#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d5d h LYS 2 N 0.00 0.00 0.38 2.12 6.56 -2.06 -2.63 116.57 120.94 3d5d h LYS 2 Ca 0.00 0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.57 3d5d h LYS 2 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 3d5d h LYS 2 CO 0.00 0.00 -0.18 1.25 -2.06 0.00 0.00 179.45 178.46 3d5d h LEU 3 N 0.00 -0.43 -1.55 2.94 6.46 -2.04 -0.75 115.31 119.94 3d5d h LEU 3 Ca 0.00 0.01 0.28 0.00 -0.12 0.00 0.00 57.88 58.06 3d5d h LEU 3 Cb 0.49 0.11 -0.08 0.00 -0.73 0.00 0.00 40.66 40.45 3d5d h LEU 3 CO 0.00 -0.26 0.70 0.28 -0.62 0.00 0.00 178.44 178.54 3d5d h SER 4 N -0.60 0.32 0.00 1.25 0.02 -1.92 -0.33 113.55 112.29 3d5d h SER 4 Ca -0.05 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 3d5d h SER 4 Cb 0.39 0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.94 3d5d h SER 4 CO 0.09 0.06 0.00 -0.62 -1.14 0.00 0.00 176.83 175.22 3d5d n GLU 5 N -4.50 0.00 -0.16 3.45 1.02 -1.14 -3.57 120.64 115.74 3d5d n GLU 5 Ca 0.25 0.47 0.07 0.00 -0.02 0.00 0.00 57.16 57.93 3d5d n GLU 5 Cb 0.96 -1.45 0.37 0.00 -0.02 0.00 0.00 31.44 31.30 3d5d n GLU 5 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3d5d h VAL 6 N 0.00 1.02 0.07 2.62 2.07 -0.38 -3.11 116.25 118.54 3d5d h VAL 6 Ca 0.00 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.28 3d5d h VAL 6 Cb 0.00 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 3d5d h VAL 6 CO 0.00 0.13 -0.21 -0.09 0.02 0.00 0.00 177.57 177.42 3d5d h ARG 7 N 0.71 -0.30 -1.03 1.57 9.65 -1.18 -0.55 114.38 123.25 3d5d h ARG 7 Ca 0.29 0.02 0.29 0.00 -1.10 0.00 0.00 59.98 59.49 3d5d h ARG 7 Cb 0.25 0.07 -0.05 0.00 -1.39 0.00 0.00 29.97 28.85 3d5d h ARG 7 CO -0.09 -0.20 0.73 0.87 2.80 0.00 0.00 179.97 184.08 3d5d h LYS 8 N -0.31 0.06 0.00 0.20 1.57 -1.59 0.45 116.57 116.94 3d5d h LYS 8 Ca -0.01 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 3d5d h LYS 8 Cb 0.30 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.60 3d5d h LYS 8 CO -0.10 0.04 -0.05 1.96 -0.57 0.00 0.00 179.45 180.73 3d5d h GLN 9 N 0.06 0.00 0.07 3.15 4.20 -1.04 -0.33 115.11 121.22 3d5d h GLN 9 Ca 0.50 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.88 3d5d h GLN 9 Cb 1.89 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.64 3d5d h GLN 9 CO -0.04 0.05 -1.80 1.28 -0.67 0.00 0.00 178.83 177.65 3d5d n LEU 10 N -3.51 2.37 0.29 1.46 4.77 0.16 0.03 117.00 122.57 3d5d n LEU 10 Ca -0.02 0.27 0.17 0.00 -0.03 0.00 0.00 56.01 56.40 3d5d n LEU 10 Cb 0.17 -1.05 0.88 0.00 -2.33 0.00 0.00 43.42 41.09 3d5d n LEU 10 CO 0.27 0.66 1.05 -0.33 -1.33 0.00 0.00 177.39 177.71 3d5d h GLU 11 N -0.33 0.00 0.01 3.23 3.07 -1.54 0.27 114.58 119.29 3d5d h GLU 11 Ca -0.42 0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 58.25 3d5d h GLU 11 Cb 1.77 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.66 3d5d h GLU 11 