#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zjq n ARG 3 N 0.00 1.24 -3.41 0.54 0.63 -1.26 -4.97 116.66 109.43 2zjq n ARG 3 Ca 0.00 0.44 -0.25 0.00 -0.92 0.00 0.00 57.85 57.11 2zjq n ARG 3 Cb 0.00 -1.83 -0.10 0.00 0.45 0.00 0.00 32.46 30.97 2zjq n ARG 3 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2zjq s ALA 4 N -0.76 0.64 0.55 5.13 0.00 -1.26 -5.14 121.76 120.93 2zjq s ALA 4 Ca 0.64 -1.75 0.00 0.00 0.00 0.00 0.00 51.96 50.85 2zjq s ALA 4 Cb -0.76 -1.72 0.00 0.00 0.00 0.00 0.00 23.12 20.64 2zjq s ALA 4 CO 0.57 -2.10 0.00 1.63 0.00 0.00 0.00 175.76 175.86 2zjq n LYS 5 N 3.83 -0.09 0.00 0.00 5.02 -1.26 -4.92 118.16 120.73 2zjq n LYS 5 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.44 2zjq n LYS 5 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.42 2zjq n LYS 5 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2zjq n THR 6 N -2.44 0.60 -1.54 -0.18 -2.24 -1.26 -5.05 114.28 102.17 2zjq n THR 6 Ca 0.00 -0.62 -0.45 0.00 -2.27 0.00 0.00 64.05 60.72 2zjq n THR 6 Cb 0.00 0.71 -0.01 0.00 -2.10 0.00 0.00 70.33 68.93 2zjq n THR 6 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2zjq n GLY 7 N -0.30 -0.65 4.57 3.38 0.00 -1.26 -2.03 105.19 108.90 2zjq n GLY 7 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.31 2zjq n GLY 7 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2zjq n ILE 8 N 0.02 0.00 0.08 -0.61 -6.64 -1.26 -4.58 119.36 106.37 2zjq n ILE 8 Ca 0.11 0.00 -0.05 0.00 -1.77 0.00 0.00 62.75 61.04 2zjq n ILE 8 Cb 0.32 0.00 -0.07 0.00 -1.44 0.00 0.00 39.64 38.45 2zjq n ILE 8 CO 0.00 0.00 0.00 0.58 -1.77 0.00 0.00 176.55 175.36 2zjq h VAL 9 N 0.00 1.58 0.11 7.28 2.07 -1.82 -3.23 116.25 122.23 2zjq h VAL 9 Ca 0.00 -3.14 -0.32 0.00 0.82 0.00 0.00 66.70 64.05 2zjq h VAL 9 Cb 0.00 2.73 -0.01 0.00 -1.52 0.00 0.00 31.29 32.48 2zjq h VAL 9 CO 0.00 0.88 -1.73 -0.09 0.02 0.00 0.00 177.57 176.65 2zjq h ARG 10 N 0.00 0.23 -0.34 1.57 2.43 -1.79 -3.21 114.38 113.26 2zjq h ARG 10 Ca -0.01 -0.39 0.07 0.00 -0.81 0.00 0.00 59.98 58.84 2zjq h ARG 10 Cb 1.65 0.14 -0.09 0.00 -0.42 0.00 0.00 29.97 31.26 2zjq h ARG 10 CO 0.12 1.18 -0.39 0.00 -1.51 0.00 0.00 179.97 179.37 2zjq h ARG 11 N -0.20 -0.33 -0.05 0.20 3.08 -1.86 -1.31 114.38 113.92 2zjq h ARG 11 Ca -0.38 0.02 0.01 0.00 0.07 0.00 0.00 59.98 59.70 2zjq h ARG 11 Cb 1.85 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.96 2zjq h ARG 11 CO 0.04 -0.22 -0.16 0.00 -1.07 0.00 0.00 179.97 178.56 2zjq h ARG 12 N -0.34 -0.16 -0.61 0.04 3.08 -1.72 -0.37 114.38 114.30 2zjq h ARG 12 Ca 0.13 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.31 2zjq h ARG 12 Cb 0.58 0.04 -0.11 0.00 0.08 0.00 0.00 29.97 30.55 2zjq h ARG 12 CO -0.52 -0.11 -0.16 -2.13 -1.07 0.00 0.00 179.97 175.98 2zjq n ARG 13 N -3.43 -0.07 0.02 0.04 0.63 -0.86 -0.99 116.66 112.00 2zjq n ARG 13 Ca -0.02 0.95 -0.01 0.00 -0.92 0.00 0.00 57.85 57.86 2zjq