#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmu s SER 2 N 0.00 3.16 0.06 1.61 1.04 -1.26 -5.02 113.70 113.29 2dmu s SER 2 Ca 0.00 -0.73 -0.24 0.00 0.48 0.00 0.00 55.95 55.45 2dmu s SER 2 Cb 0.00 -1.28 -0.17 0.00 0.10 0.00 0.00 66.02 64.68 2dmu s SER 2 CO 0.00 -0.09 1.60 0.77 0.98 0.00 0.00 173.24 176.50 2dmu h SER 3 N 7.98 -0.04 -0.01 7.02 4.64 -2.12 -3.48 113.55 127.55 2dmu h SER 3 Ca -0.34 -0.12 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2dmu h SER 3 Cb 1.11 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2dmu h SER 3 CO 0.52 0.10 0.00 0.61 -0.87 0.00 0.00 176.83 177.19 2dmu n GLY 4 N -0.75 0.66 3.46 -0.77 0.00 -1.26 -5.13 105.19 101.40 2dmu n GLY 4 Ca -0.08 -0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.71 2dmu n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dmu s SER 5 N -1.34 3.12 -1.29 1.61 0.01 -1.26 -4.78 113.70 109.77 2dmu s SER 5 Ca 0.00 -1.16 -0.06 0.00 1.31 0.00 0.00 55.95 56.04 2dmu s SER 5 Cb 0.00 -0.23 0.01 0.00 0.21 0.00 0.00 66.02 66.00 2dmu s SER 5 CO 0.00 -0.25 1.12 -1.20 0.41 0.00 0.00 173.24 173.32 2dmu n SER 6 N -0.63 -4.88 -4.88 2.44 7.64 -1.26 -4.98 113.62 107.06 2dmu n SER 6 Ca -0.05 -0.56 -0.30 0.00 1.01 0.00 0.00 58.87 58.96 2dmu n SER 6 Cb 0.63 -5.04 0.03 0.00 -1.01 0.00 0.00 64.21 58.82 2dmu n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dmu s GLY 7 N -3.67 1.63 -0.09 0.23 0.00 -1.26 -5.07 107.32 99.09 2dmu s GLY 7 Ca 0.38 -0.29 -0.02 0.00 0.00 0.00 0.00 44.72 44.80 2dmu s GLY 7 CO 0.72 0.03 0.00 1.09 0.00 0.00 0.00 173.10 174.95 2dmu s ARG 8 N -5.25 3.02 -0.05 2.90 1.70 -1.26 -5.11 118.95 114.90 2dmu s ARG 8 Ca 0.56 -0.41 0.04 0.00 -0.47 0.00 0.00 55.73 55.45 2dmu s ARG 8 Cb -0.11 -2.80 0.00 0.00 -0.57 0.00 0.00 34.95 31.47 2dmu s ARG 8 CO 0.52 0.68 -0.16 -0.98 -1.08 0.00 0.00 175.30 174.29 2dmu s ARG 9 N -0.83 1.74 0.12 3.89 1.70 -1.26 -5.12 118.95 119.19 2dmu s ARG 9 Ca 0.13 -0.55 -0.30 0.00 -0.47 0.00 0.00 55.73 54.54 2dmu s ARG 9 Cb -0.11 -1.49 -0.06 0.00 -0.57 0.00 0.00 34.95 32.72 2dmu s ARG 9 CO 0.02 0.18 1.04 -1.58 -1.08 0.00 0.00 175.30 173.89 2dmu s HIS 10 N 0.19 3.68 -0.16 5.89 2.46 -1.26 -4.98 115.29 121.12 2dmu s HIS 10 Ca -0.07 1.66 -0.14 0.00 0.47 0.00 0.00 55.06 56.98 2dmu s HIS 10 Cb -0.12 -3.18 -0.11 0.00 -0.13 0.00 0.00 32.58 29.04 2dmu s HIS 10 CO 0.03 -0.28 0.09 0.00 -2.47 