#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gzy h ILE 2 N 0.00 0.94 -0.41 1.12 1.08 -2.01 -2.39 117.51 115.84 3gzy h ILE 2 Ca 0.00 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.41 3gzy h ILE 2 Cb 0.00 0.98 -0.04 0.00 -3.07 0.00 0.00 36.82 34.69 3gzy h ILE 2 CO 0.00 0.00 0.04 -1.54 -0.69 0.00 0.00 178.15 175.96 3gzy n SER 3 N -4.46 4.21 -4.71 1.72 3.41 -1.26 -4.98 113.62 107.55 3gzy n SER 3 Ca -0.02 -3.14 -0.43 0.00 -0.26 0.00 0.00 58.87 55.02 3gzy n SER 3 Cb 0.13 -0.62 -0.02 0.00 -0.26 0.00 0.00 64.21 63.44 3gzy n SER 3 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3gzy n THR 4 N -0.34 1.26 -1.67 6.66 -1.04 -0.90 -4.92 114.28 113.32 3gzy n THR 4 Ca 0.28 -0.31 -0.40 0.00 -2.04 0.00 0.00 64.05 61.57 3gzy n THR 4 Cb 1.06 -1.72 0.02 0.00 -1.82 0.00 0.00 70.33 67.87 3gzy n THR 4 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3gzy n PRO 5 N 1.67 1.61 0.24 -2.82 -0.02 -1.26 -4.86 135.00 129.56 3gzy n PRO 5 Ca 0.08 0.58 0.16 0.00 -2.02 0.00 0.00 63.50 62.30 3gzy n PRO 5 Cb 0.35 -2.30 0.64 0.00 -0.02 0.00 0.00 33.50 32.17 3gzy n PRO 5 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3gzy h LEU 6 N 1.64 0.00 -0.25 2.45 3.38 -1.99 -1.19 115.31 119.34 3gzy h LEU 6 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 3gzy h LEU 6 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 3gzy h LEU 6 CO 0.57 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 177.56 3gzy n SER 7 N -2.83 0.69 -4.90 -0.43 3.41 -1.26 -4.81 113.62 103.49 3gzy n SER 7 Ca 0.01 0.60 -0.32 0.00 -0.26 0.00 0.00 58.87 58.90 3gzy n SER 7 Cb 0.27 -0.77 -0.05 0.00 -0.26 0.00 0.00 64.21 63.40 3gzy n SER 7 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3gzy s LYS 8 N -3.17 3.40 0.71 4.33 -0.14 -0.45 -5.08 119.74 119.34 3gzy s LYS 8 Ca 0.08 -0.38 -0.16 0.00 -1.36 0.00 0.00 55.97 54.15 3gzy s LYS 8 Cb 0.12 -3.05 0.03 0.00 -1.68 0.00 0.00 37.83 33.24 3gzy s LYS 8 CO 0.51 0.65 1.26 -0.85 -0.76 0.00 0.00 175.35 176.16 3gzy n GLU 9 N 0.74 0.74 -1.67 1.68 0.00 -1.26 -4.83 120.64 116.03 3gzy n GLU 9 Ca -0.09 0.32 -0.44 0.00 0.00 0.00 0.00 57.16 56.94 3gzy n GLU 9 Cb 0.52 -2.50 -0.02 0.00 0.00 0.00 0.00 31.44 29.44 3gzy n GLU 9 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 3gzy n PHE 10 N -2.48 2.12 -2.50 -1.84 7.35 -1.26 -4.89 117.46 113.96 3gzy n PHE 10 Ca 0.15 0.48 -0.43 0.00 -0.76 0.00 0.00 57.45 56.89 3gzy n PHE 10 Cb 0.49 -2.43 0.00 0.00 0.35 0.00 0.00 39.48 37.89 3gzy n PHE 10 CO 0.00 0.00 0.00 -1.91 -0.76 0.00 0.00 176.76 174.09 3gzy n GLU 11 N 1.65 3.48 -1.53 -4.13 2.13 -1.26 -4.99 120.64 115.98 3gzy n GLU 11 Ca 0.10 -3.56 -0.35 0.00 0.66 0.00 0.00 57.16 54.02 3gzy n GLU 11 Cb 0.32 -3.01 0.08 0.00 0.27 0.00 0.00 31.44 29.11 3gzy n GLU 11 CO 0.00 0.00 0.00 1.67 -0.41 0.00 0.00 177.13 178.39 3gzy s TRP 12 N 1.10 2.06 0.59 4.31 -2.14 -1.26 -4.41 118.94 119.20 3gzy s TRP 12 Ca 0.42 1.57 -0.18 0.00 2.66 0.00 0.00 56.10 60.57 3gzy s TRP 12 Cb 0.06 -3.53 -0.03 0.00 -3.10 0.00 0.00 33.47 26.86 3gzy s TRP 12 CO 0.00 -2.68 1.14 -1.25 -2.66 0.00 0.00 176.95 171.50 3gzy s PRO 13 N -3.74 3.07 0.29 3.25 0.04 -1.26 -4.93 135.00 131.72 3gzy s PRO 13 Ca 0.77 1.58 0.04 0.00 0.04 0.00 0.00 61.00 63.42 3gzy s PRO 13 Cb -0.31 -1.97 0.74 0.00 0.04 0.00 0.00 34.50 32.99 3gzy s PRO 13 CO 0.43 -1.07 1.68 0.00 0.04 0.00 0.00 177.00 178.08 3gzy h ALA 14 N 0.72 1.41 -3.72 8.56 0.00 -1.99 -3.38 119.26 120.86 3gzy h ALA 14 Ca -0.49 0.18 -0.53 0.00 0.00 0.00 0.00 54.91 54.07 3gzy h ALA 14 Cb 1.26 0.20 -0.23 0.00 0.00 0.00 0.00 17.79 19.02 3gzy h ALA 14 CO 0.55 -0.39 -0.82 -1.59 0.00 0.00 0.00 179.25 177.00 3gzy s LYS 15 N -5.89 1.11 0.70 0.00 -2.85 -1.26 -5.13 119.74 106.43 3gzy s LYS 15 Ca -0.12 -1.06 -0.17 0.00 -1.00 0.00 0.00 55.97 53.63 3gzy s LYS 15 Cb 0.26 -1.30 0.02 0.00 -2.06 0.00 0.00 37.83 34.75 3gzy s LYS 15 CO 0.78 0.31 1.26 -2.30 0.10 0.00 0.00 175.35 175.49 3gzy n PRO 16 N 1.32 0.82 -0.83 1.78 -0.02 -1.26 -5.00 135.00 131.81 3gzy n PRO 16 Ca -0.19 0.34 -0.28 0.00 -2.02 0.00 0.00 63.50 61.35 3gzy n PRO 16 Cb 0.54 -2.50 0.22 0.00 -0.02 0.00 0.00 33.50 31.74 3gzy n PRO 16 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3gzy s VAL 17 N -1.62 2.03 0.86 -1.45 -7.23 -1.26 -4.98 120.40 106.75 3gzy s VAL 17 Ca 0.80 0.01 -0.11 0.00 -1.81 0.00 0.00 61.98 60.87 3gzy s VAL 17 Cb -0.35 -2.27 0.12 0.00 0.56 0.00 0.00 36.38 34.44 3gzy s VAL 17 CO 0.44 -0.01 1.15 -0.94 -0.31 0.00 0.00 175.10 175.42 3gzy s SER 18 N -2.95 3.37 0.32 4.85 1.04 -1.26 -4.81 113.70 114.26 3gzy s SER 18 Ca 0.67 2.15 0.01 0.00 0.48 0.00 0.00 55.95 59.26 3gzy s SER 18 Cb -0.22 -2.56 0.54 0.00 0.10 0.00 0.00 66.02 63.88 3gzy s SER 18 CO 0.61 -2.81 1.94 -0.07 0.98 0.00 0.00 173.24 173.90 3gzy h LEU 19 N -1.53 0.75 -0.28 2.42 3.38 -1.99 -1.59 115.31 116.47 3gzy h LEU 19 Ca -0.44 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.42 3gzy h LEU 19 Cb 1.27 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 3gzy h LEU 19 CO 0.44 0.62 -0.04 -0.33 0.09 0.00 0.00 178.44 179.22 3gzy h GLU 20 N 0.85 0.53 -0.58 1.13 3.07 -1.99 -0.59 114.58 116.99 3gzy h GLU 20 Ca 0.21 -0.19 -0.08 0.00 -0.50 0.00 0.00 59.36 58.81 3gzy h GLU 20 Cb 0.04 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 27.89 3gzy h GLU 20 CO -0.03 0.71 0.07 1.25 -1.40 0.00 0.00 179.01 179.60 3gzy h LEU 21 N 0.29 0.95 -0.55 1.33 5.85 -1.89 -0.93 115.31 120.36 3gzy h LEU 21 Ca 0.07 -0.28 0.07 0.00 0.84 0.00 0.00 57.88 58.59 3gzy h LEU 21 Cb 0.50 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.22 3gzy h LEU 21 CO 0.02 0.99 0.24 -0.61 -0.34 0.00 0.00 178.44 178.75 3gzy h GLN 22 N 0.88 0.45 0.03 1.25 5.75 -1.06 -1.50 115.11 120.92 3gzy h GLN 22 Ca 0.17 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.65 3gzy h GLN 22 Cb 0.46 -0.10 0.00 0.00 1.07 0.00 0.00 27.48 28.91 3gzy h GLN 22 CO 0.02 0.30 -0.02 1.25 -2.65 0.00 0.00 178.83 177.73 3gzy h HIS 23 N 0.46 -0.04 -0.52 3.99 2.76 -0.85 -0.95 115.15 120.00 3gzy h HIS 23 Ca 0.26 -0.00 0.08 0.00 -2.20 0.00 0.00 60.37 58.51 3gzy h HIS 23 Cb 0.24 0.01 -0.07 0.00 1.55 0.00 0.00 27.41 29.15 3gzy h HIS 23 CO -0.13 0.15 0.15 1.96 -1.30 0.00 0.00 177.93 178.76 3gzy h GLN 24 N -0.23 0.30 -0.08 5.26 1.08 -1.00 0.13 115.11 120.58 3gzy h GLN 24 Ca -0.00 -0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.17 3gzy h GLN 24 Cb 0.21 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.57 3gzy h GLN 24 CO 0.01 0.20 0.02 0.28 -0.95 0.00 0.00 178.83 178.39 3gzy h VAL 25 N 0.31 1.18 -0.54 -0.54 2.07 -1.18 -0.26 116.25 117.30 3gzy h VAL 25 Ca 0.26 -0.55 0.08 0.00 0.82 0.00 0.00 66.70 67.30 3gzy h VAL 25 Cb 0.32 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 31.43 3gzy h VAL 25 CO -0.29 0.16 0.20 -0.33 0.02 0.00 0.00 177.57 177.32 3gzy h GLU 26 N -0.08 0.37 -0.64 1.57 5.08 -0.94 -1.60 114.58 118.34 3gzy h GLU 26 Ca 0.02 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 3gzy h GLU 26 Cb 0.23 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 3gzy h GLU 26 CO -0.00 0.24 0.12 1.96 -1.00 0.00 0.00 179.01 180.33 3gzy h GLN 27 N 0.38 1.05 -0.08 2.33 1.08 -0.58 -0.24 115.11 119.05 3gzy h GLN 27 Ca 0.26 -0.26 0.03 0.00 -1.45 0.00 0.00 58.65 57.23 3gzy h GLN 27 Cb 0.29 -0.13 -0.04 0.00 -0.05 0.00 0.00 27.48 27.55 3gzy h GLN 27 CO -0.26 0.95 -0.15 0.35 -0.95 0.00 0.00 178.83 178.77 3gzy h PHE 28 N 0.99 -0.38 -0.71 2.96 3.57 -0.67 -1.46 116.94 121.23 3gzy h PHE 28 Ca 0.20 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.76 3gzy h PHE 28 Cb 0.41 0.18 -0.04 0.00 2.79 0.00 0.00 35.95 39.29 3gzy h PHE 28 CO 0.03 -0.22 0.47 1.88 -2.23 0.00 0.00 178.31 178.24 3gzy h TYR 29 N -0.21 0.81 -0.40 0.41 0.05 -0.51 0.58 116.97 117.70 3gzy h TYR 29 Ca 0.08 0.02 -0.15 0.00 0.05 0.00 0.00 58.73 58.73 3gzy h TYR 29 Cb 0.32 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 37.78 3gzy h TYR 29 CO -0.24 0.46 -0.33 1.88 -1.05 0.00 0.00 178.16 178.88 3gzy h TYR 30 N 0.83 1.07 -0.40 4.88 0.05 -0.76 -0.91 116.97 121.73 3gzy h TYR 30 Ca 0.29 -0.30 -0.04 0.00 0.05 0.00 0.00 58.73 58.73 3gzy h TYR 30 Cb 0.12 -0.23 -0.02 0.00 1.01 0.00 0.00 36.73 37.60 3gzy h TYR 30 CO -0.00 1.11 0.10 0.00 -1.05 0.00 0.00 178.16 178.32 3gzy h ARG 31 N 0.76 0.64 -0.59 4.88 3.08 -0.71 -1.39 114.38 121.05 3gzy h ARG 31 Ca 0.07 -0.15 0.10 0.00 0.07 0.00 0.00 59.98 60.07 3gzy h ARG 31 Cb 0.91 -0.08 -0.08 0.00 0.08 0.00 0.00 29.97 30.80 3gzy h ARG 31 CO 0.08 0.66 0.17 1.49 -1.07 0.00 0.00 179.97 181.30 3gzy h GLU 32 N 0.50 0.31 -0.20 0.04 4.81 -0.79 -1.26 114.58 117.99 3gzy h GLU 32 Ca 0.13 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 3gzy h GLU 32 Cb 0.31 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 3gzy h GLU 32 CO 0.00 0.20 -0.15 0.00 -0.73 0.00 0.00 179.01 178.33 3gzy h ALA 33 N 1.44 1.37 -0.28 2.92 0.00 -0.87 -1.60 119.26 122.24 3gzy h ALA 33 Ca 0.30 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3gzy h ALA 33 Cb 0.42 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3gzy h ALA 33 CO -0.35 0.43 0.17 1.96 0.00 0.00 0.00 179.25 181.46 3gzy h GLN 34 N 0.31 0.37 -0.38 0.00 1.08 -0.66 0.26 115.11 116.09 3gzy h GLN 34 Ca 0.06 -0.03 0.02 0.00 -1.45 0.00 0.00 58.65 57.24 3gzy h GLN 34 Cb 0.46 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.79 3gzy h GLN 34 CO 0.03 0.29 0.23 -0.07 -0.95 0.00 0.00 178.83 178.35 3gzy h LEU 35 N 0.35 0.36 -0.65 1.46 3.38 -0.62 -1.02 115.31 118.58 3gzy h LEU 35 Ca 0.10 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 3gzy h LEU 35 Cb 0.01 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 3gzy h LEU 35 CO -0.02 0.26 0.28 -0.07 0.09 0.00 0.00 178.44 178.99 3gzy h LEU 36 N 0.46 0.88 0.00 1.67 3.38 -1.13 0.94 115.31 121.51 3gzy h LEU 36 Ca 0.15 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3gzy h LEU 36 Cb 0.00 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.53 3gzy h LEU 36 CO -0.07 0.79 0.00 0.47 0.09 0.00 0.00 178.44 179.72 3gzy n ASP 37 N -4.44 0.00 -0.34 -0.43 8.00 0.90 -1.87 116.55 118.38 3gzy n ASP 37 Ca 0.05 0.32 0.07 0.00 0.71 0.00 0.00 54.79 55.94 3gzy n ASP 37 Cb 0.15 -0.43 0.14 0.00 -0.02 0.00 0.00 41.12 40.96 3gzy n ASP 37 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3gzy n HIS 38 N -1.43 0.30 -3.08 1.24 8.25 -0.42 -4.65 115.22 115.43 3gzy n HIS 38 Ca 0.08 -0.78 -0.22 0.00 -0.26 0.00 0.00 57.72 56.54 3gzy n HIS 38 Cb 0.26 -0.15 0.02 0.00 1.12 0.00 0.00 29.99 31.24 3gzy n HIS 38 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3gzy n HIS 39 N -0.70 -1.83 -1.53 4.41 8.25 -0.74 -4.89 115.22 118.19 3gzy n HIS 39 Ca 0.13 0.44 -0.40 0.00 -0.26 0.00 0.00 57.72 57.64 3gzy n HIS 39 Cb 0.58 -3.77 -0.02 0.00 1.12 0.00 0.00 29.99 27.90 3gzy n HIS 39 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3gzy n ALA 40 N -3.39 7.00 -0.15 -1.41 0.00 0.25 -4.80 120.51 118.01 3gzy n ALA 40 Ca -0.08 -3.71 -0.11 0.00 0.00 0.00 0.00 53.44 49.54 3gzy n ALA 40 Cb 0.59 -3.30 -0.01 0.00 0.00 0.00 0.00 19.45 16.73 3gzy n ALA 40 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3gzy h PHE 41 N 5.16 0.90 -0.84 0.00 -1.00 -1.90 -0.61 116.94 118.65 3gzy h PHE 41 Ca 0.78 -0.18 0.06 0.00 2.81 0.00 0.00 57.97 61.43 3gzy h PHE 41 Cb 0.37 -0.23 -0.06 0.00 3.61 0.00 0.00 35.95 39.64 3gzy h PHE 41 CO 1.74 0.90 0.52 1.96 -1.61 0.00 0.00 178.31 181.82 3gzy h GLN 42 N 0.65 0.94 -0.19 1.51 1.08 -1.93 0.90 115.11 118.07 3gzy h GLN 42 Ca 0.12 -0.06 -0.16 0.00 -1.45 0.00 0.00 58.65 57.10 3gzy h GLN 42 Cb 0.57 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.79 3gzy h GLN 42 CO 0.03 0.62 -0.55 0.00 -0.95 0.00 0.00 178.83 177.98 3gzy h ALA 43 N 1.39 0.68 -0.20 3.87 0.00 -1.87 -2.11 119.26 121.02 3gzy h ALA 43 Ca 0.36 -0.51 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 3gzy h ALA 43 Cb 0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3gzy h ALA 43 CO -0.16 0.69 0.02 2.35 0.00 0.00 0.00 179.25 182.15 3gzy h TRP 44 N 0.44 0.37 -0.03 0.00 7.01 -0.87 -2.89 115.95 119.98 3gzy h TRP 44 Ca 0.01 -0.06 -0.01 0.00 2.11 0.00 0.00 58.89 60.94 3gzy h TRP 44 Cb 1.10 -0.10 -0.00 0.00 -2.10 0.00 0.00 29.16 28.06 3gzy h TRP 44 CO 0.05 0.51 -0.03 0.35 -2.79 0.00 0.00 178.44 176.53 3gzy h PHE 45 N 0.12 0.03 -0.01 2.65 3.57 -0.56 0.72 116.94 123.46 3gzy h PHE 45 Ca 0.06 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.56 3gzy h PHE 45 Cb 0.35 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.08 3gzy h PHE 45 CO 0.03 0.07 0.06 0.00 -2.23 0.00 0.00 178.31 176.23 3gzy h ALA 46 N 1.94 1.18 0.00 2.41 0.00 -1.16 -1.47 119.26 122.15 3gzy h ALA 46 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3gzy h ALA 46 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3gzy h ALA 46 CO 0.00 -0.07 0.00 1.28 0.00 0.00 0.00 179.25 180.47 3gzy n LEU 47 N -3.21 0.54 -4.68 0.00 4.77 0.24 -4.79 117.00 109.87 3gzy n LEU 47 Ca -0.03 0.56 -0.41 0.00 -0.03 0.00 0.00 56.01 56.11 3gzy n LEU 47 