#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zsh s MET 27 N 0.00 3.96 -0.36 1.61 1.00 -1.26 -1.16 119.30 123.09 2zsh s MET 27 Ca 0.00 0.63 -0.29 0.00 0.00 0.00 0.00 55.69 56.04 2zsh s MET 27 Cb 0.00 -2.42 -0.00 0.00 0.00 0.00 0.00 34.83 32.41 2zsh s MET 27 CO 0.00 0.11 1.50 0.34 0.00 0.00 0.00 175.02 176.97 2zsh s ASP 28 N -2.45 6.29 0.50 3.03 -1.08 0.52 -4.69 116.67 118.78 2zsh s ASP 28 Ca 0.54 1.05 0.27 0.00 -0.52 0.00 0.00 52.55 53.89 2zsh s ASP 28 Cb -0.10 -2.54 1.24 0.00 -1.46 0.00 0.00 42.92 40.06 2zsh s ASP 28 CO 0.20 -1.43 1.96 -0.33 0.52 0.00 0.00 175.17 176.09 2zsh h GLU 29 N 10.98 0.00 0.00 4.34 4.39 -1.94 -1.45 114.58 130.90 2zsh h GLU 29 Ca -0.29 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.35 2zsh h GLU 29 Cb 1.12 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.76 2zsh h GLU 29 CO 1.06 0.15 -0.28 -0.07 -1.16 0.00 0.00 179.01 178.71 2zsh h LEU 30 N 0.00 0.00 0.07 1.33 3.38 -1.97 -2.74 115.31 115.38 2zsh h LEU 30 Ca -0.00 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.64 2zsh h LEU 30 Cb 0.53 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 2zsh h LEU 30 CO 0.02 0.28 -1.87 0.18 0.09 0.00 0.00 178.44 177.14 2zsh n LEU 31 N -3.34 1.80 -0.36 1.67 4.77 -0.99 -4.11 117.00 116.43 2zsh n LEU 31 Ca 0.01 0.30 0.01 0.00 -0.03 0.00 0.00 56.01 56.30 2zsh n LEU 31 Cb 0.51 -0.51 0.16 0.00 -2.33 0.00 0.00 43.42 41.24 2zsh n LEU 31 CO 0.35 0.64 1.26 0.00 -1.33 0.00 0.00 177.39 178.31 2zsh h ALA 32 N 0.51 1.34 0.00 -1.18 0.00 -0.80 0.62 119.26 119.76 2zsh h ALA 32 Ca -0.36 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 2zsh h ALA 32 Cb 2.03 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 19.49 2zsh h ALA 32 CO 0.08 0.47 -0.09 -0.24 0.00 0.00 0.00 179.25 179.47 2zsh h VAL 33 N 1.19 0.38 -0.16 0.00 3.04 -1.65 -1.47 116.25 117.58 2zsh h VAL 33 Ca 0.41 -0.52 0.00 0.00 -1.01 0.00 0.00 66.70 65.59 2zsh h VAL 33 Cb 0.10 1.37 0.00 0.00 -2.01 0.00 0.00 31.29 30.75 2zsh h VAL 33 CO -0.15 0.09 0.00 0.18 -1.01 0.00 0.00 177.57 176.68 2zsh n LEU 34 N -3.43 1.89 0.00 3.16 4.77 0.13 -4.92 117.00 118.60 2zsh n LEU 34 Ca -0.01 -0.76 0.00 0.00 -0.03 0.00 0.00 56.01 55.20 2zsh n LEU 34 Cb 0.25 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2zsh n LEU 34 CO 0.28 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 2zsh n GLY 35 N 1.19 0.67 3.55 -0.72 0.00 -0.55 -5.08 105.19 104.25 2zsh n GLY 35 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 2zsh n GLY 35 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2zsh s TYR 36 N -2.29 2.99 -0.39 1.61 2.02 -0.71 -4.65 117.35 115.94 2zsh s TYR 36 Ca 0.00 -0.12 -0.10 0.00 -0.37 0.00 0.00 57.07 56.49 2zsh s TYR 36 Cb 