0.00 0.00 174.74 172.11 2dmu h ARG 11 N 5.65 0.00 -6.30 2.88 3.08 -2.07 -3.45 114.38 114.16 2dmu h ARG 11 Ca -0.43 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.08 2dmu h ARG 11 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 2dmu h ARG 11 CO 0.73 0.46 1.13 0.99 -1.07 0.00 0.00 179.97 182.21 2dmu s THR 12 N -2.18 3.39 -0.13 2.04 2.01 -1.26 -4.99 115.64 114.52 2dmu s THR 12 Ca -0.18 0.48 -0.04 0.00 0.31 0.00 0.00 61.69 62.25 2dmu s THR 12 Cb 0.03 -3.31 -0.04 0.00 0.01 0.00 0.00 72.50 69.19 2dmu s THR 12 CO 0.37 -0.04 0.04 -0.63 -0.69 0.00 0.00 174.62 173.66 2dmu s ILE 13 N 4.14 4.59 0.59 1.82 1.01 -1.26 -5.11 121.20 126.98 2dmu s ILE 13 Ca 0.78 -0.13 -0.09 0.00 0.00 0.00 0.00 60.65 61.21 2dmu s ILE 13 Cb -0.37 -2.99 -0.03 0.00 0.01 0.00 0.00 42.46 39.08 2dmu s ILE 13 CO 0.33 0.55 0.97 -0.36 0.00 0.00 0.00 174.94 176.44 2dmu s PHE 14 N -0.39 3.56 0.62 3.97 0.40 -1.26 -5.07 117.98 119.80 2dmu s PHE 14 Ca 0.08 1.11 -0.09 0.00 -0.60 0.00 0.00 56.93 57.43 2dmu s PHE 14 Cb -0.12 -2.66 -0.01 0.00 0.51 0.00 0.00 43.02 40.75 2dmu s PHE 14 CO 0.02 -0.65 0.98 0.95 0.70 0.00 0.00 175.22 177.21 2dmu s THR 15 N -3.08 3.98 0.14 0.64 -4.23 -1.26 -4.88 115.64 106.95 2dmu s THR 15 Ca 0.53 0.36 -0.26 0.00 -1.18 0.00 0.00 61.69 61.15 2dmu s THR 15 Cb -0.11 -3.60 -0.01 0.00 1.34 0.00 0.00 72.50 70.12 2dmu s THR 15 CO 0.51 -0.71 1.60 -2.24 -0.54 0.00 0.00 174.62 173.24 2dmu h ASP 16 N -0.31 -1.12 -0.20 3.99 3.04 -1.99 -1.38 116.42 118.45 2dmu h ASP 16 Ca -0.45 0.17 0.04 0.00 -3.24 0.00 0.00 57.03 53.55 2dmu h ASP 16 Cb 1.24 0.48 -0.07 0.00 -1.04 0.00 0.00 39.33 39.94 2dmu h ASP 16 CO 0.62 -0.37 -0.48 -0.08 -2.04 0.00 0.00 179.24 176.89 2dmu h GLU 17 N -0.39 -0.48 -0.52 4.15 4.81 -1.99 0.10 114.58 120.27 2dmu h GLU 17 Ca 0.11 0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.47 2dmu h GLU 17 Cb 0.57 0.11 -0.11 0.00 0.63 0.00 0.00 28.75 29.95 2dmu h GLU 17 CO -0.42 -0.32 -0.28 1.96 -0.73 0.00 0.00 179.01 179.22 2dmu h GLN 18 N -0.50 -0.15 -0.78 1.92 4.20 -1.76 0.60 115.11 118.64 2dmu h GLN 18 Ca 0.07 0.01 0.06 0.00 0.06 0.00 0.00 58.65 58.85 2dmu h GLN 18 Cb 0.64 0.03 -0.06 0.00 0.30 0.00 0.00 27.48 28.40 2dmu h GLN 18 CO -0.46 -0.10 0.47 -0.07 -0.67 0.00 0.00 178.83 178.00 2dmu h LEU 19 N -0.15 0.71 0.50 1.46 3.38 -0.45 -0.35 115.31 120.41 2dmu h LEU 19 Ca 0.23 