CO -0.04 0.05 -0.91 1.49 -1.40 0.00 0.00 179.01 178.20 3d5d h GLU 12 N 0.00 0.03 -0.34 2.33 4.81 -1.01 -3.08 114.58 117.32 3d5d h GLU 12 Ca -0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 3d5d h GLU 12 Cb 0.25 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.65 3d5d h GLU 12 CO 0.01 0.92 0.00 0.00 -0.73 0.00 0.00 179.01 179.20 3d5d n ALA 13 N -2.39 1.98 -1.17 2.92 0.00 0.10 -3.75 120.51 118.22 3d5d n ALA 13 Ca -0.01 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.20 3d5d n ALA 13 Cb 0.86 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 19.31 3d5d n ALA 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3d5d n ARG 14 N -0.11 2.12 0.02 0.00 1.74 -1.15 -1.66 116.66 117.63 3d5d n ARG 14 Ca 0.00 -2.06 -0.22 0.00 -0.77 0.00 0.00 57.85 54.81 3d5d n ARG 14 Cb 0.08 -1.88 -0.14 0.00 -1.02 0.00 0.00 32.46 29.50 3d5d n ARG 14 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 3d5d h LYS 15 N 2.09 0.28 0.00 5.56 1.79 -1.88 -3.38 116.57 121.03 3d5d h LYS 15 Ca 0.36 -0.48 0.00 0.00 -2.18 0.00 0.00 60.65 58.36 3d5d h LYS 15 Cb 0.81 0.18 0.00 0.00 -1.58 0.00 0.00 32.23 31.64 3d5d h LYS 15 CO 0.90 1.23 -0.03 1.28 -1.08 0.00 0.00 179.45 181.75 3d5d n LEU 16 N -3.85 1.29 0.00 2.94 7.99 -1.26 -5.03 117.00 119.08 3d5d n LEU 16 Ca -0.25 -1.41 0.00 0.00 -0.01 0.00 0.00 56.01 54.35 3d5d n LEU 16 Cb 0.94 -0.04 0.00 0.00 -0.11 0.00 0.00 43.42 44.21 3d5d n LEU 16 CO 0.43 0.35 0.00 -0.24 -1.51 0.00 0.00 177.39 176.42 3d5d n SER 17 N -0.40 0.00 0.22 -1.43 2.88 -0.67 0.75 113.62 114.97 3d5d n SER 17 Ca 0.01 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.63 3d5d n SER 17 Cb 0.39 0.00 0.49 0.00 -0.75 0.00 0.00 64.21 64.34 3d5d n SER 17 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3d5d h PRO 18 N 0.00 0.00 -0.07 -1.46 0.13 -1.90 1.94 132.00 130.64 3d5d h PRO 18 Ca 0.00 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.09 3d5d h PRO 18 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 3d5d h PRO 18 CO 0.00 0.27 -0.10 0.28 -0.23 0.00 0.00 178.00 178.22 3d5d h VAL 19 N 0.00 1.39 -0.54 1.56 2.07 -0.04 -1.87 116.25 118.83 3d5d h VAL 19 Ca -0.00 -1.34 0.05 0.00 0.82 0.00 0.00 66.70 66.23 3d5d h VAL 19 Cb 0.59 2.13 -0.05 0.00 -1.52 0.00 0.00 31.29 32.44 3d5d h VAL 19 CO 0.03 0.37 0.27 -0.33 0.02 0.00 0.00 177.57 177.94 3d5d h GLU 20 N -0.28 0.51 0.00 1.57 4.39 -1.26 -0.84 114.58 118.67 3d5d h GLU 20 Ca 0.01 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.68 3d5d h GLU 20 Cb 0.65 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 3d5d h GLU 20 CO 0.02 0.34 0.00 -0.11 -1.16 0.00 0.00 179.01 178.10 3d5d n LEU 21 N -4.88 0.00 -0.29 1.33 0.00 0.65 0.62 117.00 114.44 3d5d n LEU 21 Ca 0.05 0.63 0.07 0.00 0.00 0.00 0.00 56.01 56.76 3d5d n LEU 21 Cb 0.15 -0.19 0.30 0.00 0.00 0.00 0.00 43.42 43.67 3d5d n LEU 21 CO 0.29 -0.19 