#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ggz s ILE 6 N 0.00 4.83 0.00 1.12 1.01 -1.26 -5.11 121.20 121.79 3ggz s ILE 6 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.75 3ggz s ILE 6 Cb 0.00 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.64 3ggz s ILE 6 CO 0.00 -0.78 0.00 -2.65 0.00 0.00 0.00 174.94 171.51 3ggz n PRO 7 N -2.23 -0.27 0.08 2.79 -0.02 -1.26 -5.08 135.00 129.01 3ggz n PRO 7 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3ggz n PRO 7 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.03 3ggz n PRO 7 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3ggz n PHE 8 N -1.78 -1.18 -0.60 6.00 7.35 -1.26 -4.61 117.46 121.38 3ggz n PHE 8 Ca 0.00 0.21 0.48 0.00 -0.76 0.00 0.00 57.45 57.38 3ggz n PHE 8 Cb 0.00 0.34 0.80 0.00 0.35 0.00 0.00 39.48 40.96 3ggz n PHE 8 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 3ggz h THR 9 N 0.00 0.11 0.00 -2.13 2.02 -1.98 0.12 112.91 111.06 3ggz h THR 9 Ca 0.00 -0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.10 3ggz h THR 9 Cb 0.00 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.51 3ggz h THR 9 CO 0.00 0.00 -0.45 0.40 0.37 0.00 0.00 175.52 175.84 3ggz h ILE 10 N 0.01 1.26 -0.33 3.11 2.04 -2.00 -3.00 117.51 118.60 3ggz h ILE 10 Ca 0.84 -2.11 0.05 0.00 1.00 0.00 0.00 64.86 64.64 3ggz h ILE 10 Cb 3.32 2.54 -0.05 0.00 -0.74 0.00 0.00 36.82 41.90 3ggz h ILE 10 CO -0.04 0.43 0.06 0.11 0.00 0.00 0.00 178.15 178.70 3ggz h LYS 11 N -1.00 0.16 -0.05 2.37 1.57 -1.11 -1.44 116.57 117.07 3ggz h LYS 11 Ca -0.12 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.66 3ggz h LYS 11 Cb 0.99 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.26 3ggz h LYS 11 CO -0.07 0.11 -0.01 1.25 -0.57 0.00 0.00 179.45 180.15 3ggz h LEU 12 N 0.17 -0.05 -0.69 2.94 5.85 -1.19 0.11 115.31 122.45 3ggz h LEU 12 Ca 0.16 0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.98 3ggz h LEU 12 Cb 0.18 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.17 3ggz h LEU 12 CO -0.21 -0.02 0.34 0.50 -0.34 0.00 0.00 178.44 178.70 3ggz h LYS 13 N 0.00 0.56 -0.40 1.25 3.64 -1.33 0.83 116.57 121.12 3ggz h LYS 13 Ca 0.03 -0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 59.22 3ggz h LYS 13 Cb 0.04 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 3ggz h LYS 13 CO -0.05 0.37 -0.36 1.15 -2.27 0.00 0.00 179.45 178.29 3ggz h THR 14 N 0.57 1.27 0.37 1.00 2.02 -0.99 -1.35 112.91 115.80 3ggz h THR 14 Ca 0.34 -1.53 -0.01 0.00 0.77 0.00 0.00 66.41 65.98 3ggz h THR 14 Cb 0.36 1.34 -0.00 0.00 -1.74 0.00 0.00 68.15 68.11 3ggz h THR 14 CO -0.27 0.51 -0.22 0.00 0.37 0.00 0.00 175.52 175.91 3ggz h LEU 16 N -0.56 -0.35 -1.65 0.00 3.38 -0.86 -2.14 115.31 113.13 3ggz h LEU 16 Ca -0.04 0.02 0.36 0.00 0.09 0.00 0.00 57.88 58.31 3ggz h LEU 16 Cb 0.46 0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.22 3ggz h LEU 16 CO 0.04 -0.24 0.85 0.11 0.09 0.00 0.00 178.44 179.29 3ggz h LYS 17 N -0.39 0.14 0.58 1.13 1.57 -1.20 0.15 116.57 118.56 3ggz h LYS 17 Ca -0.03 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 3ggz h LYS 17 Cb 0.31 -0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.59 3ggz h LYS 17 CO 0.05 0.09 -0.28 1.98 -0.57 0.00 0.00 179.45 180.72 3ggz h MET 18 N 0.15 -0.76 -1.01 3.15 4.05 -0.86 -2.30 114.93 117.35 3ggz h MET 18 Ca 0.67 0.05 0.32 0.00 -0.28 0.00 0.00 59.70 60.47 3ggz h MET 18 Cb 2.25 0.17 -0.15 0.00 -0.80 0.00 0.00 31.60 33.08 3ggz h MET 18 CO -0.20 -0.50 0.58 0.00 0.23 0.00 0.00 176.91 177.02 3ggz h ILE 20 N 0.33 0.59 -0.40 0.00 2.04 -1.09 0.18 117.51 119.16 3ggz h ILE 20 Ca 0.73 -0.22 0.07 0.00 1.00 0.00 0.00 64.86 66.44 3ggz h ILE 20 Cb 1.68 0.70 -0.09 0.00 -0.74 0.00 0.00 36.82 38.36 3ggz h ILE 20 CO -0.59 0.04 -0.38 1.56 0.00 0.00 0.00 178.15 178.78 3ggz h GLN 21 N -0.69 -0.28 -0.43 2.37 1.08 -0.08 -0.66 115.11 116.42 3ggz h GLN 21 Ca -0.06 0.02 -0.15 0.00 -1.45 0.00 0.00 58.65 57.01 3ggz h GLN 21 Cb 0.50 0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.98 3ggz h GLN 21 CO 0.09 -0.19 -0.31 0.00 -0.95 0.00 0.00 178.83 177.47 3ggz h ARG 22 N -0.29 0.97 -0.72 1.46 2.47 -1.28 -1.91 114.38 115.08 3ggz h ARG 22 Ca 0.16 -0.47 0.04 0.00 -1.26 0.00 0.00 59.98 58.45 3ggz h ARG 22 Cb 0.56 -0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 28.84 3ggz h ARG 22 CO -0.55 1.13 0.48 -0.07 0.56 0.00 0.00 179.97 181.52 3ggz h LEU 23 N 0.81 0.72 -0.07 3.04 3.38 -0.18 0.10 115.31 123.12 3ggz h LEU 23 Ca 0.08 -0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.81 3ggz h LEU 23 Cb 0.90 -0.16 0.02 0.00 0.09 0.00 0.00 40.66 41.50 3ggz h LEU 23 CO 0.08 0.49 -0.89 -0.09 0.09 0.00 0.00 178.44 178.12 3ggz h ARG 24 N 0.83 0.73 -0.29 1.13 2.43 -1.02 -2.48 114.38 115.70 3ggz h ARG 24 Ca 0.30 -0.69 0.06 0.00 -0.81 0.00 0.00 59.98 58.84 3ggz h ARG 24 Cb 0.12 0.17 -0.06 0.00 -0.42 0.00 0.00 29.97 29.79 3ggz h ARG 24 CO -0.09 1.28 -0.09 -0.92 -1.51 0.00 0.00 179.97 178.64 3ggz h TYR 25 N 0.43 -0.20 -0.98 2.20 3.20 -0.39 0.92 116.97 122.15 3ggz h TYR 25 Ca -0.09 0.03 0.09 0.00 3.14 0.00 0.00 58.73 61.90 3ggz h TYR 25 Cb 1.54 0.13 -0.07 0.00 1.54 0.00 0.00 36.73 39.87 3ggz h TYR 25 CO 0.10 -0.15 0.63 0.00 -1.64 0.00 0.00 178.16 177.10 3ggz h ALA 26 N 1.25 1.50 0.81 1.82 0.00 -0.82 -0.95 119.26 122.86 3ggz h ALA 26 Ca 0.14 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 3ggz h ALA 26 Cb 0.24 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.79 3ggz h ALA 26 CO -0.31 0.32 -0.39 1.96 0.00 0.00 0.00 179.25 180.82 3ggz h GLN 27 N 1.05 -1.05 -0.98 0.00 4.20 -0.42 0.13 115.11 118.04 3ggz h GLN 27 Ca 0.45 0.07 0.17 0.00 0.06 0.00 0.00 58.65 59.40 3ggz h GLN 27 Cb 0.33 0.24 -0.10 0.00 0.30 0.00 0.00 27.48 28.24 3ggz h GLN 27 CO -0.20 -0.70 0.59 1.49 -0.67 0.00 0.00 178.83 179.33 3ggz h GLU 28 N -1.14 0.76 0.01 1.46 4.81 -0.72 0.21 114.58 119.98 3ggz h GLU 28 Ca -0.11 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.07 3ggz h GLU 28 Cb 0.83 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.04 3ggz h GLU 28 CO 0.18 0.50 -0.01 -0.22 -0.73 0.00 0.00 179.01 178.74 3ggz h LYS 29 N 0.78 -0.02 -0.22 1.92 3.64 -1.07 -2.75 116.57 118.84 3ggz h LYS 29 Ca 0.55 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.85 3ggz h LYS 29 Cb 0.79 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 3ggz h LYS 29 CO -0.36 0.50 -0.19 1.96 -2.27 0.00 0.00 179.45 179.09 3ggz h GLN 30 N -0.55 0.39 0.15 1.90 4.20 -0.21 -0.24 115.11 120.75 3ggz h GLN 30 Ca -0.00 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.58 