#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zz9 h ALA 7 N 0.00 1.69 -0.16 6.98 0.00 -1.99 -0.98 119.26 124.80 1zz9 h ALA 7 Ca 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1zz9 h ALA 7 Cb 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1zz9 h ALA 7 CO 0.00 0.26 -0.07 0.77 0.00 0.00 0.00 179.25 180.20 1zz9 h SER 8 N 0.67 0.34 -0.54 0.00 0.02 -1.95 -1.72 113.55 110.37 1zz9 h SER 8 Ca 0.22 -0.41 -0.02 0.00 -0.84 0.00 0.00 61.79 60.74 1zz9 h SER 8 Cb 0.05 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.46 1zz9 h SER 8 CO -0.06 0.68 0.29 0.74 -1.14 0.00 0.00 176.83 177.34 1zz9 h THR 9 N 0.01 1.18 -0.08 -2.27 2.02 -1.68 -0.34 112.91 111.75 1zz9 h THR 9 Ca 0.04 -0.50 -0.20 0.00 0.77 0.00 0.00 66.41 66.52 1zz9 h THR 9 Cb 0.54 0.44 -0.00 0.00 -1.74 0.00 0.00 68.15 67.39 1zz9 h THR 9 CO 0.02 0.21 -0.77 1.23 0.37 0.00 0.00 175.52 176.58 1zz9 h GLY 10 N 0.88 0.54 1.08 2.16 0.00 -1.16 -2.86 103.07 103.72 1zz9 h GLY 10 Ca 0.20 -0.80 -0.09 0.00 0.00 0.00 0.00 47.33 46.64 1zz9 h GLY 10 CO -0.03 0.71 0.01 -2.75 0.00 0.00 0.00 176.54 174.48 1zz9 h PHE 11 N 0.33 1.16 0.04 5.60 3.04 -0.91 -0.01 116.94 126.18 1zz9 h PHE 11 Ca -0.04 -0.20 0.02 0.00 3.98 0.00 0.00 57.97 61.73 1zz9 h PHE 11 Cb 1.37 -0.30 -0.03 0.00 2.56 0.00 0.00 35.95 39.55 1zz9 h PHE 11 CO 0.06 1.02 -0.16 0.00 -2.02 0.00 0.00 178.31 177.20 1zz9 h ALA 12 N 0.99 -0.22 -0.36 2.41 0.00 -1.02 0.25 119.26 121.30 1zz9 h ALA 12 Ca 0.17 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1zz9 h ALA 12 Cb 0.55 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1zz9 h ALA 12 CO 0.03 -0.66 -0.03 1.05 0.00 0.00 0.00 179.25 179.63 1zz9 h GLU 13 N -0.28 0.66 -0.24 0.00 9.09 -1.38 -2.85 114.58 119.58 1zz9 h GLU 13 Ca 0.04 -0.23 -0.15 0.00 0.05 0.00 0.00 59.36 59.08 1zz9 h GLU 13 Cb 0.33 -0.05 -0.01 0.00 -1.65 0.00 0.00 28.75 27.37 1zz9 h GLU 13 CO -0.12 0.79 -0.46 -0.07 0.05 0.00 0.00 179.01 179.19 1zz9 h LEU 14 N 0.46 0.66 -0.03 3.06 3.38 -0.87 -2.24 115.31 119.73 1zz9 h LEU 14 Ca 0.10 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 57.76 1zz9 h LEU 14 Cb 0.51 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1zz9 h LEU 14 CO 0.02 1.02 -0.06 0.25 0.09 0.00 0.00 178.44 179.77 1zz9 h LEU 15 N 0.49 -0.17 -1.32 1.67 5.85 -0.50 -1.09 115.31 120.24 1zz9 h LEU 15 Ca 0.03 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.79 1zz9 h LEU 15 Cb 0.99 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.07 1zz9 h LEU 15 CO 0.09 -0.08 0.45 0.50 -0.34 0.00 0.00 178.44 179.05 1zz9 h LYS 16 N -0.09 0.90 -0.32 1.25 3.64 -1.45 0.53 116.57 121.03 1zz9 h LYS 16 Ca 0.03 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.32 1zz9 h LYS 16 Cb 0.13 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 1zz9 h LYS 16 CO -0.08 0.60 0.06 -0.44 -2.27 0.00 0.00 179.45 177.32 1zz9 h ASP 17 N 0.93 0.50 -0.30 4.20 3.32 -0.79 -1.51 116.42 122.77 1zz9 h ASP 17 Ca 0.25 -0.25 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 1zz9 h ASP 17 Cb -0.10 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 1zz9 h ASP 17 CO -0.05 0.62 0.00 -0.09 -1.72 0.00 0.00 179.24 178.00 1zz9 h ARG 18 N 0.36 0.52 -0.70 3.56 9.65 -0.77 -0.01 114.38 126.98 1zz9 h ARG 18 Ca 0.10 -0.17 0.07 0.00 -1.10 0.00 0.00 59.98 58.88 1zz9 h ARG 18 Cb 0.33 -0.05 -0.06 0.00 -1.39 0.00 0.00 29.97 28.80 1zz9 h ARG 18 CO 0.00 0.67 0.39 -0.09 2.80 0.00 0.00 179.97 183.74 1zz9 h ARG 19 N 0.31 0.68 0.00 0.20 2.43 -0.82 -1.28 114.38 115.90 1zz9 h ARG 19 Ca 0.08 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.08 1zz9 h ARG 19 Cb 0.43 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 1zz9 h ARG 19 CO 0.02 0.45 -0.61 0.93 -1.51 0.00 0.00 179.97 179.24 1zz9 h GLU 20 N 0.70 0.00 -0.17 0.20 5.08 -1.13 -1.37 114.58 117.89 1zz9 h GLU 20 Ca 0.32 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.62 1zz9 h GLU 20 Cb 0.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1zz9 h GLU 20 CO -0.20 0.61 -0.18 0.37 -1.00 0.00 0.00 179.01 178.60 1zz9 h GLN 21 N 0.00 0.28 -0.58 2.33 4.15 0.15 -2.40 115.11 119.04 1zz9 h GLN 21 Ca -0.01 -0.08 -0.07 0.00 0.77 0.00 0.00 58.65 59.27 1zz9 h GLN 21 Cb 1.14 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.76 1zz9 h GLN 21 CO 0.08 0.47 0.08 1.33 -1.93 0.00 0.00 178.83 178.86 1zz9 n VAL 22 N -4.21 2.77 -1.69 2.39 0.24 -0.83 -4.94 118.33 112.05 1zz9 n VAL 22 Ca -0.01 -1.57 -0.18 0.00 -2.04 0.00 0.00 64.34 60.55 1zz9 n VAL 22 Cb 0.32 -0.30 -0.06 0.00 -1.47 0.00 0.00 33.84 32.33 1zz9 n VAL 22 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1zz9 n LYS 23 N 0.22 -1.49 -3.35 7.34 4.76 -0.90 -4.97 118.16 119.76 1zz9 n LYS 23 Ca 0.31 1.01 -0.32 0.00 -2.87 0.00 0.00 58.31 56.44 1zz9 n LYS 23 Cb 1.22 -5.40 -0.06 0.00 -1.84 0.00 0.00 35.03 28.95 1zz9 n LYS 23 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 1zz9 s MET 24 N -3.81 3.86 0.54 1.97 -1.94 -0.54 -5.01 119.30 114.38 1zz9 s MET 24 Ca 0.00 0.38 0.06 0.00 -1.71 0.00 0.00 55.69 54.42 1zz9 s MET 24 Cb 0.00 -2.63 0.04 0.00 2.01 0.00 0.00 34.83 34.25 1zz9 s MET 24 CO 0.00 0.30 0.45 0.16 -0.01 0.00 0.00 175.02 175.92 1zz9 s ASP 25 N -2.27 4.70 0.15 3.03 -4.77 -1.26 -4.39 116.67 111.86 1zz9 s ASP 25 Ca 0.48 -1.18 -0.20 0.00 -3.30 0.00 0.00 52.55 48.35 1zz9 s ASP 25 Cb -0.11 0.35 0.05 0.00 -1.09 0.00 0.00 42.92 42.12 1zz9 s ASP 25 CO 0.20 -1.11 1.65 0.45 0.70 0.00 0.00 175.17 177.06 1zz9 h HIS 26 N 0.70 -0.44 -0.66 2.11 3.86 -1.99 -1.94 115.15 116.80 1zz9 h HIS 26 Ca -0.36 0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 58.88 1zz9 h HIS 26 Cb 1.30 0.24 -0.03 0.00 1.06 0.00 0.00 27.41 29.98 1zz9 h HIS 26 CO 0.89 -0.25 0.41 0.00 0.86 0.00 0.00 177.93 179.84 1zz9 h ALA 27 N 1.05 1.47 -0.62 2.45 0.00 -1.94 0.75 119.26 122.42 1zz9 h ALA 27 Ca 0.16 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1zz9 h ALA 27 Cb 0.38 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1zz9 h ALA 27 CO -0.38 0.47 0.33 0.00 0.00 0.00 0.00 179.25 179.66 1zz9 h ALA 28 N 1.54 0.79 -0.09 0.00 0.00 -1.76 -0.15 119.26 119.59 1zz9 h ALA 28 Ca 0.24 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 1zz9 h ALA 28 Cb -0.05 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1zz9 h ALA 28 CO -0.05 0.32 -0.21 1.25 0.00 0.00 0.00 179.25 180.57 1zz9 h LEU 29 N 0.84 0.34 -0.94 0.00 5.85 -0.98 -3.16 115.31 117.27 1zz9 h LEU 29 Ca 0.22 -0.58 0.21 0.00 0.84 0.00 0.00 57.88 58.57 1zz9 h LEU 29 Cb 0.06 -0.10 -0.12 0.00 0.37 0.00 0.00 40.66 40.88 1zz9 h LEU 29 CO -0.03 0.86 0.49 0.00 -0.34 0.00 0.00 178.44 179.42 1zz9 h ALA 30 N 0.49 1.56 0.07 1.25 0.00 -0.60 -2.29 119.26 119.72 1zz9 h ALA 30 Ca -0.00 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1zz9 h ALA 30 Cb 0.81 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1zz9 h ALA 30 CO 0.05 -0.24 -0.12 0.77 0.00 0.00 0.00 179.25 179.71 1zz9 h SER 31 N 0.54 -0.32 0.25 0.00 0.02 -0.99 0.01 113.55 113.07 1zz9 h SER 31 Ca 0.57 0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 61.51 1zz9 h SER 31 Cb 1.03 0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 1zz9 h SER 31 CO -0.47 -0.17 -0.26 -0.07 -1.14 0.00 0.00 176.83 174.72 1zz9 h LEU 32 N -0.23 0.01 0.00 5.07 3.38 -1.43 -3.04 115.31 119.07 1zz9 h LEU 32 Ca 0.02 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1zz9 h LEU 32 Cb 0.25 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1zz9 h LEU 32 CO -0.07 0.28 -0.93 -0.07 0.09 0.00 0.00 178.44 177.74 1zz9 h LEU 33 N 0.01 0.00 -0.35 1.67 3.38 -1.37 -3.48 115.31 115.17 1zz9 h LEU 33 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1zz9 h LEU 33 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1zz9 h LEU 33 CO 0.03 0.11 0.00 0.61 0.09 0.00 0.00 178.44 179.28 1zz9 n GLY 34 N 1.21 0.87 0.88 0.83 0.00 -0.44 -5.08 105.19 103.45 1zz9 n GLY 34 Ca -0.01 -0.59 -0.08 0.00 0.00 0.00 0.00 46.02 45.34 1zz9 n GLY 34 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1zz9 n GLU 35 N -0.70 1.70 -4.16 1.61 -0.58 -0.14 -5.05 120.64 113.32 1zz9 n GLU 35 Ca 0.00 -0.89 -0.28 0.00 -0.42 0.00 0.00 57.16 55.57 1zz9 n GLU 35 Cb 0.37 0.24 -0.07 0.00 -0.57 0.00 0.00 31.44 31.41 1zz9 n GLU 35 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 1zz9 s THR 36 N -1.44 3.94 0.60 2.62 -4.23 -1.26 -4.45 115.64 111.42 1zz9 s THR 36 Ca 0.00 -1.23 0.31 0.00 -1.18 0.00 0.00 61.69 59.58 1zz9 s THR 36 Cb 0.00 -2.95 0.36 0.00 1.34 0.00 0.00 72.50 71.25 1zz9 s THR 36 CO 0.00 -0.04 2.14 1.55 -0.54 0.00 0.00 174.62 177.73 1zz9 h PRO 37 N 2.88 0.00 -0.69 3.99 0.13 -1.90 -1.56 132.00 134.85 1zz9 h PRO 37 Ca -0.47 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.58 1zz9 h PRO 37 Cb 1.19 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 1zz9 h PRO 37 CO 0.59 0.00 0.15 0.93 -0.23 0.00 0.00 178.00 179.44 1zz9 h GLU 38 N 0.00 1.11 -0.19 0.86 3.07 -1.94 -1.03 114.58 116.47 1zz9 h GLU 38 Ca 0.06 -0.28 -0.12 0.00 -0.50 0.00 0.00 59.36 58.52 1zz9 h GLU 38 Cb 0.38 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 1zz9 h GLU 38 CO -0.00 0.99 -0.36 1.15 -1.40 0.00 0.00 179.01 179.40 1zz9 h THR 39 N 1.05 1.33 -0.34 1.13 2.02 -1.69 -1.80 112.91 114.61 1zz9 h THR 39 Ca 0.22 -1.59 0.00 0.00 0.77 0.00 0.00 66.41 65.81 1zz9 h THR 39 Cb 0.39 1.88 -0.02 0.00 -1.74 0.00 0.00 68.15 68.66 1zz9 h THR 39 CO 0.01 0.49 0.22 0.58 0.37 0.00 0.00 175.52 177.19 1zz9 h VAL 40 N 0.24 1.08 -0.46 3.16 2.07 -1.44 -1.34 116.25 119.56 1zz9 h VAL 40 Ca 0.01 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 67.38 1zz9 h VAL 40 Cb 0.95 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1zz9 h VAL 40 CO 0.08 0.08 0.30 0.00 0.02 0.00 0.00 177.57 178.06 1zz9 h ALA 41 N 1.13 1.69 -0.37 1.67 0.00 -1.14 -1.72 119.26 120.51 1zz9 h ALA 41 Ca 0.13 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1zz9 h ALA 41 Cb -0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1zz9 h ALA 41 CO -0.03 0.29 -0.01 0.00 0.00 0.00 0.00 179.25 179.50 1zz9 h ALA 42 N 1.72 0.50 -0.32 0.00 0.00 -0.54 -2.54 119.26 118.07 1zz9 h ALA 42 Ca 0.17 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 54.87 1zz9 h ALA 42 Cb -0.05 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1zz9 h ALA 42 CO -0.04 0.28 0.06 -1.49 0.00 0.00 0.00 179.25 178.06 1zz9 h TRP 43 N 0.48 0.09 0.00 0.00 6.55 -0.39 0.49 115.95 123.16 1zz9 h TRP 43 Ca 0.10 0.02 0.00 0.00 0.95 0.00 0.00 58.89 59.96 1zz9 h TRP 43 Cb 0.47 0.01 0.00 0.00 -0.86 0.00 0.00 29.16 28.78 1zz9 h TRP 43 CO 0.04 0.01 0.00 0.39 -1.05 0.00 0.00 178.44 177.83 1zz9 n GLU 44 N -5.10 0.36 -0.01 0.49 1.02 -0.89 -1.45 120.64 115.07 1zz9 n GLU 44 Ca 0.01 0.05 0.12 0.00 -0.02 0.00 0.00 57.16 57.32 1zz9 n GLU 44 Cb 0.15 -1.50 0.16 0.00 -0.02 0.00 0.00 31.44 30.22 1zz9 n GLU 44 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1zz9 n ASN 45 N -1.10 2.83 0.00 1.62 5.15 0.17 -4.69 115.26 119.24 1zz9 n ASN 45 Ca 0.09 -1.94 0.00 0.00 -0.60 0.00 0.00 54.58 52.13 1zz9 n ASN 45 Cb 0.07 -0.01 0.00 0.00 -0.53 0.00 0.00 39.78 39.31 1zz9 n ASN 45 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1zz9 n GLY 46 N 1.33 0.84 1.07 8.20 0.00 -0.53 -4.98 105.19 111.12 1zz9 n GLY 46 Ca 0.15 -0.34 -0.02 0.00 0.00 0.00 0.00 46.02 45.80 1zz9 n GLY 46 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1zz9 n GLU 47 N -2.26 1.92 0.00 1.61 1.02 -1.02 -4.57 120.64 117.35 1zz9 n GLU 47 Ca 0.00 -3.14 0.12 0.00 -0.02 0.00 0.00 57.16 54.12 1zz9 n GLU 47 Cb 0.01 -1.80 0.15 0.00 -0.02 0.00 0.00 31.44 29.78 1zz9 n GLU 47 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1zz9 n GLY 48 N -1.07 0.70 0.43 0.62 0.00 -1.26 -4.56 105.19 100.05 1zz9 n GLY 48 Ca 0.31 -0.64 0.18 0.00 0.00 0.00 0.00 46.02 45.86 1zz9 n GLY 48 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1zz9 h GLY 49 N 4.75 0.00 -0.25 -0.02 0.00 -1.90 0.21 103.07 105.85 1zz9 h GLY 49 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1zz9 h GLY 49 CO 0.00 0.00 -0.45 1.18 0.00 0.00 0.00 176.54 177.27 1zz9 n GLU 50 N -3.09 0.84 -1.74 4.80 -0.58 -1.26 -4.95 120.64 114.67 1zz9 n GLU 50 Ca 0.11 -0.62 -0.42 0.00 -0.42 0.00 0.00 57.16 55.81 1zz9 n GLU 50 Cb 1.08 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 30.45 1zz9 n GLU 50 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1zz9 n LEU 51 N -0.54 4.21 -4.91 -4.62 4.77 0.72 -4.98 117.00 111.66 1zz9 n LEU 51 Ca 0.10 1.14 -0.29 0.00 -0.03 0.00 0.00 56.01 56.92 1zz9 n LEU 51 Cb 0.40 -1.58 0.11 0.00 -2.33 0.00 0.00 43.42 40.02 1zz9 n LEU 51 CO 0.29 0.09 0.80 0.42 -1.33 0.00 0.00 177.39 177.67 1zz9 s THR 52 N 0.09 2.00 0.34 -5.08 -4.23 -1.26 -4.83 115.64 102.67 1zz9 s THR 52 Ca 0.65 -0.01 0.03 0.00 -1.18 0.00 0.00 61.69 61.19 1zz9 s THR 52 Cb -0.51 -3.00 0.19 0.00 1.34 0.00 0.00 72.50 70.52 1zz9 s THR 52 CO 0.47 0.00 1.91 0.25 -0.54 0.00 0.00 174.62 176.72 1zz9 h LEU 53 N -1.16 0.58 -0.15 4.79 5.85 -1.98 0.27 115.31 123.51 1zz9 h LEU 53 Ca -0.46 -0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.13 1zz9 h LEU 53 Cb 1.31 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 42.19 1zz9 h LEU 53 CO 0.61 0.57 -0.10 0.74 -0.34 0.00 0.00 178.44 179.91 1zz9 h THR 54 N 0.63 1.33 -0.75 1.05 2.02 -1.99 -1.27 112.91 113.93 1zz9 h THR 54 Ca 0.15 -1.19 0.02 0.00 0.77 0.00 0.00 66.41 66.16 1zz9 h THR 54 Cb 0.20 1.78 -0.04 0.00 -1.74 0.00 0.00 68.15 68.34 1zz9 h THR 54 CO -0.01 0.35 0.48 1.56 0.37 0.00 0.00 175.52 178.28 1zz9 h GLN 55 N -0.01 0.94 -0.93 6.66 4.20 -1.83 -0.34 115.11 123.79 1zz9 h GLN 55 Ca 0.03 -0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.70 1zz9 h GLN 55 Cb 0.59 -0.21 -0.05 0.00 0.30 0.00 0.00 27.48 28.12 1zz9 h GLN 55 CO 0.03 0.62 0.62 -0.07 -0.67 0.00 0.00 178.83 179.36 1zz9 h LEU 56 N 0.97 1.06 -0.78 1.46 3.38 -0.84 -0.64 115.31 119.91 1zz9 h LEU 56 Ca 0.29 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.18 1zz9 h LEU 56 Cb -0.05 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 1zz9 h LEU 56 CO -0.09 0.76 0.25 1.23 0.09 0.00 0.00 178.44 180.69 1zz9 h GLY 57 N 1.25 1.25 1.01 0.83 0.00 0.11 -1.62 103.07 105.90 1zz9 h GLY 57 Ca 0.35 -0.72 -0.11 0.00 0.00 0.00 0.00 47.33 46.85 1zz9 h GLY 57 CO -0.08 0.68 -0.19 3.21 0.00 0.00 0.00 176.54 180.15 1zz9 h ARG 58 N 1.12 0.80 -0.37 4.80 3.08 -0.55 -1.34 114.38 121.91 1zz9 h ARG 58 Ca 0.25 -0.35 0.02 0.00 0.07 0.00 0.00 59.98 59.96 1zz9 h ARG 58 Cb 0.28 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1zz9 h ARG 58 CO -0.01 0.98 0.22 0.82 -1.07 0.00 0.00 179.97 180.91 1zz9 h ILE 59 N 0.60 1.04 -0.66 2.04 2.04 -0.90 -1.75 117.51 119.91 1zz9 h ILE 59 Ca 0.08 -0.15 -0.08 0.00 1.00 0.00 0.00 64.86 65.71 1zz9 h ILE 59 Cb 0.75 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.35 1zz9 h ILE 59 CO 0.06 0.08 0.09 0.00 0.00 0.00 0.00 178.15 178.38 1zz9 h ALA 60 N 1.17 0.92 0.27 1.87 0.00 -1.26 -2.28 119.26 119.95 1zz9 h ALA 60 Ca 0.15 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1zz9 h ALA 60 Cb 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1zz9 h ALA 60 CO -0.07 0.67 -0.27 1.25 0.00 0.00 0.00 179.25 180.83 1zz9 h HIS 61 N 1.02 -0.72 -0.13 0.00 -0.00 -0.72 -0.19 115.15 114.41 1zz9 h HIS 61 Ca 0.20 0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.53 1zz9 h HIS 61 Cb 0.46 0.28 -0.01 0.00 -0.00 0.00 0.00 27.41 28.14 1zz9 h HIS 61 CO 0.03 -0.39 -0.11 -0.39 -0.00 0.00 0.00 177.93 177.07 1zz9 h VAL 62 N -0.57 1.15 -0.06 5.26 -1.51 -1.33 0.48 116.25 119.67 1zz9 h VAL 62 Ca -0.01 -0.66 0.00 0.00 -1.23 0.00 0.00 66.70 64.80 1zz9 h VAL 62 Cb 0.53 1.18 0.00 0.00 -2.13 0.00 0.00 31.29 30.86 1zz9 h VAL 62 CO -0.06 0.21 0.00 0.18 -1.23 0.00 0.00 177.57 176.67 1zz9 n LEU 63 N -4.31 0.44 -3.38 4.19 4.77 -0.86 -4.92 117.00 112.92 1zz9 n LEU 63 Ca -0.01 -0.20 -0.25 0.00 -0.03 0.00 0.00 56.01 55.53 1zz9 n LEU 63 Cb 0.24 -0.04 0.03 0.00 -2.33 0.00 0.00 43.42 41.32 1zz9 n LEU 63 CO 0.37 0.10 0.04 0.61 -1.33 0.00 0.00 177.39 177.18 1zz9 n GLY 64 N 0.78 -0.51 0.00 -0.72 0.00 0.16 -4.96 105.19 99.94 1zz9 n GLY 64 Ca 0.10 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1zz9 n GLY 64 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1zz9 n THR 65 N -4.44 0.00 -3.93 2.61 5.66 -0.24 -5.02 114.28 108.91 1zz9 n THR 65 Ca -0.04 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.75 1zz9 n THR 65 Cb 0.57 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.30 1zz9 n THR 65 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1zz9 s SER 66 N 0.53 5.13 0.32 1.09 1.04 -1.26 -4.09 113.70 116.45 1zz9 s SER 66 Ca 0.00 -0.55 -0.01 0.00 0.48 0.00 0.00 55.95 55.88 1zz9 s SER 66 Cb 0.00 -0.95 0.51 0.00 0.10 0.00 0.00 66.02 65.68 1zz9 s SER 66 CO 0.00 -0.30 1.98 0.40 0.98 0.00 0.00 173.24 176.31 1zz9 h ILE 67 N 1.37 1.20 -0.49 -1.02 2.04 -1.93 -1.91 117.51 116.76 1zz9 h ILE 67 Ca -0.45 -0.36 0.09 0.00 1.00 0.00 0.00 64.86 65.14 1zz9 h ILE 67 Cb 1.25 0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 1zz9 h ILE 67 CO 0.60 0.19 0.34 1.23 0.00 0.00 0.00 178.15 180.50 1zz9 h GLY 68 N 1.03 0.40 2.00 5.37 0.00 -1.94 -1.38 103.07 108.56 1zz9 h GLY 68 Ca 0.28 -0.12 -0.13 0.00 0.00 0.00 0.00 47.33 47.36 1zz9 h GLY 68 CO -0.06 0.08 -0.61 0.00 0.00 0.00 0.00 176.54 175.95 1zz9 h ALA 69 N 1.75 0.71 -0.38 3.60 0.00 -1.74 -3.18 119.26 120.02 1zz9 h ALA 69 Ca 0.23 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1zz9 h ALA 69 Cb 0.50 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1zz9 h ALA 69 CO -0.05 0.76 0.00 1.28 0.00 0.00 0.00 179.25 181.24 1zz9 n LEU 70 N -3.40 2.67 -4.40 0.00 4.77 -0.57 -4.91 117.00 111.17 1zz9 n LEU 70 Ca 0.01 -1.22 -0.28 0.00 -0.03 0.00 0.00 56.01 54.48 1zz9 n LEU 70 Cb 0.71 -0.25 -0.13 0.00 -2.33 0.00 0.00 43.42 41.43 1zz9 n LEU 70 CO 0.41 0.61 -0.56 0.42 -1.33 0.00 0.00 177.39 176.94 1zz9 s THR 71 N -1.51 2.27 0.70 -5.08 -4.23 -0.90 -4.16 115.64 102.73 1zz9 s THR 71 Ca 0.35 -1.83 -0.14 0.00 -1.18 0.00 0.00 61.69 58.90 1zz9 s THR 71 Cb 0.19 -2.02 0.02 0.00 1.34 0.00 0.00 72.50 72.03 1zz9 s THR 71 CO 0.27 0.03 1.11 -2.16 -0.54 0.00 0.00 174.62 173.33 1zz9 s PRO 72 N -2.23 2.59 1.07 3.99 0.04 -1.26 -4.94 135.00 134.26 1zz9 s PRO 72 Ca 0.16 1.36 -0.13 0.00 0.04 0.00 0.00 61.00 62.43 1zz9 s PRO 72 Cb -0.09 -1.93 0.23 0.00 0.04 0.00 0.00 34.50 32.75 1zz9 s PRO 72 CO 0.07 -1.41 1.07 -1.25 0.04 0.00 0.00 177.00 175.52 1zz9 s PRO 73 N -4.29 -0.19 0.23 0.56 0.04 -1.26 -4.92 135.00 125.17 1zz9 s PRO 73 Ca 0.66 0.59 -0.14 0.00 0.04 0.00 0.00 61.00 62.15 1zz9 s PRO 73 Cb -0.20 -1.66 0.27 0.00 0.04 0.00 0.00 34.50 32.95 1zz9 s PRO 73 CO 0.46 -3.17 1.59 0.00 0.04 0.00 0.00 177.00 175.91 1zz9 h ALA 74 N -2.21 0.34 0.00 8.56 0.00 -1.97 -3.48 119.26 120.50 1zz9 h ALA 74 Ca -0.58 0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1zz9 h ALA 74 Cb 1.34 0.71 0.00 0.00 0.00 0.00 0.00 17.79 19.84 1zz9 h ALA 74 CO 0.55 -0.50 0.00 0.41 0.00 0.00 0.00 179.25 179.71 1zz9 n GLY 75 N -1.50 2.50 3.43 0.00 0.00 -1.26 -5.03 105.19 103.34 1zz9 n GLY 75 Ca 0.09 -2.07 -0.34 0.00 0.00 0.00 0.00 46.02 43.71 1zz9 n GLY 75 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1zz9 s ASN 76 N 0.00 4.53 -0.10 1.61 3.84 -1.26 -3.96 114.94 119.61 1zz9 s ASN 76 Ca 0.00 -0.23 0.13 0.00 0.21 0.00 0.00 52.86 52.98 1zz9 s ASN 76 Cb 0.00 -1.74 0.23 0.00 -0.55 0.00 0.00 41.25 39.19 1zz9 s ASN 76 CO 0.00 0.13 1.12 -0.90 -2.79 0.00 0.00 177.10 174.65 1zz9 n ASP 77 N 3.81 1.58 -4.91 -4.21 5.68 -1.26 -5.07 116.55 112.17 1zz9 n ASP 77 Ca -0.18 -2.82 -0.27 0.00 -0.50 0.00 0.00 54.79 51.02 1zz9 n ASP 77 Cb 0.52 -0.37 -0.04 0.00 -1.14 0.00 0.00 41.12 40.09 1zz9 n ASP 77 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1zz9 s LEU 78 N -1.99 4.25 -0.67 -2.12 1.43 -1.26 -4.82 118.68 113.49 1zz9 s LEU 78 Ca 0.24 0.14 -0.10 0.00 -1.03 0.00 0.00 54.13 53.38 1zz9 s LEU 78 Cb 0.22 -2.84 0.17 0.00 0.03 0.00 0.00 46.19 43.77 1zz9 s LEU 78 CO 0.00 0.08 0.57 -0.62 0.23 0.00 0.00 176.35 176.61 1zz9 s ASP 79 N -3.03 6.07 -1.47 2.29 2.15 0.88 -4.48 116.67 119.09 1zz9 s ASP 79 Ca 0.34 -2.50 -0.02 0.00 0.43 0.00 0.00 52.55 50.80 1zz9 s ASP 79 Cb -0.11 -2.07 0.00 0.00 -0.30 0.00 0.00 42.92 40.44 1zz9 s ASP 79 CO 0.27 -0.57 0.29 0.47 -0.17 0.00 0.00 175.17 175.47 1zz9 n ASP 80 N 4.14 -5.48 0.00 -0.34 9.92 -1.26 -2.85 116.55 120.67 1zz9 n ASP 80 Ca 0.05 -0.15 0.00 0.00 -0.53 0.00 0.00 54.79 54.17 1zz9 n ASP 80 Cb 0.42 -4.42 0.00 0.00 -0.64 0.00 0.00 41.12 36.48 1zz9 n ASP 80 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1zz9 n GLY 81 N -1.25 0.26 3.27 0.44 0.00 -1.26 -5.08 105.19 101.58 1zz9 n GLY 81 Ca -0.15 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.70 1zz9 n GLY 81 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1zz9 s VAL 82 N -2.00 1.36 -0.03 1.61 -7.23 -1.13 -5.01 120.40 107.96 1zz9 s VAL 82 Ca 0.00 -2.04 0.01 0.00 -1.81 0.00 0.00 61.98 58.14 1zz9 s VAL 82 Cb 0.00 -1.84 0.02 0.00 0.56 0.00 0.00 36.38 35.12 1zz9 s VAL 82 CO 0.00 -0.64 -0.03 -0.51 -0.31 0.00 0.00 175.10 173.61 1zz9 s ILE 83 N -3.01 0.39 0.16 -0.62 2.07 -1.26 -0.08 121.20 118.85 1zz9 s ILE 83 Ca 0.17 -0.06 0.11 0.00 -1.41 0.00 0.00 60.65 59.45 1zz9 s ILE 83 Cb 0.00 -0.43 -0.04 0.00 0.13 0.00 0.00 42.46 42.12 1zz9 s ILE 83 CO 0.03 0.18 -0.23 -0.63 -1.91 0.00 0.00 174.94 172.38 1zz9 s ILE 84 N 0.83 2.48 -0.06 2.00 1.01 -1.26 -5.04 121.20 121.16 1zz9 s ILE 84 Ca -0.10 -1.81 -0.02 0.00 0.00 0.00 0.00 60.65 58.73 1zz9 s ILE 84 Cb -0.13 -2.15 0.03 0.00 0.01 0.00 0.00 42.46 40.22 1zz9 s ILE 84 CO -0.00 -0.00 0.03 -1.58 0.00 0.00 0.00 174.94 173.38 1zz9 s GLN 85 N -2.37 0.28 0.54 2.79 0.74 -1.26 -5.04 119.66 115.34 1zz9 s GLN 85 Ca 0.18 0.22 -0.16 0.00 0.05 0.00 0.00 55.36 55.65 1zz9 s GLN 85 Cb -0.09 -0.80 -0.07 0.00 1.10 0.00 0.00 33.01 33.15 1zz9 s GLN 85 CO 0.09 -0.33 1.01 -1.64 -0.55 0.00 0.00 175.29 173.86 1zz9 s MET 86 N 2.06 3.78 0.59 1.67 -1.94 -1.26 -4.94 119.30 119.26 1zz9 s MET 86 Ca 0.05 1.02 0.29 0.00 -1.71 0.00 0.00 55.69 55.34 1zz9 s MET 86 Cb -0.12 -2.11 1.60 0.00 2.01 0.00 0.00 34.83 36.21 1zz9 s MET 86 CO -0.04 -0.42 2.03 -1.00 -0.01 0.00 0.00 175.02 175.58 1zz9 h PRO 87 N 0.78 0.00 0.00 2.03 0.13 -2.01 -2.31 132.00 130.62 1zz9 h PRO 87 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1zz9 h PRO 87 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1zz9 h PRO 87 CO 0.60 0.00 0.00 0.38 -0.23 0.00 0.00 178.00 178.75 1zz9 h ASP 88 N 0.00 0.00 -0.50 1.44 2.03 -2.03 -3.31 116.42 114.05 1zz9 h ASP 88 Ca 0.13 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.39 1zz9 h ASP 88 Cb 0.72 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.20 1zz9 h ASP 88 CO -0.00 0.00 0.04 -1.84 -1.03 0.00 0.00 179.24 176.41 1zz9 n GLU 89 N -2.60 4.09 -3.31 4.15 0.28 -0.87 -4.95 120.64 117.43 1zz9 n GLU 89 Ca 0.05 -3.07 -0.39 0.00 -0.16 0.00 0.00 57.16 53.59 1zz9 n GLU 89 Cb 0.45 -2.13 -0.07 0.00 1.43 0.00 0.00 31.44 31.11 1zz9 n GLU 89 CO 0.00 0.00 0.00 -0.98 -0.16 0.00 0.00 177.13 175.99 1zz9 s ARG 90 N -2.84 4.15 0.24 3.44 1.70 -1.25 -4.97 118.95 119.42 1zz9 s ARG 90 Ca 0.51 0.29 -0.31 0.00 -0.47 0.00 0.00 55.73 55.75 1zz9 s ARG 90 Cb 0.40 -3.58 -0.14 0.00 -0.57 0.00 0.00 34.95 31.06 1zz9 s ARG 90 CO 0.13 -0.16 1.25 -0.35 -1.08 0.00 0.00 175.30 175.09 1zz9 n PRO 91 N 4.86 1.66 -3.95 3.89 -0.04 -1.25 -4.65 135.00 135.52 1zz9 n PRO 91 Ca -0.06 0.59 -0.34 0.00 -0.04 0.00 0.00 63.50 63.64 1zz9 n PRO 91 Cb 0.51 -2.14 -0.14 0.00 -0.04 0.00 0.00 33.50 31.69 1zz9 n PRO 91 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1zz9 s ILE 92 N -0.41 2.83 0.08 0.52 1.01 -1.26 -1.15 121.20 122.81 1zz9 s ILE 92 Ca 0.66 -1.32 0.10 0.00 0.00 0.00 0.00 60.65 60.08 1zz9 s ILE 92 Cb -0.71 -2.58 -0.03 0.00 0.01 0.00 0.00 42.46 39.15 1zz9 s ILE 92 CO 0.54 -0.01 -0.25 -0.76 0.00 0.00 0.00 174.94 174.46 1zz9 s LEU 93 N 1.25 2.31 0.51 2.97 1.02 -0.56 -4.98 118.68 121.20 1zz9 s LEU 93 Ca -0.04 -0.62 0.08 0.00 0.02 0.00 0.00 54.13 53.56 1zz9 s LEU 93 Cb -0.19 -1.31 0.03 0.00 0.02 0.00 0.00 46.19 44.74 1zz9 s LEU 93 CO -0.03 0.23 0.53 -0.54 0.02 0.00 0.00 176.35 176.56 1zz9 s LYS 94 N -1.60 2.40 -0.33 1.70 1.02 -1.26 0.50 119.74 122.17 1zz9 s LYS 94 Ca 0.13 -1.70 -0.00 0.00 0.02 0.00 0.00 55.97 54.42 1zz9 s LYS 94 Cb -0.10 -2.40 0.13 0.00 -0.52 0.00 0.00 37.83 34.94 1zz9 s LYS 94 CO 0.04 -0.54 0.26 0.20 -0.92 0.00 0.00 175.35 174.39 1zz9 s GLY 95 N -4.36 0.28 0.79 -3.33 0.00 -0.84 -4.86 107.32 95.00 1zz9 s GLY 95 Ca 0.48 -1.04 -0.11 0.00 0.00 0.00 0.00 44.72 44.04 1zz9 s GLY 95 CO 0.29 2.40 1.09 0.14 0.00 0.00 0.00 173.10 177.02 1zz9 s VAL 96 N 1.75 3.24 0.00 1.40 1.01 -1.26 -2.92 120.40 123.61 1zz9 s VAL 96 Ca 0.13 0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.52 1zz9 s VAL 96 Cb -0.17 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.15 1zz9 s VAL 96 CO -0.18 -0.53 0.00 0.52 0.00 0.00 0.00 175.10 174.91 1zz9 n VAL 100 N -3.47 0.00 -2.52 2.92 0.31 -1.26 -4.91 118.33 109.41 1zz9 n VAL 100 Ca 0.07 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.97 1zz9 n VAL 100 Cb 0.55 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.46 1zz9 n VAL 100 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1zz9 s ASP 101 N 0.00 6.85 -0.11 4.52 1.11 -1.26 -4.85 116.67 122.93 1zz9 s ASP 101 Ca 0.00 1.26 0.04 0.00 0.18 0.00 0.00 52.55 54.02 1zz9 s ASP 101 Cb 0.00 -2.54 -0.09 0.00 1.07 0.00 0.00 42.92 41.36 1zz9 s ASP 101 CO 0.00 -0.91 -0.06 -1.22 1.18 0.00 0.00 175.17 174.16 1zz9 n TYR 102 N 7.05 0.00 -3.80 4.23 4.01 -1.15 -4.64 117.16 122.86 1zz9 n TYR 102 Ca 0.13 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.75 1zz9 n TYR 102 Cb 0.46 -0.46 -0.09 0.00 -0.31 0.00 0.00 39.34 38.94 1zz9 n TYR 102 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1zz9 s TYR 103 N -2.24 -0.09 -0.12 -0.72 2.02 -1.24 -1.85 117.35 113.12 1zz9 s TYR 103 Ca -0.12 0.10 0.01 0.00 -0.37 0.00 0.00 57.07 56.69 1zz9 s TYR 103 Cb 