#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ntk n PRO 3 N 0.00 3.51 -4.40 0.00 -0.02 -1.26 -5.06 135.00 127.78 1ntk n PRO 3 Ca 0.00 0.00 -0.25 0.00 -2.02 0.00 0.00 63.50 61.23 1ntk n PRO 3 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 33.50 33.38 1ntk n PRO 3 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1ntk s THR 4 N 0.00 2.78 0.09 3.45 2.01 -1.26 -5.01 115.64 117.71 1ntk s THR 4 Ca 0.00 -2.12 -0.30 0.00 0.31 0.00 0.00 61.69 59.57 1ntk s THR 4 Cb 0.00 -2.44 -0.14 0.00 0.01 0.00 0.00 72.50 69.94 1ntk s THR 4 CO 0.00 -0.31 1.62 0.25 -0.69 0.00 0.00 174.62 175.50 1ntk h LEU 5 N 2.43 -0.85 -1.33 4.42 6.46 -1.98 0.50 115.31 124.96 1ntk h LEU 5 Ca -0.43 0.07 0.06 0.00 -0.12 0.00 0.00 57.88 57.46 1ntk h LEU 5 Cb 1.24 0.28 -0.05 0.00 -0.73 0.00 0.00 40.66 41.40 1ntk h LEU 5 CO 0.57 -0.47 0.50 0.71 -0.62 0.00 0.00 178.44 179.14 1ntk h THR 6 N -0.70 1.03 0.67 1.05 1.35 -1.98 0.11 112.91 114.45 1ntk h THR 6 Ca -0.03 -0.28 -0.03 0.00 -0.55 0.00 0.00 66.41 65.52 1ntk h THR 6 Cb 0.62 0.15 0.01 0.00 -1.73 0.00 0.00 68.15 67.19 1ntk h THR 6 CO -0.03 0.15 -0.32 0.00 -0.25 0.00 0.00 175.52 175.06 1ntk h ALA 7 N 1.59 -1.06 -0.95 6.62 0.00 -1.85 -0.73 119.26 122.88 1ntk h ALA 7 Ca 0.33 -0.20 0.20 0.00 0.00 0.00 0.00 54.91 55.24 1ntk h ALA 7 Cb 0.24 0.35 -0.08 0.00 0.00 0.00 0.00 17.79 18.29 1ntk h ALA 7 CO -0.11 -1.00 0.61 0.00 0.00 0.00 0.00 179.25 178.75 1ntk h ARG 8 N -1.04 0.53 -0.52 0.00 3.08 -0.74 -0.26 114.38 115.43 1ntk h ARG 8 Ca -0.09 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 59.87 1ntk h ARG 8 Cb 0.69 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.60 1ntk h ARG 8 CO 0.15 0.35 0.10 1.25 -1.07 0.00 0.00 179.97 180.75 1ntk h LEU 9 N 0.54 0.82 0.14 3.04 6.46 -0.65 -2.72 115.31 122.94 1ntk h LEU 9 Ca 0.51 -0.25 -0.01 0.00 -0.12 0.00 0.00 57.88 58.01 1ntk h LEU 9 Cb 1.08 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 40.79 1ntk h LEU 9 CO -0.25 0.86 -0.07 0.22 -0.62 0.00 0.00 178.44 178.59 1ntk h TYR 10 N 0.75 -0.18 0.11 1.25 3.20 0.50 -2.36 116.97 120.24 1ntk h TYR 10 Ca 0.16 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.05 1ntk h TYR 10 Cb 0.38 0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.67 1ntk h TYR 10 CO 0.03 0.02 -0.30 0.77 -1.64 0.00 0.00 178.16 177.03 1ntk h SER 11 N -0.35 -0.88 1.39 -2.11 0.02 -1.38 0.14 113.55 110.39 1ntk h SER 11 Ca -0.02 0.10 -0.05 0.00 -0.84 0.00 0.00 61.79 60.98 1ntk h SER 11 Cb 0.28 0.34 -0.01 0.00 0.14 0.00 0.00 62.40 63.14 1ntk h SER 11 CO 0.03 -0.39 -0.24 -0.07 -1.14 0.00 0.00 176.83 175.02 1ntk h LEU 12 N -0.52 0.00 0.00 5.07 3.38 -1.56 -3.41 115.31 118.28 1ntk h LEU 12 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1ntk