1.23 -0.33 0.00 0.00 0.00 177.39 178.39 3d5d h GLU 22 N 0.00 0.86 0.39 1.96 5.08 -1.14 0.51 114.58 122.23 3d5d h GLU 22 Ca 0.00 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 3d5d h GLU 22 Cb 0.00 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.05 3d5d h GLU 22 CO 0.00 0.57 -0.27 0.87 -1.00 0.00 0.00 179.01 179.18 3d5d h LYS 23 N 0.88 -0.61 -1.00 2.33 1.57 -0.32 0.11 116.57 119.53 3d5d h LYS 23 Ca 0.42 0.04 0.06 0.00 -1.87 0.00 0.00 60.65 59.30 3d5d h LYS 23 Cb 0.42 0.14 -0.07 0.00 0.08 0.00 0.00 32.23 32.80 3d5d h LYS 23 CO -0.18 -0.40 0.65 1.25 -0.57 0.00 0.00 179.45 180.19 3d5d h LEU 24 N -0.63 1.03 0.39 2.94 6.46 0.98 -1.87 115.31 124.62 3d5d h LEU 24 Ca -0.05 0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.70 3d5d h LEU 24 Cb 0.52 -0.21 -0.00 0.00 -0.73 0.00 0.00 40.66 40.23 3d5d h LEU 24 CO 0.03 0.66 -0.26 0.58 -0.62 0.00 0.00 178.44 178.83 3d5d h VAL 25 N 1.17 0.00 -0.88 1.05 2.07 0.10 -1.10 116.25 118.67 3d5d h VAL 25 Ca 0.43 0.00 0.18 0.00 0.82 0.00 0.00 66.70 68.13 3d5d h VAL 25 Cb 0.16 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 29.77 3d5d h VAL 25 CO -0.17 0.00 -0.21 0.03 0.02 0.00 0.00 177.57 177.24 3d5d h ARG 26 N -0.62 0.00 0.20 1.57 3.08 -0.47 0.41 114.38 118.55 3d5d h ARG 26 Ca -0.05 -0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.01 3d5d h ARG 26 Cb 0.50 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.51 3d5d h ARG 26 CO 0.04 0.00 -0.44 0.93 -1.07 0.00 0.00 179.97 179.43 3d5d h GLU 27 N 0.00 -0.70 -0.32 0.04 5.08 -1.17 0.16 114.58 117.68 3d5d h GLU 27 Ca 0.42 0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.87 3d5d h GLU 27 Cb 0.65 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.05 3d5d h GLU 27 CO -0.90 -0.47 0.21 0.87 -1.00 0.00 0.00 179.01 177.73 3d5d h LYS 28 N -0.73 0.28 -0.34 2.33 1.79 0.41 -0.22 116.57 120.09 3d5d h LYS 28 Ca 0.00 -0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.42 3d5d h LYS 28 Cb 0.72 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.29 3d5d h LYS 28 CO -0.20 0.19 0.08 0.87 -1.08 0.00 0.00 179.45 179.30 3d5d h LYS 29 N 0.29 0.55 -0.02 3.15 1.79 0.86 0.39 116.57 123.58 3d5d h LYS 29 Ca 0.13 -0.14 0.01 0.00 -2.18 0.00 0.00 60.65 58.48 3d5d h LYS 29 Cb 0.17 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 3d5d h LYS 29 CO -0.03 0.61 -0.05 -0.09 -1.08 0.00 0.00 179.45 178.81 3d5d h ARG 30 N 0.40 -0.09 -0.90 3.15 2.43 0.69 0.03 114.38 120.09 3d5d h ARG 30 Ca 0.11 0.01 0.15 0.00 -0.81 0.00 0.00 59.98 59.43 3d5d h ARG 30 Cb 0.31 0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 29.81 3d5d h ARG 30 CO 0.00 -0.06 0.58 0.93 -1.51 0.00 0.00 179.97 179.91 3d5d h GLU 31 N -0.09 0.67 0.31 0.20 5.08 -0.93 0.70 114.58 120.52 3d5d h GLU 31 Ca 0.03 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 3d5d h GLU 31 Cb 0.13 