#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oct n LEU 6 N 0.00 0.00 -0.25 -2.12 7.94 -1.26 -2.91 117.00 118.40 1oct n LEU 6 Ca 0.00 0.27 0.06 0.00 -1.11 0.00 0.00 56.01 55.23 1oct n LEU 6 Cb 0.00 0.00 0.18 0.00 0.53 0.00 0.00 43.42 44.13 1oct n LEU 6 CO 0.00 0.00 0.92 -0.08 -1.11 0.00 0.00 177.39 177.12 1oct h GLU 7 N 0.00 0.23 -0.98 1.96 4.81 -2.05 -1.21 114.58 117.33 1oct h GLU 7 Ca 0.00 -0.01 0.27 0.00 -0.13 0.00 0.00 59.36 59.48 1oct h GLU 7 Cb 0.00 -0.05 -0.18 0.00 0.63 0.00 0.00 28.75 29.14 1oct h GLU 7 CO 0.00 0.15 0.00 -1.91 -0.73 0.00 0.00 179.01 176.52 1oct n GLU 8 N -5.19 -0.08 0.07 1.92 2.13 -1.21 0.93 120.64 119.21 1oct n GLU 8 Ca 0.14 1.48 -0.18 0.00 0.66 0.00 0.00 57.16 59.26 1oct n GLU 8 Cb 0.47 -2.34 -0.10 0.00 0.27 0.00 0.00 31.44 29.75 1oct n GLU 8 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1oct h LEU 9 N 0.00 0.74 -0.54 4.31 5.85 -1.12 -1.96 115.31 122.59 1oct h LEU 9 Ca 0.59 -0.64 0.11 0.00 0.84 0.00 0.00 57.88 58.78 1oct h LEU 9 Cb 1.19 -0.23 -0.10 0.00 0.37 0.00 0.00 40.66 41.89 1oct h LEU 9 CO -0.93 1.45 -0.10 -0.08 -0.34 0.00 0.00 178.44 178.44 1oct h GLU 10 N 0.28 0.03 0.27 1.25 4.57 0.13 -1.20 114.58 119.90 1oct h GLU 10 Ca -0.13 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.03 1oct h GLU 10 Cb 1.75 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 30.34 1oct h GLU 10 CO 0.20 0.02 -0.13 1.96 -1.18 0.00 0.00 179.01 179.88 1oct h GLN 11 N 0.03 -0.35 -0.93 1.92 1.08 -0.79 -3.21 115.11 112.86 1oct h GLN 11 Ca 0.27 0.02 0.27 0.00 -1.45 0.00 0.00 58.65 57.76 1oct h GLN 11 Cb 0.41 0.08 -0.16 0.00 -0.05 0.00 0.00 27.48 27.76 1oct h GLN 11 CO -0.53 -0.03 0.28 0.35 -0.95 0.00 0.00 178.83 177.94 1oct h PHE 12 N -0.97 0.41 -0.05 2.96 3.57 -1.15 0.55 116.94 122.26 1oct h PHE 12 Ca -0.04 0.05 0.03 0.00 3.53 0.00 0.00 57.97 61.55 1oct h PHE 12 Cb 0.48 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 1oct h PHE 12 CO 0.05 -0.28 -0.20 0.00 -2.23 0.00 0.00 178.31 175.64 1oct h ALA 13 N 1.86 -0.22 0.64 2.41 0.00 -1.29 -0.60 119.26 122.05 1oct h ALA 13 Ca 0.62 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.52 1oct h ALA 13 Cb 1.34 0.37 0.01 0.00 0.00 0.00 0.00 17.79 19.51 1oct h ALA 13 CO -0.71 -0.69 -0.31 -0.22 0.00 0.00 0.00 179.25 177.32 1oct h LYS 14 N -0.30 -0.82 -1.00 0.00 3.11 0.04 -1.44 116.57 116.16 1oct h LYS 14 Ca 0.07 0.06 0.23 0.00 -2.81 0.00 0.00 60.65 58.20 1oct h LYS 14 Cb 0.40 0.19 -0.10 0.00 -1.00 0.00 0.00 32.23 31.72 1oct h LYS 14 CO -0.22 -0.55 0.63 1.79 -2.81 0.00 0.00 179.45 178.29 1oct h THR 15 N -0.86 0.61 -0.53 1.00 1.35 -1.24 0.35 112.91 113.59 1oct h THR 15 Ca -0.09 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 1oct h THR 15 Cb 0.65 0.04 -0.03 0.00 -1.73 0.00 0.00 68.15 67.09 1oct h THR 15 CO 0.14 0.10 0.33 0.15 -0.25 0.00 0.00 175.52 175.99 1oct h PHE 16 N 0.53 0.69 -1.00 4.73 3.57 -0.82 -0.58 116.94 124.06 1oct h PHE 16 Ca 0.57 0.00 0.02 0.00 3.53 0.00 0.00 57.97 62.10 1oct h PHE 16 Cb 1.23 -0.23 -0.05 0.00 2.79 0.00 0.00 35.95 39.69 1oct h PHE 16 CO -0.00 0.46 0.66 -0.22 -2.23 0.00 0.00 178.31 176.97 1oct h LYS 17 N 0.71 1.28 0.09 1.11 3.64 0.77 -0.73 116.57 123.44 1oct h LYS 17 Ca 0.19 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1oct h LYS 17 Cb -0.04 -0.29 0.00 0.00 -0.41 0.00 0.00 32.23 31.49 1oct h LYS 17 CO -0.04 0.84 -0.04 1.96 -2.27 0.00 0.00 179.45 179.91 1oct h GLN 18 N 1.31 -0.11 -0.86 1.90 4.20 -0.67 -2.54 115.11 118.35 1oct h GLN 18 Ca 0.38 0.01 0.17 0.00 0.06 0.00 0.00 58.65 59.27 1oct h GLN 18 Cb -0.09 0.03 -0.16 0.00 0.30 0.00 0.00 27.48 27.55 1oct h GLN 18 CO -0.10 -0.07 -0.23 0.00 -0.67 0.00 0.00 178.83 177.76 1oct h ARG 19 N -0.14 -0.01 -0.06 1.46 3.08 -1.14 0.00 114.38 117.57 1oct h ARG 19 Ca -0.01 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.08 1oct h ARG 19 Cb 0.09 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.08 1oct h ARG 19 CO 0.02 -0.00 -0.36 -0.09 -1.07 0.00 0.00 179.97 178.46 1oct h ARG 20 N -0.01 -0.46 -0.27 0.04 2.43 -1.16 -0.10 114.38 114.84 1oct h ARG 20 Ca 0.41 0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.46 1oct h ARG 20 Cb 0.63 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 1oct h ARG 20 CO -0.89 -0.31 -0.44 0.97 -1.51 0.00 0.00 179.97 177.80 1oct h ILE 21 N -0.48 1.29 -0.06 1.20 6.09 -0.88 -2.62 117.51 122.06 1oct h ILE 21 Ca 0.07 -1.62 0.02 0.00 -1.37 0.00 0.00 64.86 61.96 1oct h ILE 21 Cb 0.59 1.55 -0.03 0.00 0.47 0.00 0.00 36.82 39.41 1oct h