0.00 -1.82 0.05 0.00 -0.40 0.00 0.00 41.96 39.79 2zsh s TYR 36 CO 0.00 0.18 0.21 0.15 -1.57 0.00 0.00 175.55 174.52 2zsh s LYS 37 N -0.30 2.71 -0.05 -0.62 1.02 0.17 -2.22 119.74 120.45 2zsh s LYS 37 Ca 0.05 -1.24 -0.02 0.00 0.02 0.00 0.00 55.97 54.78 2zsh s LYS 37 Cb -0.13 -3.71 0.03 0.00 -0.52 0.00 0.00 37.83 33.51 2zsh s LYS 37 CO 0.02 -0.79 0.09 0.08 -0.92 0.00 0.00 175.35 173.83 2zsh s VAL 38 N 1.48 -0.07 0.17 3.17 1.01 -1.26 -3.83 120.40 121.07 2zsh s VAL 38 Ca 0.02 0.23 -0.30 0.00 0.00 0.00 0.00 61.98 61.92 2zsh s VAL 38 Cb -0.21 -0.17 -0.08 0.00 0.00 0.00 0.00 36.38 35.93 2zsh s VAL 38 CO 0.04 0.09 1.23 -0.13 0.00 0.00 0.00 175.10 176.34 2zsh s ARG 39 N 1.29 4.45 0.29 2.72 0.52 -1.26 -0.36 118.95 126.60 2zsh s ARG 39 Ca -0.07 1.91 0.03 0.00 -0.52 0.00 0.00 55.73 57.08 2zsh s ARG 39 Cb -0.12 -3.24 0.65 0.00 0.52 0.00 0.00 34.95 32.75 2zsh s ARG 39 CO -0.04 -0.16 1.78 0.77 0.02 0.00 0.00 175.30 177.67 2zsh h SER 40 N 5.53 0.74 0.60 0.23 0.02 -1.42 0.81 113.55 120.06 2zsh h SER 40 Ca -0.44 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 2zsh h SER 40 Cb 1.21 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2zsh h SER 40 CO 0.76 0.30 0.00 -1.54 -1.14 0.00 0.00 176.83 175.21 2zsh n SER 41 N -4.77 0.46 -0.68 3.07 3.41 -1.26 -2.59 113.62 111.24 2zsh n SER 41 Ca 0.21 0.62 0.06 0.00 -0.26 0.00 0.00 58.87 59.50 2zsh n SER 41 Cb 0.50 -0.71 0.16 0.00 -0.26 0.00 0.00 64.21 63.89 2zsh n SER 41 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2zsh n GLU 42 N -2.01 2.66 -0.20 4.33 1.02 0.26 -4.64 120.64 122.05 2zsh n GLU 42 Ca 0.02 -2.02 -0.03 0.00 -0.02 0.00 0.00 57.16 55.10 2zsh n GLU 42 Cb 0.19 -1.29 0.07 0.00 -0.02 0.00 0.00 31.44 30.39 2zsh n GLU 42 CO 0.00 0.00 0.00 1.98 1.18 0.00 0.00 177.13 180.29 2zsh h MET 43 N 2.25 0.61 -0.48 3.49 4.05 -1.28 -0.83 114.93 122.74 2zsh h MET 43 Ca 0.00 -0.04 -0.05 0.00 -0.28 0.00 0.00 59.70 59.33 2zsh h MET 43 Cb 0.73 -0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 31.37 2zsh h MET 43 CO 0.00 0.41 0.08 0.00 0.23 0.00 0.00 176.91 177.63 2zsh h ALA 44 N 1.29 1.24 -0.25 0.39 0.00 -1.83 -0.59 119.26 119.52 2zsh h ALA 44 Ca 0.25 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 2zsh h ALA 44 Cb 0.11 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2zsh h ALA 44 CO -0.15 0.52 -0.40 -0.44 0.00 0.00 0.00 179.25 178.79 2zsh h ASP 45 N 0.72 0.61 -0.43 0.00 3.32 -1.69 -1.28 116.42 117.67 2zsh h ASP 45 Ca 0.16 -0.27 -0.10 0.00 0.02 0.00 0.00 57.03 56.84 2zsh h ASP 45 Cb 0.32 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 2zsh h ASP 45 CO 0.00 0.94 -0.12 0.58 -1.72 0.00 0.00 179.24 178.93 2zsh h VAL 46 N 0.48 1.27 -0.95 -1.35 2.07 -0.74 -1.98 