#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sfc n GLU 13 N 0.00 0.00 -1.03 5.31 0.00 -1.26 -4.30 120.64 119.36 1sfc n GLU 13 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 57.16 57.13 1sfc n GLU 13 Cb 0.00 -2.41 0.15 0.00 0.00 0.00 0.00 31.44 29.18 1sfc n GLU 13 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.13 177.01 1sfc n MET 14 N -1.66 2.16 0.00 5.31 1.56 -1.26 -3.93 117.12 119.30 1sfc n MET 14 Ca 0.00 -3.54 0.00 0.00 -0.27 0.00 0.00 57.70 53.89 1sfc n MET 14 Cb 0.00 -1.79 0.00 0.00 2.15 0.00 0.00 33.22 33.58 1sfc n MET 14 CO 0.00 0.00 0.00 1.04 -0.73 0.00 0.00 175.97 176.28 1sfc n GLN 15 N -0.98 0.00 0.00 2.12 6.02 -1.26 -4.70 117.38 118.58 1sfc n GLN 15 Ca 0.26 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.33 1sfc n GLN 15 Cb 0.78 -0.31 0.34 0.00 1.02 0.00 0.00 30.24 32.07 1sfc n GLN 15 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1sfc n ARG 16 N -1.31 0.03 0.03 -1.09 5.12 -1.26 -1.80 116.66 116.37 1sfc n ARG 16 Ca 0.00 0.22 -0.17 0.00 -1.93 0.00 0.00 57.85 55.97 1sfc n ARG 16 Cb 0.00 -1.50 -0.14 0.00 -1.16 0.00 0.00 32.46 29.66 1sfc n ARG 16 CO 0.00 0.00 0.00 -0.09 -1.93 0.00 0.00 177.63 175.61 1sfc h ARG 17 N 0.00 0.22 0.00 5.56 9.65 -1.84 -2.59 114.38 125.38 1sfc h ARG 17 Ca 0.00 -0.37 0.00 0.00 -1.10 0.00 0.00 59.98 58.51 1sfc h ARG 17 Cb 0.26 0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.97 1sfc h ARG 17 CO 0.00 1.04 0.00 0.00 2.80 0.00 0.00 179.97 183.81 1sfc n ALA 18 N -2.77 1.95 -0.11 2.80 0.00 -0.75 -1.75 120.51 119.89 1sfc n ALA 18 Ca -0.22 -0.08 -0.21 0.00 0.00 0.00 0.00 53.44 52.93 1sfc n ALA 18 Cb 1.05 -1.28 -0.09 0.00 0.00 0.00 0.00 19.45 19.14 1sfc n ALA 18 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1sfc n ASP 19 N -1.25 1.86 0.13 0.00 -0.08 -1.20 -3.77 116.55 112.23 1sfc n ASP 19 Ca 0.09 0.14 0.10 0.00 -1.51 0.00 0.00 54.79 53.61 1sfc n ASP 19 Cb 0.13 -0.54 0.60 0.00 2.34 0.00 0.00 41.12 43.64 1sfc n ASP 19 CO 0.00 0.00 0.00 -0.61 0.12 0.00 0.00 177.20 176.71 1sfc h GLN 20 N -0.52 0.13 0.00 -0.67 4.15 -1.24 0.40 115.11 117.36 1sfc h GLN 20 Ca -0.53 -0.01 -0.17 0.00 0.77 0.00 0.00 58.65 58.71 1sfc h GLN 20 Cb 1.58 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 29.21 1sfc h GLN 20 CO -0.25 0.08 -0.97 -0.07 -1.93 0.00 0.00 178.83 175.69 1sfc h LEU 21 N 0.13 0.00 -0.92 -2.39 3.38 -1.56 -2.90 115.31 111.06 1sfc h LEU 21 Ca 0.10 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 1sfc h LEU 21 Cb 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1sfc h LEU 21 CO -0.01 0.70 -0.42 0.00 0.09 0.00 0.00 178.44 178.81 1sfc h ALA 22 N 1.30 1.00 0.02 1.53 0.00 -1.09 -1.56 119.26 120.47 1sfc h ALA 22 Ca -0.07 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 1sfc h ALA 22 Cb 1.60 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.32 1sfc h ALA 22 