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.21 2dmu h LEU 19 Cb 0.52 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 2dmu h LEU 19 CO -0.61 0.45 -0.44 -0.08 0.09 0.00 0.00 178.44 177.86 2dmu h GLU 20 N 0.84 -0.90 0.33 1.13 4.81 0.14 0.21 114.58 121.14 2dmu h GLU 20 Ca 0.35 0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.64 2dmu h GLU 20 Cb 0.20 0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 2dmu h GLU 20 CO -0.18 -0.60 -0.31 0.00 -0.73 0.00 0.00 179.01 177.19 2dmu h ALA 21 N -0.67 -0.67 -0.55 2.92 0.00 -0.97 0.43 119.26 119.74 2dmu h ALA 21 Ca -0.05 -0.11 0.11 0.00 0.00 0.00 0.00 54.91 54.86 2dmu h ALA 21 Cb 0.80 0.44 -0.09 0.00 0.00 0.00 0.00 17.79 18.94 2dmu h ALA 21 CO -0.03 -0.91 0.01 -0.07 0.00 0.00 0.00 179.25 178.25 2dmu h LEU 22 N -0.67 -0.22 -0.90 0.00 3.38 -1.00 0.20 115.31 116.11 2dmu h LEU 22 Ca -0.02 0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 2dmu h LEU 22 Cb 0.60 0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 2dmu h LEU 22 CO -0.05 -0.08 -0.20 -0.33 0.09 0.00 0.00 178.44 177.87 2dmu h GLU 23 N 0.13 0.58 -0.56 1.13 5.08 -0.28 0.21 114.58 120.86 2dmu h GLU 23 Ca 0.28 -0.21 -0.09 0.00 -1.00 0.00 0.00 59.36 58.35 2dmu h GLU 23 Cb 0.44 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 2dmu h GLU 23 CO -0.46 0.75 -0.00 -0.91 -1.00 0.00 0.00 179.01 177.39 2dmu h ASN 24 N 0.52 0.95 0.02 1.42 2.35 0.18 -0.08 115.58 120.93 2dmu h ASN 24 Ca 0.08 -0.26 -0.03 0.00 -0.55 0.00 0.00 56.30 55.54 2dmu h ASN 24 Cb 0.64 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.76 2dmu h ASN 24 CO 0.05 1.00 -0.13 0.25 -1.65 0.00 0.00 177.43 176.95 2dmu h LEU 25 N 0.90 0.08 -1.49 1.61 5.85 -0.49 -3.11 115.31 118.65 2dmu h LEU 25 Ca 0.16 -0.98 0.04 0.00 0.84 0.00 0.00 57.88 57.95 2dmu h LEU 25 Cb 0.53 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 2dmu h LEU 25 CO 0.03 1.05 0.40 0.15 -0.34 0.00 0.00 178.44 179.72 2dmu h PHE 26 N -0.88 0.64 -0.02 1.25 3.57 -0.61 0.14 116.94 121.03 2dmu h PHE 26 Ca -0.02 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 2dmu h PHE 26 Cb 1.09 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.62 2dmu h PHE 26 CO 0.26 0.36 0.00 1.96 -2.23 0.00 0.00 178.31 178.67 2dmu h GLN 27 N 0.65 0.03 -0.36 1.11 1.08 -1.10 -3.10 115.11 113.43 2dmu h GLN 27 Ca 0.25 -0.01 -0.11 0.00 -1.45 0.00 0.00 58.65 57.33 2dmu