116.25 115.06 2zsh h VAL 46 Ca 0.04 -1.23 0.03 0.00 0.82 0.00 0.00 66.70 66.36 2zsh h VAL 46 Cb 0.90 1.18 -0.05 0.00 -1.52 0.00 0.00 31.29 31.80 2zsh h VAL 46 CO 0.08 0.42 0.62 0.00 0.02 0.00 0.00 177.57 178.70 2zsh h ALA 47 N 0.85 1.25 -0.47 1.67 0.00 -0.89 -0.94 119.26 120.73 2zsh h ALA 47 Ca 0.11 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2zsh h ALA 47 Cb 0.66 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2zsh h ALA 47 CO 0.05 0.50 0.21 0.37 0.00 0.00 0.00 179.25 180.38 2zsh h GLN 48 N 1.20 0.69 -0.49 0.00 4.15 -1.00 -2.73 115.11 116.92 2zsh h GLN 48 Ca 0.37 -0.11 -0.06 0.00 0.77 0.00 0.00 58.65 59.63 2zsh h GLN 48 Cb -0.01 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.54 2zsh h GLN 48 CO -0.12 0.59 0.07 0.87 -1.93 0.00 0.00 178.83 178.31 2zsh h LYS 49 N 0.62 0.78 -0.71 1.69 1.57 -0.59 -1.25 116.57 118.67 2zsh h LYS 49 Ca 0.16 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2zsh h LYS 49 Cb 0.14 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 2zsh h LYS 49 CO -0.02 0.74 0.37 -0.07 -0.57 0.00 0.00 179.45 179.91 2zsh h LEU 50 N 0.74 0.90 -0.52 2.94 3.38 -0.99 -0.47 115.31 121.29 2zsh h LEU 50 Ca 0.16 -0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.86 2zsh h LEU 50 Cb 0.35 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2zsh h LEU 50 CO 0.01 0.75 -0.47 -0.08 0.09 0.00 0.00 178.44 178.73 2zsh h GLU 51 N 0.98 0.67 -0.43 1.13 4.81 -1.18 -1.63 114.58 118.92 2zsh h GLU 51 Ca 0.25 -0.38 -0.06 0.00 -0.13 0.00 0.00 59.36 59.03 2zsh h GLU 51 Cb 0.06 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 2zsh h GLU 51 CO -0.04 1.00 0.01 1.96 -0.73 0.00 0.00 179.01 181.21 2zsh h GLN 52 N 0.53 0.70 -0.13 1.92 4.20 -0.91 -1.04 115.11 120.38 2zsh h GLN 52 Ca 0.03 -0.17 -0.15 0.00 0.06 0.00 0.00 58.65 58.42 2zsh h GLN 52 Cb 1.02 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.70 2zsh h GLN 52 CO 0.10 0.70 -0.58 1.25 -0.67 0.00 0.00 178.83 179.63 2zsh h LEU 53 N 0.66 0.46 -0.51 1.46 5.85 -0.86 -2.29 115.31 120.08 2zsh h LEU 53 Ca 0.14 -0.25 -0.10 0.00 0.84 0.00 0.00 57.88 58.50 2zsh h LEU 53 Cb 0.39 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 2zsh h LEU 53 CO 0.01 0.94 -0.08 -0.33 -0.34 0.00 0.00 178.44 178.64 2zsh h GLU 54 N 0.31 0.95 0.20 1.25 5.08 -0.81 -1.46 114.58 120.09 2zsh h GLU 54 Ca -0.00 -0.34 0.01 0.00 -1.00 0.00 0.00 59.36 58.02 2zsh h GLU 54 Cb 1.11 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.27 2zsh h GLU 54 CO 0.10 1.01 -0.24 0.28 -1.00 0.00 0.00 179.01 179.16 2zsh h VAL 55 N 0.81 0.48 -0.78 3.13 2.07 -1.05 -1.37 116.25 119.55 2zsh h VAL 55 Ca 0.13 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.70 2zsh h VAL 55 Cb 