Cb 0.13 -0.41 -0.04 0.00 -2.33 0.00 0.00 43.42 40.78 3gzy n LEU 47 CO 0.21 -0.18 0.58 -0.76 -1.33 0.00 0.00 177.39 175.90 3gzy s LEU 48 N -4.04 4.22 0.77 2.23 1.43 -0.56 -0.30 118.68 122.44 3gzy s LEU 48 Ca 0.11 1.22 -0.11 0.00 -1.03 0.00 0.00 54.13 54.32 3gzy s LEU 48 Cb 0.14 -3.24 0.06 0.00 0.03 0.00 0.00 46.19 43.18 3gzy s LEU 48 CO 0.54 -0.33 1.11 0.00 0.23 0.00 0.00 176.35 177.89 3gzy s ALA 49 N 1.79 2.16 0.47 4.21 0.00 -0.42 -4.88 121.76 125.10 3gzy s ALA 49 Ca 0.39 0.39 0.12 0.00 0.00 0.00 0.00 51.96 52.86 3gzy s ALA 49 Cb -0.17 -3.32 1.07 0.00 0.00 0.00 0.00 23.12 20.70 3gzy s ALA 49 CO 0.15 -1.85 2.10 0.93 0.00 0.00 0.00 175.76 177.08 3gzy h GLU 50 N -1.03 0.23 -0.70 0.00 4.39 -1.96 -0.49 114.58 115.03 3gzy h GLU 50 Ca -0.44 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.24 3gzy h GLU 50 Cb 1.24 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.84 3gzy h GLU 50 CO 0.50 0.17 0.00 -0.40 -1.16 0.00 0.00 179.01 178.12 3gzy n ASP 51 N -4.49 4.35 -4.65 1.42 5.75 -1.26 -4.41 116.55 113.26 3gzy n ASP 51 Ca -0.00 -2.65 -0.45 0.00 -0.01 0.00 0.00 54.79 51.68 3gzy n ASP 51 Cb 0.09 -0.63 -0.02 0.00 -1.03 0.00 0.00 41.12 39.53 3gzy n ASP 51 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3gzy n ILE 52 N 0.46 1.36 -4.07 2.12 0.13 -0.19 -4.86 119.36 114.29 3gzy n ILE 52 Ca 0.20 -0.34 -0.32 0.00 -1.10 0.00 0.00 62.75 61.19 3gzy n ILE 52 Cb 0.92 -1.31 -0.16 0.00 -0.84 0.00 0.00 39.64 38.25 3gzy n ILE 52 CO 0.00 0.00 0.00 -2.28 2.80 0.00 0.00 176.55 177.07 3gzy s HIS 53 N -0.48 2.77 -0.26 9.51 5.65 -1.15 -3.72 115.29 127.60 3gzy s HIS 53 Ca 0.64 -1.76 -0.01 0.00 0.25 0.00 0.00 55.06 54.18 3gzy s HIS 53 Cb -0.67 -1.84 0.03 0.00 -1.18 0.00 0.00 32.58 28.92 3gzy s HIS 53 CO 0.55 -0.80 -0.05 -0.47 -0.65 0.00 0.00 174.74 173.32 3gzy s TYR 54 N 1.28 3.13 -0.00 3.88 5.04 -0.59 -0.87 117.35 129.23 3gzy s TYR 54 Ca 0.00 -1.69 0.02 0.00 -2.44 0.00 0.00 57.07 52.97 3gzy s TYR 54 Cb -0.15 -2.06 -0.01 0.00 0.35 0.00 0.00 41.96 40.09 3gzy s TYR 54 CO -0.10 -0.76 -0.05 -0.46 -1.34 0.00 0.00 175.55 172.84 3gzy s TRP 55 N 1.29 0.48 -0.28 4.97 -0.00 -0.31 -0.15 118.94 124.94 3gzy s TRP 55 Ca -0.02 -0.11 -0.02 0.00 -0.00 0.00 0.00 56.10 55.95 3gzy s TRP 55 Cb -0.18 -0.31 0.09 0.00 -0.00 0.00 0.00 33.47 33.08 3gzy s TRP 55 CO -0.04 -0.01 0.10 1.41 -0.00 0.00 0.00 176.95 178.41 3gzy s MET 56 N -0.21 0.54 0.75 5.86 -2.45 -0.28 -1.06 119.30 122.44 3gzy s MET 56 Ca 0.01 -0.80 -0.11 0.00 -1.25 0.00 0.00 55.69 53.55 3gzy s MET 56 Cb -0.02 -1.76 0.04 0.00 1.25 0.00 0.00 34.83 34.33 3gzy s MET 56 CO -0.00 -0.94 1.08 -1.25 1.05 0.00 0.00 175.02 174.96 3gzy s PRO 57 N 1.80 2.50 0.19 4.11 0.04 -1.26 0.00 135.00 142.39 3gzy s PRO 57 Ca 0.08 1.08 -0.30 0.00 0.04 0.00 0.00 61.00 61.90 3gzy s PRO 57 Cb -0.17 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.36 3gzy s PRO 57 CO -0.26 -1.45 0.95 0.42 0.04 0.00 0.00 177.00 176.71 3gzy s ILE 58 N -2.96 4.21 -0.11 0.56 1.01 -1.26 -4.64 121.20 118.01 3gzy s ILE 58 Ca 0.60 2.06 -0.00 0.00 0.00 0.00 0.00 60.65 63.31 3gzy s ILE 58 Cb -0.16 -4.31 -0.02 0.00 0.01 0.00 0.00 42.46 37.98 3gzy s ILE 58 CO 0.56 0.43 -0.10 -0.13 0.00 0.00 0.00 174.94 175.69 3gzy s ARG 59 N -0.74 3.23 0.38 2.79 0.52 -1.26 -0.31 118.95 123.56 3gzy s ARG 59 Ca 0.43 -0.63 0.06 0.00 -0.52 0.00 0.00 55.73 55.08 3gzy s ARG 59 Cb -0.25 -2.65 -0.07 0.00 0.52 0.00 0.00 34.95 32.49 3gzy s ARG 59 CO 0.31 0.34 0.02 0.95 0.02 0.00 0.00 175.30 176.94 3gzy s THR 60 N 0.03 1.81 -0.21 0.02 -4.23 0.84 -4.43 115.64 109.47 3gzy s THR 60 Ca -0.03 -2.01 -0.08 0.00 -1.18 0.00 0.00 61.69 58.39 3gzy s THR 60 Cb -0.14 -2.92 -0.04 0.00 1.34 0.00 0.00 72.50 70.74 3gzy s THR 60 CO 0.04 -0.02 0.07 -0.69 -0.54 0.00 0.00 174.62 173.49 3gzy s VAL 61 N -2.85 4.67 0.01 2.29 1.01 -1.26 -4.75 120.40 119.52 3gzy s VAL 61 Ca 0.35 -0.07 -0.00 0.00 0.00 0.00 0.00 61.98 62.26 3gzy s VAL 61 Cb 0.09 -3.14 -0.01 0.00 0.00 0.00 0.00 36.38 33.32 3gzy s VAL 61 CO 0.17 0.40 -0.01 -0.13 0.00 0.00 0.00 175.10 175.54 3gzy s ARG 62 N 0.89 0.18 0.66 2.72 1.81 -1.26 -5.04 118.95 118.90 3gzy s ARG 62 Ca 0.04 -0.31 -0.11 0.00 -1.72 0.00 0.00 55.73 53.63 3gzy s ARG 62 Cb -0.14 0.06 -0.01 0.00 -0.45 0.00 0.00 34.95 34.42 3gzy s ARG 62 CO 0.03 -0.03 1.05 0.95 -0.68 0.00 0.00 175.30 176.62 3gzy s THR 63 N -0.78 4.09 0.23 0.02 -4.23 -1.26 -4.78 115.64 108.93 3gzy s THR 63 Ca -0.09 0.65 -0.04 0.00 -1.18 0.00 0.00 61.69 61.03 3gzy s THR 63 Cb -0.05 -3.67 0.35 0.00 1.34 0.00 0.00 72.50 70.47 3gzy s THR 63 CO -0.00 -0.87 1.23 0.00 -0.54 0.00 0.00 174.62 174.43 3gzy n ALA 64 N -2.86 0.25 1.19 3.99 0.00 -1.26 -0.44 120.51 121.38 3gzy n ALA 64 Ca 0.06 0.86 0.14 0.00 0.00 0.00 0.00 53.44 54.50 3gzy n ALA 64 Cb 0.56 -0.55 0.54 0.00 0.00 0.00 0.00 19.45 20.00 3gzy n ALA 64 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 3gzy n ARG 65 N -5.23 0.30 -0.67 0.00 1.85 -1.26 -3.10 116.66 108.55 3gzy n ARG 65 Ca 0.14 -0.10 0.02 0.00 -1.00 0.00 0.00 57.85 56.92 3gzy n ARG 65 Cb 0.45 -1.50 0.21 0.00 -1.05 0.00 0.00 32.46 30.57 3gzy n ARG 65 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 3gzy n GLU 66 N -1.26 1.67 0.24 2.89 1.02 0.42 -4.71 120.64 120.90 3gzy n GLU 66 Ca 0.10 -3.26 0.07 0.00 -0.02 0.00 0.00 57.16 54.05 3gzy n GLU 66 Cb 0.31 -1.69 0.56 0.00 -0.02 0.00 0.00 31.44 30.61 3gzy n GLU 66 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 3gzy h GLN 67 N 0.99 0.00 0.00 3.49 5.75 -1.45 -1.02 115.11 122.87 3gzy h GLN 67 Ca 0.08 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.58 3gzy h GLN 67 Cb 1.23 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.78 3gzy h GLN 67 CO 0.14 0.15 0.00 0.41 -2.65 0.00 0.00 178.83 176.88 3gzy n GLY 68 N -1.02 -0.62 0.78 2.39 0.00 -1.26 -1.06 105.19 104.40 3gzy n GLY 68 Ca -0.02 -0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.05 3gzy n GLY 68 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3gzy n LEU 69 N -1.22 2.34 0.03 0.99 4.77 -0.39 -4.60 117.00 118.92 3gzy n LEU 69 Ca 0.07 -0.96 -0.11 0.00 -0.03 0.00 0.00 56.01 54.97 3gzy n LEU 69 Cb 0.08 -0.13 -0.05 0.00 -2.33 0.00 0.00 43.42 40.99 3gzy n LEU 69 CO 0.09 0.48 0.64 -0.08 -1.33 0.00 0.00 177.39 177.18 3gzy h GLU 70 N 3.17 -0.43 -6.00 3.23 4.81 -1.23 -3.41 114.58 114.72 3gzy h GLU 70 Ca 0.00 0.03 -0.57 0.00 -0.13 0.00 0.00 59.36 58.69 3gzy h GLU 70 Cb 0.69 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 30.11 3gzy h GLU 70 CO 