h GLN 27 Cb 0.16 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 2dmu h GLN 27 CO -0.07 0.26 -0.24 1.05 -0.95 0.00 0.00 178.83 178.89 2dmu h GLU 28 N -0.20 0.72 -3.71 1.46 4.11 -1.37 -3.44 114.58 112.15 2dmu h GLU 28 Ca 0.01 -0.29 -0.24 0.00 0.07 0.00 0.00 59.36 58.91 2dmu h GLU 28 Cb 0.25 -0.03 -0.29 0.00 0.50 0.00 0.00 28.75 29.18 2dmu h GLU 28 CO 0.00 0.89 -0.72 -0.08 0.07 0.00 0.00 179.01 179.17 2dmu s THR 29 N -4.57 -0.01 0.12 -1.06 -1.32 0.45 -5.05 115.64 104.20 2dmu s THR 29 Ca -0.09 0.02 -0.11 0.00 -1.21 0.00 0.00 61.69 60.30 2dmu s THR 29 Cb 0.13 -0.02 -0.14 0.00 -1.51 0.00 0.00 72.50 70.96 2dmu s THR 29 CO 0.83 0.01 1.34 0.11 -2.21 0.00 0.00 174.62 174.69 2dmu h LYS 30 N 6.26 0.77 -3.25 7.08 1.57 -1.82 -3.29 116.57 123.88 2dmu h LYS 30 Ca -0.26 -0.60 -0.55 0.00 -1.87 0.00 0.00 60.65 57.37 2dmu h LYS 30 Cb 1.20 0.12 -0.40 0.00 0.08 0.00 0.00 32.23 33.23 2dmu h LYS 30 CO 0.51 1.22 -0.77 0.71 -0.57 0.00 0.00 179.45 180.55 2dmu s TYR 31 N -3.80 1.03 1.07 -1.35 1.51 -1.26 -4.94 117.35 109.60 2dmu s TYR 31 Ca -0.10 -1.23 -0.14 0.00 -1.01 0.00 0.00 57.07 54.59 2dmu s TYR 31 Cb 0.09 -1.27 0.22 0.00 -0.11 0.00 0.00 41.96 40.90 2dmu s TYR 31 CO 0.90 -0.80 1.10 -1.25 -1.11 0.00 0.00 175.55 174.38 2dmu s PRO 32 N 1.85 -0.13 0.36 -1.71 0.04 -1.26 -5.05 135.00 129.10 2dmu s PRO 32 Ca 0.07 0.33 -0.03 0.00 0.04 0.00 0.00 61.00 61.42 2dmu s PRO 32 Cb -0.17 -1.69 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 2dmu s PRO 32 CO -0.26 -3.06 0.60 -0.51 0.04 0.00 0.00 177.00 173.81 2dmu s ASP 33 N -3.57 6.34 0.30 6.66 1.01 -1.26 -4.90 116.67 121.25 2dmu s ASP 33 Ca 0.67 0.64 0.06 0.00 0.71 0.00 0.00 52.55 54.64 2dmu s ASP 33 Cb -0.16 -2.12 0.79 0.00 1.01 0.00 0.00 42.92 42.44 2dmu s ASP 33 CO 0.57 -0.32 1.73 1.62 0.21 0.00 0.00 175.17 178.98 2dmu h VAL 34 N 0.84 0.56 -0.84 -1.27 3.04 -1.99 0.10 116.25 116.70 2dmu h VAL 34 Ca -0.48 -0.19 0.00 0.00 -1.01 0.00 0.00 66.70 65.02 2dmu h VAL 34 Cb 1.21 -0.05 -0.04 0.00 -2.01 0.00 0.00 31.29 30.40 2dmu h VAL 34 CO 0.63 0.10 0.53 1.23 -1.01 0.00 0.00 177.57 179.05 2dmu h GLY 35 N 0.56 1.19 0.97 3.17 0.00 -2.00 -0.97 103.07 105.99 2dmu h GLY 35 Ca 0.59 -0.47 -0.13 0.00 0.00 0.00 0.00 47.33 47.33 2dmu h GLY 35 CO -0.47 0.46 -0.34 -0.84 0.00 0.00 0.00 176.54 175.35 2dmu h THR 36 N 1.14 1.31 -0.25 4.70 2.02 -1.25 -2.55 112.91 118.03 2dmu h THR 36 Ca 0.30 -1.53 0.00 0.00 0.77 0.00 0.00 66.41 65.96 2dmu h THR 36 Cb -0.10 1.