h LEU 12 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1ntk h LEU 12 CO -0.19 0.24 -0.13 0.18 0.09 0.00 0.00 178.44 178.64 1ntk n LEU 13 N -3.24 0.00 -0.03 1.67 4.77 -0.89 -4.93 117.00 114.35 1ntk n LEU 13 Ca 0.02 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.89 1ntk n LEU 13 Cb 0.55 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.50 1ntk n LEU 13 CO 0.35 0.00 -0.64 0.49 -1.33 0.00 0.00 177.39 176.26 1ntk n PHE 14 N -0.58 0.92 0.03 -1.77 3.72 -0.38 -0.41 117.46 119.00 1ntk n PHE 14 Ca 0.00 0.31 -0.15 0.00 -0.05 0.00 0.00 57.45 57.56 1ntk n PHE 14 Cb 0.05 -1.16 -0.09 0.00 -0.94 0.00 0.00 39.48 37.33 1ntk n PHE 14 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1ntk h ARG 15 N 0.01 -0.59 -6.30 -1.08 2.43 -1.26 -3.41 114.38 104.18 1ntk h ARG 15 Ca -0.34 0.04 -0.54 0.00 -0.81 0.00 0.00 59.98 58.33 1ntk h ARG 15 Cb 2.04 0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 31.69 1ntk h ARG 15 CO 0.07 -0.39 0.23 1.03 -1.51 0.00 0.00 179.97 179.40 1ntk s ARG 16 N -5.58 4.53 0.54 0.20 0.52 -1.26 -4.92 118.95 112.98 1ntk s ARG 16 Ca -0.15 1.18 0.36 0.00 -0.52 0.00 0.00 55.73 56.60 1ntk s ARG 16 Cb 0.06 -3.41 1.93 0.00 0.52 0.00 0.00 34.95 34.05 1ntk s ARG 16 CO 0.58 0.12 2.11 1.15 0.02 0.00 0.00 175.30 179.28 1ntk h THR 17 N 4.46 0.00 0.11 0.02 2.02 -1.91 0.30 112.91 117.91 1ntk h THR 17 Ca -0.42 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 66.70 1ntk h THR 17 Cb 1.21 0.89 0.00 0.00 -1.74 0.00 0.00 68.15 68.50 1ntk h THR 17 CO 0.73 0.00 -0.05 0.28 0.37 0.00 0.00 175.52 176.85 1ntk h SER 18 N 0.00 -0.13 -0.88 4.18 0.02 -1.92 -1.61 113.55 113.22 1ntk h SER 18 Ca 0.00 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 1ntk h SER 18 Cb 0.06 0.03 -0.05 0.00 0.14 0.00 0.00 62.40 62.58 1ntk h SER 18 CO 0.00 -0.06 0.58 0.71 -1.14 0.00 0.00 176.83 176.92 1ntk h THR 19 N -0.21 1.18 -0.17 -2.27 1.35 -1.72 0.50 112.91 111.57 1ntk h THR 19 Ca -0.02 -0.39 0.05 0.00 -0.55 0.00 0.00 66.41 65.51 1ntk h THR 19 Cb 0.12 -0.06 -0.06 0.00 -1.73 0.00 0.00 68.15 66.42 1ntk h THR 19 CO 0.03 0.21 -0.22 0.15 -0.25 0.00 0.00 175.52 175.44 1ntk h PHE 20 N 1.14 -0.57 -0.35 4.73 3.57 0.24 0.54 116.94 126.23 1ntk h PHE 20 Ca 0.34 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.73 1ntk h PHE 20 Cb -0.04 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 1ntk h PHE 20 CO -0.00 -0.30 -0.32 0.00 -2.23 0.00 0.00 178.31 175.46 1ntk h ALA 21 N 0.76 0.52 -0.73 2.41 0.00 -0.55 -2.88 119.26 118.79 1ntk h ALA 21 Ca 0.11 -0.43 0.10 0.00 0.00 0.00 0.00 54.91 54.70 1ntk h ALA 21 Cb 0.43 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.03 1ntk h ALA 21 CO -0.32 0.57 0.36 1.25 0.00 0.00 0.00 179.25 181.11 