3ggz h GLN 30 Cb 0.53 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.27 3ggz h GLN 30 CO 0.00 0.57 -0.07 1.96 -0.67 0.00 0.00 178.83 180.62 3ggz h GLN 31 N 0.35 -0.19 -0.67 1.46 1.08 -0.65 0.85 115.11 117.34 3ggz h GLN 31 Ca 0.06 0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.26 3ggz h GLN 31 Cb 0.54 0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.98 3ggz h GLN 31 CO 0.04 -0.06 0.36 0.00 -0.95 0.00 0.00 178.83 178.21 3ggz h ALA 32 N 0.56 0.86 0.06 3.87 0.00 -1.33 0.54 119.26 123.82 3ggz h ALA 32 Ca -0.02 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 3ggz h ALA 32 Cb 0.22 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3ggz h ALA 32 CO 0.03 0.39 -0.03 0.82 0.00 0.00 0.00 179.25 180.47 3ggz h ILE 33 N 0.92 0.98 -0.98 0.00 2.04 -0.70 -2.10 117.51 117.67 3ggz h ILE 33 Ca 0.24 -0.15 0.05 0.00 1.00 0.00 0.00 64.86 66.00 3ggz h ILE 33 Cb 0.06 1.08 -0.06 0.00 -0.74 0.00 0.00 36.82 37.16 3ggz h ILE 33 CO -0.04 0.04 0.64 0.00 0.00 0.00 0.00 178.15 178.79 3ggz h ALA 34 N 0.78 1.33 -0.11 1.87 0.00 0.10 -1.85 119.26 121.38 3ggz h ALA 34 Ca -0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3ggz h ALA 34 Cb 0.13 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3ggz h ALA 34 CO 0.01 0.48 -0.06 -0.22 0.00 0.00 0.00 179.25 179.46 3ggz h LYS 35 N 1.20 0.16 0.00 0.00 3.64 -0.41 -0.20 116.57 120.95 3ggz h LYS 35 Ca 0.41 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.66 3ggz h LYS 35 Cb 0.08 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 3ggz h LYS 35 CO -0.15 0.23 -0.48 0.37 -2.27 0.00 0.00 179.45 177.15 3ggz h GLN 36 N 0.15 0.00 -0.16 1.90 4.15 -0.70 -3.08 115.11 117.36 3ggz h GLN 36 Ca 0.04 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.44 3ggz h GLN 36 Cb 0.22 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 3ggz h GLN 36 CO 0.01 0.48 0.04 0.77 -1.93 0.00 0.00 178.83 178.20 3ggz h SER 37 N 0.00 0.25 -0.57 -0.69 0.02 -0.43 -2.26 113.55 109.86 3ggz h SER 37 Ca -0.00 -0.23 0.12 0.00 -0.84 0.00 0.00 61.79 60.83 3ggz h SER 37 Cb 1.28 -0.07 -0.10 0.00 0.14 0.00 0.00 62.40 63.66 3ggz h SER 37 CO 0.06 0.41 -0.07 0.03 -1.14 0.00 0.00 176.83 176.13 3ggz h ARG 38 N 0.07 0.06 -0.45 3.45 3.08 -1.37 0.19 114.38 119.41 3ggz h ARG 38 Ca 0.05 -0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.19 3ggz h ARG 38 Cb 0.26 -0.01 -0.08 0.00 0.08 0.00 0.00 29.97 30.22 3ggz h ARG 38 CO 0.00 0.04 -0.05 -0.09 -1.07 0.00 0.00 179.97 178.80 3ggz h ARG 39 N 0.06 0.06 -0.34 0.04 2.43 -1.41 0.19 114.38 115.40 3ggz h ARG 39 Ca 0.29 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.42 3ggz h ARG 39 Cb 0.45 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.97 3ggz h ARG 39 CO -0.54 0.04 0.06 1.96 -1.51 0.00 0.00 179.97 179.99 3ggz h GLN 40 N 0.06 0.50 -1.00 0.20 4.20 -0.18 -2.02 115.11 116.88 3ggz h GLN 40 Ca 0.22 -0.08 0.05 0.00 0.06 0.00 0.00 58.65 58.90 3ggz h GLN 40 Cb 0.33 -0.09 -0.06 0.00 0.30 0.00 0.00 27.48 27.96 3ggz h GLN 40 CO -0.41 0.48 0.65 0.28 -0.67 0.00 0.00 178.83 179.16 3ggz h VAL 41 N 0.49 1.12 -0.26 -0.54 2.07 0.21 0.31 116.25 119.66 3ggz h VAL 41 Ca 0.11 -0.41 -0.13 0.00 0.82 0.00 0.00 66.70 67.09 3ggz h VAL 41 Cb 0.22 -0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 29.79 3ggz h VAL 41 CO -0.00 0.22 -0.39 0.00 0.02 0.00 0.00 177.57 177.42 3ggz h ALA 42 N 1.43 0.83 -0.78 1.67 0.00 -0.70 -2.87 119.26 118.84 3ggz h ALA 42 Ca 0.42 -0.44 0.04 0.00 0.00 0.00 0.00 54.91 54.93 3ggz h ALA 42 Cb 0.10 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 3ggz h ALA 42 CO -0.15 0.65 0.51 0.37 0.00 0.00 0.00 179.25 180.62 3ggz h GLN 43 N 0.50 0.90 0.00 0.00 5.75 -0.34 -0.82 115.11 121.10 3ggz h GLN 43 Ca 0.04 -0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.47 3ggz h GLN 43 Cb 0.90 -0.20 -0.00 0.00 1.07 0.00 0.00 27.48 29.25 3ggz h GLN 43 CO 0.08 0.59 -0.08 -0.07 -2.65 0.00 0.00 178.83 176.71 3ggz h LEU 44 N 0.92 0.00 0.05 -2.39 3.38 -1.01 -3.05 115.31 113.21 3ggz h LEU 44 Ca 0.32 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 58.01 3ggz h LEU 44 Cb 0.09 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.87 3ggz h LEU 44 CO -0.10 0.08 -1.11 -0.07 0.09 0.00 0.00 178.44 177.33 3ggz h LEU 45 N 0.00 0.89 -0.38 1.67 3.38 -1.10 -2.42 115.31 117.35 3ggz h LEU 45 Ca -0.00 -0.78 0.00 0.00 0.09 0.00 0.00 57.88 57.19 3ggz h LEU 45 Cb 0.66 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3ggz h LEU 45 CO 0.01 1.56 0.00 -0.11 0.09 0.00 0.00 178.44 179.99 3ggz n LEU 46 N -3.85 0.26 -0.42 1.67 0.00 -1.01 -2.05 117.00 111.60 3ggz n LEU 46 Ca -0.12 -0.13 0.04 0.00 0.00 0.00 0.00 56.01 55.80 3ggz n LEU 46 Cb 0.92 -0.13 0.06 0.00 0.00 0.00 0.00 43.42 44.27 3ggz n LEU 46 CO 0.56 0.06 0.36 0.41 0.00 0.00 0.00 177.39 178.79 3ggz n THR 47 N -0.25 0.79 -0.98 1.96 -1.04 -1.14 -4.98 114.28 108.64 3ggz n THR 47 Ca 0.00 -1.05 -0.06 0.00 -2.04 0.00 0.00 64.05 60.90 3ggz n THR 47 Cb 0.06 0.23 -0.03 0.00 -1.82 0.00 0.00 70.33 68.78 3ggz n THR 47 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3ggz n ASN 48 N -0.54 -3.47 -3.59 8.00 5.03 -0.87 -4.80 115.26 115.02 3ggz n ASN 48 Ca 0.07 0.15 -0.41 0.00 0.87 0.00 0.00 54.58 55.27 3ggz n ASN 48 Cb 0.71 -2.72 -0.01 0.00 -1.02 0.00 0.00 39.78 36.75 3ggz n ASN 48 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3ggz n LYS 49 N -0.60 4.07 -0.03 3.52 5.02 -0.92 -4.77 118.16 124.45 3ggz n LYS 49 Ca -0.06 -3.24 -0.11 0.00 -2.02 0.00 0.00 58.31 52.87 3ggz n LYS 49 Cb 0.36 -2.79 -0.07 0.00 -0.02 0.00 0.00 35.03 32.51 3ggz n LYS 49 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3ggz h GLU 50 N 5.09 -0.38 -0.03 1.97 4.39 -1.87 0.44 114.58 124.19 3ggz h GLU 50 Ca 0.63 0.03 0.04 0.00 0.34 0.00 0.00 59.36 60.39 3ggz h GLU 50 Cb 0.42 0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 29.11 3ggz h GLU 50 CO 1.60 -0.26 -0.28 1.96 -1.16 0.00 0.00 179.01 180.87 3ggz h GLN 51 N -0.40 -0.40 0.00 2.33 4.20 -1.97 0.79 115.11 119.66 3ggz h GLN 51 Ca 0.03 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.77 3ggz h GLN 51 Cb 0.48 0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.36 3ggz h GLN 51 CO -0.35 -0.27 0.00 -0.22 -0.67 0.00 0.00 178.83 177.33 3ggz h LYS 52 N -0.41 0.00 0.00 1.46 3.64 -1.90 0.40 116.57 119.75 3ggz h LYS 52 Ca 0.07 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.24 3ggz h LYS 52 Cb 0.51 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.30 3ggz h LYS 52 CO -0.27 0.00 -1.59 0.00 -2.27 0.00 0.00 179.45 175.33 3ggz n