CO 0.08 0.52 -0.01 -0.44 0.00 0.00 0.00 179.25 179.40 1sfc h ASP 23 N 0.00 -0.03 -0.61 0.00 3.32 -1.09 -2.67 116.42 115.35 1sfc h ASP 23 Ca -0.00 -0.68 0.03 0.00 0.02 0.00 0.00 57.03 56.40 1sfc h ASP 23 Cb 0.92 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 40.44 1sfc h ASP 23 CO 0.05 0.69 0.36 -0.08 -1.72 0.00 0.00 179.24 178.55 1sfc h GLU 24 N -0.78 0.68 0.26 3.56 4.57 -1.48 0.04 114.58 121.44 1sfc h GLU 24 Ca -0.00 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 1sfc h GLU 24 Cb 0.70 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 1sfc h GLU 24 CO 0.01 0.45 -0.13 0.77 -1.18 0.00 0.00 179.01 178.93 1sfc h SER 25 N 0.70 -0.30 -0.26 1.04 0.02 -1.38 0.34 113.55 113.72 1sfc h SER 25 Ca 0.25 -0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.24 1sfc h SER 25 Cb 0.06 0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.63 1sfc h SER 25 CO -0.12 -0.19 -0.01 0.25 -1.14 0.00 0.00 176.83 175.62 1sfc h LEU 26 N -0.38 -0.13 -1.92 5.07 6.46 -1.23 0.24 115.31 123.42 1sfc h LEU 26 Ca -0.04 0.06 -0.00 0.00 -0.12 0.00 0.00 57.88 57.79 1sfc h LEU 26 Cb 0.29 0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.33 1sfc h LEU 26 CO 0.06 -0.04 0.04 -0.33 -0.62 0.00 0.00 178.44 177.56 1sfc h GLU 27 N 0.06 0.10 -0.19 1.25 4.39 -0.74 -1.71 114.58 117.74 1sfc h GLU 27 Ca 0.13 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.79 1sfc h GLU 27 Cb 0.17 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.79 1sfc h GLU 27 CO -0.22 0.07 -0.00 1.03 -1.16 0.00 0.00 179.01 178.72 1sfc h SER 28 N 0.10 0.33 0.30 1.42 0.87 0.16 -1.37 113.55 115.37 1sfc h SER 28 Ca 0.03 -0.31 -0.01 0.00 -1.23 0.00 0.00 61.79 60.26 1sfc h SER 28 Cb -0.00 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 61.86 1sfc h SER 28 CO -0.01 0.56 -0.06 0.71 -0.53 0.00 0.00 176.83 177.51 1sfc h THR 29 N 0.10 0.38 0.11 2.23 1.35 -0.26 -0.15 112.91 116.66 1sfc h THR 29 Ca 0.05 -0.33 -0.18 0.00 -0.55 0.00 0.00 66.41 65.41 1sfc h THR 29 Cb 0.39 1.23 0.01 0.00 -1.73 0.00 0.00 68.15 68.06 1sfc h THR 29 CO 0.01 0.06 -0.84 0.03 -0.25 0.00 0.00 175.52 174.53 1sfc h ARG 30 N 0.00 0.24 -0.69 4.72 3.08 -1.05 -2.85 114.38 117.83 1sfc h ARG 30 Ca -0.00 -0.41 0.04 0.00 0.07 0.00 0.00 59.98 59.68 1sfc h ARG 30 Cb 0.23 0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.39 1sfc h ARG 30 CO 0.01 1.20 0.46 0.00 -1.07 0.00 0.00 179.97 180.56 1sfc h ARG 31 N -0.46 0.79 0.12 0.04 3.08 -0.84 -2.07 114.38 115.03 1sfc h ARG 31 Ca -0.16 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 59.86 1sfc h ARG 31 Cb 1.57 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 31.40 1sfc h ARG 31 CO 0.10 0.52 -0.34 0.52 -1.07 0.00 0.00 179.97 179.70 1sfc h MET 32 N 0.81 -0.55 -0.49 0.04 2.86 -1.05 0.23 114.93 116.79 1sfc h MET 32 Ca 0.28 0.04 0.08 0.00 -2.06 0.00 0.00 59.70 58.04 1sfc h