0.63 0.48 -0.05 0.00 -1.52 0.00 0.00 31.29 30.84 2zsh h VAL 55 CO 0.04 0.00 0.51 0.24 0.02 0.00 0.00 177.57 178.38 2zsh h MET 56 N -0.49 0.89 -0.42 1.57 2.86 -1.31 -2.10 114.93 115.93 2zsh h MET 56 Ca 0.01 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.50 2zsh h MET 56 Cb 0.47 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.91 2zsh h MET 56 CO -0.08 0.59 -0.10 0.52 1.06 0.00 0.00 176.91 178.89 2zsh h MET 57 N 0.91 0.75 0.00 1.72 2.07 -0.80 -1.98 114.93 117.61 2zsh h MET 57 Ca 0.32 -0.24 0.00 0.00 -2.07 0.00 0.00 59.70 57.70 2zsh h MET 57 Cb 0.11 -0.07 0.00 0.00 -1.87 0.00 0.00 31.60 29.77 2zsh h MET 57 CO -0.10 0.83 0.00 -1.13 1.07 0.00 0.00 176.91 177.58 2zsh n SER 58 N -4.17 0.00 -0.08 1.22 3.41 -0.56 -2.28 113.62 111.16 2zsh n SER 58 Ca 0.01 -0.80 0.02 0.00 -0.26 0.00 0.00 58.87 57.84 2zsh n SER 58 Cb 0.36 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.30 2zsh n SER 58 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2zsh n ASN 59 N -0.95 0.76 -1.13 4.04 5.03 -0.78 -5.09 115.26 117.13 2zsh n ASN 59 Ca 0.16 -0.88 0.00 0.00 0.87 0.00 0.00 54.58 54.73 2zsh n ASN 59 Cb 0.07 0.50 0.00 0.00 -1.02 0.00 0.00 39.78 39.34 2zsh n ASN 59 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 2zsh n VAL 60 N -0.43 0.00 0.00 2.41 0.31 -0.96 -5.09 118.33 114.56 2zsh n VAL 60 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 2zsh n VAL 60 Cb 0.08 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.01 2zsh n VAL 60 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2zsh n LEU 68 N 0.00 0.00 0.16 7.52 -0.00 -1.26 -5.02 117.00 118.39 2zsh n LEU 68 Ca 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 56.01 56.14 2zsh n LEU 68 Cb 0.00 0.00 0.38 0.00 -0.00 0.00 0.00 43.42 43.80 2zsh n LEU 68 CO 0.00 0.00 0.87 0.00 -0.00 0.00 0.00 177.39 178.26 2zsh h ALA 69 N 0.00 1.00 -0.02 1.47 0.00 -2.01 -3.12 119.26 116.58 2zsh h ALA 69 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2zsh h ALA 69 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2zsh h ALA 69 CO 0.00 0.00 -0.00 1.15 0.00 0.00 0.00 179.25 180.40 2zsh h THR 70 N 0.00 1.29 0.00 0.00 2.02 -2.05 -3.17 112.91 111.00 2zsh h THR 70 Ca 0.00 -0.86 0.00 0.00 0.77 0.00 0.00 66.41 66.32 2zsh h THR 70 Cb 0.73 1.84 0.00 0.00 -1.74 0.00 0.00 68.15 68.98 2zsh h THR 70 CO 0.00 0.23 0.00 -0.33 0.37 0.00 0.00 175.52 175.79 2zsh h GLU 71 N -0.32 0.00 -0.57 6.66 4.39 -2.04 -3.30 114.58 119.40 2zsh h GLU 71 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 2zsh h GLU 71 Cb 0.37 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.99 2zsh h GLU 71 CO 0.00 0.00 0.37 1.15 -1.16 0.00 0.00 179.01 179.37 2zsh h THR 72 N 0.00 1.15 0.00 1.13 2.02 -1.51 -2.60 112.91 113.11 2zsh h THR 72 Ca 0.00 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.89 2zsh h THR 72 Cb 0.86 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 2zsh h THR 72 CO 0.00 0.15 0.13 -0.37 0.37 0.00 0.00 175.52 175.80 2zsh h VAL 73 N 0.77 0.00 0.00 3.16 -1.51 -1.65 -1.72 116.25 115.30 2zsh h VAL 73 Ca 0.21 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.67 2zsh h VAL 73 Cb -0.08 0.67 -0.00 0.00 -2.13 0.00 0.00 31.29 29.75 2zsh h VAL 73 CO -0.04 0.00 -0.54 0.45 -1.23 0.00 0.00 177.57 176.21 2zsh h HIS 74 N 0.00 0.00 -3.77 5.19 -0.00 -1.72 -3.47 115.15 111.38 2zsh h HIS 74 Ca 0.00 0.00 -0.49 0.00 -0.00 0.00 0.00 60.37 59.88 2zsh h HIS 74 Cb 0.27 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.65 2zsh h HIS 74 CO 0.00 0.01 0.13 0.71 -0.00 0.00 0.00 177.93 178.78 2zsh s TYR 75 N -3.29 3.37 -0.47 2.45 2.02 -0.65 -5.01 117.35 115.77 2zsh s TYR 75 Ca 0.03 1.26 -0.29 0.00 -0.37 0.00 0.00 57.07 57.70 2zsh s TYR 75 Cb 0.07 -2.57 0.02 0.00 -0.40 0.00 0.00 41.96 39.08 2zsh s TYR 75 CO 0.73 0.06 1.34 1.21 -1.57 0.00 0.00 175.55 177.33 2zsh s ASN 76 N -2.29 6.36 0.42 2.29 3.84 -1.26 -4.91 114.94 119.39 2zsh s ASN 76 Ca 0.55 0.60 0.29 0.00 0.21 0.00 0.00 52.86 54.52 2zsh s ASN 76 Cb -0.10 -2.54 1.28 0.00 -0.55 0.00 0.00 41.25 39.34 2zsh s ASN 76 CO 0.17 -1.45 1.88 -0.65 -2.79 0.00 0.00 177.10 174.26 2zsh h PRO 77 N 10.41 0.00 0.00 0.43 0.11 -1.95 -3.15 132.00 137.85 2zsh h PRO 77 Ca -0.26 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.65 2zsh h PRO 77 Cb 1.09 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 2zsh h PRO 77 CO 1.12 0.00 -0.96 0.00 -0.21 0.00 0.00 178.00 177.95 2zsh h ALA 78 N 2.11 0.45 -1.67 -0.75 0.00 -1.91 -3.39 119.26 114.11 2zsh h ALA 78 Ca 0.00 -0.86 -0.71 0.00 0.00 0.00 0.00 54.91 53.34 2zsh h ALA 78 Cb 0.36 -0.09 -0.16 0.00 0.00 0.00 0.00 17.79 17.90 2zsh h ALA 78 CO 0.00 1.14 1.27 -1.21 0.00 0.00 0.00 179.25 180.45 2zsh s GLU 79 N -2.76 3.90 0.22 0.00 0.41 -1.19 -0.65 118.70 118.63 2zsh s GLU 79 Ca 0.01 -2.20 -0.08 0.00 -0.41 0.00 0.00 54.97 52.29 2zsh s GLU 79 Cb 0.09 -5.07 0.32 0.00 -1.78 0.00 0.00 34.13 27.69 2zsh s GLU 79 CO 0.81 -1.83 1.76 -0.07 -0.49 0.00 0.00 175.26 175.43 2zsh h LEU 80 N 10.33 0.35 0.20 1.80 3.38 -1.77 0.48 115.31 130.07 2zsh h LEU 80 Ca 0.27 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.32 2zsh h LEU 80 Cb 0.93 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.66 2zsh h LEU 80 CO 1.23 0.20 -0.33 0.22 0.09 0.00 0.00 178.44 179.84 2zsh h TYR 81 N 0.51 -0.90 -0.17 1.13 3.20 -1.90 -0.28 116.97 118.55 2zsh h TYR 81 Ca 0.34 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 62.11 2zsh h TYR 81 Cb 0.39 