ILE 21 CO -0.33 0.52 -0.08 0.11 -3.07 0.00 0.00 178.15 175.30 1oct h LYS 22 N 0.56 -0.11 0.00 2.19 6.56 -0.62 0.56 116.57 125.70 1oct h LYS 22 Ca 0.04 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.64 1oct h LYS 22 Cb 0.98 0.03 0.00 0.00 -0.57 0.00 0.00 32.23 32.66 1oct h LYS 22 CO 0.09 -0.08 0.00 1.28 -2.06 0.00 0.00 179.45 178.69 1oct n LEU 23 N -5.21 0.00 -2.74 2.94 4.32 -0.09 -4.76 117.00 111.45 1oct n LEU 23 Ca -0.05 0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.85 1oct n LEU 23 Cb 0.14 0.00 0.04 0.00 -1.62 0.00 0.00 43.42 41.98 1oct n LEU 23 CO 0.27 0.00 0.06 0.61 -1.22 0.00 0.00 177.39 177.11 1oct n GLY 24 N -0.48 -0.65 2.78 -0.72 0.00 0.19 -5.05 105.19 101.26 1oct n GLY 24 Ca 0.01 0.34 -0.17 0.00 0.00 0.00 0.00 46.02 46.20 1oct n GLY 24 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1oct s PHE 25 N -3.24 -0.06 0.68 1.61 0.08 -1.00 -5.03 117.98 111.02 1oct s PHE 25 Ca 0.28 0.41 -0.11 0.00 0.12 0.00 0.00 56.93 57.62 1oct s PHE 25 Cb -0.04 -0.31 -0.00 0.00 -0.57 0.00 0.00 43.02 42.10 1oct s PHE 25 CO 0.54 -0.20 1.08 0.95 -0.10 0.00 0.00 175.22 177.48 1oct s THR 26 N 1.93 3.85 0.46 0.64 -4.23 -1.26 -4.07 115.64 112.95 1oct s THR 26 Ca 0.00 0.60 0.18 0.00 -1.18 0.00 0.00 61.69 61.29 1oct s THR 26 Cb -0.12 -3.59 0.22 0.00 1.34 0.00 0.00 72.50 70.35 1oct s THR 26 CO -0.04 -0.78 2.03 1.56 -0.54 0.00 0.00 174.62 176.85 1oct h GLN 27 N -0.55 0.00 -0.68 3.99 4.20 -1.97 -1.81 115.11 118.29 1oct h GLN 27 Ca -0.45 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.23 1oct h GLN 27 Cb 1.23 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.98 1oct h GLN 27 CO 0.63 0.15 0.30 0.78 -0.67 0.00 0.00 178.83 180.02 1oct h GLY 28 N 0.53 1.06 0.58 3.46 0.00 -1.92 -0.02 103.07 106.76 1oct h GLY 28 Ca -0.00 -0.55 -0.03 0.00 0.00 0.00 0.00 47.33 46.75 1oct h GLY 28 CO 0.02 0.52 -0.26 -0.55 0.00 0.00 0.00 176.54 176.27 1oct h ASP 29 N 0.95 -0.61 -0.99 0.19 3.32 -1.78 -2.80 116.42 114.70 1oct h ASP 29 Ca 0.23 -0.01 0.35 0.00 0.02 0.00 0.00 57.03 57.63 1oct h ASP 29 Cb 0.15 0.16 -0.17 0.00 0.22 0.00 0.00 39.33 39.69 1oct h ASP 29 CO -0.03 -0.21 0.44 0.58 -1.72 0.00 0.00 179.24 178.31 1oct h VAL 30 N -1.16 0.11 0.53 -1.35 2.07 -1.28 0.44 116.25 115.60 1oct h VAL 30 Ca -0.07 -0.04 -0.03 0.00 0.82 0.00 0.00 66.70 67.38 1oct h VAL 30 Cb 0.58 -0.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1oct h VAL 30 CO 0.12 0.02 -0.25 1.23 0.02 0.00 0.00 177.57 178.71 1oct h GLY 31 N 0.11 -0.74 2.00 2.17 0.00 -0.99 -3.19 103.07 102.43 1oct h GLY 31 Ca 0.75 0.27 0.00 0.00 0.00 0.00 0.00 47.33 48.36 1oct h GLY 31 CO -0.74 -0.27 0.00 -2.00 0.00 0.00 0.00 176.54 173.53 1oct h LEU 32 N -0.99 0.00 -0.45 3.11 5.85 -0.44 -2.46 115.31 119.93 1oct h LEU 32 Ca -0.07 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.54 1oct h LEU 32 Cb 0.62 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 1oct h LEU 32 CO 0.12 0.00 -0.14 0.00 -0.34 0.00 0.00 178.44 178.08 1oct h ALA 33 N 2.04 0.62 0.00 1.25 0.00 -0.27 -0.63 119.26 122.26 1oct h ALA 33 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1oct h ALA 33 Cb 0.33 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1oct h ALA 33 CO 0.00 0.54 0.00 0.52 0.00 0.00 0.00 179.25 180.31 1oct h MET 34 N 0.72 0.00 0.68 0.00 2.86 -1.43 -2.57 114.93 115.19 1oct h MET 34 Ca 0.11 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.72 1oct h MET 34 Cb 0.70 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.36 1oct h MET 34 CO 0.05 0.00 -0.32 0.78 1.06 0.00 0.00 176.91 178.48 1oct h GLY 35 N 1.53 -0.95 -2.86 8.32 0.00 -1.05 0.34 103.07 108.41 1oct h GLY 35 Ca 0.00 0.35 -0.04 0.00 0.00 0.00 0.00 47.33 47.64 1oct h GLY 35 CO 0.00 -0.34 0.05 0.58 0.00 0.00 0.00 176.54 176.82 1oct n LYS 36 N -5.43 1.09 0.00 4.80 0.00 -0.98 -1.82 118.16 115.83 1oct n LYS 36 Ca -0.13 -0.19 0.00 0.00 -0.00 0.00 0.00 58.31 58.00 1oct n LYS 36 Cb 0.38 -1.07 0.00 0.00 -0.00 0.00 0.00 35.03 34.34 1oct n LYS 36 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1oct n LEU 37 N 1.16 0.00 0.00 -5.58 7.94 -0.92 -4.97 117.00 114.64 1oct n LEU 37 Ca 0.04 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.94 1oct n LEU 37 Cb 0.52 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.47 1oct n LEU 37 CO 0.04 0.00 0.00 -1.22 -1.11 0.00 0.00 177.39 175.10 1oct n TYR 38 N 0.00 0.00 0.00 1.96 4.01 0.06 -5.04 117.16 118.15 1oct n TYR 38 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1oct n TYR 38 Cb 0.00 