ALA 53 N -1.80 1.79 -0.64 5.00 0.00 0.13 -3.69 120.51 121.30 3ggz n ALA 53 Ca -0.01 -0.67 0.00 0.00 0.00 0.00 0.00 53.44 52.77 3ggz n ALA 53 Cb 0.09 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 18.67 3ggz n ALA 53 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3ggz n HIS 54 N -2.91 0.00 -0.56 0.00 -0.00 0.11 -2.76 115.22 109.09 3ggz n HIS 54 Ca -0.13 0.00 0.46 0.00 -0.00 0.00 0.00 57.72 58.05 3ggz n HIS 54 Cb 0.92 -0.18 0.78 0.00 -0.00 0.00 0.00 29.99 31.51 3ggz n HIS 54 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 176.34 178.22 3ggz h TYR 55 N 0.00 0.06 -0.29 1.57 0.05 -1.73 0.56 116.97 117.18 3ggz h TYR 55 Ca 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 3ggz h TYR 55 Cb 0.00 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 37.71 3ggz h TYR 55 CO 0.03 -0.02 0.16 -0.09 -1.05 0.00 0.00 178.16 177.19 3ggz h ARG 56 N 0.01 0.41 -0.69 4.88 9.65 -1.63 -2.56 114.38 124.45 3ggz h ARG 56 Ca 0.81 -0.05 -0.04 0.00 -1.10 0.00 0.00 59.98 59.61 3ggz h ARG 56 Cb 3.18 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 31.65 3ggz h ARG 56 CO -0.05 0.35 0.28 0.28 2.80 0.00 0.00 179.97 183.62 3ggz h VAL 57 N 0.36 1.24 -0.96 0.20 2.07 0.31 -2.13 116.25 117.33 3ggz h VAL 57 Ca 0.10 -0.74 0.23 0.00 0.82 0.00 0.00 66.70 67.11 3ggz h VAL 57 Cb 0.06 0.41 -0.12 0.00 -1.52 0.00 0.00 31.29 30.12 3ggz h VAL 57 CO -0.02 0.30 0.52 -0.33 0.02 0.00 0.00 177.57 178.07 3ggz h GLU 58 N 1.00 0.53 -0.21 1.57 5.08 -1.14 0.54 114.58 121.94 3ggz h GLU 58 Ca 0.23 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 3ggz h GLU 58 Cb 0.19 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3ggz h GLU 58 CO -0.02 0.35 0.09 1.15 -1.00 0.00 0.00 179.01 179.58 3ggz h THR 59 N 0.55 1.16 -0.96 1.13 2.02 -1.33 -2.25 112.91 113.23 3ggz h THR 59 Ca 0.60 -0.48 0.26 0.00 0.77 0.00 0.00 66.41 67.56 3ggz h THR 59 Cb 1.10 1.09 -0.05 0.00 -1.74 0.00 0.00 68.15 68.55 3ggz h THR 59 CO -0.47 0.16 0.67 -0.07 0.37 0.00 0.00 175.52 176.17 3ggz h LEU 60 N 0.19 0.15 0.15 2.58 -0.00 0.32 -0.96 115.31 117.73 3ggz h LEU 60 Ca 0.07 0.02 -0.01 0.00 -0.00 0.00 0.00 57.88 57.96 3ggz h LEU 60 Cb 0.17 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.82 3ggz h LEU 60 CO -0.01 0.05 -0.07 0.40 -0.00 0.00 0.00 178.44 178.81 3ggz h ILE 61 N 0.14 0.97 -0.24 1.22 5.03 -0.76 -0.56 117.51 123.32 3ggz h ILE 61 Ca 0.48 -1.06 0.04 0.00 -0.12 0.00 0.00 64.86 64.19 3ggz h ILE 61 Cb 1.65 1.57 -0.01 0.00 -3.03 0.00 0.00 36.82 36.99 3ggz h ILE 61 CO -0.08 0.23 0.17 0.45 -0.68 0.00 0.00 178.15 178.23 3ggz h HIS 62 N -0.76 0.16 -0.10 1.37 3.86 -1.05 0.47 115.15 119.11 3ggz h HIS 62 Ca -0.02 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.09 3ggz h HIS 62 Cb 0.53 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.95 3ggz h HIS 62 CO 0.08 0.09 -0.34 -0.44 0.86 0.00 0.00 177.93 178.19 3ggz h ASP 63 N 0.17 0.47 -0.85 2.45 5.19 -1.19 -1.22 116.42 121.43 3ggz h ASP 63 Ca 0.11 -0.61 -0.01 0.00 -0.62 0.00 0.00 57.03 55.89 3ggz h ASP 63 Cb 0.21 -0.14 -0.04 0.00 0.18 0.00 0.00 39.33 39.54 3ggz h ASP 63 CO -0.02 1.00 0.48 0.44 -3.12 0.00 0.00 179.24 178.02 3ggz h ASP 64 N -0.04 1.06 -0.30 6.45 3.32 0.11 -1.40 116.42 125.62 3ggz h ASP 64 Ca -0.01 -0.09 -0.07 0.00 0.02 0.00 0.00 57.03 56.87 3ggz h ASP 64 Cb 0.97 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.23 3ggz h ASP 64 CO 0.07 0.84 -0.04 0.40 -1.72 0.00 0.00 179.24 178.80 3ggz h ILE 65 N 1.18 1.23 0.63 0.35 2.04 -0.07 -2.27 117.51 120.60 3ggz h ILE 65 Ca 0.30 -0.97 -0.03 0.00 1.00 0.00 0.00 64.86 65.16 3ggz h ILE 65 Cb 0.01 0.96 0.01 0.00 -0.74 0.00 0.00 36.82 37.06 3ggz h ILE 65 CO -0.05 0.33 -0.30 -0.74 0.00 0.00 0.00 178.15 177.39 3ggz h HIS 66 N 0.62 -0.78 -0.88 1.37 2.76 -0.48 -1.96 115.15 115.80 3ggz h HIS 66 Ca 0.12 -0.02 0.23 0.00 -2.20 0.00 0.00 60.37 58.51 3ggz h HIS 66 Cb 0.44 0.26 -0.15 0.00 1.55 0.00 0.00 27.41 29.51 3ggz h HIS 66 CO 0.02 -0.46 0.12 0.82 -1.30 0.00 0.00 177.93 177.13 3ggz h ILE 67 N -0.90 0.23 -0.26 6.26 2.04 -0.92 0.72 117.51 124.67 3ggz h ILE 67 Ca -0.09 -0.04 0.04 0.00 1.00 0.00 0.00 64.86 65.77 3ggz h ILE 67 Cb 0.67 0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 3ggz h ILE 67 CO 0.14 0.02 0.04 -0.08 0.00 0.00 0.00 178.15 178.27 3ggz h GLU 68 N 0.12 0.13 -0.08 2.37 4.81 -1.06 0.17 114.58 121.03 3ggz h GLU 68 Ca 0.53 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.78 3ggz h GLU 68 Cb 1.07 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.41 3ggz h GLU 68 CO -0.74 0.08 0.19 1.25 -0.73 0.00 0.00 179.01 179.06 3ggz h LEU 69 N 0.13 0.00 0.15 1.64 5.85 0.12 -1.78 115.31 121.42 3ggz h LEU 69 Ca 0.12 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 3ggz h LEU 69 Cb 0.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.17 3ggz h LEU 69 CO -0.17 0.00 -0.07 -0.07 -0.34 0.00 0.00 178.44 177.78 3ggz h LEU 70 N 0.00 -0.17 -1.37 2.25 3.38 0.19 -2.12 115.31 117.46 3ggz h LEU 70 Ca 0.04 -0.03 0.34 0.00 0.09 0.00 0.00 57.88 58.32 3ggz h LEU 70 Cb 0.41 0.04 -0.11 0.00 0.09 0.00 0.00 40.66 41.09 3ggz h LEU 70 CO -0.00 0.32 0.74 -0.33 0.09 0.00 0.00 178.44 179.26 3ggz h GLU 71 N -1.05 0.24 -0.16 1.13 5.08 -0.73 0.52 114.58 119.61 3ggz h GLU 71 Ca -0.02 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.24 3ggz h GLU 71 Cb 0.19 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 3ggz h GLU 71 CO 0.03 0.16 -0.24 0.82 -1.00 0.00 0.00 179.01 178.78 3ggz h ILE 72 N 0.25 1.35 -0.21 3.13 2.04 -1.42 -2.33 117.51 120.32 3ggz h ILE 72 Ca 0.70 -1.46 -0.08 0.00 1.00 0.00 0.00 64.86 65.01 3ggz h ILE 72 Cb 1.99 1.92 -0.01 0.00 -0.74 0.00 0.00 36.82 39.98 3ggz h ILE 72 CO -0.37 0.44 -0.23 -0.07 0.00 0.00 0.00 178.15 177.92 3ggz h LEU 73 N 0.08 0.38 0.89 1.44 3.38 0.54 -1.52 115.31 120.50 3ggz h LEU 73 Ca 0.02 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 3ggz h LEU 73 Cb 0.81 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.47 3ggz h LEU 73 CO 0.06 0.62 -0.47 -0.08 0.09 0.00 0.00 178.44 178.65 3ggz h GLU 74 N 0.35 -1.21 0.13 1.13 4.81 -0.35 -2.25 114.58 117.19 3ggz h GLU 74 Ca 0.06 0.08 0.01 0.00 -0.13 0.00 0.00 59.36 59.38 3ggz h GLU 74 Cb 0.60 0.27 -0.05 0.00 0.63 0.00 0.00 28.75 30.20 3ggz h GLU 74 CO 0.04 -0.81 -0.51 1.25 -0.73 0.00 0.00 179.01 178.25 3ggz h LEU 75 N -1.25 -1.54 -1.40 1.64 6.46 -1.30 -0.52 115.31 117.40 3ggz h LEU 75 Ca -0.12 0.16 0.46 0.00 -0.12 0.00 0.00 57.88 58.26 3ggz h LEU 75 Cb 0.98 0.57 -0.13 0.00 -0.73 0.00 0.00 40.66 41.34 3ggz h LEU 75 CO 0.17 -0.55 0.87 