#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4p s SER 2 N 0.00 5.95 -0.36 1.61 0.15 -1.26 -5.04 113.70 114.75 1x4p s SER 2 Ca 0.00 0.00 0.00 0.00 0.70 0.00 0.00 55.95 56.65 1x4p s SER 2 Cb 0.00 -2.10 0.12 0.00 -1.71 0.00 0.00 66.02 62.33 1x4p s SER 2 CO 0.00 -0.02 0.16 -0.44 1.20 0.00 0.00 173.24 174.14 1x4p s SER 3 N 1.56 3.74 -0.20 5.45 0.01 -1.26 -5.11 113.70 117.90 1x4p s SER 3 Ca 0.07 -2.04 -0.12 0.00 1.31 0.00 0.00 55.95 55.17 1x4p s SER 3 Cb -0.15 -0.84 -0.05 0.00 0.21 0.00 0.00 66.02 65.19 1x4p s SER 3 CO 0.09 -0.35 0.24 -0.83 0.41 0.00 0.00 173.24 172.79 1x4p s GLY 4 N 1.13 2.09 0.72 3.44 0.00 -1.26 -5.09 107.32 108.35 1x4p s GLY 4 Ca 0.14 -0.63 -0.06 0.00 0.00 0.00 0.00 44.72 44.16 1x4p s GLY 4 CO -0.13 0.42 1.02 -0.45 0.00 0.00 0.00 173.10 173.96 1x4p s SER 5 N 0.69 4.58 -0.23 1.64 0.15 -1.26 -4.95 113.70 114.33 1x4p s SER 5 Ca 0.13 0.25 -0.41 0.00 0.70 0.00 0.00 55.95 56.61 1x4p s SER 5 Cb -0.13 -0.81 -0.18 0.00 -1.71 0.00 0.00 66.02 63.20 1x4p s SER 5 CO 0.03 -1.73 1.52 -1.20 1.20 0.00 0.00 173.24 173.06 1x4p n SER 6 N -2.95 1.53 -3.68 5.45 7.64 -1.26 -4.94 113.62 115.41 1x4p n SER 6 Ca 0.10 1.13 -0.13 0.00 1.01 0.00 0.00 58.87 60.98 1x4p n SER 6 Cb 0.60 -1.04 -0.13 0.00 -1.01 0.00 0.00 64.21 62.64 1x4p n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1x4p s GLY 7 N 2.25 -0.15 -0.43 0.23 0.00 -1.26 -5.02 107.32 102.93 1x4p s GLY 7 Ca 0.97 1.03 0.04 0.00 0.00 0.00 0.00 44.72 46.76 1x4p s GLY 7 CO 0.65 1.86 1.82 3.33 0.00 0.00 0.00 173.10 180.77 1x4p n VAL 8 N 5.09 3.10 0.11 1.40 0.24 -1.26 -4.50 118.33 122.50 1x4p n VAL 8 Ca -0.11 -2.24 -0.19 0.00 -2.04 0.00 0.00 64.34 59.76 1x4p n VAL 8 Cb 0.51 -0.51 -0.15 0.00 -1.47 0.00 0.00 33.84 32.22 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 1.11 0.42 1.43 7.63 0.00 -2.00 -3.02 103.07 108.63 1x4p h GLY 9 Ca 0.54 -1.06 -0.16 0.00 0.00 0.00 0.00 47.33 46.65 1x4p h GLY 9 CO 0.99 0.93 -0.52 -0.84 0.00 0.00 0.00 176.54 177.11 1x4p h THR 10 N 0.10 1.31 0.62 4.70 2.02 -1.99 -3.25 112.91 116.42 1x4p h THR 10 Ca -0.20 -1.74 -0.03 0.00 0.77 0.00 0.00 66.41 65.21 1x4p h THR 10 Cb 2.05 1.70 0.01 0.00 -1.74 0.00 0.00 68.15 70.17 1x4p h THR 10 CO 0.22 0.55 -0.30 0.40 0.37 0.00 0.00 175.52 176.76 1x4p h ILE 11 N 0.47 0.10 -1.25 3.11 2.04 -1.87 0.18 117.51 120.29 1x4p h ILE 11 Ca 0.02 -0.38 0.44 0.00 1.00 0.00 0.00 64.86 65.94 1x4p h ILE 11 Cb 1.06 0.14 -0.13 0.00 -0.74 0.00 0.00 36.82 37.15 1x4p h ILE 11 CO 0.10 0.02 0.79 -0.67 