n ARG 13 Cb 0.11 -1.42 -0.00 0.00 0.45 0.00 0.00 32.46 31.59 2zjq n ARG 13 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2zjq h HIS 14 N 0.00 -0.04 -1.78 -0.14 3.86 -0.24 -3.00 115.15 113.81 2zjq h HIS 14 Ca 0.28 -0.00 0.52 0.00 -1.16 0.00 0.00 60.37 60.01 2zjq h HIS 14 Cb 0.44 0.01 -0.07 0.00 1.06 0.00 0.00 27.41 28.85 2zjq h HIS 14 CO -0.48 -0.02 1.32 1.63 0.86 0.00 0.00 177.93 181.23 2zjq n LYS 15 N -2.16 0.00 -0.36 2.45 5.02 -0.25 0.48 118.16 123.35 2zjq n LYS 15 Ca -0.01 1.00 0.05 0.00 -2.02 0.00 0.00 58.31 57.34 2zjq n LYS 15 Cb 0.02 -2.33 0.21 0.00 -0.02 0.00 0.00 35.03 32.91 2zjq n LYS 15 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2zjq h LYS 16 N 0.00 1.05 0.00 1.97 1.57 -0.92 -0.29 116.57 119.96 2zjq h LYS 16 Ca 0.85 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 59.53 2zjq h LYS 16 Cb 3.47 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 35.54 2zjq h LYS 16 CO -0.01 0.70 -0.40 0.28 -0.57 0.00 0.00 179.45 179.45 2zjq h VAL 17 N 1.08 0.33 -0.94 0.50 2.07 1.08 -3.17 116.25 117.21 2zjq h VAL 17 Ca 0.46 -1.32 0.10 0.00 0.82 0.00 0.00 66.70 66.75 2zjq h VAL 17 Cb 0.32 0.70 -0.12 0.00 -1.52 0.00 0.00 31.29 30.67 2zjq h VAL 17 CO -0.21 0.11 -0.52 0.18 0.02 0.00 0.00 177.57 177.15 2zjq n LEU 18 N -4.64 -0.93 -0.25 2.57 4.32 -0.59 0.15 117.00 117.63 2zjq n LEU 18 Ca -0.09 1.66 0.24 0.00 -0.02 0.00 0.00 56.01 57.81 2zjq n LEU 18 Cb 0.26 -0.24 0.60 0.00 -1.62 0.00 0.00 43.42 42.42 2zjq n LEU 18 CO 0.11 -1.38 1.24 0.50 -1.22 0.00 0.00 177.39 176.64 2zjq h LYS 19 N 0.00 0.23 0.00 3.23 3.64 -1.19 0.97 116.57 123.45 2zjq h LYS 19 Ca 0.18 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 2zjq h LYS 19 Cb 0.42 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2zjq h LYS 19 CO -0.89 0.15 -0.11 0.00 -2.27 0.00 0.00 179.45 176.33 2zjq h ARG 20 N 0.24 0.00 -5.99 1.90 3.08 0.15 -3.40 114.38 110.35 2zjq h ARG 20 Ca 0.49 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.98 2zjq h ARG 20 Cb 1.52 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 31.51 2zjq h ARG 20 CO -0.13 0.11 0.19 0.00 -1.07 0.00 0.00 179.97 179.06 2zjq s ALA 21 N -4.37 3.40 0.00 0.04 0.00 0.34 -4.94 121.76 116.22 2zjq s ALA 21 Ca -0.03 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.01 2zjq s ALA 21 Cb 0.14 -3.05 0.00 0.00 0.00 0.00 0.00 23.12 20.21 2zjq s ALA 21 CO 0.60 -0.31 0.00 0.36 0.00 0.00 0.00 175.76 176.41 2zjq n LYS 22 N 4.32 0.00 -0.00 0.00 2.85 -1.26 -4.82 118.16 119.24 2zjq n LYS 22 Ca 0.01 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.27 2zjq n LYS 22 Cb 0.50 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.88 2zjq n LYS 22 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2zjq n GLY 23 N 1.33 0.54 3.57 2.58 0.00 -1.26 -4.56 105.19 107.39 2zjq n GLY 23 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2zjq n GLY 23 