#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4p h SER 2 N 0.00 -0.36 -0.19 1.61 0.87 -2.11 -3.46 113.55 109.91 1x4p h SER 2 Ca 0.00 0.02 0.25 0.00 -1.23 0.00 0.00 61.79 60.83 1x4p h SER 2 Cb 0.00 0.10 -0.20 0.00 -0.44 0.00 0.00 62.40 61.86 1x4p h SER 2 CO 0.00 -0.22 0.14 -0.55 -0.53 0.00 0.00 176.83 175.67 1x4p s SER 3 N -2.66 -0.28 0.00 6.23 0.15 -1.26 -5.16 113.70 110.72 1x4p s SER 3 Ca -0.06 0.11 0.00 0.00 0.70 0.00 0.00 55.95 56.71 1x4p s SER 3 Cb 0.01 1.21 0.00 0.00 -1.71 0.00 0.00 66.02 65.53 1x4p s SER 3 CO 0.17 -0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.17 1x4p n GLY 4 N 5.33 3.86 3.27 9.45 0.00 -1.26 -5.19 105.19 120.65 1x4p n GLY 4 Ca -0.01 -0.37 -0.09 0.00 0.00 0.00 0.00 46.02 45.55 1x4p n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x4p s SER 5 N 0.00 -0.00 0.00 1.61 1.04 -1.26 -5.07 113.70 110.01 1x4p s SER 5 Ca 0.00 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 55.83 1x4p s SER 5 Cb 0.00 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.52 1x4p s SER 5 CO 0.00 -0.81 0.00 -0.24 0.98 0.00 0.00 173.24 173.17 1x4p n SER 6 N -0.15 0.00 0.00 7.02 2.88 -1.26 -4.99 113.62 117.13 1x4p n SER 6 Ca -0.14 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.40 1x4p n SER 6 Cb 0.63 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.09 1x4p n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4p n GLY 7 N -0.13 1.54 0.00 0.46 0.00 -1.26 -2.69 105.19 103.12 1x4p n GLY 7 Ca 0.00 -0.02 0.10 0.00 0.00 0.00 0.00 46.02 46.10 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 0.31 0.27 1.61 0.24 -1.26 -3.25 118.33 116.26 1x4p n VAL 8 Ca 0.00 0.08 0.11 0.00 -2.04 0.00 0.00 64.34 62.49 1x4p n VAL 8 Cb 0.00 -0.74 0.76 0.00 -1.47 0.00 0.00 33.84 32.39 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 3.36 0.00 0.32 7.63 0.00 -1.89 -1.71 103.07 110.78 1x4p h GLY 9 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.19 1x4p h GLY 9 CO 0.00 0.00 -0.68 -0.84 0.00 0.00 0.00 176.54 175.02 1x4p h THR 10 N 0.00 1.45 -0.59 4.70 2.02 -1.85 -3.36 112.91 115.29 1x4p h THR 10 Ca -0.00 -2.40 0.06 0.00 0.77 0.00 0.00 66.41 64.85 1x4p h THR 10 Cb 0.02 3.06 -0.05 0.00 -1.74 0.00 0.00 68.15 69.44 1x4p h THR 10 CO 0.00 0.62 0.29 0.40 0.37 0.00 0.00 175.52 177.21 1x4p h ILE 11 N -0.68 0.92 -0.57 3.11 2.04 -1.69 0.01 117.51 120.64 1x4p h ILE 11 Ca -0.15 -0.19 0.17 0.00 1.00 0.00 0.00 64.86 65.69 1x4p h ILE 11 Cb 1.38 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1x4p h ILE 11 CO 0.03 0.10 0.63 -0.78 0.00 0.00 0.00 178.15 178.13 1x4p h ASP 12 N 0.55 0.00 0.06 1.72 3.58 -1.46 -0.08 116.42 120.79 1x4p h ASP 12 Ca 0.27 0.00 -0.35 0.00 0.42 0.00 0.00 57.03 57.37 1x4p h ASP 12 Cb 0.21 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.23 1x4p h ASP 12 CO -0.20 0.00 -2.00 0.00 -2.88 0.00 0.00 179.24 174.15 1x4p n GLN 13 N -3.61 0.68 0.37 0.28 6.02 -0.14 -4.11 117.38 