0.00 0.00 0.00 178.15 178.39 1x4p n ASP 12 N -5.34 0.21 -0.08 1.72 -0.08 -1.14 -0.04 116.55 111.80 1x4p n ASP 12 Ca -0.11 1.32 -0.19 0.00 -1.51 0.00 0.00 54.79 54.30 1x4p n ASP 12 Cb 0.34 -0.65 -0.12 0.00 2.34 0.00 0.00 41.12 43.03 1x4p n ASP 12 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 1x4p h GLN 13 N 0.00 0.02 0.04 -0.67 4.20 -1.57 -3.33 115.11 113.80 1x4p h GLN 13 Ca 0.82 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 59.50 1x4p h GLN 13 Cb 2.58 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 30.34 1x4p h GLN 13 CO -0.47 1.02 -0.41 1.25 -0.67 0.00 0.00 178.83 179.55 1x4p h LEU 14 N -0.94 -1.25 -0.92 1.46 5.85 0.27 -2.04 115.31 117.73 1x4p h LEU 14 Ca -0.23 0.14 0.19 0.00 0.84 0.00 0.00 57.88 58.82 1x4p h LEU 14 Cb 1.25 0.47 -0.17 0.00 0.37 0.00 0.00 40.66 42.57 1x4p h LEU 14 CO -0.12 -0.41 -0.20 0.58 -0.34 0.00 0.00 178.44 177.96 1x4p h VAL 15 N -0.54 0.08 -1.06 1.05 2.07 -1.06 0.95 116.25 117.75 1x4p h VAL 15 Ca 0.00 -0.00 0.28 0.00 0.82 0.00 0.00 66.70 67.80 1x4p h VAL 15 Cb 0.56 0.08 -0.10 0.00 -1.52 0.00 0.00 31.29 30.31 1x4p h VAL 15 CO -0.25 0.00 0.67 0.07 0.02 0.00 0.00 177.57 178.08 1x4p h LYS 16 N 0.00 0.38 0.00 1.57 2.10 -1.48 -2.05 116.57 117.09 1x4p h LYS 16 Ca 0.46 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 59.08 1x4p h LYS 16 Cb 0.73 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 1x4p h LYS 16 CO -0.94 0.25 0.00 0.54 -2.00 0.00 0.00 179.45 177.31 1x4p n ARG 17 N -4.68 0.00 -0.15 0.07 1.74 0.33 -2.22 116.66 111.74 1x4p n ARG 17 Ca 0.27 0.41 0.25 0.00 -0.77 0.00 0.00 57.85 58.01 1x4p n ARG 17 Cb 0.91 -1.29 0.40 0.00 -1.02 0.00 0.00 32.46 31.46 1x4p n ARG 17 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 1x4p h VAL 18 N 0.00 0.01 0.02 1.55 -1.51 -1.35 0.99 116.25 115.96 1x4p h VAL 18 Ca 0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1x4p h VAL 18 Cb 0.00 0.02 0.00 0.00 -2.13 0.00 0.00 31.29 29.18 1x4p h VAL 18 CO 0.00 0.00 -0.01 0.40 -1.23 0.00 0.00 177.57 176.73 1x4p h ILE 19 N 0.00 1.47 -0.00 7.19 1.08 -1.22 -3.28 117.51 122.75 1x4p h ILE 19 Ca 0.43 -1.63 0.00 0.00 -0.39 0.00 0.00 64.86 63.28 1x4p h ILE 19 Cb 2.79 2.54 0.00 0.00 -3.07 0.00 0.00 36.82 39.09 1x4p h ILE 19 CO -0.00 0.41 -0.28 -0.62 -0.69 0.00 0.00 178.15 176.96 1x4p n GLU 20 N -4.76 0.03 -0.70 2.37 1.02 0.27 -4.91 120.64 113.95 1x4p n GLU 20 Ca -0.09 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 1x4p n GLU 20 Cb 0.34 