#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 4.69 0.22 2.12 0.74 -1.26 -1.53 119.66 124.63 2rmm s GLN 2 Ca 0.00 1.40 0.09 0.00 0.05 0.00 0.00 55.36 56.89 2rmm s GLN 2 Cb 0.00 -3.36 -0.05 0.00 1.10 0.00 0.00 33.01 30.71 2rmm s GLN 2 CO 0.00 0.28 -0.16 0.71 -0.55 0.00 0.00 175.29 175.57 2rmm s TYR 3 N -0.22 1.85 0.07 1.67 1.51 0.22 -4.93 117.35 117.53 2rmm s TYR 3 Ca 0.45 -0.51 0.02 0.00 -1.01 0.00 0.00 57.07 56.02 2rmm s TYR 3 Cb -0.23 -0.85 -0.03 0.00 -0.11 0.00 0.00 41.96 40.73 2rmm s TYR 3 CO 0.29 0.43 -0.08 0.21 -1.11 0.00 0.00 175.55 175.30 2rmm s LYS 4 N -3.50 0.71 -0.04 -0.62 2.20 -1.01 -1.69 119.74 115.78 2rmm s LYS 4 Ca 0.23 -1.07 0.01 0.00 -0.36 0.00 0.00 55.97 54.78 2rmm s LYS 4 Cb -0.02 -0.29 0.02 0.00 -1.51 0.00 0.00 37.83 36.03 2rmm s LYS 4 CO 0.09 0.02 -0.04 -1.17 -0.36 0.00 0.00 175.35 173.89 2rmm s LEU 5 N -2.35 1.34 -0.16 5.43 1.98 0.61 -0.27 118.68 125.26 2rmm s LEU 5 Ca 0.02 -0.12 -0.02 0.00 -2.89 0.00 0.00 54.13 51.12 2rmm s LEU 5 Cb -0.02 -0.44 -0.01 0.00 0.66 0.00 0.00 46.19 46.38 2rmm s LEU 5 CO -0.02 -0.05 -0.09 -0.63 -1.89 0.00 0.00 176.35 173.67 2rmm s ILE 6 N 0.90 3.25 -0.25 6.68 1.01 -0.20 -1.01 121.20 131.57 2rmm s ILE 6 Ca -0.11 -0.57 -0.07 0.00 0.00 0.00 0.00 60.65 59.89 2rmm s ILE 6 Cb -0.14 -2.41 -0.02 0.00 0.01 0.00 0.00 42.46 39.89 2rmm s ILE 6 CO 0.00 0.49 0.07 -0.22 0.00 0.00 0.00 174.94 175.28 2rmm s LEU 7 N 0.73 3.46 -0.06 2.97 2.96 0.03 -0.63 118.68 128.14 2rmm s LEU 7 Ca -0.04 -0.27 0.05 0.00 -0.22 0.00 0.00 54.13 53.65 2rmm s LEU 7 Cb -0.15 -1.91 -0.01 0.00 0.50 0.00 0.00 46.19 44.62 2rmm s LEU 7 CO 0.02 -0.05 -0.22 0.20 -1.32 0.00 0.00 176.35 174.97 2rmm s ASN 8 N 1.60 3.29 0.00 3.68 0.01 0.15 -1.91 114.94 121.75 2rmm s ASN 8 Ca 0.06 -0.44 0.00 0.00 -0.71 0.00 0.00 52.86 51.76 2rmm s ASN 8 Cb -0.15 -0.86 0.00 0.00 0.41 0.00 0.00 41.25 40.64 2rmm s ASN 8 CO 0.03 0.26 0.00 0.61 -1.51 0.00 0.00 177.10 176.49 2rmm n GLY 9 N 2.86 -1.54 0.06 0.66 0.00 -1.21 -2.59 105.19 103.43 2rmm n GLY 9 Ca -0.17 -1.05 -0.07 0.00 0.00 0.00 0.00 46.02 44.73 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 -0.20 1.26 0.09 1.61 5.02 -1.26 -4.58 118.16 120.09 2rmm n LYS 10 Ca 0.00 0.04 -0.12 0.00 -2.02 0.00 0.00 58.31 56.20 2rmm n LYS 10 Cb 0.00 -1.27 -0.07 0.00 -0.02 0.00 0.00 35.03 33.67 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 0.00 1.48 -2.81 -0.18 2.02 -1.97 -3.47 112.91 107.98 2rmm h THR 