0.04 0.04 0.02 0.00 -0.40 0.00 0.00 41.96 41.66 1zz9 s TYR 103 CO 0.32 -0.35 -0.12 0.14 -1.57 0.00 0.00 175.55 173.96 1zz9 s VAL 104 N -1.39 1.34 -0.30 0.71 -7.23 -0.79 -1.98 120.40 110.76 1zz9 s VAL 104 Ca -0.14 -0.51 -0.15 0.00 -1.81 0.00 0.00 61.98 59.37 1zz9 s VAL 104 Cb -0.06 -1.27 -0.03 0.00 0.56 0.00 0.00 36.38 35.59 1zz9 s VAL 104 CO 0.03 0.41 0.35 -0.31 -0.31 0.00 0.00 175.10 175.27 1zz9 s TYR 105 N 1.32 3.23 -0.46 2.82 1.51 0.18 -1.21 117.35 124.74 1zz9 s TYR 105 Ca -0.00 0.20 -0.15 0.00 -1.01 0.00 0.00 57.07 56.10 1zz9 s TYR 105 Cb -0.14 -2.60 0.07 0.00 -0.11 0.00 0.00 41.96 39.18 1zz9 s TYR 105 CO -0.06 -0.31 0.37 -0.80 -1.11 0.00 0.00 175.55 173.65 1zz9 s ASN 106 N 1.70 6.10 -0.28 2.29 -0.87 -0.65 -1.49 114.94 121.74 1zz9 s ASN 106 Ca 0.13 -1.27 -0.29 0.00 -1.57 0.00 0.00 52.86 49.85 1zz9 s ASN 106 Cb -0.16 -2.17 0.00 0.00 -0.02 0.00 0.00 41.25 38.90 1zz9 s ASN 106 CO 0.11 -0.61 1.28 0.00 -2.57 0.00 0.00 177.10 175.31 1zz9 s LEU 108 N 4.19 2.79 0.29 0.00 1.43 -0.56 -3.92 118.68 122.90 1zz9 s LEU 108 Ca 0.55 0.14 -0.28 0.00 -1.03 0.00 0.00 54.13 53.50 1zz9 s LEU 108 Cb -0.17 -2.35 -0.14 0.00 0.03 0.00 0.00 46.19 43.56 1zz9 s LEU 108 CO 0.21 -2.33 1.10 0.55 0.23 0.00 0.00 176.35 176.11 1zz9 n VAL 109 N -3.39 1.88 -4.29 -1.59 3.14 -1.26 -4.68 118.33 108.14 1zz9 n VAL 109 Ca 0.14 -0.47 -0.16 0.00 -2.96 0.00 0.00 64.34 60.89 1zz9 n VAL 109 Cb 0.60 -1.13 -0.10 0.00 -1.06 0.00 0.00 33.84 32.14 1zz9 n VAL 109 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1zz9 s ARG 110 N -1.50 1.22 -0.07 1.45 0.52 -1.26 -4.53 118.95 114.78 1zz9 s ARG 110 Ca 0.59 -1.59 -0.14 0.00 -0.52 0.00 0.00 55.73 54.07 1zz9 s ARG 110 Cb -0.68 -0.54 0.03 0.00 0.52 0.00 0.00 34.95 34.28 1zz9 s ARG 110 CO 0.60 -0.07 0.33 -0.08 0.02 0.00 0.00 175.30 176.10 1zz9 s THR 111 N -3.45 0.03 0.42 0.02 -1.32 -1.26 -5.02 115.64 105.05 1zz9 s THR 111 Ca 0.25 -0.24 0.35 0.00 -1.21 0.00 0.00 61.69 60.83 1zz9 s THR 111 Cb 0.05 -0.56 0.37 0.00 -1.51 0.00 0.00 72.50 70.85 1zz9 s THR 111 CO 0.06 -0.13 2.15 0.11 -2.21 0.00 0.00 174.62 174.59 1zz9 h LYS 112 N 4.69 0.00 0.00 7.08 1.57 -1.96 -2.11 116.57 125.84 1zz9 h LYS 112 Ca -0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1zz9 h LYS 112 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 1zz9 h LYS 112 CO 0.34 0.05 0.00 0.54 -0.57 0.00 0.00 179.45 179.81 1zz9 n ARG 113 N -3.33 0.42 -2.79 3.15 5.12 -1.25 -4.06 116.66 113.91 1zz9 n ARG 113 Ca -0.02 0.03 -0.10 0.00 -1.93 0.00 0.00 57.85 55.83 1zz9 n ARG 113 Cb 0.20 -1.50 0.07 0.00 -1.16 0.00 0.00 32.46 30.07 1zz9 n ARG 113 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1zz9 n ALA 114 N -1.26 -0.47 -0.48 7.54 0.00 -0.81 -5.04 120.51 119.99 1zz9 n ALA 114 Ca 0.13 -1.71 0.40 0.00 0.00 0.00 0.00 53.44 52.26 1zz9 n ALA 114 Cb 0.21 -1.14 0.68 0.00 0.00 0.00 0.00 19.45 19.19 1zz9 n ALA 114 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1zz9 h PRO 115 N 3.11 0.05 0.00 0.00 0.11 -1.67 0.48 132.00 134.08 1zz9 h PRO 115 Ca -0.08 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1zz9 h PRO 115 Cb 1.07 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1zz9 h PRO 115 CO 0.20 0.03 0.00 0.66 -0.21 0.00 0.00 178.00 178.68 1zz9 h SER 116 N 0.05 0.00 -2.57 -2.05 4.64 -1.93 -3.43 113.55 108.27 1zz9 h SER 116 Ca 0.85 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 61.63 1zz9 h SER 116 Cb 2.78 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 64.82 1zz9 h SER 116 CO -0.38 0.00 1.22 -0.22 -0.87 0.00 0.00 176.83 176.58 1zz9 s LEU 117 N -6.10 3.41 -0.50 5.97 2.96 0.16 -3.80 118.68 120.77 1zz9 s LEU 117 Ca 0.02 0.61 0.03 0.00 -0.22 0.00 0.00 54.13 54.57 1zz9 s LEU 117 Cb 0.08 -3.05 0.14 0.00 0.50 0.00 0.00 46.19 43.86 1zz9 s LEU 117 CO 0.56 -1.89 0.30 -0.69 -1.32 0.00 0.00 176.35 173.31 1zz9 s VAL 118 N 7.13 1.80 0.05 1.68 1.01 -0.92 -4.63 120.40 126.52 1zz9 s VAL 118 Ca 0.65 -3.04 -0.22 0.00 0.00 0.00 0.00 61.98 59.36 1zz9 s VAL 118 Cb -0.14 -2.23 -0.06 0.00 0.00 0.00 0.00 36.38 33.94 1zz9 s VAL 118 CO 0.27 -0.93 0.67 -2.16 0.00 0.00 0.00 175.10 172.94 1zz9 s PRO 119 N -0.15 4.39 0.02 2.72 0.04 -1.26 -2.37 135.00 138.39 1zz9 s PRO 119 Ca 0.20 0.90 -0.00 0.00 0.04 0.00 0.00 61.00 62.14 1zz9 s PRO 119 Cb -0.18 -3.32 -0.02 0.00 0.04 0.00 0.00 34.50 31.02 1zz9 s PRO 119 CO -0.05 0.42 -0.02 -0.51 0.04 0.00 0.00 177.00 176.87 1zz9 s LEU 120 N -0.45 2.23 -0.47 -3.56 1.43 0.40 -1.50 118.68 116.76 1zz9 s LEU 120 Ca 0.34 -0.52 -0.07 0.00 -1.03 0.00 0.00 54.13 52.85 1zz9 s LEU 120 Cb -0.20 0.12 0.12 0.00 0.03 0.00 0.00 46.19 46.27 1zz9 s LEU 120 CO 0.21 -0.32 0.32 -0.69 0.23 0.00 0.00 176.35 176.10 1zz9 s VAL 121 N -1.59 3.97 -0.21 -1.59 1.01 0.68 -1.19 120.40 121.48 1zz9 s VAL 121 Ca -0.15 -1.94 -0.22 0.00 0.00 0.00 0.00 61.98 59.68 1zz9 s VAL 121 Cb -0.09 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 1zz9 s VAL 121 CO -0.01 -0.77 0.68 -0.69 0.00 0.00 0.00 175.10 174.31 1zz9 s VAL 122 N 1.20 4.97 -0.34 2.92 1.01 -0.65 -1.63 120.40 127.88 1zz9 s VAL 122 Ca 0.07 1.28 -0.20 0.00 0.00 0.00 0.00 61.98 63.13 1zz9 s VAL 122 Cb -0.25 -3.99 -0.00 0.00 0.00 0.00 0.00 36.38 32.14 1zz9 s VAL 122 CO -0.02 0.06 0.64 -1.81 0.00 0.00 0.00 175.10 173.97 1zz9 s ASP 123 N 1.26 6.46 -0.51 3.32 1.01 -0.35 -1.93 116.67 125.93 1zz9 s ASP 123 Ca 0.30 0.26 -0.19 0.00 0.71 0.00 0.00 52.55 53.64 1zz9 s ASP 123 Cb -0.16 -2.33 0.06 0.00 1.01 0.00 0.00 42.92 41.50 1zz9 s ASP 123 CO 0.10 -0.55 0.63 -0.69 0.21 0.00 0.00 175.17 174.86 1zz9 s VAL 124 N 2.68 4.88 -1.34 -1.27 1.01 0.11 -1.88 120.40 124.59 1zz9 s VAL 124 Ca 0.25 -0.54 0.26 0.00 0.00 0.00 0.00 61.98 61.95 1zz9 s VAL 124 Cb -0.15 -4.31 0.17 0.00 0.00 0.00 0.00 36.38 32.09 1zz9 s VAL 124 CO 0.14 -0.82 1.55 0.18 0.00 0.00 0.00 175.10 176.15 1zz9 n LEU 125 N 6.16 0.65 -4.48 3.92 4.77 -0.77 -1.81 117.00 125.43 1zz9 n LEU 125 Ca -0.07 -0.06 -0.33 0.00 -0.03 0.00 0.00 56.01 55.52 1zz9 n LEU 125 Cb 0.45 -0.21 -0.13 0.00 -2.33 0.00 0.00 43.42 41.20 1zz9 n LEU 125 CO 0.54 0.14 -0.44 0.28 -1.33 0.00 0.00 177.39 176.58 1zz9 s THR 126 N -2.76 3.18 -0.37 -5.08 -1.32 -1.25 -4.79 115.64 103.24 1zz9 s THR 126 Ca 0.18 -0.67 0.08 0.00 -1.21 0.00 0.00 61.69 60.07 1zz9 s THR 126 Cb 0.18 -2.26 0.44 0.00 -1.51 0.00 0.00 72.50 69.35 1zz9 s THR 126 CO 0.60 0.59 1.12 -0.90 -2.21 0.00 0.00 174.62 173.81 1zz9 n ASP 127 N 2.42 4.23 -3.61 8.08 5.75 -1.26 0.16 116.55 132.33 1zz9 n ASP 127 Ca -0.17 -3.52 -0.29 0.00 -0.01 0.00 0.00 54.79 50.80 1zz9 n ASP 127 Cb 0.52 -0.43 -0.12 0.00 -1.03 0.00 0.00 41.12 40.05 1zz9 n ASP 127 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1zz9 s ASN 128 N -3.53 3.30 0.29 -1.12 2.47 -1.26 -1.71 114.94 113.38 1zz9 s ASN 128 Ca 0.45 -2.53 0.18 0.00 0.42 0.00 0.00 52.86 51.38 1zz9 s ASN 128 Cb 0.40 -0.79 1.02 0.00 -1.45 0.00 0.00 41.25 40.43 1zz9 s ASN 128 CO -0.09 -0.27 1.15 -2.65 -3.72 0.00 0.00 177.10 171.52 1zz9 n PRO 129 N 3.63 -0.04 -0.03 0.43 -0.02 -1.26 0.16 135.00 137.88 1zz9 n PRO 129 Ca 0.11 0.98 -0.11 0.00 -2.02 0.00 0.00 63.50 62.47 1zz9 n PRO 129 Cb 0.36 -1.81 -0.05 0.00 -0.02 0.00 0.00 33.50 31.98 1zz9 n PRO 129 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1zz9 h ASP 130 N 0.00 0.18 -0.44 2.55 3.45 -1.99 -2.98 116.42 117.19 1zz9 h ASP 130 Ca 0.63 -0.13 0.09 0.00 0.43 0.00 0.00 57.03 58.05 1zz9 h ASP 130 Cb 1.77 -0.05 -0.10 0.00 -0.56 0.00 0.00 39.33 40.40 1zz9 h ASP 130 CO -0.50 0.26 -0.32 0.44 -1.57 0.00 0.00 179.24 177.55 1zz9 h ASP 131 N 0.09 -1.07 0.00 6.45 3.32 0.12 -3.43 116.42 121.89 1zz9 h ASP 131 Ca 0.05 0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.29 1zz9 h ASP 131 Cb 0.13 0.51 0.00 0.00 0.22 0.00 0.00 39.33 40.19 1zz9 h ASP 131 CO -0.01 -0.31 0.00 0.00 -1.72 0.00 0.00 179.24 177.20 1zz9 n ALA 132 N -3.03 0.00 -1.00 3.45 0.00 -1.13 -4.92 120.51 113.89 1zz9 n ALA 132 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1zz9 n ALA 132 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.79 1zz9 n ALA 132 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1zz9 n LYS 133 N 0.00 3.18 0.00 0.00 5.02 -1.26 -5.01 118.16 120.09 1zz9 n LYS 133 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1zz9 n LYS 133 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1zz9 n LYS 133 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1zz9 n PHE 134 N 0.00 0.00 -4.33 2.13 7.35 -1.26 -4.74 117.46 116.60 1zz9 n PHE 134 Ca 0.00 0.00 -0.34 0.00 -0.76 0.00 0.00 57.45 56.35 1zz9 n PHE 134 Cb 0.00 0.00 -0.11 0.00 0.35 0.00 0.00 39.48 39.72 1zz9 n PHE 134 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1zz9 s ASN 135 N 0.00 5.03 0.60 -2.13 4.22 -1.08 -4.98 114.94 116.60 1zz9 s ASN 135 Ca 0.00 -0.03 0.30 0.00 -2.14 0.00 0.00 52.86 50.98 1zz9 s ASN 135 Cb 0.00 -1.73 1.12 0.00 1.28 0.00 0.00 41.25 41.91 1zz9 s ASN 135 CO 0.00 0.22 1.45 0.77 -2.04 0.00 0.00 177.10 177.50 1zz9 h SER 136 N 6.35 0.00 -0.31 3.54 4.64 -1.95 -3.16 113.55 122.65 1zz9 h SER 136 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1zz9 h SER 136 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1zz9 h SER 136 CO 0.62 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.19 1zz9 n GLY 137 N -1.70 4.17 3.84 -0.77 0.00 -1.26 -3.38 105.19 106.10 1zz9 n GLY 137 Ca 0.23 -1.29 -0.31 0.00 0.00 0.00 0.00 46.02 44.65 1zz9 n GLY 137 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1zz9 s HIS 138 N -1.07 3.39 -0.46 1.61 3.76 -1.26 -4.65 115.29 116.61 1zz9 s HIS 138 Ca 0.00 1.39 -0.13 0.00 -0.15 0.00 0.00 55.06 56.18 1zz9 s HIS 138 Cb 0.00 -2.81 0.09 0.00 1.11 0.00 0.00 32.58 30.97 1zz9 s HIS 138 CO 0.00 -0.78 0.35 0.00 -0.85 0.00 0.00 174.74 173.46 1zz9 s ALA 139 N -2.92 3.45 0.00 -1.40 0.00 -1.26 -0.16 121.76 119.48 1zz9 s ALA 139 Ca 0.58 -2.22 0.00 0.00 0.00 0.00 0.00 51.96 50.32 1zz9 s ALA 139 Cb -0.12 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.08 1zz9 s ALA 139 CO 0.46 -1.75 0.00 0.41 0.00 0.00 0.00 175.76 174.88 1zz9 n GLY 140 N 5.07 3.91 3.86 0.00 0.00 -1.26 -4.96 105.19 111.81 1zz9 n GLY 140 Ca -0.11 -1.62 -0.32 0.00 0.00 0.00 0.00 46.02 43.97 1zz9 n GLY 140 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1zz9 s ASN 141 N 0.00 6.68 -0.03 1.61 0.01 -1.26 -3.65 114.94 118.30 1zz9 s ASN 141 Ca 0.00 1.26 0.04 0.00 -0.71 0.00 0.00 52.86 53.45 1zz9 s ASN 141 Cb 0.00 -2.37 -0.01 0.00 0.41 0.00 0.00 41.25 39.29 1zz9 s ASN 141 CO 0.00 -0.30 -0.16 -0.70 -1.51 0.00 0.00 177.10 174.43 1zz9 s GLU 142 N -3.35 1.60 -0.09 -0.60 2.12 -0.19 -0.48 118.70 117.70 1zz9 s GLU 142 Ca 0.54 -0.58 -0.00 0.00 0.36 0.00 0.00 54.97 55.28 1zz9 s GLU 142 Cb -0.10 -1.43 -0.03 0.00 0.26 0.00 0.00 34.13 32.83 1zz9 s GLU 142 CO 0.23 0.27 -0.06 0.12 -0.54 0.00 0.00 175.26 175.28 1zz9 s PHE 143 N -0.08 2.97 0.06 5.30 5.36 -0.22 -0.94 117.98 130.44 1zz9 s PHE 143 Ca -0.01 -0.05 0.05 0.00 -0.96 0.00 0.00 56.93 55.96 1zz9 s PHE 143 Cb -0.10 -1.77 -0.03 0.00 -0.34 0.00 0.00 43.02 40.78 1zz9 s PHE 143 CO 0.01 0.25 -0.13 -0.51 -1.46 0.00 0.00 175.22 173.38 1zz9 s LEU 144 N -0.53 2.23 -0.16 6.12 1.02 0.92 -0.21 118.68 128.07 1zz9 s LEU 144 Ca 0.08 -0.54 -0.04 0.00 0.02 0.00 0.00 54.13 53.64 1zz9 s LEU 144 Cb -0.12 -0.51 0.08 0.00 0.02 0.00 0.00 46.19 45.66 1zz9 s LEU 144 CO 0.02 -0.05 0.27 0.12 0.02 0.00 0.00 176.35 176.73 1zz9 s PHE 145 N -1.11 -0.43 -0.11 0.29 5.36 -0.68 -0.32 117.98 120.97 1zz9 s PHE 145 Ca -0.01 0.82 -0.30 0.00 -0.96 0.00 0.00 56.93 56.48 1zz9 s PHE 145 Cb -0.09 -0.09 -0.02 0.00 -0.34 0.00 0.00 43.02 42.47 1zz9 s PHE 145 CO 0.02 -0.44 1.21 0.08 -1.46 0.00 0.00 175.22 174.63 1zz9 s VAL 146 N 2.42 4.30 -0.15 3.12 1.01 -0.63 -0.92 120.40 129.56 1zz9 s VAL 146 Ca 0.03 1.60 0.16 0.00 0.00 0.00 0.00 61.98 63.78 1zz9 s VAL 146 Cb -0.13 -4.03 -0.24 0.00 0.00 0.00 0.00 36.38 31.97 1zz9 s VAL 146 CO -0.10 -0.07 0.27 0.18 0.00 0.00 0.00 175.10 175.38 1zz9 n LEU 147 N 5.87 0.29 -3.67 3.92 4.77 0.11 -1.22 117.00 127.07 1zz9 n LEU 147 Ca 0.12 0.14 -0.15 0.00 -0.03 0.00 0.00 56.01 56.09 1zz9 n LEU 147 Cb 0.46 0.39 -0.08 0.00 -2.33 0.00 0.00 43.42 41.86 1zz9 n LEU 147 CO 0.55 0.46 0.20 -1.61 -1.33 0.00 0.00 177.39 175.67 1zz9 s GLU 148 N -2.53 0.76 1.95 3.23 2.02 -0.82 -4.84 118.70 118.48 1zz9 s GLU 148 Ca -0.08 0.24 0.00 0.00 0.02 0.00 0.00 54.97 55.15 1zz9 s GLU 148 Cb 0.07 0.35 0.00 0.00 0.10 0.00 0.00 34.13 34.65 1zz9 s GLU 148 CO 0.83 -0.19 0.00 0.41 0.02 0.00 0.00 175.26 176.33 1zz9 n GLY 149 N 1.68 -0.92 3.33 -1.39 0.00 -1.26 -1.64 105.19 104.98 1zz9 n GLY 149 Ca -0.18 -1.12 -0.32 0.00 0.00 0.00 0.00 46.02 44.39 1zz9 n GLY 149 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1zz9 s GLU 150 N 0.00 2.88 -0.09 1.61 2.12 -1.26 -3.02 118.70 120.95 1zz9 s GLU 150 Ca 0.00 -0.80 -0.02 0.00 0.36 0.00 0.00 54.97 54.52 1zz9 s GLU 150 Cb 0.00 -2.37 -0.03 0.00 0.26 0.00 0.00 34.13 31.99 1zz9 s GLU 150 CO 0.00 0.34 -0.01 0.42 -0.54 0.00 0.00 175.26 175.47 