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 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 1.49 1.13 0.55 0.62 0.00 0.27 -4.83 105.19 104.42 1x4p n GLY 21 Ca 0.06 0.00 0.31 0.00 0.00 0.00 0.00 46.02 46.39 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 -4.85 1.61 2.88 -1.23 -4.18 113.62 107.85 1x4p n SER 22 Ca 0.00 0.78 -0.34 0.00 -1.33 0.00 0.00 58.87 57.97 1x4p n SER 22 Cb 0.00 -0.29 -0.06 0.00 -0.75 0.00 0.00 64.21 63.11 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 -6.59 4.21 0.90 2.46 2.34 -1.26 -5.09 118.68 115.66 1x4p s LEU 23 Ca -0.03 0.32 -0.12 0.00 0.06 0.00 0.00 54.13 54.37 1x4p s LEU 23 Cb 0.15 -2.33 0.09 0.00 -0.56 0.00 0.00 46.19 43.55 1x4p s LEU 23 CO 0.52 0.31 0.90 -1.20 -1.06 0.00 0.00 176.35 175.83 1x4p n SER 24 N 1.37 -0.34 0.17 1.48 7.64 -1.26 -4.91 113.62 117.78 1x4p n SER 24 Ca -0.14 0.43 0.02 0.00 1.01 0.00 0.00 58.87 60.19 1x4p n SER 24 Cb 0.53 -1.39 0.31 0.00 -1.01 0.00 0.00 64.21 62.65 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 -1.54 0.00 0.01 1.43 0.13 -1.98 -3.00 132.00 127.05 1x4p h PRO 25 Ca -0.44 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.48 1x4p h PRO 25 Cb 1.28 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.39 1x4p h PRO 25 CO 0.40 0.44 -1.03 -0.22 -0.23 0.00 0.00 178.00 177.36 1x4p h LYS 26 N 0.00 0.02 -0.96 0.86 1.63 -2.01 -3.29 116.57 112.82 1x4p h LYS 26 Ca -0.00 -0.03 0.04 0.00 -0.85 0.00 0.00 60.65 59.80 1x4p h LYS 26 Cb 0.83 0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 32.41 1x4p h LYS 26 CO 0.06 1.01 0.63 0.93 -3.45 0.00 0.00 179.45 178.63 1x4p h GLU 27 N 0.01 1.17 -0.01 1.90 4.39 -1.89 -2.32 114.58 117.83 1x4p h GLU 27 Ca -0.02 -0.07 0.03 0.00 0.34 0.00 0.00 59.36 59.63 1x4p h GLU 27 Cb 1.79 -0.26 -0.03 0.00 -0.10 0.00 0.00 28.75 30.14 1x4p h GLU 27 CO 0.13 0.77 -0.15 0.00 -1.16 0.00 0.00 179.01 178.60 1x4p h ARG 28 N 1.20 -0.24 0.00 2.33 3.08 -1.62 -0.35 114.38 118.77 1x4p h ARG 28 Ca 0.39 0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.44 1x4p h ARG 28 Cb 0.03 0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.13 1x4p h ARG 28 CO -0.12 -0.16 -0.04 1.15 -1.07 0.00 0.00 179.97 179.73 1x4p h THR 29 N -0.25 0.88 0.00 2.04 2.02 -1.61 -0.95 112.91 115.03 1x4p h THR 29 Ca 0.05 -0.14 -0.11 0.00 0.77 0.00 0.00 66.41 66.99 1x4p h THR 29 Cb 0.32 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 1x4p h THR 29 CO -0.16 0.04 -0.51 -0.07 0.37 0.00 0.00 175.52 175.19 1x4p h LEU 30 N 0.00 0.00 -1.01 2.58 