#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 4.14 0.76 2.02 -4.36 -1.26 -5.04 121.20 117.47 3ggz s ILE 6 Ca 0.00 0.92 -0.16 0.00 -0.26 0.00 0.00 60.65 61.15 3ggz s ILE 6 Cb 0.00 -3.53 -0.03 0.00 1.25 0.00 0.00 42.46 40.15 3ggz s ILE 6 CO 0.00 -0.69 0.44 -2.65 0.24 0.00 0.00 174.94 172.28 3ggz n PRO 7 N -2.20 0.18 0.27 0.37 -0.02 -1.26 -4.74 135.00 127.61 3ggz n PRO 7 Ca 0.08 0.10 -0.18 0.00 -2.02 0.00 0.00 63.50 61.48 3ggz n PRO 7 Cb 0.53 -1.78 -0.10 0.00 -0.02 0.00 0.00 33.50 32.14 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 -0.58 -1.38 -1.79 6.00 3.57 -2.00 -2.70 116.94 118.06 3ggz h PHE 8 Ca -0.45 0.01 0.54 0.00 3.53 0.00 0.00 57.97 61.61 3ggz h PHE 8 Cb 1.34 0.54 -0.10 0.00 2.79 0.00 0.00 35.95 40.53 3ggz h PHE 8 CO 0.34 -0.65 1.25 2.41 -2.23 0.00 0.00 178.31 179.44 3ggz n THR 9 N -5.43 -0.08 -0.07 4.41 -1.04 -1.26 -1.14 114.28 109.67 3ggz n THR 9 Ca -0.11 1.59 -0.09 0.00 -2.04 0.00 0.00 64.05 63.40 3ggz n THR 9 Cb 0.44 -2.64 -0.07 0.00 -1.82 0.00 0.00 70.33 66.24 3ggz n THR 9 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 3ggz h ILE 10 N 0.00 0.92 -0.50 12.58 2.04 -1.84 -2.79 117.51 127.93 3ggz h ILE 10 Ca 0.92 -1.74 0.09 0.00 1.00 0.00 0.00 64.86 65.14 3ggz h ILE 10 Cb 3.49 1.79 -0.07 0.00 -0.74 0.00 0.00 36.82 41.28 3ggz h ILE 10 CO -0.16 0.31 0.07 0.11 0.00 0.00 0.00 178.15 178.48 3ggz h LYS 11 N -1.00 0.19 -0.54 2.37 1.57 -0.95 0.20 116.57 118.40 3ggz h LYS 11 Ca -0.03 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 3ggz h LYS 11 Cb 0.62 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.86 3ggz h LYS 11 CO -0.02 0.13 0.23 1.25 -0.57 0.00 0.00 179.45 180.47 3ggz h LEU 12 N 0.20 0.72 -0.26 2.94 5.85 -1.28 0.44 115.31 123.92 3ggz h LEU 12 Ca 0.25 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.84 3ggz h LEU 12 Cb 0.35 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 3ggz h LEU 12 CO -0.35 0.68 0.09 0.50 -0.34 0.00 0.00 178.44 179.01 3ggz h LYS 13 N 0.72 0.20 -0.54 1.25 3.64 -1.05 0.47 116.57 121.27 3ggz h LYS 13 Ca 0.18 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.46 3ggz h LYS 13 Cb 0.16 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 3ggz h LYS 13 CO -0.02 0.13 -0.04 1.15 -2.27 0.00 0.00 179.45 178.41 3ggz h THR 14 N 0.21 1.26 0.31 1.00 2.02 -0.79 -1.53 112.91 115.39 3ggz h THR 14 Ca 0.11 -1.15 -0.02 0.00 0.77 0.00 0.00 66.41 66.13 3ggz h THR 14 Cb 0.08 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 3ggz h THR 14 CO -0.11 0.41 -0.15 0.00 0.37 0.00 0.00 175.52 176.03 3ggz h LEU 16 N -0.46 -0.19 -1.66 0.00 3.38 -0.87 -2.04 115.31 113.48 3ggz h LEU 16 Ca -0.04 0.01 0.31 0.00 0.09 0.00 0.00 57.88 58.25 3ggz h LEU 16 Cb 0.35 0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.08 3ggz h LEU 16 CO 0.07 -0.12 0.76 0.11 0.09 0.00 0.00 178.44 179.35 3ggz h LYS 17 N -0.18 0.19 0.55 1.13 1.57 -1.21 -0.36 116.57 118.27 3ggz h LYS 17 Ca -0.00 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 3ggz h LYS 17 Cb 0.16 -0.04 0.01 0.00 0.08 0.00 0.00 32.23 32.43 3ggz h LYS 17 CO -0.00 0.13 -0.27 1.98 -0.57 0.00 0.00 179.45 180.72 3ggz h MET 18 N 0.20 -0.71 -0.97 3.15 4.05 -0.88 -2.38 114.93 117.38 3ggz h MET 18 Ca 0.59 0.05 0.27 0.00 -0.28 0.00 0.00 59.70 60.32 3ggz h MET 18 Cb 1.90 0.16 -0.14 0.00 -0.80 0.00 0.00 31.60 32.72 3ggz h MET 18 CO -0.17 -0.42 0.51 0.00 0.23 0.00 0.00 176.91 177.05 3ggz h ILE 20 N 0.41 0.00 -0.82 0.00 2.04 -1.25 0.54 117.51 118.42 3ggz h ILE 20 Ca 0.65 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.60 3ggz h ILE 20 Cb 1.34 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 37.31 3ggz h ILE 20 CO -0.55 0.00 -0.55 1.56 0.00 0.00 0.00 178.15 178.60 3ggz h GLN 21 N -1.20 -0.11 -0.48 2.37 1.08 -0.52 0.12 115.11 116.37 3ggz h GLN 21 Ca -0.12 0.01 -0.09 0.00 -1.45 0.00 0.00 58.65 57.00 3ggz h GLN 21 Cb 0.94 0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.38 3ggz h GLN 21 CO 0.16 -0.07 -0.07 0.00 -0.95 0.00 0.00 178.83 177.90 3ggz h ARG 22 N -0.12 0.89 -0.82 1.46 2.47 -1.20 -1.92 114.38 115.16 3ggz h ARG 22 Ca 0.16 -0.32 0.13 0.00 -1.26 0.00 0.00 59.98 58.68 3ggz h ARG 22 Cb 0.48 -0.06 -0.09 0.00 -1.65 0.00 0.00 29.97 28.65 3ggz h ARG 22 CO -0.84 0.97 0.42 -0.07 0.56 0.00 0.00 179.97 181.00 3ggz h LEU 23 N 0.75 0.53 -0.35 3.04 3.38 0.96 0.25 115.31 123.87 3ggz h LEU 23 Ca 0.13 0.08 -0.12 0.00 0.09 0.00 0.00 57.88 58.06 3ggz h LEU 23 Cb 0.61 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 3ggz h LEU 23 CO 0.04 0.25 -0.24 -0.09 0.09 0.00 0.00 178.44 178.49 3ggz h ARG 24 N 0.64 0.77 -0.48 1.13 2.43 -0.85 -2.10 114.38 115.92 3ggz h ARG 24 Ca 0.43 -0.37 0.07 0.00 -0.81 0.00 0.00 59.98 59.30 3ggz h ARG 24 Cb 0.55 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 30.03 3ggz h ARG 24 CO -0.33 0.99 0.14 -0.92 -1.51 0.00 0.00 179.97 178.34 3ggz h TYR 25 N 0.55 0.24 -0.93 2.20 3.20 -0.11 0.14 116.97 122.27 3ggz h TYR 25 Ca 0.07 0.03 0.05 0.00 3.14 0.00 0.00 58.73 62.01 3ggz h TYR 25 Cb 0.80 -0.04 -0.06 0.00 1.54 0.00 0.00 36.73 38.97 3ggz h TYR 25 CO 0.06 0.06 0.59 0.00 -1.64 0.00 0.00 178.16 177.24 3ggz h ALA 26 N 1.34 1.25 0.61 1.82 0.00 -0.44 -1.33 119.26 122.52 3ggz h ALA 26 Ca 0.23 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 3ggz h ALA 26 Cb 0.27 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3ggz h ALA 26 CO -0.26 0.41 -0.32 1.96 0.00 0.00 0.00 179.25 181.03 3ggz h GLN 27 N 1.12 -0.83 -0.94 0.00 4.20 -0.10 0.25 115.11 118.81 3ggz h GLN 27 Ca 0.39 0.06 0.20 0.00 0.06 0.00 0.00 58.65 59.36 3ggz h GLN 27 Cb 0.09 0.19 -0.11 0.00 0.30 0.00 0.00 27.48 27.94 3ggz h GLN 27 CO -0.15 -0.55 0.51 1.49 -0.67 0.00 0.00 178.83 179.46 3ggz h GLU 28 N -0.86 0.57 -0.05 1.46 4.81 -0.92 0.27 114.58 119.86 3ggz h GLU 28 Ca -0.08 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.08 3ggz h GLU 28 Cb 0.67 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.92 3ggz h GLU 28 CO 0.12 0.38 -0.08 -0.22 -0.73 0.00 0.00 179.01 178.47 3ggz h LYS 29 N 0.59 0.14 -0.12 1.92 3.64 -1.10 -2.64 116.57 119.00 3ggz h LYS 29 Ca 0.56 -0.09 -0.11 0.00 -1.27 0.00 0.00 