116.86 1x4p n GLN 13 Ca 0.11 0.31 -0.19 0.00 -0.01 0.00 0.00 57.00 57.22 1x4p n GLN 13 Cb 0.84 -1.65 -0.10 0.00 1.02 0.00 0.00 30.24 30.35 1x4p n GLN 13 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1x4p h LEU 14 N -0.28 -1.28 -0.88 1.08 5.85 0.26 -2.85 115.31 117.20 1x4p h LEU 14 Ca -0.47 0.08 0.17 0.00 0.84 0.00 0.00 57.88 58.50 1x4p h LEU 14 Cb 1.81 0.39 -0.16 0.00 0.37 0.00 0.00 40.66 43.07 1x4p h LEU 14 CO -0.07 -0.71 -0.27 0.58 -0.34 0.00 0.00 178.44 177.64 1x4p h VAL 15 N -1.10 0.09 -1.07 1.05 2.07 -1.34 0.98 116.25 116.92 1x4p h VAL 15 Ca -0.09 0.00 0.29 0.00 0.82 0.00 0.00 66.70 67.72 1x4p h VAL 15 Cb 0.91 0.09 -0.08 0.00 -1.52 0.00 0.00 31.29 30.69 1x4p h VAL 15 CO 0.04 0.00 0.71 0.07 0.02 0.00 0.00 177.57 178.40 1x4p h LYS 16 N -0.02 0.29 0.00 1.57 2.10 -1.66 -2.27 116.57 116.58 1x4p h LYS 16 Ca 0.39 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 59.02 1x4p h LYS 16 Cb 0.63 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.89 1x4p h LYS 16 CO -0.91 0.19 0.00 0.54 -2.00 0.00 0.00 179.45 177.27 1x4p n ARG 17 N -4.54 0.00 -0.28 0.07 1.74 0.34 -2.04 116.66 111.95 1x4p n ARG 17 Ca 0.26 0.46 0.30 0.00 -0.77 0.00 0.00 57.85 58.09 1x4p n ARG 17 Cb 0.97 -1.27 0.46 0.00 -1.02 0.00 0.00 32.46 31.60 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 -1.87 0.00 0.01 1.55 0.24 -1.02 0.82 118.33 118.06 1x4p n VAL 18 Ca 0.00 1.21 -0.01 0.00 -2.04 0.00 0.00 64.34 63.50 1x4p n VAL 18 Cb 0.00 -2.14 -0.01 0.00 -1.47 0.00 0.00 33.84 30.23 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 -1.35 -3.32 117.51 115.27 1x4p h ILE 19 Ca 0.53 -0.36 0.00 0.00 -0.39 0.00 0.00 64.86 64.64 1x4p h ILE 19 Cb 2.87 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 36.62 1x4p h ILE 19 CO -0.01 0.00 0.00 -0.62 -0.69 0.00 0.00 178.15 176.83 1x4p n GLU 20 N -3.21 0.14 -0.66 2.37 1.02 0.20 -4.83 120.64 115.67 1x4p n GLU 20 Ca -0.01 0.48 0.00 0.00 -0.02 0.00 0.00 57.16 57.61 1x4p n GLU 20 Cb 0.03 -1.83 0.00 0.00 -0.02 0.00 0.00 31.44 29.63 1x4p n GLU 20 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1x4p n GLY 21 N -0.56 1.49 0.54 0.62 0.00 0.24 -4.84 105.19 102.67 1x4p n GLY 21 Ca 0.01 0.00 0.31 0.00 0.00 0.00 0.00 46.02 46.34 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 -4.69 1.61 2.88 -1.23 -4.05 113.62 108.13 1x4p n SER 22 Ca 0.00 0.76 -0.35 0.00 -1.33 0.00 0.00 58.87 57.95 1x4p n SER 22 Cb 0.00 -0.29 -0.09 0.00 -0.75 0.00 0.00 64.21 63.08 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 -6.52 3.84 0.96 2.46 2.34 -1.26 -5.09 118.68 115.41 1x4p s LEU 23 Ca -0.03 0.17 -0.13 0.00 0.06 0.00 0.00 54.13 54.20 1x4p s LEU 23 Cb 0.16 -1.93 0.03 0.00 -0.56 0.00 0.00 46.19 43.88 1x4p s LEU 23 CO 0.52 0.29 0.31 -1.20 -1.06 0.00 0.00 176.35 175.20 1x4p n SER 24 N 2.79 -2.35 0.23 1.48 7.64 -1.26 -4.88 113.62 117.28 1x4p n SER 24 Ca -0.18 0.30 0.10 0.00 1.01 0.00 0.00 58.87 60.10 