#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4p n SER 2 N 0.00 -0.41 -4.60 1.61 7.64 -1.26 -5.05 113.62 111.55 1x4p n SER 2 Ca 0.00 1.26 -0.26 0.00 1.01 0.00 0.00 58.87 60.88 1x4p n SER 2 Cb 0.00 -4.99 -0.08 0.00 -1.01 0.00 0.00 64.21 58.13 1x4p n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x4p s SER 3 N -0.63 4.39 0.00 6.43 0.01 -1.26 -5.06 113.70 117.59 1x4p s SER 3 Ca -0.27 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 56.40 1x4p s SER 3 Cb 0.02 -0.79 0.00 0.00 0.21 0.00 0.00 66.02 65.46 1x4p s SER 3 CO 0.75 0.07 0.00 0.61 0.41 0.00 0.00 173.24 175.08 1x4p n GLY 4 N -0.27 0.18 2.76 3.44 0.00 -1.26 -5.11 105.19 104.93 1x4p n GLY 4 Ca -0.09 -2.25 -0.04 0.00 0.00 0.00 0.00 46.02 43.64 1x4p n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1x4p n SER 5 N 0.00 -2.84 -3.81 1.61 2.88 -1.26 -5.06 113.62 105.14 1x4p n SER 5 Ca 0.00 1.22 -0.10 0.00 -1.33 0.00 0.00 58.87 58.66 1x4p n SER 5 Cb 0.00 -4.00 -0.08 0.00 -0.75 0.00 0.00 64.21 59.39 1x4p n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1x4p s SER 6 N -0.43 0.01 0.00 -3.46 0.01 -1.26 -5.04 113.70 103.52 1x4p s SER 6 Ca -0.19 -0.40 0.00 0.00 1.31 0.00 0.00 55.95 56.66 1x4p s SER 6 Cb 0.01 0.33 0.00 0.00 0.21 0.00 0.00 66.02 66.57 1x4p s SER 6 CO 0.52 -0.64 0.00 0.61 0.41 0.00 0.00 173.24 174.14 1x4p n GLY 7 N 0.39 -0.99 0.09 3.44 0.00 -1.26 -4.92 105.19 101.95 1x4p n GLY 7 Ca -0.18 0.34 0.08 0.00 0.00 0.00 0.00 46.02 46.27 1x4p n GLY 7 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1x4p n VAL 8 N 0.00 1.17 0.22 1.61 0.24 -1.26 -2.30 118.33 118.00 1x4p n VAL 8 Ca 0.00 0.45 0.06 0.00 -2.04 0.00 0.00 64.34 62.80 1x4p n VAL 8 Cb 0.00 -1.38 0.53 0.00 -1.47 0.00 0.00 33.84 31.52 1x4p n VAL 8 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1x4p h GLY 9 N 1.14 0.05 0.34 7.63 0.00 -1.96 -2.21 103.07 108.06 1x4p h GLY 9 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 47.33 47.27 1x4p h GLY 9 CO 0.00 0.02 -0.13 -0.84 0.00 0.00 0.00 176.54 175.60 1x4p h THR 10 N 0.04 1.58 -0.02 4.70 2.02 -1.89 -3.33 112.91 116.02 1x4p h THR 10 Ca 0.01 -1.89 0.03 0.00 0.77 0.00 0.00 66.41 65.33 1x4p h THR 10 Cb 0.21 2.81 -0.04 0.00 -1.74 0.00 0.00 68.15 69.39 1x4p h THR 10 CO 0.01 0.50 -0.18 0.40 0.37 0.00 0.00 175.52 176.62 1x4p h ILE 11 N -0.63 0.55 -1.15 3.11 2.04 -1.67 -0.80 117.51 118.97 1x4p h ILE 11 Ca -0.02 0.00 0.44 0.00 1.00 0.00 0.00 64.86 66.29 1x4p h ILE 11 Cb 0.89 0.55 -0.16 0.00 -0.74 0.00 0.00 36.82 37.36 1x4p h ILE 11 CO 0.03 0.00 0.67 -0.67 0.00 0.00 0.00 