1.88 -0.62 0.00 0.00 178.44 180.19 3ggz h TYR 76 N -0.75 0.51 0.20 1.25 0.05 -1.17 0.50 116.97 117.56 3ggz h TYR 76 Ca -0.00 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 3ggz h TYR 76 Cb 0.76 -0.12 0.00 0.00 1.01 0.00 0.00 36.73 38.38 3ggz h TYR 76 CO -0.44 -0.25 -0.09 0.00 -1.05 0.00 0.00 178.16 176.33 3ggz h GLU 78 N -0.37 0.05 -0.24 0.00 5.08 -0.12 1.20 114.58 120.18 3ggz h GLU 78 Ca -0.03 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 3ggz h GLU 78 Cb 0.20 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 3ggz h GLU 78 CO 0.04 0.04 0.09 1.25 -1.00 0.00 0.00 179.01 179.43 3ggz h LEU 79 N 0.05 0.34 -0.60 1.33 6.46 -1.06 -2.33 115.31 119.50 3ggz h LEU 79 Ca 0.77 -0.18 -0.09 0.00 -0.12 0.00 0.00 57.88 58.27 3ggz h LEU 79 Cb 1.93 -0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 41.75 3ggz h LEU 79 CO -0.77 0.42 0.04 -0.07 -0.62 0.00 0.00 178.44 177.44 3ggz h LEU 80 N 0.23 1.00 -0.74 2.25 3.38 0.18 -2.44 115.31 119.16 3ggz h LEU 80 Ca 0.08 -0.29 0.11 0.00 0.09 0.00 0.00 57.88 57.87 3ggz h LEU 80 Cb 0.20 -0.27 -0.08 0.00 0.09 0.00 0.00 40.66 40.60 3ggz h LEU 80 CO -0.01 1.04 0.36 0.25 0.09 0.00 0.00 178.44 180.18 3ggz h LEU 81 N 0.93 0.44 -0.13 1.67 5.85 -0.38 0.02 115.31 123.70 3ggz h LEU 81 Ca 0.17 0.07 -0.10 0.00 0.84 0.00 0.00 57.88 58.87 3ggz h LEU 81 Cb 0.51 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.54 3ggz h LEU 81 CO 0.02 0.23 -0.30 0.00 -0.34 0.00 0.00 178.44 178.06 3ggz h ALA 82 N 1.47 0.21 -0.01 1.25 0.00 -1.37 -3.17 119.26 117.64 3ggz h ALA 82 Ca 0.38 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ggz h ALA 82 Cb 0.46 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3ggz h ALA 82 CO -0.31 0.24 0.00 0.54 0.00 0.00 0.00 179.25 179.72 3ggz n ARG 83 N -4.40 1.07 -0.16 0.00 1.74 -0.84 -4.23 116.66 109.85 3ggz n ARG 83 Ca -0.07 -0.06 -0.03 0.00 -0.77 0.00 0.00 57.85 56.92 3ggz n ARG 83 Cb 0.48 -1.48 0.03 0.00 -1.02 0.00 0.00 32.46 30.47 3ggz n ARG 83 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3ggz h VAL 84 N 0.08 0.50 -0.98 1.55 2.07 -0.99 0.36 116.25 118.84 3ggz h VAL 84 Ca 0.00 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.72 3ggz h VAL 84 Cb 0.49 0.50 -0.10 0.00 -1.52 0.00 0.00 31.29 30.67 3ggz h VAL 84 CO 0.01 0.00 0.61 1.56 0.02 0.00 0.00 177.57 179.77 3ggz h GLN 85 N -0.00 0.64 0.00 1.57 1.08 -1.87 0.18 115.11 116.71 3ggz h GLN 85 Ca 0.24 -0.04 -0.07 0.00 -1.45 0.00 0.00 58.65 57.33 3ggz h GLN 85 Cb 0.36 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.64 3ggz h GLN 85 CO -0.51 0.43 -0.34 0.28 -0.95 0.00 0.00 178.83 177.74 3ggz h VAL 86 N 0.66 0.62 -0.10 -0.54 2.07 -1.31 -3.23 116.25 114.43 3ggz h VAL 86 Ca 0.55 -1.71 -0.17 0.00 0.82 0.00 0.00 66.70 66.19 3ggz h VAL 86 Cb 0.99 2.17 -0.01 0.00 -1.52 0.00 0.00 31.29 32.93 3ggz h VAL 86 CO -0.32 0.33 -0.68 0.40 0.02 0.00 0.00 177.57 177.32 3ggz h ILE 87 N 0.00 1.37 0.00 4.57 2.04 0.63 -3.08 117.51 123.04 3ggz h ILE 87 Ca -0.00 -2.05 -0.04 0.00 1.00 0.00 0.00 64.86 63.77 3ggz h ILE 87 Cb 1.15 2.03 -0.01 0.00 -0.74 0.00 0.00 36.82 39.25 3ggz h ILE 87 CO 0.04 0.62 -0.17 -1.13 0.00 0.00 0.00 178.15 177.51 3ggz h ASN 88 N 0.29 0.00 -1.06 1.72 -1.24 -1.36 -3.08 115.58 110.85 3ggz h ASN 88 Ca -0.02 0.00 -0.50 0.00 0.71 0.00 0.00 56.30 56.49 3ggz h ASN 88 Cb 1.23 0.00 -0.18 0.00 0.73 0.00 0.00 38.32 40.10 3ggz h ASN 88 CO 0.12 0.17 0.43 0.47 -1.29 0.00 0.00 177.43 177.33 3ggz n ASP 89 N -3.96 6.54 -3.81 1.15 8.00 -1.16 -4.87 116.55 118.44 3ggz n ASP 89 Ca -0.02 -3.23 -0.12 0.00 0.71 0.00 0.00 54.79 52.12 3ggz n ASP 89 Cb 0.26 -1.21 -0.11 0.00 -0.02 0.00 0.00 41.12 40.04 3ggz n ASP 89 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3ggz s ILE 90 N -2.42 0.03 0.00 0.53 1.01 -1.16 -5.04 121.20 114.15 3ggz s ILE 90 Ca 0.57 -0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.96 3ggz s ILE 90 Cb 0.38 -0.40 0.00 0.00 0.01 0.00 0.00 42.46 42.45 3ggz s ILE 90 CO -0.21 -0.14 0.00 -0.24 0.00 0.00 0.00 174.94 174.35 3ggz n SER 91 N 2.31 0.00 -4.35 3.58 2.88 -1.26 -4.81 113.62 111.96 3ggz n SER 91 Ca -0.17 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.19 3ggz n SER 91 Cb 0.57 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.93 3ggz n SER 91 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3ggz s THR 92 N 0.00 1.62 0.02 2.46 -4.23 -1.26 -4.56 115.64 109.69 3ggz s THR 92 Ca 0.00 -2.17 -0.24 0.00 -1.18 0.00 0.00 61.69 58.10 3ggz s THR 92 Cb 0.00 -2.12 -0.18 0.00 1.34 0.00 0.00 72.50 71.54 3ggz s THR 92 CO 0.00 -0.54 1.42 -0.33 -0.54 0.00 0.00 174.62 174.64 3ggz h GLU 93 N 2.52 0.04 -1.02 3.99 5.08 -2.00 -3.01 114.58 120.18 3ggz h GLU 93 Ca -0.38 -0.01 0.35 0.00 -1.00 0.00 0.00 59.36 58.32 3ggz h GLU 93 Cb 1.22 -0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.31 3ggz h GLU 93 CO 0.63 0.36 0.58 1.49 -1.00 0.00 0.00 179.01 181.07 3ggz h GLU 94 N -0.29 0.22 0.08 2.33 4.57 -1.99 -0.66 114.58 118.85 3ggz h GLU 94 Ca 0.01 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.17 3ggz h GLU 94 Cb 0.35 -0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 28.89 3ggz h GLU 94 CO 0.00 0.14 -0.05 1.96 -1.18 0.00 0.00 179.01 179.88 3ggz h GLN 95 N 0.22 -0.12 -0.82 1.92 4.20 -1.90 -2.58 115.11 116.03 3ggz h GLN 95 Ca 0.77 0.01 0.09 0.00 0.06 0.00 0.00 58.65 59.58 3ggz h GLN 95 Cb 1.88 0.03 -0.07 0.00 0.30 0.00 0.00 27.48 29.61 3ggz h GLN 95 CO -0.64 -0.08 0.47 1.25 -0.67 0.00 0.00 178.83 179.16 3ggz h LEU 96 N -0.12 0.68 0.00 1.46 5.85 -1.50 -2.55 115.31 119.12 3ggz h LEU 96 Ca -0.01 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3ggz h LEU 96 Cb 0.10 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.04 3ggz h LEU 96 CO 0.01 0.39 0.00 0.52 -0.34 0.00 0.00 178.44 179.02 3ggz n VAL 97 N -4.74 0.00 -1.59 1.05 0.31 -0.30 -2.33 118.33 110.73 3ggz n VAL 97 Ca 0.13 1.31 -0.35 0.00 -0.01 0.00 0.00 64.34 65.42 3ggz n VAL 97 Cb 0.27 -2.20 0.04 0.00 -0.91 0.00 0.00 33.84 31.04 3ggz n VAL 97 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3ggz n LYS 98 N -1.62 2.63 0.00 5.55 5.02 -0.98 -4.27 118.16 124.49 3ggz n LYS 98 Ca 0.00 -3.18 0.00 0.00 -2.02 0.00 0.00 58.31 53.11 3ggz n LYS 98 Cb 0.00 -2.22 0.00 0.00 -0.02 0.00 0.00 35.03 32.79 3ggz n LYS 98 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3ggz n GLU 99 N -0.47 0.00 -2.66 1.97 2.13 -0.96 -4.95 120.64 115.70 3ggz n GLU 99 Ca 0.55 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 58.12 3ggz n GLU 99 Cb 0.44 -0.12 -0.01 0.00 0.27 0.00 0.00 31.44 32.02 