1x4p n SER 24 Cb 0.53 -1.17 0.53 0.00 -1.01 0.00 0.00 64.21 63.09 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 -1.55 0.00 0.18 1.43 0.13 -1.98 -3.06 132.00 127.15 1x4p h PRO 25 Ca -0.44 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.38 1x4p h PRO 25 Cb 1.29 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.45 1x4p h PRO 25 CO 0.34 0.21 -1.35 -0.22 -0.23 0.00 0.00 178.00 176.75 1x4p h LYS 26 N 0.00 0.53 -0.65 0.86 1.63 -2.01 -3.32 116.57 113.61 1x4p h LYS 26 Ca -0.00 -0.81 0.10 0.00 -0.85 0.00 0.00 60.65 59.09 1x4p h LYS 26 Cb 0.64 0.29 -0.07 0.00 -0.60 0.00 0.00 32.23 32.49 1x4p h LYS 26 CO 0.03 1.38 0.27 0.93 -3.45 0.00 0.00 179.45 178.61 1x4p h GLU 27 N 0.18 0.46 -0.34 1.90 4.39 -1.88 -1.56 114.58 117.73 1x4p h GLU 27 Ca -0.21 -0.03 0.07 0.00 0.34 0.00 0.00 59.36 59.54 1x4p h GLU 27 Cb 2.04 -0.10 -0.08 0.00 -0.10 0.00 0.00 28.75 30.50 1x4p h GLU 27 CO 0.25 0.30 -0.21 0.00 -1.16 0.00 0.00 179.01 178.19 1x4p h ARG 28 N 0.47 -0.16 0.00 2.33 3.08 -1.65 0.30 114.38 118.75 1x4p h ARG 28 Ca 0.33 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.38 1x4p h ARG 28 Cb 0.40 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 1x4p h ARG 28 CO -0.30 -0.11 -0.04 1.15 -1.07 0.00 0.00 179.97 179.60 1x4p h THR 29 N -0.17 0.16 0.00 2.04 2.02 -1.51 -1.90 112.91 113.56 1x4p h THR 29 Ca 0.17 -0.40 -0.06 0.00 0.77 0.00 0.00 66.41 66.89 1x4p h THR 29 Cb 0.43 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 1x4p h THR 29 CO -0.44 0.04 -0.66 -0.07 0.37 0.00 0.00 175.52 174.77 1x4p h LEU 30 N 0.00 0.00 -1.41 2.58 3.38 0.38 -3.32 115.31 116.92 1x4p h LEU 30 Ca -0.00 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.14 1x4p h LEU 30 Cb 0.33 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.01 1x4p h LEU 30 CO 0.01 0.26 0.58 -0.07 0.09 0.00 0.00 178.44 179.30 1x4p h LEU 31 N 0.00 0.52 -0.98 1.67 3.38 0.23 0.11 115.31 120.24 1x4p h LEU 31 Ca -0.03 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 1x4p h LEU 31 Cb 1.22 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 1x4p h LEU 31 CO 0.03 0.23 -0.01 0.11 0.09 0.00 0.00 178.44 178.90 1x4p h LYS 32 N 0.53 0.73 0.00 1.13 1.57 -1.70 -1.75 116.57 117.08 1x4p h LYS 32 Ca 0.45 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1x4p h LYS 32 Cb 0.95 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.17 1x4p h LYS 32 CO -0.19 0.74 0.00 0.39 -0.57 0.00 0.00 179.45 179.82 1x4p n GLU 33 N -4.23 0.05 -3.64 3.15 1.02 0.39 -4.65 120.64 112.74 1x4p n GLU 33 Ca 0.02 0.40 -0.36 0.00 -0.02 0.00 0.00 57.16 57.21 1x4p n GLU 33 Cb 0.29 -1.62 -0.06 0.00 -0.02 0.00 0.00 31.44 30.04 1x4p n GLU 33 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1x4p s ASP 34 N -3.34 6.62 0.28 1.62 2.15 -0.66 -5.00 116.67 118.34 1x4p s ASP 34 Ca 0.03 0.74 0.06 0.00 0.43 0.00 0.00 52.55 53.81 1x4p s ASP 34 Cb 0.06 -2.16 0.40 0.00 -0.30 0.00 0.00 42.92 40.92 