0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 1oct n TYR 38 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1oct n GLY 39 N 0.00 1.95 3.67 2.72 0.00 -0.76 -4.99 105.19 107.79 1oct n GLY 39 Ca 0.00 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 1oct n GLY 39 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1oct s ASN 40 N -0.77 7.05 0.57 1.61 3.04 -1.26 -4.83 114.94 120.36 1oct s ASN 40 Ca 0.00 1.30 -0.07 0.00 0.04 0.00 0.00 52.86 54.13 1oct s ASN 40 Cb 0.00 -2.50 -0.01 0.00 -1.54 0.00 0.00 41.25 37.20 1oct s ASN 40 CO 0.00 -0.50 0.91 1.51 -3.04 0.00 0.00 177.10 175.98 1oct s ASP 41 N 1.18 5.91 -0.16 -4.21 1.47 -1.26 -4.34 116.67 115.25 1oct s ASP 41 Ca 0.42 0.97 0.01 0.00 1.18 0.00 0.00 52.55 55.13 1oct s ASP 41 Cb -0.16 -2.05 0.02 0.00 -0.34 0.00 0.00 42.92 40.38 1oct s ASP 41 CO 0.11 -0.90 -0.19 -0.36 0.68 0.00 0.00 175.17 174.51 1oct s PHE 42 N -2.99 2.63 0.96 2.11 0.08 -1.20 -4.95 117.98 114.63 1oct s PHE 42 Ca 0.52 -1.49 -0.12 0.00 0.12 0.00 0.00 56.93 55.96 1oct s PHE 42 Cb -0.11 -1.83 0.10 0.00 -0.57 0.00 0.00 43.02 40.61 1oct s PHE 42 CO 0.47 -0.73 0.70 -1.13 -0.10 0.00 0.00 175.22 174.43 1oct n SER 43 N 4.51 -1.16 -0.09 1.36 3.41 -1.26 -3.97 113.62 116.42 1oct n SER 43 Ca -0.20 0.31 0.05 0.00 -0.26 0.00 0.00 58.87 58.76 1oct n SER 43 Cb 0.50 -1.30 0.39 0.00 -0.26 0.00 0.00 64.21 63.54 1oct n SER 43 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1oct h GLN 44 N -1.80 0.64 -0.18 4.33 -0.00 -1.89 -2.64 115.11 113.57 1oct h GLN 44 Ca -0.45 -0.04 0.05 0.00 -0.00 0.00 0.00 58.65 58.21 1oct h GLN 44 Cb 1.29 -0.14 -0.05 0.00 0.00 0.00 0.00 27.48 28.57 1oct h GLN 44 CO 0.38 0.42 -0.16 1.15 0.00 0.00 0.00 178.83 180.63 1oct h THR 45 N 0.66 0.57 -0.81 2.39 2.02 -1.93 0.98 112.91 116.79 1oct h THR 45 Ca 0.23 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.40 1oct h THR 45 Cb 0.09 0.57 -0.04 0.00 -1.74 0.00 0.00 68.15 67.02 1oct h THR 45 CO -0.06 0.00 0.48 0.74 0.37 0.00 0.00 175.52 177.05 1oct h THR 46 N -0.17 1.23 -0.13 3.16 2.02 -1.82 -0.36 112.91 116.83 1oct h THR 46 Ca 0.11 -0.50 -0.02 0.00 0.77 0.00 0.00 66.41 66.77 1oct h THR 46 Cb 0.34 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 1oct h THR 46 CO -0.28 0.24 0.02 0.40 0.37 0.00 0.00 175.52 176.26 1oct h ILE 47 N 1.11 1.22 -0.10 3.11 1.08 -1.24 -0.42 117.51 122.27 1oct h ILE 47 Ca 0.29 -0.71 0.02 0.00 -0.39 0.00 0.00 64.86 64.07 1oct h ILE 47 Cb -0.04 1.44 -0.02 0.00 -3.07 0.00 0.00 36.82 35.14 1oct h ILE 47 CO -0.05 0.21 -0.01 -1.28 -0.69 0.00 0.00 178.15 176.32 1oct h SER 48 N -0.01 -0.07 -0.51 1.72 0.87 -0.47 -1.27 113.55 113.81 1oct h SER 48 Ca 0.04 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.62 1oct h SER 48 Cb 0.30 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.29 1oct h SER 48 CO 0.00 -0.02 0.29 0.03 -0.53 0.00 0.00 176.83 176.60 1oct h ARG 49 N 0.02 0.72 -0.54 2.24 3.08 -0.98 -0.57 114.38 118.35 1oct h ARG 49 Ca 0.05 -0.07 -0.11 0.00 0.07 0.00 0.00 59.98 59.91 1oct h ARG 49 Cb 0.06 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1oct h ARG 49 CO -0.09 0.53 -0.10 0.35 -1.07 0.00 0.00 179.97 179.60 1oct h PHE 50 N 0.73 1.14 -0.51 3.04 3.57 -0.46 0.27 116.94 124.72 1oct h PHE 50 Ca 0.19 -0.23 -0.08 0.00 3.53 0.00 0.00 57.97 61.38 1oct h PHE 50 Cb 0.02 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.46 1oct h PHE 50 CO 0.00 1.05 -0.00 0.93 -2.23 0.00 0.00 178.31 178.06 1oct h GLU 51 N 0.91 0.91 -0.01 1.11 5.08 -0.41 -2.53 114.58 119.64 1oct h GLU 51 Ca 0.14 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1oct h GLU 51 Cb 0.66 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1oct h GLU 51 CO 0.05 0.94 0.00 0.00 -1.00 0.00 0.00 179.01 178.99 1oct n ALA 52 N -2.45 2.58 -2.47 3.43 0.00 -0.30 -4.77 120.51 116.54 1oct n ALA 52 Ca 0.01 -0.11 -0.18 0.00 0.00 0.00 0.00 53.44 53.16 1oct n ALA 52 Cb 0.32 -1.23 -0.01 0.00 0.00 0.00 0.00 19.45 18.54 1oct n ALA 52 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1oct n LEU 53 N -0.69 -1.74 -2.89 0.00 4.32 -0.77 -4.88 117.00 110.35 1oct n LEU 53 Ca 0.11 0.02 -0.35 0.00 -0.02 0.00 0.00 56.01 55.77 1oct n LEU 53 Cb 0.06 -2.69 -0.00 0.00 -1.62 0.00 0.00 43.42 39.17 1oct n LEU 53 CO 0.08 -0.16 1.62 -3.20 -1.22 0.00 0.00 177.39 174.52 1oct n ASN 54 N -1.99 7.18 -3.97 -1.43 5.15 0.89 -4.91 115.26 116.18 1oct n ASN 54 Ca -0.20 -3.54 -0.10 0.00 -0.60 0.00 0.00 54.58 50.14 1oct n ASN 54 Cb 0.66 -1.16 -0.07 0.00 -0.53 0.00 0.00 39.78 38.68 1oct n