11 Ca -0.29 -2.77 -0.11 0.00 0.77 0.00 0.00 66.41 64.01 2rmm h THR 11 Cb 1.55 2.64 -0.20 0.00 -1.74 0.00 0.00 68.15 70.40 2rmm h THR 11 CO -0.02 0.81 -0.18 -0.22 0.37 0.00 0.00 175.52 176.28 2rmm s LEU 12 N -7.38 0.53 0.06 2.58 2.96 -1.26 -5.18 118.68 111.00 2rmm s LEU 12 Ca -0.04 0.25 0.01 0.00 -0.22 0.00 0.00 54.13 54.13 2rmm s LEU 12 Cb 0.09 1.53 -0.03 0.00 0.50 0.00 0.00 46.19 48.27 2rmm s LEU 12 CO 0.86 -0.46 -0.06 -0.54 -1.32 0.00 0.00 176.35 174.82 2rmm s LYS 13 N -1.22 0.64 0.00 1.98 1.02 -1.26 -3.28 119.74 117.62 2rmm s LYS 13 Ca -0.12 -1.04 0.00 0.00 0.02 0.00 0.00 55.97 54.82 2rmm s LYS 13 Cb -0.04 -0.15 0.00 0.00 -0.52 0.00 0.00 37.83 37.12 2rmm s LYS 13 CO 0.05 -0.01 0.00 0.41 -0.92 0.00 0.00 175.35 174.88 2rmm n GLY 14 N 0.67 -1.29 3.05 -3.33 0.00 -0.80 -4.99 105.19 98.50 2rmm n GLY 14 Ca -0.17 -1.09 -0.12 0.00 0.00 0.00 0.00 46.02 44.64 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 -1.38 0.25 0.06 1.61 2.02 -1.26 -0.79 118.70 119.21 2rmm s GLU 15 Ca 0.00 0.04 0.01 0.00 0.02 0.00 0.00 54.97 55.04 2rmm s GLU 15 Cb 0.00 0.11 -0.03 0.00 0.10 0.00 0.00 34.13 34.31 2rmm s GLU 15 CO 0.00 -0.04 -0.05 0.95 0.02 0.00 0.00 175.26 176.13 2rmm s THR 16 N -0.31 0.41 -0.09 3.63 -4.23 -0.18 -5.02 115.64 109.86 2rmm s THR 16 Ca -0.04 -1.48 -0.08 0.00 -1.18 0.00 0.00 61.69 58.91 2rmm s THR 16 Cb -0.03 -1.08 0.02 0.00 1.34 0.00 0.00 72.50 72.75 2rmm s THR 16 CO 0.01 -0.71 0.23 -0.89 -0.54 0.00 0.00 174.62 172.72 2rmm s THR 17 N -2.71 0.00 0.17 3.99 2.01 -1.26 -0.28 115.64 117.56 2rmm s THR 17 Ca -0.01 -0.01 -0.15 0.00 0.31 0.00 0.00 61.69 61.84 2rmm s THR 17 Cb -0.01 -0.33 0.02 0.00 0.01 0.00 0.00 72.50 72.19 2rmm s THR 17 CO -0.04 -0.00 0.42 0.28 -0.69 0.00 0.00 174.62 174.58 2rmm s THR 18 N 0.11 0.05 -0.18 -0.82 -1.32 -0.68 -5.02 115.64 107.78 2rmm s THR 18 Ca -0.00 -0.91 -0.02 0.00 -1.21 0.00 0.00 61.69 59.55 2rmm s THR 18 Cb -0.02 -1.54 -0.01 0.00 -1.51 0.00 0.00 72.50 69.43 2rmm s THR 18 CO 0.00 -0.23 -0.10 -0.70 -2.21 0.00 0.00 174.62 171.38 2rmm s GLU 19 N -3.88 3.32 0.17 7.08 2.12 -1.26 -0.61 118.70 125.64 2rmm s GLU 19 Ca 0.10 -0.68 0.01 0.00 0.36 0.00 0.00 54.97 54.76 2rmm s GLU 19 Cb 0.01 -2.78 -0.04 0.00 0.26 0.00 0.00 34.13 31.57 2rmm s GLU 19 CO -0.05 -0.03 0.02 0.00 -0.54 0.00 0.00 175.26 174.67 2rmm s ALA 20 N 0.97 1.25 0.17 6.30 0.00 -0.58 -4.95 121.76 124.93 2rmm s ALA 20 Ca -0.01 -1.58 -0.10 0.00 0.00 0.00 0.00 51.96 