1x4p s ASP 34 CO 0.20 0.26 1.66 1.55 -0.17 0.00 0.00 175.17 178.67 1x4p h PRO 35 N 4.19 0.25 -0.15 4.34 0.13 -1.84 -2.94 132.00 135.99 1x4p h PRO 35 Ca -0.51 -0.13 0.04 0.00 -0.87 0.00 0.00 66.00 64.54 1x4p h PRO 35 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1x4p h PRO 35 CO 0.64 0.66 0.14 0.00 -0.23 0.00 0.00 178.00 179.21 1x4p h ALA 36 N 1.32 1.86 -1.61 -0.56 0.00 -1.94 -2.44 119.26 115.89 1x4p h ALA 36 Ca 0.01 -0.01 -0.64 0.00 0.00 0.00 0.00 54.91 54.28 1x4p h ALA 36 Cb 0.89 0.01 -0.38 0.00 0.00 0.00 0.00 17.79 18.31 1x4p h ALA 36 CO 0.07 -0.22 -0.27 0.66 0.00 0.00 0.00 179.25 179.49 1x4p n TYR 37 N -4.02 3.46 0.12 0.00 4.01 -1.11 -4.75 117.16 114.88 1x4p n TYR 37 Ca 0.01 -3.17 -0.01 0.00 -0.16 0.00 0.00 57.90 54.57 1x4p n TYR 37 Cb 0.26 -0.46 0.05 0.00 -0.31 0.00 0.00 39.34 38.89 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 2.88 0.00 -0.16 -0.72 5.08 -1.55 -3.19 115.95 118.29 1x4p h TRP 38 Ca 0.32 0.00 0.01 0.00 1.08 0.00 0.00 58.89 60.30 1x4p h TRP 38 Cb 0.62 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.77 1x4p h TRP 38 CO 0.93 0.67 0.11 0.27 -1.28 0.00 0.00 178.44 179.13 1x4p h PHE 39 N 0.00 0.16 -0.90 0.12 -5.15 -1.86 -2.83 116.94 106.48 1x4p h PHE 39 Ca -0.01 0.00 0.23 0.00 -0.20 0.00 0.00 57.97 58.00 1x4p h PHE 39 Cb 1.39 -0.05 -0.17 0.00 0.22 0.00 0.00 35.95 37.34 1x4p h PHE 39 CO 0.00 0.10 -0.03 1.28 -2.00 0.00 0.00 178.31 177.65 1x4p n LEU 40 N -4.51 -0.15 -0.04 2.10 4.77 -1.21 0.15 117.00 118.10 1x4p n LEU 40 Ca -0.00 1.53 -0.14 0.00 -0.03 0.00 0.00 56.01 57.37 1x4p n LEU 40 Cb 0.11 -0.54 -0.03 0.00 -2.33 0.00 0.00 43.42 40.64 1x4p n LEU 40 CO 0.34 -1.54 0.39 -1.28 -1.33 0.00 0.00 177.39 173.98 1x4p h SER 41 N 0.00 0.89 -4.11 -1.43 0.87 -1.75 -3.44 113.55 104.57 1x4p h SER 41 Ca 0.52 -0.51 -0.47 0.00 -1.23 0.00 0.00 61.79 60.10 1x4p h SER 41 Cb 1.02 -0.26 0.03 0.00 -0.44 0.00 0.00 62.40 62.75 1x4p h SER 41 CO -0.86 1.30 0.38 -0.62 -0.53 0.00 0.00 176.83 176.49 1x4p s ASP 42 N -6.99 6.33 0.00 6.23 -1.08 0.39 -4.97 116.67 116.57 1x4p s ASP 42 Ca -0.10 1.83 0.00 0.00 -0.52 0.00 0.00 52.55 53.77 1x4p s ASP 42 Cb 0.10 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 39.01 1x4p s ASP 42 CO 0.89 -0.79 0.00 -0.62 0.52 0.00 0.00 175.17 175.17 1x4p n GLU 43 N -1.22 1.91 -0.47 4.34 1.02 -1.26 -4.75 120.64 120.21 1x4p n GLU 43 Ca 0.09 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.17 1x4p n GLU 43 Cb 0.53 -0.85 0.02 0.00 -0.02 0.00 0.00 31.44 31.12 1x4p n GLU 43 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1x4p n ASN 44 N -1.74 4.72 -2.81 1.62 4.13 -1.26 -4.72 115.26 115.20 1x4p n ASN 44 Ca 0.00 -2.50 -0.11 0.00 1.68 0.00 0.00 54.58 53.65 1x4p n ASN 44 Cb 0.35 -0.89 -0.02 0.00 -1.54 0.00 0.00 39.78 37.67 1x4p n ASN 44 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1x4p n SER 45 N 0.74 2.12 -0.13 6.41 3.41 -1.26 -5.09 113.62 119.82 1x4p