ASN 54 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1oct s LEU 55 N -3.26 0.74 0.52 1.20 1.43 -1.26 -4.80 118.68 113.26 1oct s LEU 55 Ca 0.53 -0.89 -0.21 0.00 -1.03 0.00 0.00 54.13 52.53 1oct s LEU 55 Cb 0.37 1.35 -0.06 0.00 0.03 0.00 0.00 46.19 47.88 1oct s LEU 55 CO -0.29 -0.96 1.18 -0.94 0.23 0.00 0.00 176.35 175.56 1oct s SER 56 N -2.99 5.74 0.31 2.29 1.04 -1.26 -4.80 113.70 114.04 1oct s SER 56 Ca 0.20 2.32 0.08 0.00 0.48 0.00 0.00 55.95 59.03 1oct s SER 56 Cb 0.02 -2.60 0.82 0.00 0.10 0.00 0.00 66.02 64.36 1oct s SER 56 CO 0.03 -1.21 1.76 0.15 0.98 0.00 0.00 173.24 174.94 1oct h PHE 57 N 1.48 1.03 -0.10 5.02 3.57 -1.98 0.20 116.94 126.15 1oct h PHE 57 Ca -0.50 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.02 1oct h PHE 57 Cb 1.27 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 39.70 1oct h PHE 57 CO 0.51 0.16 -0.00 0.87 -2.23 0.00 0.00 178.31 177.61 1oct h LYS 58 N 0.67 0.18 -0.12 1.11 1.79 -1.98 -0.44 116.57 117.79 1oct h LYS 58 Ca 0.61 -0.06 -0.05 0.00 -2.18 0.00 0.00 60.65 58.97 1oct h LYS 58 Cb 1.06 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.69 1oct h LYS 58 CO -0.42 0.44 -0.14 -0.97 -1.08 0.00 0.00 179.45 177.28 1oct h ASN 59 N -0.10 0.17 -0.38 0.86 -0.00 -1.61 0.17 115.58 114.70 1oct h ASN 59 Ca 0.03 -0.03 -0.11 0.00 -0.00 0.00 0.00 56.30 56.18 1oct h ASN 59 Cb 0.36 -0.04 -0.01 0.00 -0.00 0.00 0.00 38.32 38.63 1oct h ASN 59 CO 0.01 0.34 -0.20 0.24 -0.00 0.00 0.00 177.43 177.82 1oct h MET 60 N 0.17 0.80 0.00 6.67 2.86 -0.39 -1.13 114.93 123.91 1oct h MET 60 Ca 0.04 -0.36 -0.10 0.00 -2.06 0.00 0.00 59.70 57.22 1oct h MET 60 Cb 0.36 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 1oct h MET 60 CO 0.02 0.98 -0.47 0.00 1.06 0.00 0.00 176.91 178.50 1oct h LYS 62 N 0.00 0.65 0.01 0.00 3.64 -0.48 -3.35 116.57 117.04 1oct h LYS 62 Ca -0.00 -0.61 -0.23 0.00 -1.27 0.00 0.00 60.65 58.53 1oct h LYS 62 Cb 0.95 0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.89 1oct h LYS 62 CO 0.06 1.22 -1.14 -0.07 -2.27 0.00 0.00 179.45 177.25 1oct h LEU 63 N 0.41 0.03 -0.44 5.20 4.07 -1.09 -3.39 115.31 120.10 1oct h LEU 63 Ca -0.08 -0.04 0.05 0.00 0.08 0.00 0.00 57.88 57.89 1oct h LEU 63 Cb 1.52 -0.01 -0.07 0.00 1.08 0.00 0.00 40.66 43.18 1oct h LEU 63 CO 0.17 1.03 -0.44 0.50 -1.08 0.00 0.00 178.44 178.62 1oct h LYS 64 N 0.01 -0.23 -0.01 1.13 3.64 -1.52 -2.21 116.57 117.38 1oct h LYS 64 Ca -0.07 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1oct h LYS 64 Cb 1.83 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 33.70 1oct h LYS 64 CO 0.13 -0.15 -0.01 -1.35 -2.27 0.00 0.00 179.45 175.79 1oct h PRO 65 N -0.24 -0.00 -0.87 1.90 0.11 -1.78 0.61 132.00 131.73 1oct h PRO 65 Ca 0.07 0.00 0.16 0.00 0.11 0.00 0.00 66.00 66.35 1oct h PRO 65 Cb 0.43 0.00 -0.16 0.00 0.11 0.00 0.00 31.00 31.38 1oct h PRO 65 CO -0.53 -0.00 -0.25 1.28 -0.21 0.00 0.00 178.00 178.28 1oct n LEU 66 N -2.84 -0.38 0.28 2.35 7.99 -1.12 -0.23 117.00 123.05 1oct n LEU 66 Ca -0.00 1.50 -0.12 0.00 -0.01 0.00 0.00 56.01 57.37 1oct n LEU 66 Cb 0.01 -0.42 -0.06 0.00 -0.11 0.00 0.00 43.42 42.83 1oct n LEU 66 CO -0.00 -1.41 0.33 -0.07 -1.51 0.00 0.00 177.39 174.73 1oct h LEU 67 N 0.00 -0.64 -0.99 2.23 3.38 -0.65 -2.53 115.31 116.11 1oct h LEU 67 Ca 0.39 0.00 0.31 0.00 0.09 0.00 0.00 57.88 58.68 1oct h LEU 67 Cb 0.60 0.17 -0.18 0.00 0.09 0.00 0.00 40.66 41.34 1oct h LEU 67 CO -0.88 -0.24 0.21 -0.08 0.09 0.00 0.00 178.44 177.54 1oct h GLU 68 N -1.18 0.03 0.44 1.13 4.81 0.24 0.36 114.58 120.41 1oct h GLU 68 Ca -0.08 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 1oct h GLU 68 Cb 0.60 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.97 1oct h GLU 68 CO 0.13 0.02 -0.27 -0.22 -0.73 0.00 0.00 179.01 177.93 1oct h LYS 69 N 0.03 -0.64 -0.92 1.92 3.11 -0.56 -2.67 116.57 116.84 1oct h LYS 69 Ca 0.68 0.04 0.26 0.00 -2.81 0.00 0.00 60.65 58.82 1oct h LYS 69 Cb 1.54 0.15 -0.16 0.00 -1.00 0.00 0.00 32.23 32.76 1oct h LYS 69 CO -0.85 -0.43 0.20 2.35 -2.81 0.00 0.00 179.45 177.91 1oct h TRP 70 N -0.67 0.27 0.27 1.91 7.01 0.04 -2.07 115.95 122.70 1oct h TRP 70 Ca -0.06 0.06 -0.01 0.00 2.11 0.00 0.00 58.89 60.99 1oct h TRP 70 Cb 0.54 0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.61 1oct h TRP 70 CO -0.01 -0.30 -0.29 1.25 -2.79 0.00 0.00 178.44 176.29 1oct h LEU 71 N 0.13 -0.82 0.20 0.65 5.85 -0.54 0.13 115.31 120.91 1oct h LEU 71 Ca 0.59 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 59.38 1oct h LEU 71 Cb 1.24 