60.65 59.75 3ggz h LYS 29 Cb 0.97 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.79 3ggz h LYS 29 CO -0.44 0.66 -0.40 1.96 -2.27 0.00 0.00 179.45 178.96 3ggz h GLN 30 N -0.35 0.27 0.03 1.90 4.20 0.12 -0.88 115.11 120.39 3ggz h GLN 30 Ca 0.00 -0.13 -0.00 0.00 0.06 0.00 0.00 58.65 58.59 3ggz h GLN 30 Cb 0.65 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.42 3ggz h GLN 30 CO 0.02 0.63 -0.01 1.96 -0.67 0.00 0.00 178.83 180.76 3ggz h GLN 31 N 0.23 -0.03 -0.50 1.46 1.08 -0.54 0.56 115.11 117.35 3ggz h GLN 31 Ca 0.02 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.17 3ggz h GLN 31 Cb 0.81 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 28.22 3ggz h GLN 31 CO 0.06 0.10 0.07 0.00 -0.95 0.00 0.00 178.83 178.11 3ggz h ALA 32 N 0.81 1.19 -0.23 3.87 0.00 -1.37 -1.08 119.26 122.45 3ggz h ALA 32 Ca -0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 3ggz h ALA 32 Cb 0.15 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3ggz h ALA 32 CO 0.01 0.54 -0.02 0.82 0.00 0.00 0.00 179.25 180.60 3ggz h ILE 33 N 0.75 1.27 -0.55 0.00 2.04 -0.81 -2.60 117.51 117.61 3ggz h ILE 33 Ca 0.16 -0.96 -0.05 0.00 1.00 0.00 0.00 64.86 65.01 3ggz h ILE 33 Cb 0.35 1.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 3ggz h ILE 33 CO 0.01 0.30 0.14 0.00 0.00 0.00 0.00 178.15 178.59 3ggz h ALA 34 N 0.78 1.21 -0.06 1.87 0.00 0.31 -2.44 119.26 120.93 3ggz h ALA 34 Ca 0.06 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 3ggz h ALA 34 Cb 0.45 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3ggz h ALA 34 CO 0.02 0.55 -0.26 -0.22 0.00 0.00 0.00 179.25 179.33 3ggz h LYS 35 N 0.81 0.09 0.00 0.00 3.64 -1.06 -1.38 116.57 118.67 3ggz h LYS 35 Ca 0.18 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.43 3ggz h LYS 35 Cb 0.29 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 3ggz h LYS 35 CO -0.00 0.35 -0.50 0.37 -2.27 0.00 0.00 179.45 177.40 3ggz h GLN 36 N 0.09 0.00 -0.51 1.90 4.15 -1.12 -3.06 115.11 116.56 3ggz h GLN 36 Ca 0.01 0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.35 3ggz h GLN 36 Cb 0.51 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.18 3ggz h GLN 36 CO 0.04 0.50 -0.01 0.77 -1.93 0.00 0.00 178.83 178.19 3ggz h SER 37 N 0.00 0.90 -0.57 -0.69 0.02 -0.82 -2.53 113.55 109.86 3ggz h SER 37 Ca -0.00 -0.31 0.03 0.00 -0.84 0.00 0.00 61.79 60.66 3ggz h SER 37 Cb 1.28 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 63.53 3ggz h SER 37 CO 0.06 0.99 0.33 0.03 -1.14 0.00 0.00 176.83 177.11 3ggz h ARG 38 N 0.78 0.62 -0.41 3.45 3.08 -1.30 -0.17 114.38 120.43 3ggz h ARG 38 Ca 0.14 -0.04 0.07 0.00 0.07 0.00 0.00 59.98 60.23 3ggz h ARG 38 Cb 0.54 -0.14 -0.06 0.00 0.08 0.00 0.00 29.97 30.39 3ggz h ARG 38 CO 0.03 0.41 0.04 -0.09 -1.07 0.00 0.00 179.97 179.29 3ggz h ARG 39 N 0.64 0.15 -0.22 0.04 2.43 -1.40 -0.58 114.38 115.44 3ggz h ARG 39 Ca 0.24 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.34 3ggz h ARG 39 Cb 0.06 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 3ggz h ARG 39 CO -0.12 0.10 -0.12 1.96 -1.51 0.00 0.00 179.97 180.28 3ggz h GLN 40 N 0.15 0.36 -0.60 0.20 4.20 -0.99 -2.06 115.11 116.37 3ggz h GLN 40 Ca 0.20 -0.09 0.03 0.00 0.06 0.00 0.00 58.65 58.85 3ggz h GLN 40 Cb 0.27 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.96 3ggz h GLN 40 CO -0.30 0.48 0.36 0.28 -0.67 0.00 0.00 178.83 178.98 3ggz h VAL 41 N 0.34 1.05 -0.08 -0.54 2.07 0.53 -0.53 116.25 119.08 3ggz h VAL 41 Ca 0.07 -0.24 -0.08 0.00 0.82 0.00 0.00 66.70 67.26 3ggz h VAL 41 Cb 0.42 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 3ggz h VAL 41 CO 0.02 0.13 -0.34 0.00 0.02 0.00 0.00 177.57 177.41 3ggz h ALA 42 N 1.27 1.28 -0.27 1.67 0.00 -0.87 -2.55 119.26 119.79 3ggz h ALA 42 Ca 0.25 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 3ggz h ALA 42 Cb 0.05 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3ggz h ALA 42 CO -0.12 0.50 -0.15 0.37 0.00 0.00 0.00 179.25 179.85 3ggz h GLN 43 N 0.14 0.47 0.00 0.00 5.75 -0.48 -2.51 115.11 118.49 3ggz h GLN 43 Ca 0.02 -0.14 -0.03 0.00 -0.15 0.00 0.00 58.65 58.34 3ggz h GLN 43 Cb 0.67 -0.05 -0.00 0.00 1.07 0.00 0.00 27.48 29.17 3ggz h GLN 43 CO 0.05 0.61 -0.15 -0.07 -2.65 0.00 0.00 178.83 176.62 3ggz h LEU 44 N 0.43 0.00 0.02 -2.39 3.38 -0.77 -3.09 115.31 112.90 3ggz h LEU 44 Ca 0.08 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.81 3ggz h LEU 44 Cb 0.52 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.29 3ggz h LEU 44 CO 0.03 0.15 -0.93 -0.07 0.09 0.00 0.00 178.44 177.71 3ggz h LEU 45 N 0.00 0.79 -0.42 1.67 3.38 -1.38 -2.77 115.31 116.57 3ggz h LEU 45 Ca -0.00 -0.76 0.00 0.00 0.09 0.00 0.00 57.88 57.21 3ggz h LEU 45 Cb 0.72 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3ggz h LEU 45 CO 0.02 1.45 0.00 -0.11 0.09 0.00 0.00 178.44 179.89 3ggz n LEU 46 N -3.96 0.31 -0.67 1.67 0.00 -1.09 -2.50 117.00 110.76 3ggz n LEU 46 Ca -0.11 -0.16 0.04 0.00 0.00 0.00 0.00 56.01 55.78 3ggz n LEU 46 Cb 0.83 -0.16 0.07 0.00 0.00 0.00 0.00 43.42 44.16 3ggz n LEU 46 CO 0.53 0.08 0.29 0.41 0.00 0.00 0.00 177.39 178.70 3ggz n THR 47 N -0.23 0.75 -0.42 1.96 -1.04 -1.16 -4.99 114.28 109.14 3ggz n THR 47 Ca 0.00 -1.23 0.00 0.00 -2.04 0.00 0.00 64.05 60.78 3ggz n THR 47 Cb 0.08 0.35 0.00 0.00 -1.82 0.00 0.00 70.33 68.94 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 -0.36 -2.45 -3.48 8.00 5.03 -1.04 -4.77 115.26 116.19 3ggz n ASN 48 Ca 0.08 0.00 -0.40 0.00 0.87 0.00 0.00 54.58 55.13 3ggz n ASN 48 Cb 0.80 -1.75 -0.02 0.00 -1.02 0.00 0.00 39.78 37.79 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 0.39 3.52 0.01 3.52 5.02 -1.05 -4.72 118.16 124.84 3ggz n LYS 49 Ca 0.00 -2.49 -0.13 0.00 -2.02 0.00 0.00 58.31 53.67 3ggz n LYS 49 Cb 0.20 -2.94 -0.08 0.00 -0.02 0.00 0.00 35.03 32.19 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 5.31 -0.49 -0.35 1.97 4.39 -1.86 -1.10 114.58 122.45 3ggz h GLU 50 Ca 0.75 0.03 0.06 0.00 0.34 0.00 0.00 59.36 60.54 3ggz h GLU 50 Cb 0.41 0.11 -0.06 0.00 -0.10 0.00 0.00 28.75 29.11 3ggz h GLU 50 CO 1.79 -0.33 -0.00 1.96 -1.16 0.00 0.00 179.01 181.27 3ggz h GLN 51 