3ggz n GLU 99 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 3ggz n HIS 100 N -0.59 3.19 0.19 4.31 8.25 -0.98 -4.68 115.22 124.90 3ggz n HIS 100 Ca 0.00 -3.35 0.05 0.00 -0.26 0.00 0.00 57.72 54.15 3ggz n HIS 100 Cb 0.00 -0.24 -0.07 0.00 1.12 0.00 0.00 29.99 30.81 3ggz n HIS 100 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 3ggz n MET 101 N -0.34 1.81 0.07 -0.41 0.00 -1.26 -1.70 117.12 115.29 3ggz n MET 101 Ca 0.33 -0.05 -0.20 0.00 0.00 0.00 0.00 57.70 57.78 3ggz n MET 101 Cb 0.61 -1.11 -0.15 0.00 0.00 0.00 0.00 33.22 32.57 3ggz n MET 101 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 3ggz h ASP 102 N 0.00 0.51 0.32 6.12 3.32 -1.93 -3.32 116.42 121.44 3ggz h ASP 102 Ca 0.00 -0.76 0.00 0.00 0.02 0.00 0.00 57.03 56.29 3ggz h ASP 102 Cb 0.35 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.74 3ggz h ASP 102 CO 0.00 1.64 -0.01 -0.90 -1.72 0.00 0.00 179.24 178.24 3ggz n ASP 103 N -3.52 0.10 -0.13 6.45 5.68 -1.26 -4.91 116.55 118.96 3ggz n ASP 103 Ca -0.21 -0.55 -0.02 0.00 -0.50 0.00 0.00 54.79 53.51 3ggz n ASP 103 Cb 1.06 -0.14 -0.01 0.00 -1.14 0.00 0.00 41.12 40.89 3ggz n ASP 103 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3ggz n GLY 104 N 1.18 0.53 0.18 6.12 0.00 -1.25 -4.94 105.19 107.01 3ggz n GLY 104 Ca 0.18 -0.47 -0.12 0.00 0.00 0.00 0.00 46.02 45.61 3ggz n GLY 104 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3ggz h ILE 105 N 0.00 1.30 -0.18 -0.61 2.04 -1.86 -3.07 117.51 115.13 3ggz h ILE 105 Ca -0.03 -1.27 -0.06 0.00 1.00 0.00 0.00 64.86 64.50 3ggz h ILE 105 Cb 0.19 1.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.83 3ggz h ILE 105 CO 0.05 0.40 -0.13 -1.13 0.00 0.00 0.00 178.15 177.34 3ggz h ASN 106 N 0.29 0.43 0.14 1.72 -1.24 -1.60 -2.71 115.58 112.61 3ggz h ASN 106 Ca 0.05 -0.44 0.00 0.00 0.71 0.00 0.00 56.30 56.62 3ggz h ASN 106 Cb 0.68 -0.12 0.00 0.00 0.73 0.00 0.00 38.32 39.61 3ggz h ASN 106 CO 0.04 0.78 0.00 1.21 -1.29 0.00 0.00 177.43 178.17 3ggz n GLU 107 N -4.54 0.07 -0.10 6.67 2.13 -1.24 -1.57 120.64 122.05 3ggz n GLU 107 Ca -0.05 0.27 -0.20 0.00 0.66 0.00 0.00 57.16 57.83 3ggz n GLU 107 Cb 0.35 -1.50 -0.08 0.00 0.27 0.00 0.00 31.44 30.48 3ggz n GLU 107 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3ggz n ALA 108 N -1.34 1.64 -0.03 4.31 0.00 -1.16 -4.29 120.51 119.64 3ggz n ALA 108 Ca 0.03 -0.83 -0.14 0.00 0.00 0.00 0.00 53.44 52.50 3ggz n ALA 108 Cb 0.05 0.19 -0.10 0.00 0.00 0.00 0.00 19.45 19.59 3ggz n ALA 108 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 3ggz h ILE 109 N -0.55 1.49 -0.59 0.00 2.10 -1.43 -2.66 117.51 115.86 3ggz h ILE 109 Ca -0.50 -1.54 0.09 0.00 1.08 0.00 0.00 64.86 63.98 3ggz h ILE 109 Cb 1.51 2.46 -0.07 0.00 -1.09 0.00 0.00 36.82 39.64 3ggz h ILE 109 CO -0.26 0.41 0.22 0.03 -1.08 0.00 0.00 178.15 177.48 3ggz h ARG 110 N -0.51 0.40 0.26 2.19 3.08 -1.55 -2.50 114.38 115.76 3ggz h ARG 110 Ca -0.00 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 3ggz h ARG 110 Cb 0.71 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.67 3ggz h ARG 110 CO 0.02 0.26 -0.13 0.66 -1.07 0.00 0.00 179.97 179.72 3ggz h SER 111 N 0.41 -0.30 -0.97 7.04 4.64 -1.75 -3.03 113.55 119.61 3ggz h SER 111 Ca 0.29 -0.15 0.32 0.00 -0.47 0.00 0.00 61.79 61.77 3ggz h SER 111 Cb 0.34 0.08 -0.16 0.00 -0.31 0.00 0.00 62.40 62.35 3ggz h SER 111 CO -0.29 -0.01 0.41 -0.07 -0.87 0.00 0.00 176.83 176.00 3ggz h LEU 112 N -0.60 0.21 -0.74 5.97 3.38 -1.12 1.02 115.31 123.42 3ggz h LEU 112 Ca -0.04 0.22 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 3ggz h LEU 112 Cb 0.43 0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 3ggz h LEU 112 CO 0.06 -0.24 0.25 0.40 0.09 0.00 0.00 178.44 179.00 3ggz h ILE 113 N 0.18 1.26 0.50 1.22 2.04 -1.41 -3.10 117.51 118.20 3ggz h ILE 113 Ca 0.70 -0.87 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 3ggz h ILE 113 Cb 1.61 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 3ggz h ILE 113 CO -0.70 0.35 -0.24 0.22 0.00 0.00 0.00 178.15 177.78 3ggz h TYR 114 N 1.09 -0.62 -0.41 1.37 3.20 0.12 -2.87 116.97 118.84 3ggz h TYR 114 Ca 0.24 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.22 3ggz h TYR 114 Cb 0.28 0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.74 3ggz h TYR 114 CO 0.02 -0.38 0.60 0.00 -1.64 0.00 0.00 178.16 176.76 3ggz h ALA 115 N -0.17 2.10 -0.72 1.82 0.00 -1.21 -3.25 119.26 117.83 3ggz h ALA 115 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3ggz h ALA 115 Cb 0.52 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3ggz h ALA 115 CO 0.11 -0.81 0.00 -0.89 0.00 0.00 0.00 179.25 177.66 3ggz n ILE 116 N -3.37 0.00 -0.25 0.00 5.41 -1.08 -0.39 119.36 119.67 3ggz n ILE 116 Ca 0.08 1.34 -0.06 0.00 1.00 0.00 0.00 62.75 65.11 3ggz n ILE 116 Cb 0.76 -1.82 -0.01 0.00 -0.71 0.00 0.00 39.64 37.85 3ggz n ILE 116 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 3ggz h LEU 117 N 0.00 -1.42 -1.70 1.39 3.38 -1.80 -2.31 115.31 112.84 3ggz h LEU 117 Ca 0.00 0.26 0.02 0.00 0.09 0.00 0.00 57.88 58.25 3ggz h LEU 117 Cb 0.00 0.68 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 3ggz h LEU 117 CO 0.00 -0.31 0.24 -0.26 0.09 0.00 0.00 178.44 178.20 3ggz h PHE 118 N -0.15 0.38 -3.64 1.13 0.04 -1.39 -3.38 116.94 109.94 3ggz h PHE 118 Ca 0.23 0.01 -0.69 0.00 2.80 0.00 0.00 57.97 60.32 3ggz h PHE 118 Cb 0.56 -0.13 -0.32 0.00 2.20 0.00 0.00 35.95 38.26 3ggz h PHE 118 CO -0.74 0.23 -0.62 0.08 -0.60 0.00 0.00 178.31 176.66 3ggz s VAL 119 N -5.38 3.30 -2.11 -0.55 1.01 0.47 -4.94 120.40 112.20 3ggz s VAL 119 Ca -0.07 -1.57 0.22 0.00 0.00 0.00 0.00 61.98 60.55 3ggz s VAL 119 Cb 0.18 -3.02 0.50 0.00 0.00 0.00 0.00 36.38 34.03 3ggz s VAL 119 CO 0.72 -0.34 1.43 -0.90 0.00 0.00 0.00 175.10 176.01 3ggz n ASP 120 N 4.66 3.60 -0.63 3.32 5.68 -1.26 -4.20 116.55 127.72 3ggz n ASP 120 Ca -0.09 -1.98 0.11 0.00 -0.50 0.00 0.00 54.79 52.33 3ggz n ASP 120 Cb 0.43 -0.34 0.37 0.00 -1.14 0.00 0.00 41.12 40.43 3ggz n ASP 120 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3ggz n GLU 121 N 1.47 1.83 -2.80 0.11 0.00 -1.26 -4.02 120.64 115.98 3ggz n GLU 121 Ca 0.21 -1.24 -0.16 0.00 0.00 0.00 0.00 57.16 55.96 3ggz n GLU 121 Cb 0.59 -1.42 0.00 0.00 0.00 0.00 0.00 31.44 30.61 3ggz n GLU 121 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 3ggz n VAL 122 N 0.47 1.11 -0.39 3.84 0.31 -1.26 -4.86 118.33 117.55 3ggz n VAL 122 Ca 0.17 -4.01 0.34 0.00 -0.01 0.00 0.00 64.34 60.84 3ggz n VAL 122 Cb 0.38 -0.09 0.61 0.00 -0.91 0.00 0.00 33.84 33.83 3ggz n VAL 