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2zjq s PHE 24 N 0.75 3.17 0.10 1.61 0.40 -1.26 -5.01 117.98 117.73 2zjq s PHE 24 Ca 0.00 0.36 -0.32 0.00 -0.60 0.00 0.00 56.93 56.37 2zjq s PHE 24 Cb 0.00 -3.07 -0.11 0.00 0.51 0.00 0.00 43.02 40.35 2zjq s PHE 24 CO 0.00 -0.58 1.81 1.87 0.70 0.00 0.00 175.22 179.02 2zjq n TRP 25 N 5.95 2.54 0.00 0.36 -0.00 -1.26 -3.93 117.44 121.10 2zjq n TRP 25 Ca -0.02 -0.07 0.00 0.00 -0.00 0.00 0.00 57.50 57.41 2zjq n TRP 25 Cb 0.49 -2.70 0.00 0.00 -0.00 0.00 0.00 31.31 29.10 2zjq n TRP 25 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2zjq n GLY 26 N 4.14 0.16 0.00 5.87 0.00 -1.26 -2.91 105.19 111.20 2zjq n GLY 26 Ca 0.18 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2zjq n GLY 26 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2zjq n SER 27 N -3.92 0.00 0.00 1.61 3.41 -1.26 -0.80 113.62 112.66 2zjq n SER 27 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2zjq n SER 27 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2zjq n SER 27 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2zjq n ARG 28 N -0.58 0.01 0.00 4.33 1.74 -1.14 -1.52 116.66 119.49 2zjq n ARG 28 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2zjq n ARG 28 Cb 0.00 -1.38 0.00 0.00 -1.02 0.00 0.00 32.46 30.06 2zjq n ARG 28 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2zjq n SER 29 N -0.88 0.00 -0.06 0.55 3.41 0.02 -4.45 113.62 112.21 2zjq n SER 29 Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 2zjq n SER 29 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 2zjq n SER 29 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2zjq n LYS 30 N 0.00 1.87 -4.35 4.33 4.76 -0.92 -4.87 118.16 118.98 2zjq n LYS 30 Ca 0.00 -0.01 -0.34 0.00 -2.87 0.00 0.00 58.31 55.09 2zjq n LYS 30 Cb 0.00 -1.33 -0.09 0.00 -1.84 0.00 0.00 35.03 31.76 2zjq n LYS 30 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 2zjq s GLN 31 N -2.31 2.92 0.00 1.97 -0.21 -0.58 -5.04 119.66 116.41 2zjq s GLN 31 Ca -0.06 -0.47 0.00 0.00 0.02 0.00 0.00 55.36 54.85 2zjq s GLN 31 Cb 0.04 -2.76 0.00 0.00 1.00 0.00 0.00 33.01 31.29 2zjq s GLN 31 CO 0.53 0.68 0.00 0.98 -2.12 0.00 0.00 175.29 175.36 2zjq n TYR 32 N 1.90 0.00 0.00 0.91 9.36 -1.26 -1.72 117.16 126.35 2zjq n TYR 32 Ca -0.17 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.05 2zjq n TYR 32 Cb 0.53 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.24 2zjq n TYR 32 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2zjq n ARG 33 N 0.00 0.00 -0.23 2.98 5.12 -1.26 0.42 116.66 123.69 2zjq n ARG 33 Ca 0.00 0.00 -0.08 0.00 -1.93 0.00 0.00 57.85 55.84 2zjq n ARG 33 Cb 0.00 0.00 0.03 0.00 -1.16 0.00 0.00 32.46 31.33 2zjq n ARG 33 CO 0.00 0.00 0.00 -0.97 -1.93 0.00 0.00 177.63 174.73 2zjq h ASN 34 N 0.00 1.03 -0.09 0.55 -1.24 -1.88 -1.83 115.58 112.13 2zjq h ASN 34 Ca 0.00 -0.27 0.02 0.00 0.71 0.00 0.00 56.30 56.76 2zjq h ASN 34 Cb 0.00 -0.28 -0.04 0.00 0.73 0.00 0.00 38.32 38.74 2zjq h ASN 34 CO 0.00 1.04 -0.31 0.00 -1.29 0.00 0.00 177.43 176.87 2zjq h ALA 35 N 1.03 -0.69 -0.29 1.57 0.00 0.92 0.80 119.26 122.60 2zjq h ALA 35 Ca 0.19 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.14 2zjq h ALA 35 Cb 0.46 0.83 -0.07 0.00 0.00 0.00 0.00 17.79 19.01 2zjq h ALA 35 CO 0.02 -0.80 -0.21 0.35 0.00 0.00 0.00 179.25 178.60 2zjq h PHE 36 N -0.33 -0.55 -0.97 0.00 3.04 -1.48 -1.88 116.94 114.78 2zjq h PHE 36 Ca 0.02 0.04 0.16 0.00 3.98 0.00 0.00 57.97 62.17 2zjq h PHE 36 Cb 0.39 0.29 -0.09 0.00 2.56 0.00 0.00 35.95 39.09 2zjq h PHE 36 CO -0.54 -0.29 0.61 0.37 -2.02 0.00 0.00 178.31 176.45 2zjq h GLN 37 N -0.19 0.77 -0.66 1.11 4.15 -0.80 0.87 115.11 120.37 2zjq h GLN 37 Ca 0.15 -0.05 0.09 0.00 0.77 0.00 0.00 58.65 59.62 2zjq h GLN 37 Cb 0.43 -0.17 -0.04 0.00 0.21 0.00 0.00 27.48 27.90 2zjq h GLN 37 CO -0.40 0.51 0.44 1.15 -1.93 0.00 0.00 178.83 178.60 2zjq h THR 38 N 0.80 0.93 0.00 2.39 2.02 -0.01 -2.54 112.91 116.50 2zjq h THR 38 Ca 0.51 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.51 2zjq h THR 38 Cb 0.74 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 2zjq h THR 38 CO -0.28 0.10 0.00 0.18 0.37 0.00 0.00 175.52 175.88 2zjq n LEU 39 N -4.48 0.39 -0.11 2.58 4.77 0.30 -2.20 117.00 118.24 2zjq n LEU 39 Ca 0.11 -0.19 -0.23 0.00 -0.03 0.00 0.00 56.01 55.66 2zjq n LEU 39 Cb 0.34 -0.19 -0.08 0.00 -2.33 0.00 0.00 43.42 41.15 2zjq n LEU 39 CO 0.33 0.10 -1.26 0.18 -1.33 0.00 0.00 177.39 175.41 2zjq n LEU 40 N -0.20 1.75 0.21 2.23 4.77 -0.96 -3.68 117.00 121.12 2zjq n LEU 40 Ca 0.00 0.23 0.05 0.00 -0.03 0.00 0.00 56.01 56.25 2zjq n LEU 40 Cb 0.10 -0.67 0.48 0.00 -2.33 0.00 0.00 43.42 41.00 2zjq n LEU 40 CO 0.00 0.51 0.89 0.78 -1.33 0.00 0.00 177.39 178.25 2zjq h ASN 41 N -0.71 0.03 -0.44 -1.43 2.35 -1.69 0.34 115.58 114.04 2zjq h ASN 41 Ca -0.56 -0.01 0.04 0.00 -0.55 0.00 0.00 56.30 55.22 2zjq h ASN 41 Cb 1.53 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 39.85 2zjq h ASN 41 CO -0.31 0.22 0.21 0.00 -1.65 0.00 0.00 177.43 175.90 2zjq h ALA 42 N 1.79 0.55 0.21 -0.83 0.00 -1.61 -1.01 119.26 118.36 2zjq h ALA 42 Ca 0.00 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2zjq h ALA 42 Cb 0.34 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2zjq h ALA 42 CO 0.02 -0.15 -0.40 0.00 0.00 0.00 0.00 179.25 178.73 2zjq h ALA 43 N 1.24 -0.77 -0.93 0.00 0.00 -0.43 0.41 119.26 118.77 2zjq h ALA 43 Ca 0.19 -0.09 0.24 0.00 0.00 0.00 0.00 54.91 55.25 2zjq h ALA 43 Cb 0.11 0.64 -0.17 0.00 0.00 0.00 0.00 17.79 18.37 2zjq h ALA 43 CO -0.14 -0.99 0.00 1.15 0.00 0.00 0.00 179.25 179.27 2zjq h THR 44 N -0.70 0.10 0.10 0.00 2.02 -0.58 -1.52 112.91 112.33 2zjq h THR 44 Ca 0.00 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2zjq h THR 44 Cb 0.69 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 2zjq h THR 44 CO -0.18 0.01 -0.05 1.88 0.37 0.00 0.00 175.52 177.55 2zjq h TYR 45 N 0.04 -0.13 0.00 3.16 0.05 -0.25 -2.96 116.97 116.88 2zjq h TYR 45 Ca 0.54 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.32 2zjq h TYR 45 Cb 1.06 0.04 0.00 0.00 1.01 0.00 0.00 36.73 38.85 2zjq h TYR 45 CO -0.50 0.30 0.00 0.39 -1.05 0.00 0.00 178.16 177.30 2zjq n GLU 46 N -4.83 0.00 0.00 4.88 1.02 0.13 -1.33 120.64 120.51 2zjq n GLU 46 Ca -0.06 0.83 0.00 0.00 -0.02 0.00 0.00 57.16 57.91 2zjq n GLU 46 Cb 0.24 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 30.41 2zjq n GLU 46 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 2zjq n TYR 47 N -2.78 0.00 0.00 -0.32 9.36 -0.66 -1.74 117.16 121.03 2zjq n TYR 47 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2zjq n TYR 47 Cb 0.00 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.71 2zjq n TYR 47 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2zjq n ARG 48 N -0.67 0.00 -0.03 2.98 1.74 -1.12 -0.44 116.66 119.12 2zjq n ARG 48 Ca 0.00 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.06 2zjq n ARG 48 Cb 0.00 -1.43 -0.13 0.00 -1.02 0.00 0.00 32.46 29.88 2zjq n ARG 48 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2zjq n ASP 49 N -0.57 0.38 0.09 0.55 9.92 -0.44 -3.41 116.55 123.07 2zjq n ASP 49 Ca 0.00 0.17 -0.08 0.00 -0.53 0.00 0.00 54.79 54.35 2zjq n ASP 49 Cb 0.00 0.82 -0.05 0.00 -0.64 0.00 0.00 41.12 41.25 2zjq n ASP 49 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 2zjq h ARG 50 N 0.00 -0.31 -1.01 -1.24 3.08 -0.80 0.39 114.38 114.49 2zjq h ARG 50 Ca -0.28 0.02 0.29 0.00 0.07 0.00 0.00 59.98 60.08 2zjq h ARG 50 Cb 1.74 0.07 -0.04 0.00 0.08 0.00 0.00 29.97 31.82 2zjq h ARG 50 CO 0.03 -0.05 0.99 0.00 -1.07 0.00 0.00 179.97 179.87 2zjq h ARG 51 N -1.02 0.00 0.00 0.04 2.47 -1.76 -2.63 114.38 111.48 2zjq h ARG 51 Ca -0.03 0.00 -0.15 0.00 -1.26 0.00 0.00 59.98 58.54 2zjq h ARG 51 Cb 0.41 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.71 2zjq h ARG 51 CO 0.05 0.00 -1.06 -1.71 0.56 0.00 0.00 179.97 177.82 2zjq n ASN 52 N -3.58 1.85 0.21 7.04 5.15 -1.05 -4.16 115.26 120.72 2zjq n ASN 52 Ca 0.22 0.50 0.06 0.00 -0.60 0.00 0.00 54.58 54.75 2zjq n ASN 52 Cb 1.31 -0.90 0.30 0.00 -0.53 0.00 0.00 39.78 39.95 2zjq n ASN 52 CO 0.00 0.00 0.00 0.07 1.40 0.00 0.00 177.26 178.73 2zjq h LYS 53 N -1.00 0.00 -0.08 1.20 2.10 0.16 1.71 116.57 120.65 2zjq h LYS 53 Ca -0.22 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.42 2zjq h LYS 53 Cb 1.00 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.33 2zjq h LYS 53 CO -0.13 0.00 -0.00 0.87 -2.00 0.00 0.00 179.45 178.18 2zjq h LYS 54 N 0.00 0.15 0.45 0.07 1.57 -1.71 -1.06 116.57 116.04 2zjq h LYS 54 Ca 0.00 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2zjq h LYS 54 Cb 1.00 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 2zjq h LYS 54 CO 0.00 0.42 -0.29 0.00 -0.57 0.00 0.00 179.45 