178.15 178.18 1x4p n ASP 12 N -5.32 0.30 0.03 1.72 2.03 -0.85 0.43 116.55 114.89 1x4p n ASP 12 Ca -0.05 1.55 -0.20 0.00 0.52 0.00 0.00 54.79 56.61 1x4p n ASP 12 Cb 0.23 -0.76 -0.14 0.00 -0.72 0.00 0.00 41.12 39.73 1x4p n ASP 12 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 1x4p h GLN 13 N 0.00 0.27 0.31 -0.67 4.20 -1.42 -3.30 115.11 114.50 1x4p h GLN 13 Ca 0.86 -0.46 -0.00 0.00 0.06 0.00 0.00 58.65 59.10 1x4p h GLN 13 Cb 2.48 0.17 -0.03 0.00 0.30 0.00 0.00 27.48 30.40 1x4p h GLN 13 CO -0.65 1.22 -0.45 1.25 -0.67 0.00 0.00 178.83 179.53 1x4p h LEU 14 N -0.38 -1.28 -0.88 1.46 5.85 0.14 -2.42 115.31 117.80 1x4p h LEU 14 Ca -0.19 0.12 0.20 0.00 0.84 0.00 0.00 57.88 58.85 1x4p h LEU 14 Cb 1.66 0.44 -0.16 0.00 0.37 0.00 0.00 40.66 42.97 1x4p h LEU 14 CO 0.11 -0.54 -0.09 0.58 -0.34 0.00 0.00 178.44 178.16 1x4p h VAL 15 N -0.79 0.15 -1.02 1.05 2.07 -1.10 0.72 116.25 117.33 1x4p h VAL 15 Ca -0.04 -0.01 0.25 0.00 0.82 0.00 0.00 66.70 67.72 1x4p h VAL 15 Cb 0.72 0.11 -0.11 0.00 -1.52 0.00 0.00 31.29 30.49 1x4p h VAL 15 CO -0.13 0.01 0.62 0.07 0.02 0.00 0.00 177.57 178.15 1x4p h LYS 16 N 0.03 0.53 0.00 1.57 2.10 -1.52 -2.11 116.57 117.18 1x4p h LYS 16 Ca 0.47 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 59.09 1x4p h LYS 16 Cb 0.84 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 32.05 1x4p h LYS 16 CO -0.85 0.35 0.00 0.54 -2.00 0.00 0.00 179.45 177.49 1x4p n ARG 17 N -4.79 0.00 -0.24 0.07 1.74 0.25 -1.79 116.66 111.90 1x4p n ARG 17 Ca 0.26 0.47 0.29 0.00 -0.77 0.00 0.00 57.85 58.09 1x4p n ARG 17 Cb 0.77 -1.35 0.44 0.00 -1.02 0.00 0.00 32.46 31.30 1x4p n ARG 17 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1x4p n VAL 18 N -1.90 0.00 0.01 1.55 0.24 -1.05 0.51 118.33 117.68 1x4p n VAL 18 Ca 0.00 1.23 -0.01 0.00 -2.04 0.00 0.00 64.34 63.52 1x4p n VAL 18 Cb 0.00 -2.19 -0.00 0.00 -1.47 0.00 0.00 33.84 30.17 1x4p n VAL 18 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 1x4p h ILE 19 N 0.00 0.00 0.00 1.34 1.08 -1.22 -3.32 117.51 115.39 1x4p h ILE 19 Ca 0.50 -0.36 0.00 0.00 -0.39 0.00 0.00 64.86 64.61 1x4p h ILE 19 Cb 2.89 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 36.64 1x4p h ILE 19 CO -0.01 0.00 0.00 -0.33 -0.69 0.00 0.00 178.15 177.12 1x4p h GLU 20 N -0.43 0.00 0.00 2.37 5.08 -0.11 -3.46 114.58 118.03 1x4p h GLU 20 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1x4p h GLU 20 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1x4p h GLU 20 CO 0.01 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.43 