0.27 -0.01 0.00 0.37 0.00 0.00 40.66 42.54 1oct h LEU 71 CO -0.74 -0.38 -0.16 0.78 -0.34 0.00 0.00 178.44 177.59 1oct h ASN 72 N -0.57 -0.43 -0.99 1.25 -0.26 -1.19 -0.90 115.58 112.50 1oct h ASN 72 Ca -0.03 0.04 0.18 0.00 -0.56 0.00 0.00 56.30 55.92 1oct h ASN 72 Cb 0.50 0.14 -0.09 0.00 -1.06 0.00 0.00 38.32 37.80 1oct h ASN 72 CO -0.05 -0.26 0.61 -0.78 -1.06 0.00 0.00 177.43 175.90 1oct h ASP 73 N -0.38 0.75 1.59 5.81 1.82 -1.39 0.74 116.42 125.35 1oct h ASP 73 Ca -0.01 0.08 -0.04 0.00 -0.39 0.00 0.00 57.03 56.66 1oct h ASP 73 Cb 0.34 -0.06 -0.01 0.00 0.68 0.00 0.00 39.33 40.28 1oct h ASP 73 CO -0.02 0.30 -0.21 0.00 -1.61 0.00 0.00 179.24 177.71 1oct h ALA 74 N 1.62 0.89 0.00 -0.78 0.00 -0.32 -3.51 119.26 117.16 1oct h ALA 74 Ca 0.54 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1oct h ALA 74 Cb 0.86 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1oct h ALA 74 CO -0.32 0.26 0.00 0.39 0.00 0.00 0.00 179.25 179.58 1oct n GLU 75 N -3.18 0.30 0.00 0.00 1.02 0.25 -5.08 120.64 113.95 1oct n GLU 75 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1oct n GLU 75 Cb 0.57 -1.01 0.00 0.00 -0.02 0.00 0.00 31.44 30.98 1oct n GLU 75 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1oct n ARG 102 N -0.45 0.00 -2.39 3.49 0.63 -1.26 -5.12 116.66 111.56 1oct n ARG 102 Ca 0.00 0.00 -0.38 0.00 -0.92 0.00 0.00 57.85 56.55 1oct n ARG 102 Cb 0.00 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 32.89 1oct n ARG 102 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 1oct s LYS 103 N -4.57 4.09 0.36 -0.14 2.20 -1.26 -4.99 119.74 115.44 1oct s LYS 103 Ca 0.00 1.71 -0.28 0.00 -0.36 0.00 0.00 55.97 57.05 1oct s LYS 103 Cb 0.00 -2.63 -0.10 0.00 -1.51 0.00 0.00 37.83 33.59 1oct s LYS 103 CO 0.00 -0.25 1.31 -1.59 -0.36 0.00 0.00 175.35 174.46 1oct s LYS 104 N -2.36 4.18 -0.23 4.03 0.00 -1.26 -4.90 119.74 119.21 1oct s LYS 104 Ca 0.57 2.21 -0.28 0.00 0.00 0.00 0.00 55.97 58.47 1oct s LYS 104 Cb -0.27 -2.93 -0.04 0.00 0.00 0.00 0.00 37.83 34.58 1oct s LYS 104 CO 0.34 -0.33 2.02 0.50 0.00 0.00 0.00 175.35 177.89 1oct s ARG 105 N -2.00 3.33 -0.03 1.78 3.52 -1.26 -4.94 118.95 119.36 1oct s ARG 105 Ca 0.52 1.87 -0.30 0.00 -0.13 0.00 0.00 55.73 57.70 1oct s ARG 105 Cb -0.39 -4.28 -0.05 0.00 -1.56 0.00 0.00 34.95 28.67 1oct s ARG 105 CO 0.52 -1.87 1.45 0.99 -0.81 0.00 0.00 175.30 175.58 1oct s THR 106 N 7.30 3.71 -0.91 4.11 2.01 -1.26 -4.94 115.64 125.66 1oct s THR 106 Ca 0.91 1.03 -0.21 0.00 0.31 0.00 0.00 61.69 63.74 1oct s THR 106 Cb -0.30 -3.67 0.10 0.00 0.01 0.00 0.00 72.50 68.64 1oct s THR 106 CO 0.35 -0.03 1.19 -0.55 -0.69 0.00 0.00 174.62 174.89 1oct s SER 107 N 2.21 6.52 -0.19 3.53 0.15 -1.26 -4.98 113.70 119.68 1oct s SER 107 Ca 0.65 -1.70 -0.29 0.00 0.70 0.00 0.00 55.95 55.31 1oct s SER 107 Cb -0.31 -2.45 -0.05 0.00 -1.71 0.00 0.00 66.02 61.50 1oct s SER 107 CO 0.26 -1.25 1.98 -0.63 1.20 0.00 0.00 173.24 174.79 1oct s ILE 108 N 3.55 3.23 0.52 6.45 -1.09 -1.26 -4.95 121.20 127.66 1oct s ILE 108 Ca 0.35 0.25 -0.20 0.00 -2.23 0.00 0.00 60.65 58.82 1oct s ILE 108 Cb -0.05 -3.26 -0.07 0.00 -1.58 0.00 0.00 42.46 37.50 1oct s ILE 108 CO -0.06 -0.13 1.09 -0.70 -1.23 0.00 0.00 174.94 173.90 1oct s GLU 109 N 5.54 3.52 0.26 2.79 2.56 -1.26 -4.81 118.70 127.29 1oct s GLU 109 Ca 0.89 1.49 -0.08 0.00 0.00 0.00 0.00 54.97 57.27 1oct s GLU 109 Cb -0.31 -2.04 0.44 0.00 2.00 0.00 0.00 34.13 34.22 1oct s GLU 109 CO 0.35 -0.69 1.60 1.15 -0.56 0.00 0.00 175.26 177.11 1oct h THR 110 N 1.29 0.18 -0.57 -1.70 2.02 -1.99 -0.39 112.91 111.75 1oct h THR 110 Ca -0.50 -0.01 -0.10 0.00 0.77 0.00 0.00 66.41 66.57 1oct h THR 110 Cb 1.24 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.78 1oct h THR 110 CO 0.58 0.00 -0.04 0.78 0.37 0.00 0.00 175.52 177.21 1oct h ASN 111 N 0.03 1.01 -0.14 4.18 4.21 -2.00 -2.07 115.58 120.80 1oct h ASN 111 Ca 0.44 -0.32 -0.10 0.00 1.21 0.00 0.00 56.30 57.52 1oct h ASN 111 Cb 0.74 -0.27 -0.01 0.00 -1.12 0.00 0.00 38.32 37.65 1oct h ASN 111 CO -0.83 1.09 -0.23 0.40 -1.29 0.00 0.00 177.43 176.58 1oct h ILE 112 N 0.91 1.27 -0.94 2.81 1.08 -1.72 -1.88 117.51 119.04 1oct h ILE 112 Ca 0.16 -1.27 0.00 0.00 -0.39 0.00 0.00 64.86 63.35 1oct h ILE 112 Cb 0.60 1.28 -0.05 0.00 -3.07 0.00 0.00 36.82 35.59 1oct h ILE 112 CO 0.04 0.41 0.59 -0.09 -0.69 0.00 0.00 178.15 178.41 1oct h ARG 113 N 0.51 1.26 0.55 2.37 2.43 -0.88 -0.28 114.38 120.35 1oct h ARG 113 Ca 0.08 -0.10 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 