N -0.51 0.09 0.00 2.33 4.20 -1.96 -0.57 115.11 118.69 3ggz h GLN 51 Ca 0.02 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.73 3ggz h GLN 51 Cb 0.58 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.34 3ggz h GLN 51 CO -0.34 0.06 0.00 1.17 -0.67 0.00 0.00 178.83 179.05 3ggz n LYS 52 N -5.18 0.10 0.02 1.46 4.81 -1.14 -1.78 118.16 116.45 3ggz n LYS 52 Ca 0.01 0.37 0.08 0.00 -0.87 0.00 0.00 58.31 57.91 3ggz n LYS 52 Cb 0.18 -1.70 -0.11 0.00 0.02 0.00 0.00 35.03 33.42 3ggz n LYS 52 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3ggz n ALA 53 N -1.64 2.54 -0.00 3.14 0.00 -0.35 -3.90 120.51 120.30 3ggz n ALA 53 Ca 0.02 -0.51 -0.00 0.00 0.00 0.00 0.00 53.44 52.95 3ggz n ALA 53 Cb 0.17 -0.82 -0.00 0.00 0.00 0.00 0.00 19.45 18.80 3ggz n ALA 53 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3ggz h HIS 54 N 0.00 -0.01 -1.07 0.00 -0.00 -0.38 -3.14 115.15 110.55 3ggz h HIS 54 Ca -0.06 -0.00 0.29 0.00 -0.00 0.00 0.00 60.37 60.60 3ggz h HIS 54 Cb 1.16 0.00 -0.10 0.00 -0.00 0.00 0.00 27.41 28.47 3ggz h HIS 54 CO 0.00 -0.00 0.68 1.88 -0.00 0.00 0.00 177.93 180.49 3ggz h TYR 55 N -0.08 0.68 -0.42 5.26 0.05 -1.75 0.80 116.97 121.50 3ggz h TYR 55 Ca -0.00 0.02 0.06 0.00 0.05 0.00 0.00 58.73 58.87 3ggz h TYR 55 Cb 0.01 -0.19 -0.05 0.00 1.01 0.00 0.00 36.73 37.50 3ggz h TYR 55 CO 0.01 0.01 0.11 -0.09 -1.05 0.00 0.00 178.16 177.15 3ggz h ARG 56 N 0.36 0.24 -0.64 4.88 9.65 -1.69 -1.97 114.38 125.21 3ggz h ARG 56 Ca 0.64 -0.01 -0.07 0.00 -1.10 0.00 0.00 59.98 59.44 3ggz h ARG 56 Cb 1.64 -0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 30.14 3ggz h ARG 56 CO -0.34 0.16 0.14 0.28 2.80 0.00 0.00 179.97 183.01 3ggz h VAL 57 N 0.25 1.25 -1.03 0.20 2.07 -0.79 -2.21 116.25 115.99 3ggz h VAL 57 Ca 0.20 -0.94 0.26 0.00 0.82 0.00 0.00 66.70 67.04 3ggz h VAL 57 Cb 0.23 0.61 -0.11 0.00 -1.52 0.00 0.00 31.29 30.49 3ggz h VAL 57 CO -0.25 0.36 0.63 -0.33 0.02 0.00 0.00 177.57 178.00 3ggz h GLU 58 N 0.97 0.48 -0.29 1.57 5.08 -0.96 0.65 114.58 122.08 3ggz h GLU 58 Ca 0.20 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.49 3ggz h GLU 58 Cb 0.37 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 3ggz h GLU 58 CO 0.00 0.32 0.01 1.15 -1.00 0.00 0.00 179.01 179.49 3ggz h THR 59 N 0.50 1.25 -0.84 1.13 2.02 -1.34 -2.73 112.91 112.90 3ggz h THR 59 Ca 0.64 -0.92 0.24 0.00 0.77 0.00 0.00 66.41 67.14 3ggz h THR 59 Cb 1.37 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 69.02 3ggz h THR 59 CO -0.42 0.30 0.60 -0.07 0.37 0.00 0.00 175.52 176.30 3ggz h LEU 60 N 0.31 0.02 -0.02 2.58 -0.00 0.52 -0.50 115.31 118.21 3ggz h LEU 60 Ca 0.08 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.93 3ggz h LEU 60 Cb 0.42 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.08 3ggz h LEU 60 CO 0.01 0.01 -0.14 0.40 -0.00 0.00 0.00 178.44 178.72 3ggz h ILE 61 N 0.02 1.52 -0.89 1.22 5.03 -1.09 -1.81 117.51 121.50 3ggz h ILE 61 Ca 0.40 -1.72 -0.00 0.00 -0.12 0.00 0.00 64.86 63.42 3ggz h ILE 61 Cb 1.58 2.59 -0.04 0.00 -3.03 0.00 0.00 36.82 37.92 3ggz h ILE 61 CO -0.01 0.47 0.56 0.45 -0.68 0.00 0.00 178.15 178.93 3ggz h HIS 62 N -0.50 1.16 -0.40 1.37 3.86 -1.00 0.65 115.15 120.28 3ggz h HIS 62 Ca -0.01 0.01 -0.10 0.00 -1.16 0.00 0.00 60.37 59.11 3ggz h HIS 62 Cb 0.83 -0.38 -0.01 0.00 1.06 0.00 0.00 27.41 28.91 3ggz h HIS 62 CO 0.16 0.75 -0.14 -0.44 0.86 0.00 0.00 177.93 179.12 3ggz h ASP 63 N 1.22 0.81 -0.50 2.45 5.19 -1.26 0.51 116.42 124.84 3ggz h ASP 63 Ca 0.32 -0.38 -0.08 0.00 -0.62 0.00 0.00 57.03 56.27 3ggz h ASP 63 Cb -0.08 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 39.18 3ggz h ASP 63 CO -0.06 1.01 0.01 0.44 -3.12 0.00 0.00 179.24 177.51 3ggz h ASP 64 N 0.60 0.90 -0.16 6.45 3.32 -0.49 -1.62 116.42 125.43 3ggz h ASP 64 Ca 0.09 -0.23 -0.07 0.00 0.02 0.00 0.00 57.03 56.84 3ggz h ASP 64 Cb 0.68 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 3ggz h ASP 64 CO 0.05 0.96 -0.12 0.40 -1.72 0.00 0.00 179.24 178.80 3ggz h ILE 65 N 0.86 1.23 0.22 0.35 2.04 0.54 -2.58 117.51 120.17 3ggz h ILE 65 Ca 0.16 -1.04 -0.01 0.00 1.00 0.00 0.00 64.86 64.97 3ggz h ILE 65 Cb 0.50 1.13 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 3ggz h ILE 65 CO 0.02 0.34 -0.11 -0.74 0.00 0.00 0.00 178.15 177.67 3ggz h HIS 66 N 0.49 -0.28 -0.81 1.37 2.76 -0.37 -2.24 115.15 116.08 3ggz h HIS 66 Ca 0.09 -0.01 0.18 0.00 -2.20 0.00 0.00 60.37 58.43 3ggz h HIS 66 Cb 0.50 0.09 -0.11 0.00 1.55 0.00 0.00 27.41 29.44 3ggz h HIS 66 CO 0.02 -0.06 0.27 0.82 -1.30 0.00 0.00 177.93 177.68 3ggz h ILE 67 N -0.46 0.51 -0.09 6.26 2.04 -1.01 0.33 117.51 125.09 3ggz h ILE 67 Ca -0.03 -0.12 0.02 0.00 1.00 0.00 0.00 64.86 65.74 3ggz h ILE 67 Cb 0.35 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 3ggz h ILE 67 CO 0.05 0.06 -0.06 -0.08 0.00 0.00 0.00 178.15 178.12 3ggz h GLU 68 N 0.34 -0.06 -1.09 2.37 4.81 -1.33 -0.15 114.58 119.48 3ggz h GLU 68 Ca 0.47 0.00 0.30 0.00 -0.13 0.00 0.00 59.36 60.00 3ggz h GLU 68 Cb 0.83 0.01 -0.10 0.00 0.63 0.00 0.00 28.75 30.12 3ggz h GLU 68 CO -0.51 -0.04 0.69 1.25 -0.73 0.00 0.00 179.01 179.67 3ggz h LEU 69 N -0.06 0.42 0.15 1.64 5.85 0.23 -1.23 115.31 122.31 3ggz h LEU 69 Ca 0.06 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 3ggz h LEU 69 Cb 0.15 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.22 3ggz h LEU 69 CO -0.13 0.03 -0.07 -0.07 -0.34 0.00 0.00 178.44 177.86 3ggz h LEU 70 N 0.34 -0.17 -1.49 2.25 3.38 -0.08 -1.62 115.31 117.91 3ggz h LEU 70 Ca 0.64 -0.36 0.20 0.00 0.09 0.00 0.00 57.88 58.45 3ggz h LEU 70 Cb 1.69 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 42.42 3ggz h LEU 70 CO -0.34 0.32 0.59 -0.33 0.09 0.00 0.00 178.44 178.78 3ggz h GLU 71 N -0.74 0.42 -0.15 1.13 5.08 -0.47 0.90 114.58 120.75 3ggz h GLU 71 Ca -0.02 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.22 3ggz h GLU 71 Cb 0.52 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.68 3ggz h GLU 71 CO 0.03 0.28 -0.27 0.82 -1.00 0.00 0.00 179.01 178.88 3ggz h ILE 72 N 0.43 1.36 -0.64 3.13 2.04 -1.30 -1.92 117.51 120.62 3ggz h ILE 72 Ca 0.47 -1.52 -0.07 0.00 1.00 0.00 0.00 