#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ggz n ILE 6 N 0.00 0.00 0.00 1.12 5.41 -1.26 -5.17 119.36 119.46 3ggz n ILE 6 Ca 0.00 -0.92 0.00 0.00 1.00 0.00 0.00 62.75 62.83 3ggz n ILE 6 Cb 0.00 0.84 0.00 0.00 -0.71 0.00 0.00 39.64 39.77 3ggz n ILE 6 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 3ggz n PRO 7 N -0.81 0.00 0.19 0.38 -0.02 -1.26 -4.59 135.00 128.89 3ggz n PRO 7 Ca -0.12 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.25 3ggz n PRO 7 Cb 0.76 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 34.18 3ggz n PRO 7 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 3ggz h PHE 8 N 0.00 -0.51 -1.38 6.00 3.57 -2.01 -2.54 116.94 120.08 3ggz h PHE 8 Ca 0.00 -0.01 0.46 0.00 3.53 0.00 0.00 57.97 61.95 3ggz h PHE 8 Cb 0.00 0.17 -0.13 0.00 2.79 0.00 0.00 35.95 38.78 3ggz h PHE 8 CO 0.00 -0.22 0.89 1.15 -2.23 0.00 0.00 178.31 177.91 3ggz h THR 9 N -1.05 0.06 0.05 4.41 2.02 -1.95 0.76 112.91 117.21 3ggz h THR 9 Ca -0.06 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 3ggz h THR 9 Cb 0.52 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 3ggz h THR 9 CO 0.09 0.01 -0.02 0.40 0.37 0.00 0.00 175.52 176.37 3ggz h ILE 10 N 0.04 0.74 -0.61 3.11 2.04 -1.89 -2.57 117.51 118.37 3ggz h ILE 10 Ca 0.85 -1.45 0.12 0.00 1.00 0.00 0.00 64.86 65.39 3ggz h ILE 10 Cb 2.75 1.36 -0.10 0.00 -0.74 0.00 0.00 36.82 40.09 3ggz h ILE 10 CO -0.43 0.24 0.06 0.11 0.00 0.00 0.00 178.15 178.13 3ggz h LYS 11 N -0.98 0.17 -0.66 2.37 1.57 -0.54 -0.72 116.57 117.77 3ggz h LYS 11 Ca -0.01 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.71 3ggz h LYS 11 Cb 0.44 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.68 3ggz h LYS 11 CO 0.01 0.11 0.22 1.25 -0.57 0.00 0.00 179.45 180.47 3ggz h LEU 12 N 0.17 0.93 -0.64 2.94 5.85 -1.06 -0.70 115.31 122.80 3ggz h LEU 12 Ca 0.32 -0.16 -0.07 0.00 0.84 0.00 0.00 57.88 58.82 3ggz h LEU 12 Cb 0.51 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 3ggz h LEU 12 CO -0.48 0.86 0.14 0.50 -0.34 0.00 0.00 178.44 179.13 3ggz h LYS 13 N 0.97 1.03 -0.23 1.25 3.64 -0.75 -1.41 116.57 121.06 3ggz h LYS 13 Ca 0.22 -0.25 -0.16 0.00 -1.27 0.00 0.00 60.65 59.18 3ggz h LYS 13 Cb 0.26 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 3ggz h LYS 13 CO -0.01 0.94 -0.48 1.15 -2.27 0.00 0.00 179.45 178.77 3ggz h THR 14 N 0.95 1.30 0.08 1.00 2.02 -0.95 -2.12 112.91 115.19 3ggz h THR 14 Ca 0.20 -1.69 0.00 0.00 0.77 0.00 0.00 66.41 65.69 3ggz h THR 14 Cb 0.38 1.77 -0.01 0.00 -1.74 0.00 0.00 68.15 68.55 3ggz h THR 14 CO 0.00 0.54 -0.08 0.00 0.37 0.00 0.00 175.52 176.36 3ggz h LEU 16 N -0.17 0.02 -1.51 0.00 3.38 -1.29 -2.04 115.31 113.70 3ggz h LEU 16 Ca 0.00 -0.04 0.28 0.00 0.09 0.00 0.00 57.88 58.21 3ggz h LEU 16 Cb 0.17 -0.01 -0.08 0.00 0.09 0.00 0.00 40.66 40.83 3ggz h LEU 16 CO -0.02 0.06 0.70 0.11 0.09 0.00 0.00 178.44 179.37 3ggz h LYS 17 N -0.02 0.30 0.51 1.13 1.57 -1.25 0.92 116.57 119.72 3ggz h LYS 17 Ca 0.01 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 3ggz h LYS 17 Cb 0.04 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.29 3ggz h LYS 17 CO -0.00 0.20 -0.25 1.98 -0.57 0.00 0.00 179.45 180.81 3ggz h MET 18 N 0.30 -0.66 -1.01 3.15 4.05 -0.65 -2.32 114.93 117.79 3ggz h MET 18 Ca 0.58 0.05 0.24 0.00 -0.28 0.00 0.00 59.70 60.29 3ggz h MET 18 Cb 1.64 0.15 -0.12 0.00 -0.80 0.00 0.00 31.60 32.47 3ggz h MET 18 CO -0.23 -0.35 0.61 0.00 0.23 0.00 0.00 176.91 177.17 3ggz h ILE 20 N 0.56 0.00 -0.82 0.00 2.04 -1.05 0.48 117.51 118.72 3ggz h ILE 20 Ca 0.63 -0.02 0.09 0.00 1.00 0.00 0.00 64.86 66.55 3ggz h ILE 20 Cb 1.25 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 37.21 3ggz h ILE 20 CO -0.43 0.00 -0.54 1.56 0.00 0.00 0.00 178.15 178.74 3ggz h GLN 21 N -1.30 -0.11 -0.39 2.37 1.08 -0.55 0.55 115.11 116.76 3ggz h GLN 21 Ca -0.13 0.01 -0.08 0.00 -1.45 0.00 0.00 58.65 56.99 3ggz h GLN 21 Cb 0.98 0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.42 3ggz h GLN 21 CO 0.21 -0.08 -0.10 0.00 -0.95 0.00 0.00 178.83 177.92 3ggz h ARG 22 N -0.12 0.68 -0.13 1.46 2.47 -1.20 -1.87 114.38 115.68 3ggz h ARG 22 Ca 0.16 -0.21 -0.04 0.00 -1.26 0.00 0.00 59.98 58.63 3ggz h ARG 22 Cb 0.49 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.73 3ggz h ARG 22 CO -0.84 0.77 -0.11 -0.07 0.56 0.00 0.00 179.97 180.28 3ggz h LEU 23 N 0.63 0.18 0.12 3.04 3.38 0.18 -1.47 115.31 121.37 3ggz h LEU 23 Ca 0.11 -0.03 -0.26 0.00 0.09 0.00 0.00 57.88 57.79 3ggz h LEU 23 Cb 0.53 -0.05 0.03 0.00 0.09 0.00 0.00 40.66 41.26 3ggz h LEU 23 CO 0.03 0.32 -1.09 -0.09 0.09 0.00 0.00 178.44 177.70 3ggz h ARG 24 N 0.19 0.53 -0.45 1.13 2.43 -0.65 -2.75 114.38 114.81 3ggz h ARG 24 Ca 0.04 -0.73 0.08 0.00 -0.81 0.00 0.00 59.98 58.56 3ggz h ARG 24 Cb 0.32 0.25 -0.07 0.00 -0.42 0.00 0.00 29.97 30.04 3ggz h ARG 24 CO 0.02 1.32 0.00 -0.92 -1.51 0.00 0.00 179.97 178.88 3ggz h TYR 25 N 0.09 -0.03 -0.51 2.20 3.20 -0.88 0.22 116.97 121.26 3ggz h TYR 25 Ca -0.17 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.72 3ggz h TYR 25 Cb 1.80 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 40.13 3ggz h TYR 25 CO 0.14 -0.09 0.28 0.00 -1.64 0.00 0.00 178.16 176.84 3ggz h ALA 26 N 1.39 1.54 0.77 1.82 0.00 -1.33 -1.28 119.26 122.17 3ggz h ALA 26 Ca 0.22 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3ggz h ALA 26 Cb 0.32 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.91 3ggz h ALA 26 CO -0.37 0.39 -0.37 1.96 0.00 0.00 0.00 179.25 180.86 3ggz h GLN 27 N 0.70 -1.00 -1.00 0.00 4.20 -0.35 0.08 115.11 117.75 3ggz h GLN 27 Ca 0.18 0.07 0.20 0.00 0.06 0.00 0.00 58.65 59.16 3ggz h GLN 27 Cb 0.01 0.23 -0.10 0.00 0.30 0.00 0.00 27.48 27.92 3ggz h GLN 27 CO -0.03 -0.67 0.61 1.49 -0.67 0.00 0.00 178.83 179.57 3ggz h GLU 28 N -1.18 0.67 -0.08 1.46 4.81 -0.80 0.30 114.58 119.76 3ggz h GLU 28 Ca -0.11 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.00 3ggz h GLU 28 Cb 0.79 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.02 3ggz h GLU 28 CO 0.17 0.45 -0.29 -0.22 -0.73 0.00 0.00 179.01 178.39 3ggz h LYS 29 N 0.69 0.33 -0.09 1.92 3.64 -1.19 -2.81 116.57 119.06 3ggz h LYS 29 Ca 0.57 -0.25 -0.12 0.00 -1.27 0.00 0.00 60.65 59.58 3ggz h LYS 29 Cb 0.99 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 3ggz h LYS 29 CO -0.36 