1x4p n GLY 21 N -0.85 1.58 0.54 -3.84 0.00 0.18 -4.82 105.19 97.98 1x4p n GLY 21 Ca -0.02 0.00 0.31 0.00 0.00 0.00 0.00 46.02 46.31 1x4p n GLY 21 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1x4p n SER 22 N 0.00 0.00 -4.53 1.61 2.88 -1.24 -3.99 113.62 108.35 1x4p n SER 22 Ca 0.00 0.76 -0.34 0.00 -1.33 0.00 0.00 58.87 57.96 1x4p n SER 22 Cb 0.00 -0.29 -0.12 0.00 -0.75 0.00 0.00 64.21 63.06 1x4p n SER 22 CO 0.00 0.00 0.00 -1.48 -1.23 0.00 0.00 175.04 172.33 1x4p s LEU 23 N -6.51 3.27 1.09 2.46 2.34 -1.26 -5.10 118.68 114.96 1x4p s LEU 23 Ca -0.03 -0.09 -0.16 0.00 0.06 0.00 0.00 54.13 53.91 1x4p s LEU 23 Cb 0.15 -1.77 0.13 0.00 -0.56 0.00 0.00 46.19 44.14 1x4p s LEU 23 CO 0.51 0.22 0.31 -1.20 -1.06 0.00 0.00 176.35 175.14 1x4p n SER 24 N 3.19 -2.09 0.10 1.48 7.64 -1.26 -4.86 113.62 117.83 1x4p n SER 24 Ca -0.18 -0.01 -0.03 0.00 1.01 0.00 0.00 58.87 59.66 1x4p n SER 24 Cb 0.53 -1.08 0.20 0.00 -1.01 0.00 0.00 64.21 62.84 1x4p n SER 24 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1x4p h PRO 25 N -2.07 0.22 -0.13 1.43 0.13 -1.99 -3.20 132.00 126.39 1x4p h PRO 25 Ca -0.53 -0.11 -0.07 0.00 -0.87 0.00 0.00 66.00 64.42 1x4p h PRO 25 Cb 1.34 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.47 1x4p h PRO 25 CO 0.39 0.64 -0.20 -0.22 -0.23 0.00 0.00 178.00 178.39 1x4p h LYS 26 N 0.18 0.36 -0.94 0.86 1.63 -2.01 -3.18 116.57 113.47 1x4p h LYS 26 Ca 0.01 -0.21 0.24 0.00 -0.85 0.00 0.00 60.65 59.83 1x4p h LYS 26 Cb 0.90 0.02 -0.13 0.00 -0.60 0.00 0.00 32.23 32.42 1x4p h LYS 26 CO 0.07 0.80 0.46 0.93 -3.45 0.00 0.00 179.45 178.25 1x4p h GLU 27 N -0.05 0.42 0.41 1.90 3.07 -1.91 -0.99 114.58 117.43 1x4p h GLU 27 Ca 0.01 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 58.84 1x4p h GLU 27 Cb 0.76 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.56 1x4p h GLU 27 CO 0.05 0.27 -0.36 0.00 -1.40 0.00 0.00 179.01 177.57 1x4p h ARG 28 N 0.43 -0.75 0.00 2.33 3.08 -1.59 -0.79 114.38 117.08 1x4p h ARG 28 Ca 0.60 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.70 1x4p h ARG 28 Cb 1.18 0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.40 1x4p h ARG 28 CO -0.53 -0.50 0.18 1.15 -1.07 0.00 0.00 179.97 179.19 1x4p h THR 29 N -0.78 0.00 0.00 2.04 2.02 -1.25 0.25 112.91 115.18 1x4p h THR 29 Ca -0.04 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 66.99 1x4p h THR 29 Cb 0.69 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 1x4p h THR 29 CO -0.03 0.00 -0.98 -0.07 0.37 0.00 0.00 175.52 174.81 1x4p h LEU 30 N 0.00 0.00 -1.50 2.58 3.38 -0.50 -3.32 115.31 115.95 1x4p h LEU 30 Ca 0.00 0.00 0.26 0.00 0.09 0.00 0.00 57.88 58.23 1x4p h LEU 30 Cb 0.35 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.02 1x4p h LEU 30 CO 0.00 0.61 0.68 -0.07 0.09 0.00 0.00 178.44 179.75 1x4p h LEU 31 N 0.00 0.36 -0.91 1.67 3.38 0.58 0.35 115.31 120.74 1x4p h LEU 31 Ca -0.08 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1x4p h LEU 31 Cb 1.54 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.26 1x4p h LEU 31 CO 0.07 0.09 0.18 0.11 0.09 0.00 0.00 178.44 178.97 1x4p h LYS 32 N 0.33 0.98 0.00 1.13 1.57 -1.68 -1.75 116.57 117.15 1x4p h LYS 32 Ca 0.56 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1x4p h LYS 32 Cb 1.54 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.71 1x4p h LYS 32 CO -0.22 0.86 0.00 0.93 -0.57 0.00 0.00 179.45 180.44 1x4p h GLU 33 N 0.95 0.00 -6.28 3.15 5.08 -0.51 -3.42 114.58 113.54 1x4p h GLU 33 Ca 0.21 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 58.00 1x4p h GLU 33 Cb 0.30 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 1x4p h GLU 33 CO -0.00 0.00 -0.08 0.34 -1.00 0.00 0.00 179.01 178.27 1x4p s ASP 34 N -4.53 6.89 0.29 1.42 2.15 -0.66 -4.99 116.67 117.24 1x4p s ASP 34 Ca -0.02 1.12 0.07 0.00 0.43 0.00 0.00 52.55 54.15 1x4p s ASP 34 Cb 0.09 -2.31 0.43 0.00 -0.30 0.00 0.00 42.92 40.83 1x4p s ASP 34 CO 0.32 0.17 1.67 1.55 -0.17 0.00 0.00 175.17 178.71 1x4p h PRO 35 N 3.91 0.20 0.00 4.34 0.13 -1.83 -2.90 132.00 135.83 1x4p h PRO 35 Ca -0.49 -0.10 -0.00 0.00 -0.87 0.00 0.00 66.00 64.53 1x4p h PRO 35 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1x4p h PRO 35 CO 0.65 0.63 -0.01 0.00 -0.23 0.00 0.00 178.00 179.03 1x4p h ALA 36 N 1.36 1.53 -1.61 -0.56 0.00 -1.94 -2.70 119.26 115.34 1x4p h ALA 36 Ca 0.01 -0.01 -0.64 0.00 0.00 0.00 0.00 54.91 54.27 1x4p h ALA 36 Cb 0.89 -0.00 -0.38 0.00 0.00 0.00 0.00 17.79 18.29 1x4p h ALA 36 CO 0.07 0.01 -0.25 0.66 0.00 0.00 0.00 179.25 179.74 1x4p n TYR 37 N -3.87 3.46 0.14 0.00 4.01 -1.10 -4.74 117.16 115.06 1x4p n TYR 37 Ca -0.03 -3.16 0.02 0.00 -0.16 0.00 0.00 57.90 54.57 1x4p n TYR 37 Cb 0.10 -0.47 0.05 0.00 -0.31 0.00 0.00 39.34 38.70 1x4p n TYR 37 CO 0.00 0.00 0.00 0.11 -0.46 0.00 0.00 176.86 176.51 1x4p h TRP 38 N 2.90 0.00 -0.45 -0.72 5.08 -1.59 -3.24 115.95 117.93 1x4p h TRP 38 Ca 0.32 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 60.27 1x4p h TRP 38 Cb 0.61 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.75 1x4p h TRP 38 CO 0.93 0.55 0.17 0.27 -1.28 0.00 0.00 178.44 179.07 1x4p h PHE 