1zz9 s ILE 151 N -0.02 4.21 -0.35 -3.70 -1.09 -0.26 0.34 121.20 120.31 1zz9 s ILE 151 Ca -0.06 -0.29 -0.04 0.00 -2.23 0.00 0.00 60.65 58.03 1zz9 s ILE 151 Cb -0.15 -2.76 0.07 0.00 -1.58 0.00 0.00 42.46 38.04 1zz9 s ILE 151 CO 0.05 0.60 0.11 -2.28 -1.23 0.00 0.00 174.94 172.19 1zz9 s HIS 152 N -0.81 3.35 0.09 3.97 5.65 0.13 -0.07 115.29 127.59 1zz9 s HIS 152 Ca 0.12 -1.83 -0.03 0.00 0.25 0.00 0.00 55.06 53.57 1zz9 s HIS 152 Cb -0.11 -2.54 -0.05 0.00 -1.18 0.00 0.00 32.58 28.70 1zz9 s HIS 152 CO 0.02 -0.83 0.29 1.41 -0.65 0.00 0.00 174.74 174.98 1zz9 s MET 153 N 1.29 3.54 -0.00 2.88 1.75 -0.55 -2.28 119.30 125.92 1zz9 s MET 153 Ca 0.00 -0.24 -0.02 0.00 -1.25 0.00 0.00 55.69 54.18 1zz9 s MET 153 Cb -0.21 -2.96 -0.00 0.00 2.84 0.00 0.00 34.83 34.50 1zz9 s MET 153 CO -0.00 0.55 0.04 0.15 -0.65 0.00 0.00 175.02 175.11 1zz9 s LYS 154 N -2.48 0.23 0.18 4.11 1.02 -0.85 -2.44 119.74 119.52 1zz9 s LYS 154 Ca 0.37 -0.26 -0.19 0.00 0.02 0.00 0.00 55.97 55.91 1zz9 s LYS 154 Cb -0.13 0.09 0.04 0.00 -0.52 0.00 0.00 37.83 37.31 1zz9 s LYS 154 CO 0.25 -0.04 0.54 1.67 -0.92 0.00 0.00 175.35 176.85 1zz9 s TRP 155 N -0.76 -0.26 0.00 3.18 -2.14 -0.61 -1.61 118.94 116.74 1zz9 s TRP 155 Ca -0.08 -0.05 0.00 0.00 2.66 0.00 0.00 56.10 58.62 1zz9 s TRP 155 Cb -0.05 0.45 0.00 0.00 -3.10 0.00 0.00 33.47 30.77 1zz9 s TRP 155 CO -0.00 -0.89 0.00 0.41 -2.66 0.00 0.00 176.95 173.80 1zz9 n GLY 156 N -0.35 -0.91 3.68 3.67 0.00 -0.74 -1.40 105.19 109.14 1zz9 n GLY 156 Ca -0.12 -1.52 -0.59 0.00 0.00 0.00 0.00 46.02 43.79 1zz9 n GLY 156 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1zz9 n ASP 157 N 0.30 1.74 -0.24 1.61 2.03 -1.26 -4.54 116.55 116.19 1zz9 n ASP 157 Ca 0.00 1.12 0.26 0.00 0.52 0.00 0.00 54.79 56.69 1zz9 n ASP 157 Cb 0.00 -1.06 0.63 0.00 -0.72 0.00 0.00 41.12 39.97 1zz9 n ASP 157 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 1zz9 h LYS 158 N 5.82 0.17 0.00 -0.67 2.10 -1.97 -3.15 116.57 118.87 1zz9 h LYS 158 Ca -0.46 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1zz9 h LYS 158 Cb 1.34 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.64 1zz9 h LYS 158 CO 0.90 0.11 0.00 0.39 -2.00 0.00 0.00 179.45 178.86 1zz9 n GLU 159 N -4.39 0.00 -1.53 0.07 -0.58 -1.26 -4.56 120.64 108.39 1zz9 n GLU 159 Ca 0.21 0.00 -0.21 0.00 -0.42 0.00 0.00 57.16 56.74 1zz9 n GLU 159 Cb 0.92 0.00 -0.13 0.00 -0.57 0.00 0.00 31.44 31.66 1zz9 n GLU 159 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1zz9 n ASN 160 N 0.00 0.48 -4.72 1.62 5.15 -1.26 -4.89 115.26 111.64 1zz9 n ASN 160 Ca 0.00 -0.91 -0.24 0.00 -0.60 0.00 0.00 54.58 52.83 1zz9 n ASN 160 Cb 0.00 -1.17 0.10 0.00 -0.53 0.00 0.00 39.78 38.18 1zz9 n ASN 160 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1zz9 s PRO 161 N 8.14 1.82 -0.04 1.20 0.04 -1.19 -4.51 135.00 140.46 1zz9 s PRO 161 Ca 1.12 -0.94 -0.09 0.00 0.04 0.00 0.00 61.00 61.13 1zz9 s PRO 161 Cb -0.50 -2.32 -0.05 0.00 0.04 0.00 0.00 34.50 31.68 1zz9 s PRO 161 CO 0.32 -1.35 0.26 0.15 0.04 0.00 0.00 177.00 176.42 1zz9 s LYS 162 N -5.12 3.62 0.07 4.56 -0.14 -0.50 -4.90 119.74 117.34 1zz9 s LYS 162 Ca 0.65 0.04 0.04 0.00 -1.36 0.00 0.00 55.97 55.33 1zz9 s LYS 162 Cb -0.07 -3.15 -0.03 0.00 -1.68 0.00 0.00 37.83 32.90 1zz9 s LYS 162 CO 0.44 0.70 -0.10 -1.21 -0.76 0.00 0.00 175.35 174.42 1zz9 s GLU 163 N -1.32 0.74 -0.11 1.68 2.02 -1.26 -1.57 118.70 118.87 1zz9 s GLU 163 Ca 0.22 -0.99 -0.25 0.00 0.02 0.00 0.00 54.97 53.97 1zz9 s GLU 163 Cb -0.14 -0.53 0.06 0.00 0.10 0.00 0.00 34.13 33.62 1zz9 s GLU 163 CO 0.11 0.10 0.61 0.00 0.02 0.00 0.00 175.26 176.09 1zz9 s ALA 164 N -1.84 -1.54 -0.30 5.21 0.00 -1.02 -5.03 121.76 117.23 1zz9 s ALA 164 Ca -0.01 1.34 -0.11 0.00 0.00 0.00 0.00 51.96 53.18 1zz9 s ALA 164 Cb -0.07 -0.37 -0.02 0.00 0.00 0.00 0.00 23.12 22.66 1zz9 s ALA 164 CO 0.01 -0.33 0.17 -0.51 0.00 0.00 0.00 175.76 175.10 1zz9 s LEU 165 N -0.65 4.12 -0.35 0.00 1.43 -1.26 -1.48 118.68 120.49 1zz9 s LEU 165 Ca -0.07 -0.34 -0.11 0.00 -1.03 0.00 0.00 54.13 52.58 1zz9 s LEU 165 Cb -0.02 -2.06 0.01 0.00 0.03 0.00 0.00 46.19 44.14 1zz9 s LEU 165 CO 0.06 -0.15 0.20 -0.76 0.23 0.00 0.00 176.35 175.93 1zz9 s LEU 166 N 1.68 4.48 0.81 1.79 1.43 0.89 -4.97 118.68 124.79 1zz9 s LEU 166 Ca 0.06 -0.70 -0.12 0.00 -1.03 0.00 0.00 54.13 52.34 1zz9 s LEU 166 Cb -0.17 -2.05 0.08 0.00 0.03 0.00 0.00 46.19 44.09 1zz9 s LEU 166 CO 0.08 -0.29 1.18 -2.16 0.23 0.00 0.00 176.35 175.39 1zz9 s PRO 167 N 1.62 1.95 0.11 1.29 0.04 -1.26 -1.10 135.00 137.64 1zz9 s PRO 167 Ca 0.04 0.12 -0.33 0.00 0.04 0.00 0.00 61.00 60.87 1zz9 s PRO 167 Cb -0.18 -1.95 -0.12 0.00 0.04 0.00 0.00 34.50 32.29 1zz9 s PRO 167 CO 0.07 -1.61 1.72 2.41 0.04 0.00 0.00 177.00 179.63 1zz9 n THR 168 N -3.33 0.20 0.00 1.26 -1.04 -1.17 -1.77 114.28 108.43 1zz9 n THR 168 Ca 0.08 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 1zz9 n THR 168 Cb 0.61 -1.80 0.00 0.00 -1.82 0.00 0.00 70.33 67.32 1zz9 n THR 168 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1zz9 n GLY 169 N 3.87 2.89 3.77 3.41 0.00 -0.35 -5.02 105.19 113.75 1zz9 n GLY 169 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1zz9 n GLY 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zz9 s ALA 170 N -2.68 3.23 0.22 4.61 0.00 -0.73 -4.76 121.76 121.66 1zz9 s ALA 170 Ca 0.00 1.00 0.09 0.00 0.00 0.00 0.00 51.96 53.05 1zz9 s ALA 170 Cb 0.00 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 1zz9 s ALA 170 CO 0.00 -0.50 -0.05 -1.54 0.00 0.00 0.00 175.76 173.67 1zz9 s SER 171 N -1.02 4.40 -0.00 0.00 1.04 -1.26 -1.60 113.70 115.26 1zz9 s SER 171 Ca 0.54 -0.61 -0.19 0.00 0.48 0.00 0.00 55.95 56.18 1zz9 s SER 171 Cb -0.32 -0.78 0.04 0.00 0.10 0.00 0.00 66.02 65.05 1zz9 s SER 171 CO 0.41 0.06 0.41 -0.32 0.98 0.00 0.00 173.24 174.78 1zz9 s MET 172 N -3.21 0.83 -0.08 4.02 0.00 0.56 -4.97 119.30 116.46 1zz9 s MET 172 Ca 0.28 -0.17 0.02 0.00 0.00 0.00 0.00 55.69 55.82 1zz9 s MET 172 Cb -0.08 0.37 0.01 0.00 0.00 0.00 0.00 34.83 35.14 1zz9 s MET 172 CO 0.17 -0.26 -0.15 0.12 0.00 0.00 0.00 175.02 174.91 1zz9 s PHE 173 N -1.71 1.73 -0.15 4.11 5.36 -1.26 -0.06 117.98 126.01 1zz9 s PHE 173 Ca -0.10 -0.70 0.01 0.00 -0.96 0.00 0.00 56.93 55.18 1zz9 s PHE 173 Cb -0.03 -1.25 0.02 0.00 -0.34 0.00 0.00 43.02 41.42 1zz9 s PHE 173 CO 0.03 -0.35 -0.18 0.08 -1.46 0.00 0.00 175.22 173.35 1zz9 s VAL 174 N 0.71 1.82 0.56 3.12 1.01 -0.11 -5.00 120.40 122.50 1zz9 s VAL 174 Ca -0.13 -0.81 -0.16 0.00 