50.26 2rmm s ALA 20 Cb -0.15 0.67 0.06 0.00 0.00 0.00 0.00 23.12 23.70 2rmm s ALA 20 CO -0.01 -0.38 1.64 -0.24 0.00 0.00 0.00 175.76 176.77 2rmm h VAL 21 N 2.71 1.26 -3.63 0.00 3.04 -1.95 -1.37 116.25 116.32 2rmm h VAL 21 Ca -0.36 -1.12 -0.05 0.00 -1.01 0.00 0.00 66.70 64.15 2rmm h VAL 21 Cb 1.21 0.82 -0.09 0.00 -2.01 0.00 0.00 31.29 31.21 2rmm h VAL 21 CO 0.62 0.41 -0.11 -0.62 -1.01 0.00 0.00 177.57 176.85 2rmm s ASP 22 N -6.51 -0.10 0.48 3.17 2.15 -1.26 -4.55 116.67 110.04 2rmm s ASP 22 Ca -0.12 -0.91 0.24 0.00 0.43 0.00 0.00 52.55 52.19 2rmm s ASP 22 Cb 0.13 0.59 1.27 0.00 -0.30 0.00 0.00 42.92 44.61 2rmm s ASP 22 CO 0.85 -1.14 1.89 0.00 -0.17 0.00 0.00 175.17 176.60 2rmm h ALA 23 N 2.25 2.48 -0.11 3.66 0.00 -1.96 -1.00 119.26 124.59 2rmm h ALA 23 Ca -0.26 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.43 2rmm h ALA 23 Cb 1.25 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2rmm h ALA 23 CO 0.35 -0.73 -0.78 0.00 0.00 0.00 0.00 179.25 178.09 2rmm h ALA 24 N 1.61 0.42 -0.20 0.00 0.00 -1.97 -0.42 119.26 118.69 2rmm h ALA 24 Ca 0.42 -0.61 -0.12 0.00 0.00 0.00 0.00 54.91 54.60 2rmm h ALA 24 Cb 1.33 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 2rmm h ALA 24 CO -0.09 0.72 -0.33 1.15 0.00 0.00 0.00 179.25 180.71 2rmm h THR 25 N 0.41 1.33 -0.73 0.00 2.02 -1.64 0.56 112.91 114.87 2rmm h THR 25 Ca -0.05 -1.54 -0.03 0.00 0.77 0.00 0.00 66.41 65.56 2rmm h THR 25 Cb 1.39 1.83 -0.03 0.00 -1.74 0.00 0.00 68.15 69.60 2rmm h THR 25 CO 0.15 0.48 0.33 0.00 0.37 0.00 0.00 175.52 176.84 2rmm h ALA 26 N 0.61 1.21 -0.87 6.16 0.00 -1.30 0.36 119.26 125.43 2rmm h ALA 26 Ca 0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2rmm h ALA 26 Cb 0.91 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 2rmm h ALA 26 CO 0.07 0.59 0.45 1.49 0.00 0.00 0.00 179.25 181.86 2rmm h GLU 27 N 1.04 1.23 -0.27 0.00 4.81 -1.04 -0.41 114.58 119.93 2rmm h GLU 27 Ca 0.25 -0.16 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 2rmm h GLU 27 Cb 0.14 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 2rmm h GLU 27 CO -0.03 0.92 0.01 -0.22 -0.73 0.00 0.00 179.01 178.96 2rmm h LYS 28 N 1.23 0.47 -0.10 1.92 3.64 -0.08 0.37 116.57 124.01 2rmm h LYS 28 Ca 0.30 -0.15 0.01 0.00 -1.27 0.00 0.00 60.65 59.54 2rmm h LYS 28 Cb 0.07 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2rmm h LYS 28 CO -0.04 0.62 0.05 0.28 -2.27 0.00 0.00 179.45 178.09 2rmm h VAL 29 