0.00 -0.29 0.26 0.71 -0.73 0.00 0.00 179.01 178.96 3gzy s TYR 71 N -5.98 3.50 0.13 0.92 2.02 -1.26 -0.11 117.35 116.57 3gzy s TYR 71 Ca -0.15 1.28 -0.31 0.00 -0.37 0.00 0.00 57.07 57.51 3gzy s TYR 71 Cb 0.10 -2.93 -0.09 0.00 -0.40 0.00 0.00 41.96 38.63 3gzy s TYR 71 CO 0.65 -0.09 1.53 0.08 -1.57 0.00 0.00 175.55 176.15 3gzy s VAL 72 N 1.52 2.89 0.78 0.71 1.01 0.58 -4.95 120.40 122.94 3gzy s VAL 72 Ca 0.39 0.60 -0.11 0.00 0.00 0.00 0.00 61.98 62.85 3gzy s VAL 72 Cb -0.17 -3.38 0.06 0.00 0.00 0.00 0.00 36.38 32.88 3gzy s VAL 72 CO 0.16 0.04 1.09 -2.16 0.00 0.00 0.00 175.10 174.23 3gzy s PRO 73 N 1.36 2.23 0.52 2.72 0.04 -1.26 -4.59 135.00 136.03 3gzy s PRO 73 Ca 0.69 0.66 -0.21 0.00 0.04 0.00 0.00 61.00 62.18 3gzy s PRO 73 Cb -0.41 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 32.12 3gzy s PRO 73 CO 0.31 -1.52 0.89 0.00 0.04 0.00 0.00 177.00 176.72 3gzy n ALA 74 N -3.37 -0.10 -0.88 8.56 0.00 -1.26 -2.44 120.51 121.02 3gzy n ALA 74 Ca 0.07 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.61 3gzy n ALA 74 Cb 0.56 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 17.97 3gzy n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gzy n GLY 75 N 1.35 0.74 0.24 0.00 0.00 -1.26 -5.02 105.19 101.24 3gzy n GLY 75 Ca 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.11 3gzy n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gzy n ALA 76 N 0.63 0.04 -0.87 4.61 0.00 -1.02 -5.13 120.51 118.76 3gzy n ALA 76 Ca 0.00 -0.15 -0.32 0.00 0.00 0.00 0.00 53.44 52.97 3gzy n ALA 76 Cb 0.00 0.09 0.15 0.00 0.00 0.00 0.00 19.45 19.69 3gzy n ALA 76 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3gzy s ASN 77 N -1.18 3.23 0.16 0.00 2.47 -1.26 -4.99 114.94 113.37 3gzy s ASN 77 Ca 0.01 2.24 -0.25 0.00 0.42 0.00 0.00 52.86 55.29 3gzy s ASN 77 Cb 0.00 -2.57 0.06 0.00 -1.45 0.00 0.00 41.25 37.29 3gzy s ASN 77 CO 0.01 -2.90 0.90 0.00 -3.72 0.00 0.00 177.10 171.39 3gzy s ALA 78 N -2.47 -1.59 -0.03 1.71 0.00 -1.26 -4.56 121.76 113.55 3gzy s ALA 78 Ca 0.69 0.14 -0.14 0.00 0.00 0.00 0.00 51.96 52.64 3gzy s ALA 78 Cb -0.25 0.66 -0.32 0.00 0.00 0.00 0.00 23.12 23.22 3gzy s ALA 78 CO 0.55 -1.00 0.78 0.45 0.00 0.00 0.00 175.76 176.54 3gzy h HIS 79 N 2.00 0.78 -3.98 0.00 3.86 -0.68 -3.46 115.15 113.67 3gzy h HIS 79 Ca -0.23 -0.57 -0.36 0.00 -1.16 0.00 0.00 60.37 58.05 3gzy h HIS 79 Cb 1.24 -0.03 -0.24 0.00 1.06 0.00 0.00 27.41 29.44 3gzy h HIS 79 CO 0.38 1.61 -0.76 -0.06 0.86 0.00 0.00 177.93 179.95 3gzy s PHE 80 N -2.57 0.87 -0.40 2.45 0.40 -1.09 -4.94 117.98 112.70 3gzy s PHE 80 Ca -0.14 -0.36 0.05 0.00 -0.60 0.00 0.00 56.93 55.88 3gzy s PHE 80 Cb 0.05 -0.52 0.18 0.00 0.51 0.00 0.00 43.02 43.24 3gzy s PHE 80 CO 0.88 -0.02 0.72 0.34 0.70 0.00 0.00 175.22 177.84 3gzy s ASP 81 N -1.13 -1.30 0.08 1.36 3.68 -1.21 -1.13 116.67 117.02 3gzy s ASP 81 Ca -0.03 -0.73 0.05 0.00 2.13 0.00 0.00 52.55 53.97 3gzy s ASP 81 Cb -0.08 1.67 -0.03 0.00 -1.45 0.00 0.00 42.92 43.03 3gzy s ASP 81 CO 0.01 -0.14 -0.14 -1.81 0.13 0.00 0.00 175.17 173.22 3gzy s ASP 82 N 1.79 1.68 0.54 -0.34 1.01 0.79 -5.00 116.67 117.15 3gzy s ASP 82 Ca 0.17 -0.65 0.06 0.00 0.71 0.00 0.00 52.55 52.83 3gzy s ASP 82 Cb -0.02 -0.05 0.04 0.00 1.01 0.00 0.00 42.92 43.90 3gzy s ASP 82 CO -0.08 -0.10 0.43 0.42 0.21 0.00 0.00 175.17 176.05 3gzy s THR 83 N -1.46 1.71 0.18 -1.27 -4.23 -1.26 -1.54 115.64 107.76 3gzy s THR 83 Ca -0.00 -1.46 -0.13 0.00 -1.18 0.00 0.00 61.69 58.92 3gzy s THR 83 Cb -0.09 -2.16 0.08 0.00 1.34 0.00 0.00 72.50 71.66 3gzy s THR 83 CO 0.02 0.00 1.83 -0.74 -0.54 0.00 0.00 174.62 175.20 3gzy h HIS 84 N 0.72 0.66 -0.34 3.99 2.76 -1.77 0.54 115.15 121.71 3gzy h HIS 84 Ca -0.36 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 57.83 3gzy h HIS 84 Cb 1.30 -0.22 -0.02 0.00 1.55 0.00 0.00 27.41 30.02 3gzy h HIS 84 CO 0.93 0.40 0.21 0.00 -1.30 0.00 0.00 177.93 178.17 3gzy h ALA 85 N 1.22 0.43 -0.09 5.26 0.00 -1.94 -1.13 119.26 123.00 3gzy h ALA 85 Ca 0.21 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.94 3gzy h ALA 85 Cb -0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3gzy h ALA 85 CO -0.06 -0.14 -0.68 1.79 0.00 0.00 0.00 179.25 180.16 3gzy h THR 86 N 0.42 1.38 -0.33 0.00 1.35 -1.90 -2.76 112.91 111.07 3gzy h THR 86 Ca 0.13 -2.07 -0.06 0.00 -0.55 0.00 0.00 66.41 63.86 3gzy h THR 86 Cb -0.02 2.05 -0.02 0.00 -1.73 0.00 0.00 68.15 68.44 3gzy h THR 86 CO -0.05 0.62 -0.07 0.24 -0.25 0.00 0.00 175.52 176.01 3gzy h MET 87 N 0.26 0.55 -0.54 4.72 2.86 -0.80 -1.27 114.93 120.70 3gzy h MET 87 Ca -0.02 -0.14 0.04 0.00 -2.06 0.00 0.00 59.70 57.52 3gzy h MET 87 Cb 1.23 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 32.78 3gzy h MET 87 CO 0.11 0.62 0.30 -0.92 1.06 0.00 0.00 176.91 178.09 3gzy h TYR 88 N 0.51 0.56 -0.69 -0.22 3.20 -0.96 -0.80 116.97 118.56 3gzy h TYR 88 Ca 0.10 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 3gzy h TYR 88 Cb 0.43 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 3gzy h TYR 88 CO 0.02 0.29 0.38 0.78 -1.64 0.00 0.00 178.16 177.99 3gzy h GLY 89 N 0.59 1.03 0.94 1.82 0.00 -1.16 0.27 103.07 106.56 3gzy h GLY 89 Ca 0.23 -0.46 0.02 0.00 0.00 0.00 0.00 47.33 47.12 3gzy h GLY 89 CO -0.13 0.45 0.63 3.21 0.00 0.00 0.00 176.54 180.69 3gzy h ARG 90 N 0.95 1.21 -0.37 4.80 3.08 -0.63 -0.65 114.38 122.77 3gzy h ARG 90 Ca 0.24 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 60.14 3gzy h ARG 90 Cb 0.03 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 29.80 3gzy h ARG 90 CO -0.04 0.80 -0.09 0.82 -1.07 0.00 0.00 179.97 180.39 3gzy h ILE 91 N 1.25 1.28 -0.88 2.04 1.08 -0.70 0.36 117.51 121.94 3gzy h ILE 91 Ca 0.36 -1.16 0.10 0.00 -0.39 0.00 0.00 64.86 63.78 3gzy h ILE 91 Cb -0.07 1.26 -0.08 0.00 -3.07 0.00 0.00 36.82 34.86 3gzy h ILE 91 CO -0.10 0.38 0.52 0.03 -0.69 0.00 0.00 178.15 178.29 3gzy h ARG 92 N 0.51 0.83 -0.54 2.37 3.08 -0.15 -1.39 114.38 119.10 3gzy h ARG 92 Ca 0.09 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.04 3gzy h ARG 92 Cb 0.60 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 3gzy h ARG 92 CO 0.04 0.55 0.12 0.37 -1.07 0.00 0.00 179.97 179.97 3gzy h GLN 93 N 0.85 0.87 0.00 0.04 4.15 -0.71 -2.41 115.11 117.90 3gzy h GLN 93 Ca 0.43 -0.22 -0.04 0.00 0.77 0.00 0.00 58.65 59.60 3gzy h GLN 93 Cb 0.40 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.97 3gzy h GLN 93 CO -0.25 0.83 -0.17 0.87 -1.93 0.00 0.00 178.83 178.17 3gzy h LYS 94 N 0.76 0.00 -0.42 1.69 1.79 -0.22 -2.92 116.57 117.26 3gzy h LYS 94 Ca 0.17 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.64 3gzy h LYS 94 Cb 0.