0.03 -0.13 0.05 -0.51 -1.34 0.00 0.00 175.55 173.59 2rmm s ASP 46 N 0.68 4.83 0.36 4.32 1.01 -0.26 -5.01 116.67 122.61 2rmm s ASP 46 Ca -0.05 -1.95 0.10 0.00 0.71 0.00 0.00 52.55 51.36 2rmm s ASP 46 Cb -0.07 -1.67 0.68 0.00 1.01 0.00 0.00 42.92 42.88 2rmm s ASP 46 CO -0.03 -0.38 1.83 -0.78 0.21 0.00 0.00 175.17 176.02 2rmm h ASP 47 N 7.75 0.13 0.00 0.27 3.58 -1.95 -1.92 116.42 124.27 2rmm h ASP 47 Ca -0.09 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.32 2rmm h ASP 47 Cb 1.03 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 42.05 2rmm h ASP 47 CO 0.55 0.43 0.19 0.00 -2.88 0.00 0.00 179.24 177.54 2rmm h ALA 48 N 1.58 1.19 0.00 -0.78 0.00 -1.96 -1.37 119.26 117.92 2rmm h ALA 48 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2rmm h ALA 48 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2rmm h ALA 48 CO 0.04 -0.19 -0.06 -2.37 0.00 0.00 0.00 179.25 176.67 2rmm n THR 49 N -2.94 0.70 -4.41 0.00 5.66 -1.10 -5.04 114.28 107.15 2rmm n THR 49 Ca -0.02 -0.75 -0.38 0.00 -3.05 0.00 0.00 64.05 59.84 2rmm n THR 49 Cb 0.25 0.55 -0.07 0.00 -1.55 0.00 0.00 70.33 69.50 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 -0.42 -1.28 -4.58 1.09 4.76 -0.52 -4.89 118.16 112.32 2rmm n LYS 50 Ca 0.02 0.17 -0.22 0.00 -2.87 0.00 0.00 58.31 55.42 2rmm n LYS 50 Cb 0.44 -4.45 -0.15 0.00 -1.84 0.00 0.00 35.03 29.03 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 -3.61 1.04 -0.01 -0.18 2.01 -0.89 -2.39 115.64 111.61 2rmm s THR 51 Ca 0.54 -0.53 -0.02 0.00 0.31 0.00 0.00 61.69 61.99 2rmm s THR 51 Cb -0.31 -0.90 -0.04 0.00 0.01 0.00 0.00 72.50 71.26 2rmm s THR 51 CO 1.00 0.31 0.15 -0.36 -0.69 0.00 0.00 174.62 175.02 2rmm s PHE 52 N -0.06 3.47 -0.00 4.92 0.40 0.52 -1.10 117.98 126.13 2rmm s PHE 52 Ca 0.00 0.32 0.04 0.00 -0.60 0.00 0.00 56.93 56.69 2rmm s PHE 52 Cb -0.08 -1.80 -0.01 0.00 0.51 0.00 0.00 43.02 41.64 2rmm s PHE 52 CO 0.00 0.62 -0.14 0.99 0.70 0.00 0.00 175.22 177.39 2rmm s THR 53 N -1.27 1.13 -0.05 0.64 2.01 -0.14 -0.84 115.64 117.11 2rmm s THR 53 Ca 0.25 -0.68 0.01 0.00 0.31 0.00 0.00 61.69 61.59 2rmm s THR 53 Cb -0.12 -0.95 0.02 0.00 0.01 0.00 0.00 72.50 71.45 2rmm s THR 53 CO 0.16 0.26 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.60 2rmm s VAL 54 N -0.42 0.72 -0.01 3.82 1.01 0.05 -0.91 120.40 124.66 2rmm s VAL 54 Ca 0.05 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 61.82 2rmm s VAL 54 Cb -0.06 -0.71 -0.00 0.00 0.00 0.00 0.00 36.38 35.61 2rmm s VAL 54 CO -0.00 0.27 -0.07 -0.89 0.00 0.00 0.00 175.10 174.41 2rmm s THR 55 N 0.86 0.54 -2.00 3.92 2.01 -1.10 -0.77 115.64 119.11 2rmm s THR 55 Ca -0.12 -0.27 0.15 0.00 0.31 0.00 0.00 61.69 61.75 2rmm s THR 55 Cb -0.15 -0.47 0.41 0.00 0.01 0.00 0.00 72.50 72.31 2rmm s THR 55 CO 0.01 0.16 1.28 -0.62 -0.69 0.00 0.00 174.62 174.77