0.88 -0.48 1.96 -2.27 0.00 0.00 179.45 179.18 3ggz h GLN 30 N -0.15 0.23 -0.07 1.90 4.20 -0.17 -0.88 115.11 120.17 3ggz h GLN 30 Ca -0.01 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 3ggz h GLN 30 Cb 0.92 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.71 3ggz h GLN 30 CO 0.06 0.67 0.01 1.96 -0.67 0.00 0.00 178.83 180.86 3ggz h GLN 31 N 0.19 0.11 -0.59 1.46 1.08 -0.49 0.35 115.11 117.21 3ggz h GLN 31 Ca 0.01 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.15 3ggz h GLN 31 Cb 0.92 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.31 3ggz h GLN 31 CO 0.07 0.32 0.24 0.00 -0.95 0.00 0.00 178.83 178.51 3ggz h ALA 32 N 0.79 0.76 -0.42 3.87 0.00 -1.44 -0.96 119.26 121.86 3ggz h ALA 32 Ca 0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3ggz h ALA 32 Cb 0.26 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3ggz h ALA 32 CO 0.00 0.37 0.24 0.82 0.00 0.00 0.00 179.25 180.68 3ggz h ILE 33 N 0.81 1.15 -0.15 0.00 2.04 -0.94 -2.13 117.51 118.29 3ggz h ILE 33 Ca 0.20 -0.37 -0.07 0.00 1.00 0.00 0.00 64.86 65.62 3ggz h ILE 33 Cb 0.19 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 3ggz h ILE 33 CO -0.02 0.15 -0.22 0.00 0.00 0.00 0.00 178.15 178.07 3ggz h ALA 34 N 1.10 1.37 0.00 1.87 0.00 -0.12 -2.29 119.26 121.18 3ggz h ALA 34 Ca 0.15 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 3ggz h ALA 34 Cb 0.03 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3ggz h ALA 34 CO -0.03 0.43 -0.54 -0.22 0.00 0.00 0.00 179.25 178.90 3ggz h LYS 35 N 0.23 0.00 0.00 0.00 3.64 -0.72 -2.20 116.57 117.52 3ggz h LYS 35 Ca 0.04 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 3ggz h LYS 35 Cb 0.52 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 3ggz h LYS 35 CO 0.03 0.54 -0.24 0.37 -2.27 0.00 0.00 179.45 177.88 3ggz h GLN 36 N 0.00 0.00 -0.20 1.90 4.15 -1.02 -3.07 115.11 116.87 3ggz h GLN 36 Ca -0.01 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 59.30 3ggz h GLN 36 Cb 0.96 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.65 3ggz h GLN 36 CO 0.07 0.24 -0.32 0.77 -1.93 0.00 0.00 178.83 177.66 3ggz h SER 37 N 0.00 0.62 -0.42 -0.69 0.02 -0.87 -2.86 113.55 109.35 3ggz h SER 37 Ca -0.00 -0.53 0.09 0.00 -0.84 0.00 0.00 61.79 60.51 3ggz h SER 37 Cb 1.11 -0.18 -0.09 0.00 0.14 0.00 0.00 62.40 63.38 3ggz h SER 37 CO 0.03 1.03 -0.16 0.03 -1.14 0.00 0.00 176.83 176.63 3ggz h ARG 38 N 0.23 -0.07 -0.54 3.45 3.08 -1.34 0.39 114.38 119.59 3ggz h ARG 38 Ca 0.02 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.17 3ggz h ARG 38 Cb 0.91 0.02 -0.09 0.00 0.08 0.00 0.00 29.97 30.89 3ggz h ARG 38 CO 0.07 -0.04 0.02 -0.09 -1.07 0.00 0.00 179.97 178.86 3ggz h ARG 39 N -0.07 0.14 0.00 0.04 2.43 -1.50 0.15 114.38 115.57 3ggz h ARG 39 Ca 0.20 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.32 3ggz h ARG 39 Cb 0.38 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 3ggz h ARG 39 CO -0.47 0.09 -0.22 1.96 -1.51 0.00 0.00 179.97 179.82 3ggz h GLN 40 N 0.14 0.00 -0.85 0.20 4.20 -0.79 -2.14 115.11 115.87 3ggz h GLN 40 Ca 0.27 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.95 3ggz h GLN 40 Cb 0.42 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.16 3ggz h GLN 40 CO -0.43 0.22 0.40 0.28 -0.67 0.00 0.00 178.83 178.63 3ggz h VAL 41 N 0.00 1.26 -0.25 -0.54 2.07 0.12 -1.35 116.25 117.56 3ggz h VAL 41 Ca -0.00 -0.75 -0.12 0.00 0.82 0.00 0.00 66.70 66.64 3ggz h VAL 41 Cb 0.41 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 3ggz h VAL 41 CO 0.03 0.32 -0.36 0.00 0.02 0.00 0.00 177.57 177.58 3ggz h ALA 42 N 1.21 0.91 -0.81 1.67 0.00 -0.88 -2.80 119.26 118.56 3ggz h ALA 42 Ca 0.29 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3ggz h ALA 42 Cb 0.14 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 3ggz h ALA 42 CO -0.03 0.62 0.51 0.37 0.00 0.00 0.00 179.25 180.72 3ggz h GLN 43 N 0.47 1.09 0.00 0.00 5.75 -0.71 -1.69 115.11 120.02 3ggz h GLN 43 Ca 0.05 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.46 3ggz h GLN 43 Cb 0.84 -0.24 0.00 0.00 1.07 0.00 0.00 27.48 29.15 3ggz h GLN 43 CO 0.07 0.75 0.00 -0.07 -2.65 0.00 0.00 178.83 176.93 3ggz h LEU 44 N 1.12 0.00 0.13 -2.39 3.38 -1.01 -3.05 115.31 113.49 3ggz h LEU 44 Ca 0.29 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.99 3ggz h LEU 44 Cb -0.08 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.70 3ggz h LEU 44 CO -0.06 0.00 -1.14 -0.07 0.09 0.00 0.00 178.44 177.26 3ggz h LEU 45 N 0.00 0.77 -0.77 1.67 3.38 -1.21 -2.83 115.31 116.32 3ggz h LEU 45 Ca 0.00 -0.85 0.00 0.00 0.09 0.00 0.00 57.88 57.12 3ggz h LEU 45 Cb 0.59 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3ggz h LEU 45 CO 0.00 1.55 0.00 -0.11 0.09 0.00 0.00 178.44 179.97 3ggz n LEU 46 N -3.89 0.54 -0.82 1.67 0.00 -1.02 -2.31 117.00 111.18 3ggz n LEU 46 Ca -0.14 -0.27 0.03 0.00 0.00 0.00 0.00 56.01 55.63 3ggz n LEU 46 Cb 0.94 -0.27 0.03 0.00 0.00 0.00 0.00 43.42 44.13 3ggz n LEU 46 CO 0.56 0.13 0.22 0.41 0.00 0.00 0.00 177.39 178.71 3ggz n THR 47 N 0.01 0.32 -0.42 1.96 -1.04 -1.19 -4.99 114.28 108.93 3ggz n THR 47 Ca 0.00 -0.77 0.00 0.00 -2.04 0.00 0.00 64.05 61.24 3ggz n THR 47 Cb 0.13 0.56 0.00 0.00 -1.82 0.00 0.00 70.33 69.20 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 -0.03 -2.21 -3.62 8.00 5.03 -0.98 -4.78 115.26 116.67 3ggz n ASN 48 Ca 0.05 0.00 -0.41 0.00 0.87 0.00 0.00 54.58 55.09 3ggz n ASN 48 Cb 0.85 -1.76 -0.01 0.00 -1.02 0.00 0.00 39.78 37.85 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 0.28 3.15 0.07 3.52 5.02 -1.07 -4.72 118.16 124.40 3ggz n LYS 49 Ca 0.00 -2.55 -0.12 0.00 -2.02 0.00 0.00 58.31 53.62 3ggz n LYS 49 Cb 0.18 -3.13 -0.07 0.00 -0.02 0.00 0.00 35.03 31.99 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 5.69 -0.51 -0.06 1.97 4.39 -1.86 -0.90 114.58 123.31 3ggz h GLU 50 Ca 0.65 0.03 0.04 0.00 0.34 0.00 0.00 59.36 60.42 3ggz h GLU 50 Cb 0.54 0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 29.25 3ggz h GLU 50 CO 1.84 -0.34 -0.25 1.96 -1.16 0.00 0.00 179.01 181.07 3ggz h GLN 51 N -0.53 -0.34 0.00 2.33 4.20 -1.96 -0.77 115.11 118.05 3ggz h GLN 51 Ca 0.00 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.73 3ggz h GLN 51 Cb 0.54 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.40 3ggz h GLN 51 CO -0.23 -0.23 0.00 -0.22 -0.67 0.00 0.00 178.83 177.49 3ggz h LYS 52 N -0.35 0.00 0.00 1.46 3.64 -1.93 -0.83 116.57 118.56 3ggz h LYS 52 Ca 0.08 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.33 3ggz h LYS 52 Cb 0.46 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 3ggz h LYS 52 CO -0.26 0.00 -1.31 0.00 -2.27 0.00 0.00 179.45 175.61 3ggz n ALA 53 N -1.86 2.07 -0.61 5.00 0.00 -0.35 -3.64 120.51 121.12 3ggz n ALA 53 Ca -0.00 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.97 3ggz n ALA 53 Cb 0.13 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.58 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 -2.84 0.00 -0.47 0.00 -0.00 -0.34 -2.86 115.22 108.72 3ggz n HIS 54 Ca -0.07 0.00 0.38 0.00 -0.00 0.00 0.00 57.72 58.03 3ggz n HIS 54 Cb 0.77 -0.20 0.68 0.00 -0.00 0.00 0.00 29.99 31.25 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 0.37 -0.82 1.57 0.05 -1.74 0.71 116.97 117.11 3ggz h TYR 55 Ca 0.00 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.80 3ggz h TYR 55 Cb 0.00 -0.09 -0.04 0.00 1.01 0.00 0.00 36.73 37.61 3ggz h TYR 55 CO 0.02 -0.11 0.52 -0.09 -1.05 0.00 0.00 178.16 177.44 3ggz h ARG 56 N 0.09 1.11 -0.39 4.88 9.65 -1.65 -2.47 114.38 125.59 3ggz h ARG 56 Ca 0.79 -0.09 -0.07 0.00 -1.10 0.00 0.00 59.98 59.51 3ggz h ARG 56 Cb 2.66 -0.24 -0.01 0.00 -1.39 0.00 0.00 29.97 30.99 3ggz h ARG 56 CO -0.28 0.76 -0.03 0.28 2.80 0.00 0.00 179.97 183.51 3ggz h VAL 57 N 1.13 1.27 -0.94 0.20 2.07 0.58 -2.75 116.25 117.80 3ggz h VAL 57 Ca 0.30 -1.07 0.28 0.00 0.82 0.00 0.00 66.70 67.03 3ggz h VAL 57 Cb -0.07 1.17 -0.16 0.00 -1.52 0.00 0.00 31.29 30.70 3ggz h VAL 57 CO -0.06 0.36 0.21 -0.33 0.02 0.00 0.00 177.57 177.77 3ggz h GLU 58 N 0.53 0.10 -0.59 1.57 5.08 -1.13 1.41 114.58 121.55 3ggz h GLU 58 Ca 0.11 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 3ggz h GLU 58 Cb 0.52 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 3ggz h GLU 58 CO 0.03 0.06 0.30 1.15 -1.00 0.00 0.00 179.01 179.55 3ggz h THR 59 N 0.10 1.20 -0.63 1.13 2.02 -1.43 -1.82 112.91 113.48 3ggz h THR 59 Ca 0.62 -0.54 0.18 0.00 0.77 0.00 0.00 66.41 67.45 3ggz h THR 59 Cb 1.36 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 68.22 3ggz h THR 59 CO -0.78 0.22 0.47 -0.07 0.37 0.00 0.00 175.52 175.74 3ggz h LEU 60 N 0.80 0.00 -0.01 2.58 -0.00 0.21 -0.04 115.31 118.85 3ggz h LEU 60 Ca 0.21 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 58.04 3ggz h LEU 60 Cb 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.74 3ggz h LEU 60 CO -0.03 0.00 -0.18 0.40 -0.00 0.00 0.00 178.44 178.63 3ggz h ILE 61 N 0.00 1.53 -0.11 1.22 5.03 -0.56 -1.23 117.51 123.39 3ggz h ILE 61 Ca 0.30 -1.80 -0.05 0.00 -0.12 0.00 0.00 64.86 63.18 3ggz h ILE 61 Cb 1.23 2.65 -0.01 0.00 -3.03 0.00 0.00 36.82 37.66 3ggz h ILE 61 CO -0.00 0.49 -0.18 0.45 -0.68 0.00 0.00 178.15 178.23 3ggz h HIS 62 N -0.50 0.19 -0.24 1.37 3.86 -1.05 0.19 115.15 118.97 3ggz h HIS 62 Ca -0.02 -0.02 -0.18 0.00 -1.16 0.00 0.00 60.37 58.98 3ggz h HIS 62 Cb 0.89 -0.05 -0.00 0.00 1.06 0.00 0.00 27.41 29.31 3ggz h HIS 62 CO 0.17 0.35 -0.58 -0.44 0.86 0.00 0.00 177.93 178.29 3ggz h ASP 63 N 0.17 0.86 -0.24 2.45 5.19 -1.06 -1.46 116.42 122.33 3ggz h ASP 63 Ca 0.03 -0.48 -0.14 0.00 -0.62 0.00 0.00 57.03 55.83 3ggz h ASP 63 Cb 0.42 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.67 3ggz h ASP 63 CO 0.03 1.25 -0.33 0.44 -3.12 0.00 0.00 179.24 177.51 3ggz h ASP 64 N 0.58 0.80 -0.56 6.45 3.32 -0.65 -2.55 116.42 123.81 3ggz h ASP 64 Ca 0.00 -0.34 -0.08 0.00 0.02 0.00 0.00 57.03 56.64 3ggz h ASP 64 Cb 1.17 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.48 3ggz h ASP 64 CO 0.12 1.06 0.05 0.40 -1.72 0.00 0.00 179.24 179.16 3ggz h ILE 65 N 0.64 1.26 -0.58 0.35 2.04 -0.55 -2.41 117.51 118.26 3ggz h ILE 65 Ca 0.07 -1.04 -0.01 0.00 1.00 0.00 0.00 64.86 64.87 3ggz h ILE 65 Cb 0.87 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 3ggz h ILE 65 CO 0.08 0.38 0.31 -0.74 0.00 0.00 0.00 178.15 178.18 3ggz h HIS 66 N 0.92 0.80 -0.47 1.37 2.76 -1.14 -2.18 115.15 117.21 3ggz h HIS 66 Ca 0.18 -0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.39 3ggz h HIS 66 Cb 0.46 -0.25 -0.06 0.00 1.55 0.00 0.00 27.41 29.11 3ggz h HIS 66 CO 0.03 0.59 0.13 0.82 -1.30 0.00 0.00 177.93 178.20 3ggz h ILE 67 N 0.78 0.80 0.04 6.26 2.04 -1.10 -1.61 117.51 124.70 3ggz h ILE 67 Ca 0.20 -0.10 0.03 0.00 1.00 0.00 0.00 64.86 65.99 3ggz h ILE 67 Cb 0.06 0.48 -0.05 0.00 -0.74 0.00 0.00 36.82 36.57 3ggz h ILE 67 CO -0.03 0.05 -0.45 -0.08 0.00 0.00 0.00 178.15 177.64 3ggz h GLU 68 N 0.29 -0.60 -1.21 2.37 4.81 -0.94 0.13 114.58 119.42 3ggz h GLU 68 Ca 0.23 0.04 0.34 0.00 -0.13 0.00 0.00 59.36 59.84 3ggz h GLU 68 Cb 0.27 0.14 -0.07 0.00 0.63 0.00 0.00 28.75 29.71 3ggz h GLU 68 CO -0.26 -0.40 0.83 1.25 -0.73 0.00 0.00 179.01 179.70 3ggz h LEU 69 N -0.63 0.16 0.33 1.64 5.85 -0.78 0.58 115.31 122.47 3ggz h LEU 69 Ca 0.03 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 3ggz h LEU 69 Cb 0.68 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.73 3ggz h LEU 69 CO -0.31 0.01 -0.16 -0.07 -0.34 0.00 0.00 178.44 177.57 3ggz h LEU 70 N 0.13 -0.38 -1.41 2.25 3.38 0.12 -1.08 115.31 118.32 3ggz h LEU 70 Ca 0.63 -0.15 0.28 0.00 0.09 0.00 0.00 57.88 58.72 3ggz h LEU 70 Cb 2.16 0.10 -0.09 0.00 0.09 0.00 0.00 40.66 42.92 3ggz h LEU 70 CO -0.14 0.08 0.69 -0.33 0.09 0.00 0.00 178.44 178.83 3ggz h GLU 71 N -0.97 0.33 -0.10 1.13 5.08 0.11 0.32 114.58 120.49 3ggz h GLU 71 Ca -0.05 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 3ggz h GLU 71 Cb 0.51 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 3ggz h GLU 71 CO 0.07 0.22 -0.13 0.82 -1.00 0.00 0.00 179.01 179.00 3ggz h ILE 72 N 0.34 1.38 -0.55 3.13 2.04 -1.08 -2.52 117.51 120.25 3ggz h ILE 72 Ca 0.61 -1.34 -0.04 0.00 1.00 0.00 0.00 64.86 65.09 3ggz h ILE 72 Cb 1.63 2.04 -0.03 0.00 -0.74 0.00 0.00 36.82 39.72 3ggz h ILE 72 CO -0.28 0.38 0.18 -0.07 0.00 0.00 0.00 178.15 178.35 3ggz h LEU 73 N -0.18 0.75 0.23 1.44 3.38 0.62 -1.38 115.31 120.18 3ggz h LEU 73 Ca 0.01 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3ggz h LEU 73 Cb 0.67 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 3ggz h LEU 73 CO 0.03 0.71 -0.35 -0.08 0.09 0.00 0.00 178.44 178.84 3ggz h GLU 