1oct h ARG 113 Cb 0.68 -0.27 0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1oct h ARG 113 CO 0.05 0.86 -0.26 0.28 -1.51 0.00 0.00 179.97 179.39 1oct h VAL 114 N 1.29 0.38 -0.91 0.20 2.07 -0.76 0.15 116.25 118.67 1oct h VAL 114 Ca 0.34 -0.28 0.15 0.00 0.82 0.00 0.00 66.70 67.73 1oct h VAL 114 Cb -0.10 0.49 -0.07 0.00 -1.52 0.00 0.00 31.29 30.08 1oct h VAL 114 CO -0.07 0.04 0.58 0.00 0.02 0.00 0.00 177.57 178.14 1oct h ALA 115 N -0.60 1.83 -0.38 1.67 0.00 -1.15 0.39 119.26 121.02 1oct h ALA 115 Ca -0.08 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1oct h ALA 115 Cb 0.63 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1oct h ALA 115 CO 0.12 -0.08 0.15 -0.07 0.00 0.00 0.00 179.25 179.37 1oct h LEU 116 N 0.70 0.52 -0.74 0.00 3.38 -0.82 0.12 115.31 118.46 1oct h LEU 116 Ca 0.46 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 58.20 1oct h LEU 116 Cb 0.75 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 1oct h LEU 116 CO -0.22 0.54 0.19 -0.08 0.09 0.00 0.00 178.44 178.96 1oct h GLU 117 N 0.47 1.15 0.05 1.13 4.57 0.14 0.20 114.58 122.28 1oct h GLU 117 Ca 0.13 -0.27 -0.00 0.00 -1.18 0.00 0.00 59.36 58.04 1oct h GLU 117 Cb 0.18 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 1oct h GLU 117 CO -0.01 1.00 -0.02 0.87 -1.18 0.00 0.00 179.01 179.66 1oct h LYS 118 N 1.09 -0.06 -0.37 1.92 6.56 0.11 -1.35 116.57 124.46 1oct h LYS 118 Ca 0.23 0.00 0.04 0.00 -1.06 0.00 0.00 60.65 59.86 1oct h LYS 118 Cb 0.35 0.01 -0.04 0.00 -0.57 0.00 0.00 32.23 31.99 1oct h LYS 118 CO -0.00 -0.03 0.15 1.03 -2.06 0.00 0.00 179.45 178.55 1oct h SER 119 N -0.08 0.19 -0.79 0.86 0.87 -0.48 -2.06 113.55 112.07 1oct h SER 119 Ca -0.01 0.03 0.03 0.00 -1.23 0.00 0.00 61.79 60.62 1oct h SER 119 Cb 0.06 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 61.98 1oct h SER 119 CO 0.01 0.15 0.52 0.15 -0.53 0.00 0.00 176.83 177.13 1oct h PHE 120 N 0.32 0.95 0.00 2.24 3.57 -0.64 -0.74 116.94 122.63 1oct h PHE 120 Ca 0.17 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 1oct h PHE 120 Cb 0.12 -0.32 -0.00 0.00 2.79 0.00 0.00 35.95 38.54 1oct h PHE 120 CO -0.13 0.56 -0.11 -0.07 -2.23 0.00 0.00 178.31 176.34 1oct h LEU 121 N 0.99 0.00 0.00 0.59 3.38 -0.52 -2.85 115.31 116.90 1oct h LEU 121 Ca 0.31 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.14 1oct h LEU 121 Cb 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1oct h LEU 121 CO -0.09 0.11 -0.80 -0.33 0.09 0.00 0.00 178.44 177.42 1oct h GLU 122 N 0.00 0.00 -3.43 1.13 5.08 -1.11 -3.45 114.58 112.80 1oct h GLU 122 Ca -0.00 0.00 -0.48 0.00 -1.00 0.00 0.00 59.36 57.88 1oct h GLU 122 Cb 0.27 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.12 1oct h GLU 122 CO 0.01 0.92 -0.76 1.21 -1.00 0.00 0.00 179.01 179.40 1oct s ASN 123 N -6.57 2.42 0.02 1.42 2.47 -0.40 -5.04 114.94 109.26 1oct s ASN 123 Ca -0.24 -0.58 -0.23 0.00 0.42 0.00 0.00 52.86 52.22 1oct s ASN 123 Cb 0.03 -0.45 -0.17 0.00 -1.45 0.00 0.00 41.25 39.21 1oct s ASN 123 CO 0.59 -0.29 1.39 1.56 -3.72 0.00 0.00 177.10 176.63 1oct h GLN 124 N 8.32 0.12 -3.52 0.43 4.20 -1.77 -3.37 115.11 119.51 1oct h GLN 124 Ca -0.16 -0.05 -0.75 0.00 0.06 0.00 0.00 58.65 57.75 1oct h GLN 124 Cb 1.13 -0.01 -0.31 0.00 0.30 0.00 0.00 27.48 28.59 1oct h GLN 124 CO 0.30 0.47 0.07 0.21 -0.67 0.00 0.00 178.83 179.20 1oct s LYS 125 N -4.68 3.52 0.73 1.46 2.20 -1.26 -4.96 119.74 116.75 1oct s LYS 125 Ca -0.15 -3.00 -0.13 0.00 -0.36 0.00 0.00 55.97 52.33 1oct s LYS 125 Cb 0.04 -4.19 0.04 0.00 -1.51 0.00 0.00 37.83 32.20 1oct s LYS 125 CO 0.69 -1.25 1.11 -1.25 -0.36 0.00 0.00 175.35 174.30 1oct s PRO 126 N -0.86 2.37 0.33 4.03 0.04 -1.26 -5.02 135.00 134.63 1oct s PRO 126 Ca 0.25 1.35 -0.12 0.00 0.04 0.00 0.00 61.00 62.52 1oct s PRO 126 Cb -0.11 -1.90 -0.08 0.00 0.04 0.00 0.00 34.50 32.46 1oct s PRO 126 CO -0.09 -1.58 0.71 0.95 0.04 0.00 0.00 177.00 177.03 1oct s THR 127 N -2.56 4.77 0.21 1.26 -4.23 -1.26 -4.86 115.64 108.97 1oct s THR 127 Ca 0.65 0.73 -0.16 0.00 -1.18 0.00 0.00 61.69 61.73 1oct s THR 127 Cb -0.20 -3.65 0.22 0.00 1.34 0.00 0.00 72.50 70.21 1oct s THR 127 CO 0.49 -0.28 1.59 0.28 -0.54 0.00 0.00 174.62 176.16 1oct h SER 128 N 1.97 -1.00 -0.50 3.99 0.02 -1.99 0.53 113.55 116.57 1oct h SER 128 Ca -0.47 0.24 -0.03 0.00 -0.84 0.00 0.00 61.79 60.68 1oct h SER 128 Cb 1.18 0.55 -0.03 0.00 0.14 0.00 0.00 62.40 64.24 1oct h SER 128 CO 0.65 -0.28 0.22 -0.33 -1.14 0.00 0.00 176.83 175.95 1oct h GLU 129 N -0.07 0.79 -0.54 3.45 