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 2dmu h THR 36 CO -0.06 0.48 0.16 0.03 0.37 0.00 0.00 175.52 176.51 2dmu h ARG 37 N 0.41 0.33 0.34 6.66 3.08 -0.91 0.25 114.38 124.54 2dmu h ARG 37 Ca 0.03 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 2dmu h ARG 37 Cb 0.92 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.90 2dmu h ARG 37 CO 0.08 0.22 -0.21 0.93 -1.07 0.00 0.00 179.97 179.92 2dmu h GLU 38 N 0.33 -0.51 0.86 0.04 5.08 -1.20 0.54 114.58 119.71 2dmu h GLU 38 Ca 0.09 0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 2dmu h GLU 38 Cb -0.03 0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.34 2dmu h GLU 38 CO -0.02 -0.34 -0.41 1.96 -1.00 0.00 0.00 179.01 179.19 2dmu h GLN 39 N -0.53 -1.12 -0.69 2.33 1.08 -1.35 -2.86 115.11 111.97 2dmu h GLN 39 Ca -0.04 0.08 0.15 0.00 -1.45 0.00 0.00 58.65 57.39 2dmu h GLN 39 Cb 0.44 0.25 -0.11 0.00 -0.05 0.00 0.00 27.48 28.01 2dmu h GLN 39 CO 0.03 -0.74 0.04 1.25 -0.95 0.00 0.00 178.83 178.46 2dmu h LEU 40 N -1.17 -0.25 -0.17 1.46 5.85 -0.51 -1.13 115.31 119.40 2dmu h LEU 40 Ca -0.12 0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.79 2dmu h LEU 40 Cb 0.89 0.28 -0.05 0.00 0.37 0.00 0.00 40.66 42.16 2dmu h LEU 40 CO 0.19 -0.12 -0.35 0.00 -0.34 0.00 0.00 178.44 177.82 2dmu h ALA 41 N 1.62 -0.67 -0.80 1.25 0.00 -0.74 0.30 119.26 120.22 2dmu h ALA 41 Ca 0.37 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.40 2dmu h ALA 41 Cb 0.63 0.91 -0.06 0.00 0.00 0.00 0.00 17.79 19.27 2dmu h ALA 41 CO -0.57 -0.81 0.52 0.00 0.00 0.00 0.00 179.25 178.39 2dmu h ARG 42 N -0.31 0.52 -0.65 0.00 2.47 -1.19 0.35 114.38 115.57 2dmu h ARG 42 Ca 0.03 -0.03 -0.07 0.00 -1.26 0.00 0.00 59.98 58.65 2dmu h ARG 42 Cb 0.40 -0.12 -0.03 0.00 -1.65 0.00 0.00 29.97 28.58 2dmu h ARG 42 CO -0.33 0.35 0.15 -0.22 0.56 0.00 0.00 179.97 180.48 2dmu h LYS 43 N 0.54 1.05 -0.48 0.04 1.63 0.23 -2.47 116.57 117.10 2dmu h LYS 43 Ca 0.39 -0.26 0.00 0.00 -0.85 0.00 0.00 60.65 59.93 2dmu h LYS 43 Cb 0.75 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 32.25 2dmu h LYS 43 CO -0.15 0.95 0.00 1.33 -3.45 0.00 0.00 179.45 178.13 2dmu n VAL 44 N -4.29 0.64 -3.59 2.00 0.24 0.85 -4.94 118.33 109.24 2dmu n VAL 44 Ca 0.04 -0.68 -0.21 0.00 -2.04 0.00 0.00 