39 N 0.00 0.64 -0.87 0.12 -5.15 -1.87 -2.90 116.94 106.91 1x4p h PHE 39 Ca -0.01 -0.03 0.29 0.00 -0.20 0.00 0.00 57.97 58.03 1x4p h PHE 39 Cb 1.37 -0.20 -0.16 0.00 0.22 0.00 0.00 35.95 37.19 1x4p h PHE 39 CO 0.00 0.51 0.20 1.28 -2.00 0.00 0.00 178.31 178.30 1x4p n LEU 40 N -4.36 0.06 0.03 2.10 4.77 -1.22 0.23 117.00 118.62 1x4p n LEU 40 Ca 0.03 1.47 -0.12 0.00 -0.03 0.00 0.00 56.01 57.35 1x4p n LEU 40 Cb 0.16 -0.61 -0.01 0.00 -2.33 0.00 0.00 43.42 40.63 1x4p n LEU 40 CO 0.38 -1.55 0.31 0.28 -1.33 0.00 0.00 177.39 175.48 1x4p h SER 41 N 0.00 0.63 -4.21 -1.43 0.02 -1.76 -3.45 113.55 103.36 1x4p h SER 41 Ca 0.61 -0.42 -0.48 0.00 -0.84 0.00 0.00 61.79 60.66 1x4p h SER 41 Cb 1.44 -0.19 0.03 0.00 0.14 0.00 0.00 62.40 63.82 1x4p h SER 41 CO -0.76 1.18 0.38 -0.62 -1.14 0.00 0.00 176.83 175.87 1x4p s ASP 42 N -7.03 6.42 0.00 3.07 2.15 0.63 -4.99 116.67 116.92 1x4p s ASP 42 Ca -0.07 1.61 0.00 0.00 0.43 0.00 0.00 52.55 54.52 1x4p s ASP 42 Cb 0.10 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 40.21 1x4p s ASP 42 CO 0.86 -0.73 0.00 -0.62 -0.17 0.00 0.00 175.17 174.51 1x4p n GLU 43 N -1.77 1.72 -1.56 4.34 1.02 -1.26 -4.79 120.64 118.34 1x4p n GLU 43 Ca 0.07 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.92 1x4p n GLU 43 Cb 0.54 -0.88 -0.06 0.00 -0.02 0.00 0.00 31.44 31.03 1x4p n GLU 43 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1x4p n ASN 44 N -1.89 6.78 -1.54 1.62 2.85 -1.26 -4.74 115.26 117.08 1x4p n ASN 44 Ca 0.00 -3.11 -0.03 0.00 -0.11 0.00 0.00 54.58 51.33 1x4p n ASN 44 Cb 0.38 -1.29 -0.01 0.00 1.24 0.00 0.00 39.78 40.10 1x4p n ASN 44 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1x4p n SER 45 N 1.30 0.40 -0.13 1.20 3.41 -1.26 -5.09 113.62 113.43 1x4p n SER 45 Ca 0.52 -1.31 -0.25 0.00 -0.26 0.00 0.00 58.87 57.58 1x4p n SER 45 Cb 0.51 0.19 -0.11 0.00 -0.26 0.00 0.00 64.21 64.54 1x4p n SER 45 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1x4p n LEU 46 N 0.00 2.38 0.08 1.04 -0.00 -1.26 -3.77 117.00 115.47 1x4p n LEU 46 Ca 0.00 0.15 0.11 0.00 -0.00 0.00 0.00 56.01 56.27 1x4p n LEU 46 Cb 0.09 -0.86 0.58 0.00 -0.00 0.00 0.00 43.42 43.23 1x4p n LEU 46 CO 0.04 0.72 1.14 -0.33 -0.00 0.00 0.00 177.39 178.97 1x4p h GLU 47 N -0.59 0.18 0.00 1.96 5.08 -1.97 -0.35 114.58 118.89 1x4p h GLU 47 Ca -0.65 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 57.57 1x4p h GLU 47 Cb 1.73 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.92 1x4p h GLU 47 CO -0.29 0.12 -0.70 -0.92 -1.00 0.00 0.00 179.01 176.22 1x4p h TYR 48 N 0.18 