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.23 3d5d h GLU 31 CO -0.07 0.44 -0.15 1.25 -1.00 0.00 0.00 179.01 179.49 3d5d h LEU 32 N 0.69 -0.35 0.19 1.33 6.46 -0.02 0.16 115.31 123.77 3d5d h LEU 32 Ca 0.45 -0.11 0.01 0.00 -0.12 0.00 0.00 57.88 58.11 3d5d h LEU 32 Cb 0.73 0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 40.72 3d5d h LEU 32 CO -0.21 -0.09 -0.30 -0.03 -0.62 0.00 0.00 178.44 177.20 3d5d h MET 33 N -0.62 -0.54 -1.01 1.25 4.05 0.07 0.29 114.93 118.42 3d5d h MET 33 Ca -0.04 0.04 0.29 0.00 -0.28 0.00 0.00 59.70 59.71 3d5d h MET 33 Cb 0.44 0.12 -0.04 0.00 -0.80 0.00 0.00 31.60 31.33 3d5d h MET 33 CO 0.07 -0.36 0.75 1.49 0.23 0.00 0.00 176.91 179.09 3d5d h GLU 34 N -0.56 0.00 0.00 0.39 4.57 0.43 0.29 114.58 119.69 3d5d h GLU 34 Ca 0.01 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 3d5d h GLU 34 Cb 0.56 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.15 3d5d h GLU 34 CO -0.13 0.00 0.00 -0.11 -1.18 0.00 0.00 179.01 177.59 3d5d n LEU 35 N -4.14 0.70 0.08 1.64 0.00 0.57 -2.72 117.00 113.13 3d5d n LEU 35 Ca 0.21 0.52 0.20 0.00 0.00 0.00 0.00 56.01 56.94 3d5d n LEU 35 Cb 1.10 -0.25 0.75 0.00 0.00 0.00 0.00 43.42 45.01 3d5d n LEU 35 CO 0.38 -0.25 1.18 0.08 0.00 0.00 0.00 177.39 178.78 3d5d h ARG 36 N 0.00 0.00 -0.36 1.96 0.11 -1.23 0.50 114.38 115.36 3d5d h ARG 36 Ca 0.00 0.00 0.04 0.00 0.10 0.00 0.00 59.98 60.12 3d5d h ARG 36 Cb 0.00 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.04 3d5d h ARG 36 CO 0.00 0.00 0.13 0.35 0.10 0.00 0.00 179.97 180.55 3d5d h PHE 37 N 0.00 0.23 0.00 4.08 3.57 -0.47 0.32 116.94 124.66 3d5d h PHE 37 Ca 0.20 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 3d5d h PHE 37 Cb 1.01 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.69 3d5d h PHE 37 CO 0.00 0.09 -0.88 1.96 -2.23 0.00 0.00 178.31 177.25 3d5d h GLN 38 N 0.28 0.00 0.00 1.11 4.20 -0.82 -3.30 115.11 116.58 3d5d h GLN 38 Ca 0.16 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.82 3d5d h GLN 38 Cb 0.14 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 3d5d h GLN 38 CO -0.17 0.07 -0.26 0.00 -0.67 0.00 0.00 178.83 177.80 3d5d h ALA 39 N 1.89 1.13 0.17 3.87 0.00 0.79 -2.94 119.26 124.17 3d5d h ALA 39 Ca -0.03 -0.24 -0.29 0.00 0.00 0.00 0.00 54.91 54.35 3d5d h ALA 39 Cb 1.11 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.87 3d5d h ALA 39 CO 0.01 0.33 -1.32 0.66 0.00 0.00 0.00 179.25 178.93 3d5d h SER 40 N 0.00 0.57 0.52 0.00 4.64 -0.48 -3.16 113.55 115.64 3d5d h SER 40 Ca -0.00 -0.61 0.00 0.00 -0.47 0.00 0.00 61.79 60.71 3d5d h SER 40 Cb 0.67 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 3d5d h SER 40 CO 0.03 1.47 0.00 2.30 -0.87 0.00 0.00 176.83 179.77 3d5d n ILE 41 N -3.60 0.94 0.00 0.95 -5.35 -1.12 -4.91 119.36 106.27 3d5d n ILE 41 Ca -0.11 0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.72 