64.86 64.74 3ggz h ILE 72 Cb 1.12 1.99 -0.03 0.00 -0.74 0.00 0.00 36.82 39.16 3ggz h ILE 72 CO -0.18 0.45 0.13 -0.07 0.00 0.00 0.00 178.15 178.48 3ggz h LEU 73 N 0.05 0.99 0.00 1.44 3.38 0.10 -1.30 115.31 119.97 3ggz h LEU 73 Ca 0.01 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3ggz h LEU 73 Cb 0.85 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 3ggz h LEU 73 CO 0.06 0.98 -0.09 -0.08 0.09 0.00 0.00 178.44 179.41 3ggz h GLU 74 N 0.95 -0.10 -0.64 1.13 4.81 0.80 -1.72 114.58 119.80 3ggz h GLU 74 Ca 0.20 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.49 3ggz h GLU 74 Cb 0.40 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.72 3ggz h GLU 74 CO 0.01 -0.07 -0.43 1.25 -0.73 0.00 0.00 179.01 179.03 3ggz h LEU 75 N -0.11 -1.57 -0.93 1.64 6.46 -1.26 0.42 115.31 119.96 3ggz h LEU 75 Ca 0.00 0.23 0.31 0.00 -0.12 0.00 0.00 57.88 58.30 3ggz h LEU 75 Cb 0.11 0.68 -0.17 0.00 -0.73 0.00 0.00 40.66 40.56 3ggz h LEU 75 CO -0.06 -0.20 0.20 -1.22 -0.62 0.00 0.00 178.44 176.54 3ggz n TYR 76 N -4.68 0.78 0.27 1.25 4.01 -0.50 -0.19 117.16 118.09 3ggz n TYR 76 Ca 0.01 1.11 -0.11 0.00 -0.16 0.00 0.00 57.90 58.75 3ggz n TYR 76 Cb 0.21 -1.31 -0.05 0.00 -0.31 0.00 0.00 39.34 37.87 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 -0.85 0.05 -0.19 0.00 5.08 0.01 1.53 114.58 120.22 3ggz h GLU 78 Ca -0.07 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3ggz h GLU 78 Cb 0.54 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 3ggz h GLU 78 CO 0.12 0.03 0.11 1.25 -1.00 0.00 0.00 179.01 179.52 3ggz h LEU 79 N 0.05 0.23 -0.57 1.33 6.46 -0.42 -2.18 115.31 120.21 3ggz h LEU 79 Ca 0.75 -0.07 -0.13 0.00 -0.12 0.00 0.00 57.88 58.31 3ggz h LEU 79 Cb 1.84 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 41.70 3ggz h LEU 79 CO -0.78 0.23 -0.24 -0.07 -0.62 0.00 0.00 178.44 176.96 3ggz h LEU 80 N 0.21 0.91 -0.39 2.25 3.38 0.28 -2.50 115.31 119.44 3ggz h LEU 80 Ca 0.07 -0.35 0.08 0.00 0.09 0.00 0.00 57.88 57.77 3ggz h LEU 80 Cb 0.05 -0.25 -0.08 0.00 0.09 0.00 0.00 40.66 40.47 3ggz h LEU 80 CO -0.01 1.11 -0.15 0.25 0.09 0.00 0.00 178.44 179.73 3ggz h LEU 81 N 0.76 -0.52 -0.00 1.67 5.85 0.10 -0.30 115.31 122.88 3ggz h LEU 81 Ca 0.10 0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 3ggz h LEU 81 Cb 0.79 0.30 -0.00 0.00 0.37 0.00 0.00 40.66 42.12 3ggz h LEU 81 CO 0.07 -0.18 0.00 0.00 -0.34 0.00 0.00 178.44 177.98 3ggz h ALA 82 N 1.27 0.00 0.00 1.25 0.00 -1.34 -2.76 119.26 117.68 3ggz h ALA 82 Ca 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3ggz h ALA 82 Cb 0.36 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3ggz h ALA 82 CO -0.44 -0.37 0.00 0.54 0.00 0.00 0.00 179.25 178.98 3ggz n ARG 83 N -4.96 0.76 -0.28 0.00 1.74 -0.90 -4.16 116.66 108.86 3ggz n ARG 83 Ca -0.08 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 57.10 3ggz n ARG 83 Cb 0.15 -1.28 0.24 0.00 -1.02 0.00 0.00 32.46 30.55 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 0.00 0.45 -0.58 1.55 2.07 -0.76 0.36 116.25 119.34 3ggz h VAL 84 Ca 0.00 -0.10 0.11 0.00 0.82 0.00 0.00 66.70 67.53 3ggz h VAL 84 Cb 0.28 0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.15 3ggz h VAL 84 CO 0.00 0.05 0.39 1.56 0.02 0.00 0.00 177.57 179.60 3ggz h GLN 85 N 0.29 0.33 0.00 1.57 1.08 -1.86 -0.74 115.11 115.78 3ggz h GLN 85 Ca 0.49 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.65 3ggz h GLN 85 Cb 0.90 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 28.25 3ggz h GLN 85 CO -0.56 0.22 -0.36 0.28 -0.95 0.00 0.00 178.83 177.46 3ggz h VAL 86 N 0.34 0.11 0.00 -0.54 2.07 -0.64 -3.26 116.25 114.33 3ggz h VAL 86 Ca 0.27 -1.17 -0.13 0.00 0.82 0.00 0.00 66.70 66.49 3ggz h VAL 86 Cb 0.62 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 32.29 3ggz h VAL 86 CO -0.07 0.06 -0.63 0.40 0.02 0.00 0.00 177.57 177.35 3ggz h ILE 87 N 0.00 1.22 0.00 4.57 2.04 -0.31 -3.15 117.51 121.88 3ggz h ILE 87 Ca -0.01 -2.37 -0.05 0.00 1.00 0.00 0.00 64.86 63.44 3ggz h ILE 87 Cb 1.06 2.37 -0.01 0.00 -0.74 0.00 0.00 36.82 39.50 3ggz h ILE 87 CO 0.01 0.62 -0.21 -1.13 0.00 0.00 0.00 178.15 177.43 3ggz h ASN 88 N 0.00 0.00 -1.44 1.72 -1.24 -1.49 -3.24 115.58 109.90 3ggz h ASN 88 Ca -0.01 0.00 -0.62 0.00 0.71 0.00 0.00 56.30 56.39 3ggz h ASN 88 Cb 1.31 0.00 -0.22 0.00 0.73 0.00 0.00 38.32 40.14 3ggz h ASN 88 CO 0.08 0.21 0.71 0.47 -1.29 0.00 0.00 177.43 177.62 3ggz n ASP 89 N -3.32 7.00 -3.79 1.15 8.00 -1.19 -4.90 116.55 119.51 3ggz n ASP 89 Ca 0.01 -3.51 -0.13 0.00 0.71 0.00 0.00 54.79 51.87 3ggz n ASP 89 Cb 0.46 -1.14 -0.10 0.00 -0.02 0.00 0.00 41.12 40.31 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 -3.62 0.03 0.00 0.53 1.01 -1.22 -5.04 121.20 112.89 3ggz s ILE 90 Ca 0.55 -0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.95 3ggz s ILE 90 Cb 0.41 -0.46 0.00 0.00 0.01 0.00 0.00 42.46 42.42 3ggz s ILE 90 CO -0.29 -0.14 0.00 -0.24 0.00 0.00 0.00 174.94 174.27 3ggz n SER 91 N 2.21 0.00 -4.38 3.58 2.88 -1.26 -4.80 113.62 111.86 3ggz n SER 91 Ca -0.17 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.15 3ggz n SER 91 Cb 0.57 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.92 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 2.00 0.05 2.46 -4.23 -1.26 -4.48 115.64 110.18 3ggz s THR 92 Ca 0.00 -2.13 -0.27 0.00 -1.18 0.00 0.00 61.69 58.10 3ggz s THR 92 Cb 0.00 -2.04 -0.17 0.00 1.34 0.00 0.00 72.50 71.63 3ggz s THR 92 CO 0.00 -0.40 1.47 -0.33 -0.54 0.00 0.00 174.62 174.82 3ggz h GLU 93 N 2.81 -0.49 -0.93 3.99 5.08 -2.00 -2.91 114.58 120.14 3ggz h GLU 93 Ca -0.41 0.03 0.38 0.00 -1.00 0.00 0.00 59.36 58.37 3ggz h GLU 93 Cb 1.22 0.11 -0.17 0.00 0.50 0.00 0.00 28.75 30.42 3ggz h GLU 93 CO 0.56 -0.24 0.48 -1.91 -1.00 0.00 0.00 179.01 176.90 3ggz n GLU 94 N -5.24 -0.06 0.08 2.33 4.07 -1.26 -0.85 120.64 119.71 3ggz n GLU 94 Ca -0.10 1.29 -0.03 0.00 -0.06 0.00 0.00 57.16 58.25 3ggz n GLU 94 Cb 0.26 -2.30 -0.02 0.00 -0.06 0.00 0.00 31.44 29.32 3ggz n GLU 94 CO 0.00 0.00 0.00 1.96 -0.06 0.00 0.00 177.13 179.03 3ggz h GLN 95 N 0.00 -0.21 -0.69 5.31 4.20 -1.89 -2.58 115.11 119.25 3ggz h GLN 95 Ca 0.78 