74 N 0.80 -0.58 -0.32 1.13 4.81 -0.45 -1.57 114.58 118.41 3ggz h GLU 74 Ca 0.18 0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.49 3ggz h GLU 74 Cb 0.22 0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.68 3ggz h GLU 74 CO -0.01 -0.39 -0.34 1.25 -0.73 0.00 0.00 179.01 178.79 3ggz h LEU 75 N -0.60 -1.17 -1.00 1.64 6.46 -1.23 0.17 115.31 119.58 3ggz h LEU 75 Ca -0.03 0.16 0.41 0.00 -0.12 0.00 0.00 57.88 58.30 3ggz h LEU 75 Cb 0.55 0.49 -0.18 0.00 -0.73 0.00 0.00 40.66 40.79 3ggz h LEU 75 CO -0.11 -0.22 0.51 -1.22 -0.62 0.00 0.00 178.44 176.78 3ggz n TYR 76 N -4.33 1.14 0.25 1.25 4.01 -0.54 -0.37 117.16 118.57 3ggz n TYR 76 Ca -0.01 1.18 -0.10 0.00 -0.16 0.00 0.00 57.90 58.80 3ggz n TYR 76 Cb 0.20 -1.56 -0.05 0.00 -0.31 0.00 0.00 39.34 37.62 3ggz n TYR 76 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3ggz h GLU 78 N -0.92 0.04 -0.52 0.00 5.08 0.44 1.07 114.58 119.77 3ggz h GLU 78 Ca -0.07 -0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.35 3ggz h GLU 78 Cb 0.51 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.70 3ggz h GLU 78 CO 0.11 0.02 0.22 1.25 -1.00 0.00 0.00 179.01 179.62 3ggz h LEU 79 N 0.04 0.28 -0.35 1.33 6.46 -0.64 -2.04 115.31 120.39 3ggz h LEU 79 Ca 0.58 0.05 -0.13 0.00 -0.12 0.00 0.00 57.88 58.26 3ggz h LEU 79 Cb 1.18 0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 41.11 3ggz h LEU 79 CO -0.87 0.19 -0.28 -0.07 -0.62 0.00 0.00 178.44 176.79 3ggz h LEU 80 N 0.43 0.86 -0.66 2.25 3.38 0.16 -2.80 115.31 118.93 3ggz h LEU 80 Ca 0.24 -0.45 0.14 0.00 0.09 0.00 0.00 57.88 57.91 3ggz h LEU 80 Cb 0.22 -0.24 -0.11 0.00 0.09 0.00 0.00 40.66 40.63 3ggz h LEU 80 CO -0.21 1.13 0.07 0.25 0.09 0.00 0.00 178.44 179.76 3ggz h LEU 81 N 0.60 -0.17 0.12 1.67 5.85 0.09 -0.30 115.31 123.18 3ggz h LEU 81 Ca 0.06 0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 3ggz h LEU 81 Cb 0.86 0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.13 3ggz h LEU 81 CO 0.07 -0.09 -0.06 0.00 -0.34 0.00 0.00 178.44 178.03 3ggz h ALA 82 N 1.58 -0.16 0.00 1.25 0.00 -1.44 -2.93 119.26 117.57 3ggz h ALA 82 Ca 0.36 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3ggz h ALA 82 Cb 0.59 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3ggz h ALA 82 CO -0.52 -0.42 0.00 0.54 0.00 0.00 0.00 179.25 178.85 3ggz n ARG 83 N -5.01 0.68 -0.32 0.00 1.74 -0.65 -4.12 116.66 109.00 3ggz n ARG 83 Ca -0.09 0.00 0.07 0.00 -0.77 0.00 0.00 57.85 57.07 3ggz n ARG 83 Cb 0.22 -1.33 0.23 0.00 -1.02 0.00 0.00 32.46 30.56 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 0.02 0.78 -0.47 1.55 2.07 -0.89 -0.56 116.25 118.75 3ggz h VAL 84 Ca 0.00 -0.25 0.06 0.00 0.82 0.00 0.00 66.70 67.33 3ggz h VAL 84 Cb 0.37 -0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.10 3ggz h VAL 84 CO 0.00 0.13 0.32 1.56 0.02 0.00 0.00 177.57 179.60 3ggz h GLN 85 N 0.73 0.37 0.00 1.57 1.08 -1.86 -0.78 115.11 116.22 3ggz h GLN 85 Ca 0.48 -0.02 -0.05 0.00 -1.45 0.00 0.00 58.65 57.61 3ggz h GLN 85 Cb 0.62 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.96 3ggz h GLN 85 CO -0.33 0.25 -0.34 0.28 -0.95 0.00 0.00 178.83 177.73 3ggz h VAL 86 N 0.38 0.36 0.00 -0.54 2.07 -1.45 -3.22 116.25 113.86 3ggz h VAL 86 Ca 0.21 -1.53 -0.11 0.00 0.82 0.00 0.00 66.70 66.09 3ggz h VAL 86 Cb 0.33 2.13 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 3ggz h VAL 86 CO -0.05 0.21 -0.53 0.40 0.02 0.00 0.00 177.57 177.62 3ggz h ILE 87 N 0.00 1.03 0.00 4.57 2.04 -0.58 -3.09 117.51 121.49 3ggz h ILE 87 Ca -0.01 -2.08 -0.02 0.00 1.00 0.00 0.00 64.86 63.75 3ggz h ILE 87 Cb 1.18 2.25 -0.00 0.00 -0.74 0.00 0.00 36.82 39.51 3ggz h ILE 87 CO 0.03 0.52 -0.10 -1.13 0.00 0.00 0.00 178.15 177.47 3ggz h ASN 88 N 0.00 0.00 -1.44 1.72 -1.24 -1.44 -3.23 115.58 109.95 3ggz h ASN 88 Ca -0.01 0.00 -0.63 0.00 0.71 0.00 0.00 56.30 56.38 3ggz h ASN 88 Cb 1.21 0.00 -0.23 0.00 0.73 0.00 0.00 38.32 40.04 3ggz h ASN 88 CO 0.07 0.10 0.74 0.47 -1.29 0.00 0.00 177.43 177.51 3ggz n ASP 89 N -3.21 7.06 -3.81 1.15 8.00 -1.17 -4.90 116.55 119.67 3ggz n ASP 89 Ca 0.01 -3.53 -0.12 0.00 0.71 0.00 0.00 54.79 51.85 3ggz n ASP 89 Cb 0.38 -1.13 -0.11 0.00 -0.02 0.00 0.00 41.12 40.25 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 -3.75 0.04 0.00 0.53 1.01 -1.22 -5.04 121.20 112.76 3ggz s ILE 90 Ca 0.55 -0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.90 3ggz s ILE 90 Cb 0.41 -0.40 0.00 0.00 0.01 0.00 0.00 42.46 42.48 3ggz s ILE 90 CO -0.28 -0.16 0.00 -0.24 0.00 0.00 0.00 174.94 174.26 3ggz n SER 91 N 2.21 0.00 -4.23 3.58 2.88 -1.26 -4.82 113.62 111.98 3ggz n SER 91 Ca -0.17 -0.11 -0.15 0.00 -1.33 0.00 0.00 58.87 57.11 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 1.14 0.06 2.46 -4.23 -1.26 -4.60 115.64 109.21 3ggz s THR 92 Ca 0.00 -1.88 -0.25 0.00 -1.18 0.00 0.00 61.69 58.38 3ggz s THR 92 Cb 0.00 -1.66 -0.16 0.00 1.34 0.00 0.00 72.50 72.02 3ggz s THR 92 CO 0.00 -0.64 1.61 -0.33 -0.54 0.00 0.00 174.62 174.73 3ggz h GLU 93 N 3.13 -0.10 -1.00 3.99 5.08 -2.00 -2.70 114.58 120.98 3ggz h GLU 93 Ca -0.37 0.01 0.38 0.00 -1.00 0.00 0.00 59.36 58.37 3ggz h GLU 93 Cb 1.19 0.02 -0.17 0.00 0.50 0.00 0.00 28.75 30.29 3ggz h GLU 93 CO 0.58 0.03 0.49 1.49 -1.00 0.00 0.00 179.01 180.61 3ggz h GLU 94 N -0.22 0.09 0.03 2.33 4.57 -1.98 0.13 114.58 119.52 3ggz h GLU 94 Ca -0.01 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.16 3ggz h GLU 94 Cb 0.18 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.75 3ggz h GLU 94 CO 0.02 0.06 -0.02 1.96 -1.18 0.00 0.00 179.01 179.85 3ggz h GLN 95 N 0.09 -0.04 -0.77 1.92 4.20 -1.86 -2.43 115.11 116.22 3ggz h GLN 95 Ca 0.79 0.00 0.12 0.00 0.06 0.00 0.00 58.65 59.62 3ggz h GLN 95 Cb 1.98 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 29.69 3ggz h GLN 95 CO -0.74 -0.03 0.37 1.25 -0.67 0.00 0.00 178.83 179.02 3ggz h LEU 96 N -0.04 0.46 0.00 1.46 5.85 -1.33 -2.77 115.31 118.94 3ggz h LEU 96 Ca -0.00 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.79 3ggz h LEU 96 Cb 0.04 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.07 3ggz h LEU 96 CO 0.00 0.23 0.00 0.52 -0.34 0.00 0.00 178.44 178.85 3ggz n VAL 97 N -4.88 0.00 -1.63 1.05 0.31 -0.07 -2.46 118.33 110.65 3ggz n VAL 97 Ca 0.13 1.42 -0.36 0.00 -0.01 0.00 0.00 64.34 65.52 3ggz n VAL 97 Cb 0.34 -2.32 0.04 0.00 -0.91 0.00 0.00 33.84 31.00 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 -1.93 2.65 0.00 5.55 5.02 -0.92 -4.29 118.16 124.24 3ggz n LYS 98 Ca 0.00 -3.24 0.00 0.00 -2.02 0.00 0.00 58.31 53.05 3ggz n LYS 98 Cb 0.00 -2.23 0.00 0.00 -0.02 0.00 0.00 35.03 32.78 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 -0.49 0.00 -2.65 1.97 2.13 -1.04 -4.95 120.64 115.61 3ggz n GLU 99 Ca 0.55 0.00 -0.24 0.00 0.66 0.00 0.00 57.16 58.13 3ggz n GLU 99 Cb 0.42 -0.09 -0.01 0.00 0.27 0.00 0.00 31.44 32.03 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 -0.56 3.15 0.35 4.31 8.25 -1.03 -4.68 115.22 125.01 3ggz n HIS 100 Ca 0.00 -3.33 0.04 0.00 -0.26 0.00 0.00 57.72 54.18 3ggz n HIS 100 Cb 0.00 -0.23 -0.05 0.00 1.12 0.00 0.00 29.99 30.83 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 3.41 0.02 -0.41 0.00 -1.26 -2.10 117.12 116.44 3ggz n MET 101 Ca 0.33 -0.01 -0.18 0.00 0.00 0.00 0.00 57.70 57.84 3ggz n MET 101 Cb 0.61 -0.97 -0.14 0.00 0.00 0.00 0.00 33.22 32.72 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 0.33 0.47 6.12 3.32 -1.94 -3.33 116.42 121.40 3ggz h ASP 102 Ca 0.00 -0.65 0.00 0.00 0.02 0.00 0.00 57.03 56.40 3ggz h ASP 102 Cb 0.25 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.69 3ggz h ASP 102 CO 0.00 1.57 -0.04 -0.90 -1.72 0.00 0.00 179.24 178.15 3ggz n ASP 103 N -3.39 0.15 -0.00 6.45 5.68 -1.26 -4.92 116.55 119.26 3ggz n ASP 103 Ca -0.24 -0.33 -0.00 0.00 -0.50 0.00 0.00 54.79 53.71 3ggz n ASP 103 Cb 1.05 -0.20 -0.00 0.00 -1.14 0.00 0.00 41.12 40.83 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 1.27 0.49 0.29 6.12 0.00 -1.25 -4.94 105.19 107.16 3ggz n GLY 104 Ca 0.15 -0.10 -0.07 0.00 0.00 0.00 0.00 46.02 45.99 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 1.24 0.17 -0.61 2.04 -1.86 -2.79 117.51 115.70 3ggz h ILE 105 Ca -0.00 -0.76 -0.01 0.00 1.00 0.00 0.00 64.86 65.09 3ggz h ILE 105 Cb 0.01 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 3ggz h ILE 105 CO 0.00 0.30 -0.08 -1.13 0.00 0.00 0.00 178.15 177.24 3ggz h ASN 106 N 0.91 -0.19 0.00 1.72 -1.24 -1.70 -2.47 115.58 112.61 3ggz h ASN 106 Ca 0.21 -0.35 0.00 0.00 0.71 0.00 0.00 56.30 56.88 3ggz h ASN 106 Cb 0.22 0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.32 3ggz h ASN 106 CO -0.02 0.33 0.28 1.21 -1.29 0.00 0.00 177.43 177.95 3ggz n GLU 107 N -4.95 0.06 -0.10 6.67 2.13 -1.22 -1.63 120.64 121.61 3ggz n GLU 107 Ca -0.08 0.49 -0.14 0.00 0.66 0.00 0.00 57.16 58.09 3ggz n GLU 107 Cb 0.27 -1.99 -0.05 0.00 0.27 0.00 0.00 31.44 29.94 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 -1.48 1.08 0.03 4.31 0.00 -1.05 -4.13 120.51 119.27 3ggz n ALA 108 Ca -0.01 -0.86 -0.11 0.00 0.00 0.00 0.00 53.44 52.47 3ggz n ALA 108 Cb 0.30 0.08 -0.06 0.00 0.00 0.00 0.00 19.45 19.76 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 -0.95 0.93 -0.69 0.00 2.10 -1.22 -1.90 117.51 115.78 3ggz h ILE 109 Ca -0.20 0.00 0.10 0.00 1.08 0.00 0.00 64.86 65.84 3ggz h ILE 109 Cb 1.13 0.93 -0.07 0.00 -1.09 0.00 0.00 36.82 37.72 3ggz h ILE 109 CO -0.12 0.00 0.31 0.03 -1.08 0.00 0.00 178.15 177.29 3ggz h ARG 110 N -0.02 0.51 -0.01 2.19 3.08 -1.56 -2.29 114.38 116.28 3ggz h ARG 110 Ca 0.02 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 3ggz h ARG 110 Cb 0.06 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 29.99 3ggz h ARG 110 CO -0.05 0.34 0.00 0.66 -1.07 0.00 0.00 179.97 179.85 3ggz h SER 111 N 0.53 0.01 -0.73 7.04 4.64 -1.67 -2.86 113.55 120.51 3ggz h SER 111 Ca 0.35 -0.31 0.15 0.00 -0.47 0.00 0.00 61.79 61.51 3ggz h SER 111 Cb 0.41 -0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.36 3ggz h SER 111 CO -0.30 0.32 -0.11 -0.07 -0.87 0.00 0.00 176.83 175.80 3ggz h LEU 112 N -0.29 -0.56 -0.98 5.97 3.38 -0.94 0.45 115.31 122.34 3ggz h LEU 112 Ca 0.00 0.21 0.04 0.00 0.09 0.00 0.00 57.88 58.23 3ggz h LEU 112 Cb 0.31 0.41 -0.06 0.00 0.09 0.00 0.00 40.66 41.41 3ggz h LEU 112 CO 0.00 -0.22 0.64 0.40 0.09 0.00 0.00 178.44 179.35 3ggz h ILE 113 N 0.03 1.14 0.36 1.22 2.04 -1.34 -2.49 117.51 118.48 3ggz h ILE 113 Ca 0.37 -0.41 -0.02 0.00 1.00 0.00 0.00 64.86 65.80 3ggz h ILE 113 Cb 0.60 -0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 3ggz h ILE 113 CO -0.72 0.22 -0.18 0.22 0.00 0.00 0.00 178.15 177.70 3ggz h TYR 114 N 1.21 -0.46 -0.25 1.37 3.20 0.04 -2.71 116.97 119.37 3ggz h TYR 114 Ca 0.40 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.33 3ggz h TYR 114 Cb 0.05 0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 3ggz h TYR 114 CO -0.01 -0.28 0.53 0.00 -1.64 0.00 0.00 178.16 176.76 3ggz h ALA 115 N 0.15 1.85 -0.59 1.82 0.00 -0.66 -3.27 119.26 118.56 3ggz h ALA 115 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3ggz h ALA 115 Cb 0.38 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3ggz h ALA 115 CO 0.08 -0.66 0.00 -0.89 0.00 0.00 0.00 179.25 177.78 3ggz n ILE 116 N -3.18 0.00 -0.23 0.00 5.41 -1.02 -0.80 119.36 119.54 3ggz n ILE 116 Ca 0.04 1.35 -0.05 0.00 1.00 0.00 0.00 62.75 65.10 3ggz n ILE 116 Cb 0.65 -1.83 0.01 0.00 -0.71 0.00 0.00 39.64 37.76 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 -1.20 -1.87 1.39 3.38 -1.81 -2.38 115.31 112.83 3ggz h LEU 117 Ca 0.00 0.24 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 3ggz h LEU 117 Cb 0.00 0.60 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 3ggz h LEU 117 CO 0.00 -0.30 -0.05 -0.26 0.09 0.00 0.00 178.44 177.92 3ggz h PHE 118 N -0.14 0.02 -3.69 1.13 0.04 -1.47 -3.38 116.94 109.45 3ggz h PHE 118 Ca 0.25 -0.00 -0.69 0.00 2.80 0.00 0.00 57.97 60.33 3ggz h PHE 118 Cb 0.56 -0.01 -0.33 0.00 2.20 0.00 0.00 35.95 38.37 3ggz h PHE 118 CO -0.67 0.07 -0.66 0.08 -0.60 0.00 0.00 178.31 176.53 3ggz s VAL 119 N -4.95 3.06 -2.27 -0.55 1.01 0.02 -4.95 120.40 111.77 3ggz s VAL 119 Ca -0.05 -1.60 0.22 0.00 0.00 0.00 0.00 61.98 60.55 3ggz s VAL 119 Cb 0.17 -2.87 0.43 0.00 0.00 0.00 0.00 36.38 34.10 3ggz s VAL 119 CO 0.68 -0.29 1.39 -0.90 0.00 0.00 0.00 175.10 175.98 3ggz n ASP 120 N 4.60 3.45 -0.56 3.32 5.68 -1.26 -4.23 116.55 127.56 3ggz n ASP 120 Ca -0.09 -1.97 0.11 0.00 -0.50 0.00 0.00 54.79 52.33 3ggz n ASP 120 Cb 0.43 -0.27 0.38 0.00 -1.14 0.00 0.00 41.12 40.52 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 1.43 1.74 -2.70 0.11 