179.01 2zjq h ARG 55 N -0.14 -0.68 0.00 3.15 3.08 0.24 -3.09 114.38 116.94 2zjq h ARG 55 Ca 0.02 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2zjq h ARG 55 Cb 0.35 0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.56 2zjq h ARG 55 CO 0.00 -0.45 0.00 -0.25 -1.07 0.00 0.00 179.97 178.20 2zjq n ASP 56 N -5.42 0.00 -0.34 7.04 10.43 -1.02 -2.57 116.55 124.67 2zjq n ASP 56 Ca -0.11 0.70 -0.04 0.00 2.57 0.00 0.00 54.79 57.92 2zjq n ASP 56 Cb 0.32 -0.20 -0.01 0.00 1.84 0.00 0.00 41.12 43.07 2zjq n ASP 56 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 2zjq n PHE 57 N -1.55 -0.11 0.19 1.24 0.99 -0.41 0.21 117.46 118.01 2zjq n PHE 57 Ca 0.00 1.05 0.16 0.00 -0.00 0.00 0.00 57.45 58.66 2zjq n PHE 57 Cb 0.00 -0.73 0.63 0.00 -1.00 0.00 0.00 39.48 38.38 2zjq n PHE 57 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2zjq h ARG 58 N 0.00 0.00 0.05 -1.08 3.08 -1.43 1.34 114.38 116.34 2zjq h ARG 58 Ca 0.24 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 60.06 2zjq h ARG 58 Cb 0.45 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.50 2zjq h ARG 58 CO -0.82 0.00 -1.03 -0.09 -1.07 0.00 0.00 179.97 176.96 2zjq h ARG 59 N 0.00 0.28 -0.13 0.04 2.43 0.27 -2.15 114.38 115.12 2zjq h ARG 59 Ca 0.12 -0.37 -0.15 0.00 -0.81 0.00 0.00 59.98 58.77 2zjq h ARG 59 Cb 1.26 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.92 2zjq h ARG 59 CO -0.00 1.10 -0.57 1.25 -1.51 0.00 0.00 179.97 180.24 2zjq h LEU 60 N 0.13 0.44 0.77 3.80 7.12 0.19 -2.38 115.31 125.39 2zjq h LEU 60 Ca -0.09 -0.24 -0.04 0.00 0.13 0.00 0.00 57.88 57.65 2zjq h LEU 60 Cb 1.70 -0.13 0.01 0.00 -0.53 0.00 0.00 40.66 41.71 2zjq h LEU 60 CO 0.17 0.92 -0.37 -0.50 -0.13 0.00 0.00 178.44 178.52 2zjq h TRP 61 N 0.30 -0.96 -0.04 1.25 4.06 -1.32 -2.99 115.95 116.24 2zjq h TRP 61 Ca 0.00 -0.02 0.03 0.00 2.06 0.00 0.00 58.89 60.96 2zjq h TRP 61 Cb 1.09 0.32 -0.03 0.00 -1.00 0.00 0.00 29.16 29.53 2zjq h TRP 61 CO 0.03 -0.58 -0.14 0.82 -3.56 0.00 0.00 178.44 175.01 2zjq h ILE 62 N -1.16 0.63 -1.11 1.49 2.04 -1.43 -0.88 117.51 117.09 2zjq h ILE 62 Ca -0.11 0.00 0.31 0.00 1.00 0.00 0.00 64.86 66.06 2zjq h ILE 62 Cb 0.81 0.63 -0.10 0.00 -0.74 0.00 0.00 36.82 37.43 2zjq h ILE 62 CO 0.17 0.00 0.72 1.56 0.00 0.00 0.00 178.15 180.60 2zjq h GLN 63 N -0.22 0.29 0.13 2.37 4.20 -1.46 -0.40 115.11 120.02 2zjq h GLN 63 Ca 0.06 -0.02 -0.21 0.00 0.06 0.00 0.00 58.65 58.54 2zjq h GLN 63 Cb 0.31 -0.07 0.01 0.00 0.30 0.00 0.00 27.48 28.03 2zjq h GLN 63 CO -0.17 0.19 -0.99 0.00 -0.67 0.00 0.00 178.83 177.18 2zjq h ARG 64 N 0.30 0.28 0.00 1.46 3.08 -1.26 -3.10 114.38 115.14 2zjq h ARG 64 Ca 0.64 -0.47 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2zjq h ARG 64 Cb 1.79 0.18 0.00 0.00 0.08 0.00 0.00 29.97 32.02 2zjq h ARG 64 CO -0.30 1.23 0.38 -0.89 -1.07 0.00 0.00 179.97 179.31 2zjq n ILE 65 N -4.07 0.58 0.00 2.04 5.41 -0.17 -0.91 119.36 