0.01 0.10 0.00 0.06 0.00 0.00 58.65 59.60 3ggz h GLN 95 Cb 2.04 0.05 -0.08 0.00 0.30 0.00 0.00 27.48 29.80 3ggz h GLN 95 CO -0.72 -0.14 0.31 1.25 -0.67 0.00 0.00 178.83 178.86 3ggz h LEU 96 N -0.21 0.37 0.00 1.46 5.85 -1.08 -2.65 115.31 119.05 3ggz h LEU 96 Ca -0.02 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3ggz h LEU 96 Cb 0.17 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.22 3ggz h LEU 96 CO 0.03 0.20 0.00 0.52 -0.34 0.00 0.00 178.44 178.85 3ggz n VAL 97 N -4.92 0.00 -1.43 1.05 0.31 -0.03 -2.40 118.33 110.91 3ggz n VAL 97 Ca 0.11 1.28 -0.31 0.00 -0.01 0.00 0.00 64.34 65.41 3ggz n VAL 97 Cb 0.30 -2.17 0.03 0.00 -0.91 0.00 0.00 33.84 31.09 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 -1.52 2.45 0.00 5.55 5.02 -0.98 -4.23 118.16 124.46 3ggz n LYS 98 Ca 0.00 -2.77 0.00 0.00 -2.02 0.00 0.00 58.31 53.52 3ggz n LYS 98 Cb 0.00 -2.11 0.00 0.00 -0.02 0.00 0.00 35.03 32.90 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 -0.15 0.13 -2.58 1.97 2.13 -1.00 -4.95 120.64 116.19 3ggz n GLU 99 Ca 0.51 0.00 -0.24 0.00 0.66 0.00 0.00 57.16 58.09 3ggz n GLU 99 Cb 0.51 -0.14 -0.00 0.00 0.27 0.00 0.00 31.44 32.08 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 -0.46 3.03 0.27 4.31 8.25 -1.01 -4.68 115.22 124.94 3ggz n HIS 100 Ca 0.00 -3.19 0.05 0.00 -0.26 0.00 0.00 57.72 54.32 3ggz n HIS 100 Cb 0.00 -0.19 -0.06 0.00 1.12 0.00 0.00 29.99 30.86 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 -0.36 2.39 0.03 -0.41 0.00 -1.26 -1.92 117.12 115.59 3ggz n MET 101 Ca 0.33 -0.04 -0.15 0.00 0.00 0.00 0.00 57.70 57.84 3ggz n MET 101 Cb 0.65 -1.07 -0.14 0.00 0.00 0.00 0.00 33.22 32.66 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 0.28 0.87 6.12 3.32 -1.93 -3.32 116.42 121.76 3ggz h ASP 102 Ca 0.00 -0.46 0.00 0.00 0.02 0.00 0.00 57.03 56.59 3ggz h ASP 102 Cb 0.32 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.78 3ggz h ASP 102 CO 0.00 1.39 -0.10 -0.90 -1.72 0.00 0.00 179.24 177.91 3ggz n ASP 103 N -3.36 0.11 0.00 6.45 5.68 -1.26 -4.92 116.55 119.25 3ggz n ASP 103 Ca -0.18 0.31 0.00 0.00 -0.50 0.00 0.00 54.79 54.42 3ggz n ASP 103 Cb 1.04 -0.34 0.00 0.00 -1.14 0.00 0.00 41.12 40.68 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 1.49 0.67 0.08 6.12 0.00 -1.25 -4.94 105.19 107.36 3ggz n GLY 104 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 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 1.00 0.30 -0.61 2.04 -1.86 -2.45 117.51 115.93 3ggz h ILE 105 Ca 0.00 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 3ggz h ILE 105 Cb 0.00 0.86 0.00 0.00 -0.74 0.00 0.00 36.82 36.94 3ggz h ILE 105 CO 0.00 0.02 -0.14 -1.13 0.00 0.00 0.00 178.15 176.90 3ggz h ASN 106 N 0.13 -0.34 0.00 1.72 -1.24 -1.66 -2.03 115.58 112.16 3ggz h ASN 106 Ca 0.05 -0.14 0.00 0.00 0.71 0.00 0.00 56.30 56.91 3ggz h ASN 106 Cb 0.00 0.09 0.00 0.00 0.73 0.00 0.00 38.32 39.14 3ggz h ASN 106 CO -0.03 -0.04 0.17 1.21 -1.29 0.00 0.00 177.43 177.45 3ggz n GLU 107 N -5.16 0.10 -0.11 6.67 2.13 -1.21 -1.49 120.64 121.56 3ggz n GLU 107 Ca -0.10 0.57 -0.21 0.00 0.66 0.00 0.00 57.16 58.09 3ggz n GLU 107 Cb 0.25 -1.98 -0.08 0.00 0.27 0.00 0.00 31.44 29.89 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 -1.62 0.93 -0.04 4.31 0.00 -0.93 -4.15 120.51 119.02 3ggz n ALA 108 Ca -0.01 -0.80 -0.12 0.00 0.00 0.00 0.00 53.44 52.51 3ggz n ALA 108 Cb 0.19 -0.08 -0.07 0.00 0.00 0.00 0.00 19.45 19.49 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 -1.00 1.27 -0.55 0.00 2.10 -1.04 -2.53 117.51 115.76 3ggz h ILE 109 Ca -0.39 -0.89 0.08 0.00 1.08 0.00 0.00 64.86 64.73 3ggz h ILE 109 Cb 1.28 1.65 -0.06 0.00 -1.09 0.00 0.00 36.82 38.59 3ggz h ILE 109 CO -0.23 0.26 0.21 0.03 -1.08 0.00 0.00 178.15 177.34 3ggz h ARG 110 N -0.10 0.39 0.28 2.19 3.08 -1.52 -2.79 114.38 115.92 3ggz h ARG 110 Ca 0.03 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 3ggz h ARG 110 Cb 0.40 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3ggz h ARG 110 CO 0.01 0.26 -0.14 0.66 -1.07 0.00 0.00 179.97 179.69 3ggz h SER 111 N 0.41 -0.32 -0.89 7.04 4.64 -1.71 -2.99 113.55 119.72 3ggz h SER 111 Ca 0.27 -0.07 0.24 0.00 -0.47 0.00 0.00 61.79 61.76 3ggz h SER 111 Cb 0.29 0.08 -0.15 0.00 -0.31 0.00 0.00 62.40 62.31 3ggz h SER 111 CO -0.26 -0.13 0.15 -0.07 -0.87 0.00 0.00 176.83 175.66 3ggz h LEU 112 N -0.50 -0.17 -0.55 5.97 3.38 -1.24 0.34 115.31 122.54 3ggz h LEU 112 Ca -0.04 0.22 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 3ggz h LEU 112 Cb 0.37 0.34 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 3ggz h LEU 112 CO 0.06 -0.23 0.33 0.40 0.09 0.00 0.00 178.44 179.10 3ggz h ILE 113 N 0.13 1.16 0.12 1.22 2.04 -1.43 -2.85 117.51 117.91 3ggz h ILE 113 Ca 0.56 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 66.05 3ggz h ILE 113 Cb 1.13 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 3ggz h ILE 113 CO -0.74 0.17 -0.09 0.22 0.00 0.00 0.00 178.15 177.71 3ggz h TYR 114 N 0.74 -0.24 -0.44 1.37 3.20 -0.24 -2.37 116.97 118.99 3ggz h TYR 114 Ca 0.20 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.19 3ggz h TYR 114 Cb -0.02 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.33 3ggz h TYR 114 CO -0.02 -0.15 0.57 0.00 -1.64 0.00 0.00 178.16 176.91 3ggz h ALA 115 N 0.65 2.13 -0.13 1.82 0.00 -0.93 -3.24 119.26 119.56 3ggz h ALA 115 Ca -0.00 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3ggz h ALA 115 Cb 0.20 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3ggz h ALA 115 CO -0.01 -0.79 -0.07 -0.89 0.00 0.00 0.00 179.25 177.48 3ggz n ILE 116 N -3.48 -0.09 -0.13 0.00 5.41 -0.89 -1.27 119.36 118.91 3ggz n ILE 116 Ca 0.08 1.55 -0.10 0.00 1.00 0.00 0.00 62.75 65.28 3ggz n ILE 116 Cb 0.74 -2.04 -0.05 0.00 -0.71 0.00 0.00 39.64 37.59 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 -1.44 -1.55 1.39 3.38 -1.79 -2.91 115.31 112.39 3ggz h LEU 117 Ca 0.02 0.22 0.03 0.00 0.09 0.00 0.00 57.88 58.24 3ggz h LEU 117 Cb 0.05 0.63 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 3ggz h LEU 117 CO -0.12 -0.37 0.35 -0.26 0.09 0.00 0.00 178.44 178.13 3ggz h PHE 118 N -0.32 