MET 32 Cb 0.09 0.13 -0.07 0.00 0.06 0.00 0.00 31.60 31.81 1sfc h MET 32 CO -0.08 -0.37 0.08 1.25 1.06 0.00 0.00 176.91 178.85 1sfc h LEU 33 N -0.57 -0.03 -0.91 1.22 5.85 -1.13 0.36 115.31 120.10 1sfc h LEU 33 Ca 0.03 0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.76 1sfc h LEU 33 Cb 0.60 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 1sfc h LEU 33 CO -0.20 0.01 -0.40 0.06 -0.34 0.00 0.00 178.44 177.57 1sfc h GLN 34 N 0.21 0.00 -0.16 1.25 -0.00 -1.39 -1.83 115.11 113.20 1sfc h GLN 34 Ca 0.24 0.00 -0.14 0.00 -0.00 0.00 0.00 58.65 58.75 1sfc h GLN 34 Cb 0.33 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.80 1sfc h GLN 34 CO -0.33 0.40 -0.51 1.25 -0.00 0.00 0.00 178.83 179.64 1sfc h LEU 35 N 0.00 0.48 0.00 0.06 5.85 0.99 -3.13 115.31 119.57 1sfc h LEU 35 Ca -0.00 -0.24 -0.00 0.00 0.84 0.00 0.00 57.88 58.47 1sfc h LEU 35 Cb 0.92 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.82 1sfc h LEU 35 CO 0.05 0.90 -0.00 0.58 -0.34 0.00 0.00 178.44 179.64 1sfc h VAL 36 N 0.34 1.52 0.00 1.05 2.07 -0.05 -3.21 116.25 117.98 1sfc h VAL 36 Ca 0.01 -2.12 0.00 0.00 0.82 0.00 0.00 66.70 65.42 1sfc h VAL 36 Cb 1.01 2.87 0.00 0.00 -1.52 0.00 0.00 31.29 33.65 1sfc h VAL 36 CO 0.09 0.51 0.00 -1.84 0.02 0.00 0.00 177.57 176.35 1sfc n GLU 37 N -4.64 0.94 -0.07 1.57 0.28 -0.72 -0.79 120.64 117.21 1sfc n GLU 37 Ca -0.09 0.00 -0.07 0.00 -0.16 0.00 0.00 57.16 56.84 1sfc n GLU 37 Cb 0.40 -1.43 -0.12 0.00 1.43 0.00 0.00 31.44 31.73 1sfc n GLU 37 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1sfc n GLU 38 N -0.01 1.58 -0.03 3.44 2.13 -1.18 -3.75 120.64 122.82 1sfc n GLU 38 Ca 0.00 -0.01 -0.13 0.00 0.66 0.00 0.00 57.16 57.69 1sfc n GLU 38 Cb 0.22 -1.38 -0.09 0.00 0.27 0.00 0.00 31.44 30.46 1sfc n GLU 38 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 1sfc h SER 39 N 0.00 0.14 -0.35 4.31 0.02 -0.96 -1.47 113.55 115.23 1sfc h SER 39 Ca -0.40 -0.45 0.08 0.00 -0.84 0.00 0.00 61.79 60.18 1sfc h SER 39 Cb 1.91 -0.04 -0.08 0.00 0.14 0.00 0.00 62.40 64.33 1sfc h SER 39 CO 0.02 0.55 -0.26 0.50 -1.14 0.00 0.00 176.83 176.51 1sfc h LYS 40 N -0.28 -0.20 -0.95 3.45 3.64 -1.25 1.07 116.57 122.04 1sfc h LYS 40 Ca 0.01 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.45 1sfc h LYS 40 Cb 0.51 0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.32 1sfc h LYS 40 CO 0.01 -0.14 0.62 -0.44 -2.27 0.00 0.00 179.45 177.23 1sfc h ASP 41 N -0.21 1.01 -0.56 4.20 5.19 -1.63 -1.25 116.42 123.17 1sfc h ASP 41 Ca 0.17 -0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.54 1sfc h ASP 41 Cb 0.48 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 39.75 1sfc h ASP 41 CO -0.47 0.67 0.20 0.00 -3.12 0.00 0.00 179.24 176.52 1sfc h ALA 42 N 1.41 0.73 0.66 3.45 0.00 0.43 -1.88 119.26 124.05 1sfc h ALA 42 Ca 0.39 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1sfc