122.23 2zjq n ILE 65 Ca -0.17 0.66 0.00 0.00 1.00 0.00 0.00 62.75 64.24 2zjq n ILE 65 Cb 0.84 -1.66 0.00 0.00 -0.71 0.00 0.00 39.64 38.11 2zjq n ILE 65 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 2zjq n ASN 66 N -1.71 0.13 -0.21 4.38 6.94 -1.15 -3.28 115.26 120.35 2zjq n ASN 66 Ca -0.00 -0.32 0.08 0.00 -0.02 0.00 0.00 54.58 54.31 2zjq n ASN 66 Cb 0.39 0.67 0.38 0.00 -2.36 0.00 0.00 39.78 38.86 2zjq n ASN 66 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2zjq n ALA 67 N -0.68 2.55 0.00 -2.53 0.00 -0.09 0.52 120.51 120.27 2zjq n ALA 67 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2zjq n ALA 67 Cb 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.29 2zjq n ALA 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2zjq n GLY 68 N 0.86 0.00 0.09 0.00 0.00 -0.96 -4.43 105.19 100.76 2zjq n GLY 68 Ca 0.12 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.01 2zjq n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zjq h ALA 69 N 0.00 -0.15 0.00 4.61 0.00 -1.44 -0.03 119.26 122.25 2zjq h ALA 69 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2zjq h ALA 69 Cb 0.92 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2zjq h ALA 69 CO 0.00 -0.57 0.00 0.54 0.00 0.00 0.00 179.25 179.22 2zjq n ARG 70 N -5.15 0.13 0.00 0.00 1.74 0.18 -2.01 116.66 111.56 2zjq n ARG 70 Ca -0.08 0.21 0.14 0.00 -0.77 0.00 0.00 57.85 57.34 2zjq n ARG 70 Cb 0.09 -1.50 0.74 0.00 -1.02 0.00 0.00 32.46 30.78 2zjq n ARG 70 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2zjq n LEU 71 N -1.33 0.00 0.00 0.55 7.94 -0.02 -3.50 117.00 120.63 2zjq n LEU 71 Ca 0.05 0.16 0.00 0.00 -1.11 0.00 0.00 56.01 55.11 2zjq n LEU 71 Cb 0.10 -0.16 0.00 0.00 0.53 0.00 0.00 43.42 43.89 2zjq n LEU 71 CO 0.09 -0.02 -0.30 1.41 -1.11 0.00 0.00 177.39 177.47 2zjq n HIS 72 N -1.16 0.00 0.00 1.96 8.25 -0.85 -5.04 115.22 118.38 2zjq n HIS 72 Ca 0.16 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.62 2zjq n HIS 72 Cb 0.16 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.27 2zjq n HIS 72 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2zjq n GLY 73 N 2.03 -0.90 0.00 -1.41 0.00 -1.12 -5.14 105.19 98.65 2zjq n GLY 73 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2zjq n GLY 73 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2zjq n MET 74 N 0.00 1.98 0.00 1.61 2.81 -0.99 -4.96 117.12 117.57 2zjq n MET 74 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2zjq n MET 74 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.51 2zjq n MET 74 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 2zjq n ASN 75 N 0.00 0.00 -0.10 7.83 6.94 -1.26 -4.16 115.26 124.51 2zjq n ASN 75 Ca 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 54.58 54.53 2zjq n ASN 75 Cb 0.00 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 37.40 2zjq n ASN 75 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2zjq