5.08 -1.99 0.10 114.58 121.40 1oct h GLU 129 Ca 0.30 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.51 1oct h GLU 129 Cb 0.56 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1oct h GLU 129 CO -0.76 0.65 0.20 0.93 -1.00 0.00 0.00 179.01 179.03 1oct h GLU 130 N 0.78 0.81 -0.23 2.33 5.08 -0.54 0.96 114.58 123.77 1oct h GLU 130 Ca 0.19 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1oct h GLU 130 Cb 0.15 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1oct h GLU 130 CO -0.02 0.72 0.14 0.82 -1.00 0.00 0.00 179.01 179.68 1oct h ILE 131 N 0.73 1.04 -0.23 3.13 2.04 0.62 -0.27 117.51 124.57 1oct h ILE 131 Ca 0.18 -0.10 0.04 0.00 1.00 0.00 0.00 64.86 65.98 1oct h ILE 131 Cb 0.22 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 1oct h ILE 131 CO -0.01 0.05 -0.01 0.74 0.00 0.00 0.00 178.15 178.92 1oct h THR 132 N 0.30 0.83 -0.82 -0.27 2.02 -0.46 -0.43 112.91 114.06 1oct h THR 132 Ca 0.09 -0.02 0.14 0.00 0.77 0.00 0.00 66.41 67.38 1oct h THR 132 Cb -0.02 0.76 -0.09 0.00 -1.74 0.00 0.00 68.15 67.06 1oct h THR 132 CO -0.03 0.01 0.42 0.24 0.37 0.00 0.00 175.52 176.53 1oct h MET 133 N 0.06 0.60 -0.21 6.66 2.86 0.04 -1.27 114.93 123.67 1oct h MET 133 Ca 0.11 -0.04 -0.09 0.00 -2.06 0.00 0.00 59.70 57.62 1oct h MET 133 Cb 0.14 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 31.67 1oct h MET 133 CO -0.19 0.40 -0.24 0.82 1.06 0.00 0.00 176.91 178.76 1oct h ILE 134 N 0.62 1.33 -0.66 -1.22 2.04 -0.10 -1.71 117.51 117.80 1oct h ILE 134 Ca 0.44 -1.42 0.07 0.00 1.00 0.00 0.00 64.86 64.96 1oct h ILE 134 Cb 0.60 1.77 -0.04 0.00 -0.74 0.00 0.00 36.82 38.41 1oct h ILE 134 CO -0.35 0.43 0.44 0.00 0.00 0.00 0.00 178.15 178.68 1oct h ALA 135 N 0.64 1.81 -0.02 1.87 0.00 -0.43 0.36 119.26 123.49 1oct h ALA 135 Ca 0.03 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1oct h ALA 135 Cb 0.80 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1oct h ALA 135 CO 0.06 0.07 0.00 0.22 0.00 0.00 0.00 179.25 179.60 1oct h ASP 136 N 0.62 0.03 1.65 0.00 1.82 -1.07 -1.42 116.42 118.05 1oct h ASP 136 Ca 0.29 -0.29 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 1oct h ASP 136 Cb 0.35 -0.01 0.00 0.00 0.68 0.00 0.00 39.33 40.35 1oct h ASP 136 CO -0.09 0.31 0.00 -0.61 -1.61 0.00 0.00 179.24 177.24 1oct h GLN 137 N -0.25 0.00 -0.36 0.28 4.15 -0.49 -3.24 115.11 115.20 1oct h GLN 137 Ca 0.01 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.36 1oct h GLN 137 Cb 0.29 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.95 1oct h GLN 137 CO 0.00 0.00 0.03 1.28 -1.93 0.00 0.00 178.83 178.21 1oct n LEU 138 N -2.97 4.35 0.00 -2.39 4.77 0.12 -4.97 117.00 115.90 1oct n LEU 138 Ca 0.03 -3.18 0.00 0.00 -0.03 0.00 0.00 56.01 52.83 1oct n LEU 138 Cb 0.45 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 1oct n LEU 138 CO 0.31 0.80 0.00 -0.46 -1.33 0.00 0.00 177.39 176.71 1oct n ASN 139 N -0.52 0.00 -4.97 -1.43 0.23 -0.58 -4.91 115.26 103.07 1oct n ASN 139 Ca 0.27 0.00 -0.21 0.00 -0.53 0.00 0.00 54.58 54.11 1oct n ASN 139 Cb 1.01 -1.30 -0.00 0.00 -2.08 0.00 0.00 39.78 37.41 1oct n ASN 139 CO 0.00 0.00 0.00 -0.04 -0.93 0.00 0.00 177.26 176.29 1oct s MET 140 N -0.41 3.19 0.34 -3.83 -1.94 -0.89 -4.99 119.30 110.76 1oct s MET 140 Ca 0.00 -0.80 -0.29 0.00 -1.71 0.00 0.00 55.69 52.89 1oct s MET 140 Cb 0.00 -2.76 -0.11 0.00 2.01 0.00 0.00 34.83 33.96 1oct s MET 140 CO 0.00 0.06 1.51 -1.91 -0.01 0.00 0.00 175.02 174.67 1oct n GLU 141 N -1.71 2.63 -0.11 2.03 2.13 -1.26 -4.44 120.64 119.90 1oct n GLU 141 Ca -0.02 0.93 -0.05 0.00 0.66 0.00 0.00 57.16 58.68 1oct n GLU 141 Cb 0.58 -2.67 0.01 0.00 0.27 0.00 0.00 31.44 29.63 1oct n GLU 141 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1oct h LYS 142 N 3.65 -0.10 -0.62 5.31 3.64 -1.92 -2.84 116.57 123.70 1oct h LYS 142 Ca -0.49 0.01 0.12 0.00 -1.27 0.00 0.00 60.65 59.02 1oct h LYS 142 Cb 1.24 0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 32.99 1oct h LYS 142 CO 0.70 -0.06 0.13 1.49 -2.27 0.00 0.00 179.45 179.43 1oct h GLU 143 N -0.10 0.25 -0.08 1.90 4.57 -1.97 0.10 114.58 119.25 1oct h GLU 143 Ca 0.19 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.38 1oct h GLU 143 Cb 0.39 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.93 1oct h GLU 143 CO -0.46 0.16 0.12 0.28 -1.18 0.00 0.00 179.01 177.94 1oct h VAL 144 N 0.25 0.36 0.10 0.32 2.07 -1.89 -2.00 116.25 115.47 1oct h VAL 144 Ca 0.33 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.70 1oct h VAL 144 Cb 0.49 