h ALA 42 Cb 0.07 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1sfc h ALA 42 CO -0.14 0.36 -0.48 0.78 0.00 0.00 0.00 179.25 179.77 1sfc h GLY 43 N 0.77 -1.25 0.56 0.00 0.00 0.21 -0.67 103.07 102.69 1sfc h GLY 43 Ca 0.18 0.54 0.11 0.00 0.00 0.00 0.00 47.33 48.16 1sfc h GLY 43 CO -0.01 -0.41 0.63 0.16 0.00 0.00 0.00 176.54 176.91 1sfc h ILE 44 N -1.09 0.96 -0.55 2.60 3.07 -1.31 0.17 117.51 121.36 1sfc h ILE 44 Ca -0.08 -0.35 0.03 0.00 1.55 0.00 0.00 64.86 66.00 1sfc h ILE 44 Cb 0.90 -0.14 -0.04 0.00 -0.27 0.00 0.00 36.82 37.27 1sfc h ILE 44 CO 0.04 0.19 0.33 -0.09 -1.05 0.00 0.00 178.15 177.57 1sfc h ARG 45 N 1.02 0.64 0.64 0.16 2.43 -1.08 0.26 114.38 118.45 1sfc h ARG 45 Ca 0.47 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.57 1sfc h ARG 45 Cb 0.41 -0.14 0.01 0.00 -0.42 0.00 0.00 29.97 29.83 1sfc h ARG 45 CO -0.23 0.42 -0.31 1.15 -1.51 0.00 0.00 179.97 179.49 1sfc h THR 46 N 0.66 0.00 -1.13 0.20 2.02 0.51 -1.78 112.91 113.39 1sfc h THR 46 Ca 0.22 -0.23 0.32 0.00 0.77 0.00 0.00 66.41 67.50 1sfc h THR 46 Cb 0.02 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.33 1sfc h THR 46 CO -0.10 0.00 0.73 -0.07 0.37 0.00 0.00 175.52 176.45 1sfc h LEU 47 N -1.09 0.36 -0.07 2.58 4.07 -0.65 0.44 115.31 120.95 1sfc h LEU 47 Ca -0.09 0.10 -0.06 0.00 0.08 0.00 0.00 57.88 57.91 1sfc h LEU 47 Cb 0.66 0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.45 1sfc h LEU 47 CO 0.14 -0.01 -0.20 0.58 -1.08 0.00 0.00 178.44 177.88 1sfc h VAL 48 N 0.28 1.42 -0.41 1.22 2.07 -0.88 -1.99 116.25 117.97 1sfc h VAL 48 Ca 0.67 -1.56 0.01 0.00 0.82 0.00 0.00 66.70 66.64 1sfc h VAL 48 Cb 1.88 2.26 -0.03 0.00 -1.52 0.00 0.00 31.29 33.89 1sfc h VAL 48 CO -0.33 0.44 0.25 0.24 0.02 0.00 0.00 177.57 178.18 1sfc h MET 49 N -0.24 0.48 -0.68 1.57 2.86 0.19 -0.88 114.93 118.23 1sfc h MET 49 Ca -0.00 -0.03 0.11 0.00 -2.06 0.00 0.00 59.70 57.72 1sfc h MET 49 Cb 0.81 -0.11 -0.08 0.00 0.06 0.00 0.00 31.60 32.28 1sfc h MET 49 CO 0.04 0.32 0.27 -0.07 1.06 0.00 0.00 176.91 178.54 1sfc h LEU 50 N 0.50 0.28 0.30 1.22 4.07 -0.27 0.40 115.31 121.80 1sfc h LEU 50 Ca 0.16 0.09 -0.01 0.00 0.08 0.00 0.00 57.88 58.19 1sfc h LEU 50 Cb -0.01 0.06 0.00 0.00 1.08 0.00 0.00 40.66 41.79 1sfc h LEU 50 CO -0.07 0.15 -0.14 -0.78 -1.08 0.00 0.00 178.44 176.52 1sfc h ASP 51 N 0.45 -0.34 -0.03 -0.43 3.58 -0.50 0.12 116.42 119.27 1sfc h ASP 51 Ca 0.35 -0.04 0.01 0.00 0.42 0.00 0.00 57.03 57.78 1sfc h ASP 51 Cb 0.46 0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.60 1sfc h ASP 51 CO -0.34 -0.18 0.03 -0.08 -2.88 0.00 0.00 179.24 175.79 1sfc h GLU 52 N -0.47 0.00 0.11 0.28 4.57 -0.68 -1.55 114.58 116.84 1sfc h GLU 52 Ca -0.04 0.00 -0.27 0.00 -1.18 0.00 0.00 59.36 57.87 1sfc h GLU 52 Cb 0.35 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.95 1sfc h GLU 52 CO 