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 3gzy h LYS 94 CO 0.00 0.17 0.00 0.25 -1.08 0.00 0.00 179.45 178.79 3gzy n THR 95 N -3.64 0.75 0.22 -0.16 -2.24 -0.59 -4.58 114.28 104.04 3gzy n THR 95 Ca -0.01 -0.87 0.11 0.00 -2.27 0.00 0.00 64.05 61.01 3gzy n THR 95 Cb 0.30 0.72 0.22 0.00 -2.10 0.00 0.00 70.33 69.46 3gzy n THR 95 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3gzy h SER 96 N 3.28 0.00 -1.40 3.42 4.64 -1.23 -3.48 113.55 118.78 3gzy h SER 96 Ca 0.00 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.94 3gzy h SER 96 Cb 0.83 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.81 3gzy h SER 96 CO 0.00 0.07 -0.38 0.47 -0.87 0.00 0.00 176.83 176.11 3gzy n ASP 97 N -3.12 -5.28 0.00 4.97 8.00 -1.26 -4.86 116.55 115.00 3gzy n ASP 97 Ca 0.03 0.32 0.00 0.00 0.71 0.00 0.00 54.79 55.85 3gzy n ASP 97 Cb 0.53 -4.39 0.00 0.00 -0.02 0.00 0.00 41.12 37.23 3gzy n ASP 97 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3gzy n LEU 98 N -2.28 1.13 -4.54 0.64 4.77 -1.26 -4.95 117.00 110.51 3gzy n LEU 98 Ca -0.20 -1.13 -0.42 0.00 -0.03 0.00 0.00 56.01 54.23 3gzy n LEU 98 Cb 0.63 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.69 3gzy n LEU 98 CO 0.28 0.28 1.45 0.21 -1.33 0.00 0.00 177.39 178.28 3gzy s ASN 99 N -0.40 6.56 0.38 -1.43 3.04 -1.26 -4.87 114.94 116.95 3gzy s ASN 99 Ca 0.00 -1.65 0.06 0.00 0.04 0.00 0.00 52.86 51.31 3gzy s ASN 99 Cb 0.00 -2.54 0.77 0.00 -1.54 0.00 0.00 41.25 37.94 3gzy s ASN 99 CO 0.00 -1.40 2.01 -0.50 -3.04 0.00 0.00 177.10 174.17 3gzy h TRP 100 N 9.42 0.66 0.00 0.43 -0.00 -1.92 0.15 115.95 124.68 3gzy h TRP 100 Ca 0.22 0.02 -0.00 0.00 -0.00 0.00 0.00 58.89 59.12 3gzy h TRP 100 Cb 1.00 -0.22 -0.00 0.00 -0.00 0.00 0.00 29.16 29.93 3gzy h TRP 100 CO 1.27 0.39 -0.01 0.00 -0.00 0.00 0.00 178.44 180.09 3gzy h ALA 101 N 1.66 1.04 -0.11 1.49 0.00 -1.93 -2.33 119.26 119.08 3gzy h ALA 101 Ca 0.23 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 3gzy h ALA 101 Cb 0.06 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3gzy h ALA 101 CO -0.06 0.02 -0.25 0.39 0.00 0.00 0.00 179.25 179.35 3gzy n GLU 102 N -3.16 1.69 -3.58 0.00 -0.58 0.40 -4.80 120.64 110.62 3gzy n GLU 102 Ca -0.02 -3.09 -0.29 0.00 -0.42 0.00 0.00 57.16 53.34 3gzy n GLU 102 Cb 0.17 -1.66 -0.14 0.00 -0.57 0.00 0.00 31.44 29.23 3gzy n GLU 102 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3gzy s ASP 103 N -2.88 3.51 0.64 1.62 2.15 -0.52 -2.07 116.67 119.11 3gzy s ASP 103 Ca 0.39 -1.73 -0.15 0.00 0.43 0.00 0.00 52.55 51.49 3gzy s ASP 103 Cb 0.36 -0.54 -0.01 0.00 -0.30 0.00 0.00 42.92 42.43 3gzy s ASP 103 CO -0.02 -0.38 1.10 -2.84 -0.17 0.00 0.00 175.17 172.86 3gzy s PRO 104 N 1.56 2.96 0.52 4.34 0.02 -1.26 -4.77 135.00 138.37 3gzy s PRO 104 Ca 0.12 1.36 -0.21 0.00 0.02 0.00 0.00 61.00 62.30 3gzy s PRO 104 Cb -0.19 -1.97 -0.06 0.00 0.02 0.00 0.00 34.50 32.30 3gzy s PRO 104 CO -0.21 -1.12 1.15 -2.14 -0.33 0.00 0.00 177.00 174.35 3gzy s PRO 105 N -4.03 3.45 0.54 5.54 0.02 -0.88 -4.87 135.00 134.77 3gzy s PRO 105 Ca 0.67 1.69 -0.20 0.00 0.02 0.00 0.00 61.00 63.18 3gzy s PRO 105 Cb -0.20 -2.13 -0.06 0.00 0.02 0.00 0.00 34.50 32.14 3gzy s PRO 105 CO 0.39 -0.79 1.14 -1.12 -0.33 0.00 0.00 177.00 176.30 3gzy s SER 106 N -1.62 5.72 -0.41 2.53 0.01 -1.26 -4.74 113.70 113.93 3gzy s SER 106 Ca 0.70 2.20 -0.18 0.00 1.31 0.00 0.00 55.95 59.98 3gzy s SER 106 Cb -0.26 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.40 3gzy s SER 106 CO 0.30 -1.22 0.50 -0.13 0.41 0.00 0.00 173.24 173.10 3gzy s ARG 107 N -3.24 3.27 0.20 12.44 0.52 0.72 -4.96 118.95 127.89 3gzy s ARG 107 Ca 0.72 -0.53 0.10 0.00 -0.52 0.00 0.00 55.73 55.51 3gzy s ARG 107 Cb -0.25 -3.92 -0.04 0.00 0.52 0.00 0.00 34.95 31.25 3gzy s ARG 107 CO 0.28 -0.83 -0.16 0.95 0.02 0.00 0.00 175.30 175.55 3gzy s THR 108 N 2.35 2.77 -0.08 0.02 -4.23 -1.26 0.01 115.64 115.23 3gzy s THR 108 Ca 0.16 -1.93 -0.01 0.00 -1.18 0.00 0.00 61.69 58.74 3gzy s THR 108 Cb -0.16 -2.37 0.03 0.00 1.34 0.00 0.00 72.50 71.33 3gzy s THR 108 CO 0.15 -0.17 -0.03 -0.60 -0.54 0.00 0.00 174.62 173.43 3gzy s ARG 109 N -2.90 0.89 -0.52 3.99 6.06 -0.05 -4.71 118.95 121.70 3gzy s ARG 109 Ca 0.24 -0.03 -0.13 0.00 -2.50 0.00 0.00 55.73 53.31 3gzy s ARG 109 Cb -0.08 -1.10 0.13 0.00 0.06 0.00 0.00 34.95 33.96 3gzy s ARG 109 CO 0.13 -0.25 0.44 -1.01 -2.50 0.00 0.00 175.30 172.12 3gzy s HIS 110 N 1.69 3.34 -0.04 5.12 3.76 -1.26 -1.25 115.29 126.66 3gzy s HIS 110 Ca 0.02 -1.56 -0.26 0.00 -0.15 0.00 0.00 55.06 53.10 3gzy s HIS 110 Cb -0.13 -3.68 -0.03 0.00 1.11 0.00 0.00 32.58 29.85 3gzy s HIS 110 CO -0.05 -1.01 0.83 -0.51 -0.85 0.00 0.00 174.74 173.15 3gzy s LEU 111 N 1.45 4.34 -0.27 0.89 1.02 0.42 -4.92 118.68 121.62 3gzy s LEU 111 Ca 0.05 1.41 -0.07 0.00 0.02 0.00 0.00 54.13 55.53 3gzy s LEU 111 Cb -0.28 -3.31 -0.01 0.00 0.02 0.00 0.00 46.19 42.61 3gzy s LEU 111 CO 0.01 -0.18 0.07 -0.69 0.02 0.00 0.00 176.35 175.58 3gzy s VAL 112 N 0.91 4.18 0.35 -1.59 1.01 -1.26 -2.26 120.40 121.72 3gzy s VAL 112 Ca 0.44 -0.37 -0.01 0.00 0.00 0.00 0.00 61.98 62.04 3gzy s VAL 112 Cb -0.19 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.16 3gzy s VAL 112 CO 0.23 0.25 0.46 -0.94 0.00 0.00 0.00 175.10 175.09 3gzy s SER 113 N 1.57 1.02 -1.36 3.32 1.04 -0.49 -4.93 113.70 113.86 3gzy s SER 113 Ca 0.05 -1.52 -0.07 0.00 0.48 0.00 0.00 55.95 54.89 3gzy s SER 113 Cb -0.16 0.66 0.03 0.00 0.10 0.00 0.00 66.02 66.65 3gzy s SER 113 CO 0.03 -1.28 1.01 0.59 0.98 0.00 0.00 173.24 174.56 3gzy n ASN 114 N -1.45 -4.12 -4.64 7.02 4.13 -1.26 0.39 115.26 115.32 3gzy n ASN 114 Ca 0.02 -0.67 -0.43 0.00 1.68 0.00 0.00 54.58 55.18 3gzy n ASN 114 Cb 0.62 -4.58 -0.02 0.00 -1.54 0.00 0.00 39.78 34.25 3gzy n ASN 114 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3gzy s VAL 115 N -3.39 4.27 -0.15 2.41 1.01 -1.26 -4.06 120.40 119.23 3gzy s VAL 115 Ca 0.38 1.48 0.01 0.00 0.00 0.00 0.00 61.98 63.85 3gzy s VAL 115 Cb -0.18 -4.18 0.01 0.00 0.00 0.00 0.00 36.38 32.03 3gzy s VAL 115 CO 0.77 -0.38 -0.19 -0.63 0.00 0.00 0.00 175.10 174.67 3gzy s ILE 116 N 3.97 2.32 -0.06 2.22 1.01 0.46 -5.00 121.20 126.12 3gzy s ILE 116 Ca 0.53 -0.88 -0.00 0.00 0.00 0.00 0.00 60.65 60.30 3gzy s ILE 116 Cb -0.17 -1.96 -0.03 0.00 0.01 0.00 0.00 42.46 40.31 3gzy s ILE 116 CO 0.19 0.53 -0.03 -0.69 