1ntk h LEU 22 N 0.64 0.45 -0.90 0.00 5.85 0.51 -1.32 115.31 120.53 1ntk h LEU 22 Ca 0.06 0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.91 1ntk h LEU 22 Cb 0.91 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.87 1ntk h LEU 22 CO 0.08 0.25 0.57 0.74 -0.34 0.00 0.00 178.44 179.74 1ntk h THR 23 N 0.59 1.07 0.00 1.05 2.02 0.26 -1.30 112.91 116.60 1ntk h THR 23 Ca 0.37 -0.36 -0.17 0.00 0.77 0.00 0.00 66.41 67.02 1ntk h THR 23 Cb 0.42 -0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.73 1ntk h THR 23 CO -0.29 0.19 -0.80 0.16 0.37 0.00 0.00 175.52 175.15 1ntk h ILE 24 N 1.05 1.56 -0.02 3.11 3.07 -1.06 0.37 117.51 125.59 1ntk h ILE 24 Ca 0.39 -2.74 -0.19 0.00 1.55 0.00 0.00 64.86 63.87 1ntk h ILE 24 Cb 0.15 2.48 -0.01 0.00 -0.27 0.00 0.00 36.82 39.17 1ntk h ILE 24 CO -0.17 0.78 -0.83 0.58 -1.05 0.00 0.00 178.15 177.46 1ntk h VAL 25 N 0.00 1.45 -0.21 0.16 2.07 -1.09 0.75 116.25 119.38 1ntk h VAL 25 Ca -0.01 -2.45 -0.17 0.00 0.82 0.00 0.00 66.70 64.89 1ntk h VAL 25 Cb 1.42 2.35 -0.00 0.00 -1.52 0.00 0.00 31.29 33.53 1ntk h VAL 25 CO 0.10 0.72 -0.57 0.58 0.02 0.00 0.00 177.57 178.42 1ntk h VAL 26 N 0.15 1.31 0.00 2.57 2.07 -1.19 -3.06 116.25 118.10 1ntk h VAL 26 Ca -0.04 -1.81 0.00 0.00 0.82 0.00 0.00 66.70 65.67 1ntk h VAL 26 Cb 1.43 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 32.96 1ntk h VAL 26 CO 0.13 0.57 0.00 1.23 0.02 0.00 0.00 177.57 179.52 1ntk h GLY 27 N 0.94 0.00 1.31 2.17 0.00 -0.07 -3.27 103.07 104.15 1ntk h GLY 27 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.03 1ntk h GLY 27 CO 0.11 0.00 -1.48 0.00 0.00 0.00 0.00 176.54 175.18 1ntk h ALA 28 N 2.13 0.24 0.17 3.60 0.00 -0.80 -2.95 119.26 121.65 1ntk h ALA 28 Ca 0.00 -1.07 -0.01 0.00 0.00 0.00 0.00 54.91 53.84 1ntk h ALA 28 Cb 0.77 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 1ntk h ALA 28 CO 0.00 1.11 -0.09 1.25 0.00 0.00 0.00 179.25 181.51 1ntk h LEU 29 N 0.07 -0.22 -1.28 0.00 5.85 -1.59 -0.29 115.31 117.85 1ntk h LEU 29 Ca -0.22 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.44 1ntk h LEU 29 Cb 2.01 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 43.09 1ntk h LEU 29 CO 0.17 -0.15 -0.35 -0.26 -0.34 0.00 0.00 178.44 177.51 1ntk h PHE 30 N -0.25 0.00 -0.12 1.25 -1.00 -1.70 -2.92 116.94 112.20 1ntk h PHE 30 Ca -0.02 0.00 -0.21 0.00 2.81 0.00 0.00 57.97 60.55 1ntk h PHE 30 Cb 0.20 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.77 1ntk h PHE 30 CO -0.07 0.35 -0.73 0.35 -1.61 0.00 0.00 178.31 176.59 1ntk h PHE 31 N 0.00 0.97 -0.90 -0.55 3.57 -1.30 -2.13 116.94 116.59 1ntk h PHE 31 Ca -0.00 -0.44 -0.01 0.00 3.53 0.00 0.00 57.97 61.05 1ntk h PHE 31 Cb 0.66 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.22 