0.37 -0.01 0.00 1.54 0.00 0.00 36.73 39.02 2zsh h TYR 81 CO -0.14 -0.45 -0.39 1.79 -1.64 0.00 0.00 178.16 177.34 2zsh h THR 82 N -0.61 1.30 0.05 1.81 1.35 -1.89 -1.36 112.91 113.56 2zsh h THR 82 Ca 0.01 -1.50 -0.00 0.00 -0.55 0.00 0.00 66.41 64.37 2zsh h THR 82 Cb 0.60 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.62 2zsh h THR 82 CO -0.15 0.46 -0.02 -0.25 -0.25 0.00 0.00 175.52 175.31 2zsh h TRP 83 N 0.31 -0.06 -0.36 4.73 7.01 -0.59 0.38 115.95 127.38 2zsh h TRP 83 Ca 0.03 -0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.00 2zsh h TRP 83 Cb 0.82 0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.89 2zsh h TRP 83 CO 0.02 0.07 0.10 -0.07 -2.79 0.00 0.00 178.44 175.77 2zsh h LEU 84 N -0.18 0.54 -0.94 0.65 3.38 -1.02 -1.15 115.31 116.59 2zsh h LEU 84 Ca -0.01 -0.22 0.05 0.00 0.09 0.00 0.00 57.88 57.79 2zsh h LEU 84 Cb 0.16 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 2zsh h LEU 84 CO 0.01 0.62 0.61 -0.78 0.09 0.00 0.00 178.44 178.99 2zsh h ASP 85 N 0.43 1.00 -0.38 -0.43 3.58 -1.14 0.43 116.42 119.91 2zsh h ASP 85 Ca 0.11 -0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.43 2zsh h ASP 85 Cb 0.29 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.11 2zsh h ASP 85 CO -0.00 0.67 -0.25 0.28 -2.88 0.00 0.00 179.24 177.06 2zsh h SER 86 N 1.15 0.92 -0.37 2.28 0.02 -0.65 -2.90 113.55 113.99 2zsh h SER 86 Ca 0.39 -0.35 -0.07 0.00 -0.84 0.00 0.00 61.79 60.92 2zsh h SER 86 Cb 0.06 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.34 2zsh h SER 86 CO -0.14 1.11 -0.02 0.24 -1.14 0.00 0.00 176.83 176.88 2zsh h MET 87 N 0.76 0.68 -0.57 3.45 2.86 -0.38 -2.89 114.93 118.85 2zsh h MET 87 Ca 0.10 -0.23 0.08 0.00 -2.06 0.00 0.00 59.70 57.59 2zsh h MET 87 Cb 0.80 -0.06 -0.07 0.00 0.06 0.00 0.00 31.60 32.34 2zsh h MET 87 CO 0.07 0.79 0.21 -0.07 1.06 0.00 0.00 176.91 178.96 2zsh h LEU 88 N 0.49 0.20 -0.36 1.22 -0.00 -0.88 -2.08 115.31 113.90 2zsh h LEU 88 Ca 0.10 0.07 0.04 0.00 -0.00 0.00 0.00 57.88 58.10 2zsh h LEU 88 Cb 0.50 0.06 -0.04 0.00 -0.00 0.00 0.00 40.66 41.17 2zsh h LEU 88 CO 0.02 0.13 0.12 0.74 -0.00 0.00 0.00 178.44 179.46 2zsh h THR 89 N 0.38 0.89 0.00 0.22 2.02 -1.42 -0.55 112.91 114.46 2zsh h THR 89 Ca 0.28 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.37 2zsh h THR 89 Cb 0.33 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 2zsh h THR 89 CO -0.29 0.05 0.01 0.47 0.37 0.00 0.00 175.52 176.13 2zsh n ASP 90 N -5.02 0.00 -0.15 4.18 10.43 -0.80 -5.14 116.55 120.05 2zsh n ASP 90 Ca 0.01 0.45 0.02 0.00 2.57 0.00 0.00 54.79 57.84 2zsh n ASP 90 Cb 0.13 -0.45 0.02 0.00 1.84 0.00 0.00 41.12 42.65 2zsh n ASP 90 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31