64.34 61.45 2dmu n VAL 44 Cb 0.26 0.43 0.06 0.00 -1.47 0.00 0.00 33.84 33.12 2dmu n VAL 44 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2dmu n HIS 45 N 1.04 -2.22 -4.40 6.34 8.25 0.92 -4.79 115.22 120.37 2dmu n HIS 45 Ca 0.18 0.92 -0.22 0.00 -0.26 0.00 0.00 57.72 58.34 2dmu n HIS 45 Cb 0.46 -4.74 -0.08 0.00 1.12 0.00 0.00 29.99 26.74 2dmu n HIS 45 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2dmu s LEU 46 N -6.70 1.83 -0.14 2.41 1.43 0.47 -4.99 118.68 112.99 2dmu s LEU 46 Ca 0.16 -1.65 -0.06 0.00 -1.03 0.00 0.00 54.13 51.54 2dmu s LEU 46 Cb -0.07 0.15 -0.04 0.00 0.03 0.00 0.00 46.19 46.26 2dmu s LEU 46 CO 0.77 -0.95 0.08 -0.13 0.23 0.00 0.00 176.35 176.35 2dmu s ARG 47 N -3.68 3.55 0.32 1.70 0.52 -1.26 -3.90 118.95 116.20 2dmu s ARG 47 Ca 0.32 -0.27 0.07 0.00 -0.52 0.00 0.00 55.73 55.33 2dmu s ARG 47 Cb 0.03 -3.12 0.92 0.00 0.52 0.00 0.00 34.95 33.31 2dmu s ARG 47 CO 0.19 0.57 1.59 0.93 0.02 0.00 0.00 175.30 178.59 2dmu h GLU 48 N 5.69 0.04 -0.71 3.54 3.07 -1.91 0.88 114.58 125.17 2dmu h GLU 48 Ca -0.47 -0.00 0.07 0.00 -0.50 0.00 0.00 59.36 58.46 2dmu h GLU 48 Cb 1.19 -0.01 -0.06 0.00 -0.84 0.00 0.00 28.75 29.03 2dmu h GLU 48 CO 0.62 0.02 0.39 1.05 -1.40 0.00 0.00 179.01 179.70 2dmu h GLU 49 N 0.04 0.67 -0.24 2.33 4.11 -1.95 -2.26 114.58 117.27 2dmu h GLU 49 Ca 0.67 -0.04 -0.01 0.00 0.07 0.00 0.00 59.36 60.04 2dmu h GLU 49 Cb 1.51 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.60 2dmu h GLU 49 CO -0.84 0.44 0.11 0.87 0.07 0.00 0.00 179.01 179.66 2dmu h LYS 50 N 0.69 0.36 -0.74 1.06 1.79 0.36 -2.76 116.57 117.33 2dmu h LYS 50 Ca 0.33 -0.06 0.17 0.00 -2.18 0.00 0.00 60.65 58.91 2dmu h LYS 50 Cb 0.26 -0.06 -0.12 0.00 -1.58 0.00 0.00 32.23 30.73 2dmu h LYS 50 CO -0.21 0.37 0.11 0.28 -1.08 0.00 0.00 179.45 178.92 2dmu h VAL 51 N 0.26 0.44 -0.28 0.50 2.07 -0.79 -0.22 116.25 118.23 2dmu h VAL 51 Ca 0.08 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 2dmu h VAL 51 Cb 0.14 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 2dmu h VAL 51 CO -0.01 0.03 0.16 -0.08 0.02 0.00 0.00 177.57 177.70 2dmu h GLU 52 N 0.19 0.39 -0.11 1.57 4.81 -1.29 -2.65 114.58 117.49 2dmu h GLU 52 Ca 0.42 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.63 2dmu h GLU 52 Cb 0.73 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.99 2dmu h GLU 52 CO -0.57 0.32 -0.41 0.28 -0.73 0.00 0.00 179.01 177.89 2dmu h VAL 53 N 0.35 0.00 -0.21 0.32 2.07 -0.77 -0.30 116.25 117.71 2dmu h VAL 53 Ca 0.10 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.66 2dmu h VAL 53 Cb 0.04 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.74 2dmu h VAL 53 CO -0.02 0.00 -0.50 -0.25 0.02 0.00 0.00 177.57 176.82 2dmu h TRP 54 N -0.44 -1.47 -0.82 1.57 7.01 -1.41 0.18 115.95 120.57 2dmu h TRP 54 Ca 0.03 0.06 0.20 0.00 2.11 0.00 0.00 58.89 61.28 2dmu h TRP 54 Cb 0.51 0.67 -0.14 0.00 -2.10 0.00 0.00 29.16 28.10 2dmu h TRP 54 CO -0.56 -0.51 0.05 0.74 -2.79 0.00 0.00 178.44 175.37 2dmu h PHE 55 N -0.50 0.02 -0.41 2.65 -1.00 -1.11 0.24 116.94 116.82 2dmu h PHE 55 Ca 0.06 0.06 -0.05 0.00 2.81 0.00 0.00 57.97 60.86 2dmu h PHE 55 Cb 0.65 0.12 -0.02 0.00 3.61 0.00 0.00 35.95 40.31 2dmu h PHE 55 CO -0.58 -0.26 0.08 0.87 -1.61 0.00 0.00 178.31 176.80 2dmu h LYS 56 N 0.11 0.68 0.34 1.51 1.57 0.32 -2.35 116.57 118.75 2dmu h LYS 56 Ca 0.47 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 59.07 2dmu h LYS 56 Cb 0.87 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 2dmu h LYS 56 CO -0.71 0.71 -0.24 -0.91 -0.57 0.00 0.00 179.45 177.73 2dmu h ASN 57 N 0.53 -0.61 -0.00 0.86 2.35 0.22 -2.78 115.58 116.16 2dmu h ASN 57 Ca 0.13 0.04 0.03 0.00 -0.55 0.00 0.00 56.30 55.95 2dmu h ASN 57 Cb 0.35 0.19 -0.05 0.00 0.05 0.00 0.00 38.32 38.85 2dmu h ASN 57 CO 0.01 -0.37 -0.39 0.03 -1.65 0.00 0.00 177.43 175.06 2dmu h ARG 58 N -0.57 -0.52 -0.95 0.81 2.47 -0.78 -1.70 114.38 113.13 2dmu h ARG 58 Ca -0.03 0.04 0.27 0.00 -1.26 0.00 0.00 59.98 58.99 2dmu h ARG 58 Cb 0.49 0.12 -0.17 0.00 -1.65 0.00 0.00 29.97 28.75 2dmu h ARG 58 CO 0.01 -0.35 0.10 0.00 0.56 0.00 0.00 179.97 180.29 2dmu h ARG 59 N -0.54 0.05 -1.00 0.04 3.08 -1.33 0.55 114.38 115.22 2dmu h ARG 59 Ca 0.05 -0.00 0.37 0.00 0.07 0.00 0.00 59.98 60.47 2dmu h ARG 59 Cb 0.63 -0.01 -0.17 0.00 0.08 0.00 0.00 29.97 30.50 2dmu h ARG 59 CO -0.30 0.03 0.51 0.00 -1.07 0.00 0.00 179.97 179.13 2dmu h ALA 60 N 1.93 2.00 0.04 0.04 0.00 -1.02 0.23 119.26 122.48 2dmu h ALA 60 Ca 0.60 0.25 -0.06 0.00 0.00 0.00 0.00 54.91 55.69 2dmu h ALA 60 Cb 1.25 0.29 0.01 0.00 0.00 0.00 0.00 17.79 19.33 2dmu h ALA 60 CO -0.84 -0.78 -0.25 -0.22 0.00 0.00 0.00 179.25 177.15 2dmu h LYS 61 N 0.12 0.10 -0.65 0.00 3.64 0.01 -2.66 116.57 117.13 2dmu h LYS 61 Ca 