1ntk h PHE 31 CO 0.00 1.26 0.53 1.49 -2.23 0.00 0.00 178.31 179.37 1ntk h GLU 32 N 0.40 1.22 0.44 1.11 4.81 -0.91 0.44 114.58 122.09 1ntk h GLU 32 Ca -0.06 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.04 1ntk h GLU 32 Cb 1.37 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1ntk h GLU 32 CO 0.15 0.86 -0.21 -0.09 -0.73 0.00 0.00 179.01 178.99 1ntk h ARG 33 N 1.24 -0.56 -0.29 1.92 9.65 -1.53 -2.18 114.38 122.63 1ntk h ARG 33 Ca 0.32 0.04 -0.07 0.00 -1.10 0.00 0.00 59.98 59.17 1ntk h ARG 33 Cb -0.04 0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.65 1ntk h ARG 33 CO -0.06 -0.26 -0.11 0.00 2.80 0.00 0.00 179.97 182.35 1ntk h ALA 34 N -0.65 1.28 -0.11 2.80 0.00 -1.30 -1.80 119.26 119.47 1ntk h ALA 34 Ca -0.06 -0.26 -0.19 0.00 0.00 0.00 0.00 54.91 54.40 1ntk h ALA 34 Cb 0.57 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1ntk h ALA 34 CO 0.10 0.48 -0.72 0.35 0.00 0.00 0.00 179.25 179.45 1ntk h PHE 35 N 0.45 0.71 -0.20 0.00 3.57 -1.00 -2.25 116.94 118.21 1ntk h PHE 35 Ca 0.09 -0.31 -0.10 0.00 3.53 0.00 0.00 57.97 61.18 1ntk h PHE 35 Cb 0.46 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1ntk h PHE 35 CO 0.01 1.08 -0.32 -0.44 -2.23 0.00 0.00 178.31 176.42 1ntk h ASP 36 N 0.37 0.41 0.00 0.41 3.45 -1.10 -1.52 116.42 118.43 1ntk h ASP 36 Ca -0.03 -0.15 0.00 0.00 0.43 0.00 0.00 57.03 57.28 1ntk h ASP 36 Cb 1.31 -0.11 0.00 0.00 -0.56 0.00 0.00 39.33 39.97 1ntk h ASP 36 CO 0.13 0.71 0.00 0.00 -1.57 0.00 0.00 179.24 178.52 1ntk n GLN 37 N -4.09 0.00 -0.34 3.56 1.13 -0.70 -1.95 117.38 114.98 1ntk n GLN 37 Ca -0.01 0.43 0.22 0.00 -1.94 0.00 0.00 57.00 55.70 1ntk n GLN 37 Cb 0.44 -1.31 0.45 0.00 0.11 0.00 0.00 30.24 29.93 1ntk n GLN 37 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1ntk h GLY 38 N 0.00 1.77 0.63 1.08 0.00 -1.51 -0.89 103.07 104.16 1ntk h GLY 38 Ca 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 47.33 47.04 1ntk h GLY 38 CO 0.00 -0.30 -0.30 0.00 0.00 0.00 0.00 176.54 175.93 1ntk h ALA 39 N 1.73 -0.91 -0.71 3.60 0.00 -1.32 -0.90 119.26 120.76 1ntk h ALA 39 Ca 0.67 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 55.51 1ntk h ALA 39 Cb 1.50 0.33 -0.08 0.00 0.00 0.00 0.00 17.79 19.54 1ntk h ALA 39 CO -0.47 -0.85 0.30 -0.44 0.00 0.00 0.00 179.25 177.79 1ntk h ASP 40 N -1.15 0.31 -0.49 0.00 3.32 -1.14 0.12 116.42 117.39 1ntk h ASP 40 Ca -0.09 0.09 0.08 0.00 0.02 0.00 0.00 57.03 57.13 1ntk h ASP 40 Cb 0.65 0.05 -0.07 0.00 0.22 0.00 0.00 39.33 40.19 1ntk h ASP 40 CO 0.14 0.16 0.12 0.00 -1.72 0.00 0.00 179.24 177.94 1ntk h ALA 41 N 1.48 0.57 -0.69 3.45 0.00 -1.15 0.23 119.26 123.15 1ntk h ALA 41 Ca 0.37 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.35 