122 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 3ggz h LYS 123 N 2.93 0.05 -0.11 5.55 1.57 -1.83 0.30 116.57 125.02 3ggz h LYS 123 Ca 0.04 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.85 3ggz h LYS 123 Cb 1.02 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.31 3ggz h LYS 123 CO 0.59 0.03 0.49 0.93 -0.57 0.00 0.00 179.45 180.92 3ggz h GLU 124 N 0.05 0.00 -0.42 3.15 3.07 -1.95 -1.97 114.58 116.51 3ggz h GLU 124 Ca 0.84 0.00 0.03 0.00 -0.50 0.00 0.00 59.36 59.74 3ggz h GLU 124 Cb 2.41 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 30.29 3ggz h GLU 124 CO -0.61 0.00 0.21 -0.07 -1.40 0.00 0.00 179.01 177.14 3ggz h LEU 125 N 0.00 0.31 -1.80 1.33 3.38 -0.78 -1.67 115.31 116.08 3ggz h LEU 125 Ca 0.05 0.02 0.34 0.00 0.09 0.00 0.00 57.88 58.39 3ggz h LEU 125 Cb 1.04 -0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.68 3ggz h LEU 125 CO -0.00 0.22 0.84 0.77 0.09 0.00 0.00 178.44 180.36 3ggz h SER 126 N 0.42 0.13 -0.77 -0.43 4.64 -1.58 0.32 113.55 116.28 3ggz h SER 126 Ca 0.18 0.03 0.12 0.00 -0.47 0.00 0.00 61.79 61.64 3ggz h SER 126 Cb 0.08 0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 62.13 3ggz h SER 126 CO -0.12 0.01 0.51 1.56 -0.87 0.00 0.00 176.83 177.91 3ggz h GLN 127 N 0.11 0.59 -0.50 4.77 4.20 -1.49 -1.08 115.11 121.70 3ggz h GLN 127 Ca 0.61 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 59.28 3ggz h GLN 127 Cb 2.17 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 29.80 3ggz h GLN 127 CO -0.11 0.39 0.28 -0.07 -0.67 0.00 0.00 178.83 178.65 3ggz h LEU 128 N 0.61 0.62 -0.19 1.46 3.38 -0.48 0.35 115.31 121.06 3ggz h LEU 128 Ca 0.37 -0.09 0.05 0.00 0.09 0.00 0.00 57.88 58.30 3ggz h LEU 128 Cb 0.59 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.13 3ggz h LEU 128 CO -0.14 0.53 -0.19 0.50 0.09 0.00 0.00 178.44 179.23 3ggz h LYS 129 N 0.67 -0.21 -0.15 1.13 3.64 -1.29 -1.61 116.57 118.76 3ggz h LYS 129 Ca 0.18 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.60 3ggz h LYS 129 Cb 0.04 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 3ggz h LYS 129 CO -0.03 -0.14 -0.04 -0.44 -2.27 0.00 0.00 179.45 176.53 3ggz h ASP 130 N -0.22 -0.15 0.00 4.20 3.32 -1.23 -0.64 116.42 121.71 3ggz h ASP 130 Ca 0.12 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3ggz h ASP 130 Cb 0.39 0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.04 3ggz h ASP 130 CO -0.31 -0.05 0.00 0.18 -1.72 0.00 0.00 179.24 177.33 3ggz n LEU 131 N -5.17 0.00 -0.10 1.55 4.77 0.08 -1.58 117.00 116.55 3ggz n LEU 131 Ca -0.04 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.81 3ggz n LEU 131 Cb 0.10 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.05 3ggz n LEU 131 CO 0.26 0.00 -1.15 0.23 -1.33 0.00 0.00 177.39 175.41 3ggz n MET 132 N -0.51 0.68 0.22 3.23 2.81 -0.25 -3.75 117.12 119.55 3ggz n MET 132 Ca 0.00 0.10 0.09 0.00 -1.81 0.00 0.00 57.70 56.08 3ggz n MET 132 Cb 0.00 -1.56 0.43 0.00 -0.71 0.00 0.00 33.22 31.38 3ggz n MET 132 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3ggz h ALA 133 N 0.56 1.02 0.00 3.04 0.00 -1.26 1.60 119.26 124.21 3ggz h ALA 133 Ca -0.53 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.09 3ggz h ALA 133 Cb 2.08 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.82 3ggz h ALA 133 CO -0.01 0.31 -0.32 2.35 0.00 0.00 0.00 179.25 181.58 3ggz h TRP 134 N 0.00 0.00 0.00 0.00 7.01 -1.67 -3.26 115.95 118.03 3ggz h TRP 134 Ca -0.00 0.00 -0.16 0.00 2.11 0.00 0.00 58.89 60.84 3ggz h TRP 134 Cb 0.78 0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 27.81 3ggz h TRP 134 CO 0.00 0.32 -1.60 1.17 -2.79 0.00 0.00 178.44 175.55 3ggz n LYS 135 N -3.68 2.44 0.00 2.65 3.00 -0.99 -5.02 118.16 116.57 3ggz n LYS 135 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.30 3ggz n LYS 135 Cb 0.43 -1.22 0.00 0.00 0.00 0.00 0.00 35.03 34.24 3ggz n LYS 135 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 3ggz n ILE 136 N -2.35 0.00 -3.86 3.15 5.41 0.54 -4.34 119.36 117.91 3ggz n ILE 136 Ca -0.14 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.50 3ggz n ILE 136 Cb 0.78 0.00 0.01 0.00 -0.71 0.00 0.00 39.64 39.72 3ggz n ILE 136 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 3ggz n ASN 137 N 0.00 -1.98 -0.23 4.38 0.23 -1.13 -4.79 115.26 111.73 3ggz n ASN 137 Ca 0.00 -2.66 0.13 0.00 -0.53 0.00 0.00 54.58 51.52 3ggz n ASN 137 Cb 0.00 3.38 0.32 0.00 -2.08 0.00 0.00 39.78 41.41 3ggz n ASN 137 CO 0.00 0.00 0.00 0.52 -0.93 0.00 0.00 177.26 176.85 3ggz n VAL 138 N -0.54 0.00 0.06 3.53 0.31 -1.26 -3.23 118.33 117.19 3ggz n VAL 138 Ca -0.06 -0.12 -0.14 0.00 -0.01 0.00 0.00 64.34 64.01 3ggz n VAL 138 Cb 0.58 0.46 -0.14 0.00 -0.91 0.00 0.00 33.84 33.84 3ggz n VAL 138 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 3ggz h GLU 139 N 1.15 0.18 0.07 5.55 -0.00 -1.98 -3.32 114.58 116.24 3ggz h GLU 139 Ca 0.00 -0.31 0.01 0.00 -0.00 0.00 0.00 59.36 59.06 3ggz h GLU 139 Cb 0.53 0.11 -0.01 0.00 -0.00 0.00 0.00 28.75 29.38 3ggz h GLU 139 CO 0.00 1.04 -0.10 0.35 -0.00 0.00 0.00 179.01 180.29 3ggz h PHE 140 N 0.05 -0.26 -0.61 2.06 3.57 -1.97 -2.23 116.94 117.54 3ggz h PHE 140 Ca -0.19 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.33 3ggz h PHE 140 Cb 1.97 0.11 -0.04 0.00 2.79 0.00 0.00 35.95 40.78 3ggz h PHE 140 CO 0.04 -0.16 0.38 -0.39 -2.23 0.00 0.00 178.31 175.96 3ggz h VAL 141 N -0.21 1.09 0.00 1.41 -1.51 -1.76 -1.37 116.25 113.89 3ggz h VAL 141 Ca 0.01 -0.26 -0.00 0.00 -1.23 0.00 0.00 66.70 65.23 3ggz h VAL 141 Cb 0.22 0.27 -0.00 0.00 -2.13 0.00 0.00 31.29 29.65 3ggz h VAL 141 CO -0.05 0.14 -0.00 0.78 -1.23 0.00 0.00 177.57 177.20 3ggz h ASN 142 N 0.75 0.00 1.06 4.19 2.35 -1.62 -1.69 115.58 120.63 3ggz h ASN 142 Ca 0.24 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 3ggz h ASN 142 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 3ggz h ASN 142 CO -0.09 0.00 -0.11 0.61 -1.65 0.00 0.00 177.43 176.19 3ggz n GLY 143 N -0.42 -1.52 0.16 2.83 0.00 -0.53 -2.73 105.19 102.98 3ggz n GLY 143 Ca -0.01 -0.12 -0.18 0.00 0.00 0.00 0.00 46.02 45.71 3ggz n GLY 143 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3ggz n VAL 144 N -1.77 1.47 0.19 1.61 0.31 -0.72 -3.24 118.33 116.19 3ggz n VAL 144 Ca 0.06 -0.08 0.10 0.00 -0.01 0.00 0.00 64.34 64.41 3ggz n VAL 144 Cb 0.37 -2.11 0.53 0.00 -0.91 0.00 0.00 33.84 31.73 3ggz n VAL 144 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3ggz n ILE 145 N -4.31 1.08 -0.07 2.52 5.41 -0.73 -0.66 119.36 122.59 3ggz n ILE 145 Ca -0.31 0.64 -0.12 