3d5d n ILE 41 Cb 1.05 -1.28 0.00 0.00 -1.74 0.00 0.00 39.64 37.67 3d5d n ILE 41 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3d5d n GLY 42 N -0.34 2.10 2.00 3.28 0.00 -1.15 -4.84 105.19 106.25 3d5d n GLY 42 Ca 0.01 -0.51 -0.11 0.00 0.00 0.00 0.00 46.02 45.41 3d5d n GLY 42 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3d5d n GLN 43 N 0.00 1.86 -0.41 1.61 6.02 -1.26 -2.72 117.38 122.48 3d5d n GLN 43 Ca 0.00 -0.91 -0.01 0.00 -0.01 0.00 0.00 57.00 56.07 3d5d n GLN 43 Cb 0.00 -1.93 -0.01 0.00 1.02 0.00 0.00 30.24 29.31 3d5d n GLN 43 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3d5d n LEU 44 N 2.48 -0.16 -4.11 1.08 4.77 -1.25 -5.09 117.00 114.71 3d5d n LEU 44 Ca 0.39 -0.66 -0.33 0.00 -0.03 0.00 0.00 56.01 55.39 3d5d n LEU 44 Cb 0.86 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.79 3d5d n LEU 44 CO 0.12 0.83 -0.52 -0.94 -1.33 0.00 0.00 177.39 175.54 3d5d s SER 45 N -0.16 3.19 -0.30 -1.43 1.04 -1.10 -4.41 113.70 110.53 3d5d s SER 45 Ca 0.00 -0.69 0.02 0.00 0.48 0.00 0.00 55.95 55.76 3d5d s SER 45 Cb 0.00 -1.47 0.07 0.00 0.10 0.00 0.00 66.02 64.72 3d5d s SER 45 CO 0.00 -0.01 -0.02 -1.10 0.98 0.00 0.00 173.24 173.09 3d5d s GLN 46 N 1.29 2.03 0.00 4.02 -1.52 -1.26 -5.06 119.66 119.16 3d5d s GLN 46 Ca 0.04 -1.53 0.00 0.00 -1.95 0.00 0.00 55.36 51.92 3d5d s GLN 46 Cb -0.13 -3.10 0.00 0.00 -0.22 0.00 0.00 33.01 29.56 3d5d s GLN 46 CO -0.12 -0.73 0.09 -1.71 -0.25 0.00 0.00 175.29 172.57 3d5d n ASN 47 N 4.43 0.00 -0.28 5.90 2.85 -1.26 -2.76 115.26 124.14 3d5d n ASN 47 Ca -0.08 0.09 0.21 0.00 -0.11 0.00 0.00 54.58 54.69 3d5d n ASN 47 Cb 0.42 0.00 0.39 0.00 1.24 0.00 0.00 39.78 41.83 3d5d n ASN 47 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3d5d n HIS 48 N -0.53 0.79 -0.29 1.20 1.44 -1.26 -1.95 115.22 114.61 3d5d n HIS 48 Ca 0.00 1.00 -0.03 0.00 -2.01 0.00 0.00 57.72 56.68 3d5d n HIS 48 Cb 0.00 -1.29 -0.00 0.00 0.12 0.00 0.00 29.99 28.82 3d5d n HIS 48 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 3d5d n LYS 49 N -5.02 -0.22 0.00 -1.40 4.01 -1.11 -2.62 118.16 111.78 3d5d n LYS 49 Ca 0.27 1.14 0.00 0.00 -0.51 0.00 0.00 58.31 59.20 3d5d n LYS 49 Cb 0.89 -1.68 0.00 0.00 -0.51 0.00 0.00 35.03 33.73 3d5d n LYS 49 CO 0.00 0.00 0.00 -0.89 -1.11 0.00 0.00 177.40 175.40 3d5d n ILE 50 N -5.04 0.00 0.21 -0.18 -0.00 -0.82 -0.04 119.36 113.49 3d5d n ILE 50 Ca 0.06 1.35 0.11 0.00 -0.00 0.00 0.00 62.75 64.27 3d5d n ILE 50 Cb 0.26 -2.05 0.60 0.00 -0.00 0.00 0.00 39.64 38.45 3d5d n ILE 50 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.55 176.63 3d5d h ARG 51 N 0.00 0.00 0.10 0.38 0.11 -1.74 0.14 114.38 113.37 3d5d h ARG 51 Ca 0.00 0.00 -0.29 0.00 0.10 0.00 0.00 59.98 59.79 3d5d h ARG 51 Cb 0.00 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.07 3d5d h ARG 51 CO 0.00 0.00 -1.52 -0.44 0.10 0.00 0.00 179.97 178.11 