0.78 -0.16 0.13 0.00 -1.27 0.00 0.00 60.65 60.13 2dmu h LYS 61 Cb 1.95 0.06 -0.10 0.00 -0.41 0.00 0.00 32.23 33.73 2dmu h LYS 61 CO -0.72 1.05 0.12 2.35 -2.27 0.00 0.00 179.45 179.97 2dmu h TRP 62 N -0.76 0.17 -0.38 1.91 7.01 -0.39 -0.48 115.95 123.03 2dmu h TRP 62 Ca -0.04 0.04 -0.13 0.00 2.11 0.00 0.00 58.89 60.86 2dmu h TRP 62 Cb 1.17 0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 28.24 2dmu h TRP 62 CO 0.24 -0.08 -0.29 0.07 -2.79 0.00 0.00 178.44 175.59 2dmu h ARG 63 N 0.23 0.87 -0.64 2.65 0.11 -0.80 -3.14 114.38 113.66 2dmu h ARG 63 Ca 0.35 -0.42 0.09 0.00 0.10 0.00 0.00 59.98 60.09 2dmu h ARG 63 Cb 0.56 -0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.57 2dmu h ARG 63 CO -0.47 1.07 0.29 -0.09 0.10 0.00 0.00 179.97 180.87 2dmu h ARG 64 N 0.68 0.49 -6.80 0.08 2.43 -0.80 -3.41 114.38 107.05 2dmu h ARG 64 Ca 0.07 -0.03 -0.54 0.00 -0.81 0.00 0.00 59.98 58.67 2dmu h ARG 64 Cb 0.87 -0.11 0.09 0.00 -0.42 0.00 0.00 29.97 30.39 2dmu h ARG 64 CO 0.08 0.33 0.82 0.45 -1.51 0.00 0.00 179.97 180.14 2dmu n SER 65 N -4.92 3.70 0.00 -3.80 2.88 -0.33 -4.98 113.62 106.17 2dmu n SER 65 Ca 0.09 1.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.79 2dmu n SER 65 Cb 0.25 -1.58 0.00 0.00 -0.75 0.00 0.00 64.21 62.13 2dmu n SER 65 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dmu n GLY 66 N 1.82 5.44 0.00 0.46 0.00 -1.26 -4.99 105.19 106.66 2dmu n GLY 66 Ca 0.07 -1.20 0.06 0.00 0.00 0.00 0.00 46.02 44.96 2dmu n GLY 66 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dmu n PRO 67 N 0.00 0.49 -2.29 1.61 -0.04 -1.26 -4.70 135.00 128.81 2dmu n PRO 67 Ca 0.00 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.04 2dmu n PRO 67 Cb 0.00 -1.42 -0.02 0.00 -0.04 0.00 0.00 33.50 32.02 2dmu n PRO 67 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dmu s SER 68 N -1.92 6.14 0.32 3.54 1.04 -1.26 -4.97 113.70 116.59 2dmu s SER 68 Ca 0.19 0.72 -0.29 0.00 0.48 0.00 0.00 55.95 57.05 2dmu s SER 68 Cb 0.09 -2.54 -0.10 0.00 0.10 0.00 0.00 66.02 63.57 2dmu s SER 68 CO 0.15 -1.62 1.39 -0.55 0.98 0.00 0.00 173.24 173.60 2dmu s SER 69 N 4.68 6.62 0.00 7.02 0.15 -1.26 -5.12 113.70 125.78 2dmu s SER 69 Ca 0.62 2.79 0.00 0.00 0.70 0.00 0.00 55.95 60.06 2dmu s SER 69 Cb -0.14 -2.65 0.00 0.00 -1.71 0.00 0.00 66.02 61.52 2dmu s SER 69 CO 0.30 -0.68 0.00 0.61 1.20 0.00 0.00 173.24 174.67