N 0.26 1.00 -0.81 2.00 2.07 -0.83 -0.09 116.25 119.86 2rmm h VAL 29 Ca 0.08 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.56 2rmm h VAL 29 Cb 0.40 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 2rmm h VAL 29 CO 0.01 0.02 0.51 -0.26 0.02 0.00 0.00 177.57 177.87 2rmm h PHE 30 N 0.11 1.05 0.00 1.57 0.04 -1.05 -2.01 116.94 116.65 2rmm h PHE 30 Ca 0.04 0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.76 2rmm h PHE 30 Cb 0.00 -0.35 -0.01 0.00 2.20 0.00 0.00 35.95 37.80 2rmm h PHE 30 CO -0.09 0.69 -0.29 0.87 -0.60 0.00 0.00 178.31 178.89 2rmm h LYS 31 N 1.11 0.00 -0.15 1.51 1.57 -0.74 0.18 116.57 120.04 2rmm h LYS 31 Ca 0.29 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 59.00 2rmm h LYS 31 Cb -0.08 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 2rmm h LYS 31 CO -0.06 0.29 -0.22 1.96 -0.57 0.00 0.00 179.45 180.85 2rmm h GLN 32 N 0.00 0.26 0.00 3.15 4.20 -0.27 -0.58 115.11 121.87 2rmm h GLN 32 Ca -0.00 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.63 2rmm h GLN 32 Cb 0.61 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.37 2rmm h GLN 32 CO 0.04 0.48 -0.77 0.66 -0.67 0.00 0.00 178.83 178.56 2rmm n TYR 33 N -4.19 0.29 -2.07 2.96 4.02 -0.96 -4.60 117.16 112.61 2rmm n TYR 33 Ca -0.01 0.08 0.02 0.00 -0.01 0.00 0.00 57.90 57.98 2rmm n TYR 33 Cb 0.34 -0.45 0.02 0.00 -0.02 0.00 0.00 39.34 39.23 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 -1.89 0.00 0.00 -0.72 3.72 0.01 -4.94 117.46 113.65 2rmm n PHE 34 Ca 0.03 -0.22 0.00 0.00 -0.05 0.00 0.00 57.45 57.21 2rmm n PHE 34 Cb 0.41 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.86 2rmm n PHE 34 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 2rmm n ASN 35 N 0.03 0.00 -0.65 4.37 0.23 -0.23 -4.73 115.26 114.28 2rmm n ASN 35 Ca 0.03 0.97 -0.02 0.00 -0.53 0.00 0.00 54.58 55.03 2rmm n ASN 35 Cb 0.82 -0.47 -0.02 0.00 -2.08 0.00 0.00 39.78 38.02 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 -2.02 -0.32 -0.30 0.53 5.68 -1.26 -4.51 116.55 114.36 2rmm n ASP 36 Ca 0.00 -1.30 0.04 0.00 -0.50 0.00 0.00 54.79 53.03 2rmm n ASP 36 Cb 0.00 0.09 0.24 0.00 -1.14 0.00 0.00 41.12 40.31 2rmm n ASP 36 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 2rmm h ASN 37 N 0.00 0.91 0.00 -1.12 7.08 -1.92 -3.45 115.58 117.08 2rmm h ASN 37 Ca -0.18 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.04 2rmm h ASN 37 Cb 1.12 -0.19 0.00 0.00 -2.08 0.00 0.00 38.32 