1ntk h ALA 41 Cb 0.49 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 1ntk h ALA 41 CO -0.34 -0.29 0.34 0.82 0.00 0.00 0.00 179.25 179.78 1ntk h ILE 42 N 0.26 1.22 -0.46 0.00 1.08 0.20 0.11 117.51 119.92 1ntk h ILE 42 Ca 0.25 -0.60 -0.09 0.00 -0.39 0.00 0.00 64.86 64.03 1ntk h ILE 42 Cb 0.31 0.32 -0.02 0.00 -3.07 0.00 0.00 36.82 34.37 1ntk h ILE 42 CO -0.30 0.25 -0.09 0.22 -0.69 0.00 0.00 178.15 177.54 1ntk h TYR 43 N 0.97 0.90 0.07 1.37 5.03 0.14 -2.91 116.97 122.53 1ntk h TYR 43 Ca 0.24 -0.16 -0.00 0.00 2.58 0.00 0.00 58.73 61.39 1ntk h TYR 43 Cb 0.08 -0.23 0.00 0.00 1.55 0.00 0.00 36.73 38.13 1ntk h TYR 43 CO 0.01 0.87 -0.03 0.93 -1.32 0.00 0.00 178.16 178.62 1ntk h GLU 44 N 0.75 -0.08 -1.13 1.82 5.08 -0.29 -3.19 114.58 117.54 1ntk h GLU 44 Ca 0.13 0.01 0.32 0.00 -1.00 0.00 0.00 59.36 58.81 1ntk h GLU 44 Cb 0.58 0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.75 1ntk h GLU 44 CO 0.04 0.50 0.74 1.25 -1.00 0.00 0.00 179.01 180.54 1ntk h HIS 45 N -0.84 0.52 -0.01 4.33 2.76 -1.01 1.02 115.15 121.92 1ntk h HIS 45 Ca -0.01 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 1ntk h HIS 45 Cb 0.62 -0.15 0.00 0.00 1.55 0.00 0.00 27.41 29.44 1ntk h HIS 45 CO 0.14 -0.00 -0.08 1.51 -1.30 0.00 0.00 177.93 178.19 1ntk n ILE 46 N -4.56 0.00 0.00 6.26 3.06 -1.10 -4.82 119.36 118.20 1ntk n ILE 46 Ca 0.28 -0.17 0.00 0.00 -2.50 0.00 0.00 62.75 60.36 1ntk n ILE 46 Cb 1.06 0.32 0.00 0.00 0.54 0.00 0.00 39.64 41.56 1ntk n ILE 46 CO 0.00 0.00 0.00 0.59 -2.50 0.00 0.00 176.55 174.64 1ntk n ASN 47 N -0.29 0.00 0.00 9.51 3.02 0.35 -5.06 115.26 122.79 1ntk n ASN 47 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 1ntk n ASN 47 Cb 0.32 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.49 1ntk n ASN 47 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ntk n GLU 48 N 0.00 0.00 -2.03 3.52 1.02 -1.19 -4.97 120.64 116.99 1ntk n GLU 48 Ca 0.00 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 56.89 1ntk n GLU 48 Cb 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 31.44 1ntk n GLU 48 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ntk n GLY 49 N -1.85 6.34 0.00 0.62 0.00 -1.26 -4.97 105.19 104.07 1ntk n GLY 49 Ca 0.00 -2.66 0.00 0.00 0.00 0.00 0.00 46.02 43.36 1ntk n GLY 49 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ntk n LYS 50 N -0.70 0.46 -0.01 1.61 5.02 -1.26 -4.99 118.16 118.29 1ntk n LYS 50 Ca 0.44 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.75 1ntk n LYS 50 Cb 0.92 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.95 1ntk n LYS 50 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1ntk n LEU 51 N 0.00 1.45 0.02 -0.35 -0.00 -1.26 -4.45 117.00 112.41 1ntk n LEU 51 