0.07 0.00 -1.18 1.96 -1.18 0.00 0.00 179.01 178.67 1sfc h GLN 53 N 0.00 0.33 -0.79 1.92 4.20 -0.25 -3.16 115.11 117.36 1sfc h GLN 53 Ca 0.02 -0.50 -0.03 0.00 0.06 0.00 0.00 58.65 58.19 1sfc h GLN 53 Cb 0.08 0.18 -0.04 0.00 0.30 0.00 0.00 27.48 28.00 1sfc h GLN 53 CO -0.00 1.21 0.36 0.78 -0.67 0.00 0.00 178.83 180.51 1sfc h GLY 54 N 1.36 1.24 0.73 3.46 0.00 0.20 -0.88 103.07 109.19 1sfc h GLY 54 Ca -0.13 -0.63 0.05 0.00 0.00 0.00 0.00 47.33 46.62 1sfc h GLY 54 CO 0.20 0.60 0.34 0.83 0.00 0.00 0.00 176.54 178.50 1sfc h GLU 55 N 1.14 0.62 -0.76 4.80 5.08 -1.43 0.82 114.58 124.84 1sfc h GLU 55 Ca 0.27 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.61 1sfc h GLU 55 Cb 0.15 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 1sfc h GLU 55 CO -0.03 0.41 0.50 1.96 -1.00 0.00 0.00 179.01 180.85 1sfc h GLN 56 N 0.64 0.99 -0.41 2.33 4.20 -1.30 0.60 115.11 122.16 1sfc h GLN 56 Ca 0.27 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.88 1sfc h GLN 56 Cb 0.14 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 1sfc h GLN 56 CO -0.16 0.65 0.10 -0.07 -0.67 0.00 0.00 178.83 178.69 1sfc h LEU 57 N 1.02 0.56 -0.32 1.46 3.38 -0.14 0.26 115.31 121.53 1sfc h LEU 57 Ca 0.28 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 1sfc h LEU 57 Cb -0.10 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1sfc h LEU 57 CO -0.07 0.56 0.08 0.44 0.09 0.00 0.00 178.44 179.55 1sfc h ASP 58 N 0.60 0.49 -0.18 -0.43 3.32 0.90 0.55 116.42 121.67 1sfc h ASP 58 Ca 0.14 -0.23 -0.10 0.00 0.02 0.00 0.00 57.03 56.87 1sfc h ASP 58 Cb 0.23 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 1sfc h ASP 58 CO -0.00 0.59 -0.19 0.03 -1.72 0.00 0.00 179.24 177.94 1sfc h ARG 59 N 0.36 0.61 0.13 3.56 3.08 -0.39 0.05 114.38 121.79 1sfc h ARG 59 Ca 0.10 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 1sfc h ARG 59 Cb 0.29 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1sfc h ARG 59 CO 0.00 0.77 -0.06 0.28 -1.07 0.00 0.00 179.97 179.89 1sfc h VAL 60 N 0.55 1.00 -0.57 2.04 2.07 -0.10 0.26 116.25 121.49 1sfc h VAL 60 Ca 0.09 -0.52 0.07 0.00 0.82 0.00 0.00 66.70 67.15 1sfc h VAL 60 Cb 0.64 1.32 -0.06 0.00 -1.52 0.00 0.00 31.29 31.67 1sfc h VAL 60 CO 0.05 0.12 0.25 -0.08 0.02 0.00 0.00 177.57 177.93 1sfc h GLU 61 N -0.42 0.45 -0.58 1.57 4.81 0.32 0.34 114.58 121.07 1sfc h GLU 61 Ca -0.02 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 1sfc h GLU 61 Cb 0.34 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1sfc h GLU 61 CO 0.03 0.30 0.20 1.49 -0.73 0.00 0.00 179.01 180.30 1sfc h GLU 62 N 0.46 0.87 -0.35 1.92 4.81 -0.79 0.12 114.58 121.62 1sfc h GLU 62 Ca 0.27 -0.15 -0.03 0.00 -0.13 0.00 0.00 59.36 59.32 1sfc h GLU 62 Cb 0.26 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 1sfc h GLU 62 CO -0.23 0.73 0.09 0.78 -0.73 0.00 0.00 179.01 179.65 1sfc