3d5d h ASP 52 N 0.00 0.33 -0.48 0.08 3.32 -1.02 -3.00 116.42 115.65 3d5d h ASP 52 Ca 0.00 -0.82 -0.04 0.00 0.02 0.00 0.00 57.03 56.19 3d5d h ASP 52 Cb 0.39 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 3d5d h ASP 52 CO 0.00 1.65 0.15 0.25 -1.72 0.00 0.00 179.24 179.57 3d5d h LEU 53 N -0.32 0.71 0.04 1.55 6.46 0.20 0.40 115.31 124.33 3d5d h LEU 53 Ca -0.34 -0.21 0.00 0.00 -0.12 0.00 0.00 57.88 57.22 3d5d h LEU 53 Cb 1.75 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 41.49 3d5d h LEU 53 CO 0.02 0.73 -0.11 0.11 -0.62 0.00 0.00 178.44 178.57 3d5d h LYS 54 N 0.65 -0.16 -0.09 1.25 1.57 -1.01 0.10 116.57 118.88 3d5d h LYS 54 Ca 0.16 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.97 3d5d h LYS 54 Cb 0.28 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 3d5d h LYS 54 CO -0.00 -0.11 0.19 0.00 -0.57 0.00 0.00 179.45 178.95 3d5d h ARG 55 N -0.17 0.00 0.34 3.15 3.08 -1.46 0.35 114.38 119.67 3d5d h ARG 55 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 3d5d h ARG 55 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.22 3d5d h ARG 55 CO -0.05 0.00 -0.16 0.37 -1.07 0.00 0.00 179.97 179.05 3d5d h GLN 56 N 0.00 -0.44 -0.41 0.04 -0.00 0.71 -3.10 115.11 111.91 3d5d h GLN 56 Ca 0.04 0.03 0.09 0.00 -0.00 0.00 0.00 58.65 58.81 3d5d h GLN 56 Cb 0.42 0.10 -0.09 0.00 0.00 0.00 0.00 27.48 27.92 3d5d h GLN 56 CO -0.00 -0.16 -0.17 0.82 0.00 0.00 0.00 178.83 179.32 3d5d h ILE 57 N -0.69 0.46 0.00 2.39 1.08 0.22 -2.52 117.51 118.44 3d5d h ILE 57 Ca -0.05 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.42 3d5d h ILE 57 Cb 0.48 0.46 0.00 0.00 -3.07 0.00 0.00 36.82 34.69 3d5d h ILE 57 CO 0.08 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.54 3d5d n ALA 58 N -2.84 0.00 -0.30 1.87 0.00 -0.57 0.05 120.51 118.72 3d5d n ALA 58 Ca 0.02 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.49 3d5d n ALA 58 Cb 0.27 0.19 0.09 0.00 0.00 0.00 0.00 19.45 20.01 3d5d n ALA 58 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 3d5d h ARG 59 N 0.00 -0.01 -0.24 0.00 0.11 -1.57 2.36 114.38 115.03 3d5d h ARG 59 Ca 0.00 0.00 0.02 0.00 0.10 0.00 0.00 59.98 60.10 3d5d h ARG 59 Cb 0.00 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.05 3d5d h ARG 59 CO 0.00 -0.01 -0.20 -0.07 0.10 0.00 0.00 179.97 179.79 3d5d h LEU 60 N -0.01 -0.71 0.24 0.08 3.38 -0.97 0.75 115.31 118.06 3d5d h LEU 60 Ca 0.39 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.46 3d5d h LEU 60 Cb 0.61 0.30 -0.03 0.00 0.09 0.00 0.00 40.66 41.63 3d5d h LEU 60 CO -0.86 -0.12 -0.46 0.25 0.09 0.00 0.00 178.44 177.34 3d5d h LEU 61 N -0.08 -1.35 0.00 1.67 5.85 0.25 -1.67 115.31 119.98 3d5d h LEU 61 Ca 0.04 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3d5d h LEU 61 Cb 0.18 0.48 0.00 0.00 0.37 0.00 0.00 40.66 41.69 3d5d h LEU 61 CO -0.27 -0.53 0.00 0.41 -0.34 0.00 