37.16 2rmm h ASN 37 CO -0.09 0.59 0.00 0.61 -2.08 0.00 0.00 177.43 176.46 2rmm n GLY 38 N -1.40 0.08 0.15 9.14 0.00 -1.26 -5.03 105.19 106.87 2rmm n GLY 38 Ca 0.13 -0.05 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 2rmm n GLY 38 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2rmm h VAL 39 N 0.00 1.23 -6.66 1.61 3.04 -1.89 -3.47 116.25 110.11 2rmm h VAL 39 Ca 0.00 -0.79 -0.54 0.00 -1.01 0.00 0.00 66.70 64.36 2rmm h VAL 39 Cb 0.00 1.28 -0.32 0.00 -2.01 0.00 0.00 31.29 30.24 2rmm h VAL 39 CO 0.00 0.25 -0.79 -0.67 -1.01 0.00 0.00 177.57 175.35 2rmm n ASP 40 N -4.68 -1.32 -4.77 3.17 2.03 -1.26 -4.71 116.55 105.01 2rmm n ASP 40 Ca -0.03 -1.09 -0.23 0.00 0.52 0.00 0.00 54.79 53.96 2rmm n ASP 40 Cb 0.21 -1.38 0.09 0.00 -0.72 0.00 0.00 41.12 39.31 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 -3.09 1.77 -0.33 0.27 0.00 -1.26 -4.97 107.32 99.72 2rmm s GLY 41 Ca 0.65 -1.53 -0.29 0.00 0.00 0.00 0.00 44.72 43.55 2rmm s GLY 41 CO 0.89 -1.05 1.19 1.85 0.00 0.00 0.00 173.10 175.98 2rmm s GLU 42 N -5.06 3.96 0.25 2.90 2.12 -0.10 -4.84 118.70 117.92 2rmm s GLU 42 Ca 0.63 1.10 -0.29 0.00 0.36 0.00 0.00 54.97 56.77 2rmm s GLU 42 Cb -0.07 -3.82 -0.09 0.00 0.26 0.00 0.00 34.13 30.41 2rmm s GLU 42 CO 0.43 -1.06 0.93 -1.58 -0.54 0.00 0.00 175.26 173.44 2rmm s TRP 43 N 4.08 3.93 0.03 5.30 0.52 -1.26 -2.89 118.94 128.65 2rmm s TRP 43 Ca 0.51 1.88 0.00 0.00 0.02 0.00 0.00 56.10 58.51 2rmm s TRP 43 Cb -0.14 -2.96 -0.03 0.00 -1.15 0.00 0.00 33.47 29.20 2rmm s TRP 43 CO 0.21 0.42 -0.04 0.99 0.02 0.00 0.00 176.95 178.54 2rmm s THR 44 N -1.26 0.25 -0.05 2.01 2.01 -0.14 -5.01 115.64 113.44 2rmm s THR 44 Ca 0.42 -1.15 -0.03 0.00 0.31 0.00 0.00 61.69 61.24 2rmm s THR 44 Cb -0.24 -0.62 0.02 0.00 0.01 0.00 0.00 72.50 71.67 2rmm s THR 44 CO 0.30 -0.58 0.12 -0.47 -0.69 0.00 0.00 174.62 173.31 2rmm s TYR 45 N -1.97 -0.14 -0.35 4.92 5.04 -1.26 -0.98 117.35 122.61 2rmm s TYR 45 Ca -0.09 0.37 0.02 0.00 -2.44 0.00 0.00 57.07 54.93 2rmm s TYR 45 Cb -0.06 -0.01 0.10 0.00 0.35 0.00 0.00 41.96 42.33 2rmm s TYR 45 CO -0.02 -0.10 0.07 -0.51 -1.34 0.00 0.00 175.55 173.64 2rmm s ASP 46 N 0.52 4.86 0.34 4.32 1.01 -0.10 -5.01 116.67 122.60 2rmm s ASP 46 Ca -0.04 -2.00 0.06 0.00 0.71 0.00 0.00 52.55 51.28 2rmm s ASP 46 Cb -0.05 -1.67 0.62 0.00 1.01 0.00 0.00 42.92 42.82 2rmm s ASP 46 CO -0.02 -0.39 1.85 -0.78 0.21 0.00 0.00 175.17 176.03 2rmm h ASP 47 N 7.75 0.37 0.00 