0.00 0.00 0.00 174.94 174.94 3gzy s VAL 117 N 0.89 4.01 -0.07 2.92 1.01 -1.26 -0.95 120.40 126.95 3gzy s VAL 117 Ca -0.05 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.54 3gzy s VAL 117 Cb -0.15 -2.68 0.02 0.00 0.00 0.00 0.00 36.38 33.57 3gzy s VAL 117 CO -0.03 0.57 -0.08 -0.60 0.00 0.00 0.00 175.10 174.96 3gzy s ARG 118 N -0.95 1.34 -0.00 2.72 3.52 0.15 -4.58 118.95 121.15 3gzy s ARG 118 Ca 0.14 -0.26 -0.30 0.00 -0.13 0.00 0.00 55.73 55.18 3gzy s ARG 118 Cb -0.11 -1.24 -0.03 0.00 -1.56 0.00 0.00 34.95 32.00 3gzy s ARG 118 CO 0.03 -0.08 1.00 -1.21 -0.81 0.00 0.00 175.30 174.23 3gzy s GLU 119 N 1.01 4.54 0.72 5.12 2.02 -1.26 -0.76 118.70 130.09 3gzy s GLU 119 Ca -0.09 1.44 -0.04 0.00 0.02 0.00 0.00 54.97 56.30 3gzy s GLU 119 Cb -0.15 -3.46 0.10 0.00 0.10 0.00 0.00 34.13 30.73 3gzy s GLU 119 CO -0.00 -0.08 1.00 -1.64 0.02 0.00 0.00 175.26 174.56 3gzy s MET 120 N 1.08 1.82 0.00 1.61 -1.94 -0.47 -4.92 119.30 116.47 3gzy s MET 120 Ca 0.52 -0.75 0.23 0.00 -1.71 0.00 0.00 55.69 53.98 3gzy s MET 120 Cb -0.21 -2.25 1.15 0.00 2.01 0.00 0.00 34.83 35.52 3gzy s MET 120 CO 0.27 -1.40 1.74 -0.25 -0.01 0.00 0.00 175.02 175.38 3gzy n ASP 121 N -2.89 0.00 -4.69 3.03 9.92 -1.26 -4.60 116.55 116.06 3gzy n ASP 121 Ca 0.12 -0.06 -0.35 0.00 -0.53 0.00 0.00 54.79 53.97 3gzy n ASP 121 Cb 0.60 -0.28 -0.09 0.00 -0.64 0.00 0.00 41.12 40.72 3gzy n ASP 121 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 3gzy s THR 122 N -2.55 5.25 0.54 -3.53 2.01 -1.26 -5.07 115.64 111.03 3gzy s THR 122 Ca 0.22 0.14 -0.21 0.00 0.31 0.00 0.00 61.69 62.14 3gzy s THR 122 Cb 0.15 -3.41 -0.05 0.00 0.01 0.00 0.00 72.50 69.20 3gzy s THR 122 CO 0.34 0.42 1.31 -2.84 -0.69 0.00 0.00 174.62 173.15 3gzy s PRO 123 N 0.58 3.20 0.00 4.92 0.02 -1.26 -1.58 135.00 140.88 3gzy s PRO 123 Ca 0.07 2.10 0.00 0.00 0.02 0.00 0.00 61.00 63.19 3gzy s PRO 123 Cb -0.12 -2.23 0.00 0.00 0.02 0.00 0.00 34.50 32.17 3gzy s PRO 123 CO 0.00 -1.10 0.00 0.41 -0.33 0.00 0.00 177.00 175.98 3gzy n GLY 124 N 0.67 0.90 3.30 0.52 0.00 -1.26 -4.96 105.19 104.36 3gzy n GLY 124 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 3gzy n GLY 124 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gzy s THR 125 N -3.65 2.34 0.09 2.61 2.01 -0.62 -0.69 115.64 117.73 3gzy s THR 125 Ca 0.00 -0.96 0.08 0.00 0.31 0.00 0.00 61.69 61.13 3gzy s THR 125 Cb 0.00 -1.88 -0.03 0.00 0.01 0.00 0.00 72.50 70.59 3gzy s THR 125 CO 0.00 0.56 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.51 3gzy s LEU 126 N -0.09 2.26 -0.17 4.42 1.43 -0.04 -1.37 118.68 125.12 3gzy s LEU 126 Ca -0.05 -0.65 -0.03 0.00 -1.03 0.00 0.00 54.13 52.37 3gzy s LEU 126 Cb -0.14 -0.98 -0.02 0.00 0.03 0.00 0.00 46.19 45.07 3gzy s LEU 126 CO 0.04 0.11 -0.04 -0.70 0.23 0.00 0.00 176.35 175.99 3gzy s GLU 127 N -1.70 3.57 -0.05 1.70 2.12 0.06 -1.11 118.70 123.29 3gzy s GLU 127 Ca 0.08 -0.56 0.02 0.00 0.36 0.00 0.00 54.97 54.87 3gzy s GLU 127 Cb -0.10 -2.92 0.01 0.00 0.26 0.00 0.00 34.13 31.38 3gzy s GLU 127 CO 0.04 0.11 -0.11 0.08 -0.54 0.00 0.00 175.26 174.84 3gzy s VAL 128 N 0.69 0.99 0.04 3.70 1.01 0.57 0.32 120.40 127.72 3gzy s VAL 128 Ca -0.02 -0.42 0.03 0.00 0.00 0.00 0.00 61.98 61.56 3gzy s VAL 128 Cb -0.15 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 3gzy s VAL 128 CO 0.02 0.31 -0.02 0.00 0.00 0.00 0.00 175.10 175.42 3gzy s ALA 129 N 0.49 3.23 0.15 5.51 0.00 -0.13 -0.40 121.76 130.61 3gzy s ALA 129 Ca -0.10 -1.03 -0.14 0.00 0.00 0.00 0.00 51.96 50.69 3gzy s ALA 129 Cb -0.13 -1.23 0.02 0.00 0.00 0.00 0.00 23.12 21.77 3gzy s ALA 129 CO 0.02 0.66 0.38 -1.54 0.00 0.00 0.00 175.76 175.28 3gzy s SER 130 N -1.83 -0.13 0.07 0.00 1.04 -0.41 -0.40 113.70 112.04 3gzy s SER 130 Ca 0.21 -0.53 0.01 0.00 0.48 0.00 0.00 55.95 56.12 3gzy s SER 130 Cb -0.11 0.48 -0.04 0.00 0.10 0.00 0.00 66.02 66.44 3gzy s SER 130 CO 0.13 -0.90 0.18 0.00 0.98 0.00 0.00 173.24 173.63 3gzy s ALA 131 N -3.87 3.91 0.08 5.32 0.00 0.16 -1.06 121.76 126.31 3gzy s ALA 131 Ca 0.08 -0.88 0.02 0.00 0.00 0.00 0.00 51.96 51.18 3gzy s ALA 131 Cb 0.02 -1.74 -0.03 0.00 0.00 0.00 0.00 23.12 21.36 3gzy s ALA 131 CO -0.07 0.80 -0.08 -0.59 0.00 0.00 0.00 175.76 175.83 3gzy s PHE 132 N -1.49 0.86 -0.19 0.00 -0.12 -0.22 -1.40 117.98 115.41 3gzy s PHE 132 Ca 0.34 -0.70 0.00 0.00 -0.05 0.00 0.00 56.93 56.52 3gzy s PHE 132 Cb -0.13 -0.49 0.04 0.00 -0.63 0.00 0.00 43.02 41.81 3gzy s PHE 132 CO 0.27 -0.09 -0.09 -1.17 -0.05 0.00 0.00 175.22 174.09 3gzy s LEU 133 N -2.37 2.12 -0.33 -1.99 1.98 -0.96 -2.14 118.68 114.99 3gzy s LEU 133 Ca 0.02 -0.84 -0.08 0.00 -2.89 0.00 0.00 54.13 50.34 3gzy s LEU 133 Cb -0.02 -1.15 0.02 0.00 0.66 0.00 0.00 46.19 45.70 3gzy s LEU 133 CO -0.02 -0.16 0.14 -0.22 -1.89 0.00 0.00 176.35 174.20 3gzy s LEU 134 N 1.46 4.28 -0.17 -0.68 0.20 0.88 -0.44 118.68 124.21 3gzy s LEU 134 Ca -0.01 -0.90 -0.15 0.00 0.69 0.00 0.00 54.13 53.77 3gzy s LEU 134 Cb -0.16 -1.94 -0.04 0.00 -0.43 0.00 0.00 46.19 43.62 3gzy s LEU 134 CO -0.08 -0.29 0.33 -0.47 -0.29 0.00 0.00 176.35 175.55 3gzy s TYR 135 N 1.50 3.43 -0.06 5.38 5.04 -0.38 -0.96 117.35 131.31 3gzy s TYR 135 Ca 0.01 0.61 0.02 0.00 -2.44 0.00 0.00 57.07 55.27 3gzy s TYR 135 Cb -0.18 -2.41 0.02 0.00 0.35 0.00 0.00 41.96 39.73 3gzy s TYR 135 CO 0.04 0.15 -0.09 0.50 -1.34 0.00 0.00 175.55 174.81 3gzy s ARG 136 N 0.75 1.36 0.06 4.97 3.00 0.00 -0.88 118.95 128.21 3gzy s ARG 136 Ca 0.18 -0.29 0.04 0.00 -1.00 0.00 0.00 55.73 54.65 3gzy s ARG 136 Cb -0.14 -1.19 -0.03 0.00 0.00 0.00 0.00 34.95 33.59 3gzy s ARG 136 CO 0.06 -0.03 -0.11 -1.54 0.00 0.00 0.00 175.30 173.68 3gzy s SER 137 N 0.80 1.27 0.16 -2.12 1.04 0.10 0.03 113.70 114.98 3gzy s SER 137 Ca -0.12 -0.61 -0.16 0.00 0.48 0.00 0.00 55.95 55.53 3gzy s SER 137 Cb -0.15 -0.00 0.03 0.00 0.10 0.00 0.00 66.02 66.00 3gzy s SER 137 CO 0.02 -0.16 0.44 0.00 0.98 0.00 0.00 173.24 174.52 3gzy s ARG 138 N -1.80 1.20 2.84 4.02 1.70 -0.52 -0.20 118.95 126.18 3gzy s ARG 138 Ca -0.05 -0.80 0.00 0.00 -0.47 0.00 0.00 55.73 54.41 3gzy s ARG 138 Cb -0.09 0.48 0.00 0.00 -0.57 0.00 0.00 34.95 34.77 3gzy s ARG 138 CO 0.01 -0.49 0.00 1.28 -1.08 0.00 0.00 175.30 175.02 3gzy n LEU 139 N -0.27 0.00 -0.06 -1.89 4.77 -1.26 -2.33 117.00 115.95 3gzy n LEU 139 Ca -0.13 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.72 3gzy n LEU 139 Cb 0.63 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.60 3gzy n LEU 139 CO 0.18 0.00 0.37 -0.33 -1.33 0.00 0.00 