0.57 -3.69 1.13 0.04 -1.60 -3.38 116.94 109.69 3ggz h PHE 118 Ca 0.14 0.01 -0.69 0.00 2.80 0.00 0.00 57.97 60.23 3ggz h PHE 118 Cb 0.58 -0.19 -0.30 0.00 2.20 0.00 0.00 35.95 38.24 3ggz h PHE 118 CO -0.63 0.33 -0.63 0.08 -0.60 0.00 0.00 178.31 176.86 3ggz s VAL 119 N -5.53 3.53 -1.88 -0.55 1.01 -0.40 -4.94 120.40 111.64 3ggz s VAL 119 Ca -0.09 -1.27 0.19 0.00 0.00 0.00 0.00 61.98 60.82 3ggz s VAL 119 Cb 0.18 -3.04 0.40 0.00 0.00 0.00 0.00 36.38 33.93 3ggz s VAL 119 CO 0.74 -0.19 1.33 -0.90 0.00 0.00 0.00 175.10 176.08 3ggz n ASP 120 N 4.75 3.27 -0.56 3.32 5.68 -1.26 -4.31 116.55 127.44 3ggz n ASP 120 Ca -0.12 -1.93 0.11 0.00 -0.50 0.00 0.00 54.79 52.34 3ggz n ASP 120 Cb 0.44 -0.27 0.38 0.00 -1.14 0.00 0.00 41.12 40.53 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 1.20 1.74 -2.68 0.11 0.00 -1.26 -3.94 120.64 115.81 3ggz n GLU 121 Ca 0.17 -1.11 -0.13 0.00 0.00 0.00 0.00 57.16 56.09 3ggz n GLU 121 Cb 0.53 -1.40 0.02 0.00 0.00 0.00 0.00 31.44 30.59 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 1.14 -0.35 3.84 0.31 -1.26 -4.86 118.33 117.49 3ggz n VAL 122 Ca 0.16 -3.53 0.33 0.00 -0.01 0.00 0.00 64.34 61.29 3ggz n VAL 122 Cb 0.33 0.24 0.58 0.00 -0.91 0.00 0.00 33.84 34.09 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 -0.10 -0.05 0.30 5.55 5.02 -1.25 0.29 118.16 127.92 3ggz n LYS 123 Ca 0.16 1.25 0.13 0.00 -2.02 0.00 0.00 58.31 57.83 3ggz n LYS 123 Cb 0.77 -2.32 0.71 0.00 -0.02 0.00 0.00 35.03 34.17 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 -0.18 1.97 3.07 -1.95 -1.83 114.58 115.67 3ggz h GLU 124 Ca 0.81 0.00 0.05 0.00 -0.50 0.00 0.00 59.36 59.71 3ggz h GLU 124 Cb 2.30 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 30.16 3ggz h GLU 124 CO -0.62 0.00 -0.14 -0.07 -1.40 0.00 0.00 179.01 176.78 3ggz h LEU 125 N 0.00 -0.44 -1.44 1.33 3.38 -0.56 -1.44 115.31 116.15 3ggz h LEU 125 Ca 0.00 0.09 0.43 0.00 0.09 0.00 0.00 57.88 58.49 3ggz h LEU 125 Cb 0.68 0.22 -0.12 0.00 0.09 0.00 0.00 40.66 41.53 3ggz h LEU 125 CO 0.00 -0.18 0.87 0.77 0.09 0.00 0.00 178.44 179.99 3ggz h SER 126 N -0.14 0.24 -0.89 -0.43 4.64 -1.55 0.59 113.55 116.01 3ggz h SER 126 Ca 0.11 0.13 0.18 0.00 -0.47 0.00 0.00 61.79 61.74 3ggz h SER 126 Cb 0.30 0.11 -0.07 0.00 -0.31 0.00 0.00 62.40 62.44 3ggz h SER 126 CO -0.27 -0.16 0.58 1.56 -0.87 0.00 0.00 176.83 177.67 3ggz h GLN 127 N 0.09 0.48 -0.82 4.77 4.20 -1.45 0.15 115.11 122.53 3ggz h GLN 127 Ca 0.81 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 59.46 3ggz h GLN 127 Cb 2.58 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 30.22 3ggz h GLN 127 CO -0.39 0.32 0.38 -0.07 -0.67 0.00 0.00 178.83 178.40 3ggz h LEU 128 N 0.49 1.09 0.19 1.46 3.38 0.07 0.85 115.31 122.84 3ggz h LEU 128 Ca 0.46 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.29 3ggz h LEU 128 Cb 1.01 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 3ggz h LEU 128 CO -0.19 0.93 -0.17 0.50 0.09 0.00 0.00 178.44 179.60 3ggz h LYS 129 N 1.18 -0.37 -0.20 1.13 3.64 -0.80 -2.22 116.57 118.93 3ggz h LYS 129 Ca 0.28 0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.73 3ggz h LYS 129 Cb 0.14 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.01 3ggz h LYS 129 CO -0.03 -0.25 -0.05 -0.44 -2.27 0.00 0.00 179.45 176.41 3ggz h ASP 130 N -0.39 -0.19 0.00 4.20 3.32 -1.14 -0.43 116.42 121.80 3ggz h ASP 130 Ca -0.00 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.11 3ggz h ASP 130 Cb 0.36 0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.03 3ggz h ASP 130 CO -0.03 -0.07 0.00 0.18 -1.72 0.00 0.00 179.24 177.60 3ggz n LEU 131 N -5.20 0.00 -0.07 1.55 4.77 0.26 -1.79 117.00 116.52 3ggz n LEU 131 Ca -0.02 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.84 3ggz n LEU 131 Cb 0.13 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.07 3ggz n LEU 131 CO 0.24 0.00 -0.97 0.23 -1.33 0.00 0.00 177.39 175.56 3ggz n MET 132 N -0.67 0.67 0.19 3.23 2.81 -0.17 -3.50 117.12 119.69 3ggz n MET 132 Ca 0.02 0.13 0.07 0.00 -1.81 0.00 0.00 57.70 56.11 3ggz n MET 132 Cb 0.01 -1.62 0.33 0.00 -0.71 0.00 0.00 33.22 31.23 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 0.78 0.94 -0.04 3.04 0.00 -1.34 1.91 119.26 124.56 3ggz h ALA 133 Ca -0.46 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.07 3ggz h ALA 133 Cb 2.11 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.84 3ggz h ALA 133 CO 0.03 0.40 -0.36 2.35 0.00 0.00 0.00 179.25 181.67 3ggz h TRP 134 N 0.00 0.09 0.00 0.00 7.01 -1.64 -3.27 115.95 118.14 3ggz h TRP 134 Ca -0.00 -0.02 -0.12 0.00 2.11 0.00 0.00 58.89 60.86 3ggz h TRP 134 Cb 0.93 -0.02 -0.02 0.00 -2.10 0.00 0.00 29.16 27.94 3ggz h TRP 134 CO 0.00 0.44 -1.67 1.17 -2.79 0.00 0.00 178.44 175.58 3ggz n LYS 135 N -4.09 1.45 0.00 2.65 3.00 -0.89 -5.00 118.16 115.28 3ggz n LYS 135 Ca -0.02 -0.05 0.00 0.00 -0.00 0.00 0.00 58.31 58.25 3ggz n LYS 135 Cb 0.41 -1.28 0.00 0.00 0.00 0.00 0.00 35.03 34.16 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 -2.21 0.00 -3.81 3.15 5.41 0.65 -4.23 119.36 118.31 3ggz n ILE 136 Ca -0.12 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.54 3ggz n ILE 136 Cb 0.64 0.00 0.01 0.00 -0.71 0.00 0.00 39.64 39.58 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 -1.82 -0.22 4.38 0.23 -1.15 -4.79 115.26 111.89 3ggz n ASN 137 Ca 0.00 -2.54 0.13 0.00 -0.53 0.00 0.00 54.58 51.63 3ggz n ASN 137 Cb 0.00 3.12 0.31 0.00 -2.08 0.00 0.00 39.78 41.12 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 -0.50 0.00 0.06 3.53 0.31 -1.26 -3.28 118.33 117.19 3ggz n VAL 138 Ca -0.05 -0.12 -0.14 0.00 -0.01 0.00 0.00 64.34 64.02 3ggz n VAL 138 Cb 0.54 0.47 -0.14 0.00 -0.91 0.00 0.00 33.84 33.80 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 1.09 0.17 0.08 5.55 -0.00 -1.98 -3.31 114.58 116.19 3ggz h GLU 139 Ca 0.00 -0.30 -0.00 0.00 -0.00 0.00 0.00 59.36 59.06 3ggz h GLU 139 Cb 0.53 0.11 -0.00 0.00 -0.00 0.00 0.00 28.75 29.39 3ggz h GLU 139 CO 0.00 1.03 -0.05 0.35 -0.00 0.00 0.00 179.01 180.34 3ggz h PHE 140 N 0.05 -0.13 -0.62 2.06 3.57 -1.97 -2.19 116.94 117.71 3ggz h PHE 140 Ca -0.19 