3.38 -0.71 -3.24 115.31 116.30 1x4p h LEU 30 Ca -0.00 0.00 0.21 0.00 0.09 0.00 0.00 57.88 58.18 1x4p h LEU 30 Cb 0.07 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.71 1x4p h LEU 30 CO 0.01 0.51 0.61 -0.07 0.09 0.00 0.00 178.44 179.59 1x4p h LEU 31 N 0.00 0.75 -0.92 1.67 3.38 0.34 0.23 115.31 120.76 1x4p h LEU 31 Ca -0.01 0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 1x4p h LEU 31 Cb 1.21 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 1x4p h LEU 31 CO 0.07 0.22 -0.08 0.11 0.09 0.00 0.00 178.44 178.85 1x4p h LYS 32 N 0.70 0.70 0.00 1.13 1.57 -1.67 -1.89 116.57 117.12 1x4p h LYS 32 Ca 0.60 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 1x4p h LYS 32 Cb 1.01 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.25 1x4p h LYS 32 CO -0.41 0.77 0.00 0.39 -0.57 0.00 0.00 179.45 179.63 1x4p n GLU 33 N -4.19 0.08 -3.93 3.15 1.02 0.79 -4.66 120.64 112.91 1x4p n GLU 33 Ca 0.01 0.25 -0.33 0.00 -0.02 0.00 0.00 57.16 57.07 1x4p n GLU 33 Cb 0.33 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.20 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 -2.75 6.26 0.31 1.62 2.15 -0.71 -5.01 116.67 118.54 1x4p s ASP 34 Ca 0.08 0.31 0.09 0.00 0.43 0.00 0.00 52.55 53.46 1x4p s ASP 34 Cb 0.07 -1.94 0.49 0.00 -0.30 0.00 0.00 42.92 41.24 1x4p s ASP 34 CO 0.17 0.26 1.70 1.55 -0.17 0.00 0.00 175.17 178.68 1x4p h PRO 35 N 3.84 0.09 -0.06 4.34 0.13 -1.83 -2.93 132.00 135.58 1x4p h PRO 35 Ca -0.49 -0.05 0.02 0.00 -0.87 0.00 0.00 66.00 64.61 1x4p h PRO 35 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 1x4p h PRO 35 CO 0.68 0.55 0.05 0.00 -0.23 0.00 0.00 178.00 179.05 1x4p h ALA 36 N 1.44 1.88 -1.43 -0.56 0.00 -1.95 -2.54 119.26 116.10 1x4p h ALA 36 Ca 0.00 -0.00 -0.64 0.00 0.00 0.00 0.00 54.91 54.27 1x4p h ALA 36 Cb 0.87 0.00 -0.38 0.00 0.00 0.00 0.00 17.79 18.29 1x4p h ALA 36 CO 0.07 -0.08 -0.24 0.66 0.00 0.00 0.00 179.25 179.65 1x4p n TYR 37 N -4.25 3.34 0.05 0.00 4.01 -1.11 -4.75 117.16 114.44 1x4p n TYR 37 Ca -0.01 -2.96 -0.10 0.00 -0.16 0.00 0.00 57.90 54.66 1x4p n TYR 37 Cb 0.15 -0.40 0.03 0.00 -0.31 0.00 0.00 39.34 38.82 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 2.74 0.55 -0.47 -0.72 5.08 -1.55 -3.07 115.95 118.51 1x4p h TRP 38 Ca 0.36 -0.24 0.14 0.00 1.08 0.00 0.00 58.89 60.23 1x4p h TRP 38 Cb 0.66 -0.09 -0.02 0.00 -3.00 0.00 0.00 29.16 26.71 1x4p h TRP 38 CO 0.92 0.99 0.34 0.27 -1.28 0.00 0.00 178.44 179.68 1x4p h PHE 39 N 0.29 0.00 -0.93 0.12 -5.15 -1.86 -2.64 116.94 106.76 1x4p h PHE 39 Ca -0.03 0.00 0.15 0.00 -0.20 0.00 0.00 57.97 57.90 1x4p h PHE 39 Cb 1.27 0.00 -0.16 0.00 0.22 0.00 0.00 35.95 37.29 1x4p h PHE 39 CO 0.04 0.00 -0.33 1.28 -2.00 0.00 0.00 178.31 177.30 1x4p n LEU 40 N -4.38 -0.53 -0.18 2.10 4.77 -1.16 0.86 117.00 118.47 1x4p n LEU 40 Ca 0.08 1.62 -0.10 0.00 -0.03 0.00 0.00 56.01 57.58 1x4p n LEU 40 Cb 0.55 -0.40 0.02 0.00 -2.33 0.00 0.00 43.42 41.26 1x4p n LEU 40 CO 0.36 -1.48 0.74 0.28 -1.33 0.00 0.00 177.39 175.97 1x4p h SER 41 N 0.00 1.02 -4.18 -1.43 0.02 -1.71 -3.44 113.55 103.84 1x4p h SER 41 Ca 0.36 -0.34 -0.50 0.00 -0.84 0.00 0.00 61.79 60.46 1x4p h SER 41 Cb 0.59 -0.28 0.08 0.00 0.14 0.00 0.00 62.40 62.93 1x4p h SER 41 CO -0.93 1.14 0.38 -0.62 -1.14 0.00 0.00 176.83 175.66 1x4p s ASP 42 N -6.66 5.55 0.00 3.07 2.15 0.25 -4.98 116.67 116.05 1x4p s ASP 42 Ca -0.11 1.93 0.00 0.00 0.43 0.00 0.00 52.55 54.80 1x4p s ASP 42 Cb 0.13 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.20 1x4p s ASP 42 CO 0.86 -1.33 0.00 -0.62 -0.17 0.00 0.00 175.17 173.92 1x4p n GLU 43 N -2.04 1.91 -1.16 4.34 1.02 -1.26 -4.79 120.64 118.66 1x4p n GLU 43 Ca 0.10 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 57.05 1x4p n GLU 43 Cb 0.52 -0.84 -0.05 0.00 -0.02 0.00 0.00 31.44 31.05 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 -1.71 6.12 -3.15 1.62 5.15 -1.26 -4.75 115.26 117.29 1x4p n ASN 44 Ca 0.00 -2.96 -0.18 0.00 -0.60 0.00 0.00 54.58 50.84 1x4p n ASN 44 Cb 0.34 -1.22 -0.05 0.00 -0.53 0.00 0.00 39.78 38.31 1x4p n ASN 44 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1x4p n SER 45 N 1.14 0.89 -0.10 1.20 3.41 -1.26 -5.09 113.62 113.81 1x4p n SER 45 Ca 0.39 -2.61 -0.22 0.00 -0.26 0.00 0.00 58.87 56.18 1x4p n SER 45 Cb 0.63 0.84 -0.12 0.00 -0.26 0.00 0.00 64.21 65.30 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 2.54 0.10 1.04 -0.00 -1.26 -3.66 117.00 115.76 1x4p n LEU 46 Ca -0.03 0.12 0.09 0.00 -0.00 0.00 0.00 56.01 56.19 1x4p n LEU 46 Cb 0.45 -0.95 0.56 0.00 -0.00 0.00 0.00 43.42 43.48 1x4p n LEU 46 CO 0.24 0.76 1.13 -0.33 -0.00 0.00 0.00 177.39 179.19 1x4p h GLU 47 N -0.32 0.23 0.00 1.96 3.07 -1.96 -0.53 114.58 117.02 1x4p h GLU 47 Ca -0.54 -0.01 -0.09 0.00 -0.50 0.00 0.00 59.36 58.22 1x4p h GLU 47 Cb 1.80 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 29.65 1x4p h GLU 47 CO -0.13 0.15 -0.55 -0.92 -1.40 0.00 0.00 179.01 176.15 1x4p h TYR 48 N 0.23 0.00 0.00 4.33 5.03 -1.82 -3.24 116.97 121.50 1x4p h TYR 