177.39 176.28 3gzy h GLU 140 N 0.00 -0.00 0.00 3.23 5.08 -2.03 -3.43 114.58 117.43 3gzy h GLU 140 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3gzy h GLU 140 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3gzy h GLU 140 CO 0.00 0.89 0.00 0.54 -1.00 0.00 0.00 179.01 179.44 3gzy n ARG 141 N -4.64 0.39 -2.26 2.33 5.12 -1.23 -5.08 116.66 111.29 3gzy n ARG 141 Ca -0.09 -0.11 -0.41 0.00 -1.93 0.00 0.00 57.85 55.30 3gzy n ARG 141 Cb 0.43 -0.51 -0.03 0.00 -1.16 0.00 0.00 32.46 31.19 3gzy n ARG 141 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 3gzy s GLN 142 N -0.09 4.40 -0.02 5.56 0.74 -0.98 -4.93 119.66 124.34 3gzy s GLN 142 Ca 0.00 1.99 -0.00 0.00 0.05 0.00 0.00 55.36 57.40 3gzy s GLN 142 Cb 0.00 -3.23 0.03 0.00 1.10 0.00 0.00 33.01 30.91 3gzy s GLN 142 CO 0.00 -0.25 0.04 0.08 -0.55 0.00 0.00 175.29 174.60 3gzy s VAL 143 N 0.34 -0.06 -0.03 1.34 1.01 -1.26 -1.44 120.40 120.30 3gzy s VAL 143 Ca 0.57 0.21 0.04 0.00 0.00 0.00 0.00 61.98 62.80 3gzy s VAL 143 Cb -0.35 -0.09 -0.00 0.00 0.00 0.00 0.00 36.38 35.94 3gzy s VAL 143 CO 0.36 0.08 -0.15 -1.81 0.00 0.00 0.00 175.10 173.58 3gzy s ASP 144 N 1.03 1.85 -0.11 3.32 1.01 0.10 -5.01 116.67 118.86 3gzy s ASP 144 Ca -0.09 -0.29 0.02 0.00 0.71 0.00 0.00 52.55 52.90 3gzy s ASP 144 Cb -0.12 -0.42 -0.01 0.00 1.01 0.00 0.00 42.92 43.38 3gzy s ASP 144 CO -0.03 0.14 -0.19 -0.69 0.21 0.00 0.00 175.17 174.61 3gzy s VAL 145 N -0.04 2.49 -0.05 -1.27 1.01 -1.26 -0.82 120.40 120.46 3gzy s VAL 145 Ca -0.01 -0.87 0.06 0.00 0.00 0.00 0.00 61.98 61.17 3gzy s VAL 145 Cb -0.09 -2.00 -0.01 0.00 0.00 0.00 0.00 36.38 34.28 3gzy s VAL 145 CO 0.01 0.55 -0.24 -0.36 0.00 0.00 0.00 175.10 175.05 3gzy s PHE 146 N 0.32 2.31 0.15 5.22 0.40 -0.13 -5.00 117.98 121.25 3gzy s PHE 146 Ca -0.15 -0.63 0.05 0.00 -0.60 0.00 0.00 56.93 55.61 3gzy s PHE 146 Cb -0.17 -1.51 -0.04 0.00 0.51 0.00 0.00 43.02 41.80 3gzy s PHE 146 CO 0.07 -0.17 -0.12 0.00 0.70 0.00 0.00 175.22 175.70 3gzy s ALA 147 N -0.25 1.55 0.00 5.36 0.00 -1.26 -0.09 121.76 127.08 3gzy s ALA 147 Ca -0.00 -1.45 0.00 0.00 0.00 0.00 0.00 51.96 50.51 3gzy s ALA 147 Cb -0.13 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 22.98 3gzy s ALA 147 CO 0.02 -0.00 0.00 0.41 0.00 0.00 0.00 175.76 176.19 3gzy n GLY 148 N 0.03 -0.53 3.08 0.00 0.00 -0.91 -1.17 105.19 105.69 3gzy n GLY 148 Ca -0.12 -0.85 -0.19 0.00 0.00 0.00 0.00 46.02 44.86 3gzy n GLY 148 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3gzy s GLU 149 N -1.11 0.83 -0.09 1.61 2.12 0.01 -1.06 118.70 121.00 3gzy s GLU 149 Ca 0.00 -0.54 0.01 0.00 0.36 0.00 0.00 54.97 54.80 3gzy s GLU 149 Cb 0.00 -0.80 -0.02 0.00 0.26 0.00 0.00 34.13 33.57 3gzy s GLU 149 CO 0.00 0.21 -0.13 1.03 -0.54 0.00 0.00 175.26 175.82 3gzy s ARG 150 N -0.69 2.99 -0.25 4.30 0.52 -0.22 0.04 118.95 125.64 3gzy s ARG 150 Ca 0.02 -0.69 -0.00 0.00 -0.52 0.00 0.00 55.73 54.54 3gzy s ARG 150 Cb -0.06 -2.52 0.03 0.00 0.52 0.00 0.00 34.95 32.92 3gzy s ARG 150 CO 0.00 0.40 -0.09 1.03 0.02 0.00 0.00 175.30 176.67 3gzy s ARG 151 N -0.15 2.70 0.17 3.54 0.52 0.11 -1.28 118.95 124.56 3gzy s ARG 151 Ca -0.01 -1.06 0.08 0.00 -0.52 0.00 0.00 55.73 54.22 3gzy s ARG 151 Cb -0.13 -2.92 -0.04 0.00 0.52 0.00 0.00 34.95 32.37 3gzy s ARG 151 CO 0.03 -0.43 -0.03 -0.51 0.02 0.00 0.00 175.30 174.38 3gzy s ASP 152 N 1.27 4.60 -0.25 0.23 -0.00 0.47 -1.14 116.67 121.85 3gzy s ASP 152 Ca -0.02 -0.45 -0.06 0.00 -0.00 0.00 0.00 52.55 52.02 3gzy s ASP 152 Cb -0.17 -0.92 -0.02 0.00 -0.00 0.00 0.00 42.92 41.81 3gzy s ASP 152 CO -0.06 0.10 0.04 -0.69 -0.00 0.00 0.00 175.17 174.57 3gzy s VAL 153 N -1.69 4.04 -0.00 -1.27 1.01 -0.33 -0.31 120.40 121.85 3gzy s VAL 153 Ca 0.26 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.96 3gzy s VAL 153 Cb -0.09 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.36 3gzy s VAL 153 CO 0.17 0.34 0.01 -0.76 0.00 0.00 0.00 175.10 174.86 3gzy s LEU 154 N 1.57 3.54 -0.05 3.92 1.43 -0.27 -0.06 118.68 128.76 3gzy s LEU 154 Ca 0.06 0.00 0.05 0.00 -1.03 0.00 0.00 54.13 53.22 3gzy s LEU 154 Cb -0.15 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.03 3gzy s LEU 154 CO 0.02 0.28 -0.23 -0.60 0.23 0.00 0.00 176.35 176.05 3gzy s ARG 155 N -1.56 2.32 0.49 1.70 3.52 -0.20 -0.86 118.95 124.36 3gzy s ARG 155 Ca 0.20 -0.81 -0.23 0.00 -0.13 0.00 0.00 55.73 54.75 3gzy s ARG 155 Cb -0.12 -1.97 -0.06 0.00 -1.56 0.00 0.00 34.95 31.24 3gzy s ARG 155 CO 0.10 0.33 1.34 0.96 -0.81 0.00 0.00 175.30 177.22 3gzy s ILE 156 N -0.09 2.30 0.03 4.11 -4.36 0.14 -0.88 121.20 122.45 3gzy s ILE 156 Ca -0.04 0.24 -0.16 0.00 -0.26 0.00 0.00 60.65 60.43 3gzy s ILE 156 Cb -0.13 -3.13 0.03 0.00 1.25 0.00 0.00 42.46 40.48 3gzy s ILE 156 CO 0.03 0.01 0.36 0.00 0.24 0.00 0.00 174.94 175.58 3gzy s ALA 157 N -1.31 -0.86 -2.13 2.27 0.00 0.12 -4.73 121.76 115.12 3gzy s ALA 157 Ca 0.66 0.22 0.16 0.00 0.00 0.00 0.00 51.96 53.00 3gzy s ALA 157 Cb -0.39 0.28 0.55 0.00 0.00 0.00 0.00 23.12 23.56 3gzy s ALA 157 CO 0.48 -0.40 1.41 -0.25 0.00 0.00 0.00 175.76 176.99 3gzy n ASP 158 N 0.67 1.62 -4.79 0.00 8.00 -1.26 -3.85 116.55 116.94 3gzy n ASP 158 Ca -0.19 -1.83 -0.29 0.00 0.71 0.00 0.00 54.79 53.19 3gzy n ASP 158 Cb 0.59 -0.15 0.12 0.00 -0.02 0.00 0.00 41.12 41.65 3gzy n ASP 158 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3gzy s ASN 159 N -1.30 3.87 0.00 -2.24 2.20 -1.26 -4.89 114.94 111.32 3gzy s ASN 159 Ca 0.27 1.10 0.11 0.00 -0.94 0.00 0.00 52.86 53.40 3gzy s ASN 159 Cb 0.14 -1.73 0.61 0.00 -2.00 0.00 0.00 41.25 38.27 3gzy s ASN 159 CO 0.21 -2.34 1.23 -2.65 -2.94 0.00 0.00 177.10 170.61 3gzy n PRO 160 N -3.64 0.21 -0.01 3.55 -0.02 -1.26 -1.60 135.00 132.23 3gzy n PRO 160 Ca 0.07 0.14 0.09 0.00 -2.02 0.00 0.00 63.50 61.77 3gzy n PRO 160 Cb 0.58 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.43 3gzy n PRO 160 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3gzy n LEU 161 N -1.22 0.09 0.00 2.45 4.32 -1.26 -5.00 117.00 116.38 3gzy n LEU 161 Ca 0.06 -0.05 0.00 0.00 -0.02 0.00 0.00 56.01 56.00 3gzy n LEU 161 Cb 0.08 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.88 3gzy n LEU 161 CO 0.08 0.02 0.00 0.61 -1.22 0.00 0.00 177.39 176.88 3gzy n GLY 162 N 1.51 1.18 3.10 -0.72 0.00 -0.63 -4.88 105.19 104.75 3gzy n GLY 162 Ca -0.02 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.92 3gzy n GLY 162 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gzy s PHE 163 N -2.85 0.42 0.18 1.61 0.40 -1.26 -0.70 117.98 115.79 3gzy s PHE 163 Ca 0.00 -0.91 0.10 0.00 -0.60 0.00 0.00 56.93 55.52 3gzy s PHE 163 Cb 0.00 -0.31 -0.04 0.00 0.51 0.00 0.00 43.02 43.18 3gzy s PHE 163 CO 0.00 -0.38 -0.22 -0.65 0.70 0.00 0.00 175.22 174.67 3gzy s GLN 164 N -3.60 1.43 -0.40 0.44 -0.21 -0.06 -4.78 119.66 112.49 3gzy s GLN 164 Ca 0.04 -1.48 -0.23 0.00 0.02 0.00 0.00 55.36 53.70 3gzy s GLN 164 Cb 0.05 -1.65 0.02 0.00 1.00 0.00 0.00 33.01 32.43 3gzy s GLN 164 CO -0.09 0.35 0.80 0.42 -2.12 0.00 0.00 175.29 174.65 3gzy s ILE 165 N -1.83 4.68 -0.09 1.08 1.01 0.59 -1.03 121.20 125.62 3gzy s ILE 165 Ca 0.19 0.76 0.15 0.00 0.00 0.00 0.00 60.65 61.74 3gzy s ILE 165 Cb -0.07 -4.27 -0.22 0.00 0.01 0.00 0.00 42.46 37.92 3gzy s ILE 165 CO 0.09 -0.56 0.60 0.00 0.00 0.00 0.00 174.94 175.07 3gzy n ALA 166 N 6.59 1.62 -3.15 9.38 0.00 0.92 -1.30 120.51 134.56 3gzy n ALA 166 Ca 0.03 -0.81 -0.13 0.00 0.00 0.00 0.00 53.44 52.54 3gzy n ALA 166 Cb 0.48 -0.76 -0.12 0.00 0.00 0.00 0.00 19.45 19.05 3gzy n ALA 166 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3gzy s LYS 167 N -2.67 0.28 -0.05 0.00 1.02 -0.99 -2.95 119.74 114.39 3gzy s LYS 167 Ca -0.05 0.35 -0.01 0.00 0.02 0.00 0.00 55.97 56.28 3gzy s LYS 167 Cb 0.08 0.13 0.03 0.00 -0.52 0.00 0.00 37.83 37.55 3gzy s LYS 167 CO 0.82 -0.04 0.01 0.50 -0.92 0.00 0.00 175.35 175.72 3gzy s ARG 168 N 0.17 0.41 -0.11 1.68 3.52 -0.05 -1.19 118.95 123.39 3gzy s ARG 168 Ca -0.00 0.12 0.03 0.00 -0.13 0.00 0.00 55.73 55.75 3gzy s ARG 168 Cb -0.02 -0.72 -0.00 0.00 -1.56 0.00 0.00 34.95 32.65 3gzy s ARG 168 CO -0.00 -0.23 -0.21 0.99 -0.81 0.00 0.00 175.30 175.04 3gzy s THR 169 N 1.59 2.35 -0.18 4.11 2.01 -0.29 -1.16 115.64 124.07 3gzy s THR 169 Ca -0.01 -0.91 -0.01 0.00 0.31 0.00 0.00 61.69 61.06 3gzy s THR 169 Cb -0.13 -1.93 -0.00 0.00 0.01 0.00 0.00 72.50 70.45 3gzy s THR 169 CO -0.03 0.55 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.71 3gzy s ILE 170 N 0.37 2.96 -0.30 1.82 1.09 -0.23 -0.71 121.20 126.20 3gzy s ILE 170 Ca -0.16 -0.66 -0.21 0.00 -1.10 0.00 0.00 60.65 58.53 3gzy s ILE 170 Cb -0.17 -2.29 -0.01 0.00 -1.06 0.00 0.00 42.46 38.93 3gzy s ILE 170 CO 0.07 0.49 0.64 -0.63 -0.10 0.00 0.00 174.94 175.41 3gzy s ILE 171 N 1.01 4.93 -0.18 2.92 1.01 0.11 -4.05 121.20 126.94 3gzy s ILE 171 Ca -0.01 0.91 -0.08 0.00 0.00 0.00 0.00 60.65 61.46 3gzy s ILE 171 Cb -0.15 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.27 3gzy s ILE 171 CO -0.02 -0.14 0.10 -0.22 0.00 0.00 0.00 174.94 174.66 3gzy s LEU 172 N 2.63 4.03 -1.18 2.97 2.96 -1.26 -0.81 118.68 128.01 3gzy s LEU 172 Ca 0.26 0.18 -0.07 0.00 -0.22 0.00 0.00 54.13 54.27 3gzy s LEU 172 Cb -0.15 -2.02 -0.02 0.00 0.50 0.00 0.00 46.19 44.50 3gzy s LEU 172 CO 0.12 0.20 2.82 0.47 -1.32 0.00 0.00 176.35 178.63 3gzy n ASP 173 N 3.39 7.82 -3.84 3.68 8.00 -0.31 -4.77 116.55 130.51 3gzy n ASP 173 Ca -0.17 -2.84 -0.11 0.00 0.71 0.00 0.00 54.79 52.38 3gzy n ASP 173 Cb 0.52 -1.43 -0.09 0.00 -0.02 0.00 0.00 41.12 40.10 3gzy n ASP 173 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3gzy s GLN 174 N 0.37 0.61 0.00 -1.24 -0.21 -1.26 -4.88 119.66 113.05 3gzy s GLN 174 Ca 0.63 -0.47 0.00 0.00 0.02 0.00 0.00 55.36 55.53 3gzy s GLN 174 Cb 0.22 0.26 0.00 0.00 1.00 0.00 0.00 33.01 34.49 3gzy s GLN 174 CO -0.08 -0.16 0.00 -1.13 -2.12 0.00 0.00 175.29 171.79 3gzy n SER 175 N 1.07 0.00 -4.70 5.90 3.41 -1.26 -4.55 113.62 113.48 3gzy n SER 175 Ca -0.21 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 57.98 3gzy n SER 175 Cb 0.57 -0.12 -0.03 0.00 -0.26 0.00 0.00 64.21 64.37 3gzy n SER 175 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3gzy n THR 176 N -1.72 0.11 -2.26 6.66 -1.04 -1.26 -4.66 114.28 110.12 3gzy n THR 176 Ca 0.00 -0.02 -0.42 0.00 -2.04 0.00 0.00 64.05 61.56 3gzy n THR 176 Cb 0.00 -1.97 -0.03 0.00 -1.82 0.00 0.00 70.33 66.51 3gzy n THR 176 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3gzy s VAL 177 N 1.64 3.94 -0.68 12.58 1.01 -1.26 -4.89 120.40 132.74 3gzy s VAL 177 Ca 0.78 1.20 0.24 0.00 0.00 0.00 0.00 61.98 64.20 3gzy s VAL 177 Cb -0.52 -3.77 0.01 0.00 0.00 0.00 0.00 36.38 32.10 3gzy s VAL 177 CO 0.35 -0.08 1.27 0.18 0.00 0.00 0.00 175.10 176.83 3gzy n LEU 178 N 6.39 0.65 -4.89 3.92 4.77 -1.26 -4.84 117.00 121.74 3gzy n LEU 178 Ca 0.15 0.15 -0.29 0.00 -0.03 0.00 0.00 56.01 55.99 3gzy n LEU 178 Cb 0.44 -0.17 0.02 0.00 -2.33 0.00 0.00 43.42 41.38 3gzy n LEU 178 CO 0.58 -0.01 0.63 0.00 -1.33 0.00 0.00 177.39 177.26 3gzy s ALA 179 N -3.15 3.14 -1.02 -1.18 0.00 -1.26 -4.99 121.76 113.30 3gzy s ALA 179 Ca 0.06 -0.39 0.27 0.00 0.00 0.00 0.00 51.96 51.90 3gzy s ALA 179 Cb 0.14 -2.86 1.17 0.00 0.00 0.00 0.00 23.12 21.57 3gzy s ALA 179 CO 0.73 -0.80 1.87 0.27 0.00 0.00 0.00 175.76 177.84 3gzy n ASN 180 N -2.70 0.00 -3.12 0.00 6.94 -1.26 -4.88 115.26 110.24 3gzy n ASN 180 Ca 0.05 0.47 -0.07 0.00 -0.02 0.00 0.00 54.58 55.00 3gzy n ASN 180 Cb 0.56 -0.49 0.02 0.00 -2.36 0.00 0.00 39.78 37.51 3gzy n ASN 180 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3gzy s ASN 181 N -2.98 -0.02 -0.41 0.53 2.20 -1.26 -5.03 114.94 107.97 3gzy s ASN 181 Ca 0.14 -0.98 0.06 0.00 -0.94 0.00 0.00 52.86 51.14 3gzy s ASN 181 Cb 0.18 0.75 0.43 0.00 -2.00 0.00 0.00 41.25 40.61 3gzy s ASN 181 CO 0.49 -1.48 1.12 0.18 -2.94 0.00 0.00 177.10 174.47 3gzy n LEU 182 N -0.56 4.61 -0.72 3.54 4.77 -1.26 -4.89 117.00 122.49 3gzy n LEU 182 Ca -0.07 -5.08 0.00 0.00 -0.03 0.00 0.00 56.01 50.83 3gzy n LEU 182 Cb 0.60 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 3gzy n LEU 182 CO 0.24 2.19 0.28 -1.54 -1.33 0.00 0.00 177.39 177.23 3gzy n SER 183 N -0.50 1.48 -4.19 -1.43 3.41 -1.26 -4.76 113.62 106.37 3gzy n SER 183 Ca 0.39 -1.57 -0.13 0.00 -0.26 0.00 0.00 58.87 57.29 3gzy n SER 183 Cb 0.72 -0.39 -0.10 0.00 -0.26 0.00 0.00 64.21 64.17 3gzy n SER 183 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3gzy s VAL 184 N -0.46 0.92 0.13 -3.33 -7.23 -1.26 -4.97 120.40 104.19 3gzy s VAL 184 Ca 0.00 -1.79 -0.08 0.00 -1.81 0.00 0.00 61.98 58.30 3gzy s VAL 184 Cb 0.00 -1.52 -0.06 0.00 0.56 0.00 0.00 36.38 35.36 3gzy s VAL 184 CO 0.00 -0.67 0.42 -0.36 -0.31 0.00 0.00 175.10 174.18 3gzy s PHE 185 N -2.89 3.52 -1.73 2.82 0.40 -1.26 -5.22 117.98 113.62 3gzy s PHE 185 Ca 0.09 0.72 0.14 0.00 -0.60 0.00 0.00 56.93 57.28 3gzy s PHE 185 Cb 0.00 -2.12 0.11 0.00 0.51 0.00 0.00 43.02 41.52 3gzy s PHE 185 CO -0.01 0.44 0.94 1.19 0.70 0.00 0.00 175.22 178.48