h GLY 63 N 0.98 0.54 0.84 1.92 0.00 0.10 0.82 103.07 108.27 1sfc h GLY 63 Ca 0.20 -0.27 -0.04 0.00 0.00 0.00 0.00 47.33 47.21 1sfc h GLY 63 CO -0.01 0.26 -0.02 1.98 0.00 0.00 0.00 176.54 178.74 1sfc h MET 64 N 0.50 0.45 -0.47 4.80 4.05 0.87 0.30 114.93 125.42 1sfc h MET 64 Ca 0.12 -0.15 -0.04 0.00 -0.28 0.00 0.00 59.70 59.35 1sfc h MET 64 Cb 0.19 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 30.93 1sfc h MET 64 CO -0.00 0.64 0.14 -0.91 0.23 0.00 0.00 176.91 177.00 1sfc h ASN 65 N 0.21 0.64 -0.50 1.39 2.35 -0.27 -1.13 115.58 118.26 1sfc h ASN 65 Ca 0.07 -0.09 -0.02 0.00 -0.55 0.00 0.00 56.30 55.71 1sfc h ASN 65 Cb 0.45 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.63 1sfc h ASN 65 CO 0.02 0.62 0.24 -0.74 -1.65 0.00 0.00 177.43 175.92 1sfc h HIS 66 N 0.68 0.71 -0.03 1.19 2.76 0.14 -2.01 115.15 118.59 1sfc h HIS 66 Ca 0.16 -0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.22 1sfc h HIS 66 Cb 0.22 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 28.94 1sfc h HIS 66 CO 0.01 0.56 -0.34 0.82 -1.30 0.00 0.00 177.93 177.68 1sfc h ILE 67 N 0.66 1.25 0.29 6.26 2.04 0.16 -2.58 117.51 125.59 1sfc h ILE 67 Ca 0.17 -1.21 -0.01 0.00 1.00 0.00 0.00 64.86 64.81 1sfc h ILE 67 Cb 0.11 1.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.80 1sfc h ILE 67 CO -0.02 0.35 -0.14 -1.13 0.00 0.00 0.00 178.15 177.21 1sfc h ASN 68 N 0.05 -0.33 1.51 1.72 -1.24 -0.50 -1.20 115.58 115.59 1sfc h ASN 68 Ca 0.00 -0.04 0.00 0.00 0.71 0.00 0.00 56.30 56.97 1sfc h ASN 68 Cb 0.62 0.08 0.00 0.00 0.73 0.00 0.00 38.32 39.76 1sfc h ASN 68 CO 0.05 -0.17 0.00 0.06 -1.29 0.00 0.00 177.43 176.08 1sfc h GLN 69 N -0.46 0.00 -0.15 6.67 3.07 -1.45 -2.83 115.11 119.97 1sfc h GLN 69 Ca -0.04 0.00 -0.22 0.00 0.09 0.00 0.00 58.65 58.48 1sfc h GLN 69 Cb 0.35 0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.92 1sfc h GLN 69 CO 0.06 0.00 -0.78 -0.44 0.09 0.00 0.00 178.83 177.76 1sfc h ASP 70 N 0.00 0.95 0.45 0.06 5.19 -1.26 -3.03 116.42 118.77 1sfc h ASP 70 Ca 0.00 -0.63 -0.06 0.00 -0.62 0.00 0.00 57.03 55.72 1sfc h ASP 70 Cb 0.75 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.97 1sfc h ASP 70 CO 0.00 1.43 -0.30 0.24 -3.12 0.00 0.00 179.24 177.49 1sfc h MET 71 N 0.53 0.00 -0.15 3.56 2.86 -0.99 -1.87 114.93 118.88 1sfc h MET 71 Ca -0.05 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1sfc h MET 71 Cb 1.41 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.05 1sfc h MET 71 CO 0.16 0.30 0.01 -0.22 1.06 0.00 0.00 176.91 178.22 1sfc h LYS 72 N 0.00 0.06 -0.61 1.72 3.64 -1.39 0.82 116.57 120.82 1sfc h LYS 72 Ca -0.00 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1sfc h LYS 72 Cb 0.60 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.38 1sfc h LYS 72 CO 0.04 0.04 0.30 0.93 -2.27 0.00 0.00 179.45 178.49 1sfc h GLU 73 N 0.07 0.86 -0.55 