n SER 45 Ca 0.11 -1.81 -0.27 0.00 -0.26 0.00 0.00 58.87 56.64 1x4p n SER 45 Cb 0.60 0.20 -0.11 0.00 -0.26 0.00 0.00 64.21 64.64 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 2.17 -0.02 1.04 -0.00 -1.26 -3.79 117.00 115.13 1x4p n LEU 46 Ca -0.06 0.25 0.19 0.00 -0.00 0.00 0.00 56.01 56.39 1x4p n LEU 46 Cb 0.23 -0.86 0.66 0.00 -0.00 0.00 0.00 43.42 43.45 1x4p n LEU 46 CO 0.12 0.63 1.19 -0.33 -0.00 0.00 0.00 177.39 179.00 1x4p h GLU 47 N -0.78 0.06 0.00 1.96 5.08 -1.97 0.21 114.58 119.14 1x4p h GLU 47 Ca -0.65 -0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 57.60 1x4p h GLU 47 Cb 1.66 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.88 1x4p h GLU 47 CO -0.33 0.04 -0.70 -0.92 -1.00 0.00 0.00 179.01 176.10 1x4p h TYR 48 N 0.07 0.00 0.00 4.33 5.03 -1.83 -3.26 116.97 121.31 1x4p h TYR 48 Ca 0.26 0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.53 1x4p h TYR 48 Cb 0.97 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 39.24 1x4p h TYR 48 CO -0.00 0.49 -0.20 0.87 -1.32 0.00 0.00 178.16 178.00 1x4p h LYS 49 N 0.00 0.00 0.02 1.82 1.57 -0.69 -2.85 116.57 116.44 1x4p h LYS 49 Ca -0.04 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1x4p h LYS 49 Cb 1.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.71 1x4p h LYS 49 CO 0.06 0.20 -0.01 1.88 -0.57 0.00 0.00 179.45 181.00 1x4p h TYR 50 N 0.00 -0.03 -1.35 -1.35 -1.99 -1.56 -0.65 116.97 110.05 1x4p h TYR 50 Ca -0.00 -0.00 0.41 0.00 2.00 0.00 0.00 58.73 61.14 1x4p h TYR 50 Cb 0.40 0.01 -0.10 0.00 2.00 0.00 0.00 36.73 39.04 1x4p h TYR 50 CO 0.00 0.14 0.91 -0.92 -0.00 0.00 0.00 178.16 178.28 1x4p h TYR 51 N -1.00 0.38 0.03 4.88 3.20 -1.59 1.11 116.97 123.96 1x4p h TYR 51 Ca -0.00 0.02 -0.30 0.00 3.14 0.00 0.00 58.73 61.58 1x4p h TYR 51 Cb 0.18 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.31 1x4p h TYR 51 CO 0.04 -0.09 -1.74 0.87 -1.64 0.00 0.00 178.16 175.60 1x4p h LYS 52 N 0.12 0.06 0.00 1.82 1.79 -1.60 -3.27 116.57 115.48 1x4p h LYS 52 Ca 0.75 -0.10 -0.00 0.00 -2.18 0.00 0.00 60.65 59.12 1x4p h LYS 52 Cb 2.50 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 33.19 1x4p h LYS 52 CO -0.26 0.66 -0.00 1.25 -1.08 0.00 0.00 179.45 180.02 1x4p h LEU 53 N 0.02 -0.00 -1.98 2.94 7.12 0.20 -2.50 115.31 121.10 1x4p h LEU 53 Ca -0.30 0.00 0.35 0.00 0.13 0.00 0.00 57.88 58.06 1x4p h LEU 53 Cb 2.01 0.00 -0.05 0.00 -0.53 0.00 0.00 40.66 42.09 1x4p h LEU 53 CO 0.08 0.13 0.87 0.50 -0.13 0.00 0.00 178.44 179.90 1x4p h LYS 54 N -0.27 0.01 -0.01 1.25 1.63 0.66 0.21 116.57 120.06 1x4p h LYS 54 Ca -0.00 -0.00 -0.09 0.00 -0.85 0.00 0.00 60.65 59.71 1x4p h LYS 54 Cb 0.00 -0.00 0.01 0.00 -0.60 0.00 0.00 32.23 31.64 1x4p h LYS 54 CO 0.00 0.01 -0.34 1.25 -3.45 0.00 0.00 179.45 176.92 1x4p h LEU 55 N 0.01 0.31 -0.67 5.20 5.85 -1.61 -0.25 115.31 124.15 1x4p h LEU 55 Ca 0.58 -0.75 0.03 0.00 0.84 0.00 0.00 57.88 58.58 1x4p h LEU 55 Cb 2.32 