0.00 0.00 0.00 61.98 60.88 1zz9 s VAL 174 Cb -0.16 -1.65 -0.06 0.00 0.00 0.00 0.00 36.38 34.51 1zz9 s VAL 174 CO 0.03 0.50 1.03 -0.70 0.00 0.00 0.00 175.10 175.96 1zz9 s GLU 175 N 1.17 3.60 0.33 2.72 2.12 -1.26 -1.02 118.70 126.36 1zz9 s GLU 175 Ca -0.00 1.10 -0.28 0.00 0.36 0.00 0.00 54.97 56.14 1zz9 s GLU 175 Cb -0.14 -2.08 -0.12 0.00 0.26 0.00 0.00 34.13 32.05 1zz9 s GLU 175 CO -0.08 -0.57 1.36 -0.85 -0.54 0.00 0.00 175.26 174.58 1zz9 n GLU 176 N -1.81 2.25 -1.03 4.30 0.28 -1.24 -2.37 120.64 121.02 1zz9 n GLU 176 Ca 0.08 0.79 -0.01 0.00 -0.16 0.00 0.00 57.16 57.86 1zz9 n GLU 176 Cb 0.53 -2.42 -0.00 0.00 1.43 0.00 0.00 31.44 30.98 1zz9 n GLU 176 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1zz9 n HIS 177 N 0.62 0.00 -3.65 -1.84 8.25 0.78 -4.93 115.22 114.46 1zz9 n HIS 177 Ca 0.05 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.13 1zz9 n HIS 177 Cb 0.36 -0.62 -0.12 0.00 1.12 0.00 0.00 29.99 30.73 1zz9 n HIS 177 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1zz9 s VAL 178 N -1.87 4.71 0.74 1.59 1.01 -1.00 -4.85 120.40 120.74 1zz9 s VAL 178 Ca 0.00 -0.29 -0.11 0.00 0.00 0.00 0.00 61.98 61.58 1zz9 s VAL 178 Cb 0.00 -3.35 0.04 0.00 0.00 0.00 0.00 36.38 33.07 1zz9 s VAL 178 CO 0.00 0.13 1.09 -2.16 0.00 0.00 0.00 175.10 174.16 1zz9 s PRO 179 N 1.64 2.42 0.23 2.72 0.04 -1.22 -4.53 135.00 136.30 1zz9 s PRO 179 Ca 0.05 1.19 -0.22 0.00 0.04 0.00 0.00 61.00 62.06 1zz9 s PRO 179 Cb -0.17 -1.92 0.04 0.00 0.04 0.00 0.00 34.50 32.50 1zz9 s PRO 179 CO 0.07 -1.52 0.81 -3.38 0.04 0.00 0.00 177.00 173.02 1zz9 s HIS 180 N -2.82 -0.16 -0.30 0.56 -3.43 -1.19 -1.79 115.29 106.16 1zz9 s HIS 180 Ca 0.62 -0.25 -0.16 0.00 -0.80 0.00 0.00 55.06 54.47 1zz9 s HIS 180 Cb -0.17 0.69 0.16 0.00 -1.43 0.00 0.00 32.58 31.83 1zz9 s HIS 180 CO 0.53 -1.09 1.03 0.00 -2.00 0.00 0.00 174.74 173.21 1zz9 s ALA 181 N -3.64 -2.60 0.31 -1.38 0.00 -0.63 -2.62 121.76 111.19 1zz9 s ALA 181 Ca 0.12 2.08 0.08 0.00 0.00 0.00 0.00 51.96 54.24 1zz9 s ALA 181 Cb -0.04 -1.95 -0.06 0.00 0.00 0.00 0.00 23.12 21.07 1zz9 s ALA 181 CO 0.05 -0.70 -0.09 -0.59 0.00 0.00 0.00 175.76 174.44 1zz9 s PHE 182 N 1.93 2.17 0.27 0.00 -0.71 -1.26 -2.01 117.98 118.37 1zz9 s PHE 182 Ca -0.05 -0.58 -0.19 0.00 -1.04 0.00 0.00 56.93 55.08 1zz9 s PHE 182 Cb -0.05 -1.21 0.01 0.00 -1.21 0.00 0.00 43.02 40.56 1zz9 s PHE 182 CO -0.16 0.45 0.65 0.95 -1.34 0.00 0.00 175.22 175.77 1zz9 s THR 183 N -2.79 0.00 0.91 -4.49 -4.23 -0.97 -4.79 115.64 99.28 1zz9 s THR 183 Ca 0.31 -1.12 -0.11 0.00 -1.18 0.00 0.00 61.69 59.58 1zz9 s THR 183 Cb 0.02 -2.06 0.14 0.00 1.34 0.00 0.00 72.50 71.94 1zz9 s THR 183 CO 0.14 -0.00 1.09 0.00 -0.54 0.00 0.00 174.62 175.31 1zz9 s ALA 184 N -3.95 1.42 0.39 3.99 0.00 0.12 0.17 121.76 123.90 1zz9 s ALA 184 Ca 0.14 0.03 -0.27 0.00 0.00 0.00 0.00 51.96 51.87 1zz9 s ALA 184 Cb -0.04 -3.23 -0.09 0.00 0.00 0.00 0.00 23.12 19.75 1zz9 s ALA 184 CO 0.08 -2.48 1.32 0.00 0.00 0.00 0.00 175.76 174.68 1zz9 s ALA 185 N -2.86 3.33 -0.17 0.00 0.00 0.15 -4.33 121.76 117.88 1zz9 s ALA 185 Ca 0.64 1.26 -0.26 0.00 0.00 0.00 0.00 51.96 53.61 1zz9 s ALA 185 Cb -0.19 -3.49 -0.12 0.00 0.00 0.00 0.00 23.12 19.32 1zz9 s ALA 185 CO 0.58 -0.81 0.81 1.17 0.00 0.00 0.00 175.76 177.51 1zz9 n LYS 186 N 0.28 0.00 -3.69 0.00 3.00 -1.26 -0.44 118.16 116.06 1zz9 n LYS 186 Ca 0.03 0.00 -0.27 0.00 -0.00 0.00 0.00 58.31 58.06 1zz9 n LYS 186 Cb 0.43 -0.88 -0.02 0.00 0.00 0.00 0.00 35.03 34.56 1zz9 n LYS 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1zz9 n GLY 187 N 1.73 -0.46 0.71 3.14 0.00 -0.69 -4.82 105.19 104.78 1zz9 n GLY 187 Ca 0.15 0.09 0.07 0.00 0.00 0.00 0.00 46.02 46.34 1zz9 n GLY 187 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1zz9 n THR 188 N -3.93 0.50 0.00 2.61 -2.24 0.42 -5.03 114.28 106.60 1zz9 n THR 188 Ca 0.03 -0.75 0.00 0.00 -2.27 0.00 0.00 64.05 61.06 1zz9 n THR 188 Cb 0.51 0.90 0.00 0.00 -2.10 0.00 0.00 70.33 69.64 1zz9 n THR 188 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1zz9 n GLY 189 N 0.82 2.21 3.60 3.38 0.00 -1.26 -4.89 105.19 109.05 1zz9 n GLY 189 Ca 0.12 -0.24 -0.06 0.00 0.00 0.00 0.00 46.02 45.84 1zz9 n GLY 189 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1zz9 s SER 190 N -3.03 -0.26 0.26 1.61 1.04 -1.26 -4.17 113.70 107.88 1zz9 s SER 190 Ca 0.00 -0.13 0.02 0.00 0.48 0.00 0.00 55.95 56.31 1zz9 s SER 190 Cb 0.00 0.38 -0.03 0.00 0.10 0.00 0.00 66.02 66.46 1zz9 s SER 190 CO 0.00 -0.64 0.22 0.00 0.98 0.00 0.00 173.24 173.79 1zz9 s ALA 191 N -3.05 1.37 -0.01 5.32 0.00 -0.75 -4.56 121.76 120.07 1zz9 s ALA 191 Ca 0.08 -1.81 0.01 0.00 0.00 0.00 0.00 51.96 50.24 1zz9 s ALA 191 Cb -0.01 1.40 0.01 0.00 0.00 0.00 0.00 23.12 24.53 1zz9 s ALA 191 CO -0.05 -0.64 -0.01 0.21 0.00 0.00 0.00 175.76 175.27 1zz9 s LYS 192 N -3.82 0.24 -0.09 0.00 2.20 -0.65 0.07 119.74 117.69 1zz9 s LYS 192 Ca 0.39 -0.01 -0.08 0.00 -0.36 0.00 0.00 55.97 55.91 1zz9 s LYS 192 Cb 0.05 -0.33 0.03 0.00 -1.51 0.00 0.00 37.83 36.06 1zz9 s LYS 192 CO 0.18 -0.03 0.24 -0.48 -0.36 0.00 0.00 175.35 174.90 1zz9 s LEU 193 N 0.44 1.01 0.28 5.43 0.05 -0.81 0.04 118.68 125.12 1zz9 s LEU 193 Ca -0.04 0.48 -0.26 0.00 0.05 0.00 0.00 54.13 54.35 1zz9 s LEU 193 Cb -0.07 0.79 -0.09 0.00 -2.05 0.00 0.00 46.19 44.77 1zz9 s LEU 193 CO -0.01 -0.09 0.90 -0.63 -0.55 0.00 0.00 176.35 175.97 1zz9 s ILE 194 N 0.28 4.23 -0.02 1.48 1.01 -0.09 -1.64 121.20 126.43 1zz9 s ILE 194 Ca -0.01 1.83 0.01 0.00 0.00 0.00 0.00 60.65 62.47 1zz9 s ILE 194 Cb -0.03 -4.09 0.02 0.00 0.01 0.00 0.00 42.46 38.37 1zz9 s ILE 194 CO -0.01 0.28 -0.02 0.00 0.00 0.00 0.00 174.94 175.19 1zz9 s ALA 195 N -1.45 0.39 -0.21 9.38 0.00 -0.34 -1.68 121.76 127.85 1zz9 s ALA 195 Ca 0.46 0.04 -0.01 0.00 0.00 0.00 0.00 51.96 52.44 1zz9 s ALA 195 Cb -0.21 -0.27 0.06 0.00 0.00 0.00 0.00 23.12 22.70 1zz9 s ALA 195 CO 0.26 -0.01 -0.01 0.08 0.00 0.00 0.00 175.76 176.07 1zz9 s VAL 196 N 0.69 1.01 0.14 0.00 1.01 0.70 -0.45 120.40 123.50 1zz9 s VAL 196 Ca -0.07 -0.85 -0.15 0.00 0.00 0.00 0.00 61.98 60.91 1zz9 s VAL 196 Cb -0.11 -1.38 -0.07 0.00 0.00 0.00 0.00 36.38 34.82 1zz9 s VAL 196 CO -0.01 -0.13 0.55 0.20 0.00 0.00 0.00 175.10 175.71 1zz9 s ASN 197 N 1.64 6.84 0.00 3.32 0.01 -1.00 -1.05 114.94 124.70 1zz9 s ASN 197 Ca -0.03 1.09 0.00 0.00 -0.71 0.00 0.00 52.86 53.21 1zz9 s ASN 197 Cb -0.18 -2.29 0.00 0.00 0.41 0.00 0.00 41.25 39.19 1zz9 s ASN 197 CO -0.07 0.12 0.00 2.22 -1.51 0.00 0.00 177.10 177.86