0.00 -1.26 -3.96 120.64 116.01 3ggz n GLU 121 Ca 0.19 -1.11 -0.13 0.00 0.00 0.00 0.00 57.16 56.11 3ggz n GLU 121 Cb 0.59 -1.40 0.02 0.00 0.00 0.00 0.00 31.44 30.64 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 0.34 1.13 -0.40 3.84 0.31 -1.26 -4.87 118.33 117.41 3ggz n VAL 122 Ca 0.16 -3.58 0.35 0.00 -0.01 0.00 0.00 64.34 61.27 3ggz n VAL 122 Cb 0.34 0.21 0.59 0.00 -0.91 0.00 0.00 33.84 34.07 3ggz n VAL 122 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3ggz n LYS 123 N -0.09 -0.04 0.31 5.55 5.02 -1.25 0.17 118.16 127.83 3ggz n LYS 123 Ca 0.16 1.14 0.16 0.00 -2.02 0.00 0.00 58.31 57.75 3ggz n LYS 123 Cb 0.77 -2.21 0.85 0.00 -0.02 0.00 0.00 35.03 34.41 3ggz n LYS 123 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3ggz h GLU 124 N 0.00 0.00 -0.26 1.97 3.07 -1.95 -2.55 114.58 114.87 3ggz h GLU 124 Ca 0.78 0.00 0.05 0.00 -0.50 0.00 0.00 59.36 59.70 3ggz h GLU 124 Cb 2.46 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 30.32 3ggz h GLU 124 CO -0.46 0.00 -0.09 -0.07 -1.40 0.00 0.00 179.01 176.99 3ggz h LEU 125 N 0.00 -0.32 -1.71 1.33 3.38 -0.66 -1.20 115.31 116.12 3ggz h LEU 125 Ca 0.02 0.09 0.28 0.00 0.09 0.00 0.00 57.88 58.36 3ggz h LEU 125 Cb 0.64 0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.54 3ggz h LEU 125 CO -0.00 -0.12 0.89 0.77 0.09 0.00 0.00 178.44 180.07 3ggz h SER 126 N -0.04 0.00 -0.59 -0.43 4.64 -1.68 0.56 113.55 116.00 3ggz h SER 126 Ca 0.13 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.47 3ggz h SER 126 Cb 0.24 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.30 3ggz h SER 126 CO -0.29 0.00 0.39 1.56 -0.87 0.00 0.00 176.83 177.62 3ggz h GLN 127 N 0.00 0.72 -0.07 4.77 4.20 -1.41 -2.10 115.11 121.22 3ggz h GLN 127 Ca 0.46 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 59.14 3ggz h GLN 127 Cb 2.24 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 29.85 3ggz h GLN 127 CO -0.00 0.47 0.01 -0.07 -0.67 0.00 0.00 178.83 178.56 3ggz h LEU 128 N 0.74 -0.01 -0.39 1.46 3.38 -0.00 0.34 115.31 120.83 3ggz h LEU 128 Ca 0.23 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.29 3ggz h LEU 128 Cb 0.01 0.02 -0.09 0.00 0.09 0.00 0.00 40.66 40.69 3ggz h LEU 128 CO -0.06 0.01 -0.24 0.50 0.09 0.00 0.00 178.44 178.74 3ggz h LYS 129 N 0.03 -0.17 -0.18 1.13 3.64 -1.47 -0.15 116.57 119.39 3ggz h LYS 129 Ca 0.03 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.46 3ggz h LYS 129 Cb 0.03 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.85 3ggz h LYS 129 CO -0.05 -0.12 -0.07 -0.44 -2.27 0.00 0.00 179.45 176.51 3ggz h ASP 130 N -0.18 -0.24 0.00 4.20 3.32 -1.22 -0.37 116.42 121.93 3ggz h ASP 130 Ca 0.19 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.30 3ggz h ASP 130 Cb 0.47 0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.16 3ggz h ASP 130 CO -0.49 -0.09 0.00 0.18 -1.72 0.00 0.00 179.24 177.12 3ggz n LEU 131 N -5.22 0.14 -0.11 1.55 4.77 0.08 -1.69 117.00 116.51 3ggz n LEU 131 Ca -0.03 -0.07 -0.14 0.00 -0.03 0.00 0.00 56.01 55.75 3ggz n LEU 131 Cb 0.14 -0.07 -0.13 0.00 -2.33 0.00 0.00 43.42 41.03 3ggz n LEU 131 CO 0.24 0.03 -1.24 0.23 -1.33 0.00 0.00 177.39 175.32 3ggz n MET 132 N -0.24 0.70 0.18 3.23 2.81 -0.15 -3.79 117.12 119.86 3ggz n MET 132 Ca 0.00 0.07 0.02 0.00 -1.81 0.00 0.00 57.70 55.99 3ggz n MET 132 Cb 0.03 -1.50 0.33 0.00 -0.71 0.00 0.00 33.22 31.37 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 0.44 1.26 0.00 3.04 0.00 -1.36 3.31 119.26 125.95 3ggz h ALA 133 Ca -0.55 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 53.93 3ggz h ALA 133 Cb 2.03 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.74 3ggz h ALA 133 CO -0.03 0.52 -0.26 2.35 0.00 0.00 0.00 179.25 181.83 3ggz h TRP 134 N 0.00 0.00 0.00 0.00 7.01 -1.69 -3.20 115.95 118.07 3ggz h TRP 134 Ca -0.00 0.00 -0.21 0.00 2.11 0.00 0.00 58.89 60.79 3ggz h TRP 134 Cb 0.76 0.00 -0.04 0.00 -2.10 0.00 0.00 29.16 27.78 3ggz h TRP 134 CO 0.00 0.26 -1.82 1.17 -2.79 0.00 0.00 178.44 175.25 3ggz n LYS 135 N -4.19 1.93 0.00 2.65 3.00 -0.63 -5.00 118.16 115.92 3ggz n LYS 135 Ca -0.02 -0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.28 3ggz n LYS 135 Cb 0.31 -1.31 0.00 0.00 0.00 0.00 0.00 35.03 34.03 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 -2.42 0.00 -3.89 3.15 5.41 1.09 -4.38 119.36 118.31 3ggz n ILE 136 Ca -0.19 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.46 3ggz n ILE 136 Cb 0.87 0.00 -0.00 0.00 -0.71 0.00 0.00 39.64 39.80 3ggz n ILE 136 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 3ggz s ASN 137 N 1.00 0.18 0.00 4.38 2.20 -1.17 -4.78 114.94 116.76 3ggz s ASN 137 Ca 0.00 -1.15 0.28 0.00 -0.94 0.00 0.00 52.86 51.04 3ggz s ASN 137 Cb 0.00 0.78 0.99 0.00 -2.00 0.00 0.00 41.25 41.02 3ggz s ASN 137 CO 0.00 -1.53 1.72 0.52 -2.94 0.00 0.00 177.10 174.87 3ggz n VAL 138 N -0.52 0.00 0.07 3.54 0.31 -1.26 -3.54 118.33 116.92 3ggz n VAL 138 Ca -0.05 -0.06 -0.16 0.00 -0.01 0.00 0.00 64.34 64.05 3ggz n VAL 138 Cb 0.60 0.05 -0.14 0.00 -0.91 0.00 0.00 33.84 33.44 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 0.60 0.25 -0.03 5.55 -0.00 -1.98 -3.31 114.58 115.66 3ggz h GLU 139 Ca 0.00 -0.42 0.03 0.00 -0.00 0.00 0.00 59.36 58.97 3ggz h GLU 139 Cb 0.43 0.16 -0.03 0.00 -0.00 0.00 0.00 28.75 29.30 3ggz h GLU 139 CO 0.00 1.11 -0.14 0.35 -0.00 0.00 0.00 179.01 180.33 3ggz h PHE 140 N 0.07 -0.36 -0.32 2.06 3.57 -1.98 -1.75 116.94 118.23 3ggz h PHE 140 Ca -0.23 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.33 3ggz h PHE 140 Cb 2.01 0.17 -0.04 0.00 2.79 0.00 0.00 35.95 40.87 3ggz h PHE 140 CO 0.06 -0.21 0.07 -0.39 -2.23 0.00 0.00 178.31 175.61 3ggz h VAL 141 N -0.22 0.85 0.00 1.41 -1.51 -1.74 -0.20 116.25 114.84 3ggz h VAL 141 Ca 0.06 -0.06 -0.00 0.00 -1.23 0.00 0.00 66.70 65.46 3ggz h VAL 141 Cb 0.30 0.65 -0.00 0.00 -2.13 0.00 0.00 31.29 30.11 3ggz h VAL 141 CO -0.16 0.03 -0.01 0.78 -1.23 0.00 0.00 177.57 176.98 3ggz h ASN 142 N 0.19 0.00 1.37 4.19 2.35 -1.58 0.44 115.58 122.54 3ggz h ASN 142 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 3ggz h ASN 142 Cb 0.