48 Ca 0.12 0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.37 1x4p h TYR 48 Cb 0.18 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.45 1x4p h TYR 48 CO -0.00 0.39 -0.25 0.87 -1.32 0.00 0.00 178.16 177.84 1x4p h LYS 49 N 0.00 0.00 0.01 1.82 1.57 -1.16 -2.93 116.57 115.87 1x4p h LYS 49 Ca -0.02 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1x4p h LYS 49 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.63 1x4p h LYS 49 CO 0.05 0.25 -0.00 1.88 -0.57 0.00 0.00 179.45 181.06 1x4p h TYR 50 N 0.00 -0.01 -1.46 -1.35 -1.99 -1.56 -0.66 116.97 109.94 1x4p h TYR 50 Ca -0.00 -0.00 0.46 0.00 2.00 0.00 0.00 58.73 61.18 1x4p h TYR 50 Cb 0.49 0.00 -0.11 0.00 2.00 0.00 0.00 36.73 39.11 1x4p h TYR 50 CO 0.00 0.07 0.98 -0.92 -0.00 0.00 0.00 178.16 178.30 1x4p h TYR 51 N -1.00 0.35 0.09 4.88 3.20 -1.59 0.80 116.97 123.71 1x4p h TYR 51 Ca -0.00 0.02 -0.34 0.00 3.14 0.00 0.00 58.73 61.54 1x4p h TYR 51 Cb 0.09 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 1x4p h TYR 51 CO 0.02 -0.13 -1.88 0.87 -1.64 0.00 0.00 178.16 175.40 1x4p h LYS 52 N 0.06 0.19 0.00 1.82 1.79 -1.62 -3.30 116.57 115.52 1x4p h LYS 52 Ca 0.82 -0.33 0.00 0.00 -2.18 0.00 0.00 60.65 58.96 1x4p h LYS 52 Cb 2.81 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 33.58 1x4p h LYS 52 CO -0.28 1.01 0.00 -0.11 -1.08 0.00 0.00 179.45 178.98 1x4p n LEU 53 N -3.36 0.29 -0.57 2.94 -0.00 0.22 -2.26 117.00 114.25 1x4p n LEU 53 Ca -0.26 0.54 0.46 0.00 -0.00 0.00 0.00 56.01 56.75 1x4p n LEU 53 Cb 1.05 -0.44 0.78 0.00 -0.00 0.00 0.00 43.42 44.81 1x4p n LEU 53 CO 0.44 -0.44 1.41 0.50 -0.00 0.00 0.00 177.39 179.31 1x4p h LYS 54 N 0.00 0.02 -0.08 1.96 1.63 0.05 0.92 116.57 121.05 1x4p h LYS 54 Ca 0.00 -0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.67 1x4p h LYS 54 Cb 0.00 -0.00 0.01 0.00 -0.60 0.00 0.00 32.23 31.63 1x4p h LYS 54 CO 0.00 0.01 -0.43 1.25 -3.45 0.00 0.00 179.45 176.83 1x4p h LEU 55 N 0.02 0.53 -0.40 5.20 5.85 -1.64 -0.55 115.31 124.31 1x4p h LEU 55 Ca 0.82 -0.65 -0.04 0.00 0.84 0.00 0.00 57.88 58.85 1x4p h LEU 55 Cb 3.20 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 44.06 1x4p h LEU 55 CO -0.07 1.09 0.07 0.00 -0.34 0.00 0.00 178.44 179.20 1x4p h ALA 56 N 0.45 0.53 0.00 1.25 0.00 0.12 0.40 119.26 122.00 1x4p h ALA 56 Ca -0.03 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 1x4p h ALA 56 Cb 1.09 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1x4p h ALA 56 CO 0.09 0.23 -0.53 1.05 0.00 0.00 