0.00 1.00 0.00 0.00 62.75 63.97 3ggz n ILE 145 Cb 0.67 -1.63 -0.04 0.00 -0.71 0.00 0.00 39.64 37.93 3ggz n ILE 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3ggz n ALA 146 N -1.75 1.46 -1.20 -1.39 0.00 -1.11 -4.78 120.51 111.73 3ggz n ALA 146 Ca -0.01 -0.69 -0.02 0.00 0.00 0.00 0.00 53.44 52.72 3ggz n ALA 146 Cb 0.06 0.12 0.24 0.00 0.00 0.00 0.00 19.45 19.87 3ggz n ALA 146 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3ggz n ASP 147 N -4.15 3.50 -1.92 0.00 9.92 -1.20 -4.98 116.55 117.72 3ggz n ASP 147 Ca -0.20 -3.40 0.00 0.00 -0.53 0.00 0.00 54.79 50.66 3ggz n ASP 147 Cb 0.51 -0.64 0.00 0.00 -0.64 0.00 0.00 41.12 40.35 3ggz n ASP 147 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3ggz n HIS 148 N -0.74 0.00 -1.63 1.24 1.44 0.16 -4.67 115.22 111.02 3ggz n HIS 148 Ca 0.33 0.00 -0.44 0.00 -2.01 0.00 0.00 57.72 55.59 3ggz n HIS 148 Cb 1.11 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 31.18 3ggz n HIS 148 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 3ggz n ILE 149 N -0.66 0.54 -2.12 0.61 2.08 -1.24 -1.42 119.36 117.15 3ggz n ILE 149 Ca 0.00 -0.26 -0.15 0.00 0.56 0.00 0.00 62.75 62.90 3ggz n ILE 149 Cb 0.00 -2.27 -0.02 0.00 -0.75 0.00 0.00 39.64 36.60 3ggz n ILE 149 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 3ggz n ASP 150 N 9.05 -4.57 -4.64 4.38 10.43 -1.26 -4.95 116.55 124.99 3ggz n ASP 150 Ca 0.26 0.06 -0.41 0.00 2.57 0.00 0.00 54.79 57.26 3ggz n ASP 150 Cb 0.39 -3.66 -0.05 0.00 1.84 0.00 0.00 41.12 39.64 3ggz n ASP 150 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3ggz s VAL 151 N -2.71 4.86 0.38 2.53 1.01 -0.51 -4.83 120.40 121.14 3ggz s VAL 151 Ca 0.00 1.42 -0.16 0.00 0.00 0.00 0.00 61.98 63.24 3ggz s VAL 151 Cb 0.00 -4.08 -0.13 0.00 0.00 0.00 0.00 36.38 32.18 3ggz s VAL 151 CO 0.00 -0.07 -0.04 -2.65 0.00 0.00 0.00 175.10 172.34 3ggz n PRO 152 N 5.97 0.00 0.04 2.72 -0.02 -1.26 -4.75 135.00 137.70 3ggz n PRO 152 Ca 0.04 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.39 3ggz n PRO 152 Cb 0.48 -0.82 -0.09 0.00 -0.02 0.00 0.00 33.50 33.05 3ggz n PRO 152 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3ggz h GLU 153 N 0.10 -0.13 -0.08 -0.52 4.57 -2.01 -2.95 114.58 113.57 3ggz h GLU 153 Ca -0.32 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 57.89 3ggz h GLU 153 Cb 1.19 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.81 3ggz h GLU 153 CO 0.36 0.31 0.16 1.57 -1.18 0.00 0.00 179.01 180.22 3ggz h LYS 154 N -0.61 0.00 0.00 1.92 2.10 -1.98 -2.54 116.57 115.46 3ggz h LYS 154 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3ggz h LYS 154 Cb 0.49 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.82 3ggz h LYS 154 CO 0.02 0.00 0.00 -0.89 -2.00 0.00 0.00 179.45 176.58 3ggz n ILE 155 N -3.39 0.00 -0.35 0.07 2.08 -1.13 -1.66 119.36 114.99 3ggz n ILE 155 Ca -0.01 0.26 0.31 0.00 0.56 0.00 0.00 62.75 63.88 3ggz n ILE 155 Cb 0.24 -0.54 0.48 0.00 -0.75 0.00 0.00 39.64 39.07 3ggz n ILE 155 CO 0.00 0.00 0.00 2.30 0.56 0.00 0.00 176.55 179.41 3ggz n ILE 156 N -0.42 0.00 0.07 1.39 -5.35 -1.15 0.13 119.36 114.03 3ggz n ILE 156 Ca 0.00 1.09 -0.18 0.00 -0.27 0.00 0.00 62.75 63.40 3ggz n ILE 156 Cb 0.00 -1.90 -0.14 0.00 -1.74 0.00 0.00 39.64 35.86 3ggz n ILE 156 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 3ggz h LYS 157 N 0.00 0.28 -0.00 6.28 3.64 -1.54 -3.21 116.57 122.01 3ggz h LYS 157 Ca 0.55 -0.47 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3ggz h LYS 157 Cb 2.67 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 34.66 3ggz h LYS 157 CO -0.01 1.15 0.00 1.63 -2.27 0.00 0.00 179.45 179.96 3ggz n LYS 158 N -3.48 1.13 -0.04 1.90 5.02 0.35 -2.21 118.16 120.84 3ggz n LYS 158 Ca -0.17 -0.19 -0.20 0.00 -2.02 0.00 0.00 58.31 55.73 3ggz n LYS 158 Cb 1.05 -1.49 -0.13 0.00 -0.02 0.00 0.00 35.03 34.43 3ggz n LYS 158 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ggz n SER 160 N -3.39 3.09 -4.61 0.00 7.64 -1.21 -5.05 113.62 110.09 3ggz n SER 160 Ca -0.35 -3.39 -0.47 0.00 1.01 0.00 0.00 58.87 55.66 3ggz n SER 160 Cb 1.03 -0.60 -0.03 0.00 -1.01 0.00 0.00 64.21 63.60 3ggz n SER 160 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3ggz n PRO 161 N 0.21 1.43 -1.82 1.43 -0.04 -0.94 -4.90 135.00 130.36 3ggz n PRO 161 Ca 0.28 0.51 -0.33 0.00 -0.04 0.00 0.00 63.50 63.92 3ggz n PRO 161 Cb 0.47 -2.04 0.04 0.00 -0.04 0.00 0.00 33.50 31.93 3ggz n PRO 161 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3ggz s SER 162 N 0.03 5.22 0.16 3.54 1.04 -1.26 -4.92 113.70 117.51 3ggz s SER 162 Ca 0.70 2.00 -0.33 0.00 0.48 0.00 0.00 55.95 58.81 3ggz s SER 162 Cb -0.78 -2.55 -0.16 0.00 0.10 0.00 0.00 66.02 62.63 3ggz s SER 162 CO 0.52 -1.56 1.10 0.52 0.98 0.00 0.00 173.24 174.81 3ggz n VAL 163 N -2.28 0.94 -1.76 5.02 0.31 -1.26 -4.87 118.33 114.43 3ggz n VAL 163 Ca 0.10 -0.24 -0.41 0.00 -0.01 0.00 0.00 64.34 63.79 3ggz n VAL 163 Cb 0.52 -0.72 0.00 0.00 -0.91 0.00 0.00 33.84 32.73 3ggz n VAL 163 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3ggz n PRO 164 N 1.64 2.51 -2.40 5.55 -0.02 -1.26 -4.95 135.00 136.08 3ggz n PRO 164 Ca 0.15 0.88 -0.42 0.00 -2.02 0.00 0.00 63.50 62.10 3ggz n PRO 164 Cb 0.24 -2.60 -0.03 0.00 -0.02 0.00 0.00 33.50 31.08 3ggz n PRO 164 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3ggz s LYS 165 N -2.11 4.43 0.29 -0.52 -0.14 -1.26 -4.92 119.74 115.50 3ggz s LYS 165 Ca 0.55 1.80 -0.02 0.00 -1.36 0.00 0.00 55.97 56.94 3ggz s LYS 165 Cb -0.49 -3.33 0.63 0.00 -1.68 0.00 0.00 37.83 32.96 3ggz s LYS 165 CO 0.63 -0.25 1.58 0.93 -0.76 0.00 0.00 175.35 177.47 3ggz h GLU 166 N 6.67 0.02 -0.01 1.68 5.08 -2.00 -0.42 114.58 125.59 3ggz h GLU 166 Ca -0.42 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 57.97 3ggz h GLU 166 Cb 1.21 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.41 3ggz h GLU 166 CO 0.81 0.01 -0.30 0.93 -1.00 0.00 0.00 179.01 179.46 3ggz h GLU 167 N 0.02 -0.42 -0.99 2.33 3.07 -2.00 -2.07 114.58 114.52 3ggz h GLU 167 Ca 0.54 0.03 0.15 0.00 -0.50 0.00 0.00 59.36 59.58 3ggz h GLU 167 Cb 1.03 0.10 -0.09 0.00 -0.84 0.00 0.00 28.75 28.94 3ggz h GLU 167 CO -0.90 -0.28 0.62 1.25 -1.40 0.00 0.00 179.01 178.30 3ggz h LEU 168 N -0.44 0.84 0.44 1.33 5.85 -1.48 0.06 115.31 121.92 3ggz h LEU 168 Ca 0.07 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 3ggz h LEU 168 Cb 0.53 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3ggz h LEU 168 CO -0.26 0.39 -0.21 0.58 -0.34 0.00 0.00 178.44 178.60 3ggz h VAL 169 N 0.87 0.56 -0.65 1.05 2.07 -0.97 -0.11 116.25 119.08 3ggz h VAL 169 Ca 0.52 -0.21 0.08 0.00 0.82 0.00 0.00 66.70 67.92 3ggz h VAL 169 Cb 0.68 0.66 -0.07 0.00 -1.52 0.00 0.00 31.29 31.04 3ggz h VAL 169 CO -0.30 0.04 0.31 0.44 0.02 0.00 0.00 177.57 178.08 3ggz h ASP 170 N -0.72 0.40 -0.31 0.57 3.32 -0.70 0.43 116.42 119.42 3ggz h ASP 170 Ca -0.06 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3ggz h ASP 170 Cb 0.52 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.04 3ggz h ASP 170 CO 0.10 0.24 0.14 0.25 -1.72 0.00 0.00 179.24 178.26 3ggz h LEU 171 N 0.55 0.45 0.64 1.55 5.85 -0.88 -1.25 115.31 122.22 3ggz h LEU 171 Ca 0.31 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.96 3ggz h LEU 171 Cb 0.31 -0.11 0.01 0.00 0.37 0.00 0.00 40.66 41.23 3ggz h LEU 171 CO -0.25 0.41 -0.31 0.22 -0.34 0.00 0.00 178.44 178.18 3ggz h TYR 172 N 0.50 -0.80 -0.71 1.25 3.20 0.96 -2.56 116.97 118.82 3ggz h TYR 172 Ca 0.13 -0.02 0.13 0.00 3.14 0.00 0.00 58.73 62.10 3ggz h TYR 172 Cb 0.10 0.26 -0.13 0.00 1.54 0.00 0.00 36.73 38.51 3ggz h TYR 172 CO 0.00 -0.50 -0.31 -0.07 -1.64 0.00 0.00 178.16 175.64 3ggz h LEU 173 N -1.10 -1.11 -0.86 2.82 3.38 -0.84 0.24 115.31 117.84 3ggz h LEU 173 Ca -0.09 0.24 0.17 0.00 0.09 0.00 0.00 57.88 58.29 3ggz h LEU 173 Cb 0.66 0.59 -0.10 0.00 0.09 0.00 0.00 40.66 41.89 3ggz h LEU 173 CO 0.14 -0.29 0.42 0.50 0.09 0.00 0.00 178.44 179.30 3ggz h LYS 174 N -0.10 0.53 -0.36 1.13 3.64 -1.22 -0.74 116.57 119.46 3ggz h LYS 174 Ca 0.29 -0.03 -0.12 0.00 -1.27 0.00 0.00 60.65 59.51 3ggz h LYS 174 Cb 0.56 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.26 3ggz h LYS 174 CO -0.76 0.35 -0.25 0.93 -2.27 0.00 0.00 179.45 177.45 3ggz h GLU 175 N 0.55 0.81 0.00 1.90 4.39 -0.15 -2.14 114.58 119.93 3ggz h GLU 175 Ca 0.49 -0.39 -0.02 0.00 0.34 0.00 0.00 59.36 59.78 3ggz h GLU 175 Cb 0.78 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.42 3ggz h GLU 175 CO -0.41 1.02 -0.12 0.82 -1.16 0.00 0.00 179.01 179.15 3ggz h ILE 176 N 0.60 0.83 0.12 3.13 2.04 0.22 -2.31 117.51 122.13 3ggz h ILE 176 Ca 0.07 -0.44 -0.28 0.00 1.00 0.00 0.00 64.86 65.21 3ggz h ILE 176 Cb 0.82 1.26 0.03 0.00 -0.74 0.00 0.00 36.82 38.18 3ggz h ILE 176 CO 0.07 0.11 -1.18 0.00 0.00 0.00 0.00 178.15 177.15 3ggz h ALA 177 N 1.88 -0.02 0.00 1.87 0.00 -0.97 -2.74 119.26 119.29 3ggz h ALA 177 Ca -0.00 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.15 3ggz h ALA 177 Cb 0.25 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3ggz h ALA 177 CO 0.02 0.64 0.00 1.17 0.00 0.00 0.00 179.25 181.07 3ggz n LYS 178 N -3.85 0.46 -0.01 0.00 4.81 -0.83 0.37 118.16 119.11 3ggz n LYS 178 Ca -0.14 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.29 3ggz n LYS 178 Cb 0.96 -1.43 -0.02 0.00 0.02 0.00 0.00 35.03 34.56 3ggz n LYS 178 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 3ggz n THR 179 N -0.93 0.18 0.72 3.15 -1.04 -1.11 -4.68 114.28 110.57 3ggz n THR 179 Ca 0.09 -0.10 0.08 0.00 -2.04 0.00 0.00 64.05 62.08 3ggz n THR 179 Cb 0.04 -0.89 -0.05 0.00 -1.82 0.00 0.00 70.33 67.61 3ggz n THR 179 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3ggz n TYR 180 N -2.16 0.00 -2.76 -1.42 4.01 -1.04 -5.05 117.16 108.74 3ggz n TYR 180 Ca -0.04 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.69 3ggz n TYR 180 Cb 0.58 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.60 3ggz n TYR 180 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3ggz n ASP 181 N -0.81 -6.70 -3.70 7.72 -0.08 0.16 -5.06 116.55 108.08 3ggz n ASP 181 Ca 0.05 1.31 -0.14 0.00 -1.51 0.00 0.00 54.79 54.49 3ggz n ASP 181 Cb 0.28 -4.85 -0.09 0.00 2.34 0.00 0.00 41.12 38.81 3ggz n ASP 181 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 3ggz s VAL 182 N -1.38 0.02 0.25 5.18 0.11 -1.17 -5.05 120.40 118.35 3ggz s VAL 182 Ca -0.05 -0.19 -0.30 0.00 -2.93 0.00 0.00 61.98 58.52 3ggz s VAL 182 Cb 0.00 -0.70 -0.09 0.00 -1.53 0.00 0.00 36.38 34.06 3ggz s VAL 182 CO 0.69 -0.10 1.33 -2.16 -3.33 0.00 0.00 175.10 171.53 3ggz s PRO 183 N -0.63 4.36 -0.01 1.54 0.04 -1.26 -4.81 135.00 134.23 3ggz s PRO 183 Ca -0.07 2.15 0.00 0.00 0.04 0.00 0.00 61.00 63.12 3ggz s PRO 183 Cb -0.03 -3.14 0.01 0.00 0.04 0.00 0.00 34.50 31.37 3ggz s PRO 183 CO 0.04 -0.26 -0.00 -0.47 0.04 0.00 0.00 177.00 176.35 3ggz s TYR 184 N -0.27 0.10 0.00 0.56 5.04 -1.26 -4.63 117.35 116.88 3ggz s TYR 184 Ca 0.55 0.02 0.00 0.00 -2.44 0.00 0.00 57.07 55.19 3ggz s TYR 184 Cb -0.38 -0.13 0.00 0.00 0.35 0.00 0.00 41.96 41.79 3ggz s TYR 184 CO 0.43 -0.03 0.00 0.45 -1.34 0.00 0.00 175.55 175.06 3ggz n SER 185 N 3.40 0.00 -2.15 4.32 2.88 -1.26 -3.01 113.62 117.81 3ggz n SER 185 Ca -0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 3ggz n SER 185 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 3ggz n SER 185 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 3ggz n LYS 186 N 0.00 0.00 0.00 -1.46 2.85 -1.26 -4.21 118.16 114.08 3ggz n LYS 186 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 3ggz n LYS 186 Cb 0.00 -1.41 0.00 0.00 -0.65 0.00 0.00 35.03 32.97 3ggz n LYS 186 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 3ggz n LEU 187 N 2.10 0.40 -4.17 -5.58 7.94 -1.16 -4.55 117.00 111.98 3ggz n LEU 187 Ca 0.00 0.53 -0.40 0.00 -1.11 0.00 0.00 56.01 55.03 3ggz n LEU 187 Cb 0.00 -0.41 -0.07 0.00 0.53 0.00 0.00 43.42 43.47 3ggz n LEU 187 CO 0.05 -0.41 0.20 -1.61 -1.11 0.00 0.00 177.39 174.51 3ggz s GLU 188 N -1.25 2.99 0.00 1.96 8.01 -1.26 -4.72 118.70 124.42 3ggz s GLU 188 Ca 0.00 -2.62 0.00 0.00 0.01 0.00 0.00 54.97 52.36 3ggz s GLU 188 Cb 0.00 -3.97 0.00 0.00 -4.31 0.00 0.00 34.13 25.85 3ggz s GLU 188 CO 0.00 -1.22 0.00 0.27 0.01 0.00 0.00 175.26 174.32 3ggz n ASN 189 N 3.46 0.00 -1.95 -0.19 2.04 -1.26 -5.17 115.26 112.19 3ggz n ASN 189 Ca 0.12 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.26 3ggz n ASN 189 Cb 0.40 0.02 0.00 0.00 -2.53 0.00 0.00 39.78 37.68 3ggz n ASN 189 CO 0.00 0.00 0.00 -1.54 -0.44 0.00 0.00 177.26 175.28 3ggz n SER 190 N -2.30 -7.92 0.00 0.53 3.41 -1.26 -5.10 113.62 100.97 3ggz n SER 190 Ca 0.00 1.35 0.00 0.00 -0.26 0.00 0.00 58.87 59.96 3ggz n SER 190 Cb 0.00 -4.65 0.00 0.00 -0.26 0.00 0.00 64.21 59.30 3ggz n SER 190 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3ggz n LEU 191 N 1.19 0.00 0.00 1.04 7.94 -1.26 -5.24 117.00 120.67 3ggz n LEU 191 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3ggz n LEU 191 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 3ggz n LEU 191 CO 0.00 0.00 0.07 -1.20 -1.11 0.00 0.00 177.39 175.15