1.90 4.39 -1.46 -1.89 114.58 117.89 1sfc h GLU 73 Ca 0.07 -0.12 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 1sfc h GLU 73 Cb 0.08 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.54 1sfc h GLU 73 CO -0.11 0.68 0.25 0.00 -1.16 0.00 0.00 179.01 178.68 1sfc h ALA 74 N 1.13 0.72 0.00 3.43 0.00 -0.77 -0.37 119.26 123.41 1sfc h ALA 74 Ca 0.21 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.01 1sfc h ALA 74 Cb 0.10 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 1sfc h ALA 74 CO -0.03 0.29 -0.25 0.93 0.00 0.00 0.00 179.25 180.19 1sfc h GLU 75 N 0.75 -0.38 0.00 0.00 5.08 0.10 0.11 114.58 120.25 1sfc h GLU 75 Ca 0.19 0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.49 1sfc h GLU 75 Cb 0.14 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1sfc h GLU 75 CO -0.02 -0.25 -0.40 1.57 -1.00 0.00 0.00 179.01 178.90 1sfc h LYS 76 N -0.39 0.00 -0.37 2.33 2.10 -1.22 -2.79 116.57 116.24 1sfc h LYS 76 Ca 0.06 0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.57 1sfc h LYS 76 Cb 0.47 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.79 1sfc h LYS 76 CO -0.22 0.40 -0.31 -0.91 -2.00 0.00 0.00 179.45 176.42 1sfc h ASN 77 N 0.00 0.90 0.04 7.07 2.35 -0.71 -1.13 115.58 124.11 1sfc h ASN 77 Ca -0.00 -0.45 -0.00 0.00 -0.55 0.00 0.00 56.30 55.29 1sfc h ASN 77 Cb 0.98 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 39.10 1sfc h ASN 77 CO 0.05 1.17 -0.00 -0.07 -1.65 0.00 0.00 177.43 176.93 1sfc h LEU 78 N 0.65 0.00 0.17 1.61 3.38 -0.53 -1.39 115.31 119.21 1sfc h LEU 78 Ca 0.07 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.69 1sfc h LEU 78 Cb 0.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1sfc h LEU 78 CO 0.08 0.00 -1.76 0.11 0.09 0.00 0.00 178.44 176.96 1sfc h LYS 79 N 0.00 0.35 -0.32 1.13 1.57 -1.14 -3.33 116.57 114.84 1sfc h LYS 79 Ca -0.00 -0.61 0.07 0.00 -1.87 0.00 0.00 60.65 58.25 1sfc h LYS 79 Cb 0.02 0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1sfc h LYS 79 CO 0.00 1.27 0.22 -0.44 -0.57 0.00 0.00 179.45 179.93 1sfc h ASP 80 N 0.10 0.09 0.36 0.86 5.19 -0.11 0.87 116.42 123.77 1sfc h ASP 80 Ca -0.34 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.01 1sfc h ASP 80 Cb 2.08 -0.02 -0.01 0.00 0.18 0.00 0.00 39.33 41.56 1sfc h ASP 80 CO 0.16 0.06 -0.27 -0.07 -3.12 0.00 0.00 179.24 176.00 1sfc h LEU 81 N 0.10 0.00 -4.20 1.55 3.38 -1.58 -2.94 115.31 111.63 1sfc h LEU 81 Ca 0.15 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.82 1sfc h LEU 81 Cb 0.45 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.11 1sfc h LEU 81 CO -0.02 0.27 0.04 0.61 0.09 0.00 0.00 178.44 179.44 1sfc n GLY 82 N -0.60 3.41 2.50 0.83 0.00 0.30 -5.15 105.19 106.48 1sfc n GLY 82 Ca -0.02 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.61 1sfc n GLY 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60