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.35 3ggz h PHE 140 Cb 1.96 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 40.70 3ggz h PHE 140 CO 0.04 -0.08 0.34 -0.39 -2.23 0.00 0.00 178.31 176.00 3ggz h VAL 141 N -0.13 0.99 0.00 1.41 -1.51 -1.76 -0.94 116.25 114.31 3ggz h VAL 141 Ca -0.01 -0.22 0.00 0.00 -1.23 0.00 0.00 66.70 65.24 3ggz h VAL 141 Cb 0.11 0.28 0.00 0.00 -2.13 0.00 0.00 31.29 29.55 3ggz h VAL 141 CO 0.01 0.12 0.00 0.78 -1.23 0.00 0.00 177.57 177.25 3ggz h ASN 142 N 0.65 0.00 0.90 4.19 2.35 -1.61 -1.36 115.58 120.70 3ggz h ASN 142 Ca 0.27 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 3ggz h ASN 142 Cb 0.14 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.51 3ggz h ASN 142 CO -0.16 0.00 -0.09 0.61 -1.65 0.00 0.00 177.43 176.14 3ggz n GLY 143 N -0.19 -1.45 0.22 2.83 0.00 -0.37 -2.68 105.19 103.55 3ggz n GLY 143 Ca 0.00 -0.15 -0.08 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.49 1.46 0.33 1.61 0.31 -0.78 -3.32 118.33 116.45 3ggz n VAL 144 Ca 0.07 0.18 0.15 0.00 -0.01 0.00 0.00 64.34 64.73 3ggz n VAL 144 Cb 0.34 -2.24 0.82 0.00 -0.91 0.00 0.00 33.84 31.85 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 -0.86 0.00 0.00 2.52 2.04 -1.42 0.35 117.51 120.14 3ggz h ILE 145 Ca -0.00 0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.68 3ggz h ILE 145 Cb 0.86 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 3ggz h ILE 145 CO -0.00 0.00 -1.48 0.00 0.00 0.00 0.00 178.15 176.67 3ggz n ALA 146 N -1.88 1.39 -1.00 1.87 0.00 -1.09 -4.73 120.51 115.07 3ggz n ALA 146 Ca -0.02 -0.78 0.06 0.00 0.00 0.00 0.00 53.44 52.71 3ggz n ALA 146 Cb 0.36 0.13 0.30 0.00 0.00 0.00 0.00 19.45 20.25 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 -4.16 4.44 -2.92 0.00 9.92 -1.17 -4.97 116.55 117.68 3ggz n ASP 147 Ca -0.27 -3.05 -0.00 0.00 -0.53 0.00 0.00 54.79 50.94 3ggz n ASP 147 Cb 0.60 -0.61 -0.00 0.00 -0.64 0.00 0.00 41.12 40.48 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 -0.19 -0.01 -1.65 1.24 1.44 0.12 -4.69 115.22 111.48 3ggz n HIS 148 Ca 0.25 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.54 3ggz n HIS 148 Cb 1.03 -0.02 -0.03 0.00 0.12 0.00 0.00 29.99 31.09 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 -3.67 3.02 -1.38 0.61 -1.09 -1.22 -1.95 121.20 115.51 3ggz s ILE 149 Ca 0.00 0.02 0.00 0.00 -2.23 0.00 0.00 60.65 58.44 3ggz s ILE 149 Cb -0.00 -3.02 0.00 0.00 -1.58 0.00 0.00 42.46 37.86 3ggz s ILE 149 CO 0.01 -0.01 0.00 0.47 -1.23 0.00 0.00 174.94 174.18 3ggz n ASP 150 N 8.79 -4.57 -4.65 3.58 10.43 -1.26 -4.96 116.55 123.91 3ggz n ASP 150 Ca 0.23 0.16 -0.42 0.00 2.57 0.00 0.00 54.79 57.32 3ggz n ASP 150 Cb 0.42 -3.55 -0.04 0.00 1.84 0.00 0.00 41.12 39.80 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 -2.64 4.80 0.38 2.53 1.01 -0.83 -4.81 120.40 120.85 3ggz s VAL 151 Ca 0.00 1.73 -0.20 0.00 0.00 0.00 0.00 61.98 63.51 3ggz s VAL 151 Cb 0.00 -4.18 -0.15 0.00 0.00 0.00 0.00 36.38 32.05 3ggz s VAL 151 CO 0.00 -0.08 0.08 -2.65 0.00 0.00 0.00 175.10 172.45 3ggz n PRO 152 N 5.91 0.00 0.10 2.72 -0.02 -1.26 -4.78 135.00 137.66 3ggz n PRO 152 Ca 0.07 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.42 3ggz n PRO 152 Cb 0.47 -0.95 -0.08 0.00 -0.02 0.00 0.00 33.50 32.92 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 0.30 -0.23 -0.25 -0.52 4.57 -2.01 -2.74 114.58 113.70 3ggz h GLU 153 Ca -0.35 0.02 0.07 0.00 -1.18 0.00 0.00 59.36 57.92 3ggz h GLU 153 Cb 1.37 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 30.00 3ggz h GLU 153 CO 0.44 0.08 0.29 1.57 -1.18 0.00 0.00 179.01 180.21 3ggz h LYS 154 N -0.56 0.00 0.00 1.92 2.10 -1.99 -2.43 116.57 115.61 3ggz h LYS 154 Ca -0.02 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 3ggz h LYS 154 Cb 0.42 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.75 3ggz h LYS 154 CO 0.04 0.00 0.00 -0.89 -2.00 0.00 0.00 179.45 176.60 3ggz n ILE 155 N -3.73 0.00 -0.59 0.07 2.08 -1.04 -1.70 119.36 114.46 3ggz n ILE 155 Ca 0.03 0.67 0.47 0.00 0.56 0.00 0.00 62.75 64.49 3ggz n ILE 155 Cb 0.42 -1.42 0.79 0.00 -0.75 0.00 0.00 39.64 38.68 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 0.12 0.01 1.39 3.07 -1.48 0.26 117.51 120.88 3ggz h ILE 156 Ca 0.00 -0.00 -0.08 0.00 1.55 0.00 0.00 64.86 66.33 3ggz h ILE 156 Cb 0.00 0.11 0.01 0.00 -0.27 0.00 0.00 36.82 36.67 3ggz h ILE 156 CO 0.00 0.00 -0.31 0.50 -1.05 0.00 0.00 178.15 177.29 3ggz h LYS 157 N 0.01 0.20 0.00 0.16 3.64 -1.52 -3.12 116.57 115.94 3ggz h LYS 157 Ca 0.84 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.99 3ggz h LYS 157 Cb 3.28 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 35.17 3ggz h LYS 157 CO -0.05 0.97 0.00 1.63 -2.27 0.00 0.00 179.45 179.73 3ggz n LYS 158 N -4.45 0.74 -0.08 1.90 5.02 0.84 -1.43 118.16 120.70 3ggz n LYS 158 Ca -0.10 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 55.99 3ggz n LYS 158 Cb 0.54 -1.35 -0.13 0.00 -0.02 0.00 0.00 35.03 34.07 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 -3.43 2.40 -4.70 0.00 7.64 -1.07 -5.06 113.62 109.39 3ggz n SER 160 Ca -0.41 -3.17 -0.43 0.00 1.01 0.00 0.00 58.87 55.86 3ggz n SER 160 Cb 1.00 -0.65 -0.03 0.00 -1.01 0.00 0.00 64.21 63.52 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 0.95 2.43 -1.68 1.43 -0.04 -0.52 -4.83 135.00 132.74 3ggz n PRO 161 Ca 0.27 0.87 -0.33 0.00 -0.04 0.00 0.00 63.50 64.26 3ggz n PRO 161 Cb 0.46 -2.63 0.06 0.00 -0.04 0.00 0.00 33.50 31.35 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 0.66 4.90 0.05 3.54 1.04 -1.26 -4.89 113.70 117.74 3ggz s SER 162 Ca 0.70 2.07 -0.38 0.00 0.48 0.00 0.00 55.95 58.82 3ggz s SER 162 Cb -0.58 -2.56 -0.18 0.00 0.10 0.00 0.00 66.02 62.80 3ggz s SER 162 CO 0.43 -1.77 1.19 0.52 0.98 0.00 0.00 173.24 174.59 3ggz n VAL 163 N -2.50 0.09 -1.69 5.02 0.31 -1.26 -4.84 118.33 113.45 3ggz n VAL 163 Ca 0.11 -0.02 -0.43 0.00 -0.01 0.00 0.00 64.34 63.99 3ggz n VAL 163 Cb 0.52 -0.43 -0.01 0.00 -0.91 0.00 0.00 33.84 33.00 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 1.99 2.05 -2.35 5.55 -0.02 -1.26 -4.95 135.00 136.01 3ggz n PRO 164 Ca 0.19 0.72 -0.41 0.00 -2.02 0.00 0.00 63.50 61.97 3ggz n PRO 164 Cb 0.14 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.31 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 -1.81 4.46 0.33 -0.52 -0.14 -1.26 -4.91 119.74 115.89 3ggz s LYS 165 Ca 0.56 1.89 0.13 0.00 -1.36 0.00 0.00 55.97 57.19 3ggz s LYS 165 Cb -0.58 -3.25 1.01 0.00 -1.68 0.00 0.00 37.83 33.33 3ggz s LYS 165 CO 0.62 -0.14 1.69 0.93 -0.76 0.00 0.00 175.35 177.68 3ggz h GLU 166 N 5.52 0.40 0.52 1.68 5.08 -2.01 -1.89 114.58 123.89 3ggz h GLU 166 Ca -0.44 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 57.88 3ggz h GLU 166 Cb 1.21 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 3ggz h GLU 166 CO 0.76 0.27 -0.35 0.93 -1.00 0.00 0.00 179.01 179.62 3ggz h GLU 167 N 0.42 -0.80 -0.64 2.33 3.07 -2.00 -2.37 114.58 114.58 3ggz h GLU 167 Ca 0.70 0.05 0.12 0.00 -0.50 0.00 0.00 59.36 59.73 3ggz h GLU 167 Cb 1.50 0.18 -0.04 0.00 -0.84 0.00 0.00 28.75 29.56 3ggz h GLU 167 CO -0.56 -0.54 0.43 1.25 -1.40 0.00 0.00 179.01 178.19 3ggz h LEU 168 N -0.84 0.34 0.28 1.33 5.85 -1.74 -0.35 115.31 120.18 3ggz h LEU 168 Ca -0.06 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 3ggz h LEU 168 Cb 0.69 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.67 3ggz h LEU 168 CO 0.04 0.20 -0.13 0.58 -0.34 0.00 0.00 178.44 178.79 3ggz h VAL 169 N 0.37 0.76 -0.42 1.05 2.07 -1.26 -0.90 116.25 117.93 3ggz h VAL 169 Ca 0.30 -0.57 0.04 0.00 0.82 0.00 0.00 66.70 67.29 3ggz h VAL 169 Cb 0.67 1.06 -0.04 0.00 -1.52 0.00 0.00 31.29 31.46 3ggz h VAL 169 CO -0.08 0.12 0.18 0.44 0.02 0.00 0.00 177.57 178.25 3ggz h ASP 170 N -0.69 0.24 -0.52 0.57 3.32 -1.00 -0.62 116.42 117.72 3ggz h ASP 170 Ca -0.04 0.03 0.06 0.00 0.02 0.00 0.00 57.03 57.10 3ggz h ASP 170 Cb 0.47 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.99 3ggz h ASP 170 CO 0.06 0.18 0.35 0.25 -1.72 0.00 0.00 179.24 178.36 3ggz h LEU 171 N 0.37 0.42 0.19 1.55 5.85 -1.01 -1.15 115.31 121.54 3ggz h LEU 171 Ca 0.18 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 3ggz h LEU 171 Cb 0.13 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.07 3ggz h LEU 171 CO -0.15 0.28 -0.09 0.22 -0.34 0.00 0.00 178.44 178.35 3ggz h TYR 172 N 0.48 -0.24 -0.50 1.25 3.20 -0.30 -2.73 116.97 118.14 3ggz h TYR 172 Ca 0.23 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.19 3ggz h TYR 172 Cb 0.27 0.08 -0.10 0.00 1.54 0.00 0.00 36.73 38.52 3ggz h TYR 172 CO -0.00 0.17 -0.19 -0.07 -1.64 0.00 0.00 178.16 176.43 3ggz h LEU 173 N -0.78 -0.66 -0.96 2.82 3.38 -0.66 0.97 115.31 119.43 3ggz h LEU 173 Ca -0.03 0.17 0.13 0.00 0.09 0.00 0.00 57.88 58.24 3ggz h LEU 173 Cb 0.51 0.38 -0.09 0.00 0.09 0.00 0.00 40.66 41.56 3ggz h LEU 173 CO 0.04 -0.22 0.58 0.50 0.09 0.00 0.00 178.44 179.43 3ggz h LYS 174 N -0.07 0.86 -0.22 1.13 3.64 -1.27 -1.15 116.57 119.48 3ggz h LYS 174 Ca 0.24 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.46 3ggz h LYS 174 Cb 0.44 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.06 3ggz h LYS 174 CO -0.55 0.57 -0.26 0.93 -2.27 0.00 0.00 179.45 177.87 3ggz h GLU 175 N 0.88 0.57 0.00 1.90 4.39 -0.58 -2.42 114.58 119.33 3ggz h GLU 175 Ca 0.49 -0.31 -0.02 0.00 0.34 0.00 0.00 59.36 59.85 3ggz h GLU 175 Cb 0.56 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.22 3ggz h GLU 175 CO -0.29 0.91 -0.11 0.82 -1.16 0.00 0.00 179.01 179.18 3ggz h ILE 176 N 0.26 0.72 0.15 3.13 2.04 -0.29 -2.44 117.51 121.08 3ggz h ILE 176 Ca 0.03 -0.44 -0.31 0.00 1.00 0.00 0.00 64.86 65.14 3ggz h ILE 176 Cb 0.82 1.27 0.03 0.00 -0.74 0.00 0.00 36.82 38.20 3ggz h ILE 176 CO 0.06 0.11 -1.30 0.00 0.00 0.00 0.00 178.15 177.02 3ggz h ALA 177 N 1.89 -0.04 0.00 1.87 0.00 -1.10 -2.90 119.26 118.98 3ggz h ALA 177 Ca -0.00 -0.80 0.00 0.00 0.00 0.00 0.00 54.91 54.11 3ggz h ALA 177 Cb 0.26 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3ggz h ALA 177 CO 0.01 0.70 0.00 1.17 0.00 0.00 0.00 179.25 181.14 3ggz n LYS 178 N -3.76 0.44 -0.02 0.00 4.81 -0.92 -1.27 118.16 117.43 3ggz n LYS 178 Ca -0.14 0.03 -0.01 0.00 -0.87 0.00 0.00 58.31 57.32 3ggz n LYS 178 Cb 1.02 -1.50 -0.04 0.00 0.02 0.00 0.00 35.03 34.53 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 -1.06 0.22 0.61 3.15 -1.04 -1.15 -4.73 114.28 110.27 3ggz n THR 179 Ca 0.11 -0.17 0.06 0.00 -2.04 0.00 0.00 64.05 62.01 3ggz n THR 179 Cb 0.07 -0.46 -0.05 0.00 -1.82 0.00 0.00 70.33 68.07 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 -2.01 0.00 -1.64 -1.42 4.01 -1.10 -5.07 117.16 109.93 3ggz n TYR 180 Ca -0.05 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.68 3ggz n TYR 180 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.51 3ggz n TYR 180 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3ggz n ASP 181 N -0.99 -2.65 -3.64 7.72 10.43 -0.40 -5.07 116.55 121.95 3ggz n ASP 181 Ca 0.03 0.10 -0.08 0.00 2.57 0.00 0.00 54.79 57.42 3ggz n ASP 181 Cb 0.23 -1.48 -0.07 0.00 1.84 0.00 0.00 41.12 41.64 3ggz n ASP 181 CO 0.00 0.00 0.00 0.68 -1.07 0.00 0.00 177.20 176.81 3ggz s VAL 182 N -0.71 0.00 0.04 2.53 -7.23 -1.16 -5.07 120.40 108.80 3ggz s VAL 182 Ca 0.01 0.00 0.08 0.00 -1.81 0.00 0.00 61.98 60.26 3ggz s VAL 182 Cb -0.00 -1.00 -0.03 0.00 0.56 0.00 0.00 36.38 35.91 3ggz s VAL 182 CO 0.08 0.00 -0.21 -2.16 -0.31 0.00 0.00 175.10 172.51 3ggz s PRO 183 N 0.10 2.00 0.31 4.82 0.04 -1.26 -4.63 135.00 136.38 3ggz s PRO 183 Ca 0.04 -1.01 -0.09 0.00 0.04 0.00 0.00 61.00 59.98 3ggz s PRO 183 Cb -0.05 -2.12 0.01 0.00 0.04 0.00 0.00 34.50 32.38 3ggz s PRO 183 CO -0.08 0.53 0.53 1.52 0.04 0.00 0.00 177.00 179.55 3ggz s TYR 184 N -0.87 0.59 -0.30 0.56 -0.85 -1.26 -4.95 117.35 110.28 3ggz s TYR 184 Ca 0.13 -0.96 -0.25 0.00 -0.52 0.00 0.00 57.07 55.47 3ggz s TYR 184 Cb -0.10 0.19 0.19 0.00 0.38 0.00 0.00 41.96 42.62 3ggz s TYR 184 CO 0.04 -1.15 1.43 -1.12 -1.52 0.00 0.00 175.55 173.23 3ggz s SER 185 N -3.11 -0.06 0.00 -0.18 0.01 -1.26 -5.12 113.70 103.97 3ggz s SER 185 Ca 0.24 0.12 0.14 0.00 1.31 0.00 0.00 55.95 57.75 3ggz s SER 185 Cb -0.01 0.12 0.81 0.00 0.21 0.00 0.00 66.02 67.14 3ggz s SER 185 CO 0.14 -0.02 1.23 0.29 0.41 0.00 0.00 173.24 175.28