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 43.21 1x4p h LEU 55 CO -0.02 1.02 0.42 0.00 -0.34 0.00 0.00 178.44 179.53 1x4p h ALA 56 N 0.30 0.88 -0.08 1.25 0.00 -0.16 0.34 119.26 121.78 1x4p h ALA 56 Ca -0.04 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.66 1x4p h ALA 56 Cb 1.07 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.64 1x4p h ALA 56 CO 0.07 0.20 -0.69 1.05 0.00 0.00 0.00 179.25 179.88 1x4p h GLU 57 N 0.84 0.60 0.00 0.00 4.11 -1.26 -1.84 114.58 117.03 1x4p h GLU 57 Ca 0.27 -0.55 -0.02 0.00 0.07 0.00 0.00 59.36 59.14 1x4p h GLU 57 Cb -0.00 0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 1x4p h GLU 57 CO -0.10 1.16 -0.07 0.52 0.07 0.00 0.00 179.01 180.60 1x4p h MET 58 N 0.23 0.00 0.00 1.06 2.86 -0.78 -1.45 114.93 116.85 1x4p h MET 58 Ca -0.06 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.48 1x4p h MET 58 Cb 1.35 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.99 1x4p h MET 58 CO 0.14 0.07 -0.53 1.96 1.06 0.00 0.00 176.91 179.61 1x4p h GLN 59 N 0.00 0.00 -0.76 1.72 4.20 -0.27 -3.36 115.11 116.64 1x4p h GLN 59 Ca -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1x4p h GLN 59 Cb 0.45 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.19 1x4p h GLN 59 CO 0.01 0.90 0.43 0.07 -0.67 0.00 0.00 178.83 179.57 1x4p h ARG 60 N -1.00 1.03 -5.28 1.46 0.11 -1.29 -3.40 114.38 106.02 1x4p h ARG 60 Ca -0.14 -0.10 -0.62 0.00 0.10 0.00 0.00 59.98 59.22 1x4p h ARG 60 Cb 1.05 -0.21 -0.13 0.00 1.11 0.00 0.00 29.97 31.78 1x4p h ARG 60 CO -0.09 0.74 -0.14 -1.12 0.10 0.00 0.00 179.97 179.46 1x4p s SER 61 N -6.37 6.35 0.23 0.08 0.01 -0.55 -5.05 113.70 108.40 1x4p s SER 61 Ca -0.11 0.42 0.05 0.00 1.31 0.00 0.00 55.95 57.62 1x4p s SER 61 Cb 0.17 -2.24 -0.02 0.00 0.21 0.00 0.00 66.02 64.14 1x4p s SER 61 CO 0.80 -0.20 0.18 0.61 0.41 0.00 0.00 173.24 175.03 1x4p n GLY 62 N 4.44 3.30 3.61 3.44 0.00 -1.26 -4.70 105.19 114.02 1x4p n GLY 62 Ca -0.07 -1.84 -0.43 0.00 0.00 0.00 0.00 46.02 43.69 1x4p n GLY 62 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4p s PRO 63 N -2.92 3.61 0.00 1.61 0.04 -1.26 -3.83 135.00 132.24 1x4p s PRO 63 Ca 0.26 1.49 0.00 0.00 0.04 0.00 0.00 61.00 62.78 1x4p s PRO 63 Cb 0.01 -4.09 0.00 0.00 0.04 0.00 0.00 34.50 30.46 1x4p s PRO 63 CO 0.18 -1.53 0.00 0.45 0.04 0.00 0.00 177.00 176.15 1x4p n SER 64 N 9.14 0.00 -1.16 6.66 2.88 -1.26 -4.87 113.62 125.02 1x4p n SER 64 Ca 0.20 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.74 1x4p n SER 64 Cb 0.46 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.92 1x4p n SER 64 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1x4p n SER 65 N 3.42 -6.55 0.00 -3.46 2.88 -1.25 -5.22 113.62 103.44 1x4p n SER 65 Ca 0.00 0.89 0.00 0.00 -1.33 0.00 0.00 58.87 58.43 1x4p n SER 65 Cb 0.00 -3.10 0.00 0.00 -0.75 0.00 0.00 64.21 60.36 1x4p n SER 65 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42