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.53 3ggz h ASN 142 CO -0.19 0.01 0.00 0.61 -1.65 0.00 0.00 177.43 176.21 3ggz n GLY 143 N -0.74 -1.65 0.09 2.83 0.00 -0.11 -2.83 105.19 102.78 3ggz n GLY 143 Ca -0.02 -0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.30 1.48 0.28 1.61 0.31 0.04 -3.13 118.33 116.61 3ggz n VAL 144 Ca 0.05 0.13 0.14 0.00 -0.01 0.00 0.00 64.34 64.65 3ggz n VAL 144 Cb 0.40 -2.33 0.75 0.00 -0.91 0.00 0.00 33.84 31.75 3ggz n VAL 144 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 3ggz h ILE 145 N -1.00 0.00 0.00 2.52 2.04 -1.39 0.32 117.51 120.00 3ggz h ILE 145 Ca -0.04 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.70 3ggz h ILE 145 Cb 0.89 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 3ggz h ILE 145 CO -0.03 0.00 -1.24 0.00 0.00 0.00 0.00 178.15 176.89 3ggz n ALA 146 N -1.83 1.41 -1.02 1.87 0.00 -1.13 -4.73 120.51 115.08 3ggz n ALA 146 Ca -0.02 -0.72 0.05 0.00 0.00 0.00 0.00 53.44 52.75 3ggz n ALA 146 Cb 0.29 0.12 0.30 0.00 0.00 0.00 0.00 19.45 20.16 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 -4.17 4.45 -3.11 0.00 9.92 -1.18 -4.97 116.55 117.48 3ggz n ASP 147 Ca -0.21 -3.09 0.00 0.00 -0.53 0.00 0.00 54.79 50.96 3ggz n ASP 147 Cb 0.53 -0.62 0.00 0.00 -0.64 0.00 0.00 41.12 40.39 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 -0.20 0.00 -1.77 1.24 1.44 0.11 -4.68 115.22 111.36 3ggz n HIS 148 Ca 0.27 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.56 3ggz n HIS 148 Cb 1.07 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 31.15 3ggz n HIS 148 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3ggz s ILE 149 N -4.04 3.21 -0.83 0.61 -1.09 -1.24 -2.25 121.20 115.56 3ggz s ILE 149 Ca 0.00 0.22 0.00 0.00 -2.23 0.00 0.00 60.65 58.64 3ggz s ILE 149 Cb 0.00 -3.25 0.00 0.00 -1.58 0.00 0.00 42.46 37.63 3ggz s ILE 149 CO 0.00 -0.14 0.00 0.47 -1.23 0.00 0.00 174.94 174.04 3ggz n ASP 150 N 10.51 -3.41 -4.68 3.58 10.43 -1.26 -4.97 116.55 126.75 3ggz n ASP 150 Ca 0.26 0.05 -0.40 0.00 2.57 0.00 0.00 54.79 57.27 3ggz n ASP 150 Cb 0.45 -2.43 -0.05 0.00 1.84 0.00 0.00 41.12 40.93 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 -2.42 5.02 0.46 2.53 1.01 -0.95 -4.80 120.40 121.24 3ggz s VAL 151 Ca 0.00 1.32 -0.20 0.00 0.00 0.00 0.00 61.98 63.10 3ggz s VAL 151 Cb 0.00 -4.00 -0.14 0.00 0.00 0.00 0.00 36.38 32.24 3ggz s VAL 151 CO 0.00 0.15 0.11 -2.65 0.00 0.00 0.00 175.10 172.71 3ggz n PRO 152 N 4.61 0.13 0.02 2.72 -0.02 -1.26 -4.81 135.00 136.39 3ggz n PRO 152 Ca -0.01 0.05 -0.13 0.00 -2.02 0.00 0.00 63.50 61.39 3ggz n PRO 152 Cb 0.50 -1.14 -0.09 0.00 -0.02 0.00 0.00 33.50 32.75 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 0.24 -0.07 -0.14 -0.52 4.57 -2.01 -2.93 114.58 113.72 3ggz h GLU 153 Ca -0.40 0.00 0.04 0.00 -1.18 0.00 0.00 59.36 57.83 3ggz h GLU 153 Cb 1.44 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 30.04 3ggz h GLU 153 CO 0.45 0.33 0.21 1.57 -1.18 0.00 0.00 179.01 180.39 3ggz h LYS 154 N -0.49 0.00 0.00 1.92 2.10 -1.98 -2.32 116.57 115.80 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 0.43 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.76 3ggz h LYS 154 CO 0.01 0.00 0.00 -0.89 -2.00 0.00 0.00 179.45 176.57 3ggz n ILE 155 N -3.58 0.00 -0.57 0.07 2.08 -1.11 -1.60 119.36 114.65 3ggz n ILE 155 Ca 0.01 0.48 0.47 0.00 0.56 0.00 0.00 62.75 64.27 3ggz n ILE 155 Cb 0.31 -1.01 0.73 0.00 -0.75 0.00 0.00 39.64 38.93 3ggz n ILE 155 CO 0.00 0.00 0.00 0.16 0.56 0.00 0.00 176.55 177.27 3ggz h ILE 156 N 0.00 0.02 0.15 1.39 3.07 -1.52 1.17 117.51 121.79 3ggz h ILE 156 Ca 0.00 0.00 -0.29 0.00 1.55 0.00 0.00 64.86 66.12 3ggz h ILE 156 Cb 0.00 0.03 0.01 0.00 -0.27 0.00 0.00 36.82 36.59 3ggz h ILE 156 CO 0.00 0.00 -1.29 0.50 -1.05 0.00 0.00 178.15 176.31 3ggz h LYS 157 N 0.00 0.35 -0.03 0.16 3.64 -1.48 -3.20 116.57 116.00 3ggz h LYS 157 Ca 0.81 -0.58 0.00 0.00 -1.27 0.00 0.00 60.65 59.62 3ggz h LYS 157 Cb 3.51 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 35.54 3ggz h LYS 157 CO -0.01 1.27 0.00 1.63 -2.27 0.00 0.00 179.45 180.07 3ggz n LYS 158 N -3.59 1.27 -0.02 1.90 5.02 0.40 -2.21 118.16 120.93 3ggz n LYS 158 Ca -0.10 -0.40 -0.19 0.00 -2.02 0.00 0.00 58.31 55.60 3ggz n LYS 158 Cb 1.04 -1.42 -0.14 0.00 -0.02 0.00 0.00 35.03 34.49 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 -3.36 2.58 -4.66 0.00 7.64 -1.21 -5.05 113.62 109.56 3ggz n SER 160 Ca -0.32 -3.29 -0.45 0.00 1.01 0.00 0.00 58.87 55.82 3ggz n SER 160 Cb 1.04 -0.61 -0.03 0.00 -1.01 0.00 0.00 64.21 63.61 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 0.35 1.89 -1.45 1.43 -0.04 -0.94 -4.89 135.00 131.34 3ggz n PRO 161 Ca 0.27 0.67 -0.32 0.00 -0.04 0.00 0.00 63.50 64.09 3ggz n PRO 161 Cb 0.50 -2.30 0.07 0.00 -0.04 0.00 0.00 33.50 31.74 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 0.21 4.73 0.11 3.54 1.04 -1.26 -4.91 113.70 117.16 3ggz s SER 162 Ca 0.68 1.90 -0.36 0.00 0.48 0.00 0.00 55.95 58.65 3ggz s SER 162 Cb -0.68 -2.53 -0.16 0.00 0.10 0.00 0.00 66.02 62.74 3ggz s SER 162 CO 0.51 -1.88 1.29 0.52 0.98 0.00 0.00 173.24 174.65 3ggz n VAL 163 N -3.09 0.25 -1.72 5.02 0.31 -1.26 -4.85 118.33 112.99 3ggz n VAL 163 Ca 0.10 -0.06 -0.42 0.00 -0.01 0.00 0.00 64.34 63.94 3ggz n VAL 163 Cb 0.53 -0.82 -0.00 0.00 -0.91 0.00 0.00 33.84 32.63 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 2.30 2.29 -2.34 5.55 -0.02 -1.26 -4.95 135.00 136.58 3ggz n PRO 164 Ca 0.17 0.80 -0.41 0.00 -2.02 0.00 0.00 63.50 62.04 3ggz n PRO 164 Cb 0.21 -2.43 -0.03 0.00 -0.02 0.00 0.00 33.50 31.22 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 -1.93 4.46 0.31 -0.52 -0.14 -1.26 -4.93 119.74 115.73 3ggz s LYS 165 Ca 0.55 1.91 0.07 0.00 -1.36 0.00 0.00 55.97 57.13 3ggz s LYS 165 Cb -0.54 -3.24 0.85 0.00 -1.68 0.00 0.00 37.83 33.22 3ggz s LYS 165 CO 0.63 -0.15 1.65 0.93 -0.76 0.00 0.00 175.35 177.65 3ggz h GLU 166 N 5.47 0.24 0.23 1.68 5.08 -2.00 -0.92 114.58 124.36 3ggz h GLU 166 Ca -0.44 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 57.90 3ggz h GLU 166 Cb 1.21 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 3ggz h GLU 166 CO 0.76 0.16 -0.18 0.93 -1.00 0.00 0.00 179.01 179.68 3ggz h GLU 167 N 0.25 -0.40 -1.00 2.33 3.07 -2.00 -2.11 114.58 114.72 3ggz h GLU 167 Ca 0.62 0.03 0.11 0.00 -0.50 0.00 0.00 59.36 59.62 3ggz h GLU 167 Cb 1.32 0.09 -0.08 0.00 -0.84 0.00 0.00 28.75 29.24 3ggz h GLU 167 CO -0.64 -0.27 0.63 1.25 -1.40 0.00 0.00 179.01 178.58 