0.00 178.44 177.71 3d5d n THR 62 N -5.14 0.00 -0.12 1.05 -1.04 0.77 0.23 114.28 110.03 3d5d n THR 62 Ca -0.09 1.32 -0.07 0.00 -2.04 0.00 0.00 64.05 63.17 3d5d n THR 62 Cb 0.38 -1.80 -0.01 0.00 -1.82 0.00 0.00 70.33 67.08 3d5d n THR 62 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 3d5d h VAL 63 N 0.00 0.24 0.00 12.58 2.07 0.38 0.36 116.25 131.88 3d5d h VAL 63 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3d5d h VAL 63 Cb 0.00 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.01 3d5d h VAL 63 CO 0.00 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.77 3d5d n LEU 64 N -5.42 0.41 -1.26 2.57 4.77 -0.46 0.17 117.00 117.79 3d5d n LEU 64 Ca 0.01 0.64 0.11 0.00 -0.03 0.00 0.00 56.01 56.74 3d5d n LEU 64 Cb 0.34 -0.62 0.29 0.00 -2.33 0.00 0.00 43.42 41.10 3d5d n LEU 64 CO 0.07 -0.60 0.75 0.59 -1.33 0.00 0.00 177.39 176.87 3d5d n ASN 65 N -1.99 3.80 -0.02 -1.43 4.13 0.62 -3.53 115.26 116.84 3d5d n ASN 65 Ca 0.01 -2.00 -0.02 0.00 1.68 0.00 0.00 54.58 54.25 3d5d n ASN 65 Cb 0.13 -0.44 -0.02 0.00 -1.54 0.00 0.00 39.78 37.91 3d5d n ASN 65 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 3d5d n GLU 66 N 1.51 0.99 0.38 3.52 1.02 0.94 -4.62 120.64 124.39 3d5d n GLU 66 Ca 0.23 0.01 -0.16 0.00 -0.02 0.00 0.00 57.16 57.22 3d5d n GLU 66 Cb 0.60 -1.07 -0.08 0.00 -0.02 0.00 0.00 31.44 30.87 3d5d n GLU 66 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 3d5d h LYS 67 N 0.00 -0.97 -0.69 3.49 1.79 -0.44 -2.04 116.57 117.71 3d5d h LYS 67 Ca -0.08 0.07 0.15 0.00 -2.18 0.00 0.00 60.65 58.61 3d5d h LYS 67 Cb 1.13 0.22 -0.11 0.00 -1.58 0.00 0.00 32.23 31.90 3d5d h LYS 67 CO -0.01 -0.64 0.11 -0.09 -1.08 0.00 0.00 179.45 177.75 3d5d h ARG 68 N -1.25 0.21 -0.04 3.15 2.43 -1.80 0.74 114.38 117.82 3d5d h ARG 68 Ca -0.10 -0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 58.93 3d5d h ARG 68 Cb 0.78 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 3d5d h ARG 68 CO 0.17 0.14 -0.55 0.00 -1.51 0.00 0.00 179.97 178.22 3d5d h ARG 69 N 0.22 0.13 0.17 0.20 3.08 -1.82 -0.91 114.38 115.44 3d5d h ARG 69 Ca 0.38 -0.08 -0.27 0.00 0.07 0.00 0.00 59.98 60.08 3d5d h ARG 69 Cb 0.63 0.01 0.03 0.00 0.08 0.00 0.00 29.97 30.72 3d5d h ARG 69 CO -0.51 0.64 -1.17 1.96 -1.07 0.00 0.00 179.97 179.82 3d5d h GLN 70 N 0.10 0.50 0.00 0.04 4.20 -0.46 -3.28 115.11 116.21 3d5d h GLN 70 Ca -0.00 -0.76 0.00 0.00 0.06 0.00 0.00 58.65 57.95 3d5d h GLN 70 Cb 1.00 0.27 0.00 0.00 0.30 0.00 0.00 27.48 29.05 3d5d h GLN 70 CO 0.08 1.35 0.00 -0.91 -0.67 0.00 0.00 178.83 178.68 3d5d h ASN 71 N 0.03 0.00 -0.01 1.46 2.35 0.51 -3.51 115.58 116.42 3d5d h ASN 71 Ca -0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 3d5d h ASN 71 Cb 1.89 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.26 3d5d h ASN 71 CO 0.22 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 176.00