0.27 3.58 -1.96 -2.23 116.42 124.20 2rmm h ASP 47 Ca -0.09 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.28 2rmm h ASP 47 Cb 1.03 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.98 2rmm h ASP 47 CO 0.56 0.53 0.16 0.00 -2.88 0.00 0.00 179.24 177.61 2rmm h ALA 48 N 1.51 1.16 0.00 -0.78 0.00 -1.96 -1.28 119.26 117.90 2rmm h ALA 48 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2rmm h ALA 48 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2rmm h ALA 48 CO 0.03 -0.16 -0.06 -2.37 0.00 0.00 0.00 179.25 176.69 2rmm n THR 49 N -2.83 0.70 -4.34 0.00 5.66 -1.11 -5.04 114.28 107.32 2rmm n THR 49 Ca -0.02 -0.75 -0.35 0.00 -3.05 0.00 0.00 64.05 59.87 2rmm n THR 49 Cb 0.22 0.55 -0.07 0.00 -1.55 0.00 0.00 70.33 69.47 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 -1.53 -4.51 1.09 4.76 -0.49 -4.89 118.16 112.17 2rmm n LYS 50 Ca 0.02 0.19 -0.21 0.00 -2.87 0.00 0.00 58.31 55.45 2rmm n LYS 50 Cb 0.44 -4.35 -0.15 0.00 -1.84 0.00 0.00 35.03 29.14 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 -3.76 0.92 0.01 -0.18 2.01 -0.92 -2.41 115.64 111.32 2rmm s THR 51 Ca 0.42 -0.49 0.01 0.00 0.31 0.00 0.00 61.69 61.93 2rmm s THR 51 Cb -0.24 -0.78 -0.04 0.00 0.01 0.00 0.00 72.50 71.45 2rmm s THR 51 CO 0.98 0.27 0.05 -0.36 -0.69 0.00 0.00 174.62 174.87 2rmm s PHE 52 N -0.20 3.19 0.01 4.92 0.40 0.63 -0.92 117.98 126.02 2rmm s PHE 52 Ca 0.03 0.14 0.05 0.00 -0.60 0.00 0.00 56.93 56.55 2rmm s PHE 52 Cb -0.05 -1.69 -0.02 0.00 0.51 0.00 0.00 43.02 41.77 2rmm s PHE 52 CO -0.00 0.51 -0.14 0.99 0.70 0.00 0.00 175.22 177.28 2rmm s THR 53 N -1.18 1.11 -0.04 0.64 2.01 -0.16 -1.03 115.64 116.99 2rmm s THR 53 Ca 0.22 -0.79 0.02 0.00 0.31 0.00 0.00 61.69 61.45 2rmm s THR 53 Cb -0.12 -0.96 0.02 0.00 0.01 0.00 0.00 72.50 71.45 2rmm s THR 53 CO 0.13 0.16 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.47 2rmm s VAL 54 N -0.57 0.67 -0.01 3.82 1.01 0.20 -0.97 120.40 124.55 2rmm s VAL 54 Ca 0.04 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 61.81 2rmm s VAL 54 Cb -0.07 -0.66 -0.00 0.00 0.00 0.00 0.00 36.38 35.65 2rmm s VAL 54 CO 0.00 0.25 -0.07 -0.89 0.00 0.00 0.00 175.10 174.39 2rmm s THR 55 N 0.72 0.54 -2.00 3.92 2.01 -1.14 -0.68 115.64 119.01 2rmm s THR 55 Ca -0.11 -0.28 0.28 0.00 0.31 0.00 0.00 61.69 61.88 2rmm s THR 55 Cb -0.14 -0.46 0.79 0.00 0.01 0.00 0.00 72.50 72.71 2rmm s THR 55 CO 0.01 0.15 2.00 -0.62 -0.69 0.00 0.00 174.62 175.47