3ggz h LEU 168 N -0.42 0.94 0.31 1.33 5.85 -1.57 0.62 115.31 122.38 3ggz h LEU 168 Ca -0.01 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 3ggz h LEU 168 Cb 0.37 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.26 3ggz h LEU 168 CO -0.01 0.51 -0.15 0.58 -0.34 0.00 0.00 178.44 179.03 3ggz h VAL 169 N 1.02 0.71 -0.55 1.05 2.07 -1.16 0.80 116.25 120.19 3ggz h VAL 169 Ca 0.49 -0.26 0.06 0.00 0.82 0.00 0.00 66.70 67.81 3ggz h VAL 169 Cb 0.45 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 3ggz h VAL 169 CO -0.25 0.06 0.26 0.44 0.02 0.00 0.00 177.57 178.09 3ggz h ASP 170 N -0.56 0.34 -0.12 0.57 3.32 -0.90 0.24 116.42 119.30 3ggz h ASP 170 Ca -0.04 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3ggz h ASP 170 Cb 0.41 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 3ggz h ASP 170 CO 0.07 0.22 0.04 0.25 -1.72 0.00 0.00 179.24 178.11 3ggz h LEU 171 N 0.48 0.23 0.43 1.55 5.85 -0.69 -1.61 115.31 121.56 3ggz h LEU 171 Ca 0.25 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 3ggz h LEU 171 Cb 0.21 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.19 3ggz h LEU 171 CO -0.20 0.24 -0.21 0.22 -0.34 0.00 0.00 178.44 178.15 3ggz h TYR 172 N 0.25 -0.54 -0.65 1.25 3.20 0.80 -2.85 116.97 118.44 3ggz h TYR 172 Ca 0.06 -0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.05 3ggz h TYR 172 Cb 0.11 0.18 -0.12 0.00 1.54 0.00 0.00 36.73 38.44 3ggz h TYR 172 CO 0.00 -0.23 -0.22 -0.07 -1.64 0.00 0.00 178.16 176.00 3ggz h LEU 173 N -1.04 -0.79 -0.94 2.82 3.38 -0.68 0.96 115.31 119.02 3ggz h LEU 173 Ca -0.06 0.21 0.13 0.00 0.09 0.00 0.00 57.88 58.25 3ggz h LEU 173 Cb 0.55 0.46 -0.09 0.00 0.09 0.00 0.00 40.66 41.67 3ggz h LEU 173 CO 0.10 -0.25 0.56 0.50 0.09 0.00 0.00 178.44 179.44 3ggz h LYS 174 N -0.05 0.83 -0.31 1.13 3.64 -1.35 -1.39 116.57 119.07 3ggz h LYS 174 Ca 0.30 -0.05 -0.12 0.00 -1.27 0.00 0.00 60.65 59.51 3ggz h LYS 174 Cb 0.51 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 3ggz h LYS 174 CO -0.69 0.55 -0.26 0.93 -2.27 0.00 0.00 179.45 177.70 3ggz h GLU 175 N 0.85 0.72 -0.05 1.90 4.39 -0.62 -2.27 114.58 119.50 3ggz h GLU 175 Ca 0.48 -0.37 -0.02 0.00 0.34 0.00 0.00 59.36 59.80 3ggz h GLU 175 Cb 0.56 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.21 3ggz h GLU 175 CO -0.30 0.98 -0.05 0.82 -1.16 0.00 0.00 179.01 179.30 3ggz h ILE 176 N 0.48 1.07 0.00 3.13 2.04 -0.42 -2.34 117.51 121.48 3ggz h ILE 176 Ca 0.05 -0.30 -0.26 0.00 1.00 0.00 0.00 64.86 65.35 3ggz h ILE 176 Cb 0.83 1.09 0.02 0.00 -0.74 0.00 0.00 36.82 38.02 3ggz h ILE 176 CO 0.07 0.09 -1.03 0.00 0.00 0.00 0.00 178.15 177.28 3ggz h ALA 177 N 1.88 0.12 0.00 1.87 0.00 -1.14 -2.54 119.26 119.45 3ggz h ALA 177 Ca 0.02 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.23 3ggz h ALA 177 Cb 0.14 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3ggz h ALA 177 CO 0.01 0.67 0.00 1.17 0.00 0.00 0.00 179.25 181.10 3ggz n LYS 178 N -3.87 0.52 -0.01 0.00 4.81 -0.87 -0.59 118.16 118.15 3ggz n LYS 178 Ca -0.11 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.32 3ggz n LYS 178 Cb 0.88 -1.40 -0.01 0.00 0.02 0.00 0.00 35.03 34.51 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 -0.90 0.11 0.41 3.15 -1.04 -1.12 -4.77 114.28 110.11 3ggz n THR 179 Ca 0.10 -0.07 0.07 0.00 -2.04 0.00 0.00 64.05 62.11 3ggz n THR 179 Cb 0.05 -0.90 -0.09 0.00 -1.82 0.00 0.00 70.33 67.57 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 -2.04 0.00 -2.94 -1.42 4.01 -0.96 -5.06 117.16 108.74 3ggz n TYR 180 Ca -0.03 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.67 3ggz n TYR 180 Cb 0.54 -0.11 0.01 0.00 -0.31 0.00 0.00 39.34 39.46 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 -1.55 -7.85 -4.63 7.72 2.03 0.24 -5.06 116.55 107.45 3ggz n ASP 181 Ca 0.01 0.24 -0.26 0.00 0.52 0.00 0.00 54.79 55.29 3ggz n ASP 181 Cb 0.26 -5.34 -0.10 0.00 -0.72 0.00 0.00 41.12 35.23 3ggz n ASP 181 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3ggz s VAL 182 N -2.80 2.23 -0.02 5.18 -7.23 -1.25 -5.07 120.40 111.44 3ggz s VAL 182 Ca 0.13 -1.99 -0.35 0.00 -1.81 0.00 0.00 61.98 57.95 3ggz s VAL 182 Cb -0.04 -2.88 -0.17 0.00 0.56 0.00 0.00 36.38 33.85 3ggz s VAL 182 CO 0.76 -0.09 0.96 -2.65 -0.31 0.00 0.00 175.10 173.77 3ggz n PRO 183 N -0.97 0.00 0.19 4.82 -0.02 -1.26 -4.87 135.00 132.89 3ggz n PRO 183 Ca -0.04 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.52 3ggz n PRO 183 Cb 0.65 -1.31 0.21 0.00 -0.02 0.00 0.00 33.50 33.03 3ggz n PRO 183 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 3ggz h TYR 184 N 2.71 0.00 0.00 6.00 3.20 -1.97 -3.13 116.97 123.78 3ggz h TYR 184 Ca -0.44 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.43 3ggz h TYR 184 Cb 1.25 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.52 3ggz h TYR 184 CO 0.50 0.24 0.00 0.45 -1.64 0.00 0.00 178.16 177.71 3ggz n SER 185 N -3.21 0.59 0.00 -2.11 2.88 -1.26 -2.73 113.62 107.78 3ggz n SER 185 Ca 0.02 -1.91 0.00 0.00 -1.33 0.00 0.00 58.87 55.65 3ggz n SER 185 Cb 0.57 -0.29 0.00 0.00 -0.75 0.00 0.00 64.21 63.74 3ggz n SER 185 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3ggz n LYS 186 N -0.18 2.72 -0.08 -1.46 4.76 -1.18 -4.68 118.16 118.06 3ggz n LYS 186 Ca 0.00 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.31 3ggz n LYS 186 Cb 0.15 -0.76 -0.09 0.00 -1.84 0.00 0.00 35.03 32.49 3ggz n LYS 186 CO 0.00 0.00 0.00 1.37 -1.37 0.00 0.00 177.40 177.40 3ggz h LEU 187 N 0.00 0.00 -2.30 -0.35 8.10 -1.58 -3.36 115.31 115.82 3ggz h LEU 187 Ca 0.00 -0.49 -0.06 0.00 0.11 0.00 0.00 57.88 57.44 3ggz h LEU 187 Cb 0.09 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 40.27 3ggz h LEU 187 CO 0.00 1.07 0.07 -0.62 -4.11 0.00 0.00 178.44 174.85 3ggz n GLU 188 N -4.57 2.40 -0.09 0.17 1.02 -1.19 -3.81 120.64 114.58 3ggz n GLU 188 Ca -0.16 -1.35 -0.11 0.00 -0.02 0.00 0.00 57.16 55.52 3ggz n GLU 188 Cb 0.45 -1.75 -0.10 0.00 -0.02 0.00 0.00 31.44 30.02 3ggz n GLU 188 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3ggz n ASN 189 N 0.15 2.16 0.00 1.62 5.15 -1.26 -5.07 115.26 118.01 3ggz n ASN 189 Ca 0.16 -0.07 0.00 0.00 -0.60 0.00 0.00 54.58 54.07 3ggz n ASN 189 Cb 0.75 0.09 0.00 0.00 -0.53 0.00 0.00 39.78 40.09 3ggz n ASN 189 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46