0.90 0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1oct h VAL 144 CO -0.42 0.00 -0.66 0.40 0.02 0.00 0.00 177.57 176.91 1oct h ILE 145 N 0.00 1.54 -0.64 4.57 5.03 -0.83 -2.72 117.51 124.47 1oct h ILE 145 Ca 0.04 -2.48 0.04 0.00 -0.12 0.00 0.00 64.86 62.35 1oct h ILE 145 Cb 0.28 3.20 -0.05 0.00 -3.03 0.00 0.00 36.82 37.23 1oct h ILE 145 CO -0.00 0.68 0.37 -0.09 -0.68 0.00 0.00 178.15 178.43 1oct h ARG 146 N -0.54 0.68 -0.71 2.37 2.43 -1.03 -0.73 114.38 116.85 1oct h ARG 146 Ca -0.12 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 58.98 1oct h ARG 146 Cb 1.48 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.85 1oct h ARG 146 CO 0.10 0.45 0.34 0.28 -1.51 0.00 0.00 179.97 179.63 1oct h VAL 147 N 0.70 1.23 -0.79 0.20 2.07 -1.51 -1.59 116.25 116.57 1oct h VAL 147 Ca 0.27 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 67.11 1oct h VAL 147 Cb 0.11 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 30.20 1oct h VAL 147 CO -0.15 0.28 0.40 -0.25 0.02 0.00 0.00 177.57 177.87 1oct h TRP 148 N 0.99 1.12 0.00 1.57 7.01 -1.00 0.37 115.95 126.01 1oct h TRP 148 Ca 0.24 -0.05 -0.05 0.00 2.11 0.00 0.00 58.89 61.14 1oct h TRP 148 Cb 0.12 -0.35 -0.01 0.00 -2.10 0.00 0.00 29.16 26.82 1oct h TRP 148 CO 0.01 0.81 -0.25 0.74 -2.79 0.00 0.00 178.44 176.95 1oct h PHE 149 N 1.11 0.00 0.13 2.65 0.04 -0.67 0.21 116.94 120.42 1oct h PHE 149 Ca 0.27 0.00 -0.28 0.00 2.80 0.00 0.00 57.97 60.77 1oct h PHE 149 Cb 0.09 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.25 1oct h PHE 149 CO 0.01 0.25 -1.25 0.00 -0.60 0.00 0.00 178.31 176.72 1oct h ASN 151 N 0.09 0.83 -0.66 0.00 2.35 -0.50 -2.67 115.58 115.02 1oct h ASN 151 Ca -0.14 -0.45 -0.07 0.00 -0.55 0.00 0.00 56.30 55.10 1oct h ASN 151 Cb 1.97 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 40.08 1oct h ASN 151 CO 0.21 1.21 0.16 -0.09 -1.65 0.00 0.00 177.43 177.27 1oct h ARG 152 N 0.57 1.06 0.00 0.81 9.65 -0.64 0.49 114.38 126.31 1oct h ARG 152 Ca 0.01 -0.26 -0.04 0.00 -1.10 0.00 0.00 59.98 58.59 1oct h ARG 152 Cb 1.13 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 29.57 1oct h ARG 152 CO 0.12 0.95 -0.20 0.00 2.80 0.00 0.00 179.97 183.64 1oct h ARG 153 N 0.98 0.00 -0.01 0.20 3.08 -1.37 0.63 114.38 117.90 1oct h ARG 153 Ca 0.21 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 60.07 1oct h ARG 153 Cb 0.37 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.43 1oct h ARG 153 CO 0.00 0.20 -0.73 1.96 -1.07 0.00 0.00 179.97 180.33 1oct h GLN 154 N 0.00 0.52 -0.78 0.04 4.20 -0.94 -2.55 115.11 115.59 1oct h GLN 154 Ca -0.00 -0.54 -0.03 0.00 0.06 0.00 0.00 58.65 58.14 1oct h GLN 154 Cb 0.42 0.15 -0.04 0.00 0.30 0.00 0.00 27.48 28.31 1oct h GLN 154 CO 0.03 1.17 0.38 0.87 -0.67 0.00 0.00 178.83 180.61 1oct h LYS 155 N 0.08 1.12 -0.75 1.46 1.57 -0.33 -2.11 116.57 117.60 1oct h LYS 155 Ca -0.09 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.53 1oct h LYS 155 Cb 1.41 -0.21 -0.04 0.00 0.08 0.00 0.00 32.23 33.48 1oct h LYS 155 CO 0.14 0.86 0.43 1.49 -0.57 0.00 0.00 179.45 181.80 1oct h GLU 156 N 1.11 1.03 -0.42 3.15 4.57 -0.84 -1.93 114.58 121.26 1oct h GLU 156 Ca 0.27 -0.10 -0.07 0.00 -1.18 0.00 0.00 59.36 58.28 1oct h GLU 156 Cb 0.10 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 28.46 1oct h GLU 156 CO -0.04 0.74 -0.02 -0.22 -1.18 0.00 0.00 179.01 178.30 1oct h LYS 157 N 1.05 0.68 0.00 1.92 1.63 -0.95 0.09 116.57 120.99 1oct h LYS 157 Ca 0.27 -0.18 0.00 0.00 -0.85 0.00 0.00 60.65 59.89 1oct h LYS 157 Cb -0.00 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 31.54 1oct h LYS 157 CO -0.05 0.71 0.00 0.54 -3.45 0.00 0.00 179.45 177.20 1oct n ARG 158 N -4.23 0.08 -0.12 1.90 1.74 -0.75 -2.45 116.66 112.84 1oct n ARG 158 Ca 0.02 0.23 -0.14 0.00 -0.77 0.00 0.00 57.85 57.19 1oct n ARG 158 Cb 0.29 -1.63 -0.13 0.00 -1.02 0.00 0.00 32.46 29.97 1oct n ARG 158 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1oct n ILE 159 N -1.78 1.42 -3.48 0.55 5.41 -0.73 -4.81 119.36 115.94 1oct n ILE 159 Ca 0.04 -0.67 -0.28 0.00 1.00 0.00 0.00 62.75 62.84 1oct n ILE 159 Cb 0.26 -1.02 -0.11 0.00 -0.71 0.00 0.00 39.64 38.06 1oct n ILE 159 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 1oct s ASN 160 N -6.04 2.12 0.00 4.38 -0.87 -0.06 -5.12 114.94 109.36 1oct s ASN 160 Ca -0.24 -3.02 0.00 0.00 -1.57 0.00 0.00 52.86 48.03 1oct s ASN 160 Cb 0.08 -0.60 0.00 0.00 -0.02 0.00 0.00 41.25 40.71 1oct s ASN 160 CO 0.68 -0.18 0.43 -0.81 -2.57 0.00 0.00 177.10 174.64