0.00 179.25 180.09 1x4p h GLU 57 N 0.50 0.00 0.00 0.00 4.11 -1.15 -2.47 114.58 115.57 1x4p h GLU 57 Ca 0.12 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.36 1x4p h GLU 57 Cb 0.35 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.57 1x4p h GLU 57 CO 0.01 0.53 -1.02 0.52 0.07 0.00 0.00 179.01 179.11 1x4p h MET 58 N 0.00 0.00 -0.15 1.06 2.86 -0.84 -3.32 114.93 114.54 1x4p h MET 58 Ca -0.01 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.42 1x4p h MET 58 Cb 1.01 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.68 1x4p h MET 58 CO 0.07 0.75 -0.74 1.96 1.06 0.00 0.00 176.91 180.01 1x4p h GLN 59 N 0.00 0.76 0.00 1.72 4.20 -0.09 -2.97 115.11 118.74 1x4p h GLN 59 Ca -0.06 -0.62 0.00 0.00 0.06 0.00 0.00 58.65 58.03 1x4p h GLN 59 Cb 1.70 0.13 0.00 0.00 0.30 0.00 0.00 27.48 29.61 1x4p h GLN 59 CO 0.10 1.23 0.00 2.89 -0.67 0.00 0.00 178.83 182.38 1x4p n ARG 60 N -3.98 0.09 -3.58 1.46 1.85 -0.94 -4.41 116.66 107.14 1x4p n ARG 60 Ca -0.08 0.48 -0.40 0.00 -1.00 0.00 0.00 57.85 56.85 1x4p n ARG 60 Cb 0.73 -1.73 -0.11 0.00 -1.05 0.00 0.00 32.46 30.29 1x4p n ARG 60 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1x4p s SER 61 N -3.62 5.82 0.02 2.89 0.15 -1.12 -4.86 113.70 112.99 1x4p s SER 61 Ca 0.02 -0.64 0.02 0.00 0.70 0.00 0.00 55.95 56.04 1x4p s SER 61 Cb 0.06 -2.07 -0.02 0.00 -1.71 0.00 0.00 66.02 62.28 1x4p s SER 61 CO 0.20 -0.28 -0.06 -0.83 1.20 0.00 0.00 173.24 173.47 1x4p s GLY 62 N 1.64 0.37 0.22 9.45 0.00 -1.22 -4.96 107.32 112.82 1x4p s GLY 62 Ca 0.05 -0.55 0.22 0.00 0.00 0.00 0.00 44.72 44.44 1x4p s GLY 62 CO 0.08 -0.58 1.67 -1.55 0.00 0.00 0.00 173.10 172.73 1x4p n PRO 63 N 1.97 0.17 0.00 2.90 -0.04 -1.26 -4.30 135.00 134.44 1x4p n PRO 63 Ca -0.20 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.66 1x4p n PRO 63 Cb 0.56 -1.82 0.00 0.00 -0.04 0.00 0.00 33.50 32.20 1x4p n PRO 63 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x4p n SER 64 N -2.13 0.00 -4.67 3.54 2.88 -1.26 -5.07 113.62 106.91 1x4p n SER 64 Ca 0.02 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.14 1x4p n SER 64 Cb 0.22 0.04 -0.03 0.00 -0.75 0.00 0.00 64.21 63.68 1x4p n SER 64 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1x4p s SER 65 N -3.92 7.06 0.00 -3.46 1.04 -1.26 -5.24 113.70 107.92 1x4p s SER 65 Ca 0.00 1.31 0.00 0.00 0.48 0.00 0.00 55.95 57.74 1x4p s SER 65 Cb 0.00 -2.50 0.00 0.00 0.10 0.00 0.00 66.02 63.62 1x4p s SER 65 CO 0.00 -0.48 0.39 0.61 0.98 0.00 0.00 173.24 174.75