0.00 0.00 4.33 5.03 -1.84 -3.24 116.97 121.43 1x4p h TYR 48 Ca 0.14 0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.42 1x4p h TYR 48 Cb 0.33 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.61 1x4p h TYR 48 CO -0.00 0.54 -0.16 0.87 -1.32 0.00 0.00 178.16 178.09 1x4p h LYS 49 N 0.00 0.00 0.00 1.82 1.57 -1.15 -2.77 116.57 116.04 1x4p h LYS 49 Ca -0.03 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1x4p h LYS 49 Cb 1.44 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.75 1x4p h LYS 49 CO 0.07 0.16 -0.07 1.88 -0.57 0.00 0.00 179.45 180.91 1x4p h TYR 50 N 0.00 0.00 -1.13 -1.35 -1.99 -1.56 -1.09 116.97 109.85 1x4p h TYR 50 Ca -0.00 0.00 0.32 0.00 2.00 0.00 0.00 58.73 61.05 1x4p h TYR 50 Cb 0.34 0.00 -0.10 0.00 2.00 0.00 0.00 36.73 38.97 1x4p h TYR 50 CO 0.00 0.61 0.73 -0.92 -0.00 0.00 0.00 178.16 178.58 1x4p h TYR 51 N -1.00 0.60 0.01 4.88 3.20 -1.57 0.84 116.97 123.93 1x4p h TYR 51 Ca -0.02 0.02 -0.29 0.00 3.14 0.00 0.00 58.73 61.59 1x4p h TYR 51 Cb 0.62 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.68 1x4p h TYR 51 CO 0.15 -0.03 -1.63 0.87 -1.64 0.00 0.00 178.16 175.88 1x4p h LYS 52 N 0.28 0.03 0.00 1.82 1.79 -1.60 -3.26 116.57 115.64 1x4p h LYS 52 Ca 0.67 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 59.09 1x4p h LYS 52 Cb 1.87 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 32.54 1x4p h LYS 52 CO -0.33 0.63 0.00 -0.11 -1.08 0.00 0.00 179.45 178.56 1x4p n LEU 53 N -3.13 0.34 -0.34 2.94 -0.00 0.12 -2.57 117.00 114.36 1x4p n LEU 53 Ca -0.16 0.47 0.24 0.00 -0.00 0.00 0.00 56.01 56.56 1x4p n LEU 53 Cb 1.04 -0.44 0.48 0.00 -0.00 0.00 0.00 43.42 44.49 1x4p n LEU 53 CO 0.45 -0.44 1.13 0.50 -0.00 0.00 0.00 177.39 179.03 1x4p h LYS 54 N 0.00 0.33 -0.37 1.96 1.63 0.23 0.41 116.57 120.75 1x4p h LYS 54 Ca 0.00 -0.02 -0.03 0.00 -0.85 0.00 0.00 60.65 59.75 1x4p h LYS 54 Cb 0.00 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.54 1x4p h LYS 54 CO 0.00 0.22 0.13 1.25 -3.45 0.00 0.00 179.45 177.59 1x4p h LEU 55 N 0.34 0.53 0.57 5.20 5.85 -1.60 0.37 115.31 126.56 1x4p h LEU 55 Ca 0.73 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 59.23 1x4p h LEU 55 Cb 1.67 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 42.57 1x4p h LEU 55 CO -0.58 0.58 -0.27 0.00 -0.34 0.00 0.00 178.44 177.83 1x4p h ALA 56 N 0.97 -0.77 -0.63 1.25 0.00 0.03 0.55 119.26 120.67 1x4p h ALA 56 Ca 0.12 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1x4p h ALA 56 Cb 0.23 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1x4p h