Ca 0.00 -1.25 -0.01 0.00 -0.00 0.00 0.00 56.01 54.74 1ntk n LEU 51 Cb 0.00 -0.01 -0.01 0.00 -0.00 0.00 0.00 43.42 43.40 1ntk n LEU 51 CO 0.00 0.34 0.16 -0.50 -0.00 0.00 0.00 177.39 177.40 1ntk h TRP 52 N 0.45 -0.07 0.00 1.96 4.06 -1.99 -3.14 115.95 117.23 1ntk h TRP 52 Ca 0.00 -0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1ntk h TRP 52 Cb 0.21 0.02 0.00 0.00 -1.00 0.00 0.00 29.16 28.39 1ntk h TRP 52 CO 0.01 -0.04 0.00 1.63 -3.56 0.00 0.00 178.44 176.48 1ntk n LYS 53 N -2.49 0.01 0.07 0.49 5.02 -1.26 -1.92 118.16 118.09 1ntk n LYS 53 Ca -0.01 0.35 -0.07 0.00 -2.02 0.00 0.00 58.31 56.56 1ntk n LYS 53 Cb 0.03 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.46 1ntk n LYS 53 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1ntk h HIS 54 N 0.00 0.05 -0.06 2.13 3.86 -1.78 -3.37 115.15 115.98 1ntk h HIS 54 Ca 0.00 -0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.20 1ntk h HIS 54 Cb 0.13 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.57 1ntk h HIS 54 CO 0.00 0.96 -0.07 0.82 0.86 0.00 0.00 177.93 180.50 1ntk h ILE 55 N 0.01 0.80 -0.96 2.45 2.04 -1.33 -2.98 117.51 117.54 1ntk h ILE 55 Ca -0.02 0.00 0.29 0.00 1.00 0.00 0.00 64.86 66.13 1ntk h ILE 55 Cb 1.67 0.80 -0.05 0.00 -0.74 0.00 0.00 36.82 38.50 1ntk h ILE 55 CO 0.13 0.00 0.67 0.29 0.00 0.00 0.00 178.15 179.24 1ntk n LYS 56 N -5.20 -0.01 0.10 2.37 5.02 -1.26 0.24 118.16 119.43 1ntk n LYS 56 Ca -0.05 0.61 -0.03 0.00 -2.02 0.00 0.00 58.31 56.81 1ntk n LYS 56 Cb 0.12 -1.33 0.03 0.00 -0.02 0.00 0.00 35.03 33.83 1ntk n LYS 56 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1ntk h HIS 57 N 0.00 0.00 -2.26 2.13 3.86 -1.80 -3.40 115.15 113.68 1ntk h HIS 57 Ca 0.49 0.00 -0.58 0.00 -1.16 0.00 0.00 60.37 59.12 1ntk h HIS 57 Cb 1.87 0.00 -0.42 0.00 1.06 0.00 0.00 27.41 29.92 1ntk h HIS 57 CO -0.00 0.78 -0.69 1.63 0.86 0.00 0.00 177.93 180.51 1ntk n LYS 58 N -3.51 3.00 0.15 2.45 4.01 0.67 -4.78 118.16 120.14 1ntk n LYS 58 Ca -0.00 -4.72 0.04 0.00 -0.51 0.00 0.00 58.31 53.12 1ntk n LYS 58 Cb 0.78 -2.19 0.04 0.00 -0.51 0.00 0.00 35.03 33.15 1ntk n LYS 58 CO 0.00 0.00 0.00 0.10 -1.11 0.00 0.00 177.40 176.39 1ntk h TYR 59 N 3.04 0.00 0.00 2.13 -0.00 -1.78 -3.41 116.97 116.95 1ntk h TYR 59 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.86 1ntk h TYR 59 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.28 1ntk h TYR 59 CO 0.80 0.43 0.00 0.39 -0.00 0.00 0.00 178.16 179.77 1ntk n GLU 60 N -3.18 0.00 0.00 0.10 1.02 -1.26 -5.21 120.64 112.10 1ntk n GLU 60 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1ntk n GLU 60 Cb 0.71 -0.39 0.00 0.00 -0.02 0.00 0.00 31.44 31.74 1ntk n GLU 60 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40