ALA 56 CO -0.01 -0.90 0.22 1.05 0.00 0.00 0.00 179.25 179.61 1x4p h GLU 57 N -0.82 0.94 -0.07 0.00 4.11 -1.21 -0.85 114.58 116.68 1x4p h GLU 57 Ca -0.08 -0.17 -0.13 0.00 0.07 0.00 0.00 59.36 59.06 1x4p h GLU 57 Cb 0.61 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1x4p h GLU 57 CO 0.13 0.79 -0.54 0.52 0.07 0.00 0.00 179.01 179.98 1x4p h MET 58 N 0.91 0.19 0.19 1.06 2.86 -0.12 -3.04 114.93 116.98 1x4p h MET 58 Ca 0.21 -0.12 -0.01 0.00 -2.06 0.00 0.00 59.70 57.72 1x4p h MET 58 Cb 0.22 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.90 1x4p h MET 58 CO -0.01 0.68 -0.09 1.96 1.06 0.00 0.00 176.91 180.51 1x4p h GLN 59 N 0.15 -0.24 -0.85 1.72 4.20 0.64 -3.17 115.11 117.55 1x4p h GLN 59 Ca 0.00 0.02 0.25 0.00 0.06 0.00 0.00 58.65 58.97 1x4p h GLN 59 Cb 1.00 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.80 1x4p h GLN 59 CO 0.08 0.16 0.68 0.07 -0.67 0.00 0.00 178.83 179.15 1x4p h ARG 60 N -0.86 0.00 -5.92 1.46 0.11 -1.23 -3.39 114.38 104.55 1x4p h ARG 60 Ca -0.03 0.00 -0.59 0.00 0.10 0.00 0.00 59.98 59.47 1x4p h ARG 60 Cb 0.52 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.53 1x4p h ARG 60 CO 0.04 0.00 -0.15 -1.12 0.10 0.00 0.00 179.97 178.85 1x4p s SER 61 N -5.30 6.79 0.00 0.08 0.01 -1.15 -4.87 113.70 109.27 1x4p s SER 61 Ca -0.05 0.94 0.00 0.00 1.31 0.00 0.00 55.95 58.16 1x4p s SER 61 Cb 0.20 -2.28 0.00 0.00 0.21 0.00 0.00 66.02 64.14 1x4p s SER 61 CO 0.71 0.17 0.00 0.61 0.41 0.00 0.00 173.24 175.13 1x4p n GLY 62 N 2.47 0.93 0.20 3.44 0.00 -1.26 -4.89 105.19 106.08 1x4p n GLY 62 Ca -0.10 -0.39 0.06 0.00 0.00 0.00 0.00 46.02 45.59 1x4p n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x4p h PRO 63 N 0.00 0.00 -4.70 1.61 0.13 -1.95 -3.40 132.00 123.70 1x4p h PRO 63 Ca 0.00 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.47 1x4p h PRO 63 Cb 0.00 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 30.74 1x4p h PRO 63 CO 0.00 0.33 -0.76 -1.12 -0.23 0.00 0.00 178.00 176.22 1x4p s SER 64 N -6.48 4.55 0.10 1.44 0.01 -1.26 -5.09 113.70 106.97 1x4p s SER 64 Ca -0.01 -1.76 -0.34 0.00 1.31 0.00 0.00 55.95 55.15 1x4p s SER 64 Cb 0.12 -1.54 -0.18 0.00 0.21 0.00 0.00 66.02 64.63 1x4p s SER 64 CO 0.67 -0.29 0.82 -0.24 0.41 0.00 0.00 173.24 174.61 1x4p n SER 65 N 4.38 -0.54 0.00 2.44 2.88 -1.26 -5.22 113.62 116.29 1x4p n SER 65 Ca -0.05 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.64 1x4p n SER 65 Cb 0.42 -0.94 0.00 0.00 -0.75 0.00 0.00 64.21 62.94 1x4p n SER 65 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42