n TYR 76 N -0.11 -0.10 -0.04 -2.53 9.36 -1.26 0.17 117.16 122.65 2zjq n TYR 76 Ca 0.00 0.29 -0.01 0.00 3.32 0.00 0.00 57.90 61.50 2zjq n TYR 76 Cb 0.00 -0.47 -0.01 0.00 -0.63 0.00 0.00 39.34 38.23 2zjq n TYR 76 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2zjq n SER 77 N -4.08 -0.10 0.15 2.98 2.88 -1.26 0.38 113.62 114.58 2zjq n SER 77 Ca 0.00 1.05 -0.14 0.00 -1.33 0.00 0.00 58.87 58.45 2zjq n SER 77 Cb 0.06 -0.46 -0.08 0.00 -0.75 0.00 0.00 64.21 62.98 2zjq n SER 77 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 2zjq h THR 78 N 0.00 0.78 -0.95 2.46 2.02 0.13 -2.53 112.91 114.83 2zjq h THR 78 Ca 0.01 -0.16 0.19 0.00 0.77 0.00 0.00 66.41 67.23 2zjq h THR 78 Cb 0.04 0.88 -0.08 0.00 -1.74 0.00 0.00 68.15 67.24 2zjq h THR 78 CO -0.09 0.04 0.61 0.15 0.37 0.00 0.00 175.52 176.60 2zjq h PHE 79 N -0.41 0.76 0.07 3.16 3.57 0.63 -2.32 116.94 122.40 2zjq h PHE 79 Ca -0.03 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.36 2zjq h PHE 79 Cb 0.31 -0.23 0.01 0.00 2.79 0.00 0.00 35.95 38.84 2zjq h PHE 79 CO -0.04 0.19 -0.54 0.82 -2.23 0.00 0.00 178.31 176.51 2zjq h ILE 80 N 0.56 1.57 -0.54 1.41 1.08 0.06 -2.98 117.51 118.68 2zjq h ILE 80 Ca 0.51 -2.36 0.07 0.00 -0.39 0.00 0.00 64.86 62.69 2zjq h ILE 80 Cb 1.04 3.11 -0.03 0.00 -3.07 0.00 0.00 36.82 37.87 2zjq h ILE 80 CO -0.25 0.66 0.36 -1.13 -0.69 0.00 0.00 178.15 177.09 2zjq h ASN 81 N -0.49 0.41 0.44 1.72 -1.24 -1.26 -1.37 115.58 113.80 2zjq h ASN 81 Ca -0.09 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 56.91 2zjq h ASN 81 Cb 1.38 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 40.33 2zjq h ASN 81 CO 0.10 0.27 -0.37 1.23 -1.29 0.00 0.00 177.43 177.36 2zjq h GLY 82 N 0.47 -1.11 0.45 1.57 0.00 -1.44 0.73 103.07 103.73 2zjq h GLY 82 Ca 0.24 0.49 0.16 0.00 0.00 0.00 0.00 47.33 48.22 2zjq h GLY 82 CO -0.06 -0.35 0.58 1.41 0.00 0.00 0.00 176.54 178.11 2zjq h LEU 83 N -0.80 0.60 -0.87 3.11 4.07 -1.32 1.07 115.31 121.18 2zjq h LEU 83 Ca -0.06 0.04 0.01 0.00 0.08 0.00 0.00 57.88 57.96 2zjq h LEU 83 Cb 0.67 -0.07 -0.04 0.00 1.08 0.00 0.00 40.66 42.30 2zjq h LEU 83 CO -0.01 0.29 0.57 0.50 -1.08 0.00 0.00 178.44 178.71 2zjq h LYS 84 N 0.63 1.12 -0.70 1.13 3.64 -0.53 -0.43 116.57 121.43 2zjq h LYS 84 Ca 0.46 -0.07 0.13 0.00 -1.27 0.00 0.00 60.65 59.91 2zjq h LYS 84 Cb 0.83 -0.25 -0.09 0.00 -0.41 0.00 0.00 32.23 32.31 2zjq h LYS 84 CO -0.21 0.74 0.23 0.00 -2.27 0.00 0.00 179.45 177.94 2zjq h ARG 85 N 1.16 0.35 -4.71 1.90 -0.00 0.76 -2.77 114.38 111.06 2zjq h ARG 85 Ca 0.32 -0.02 -0.73 0.00 -0.50 0.00 0.00 59.98 59.06 2zjq h ARG 85 Cb -0.11 -0.08 -0.19 0.00 0.00 0.00 0.00 29.97 29.60 2zjq h ARG 85 CO -0.08 0.23 1.02 0.00 0.00 0.00 0.00 179.97 181.14 2zjq s ALA 86 N -6.05 3.82 0.66 0.04 0.00 -0.17 -4.78 121.76 115.29 2zjq s ALA 86 Ca -0.13 -3.17 0.07 0.00 0.00 0.00 0.00 51.96 48.73 2zjq s ALA 86 Cb 0.20 -4.02 0.40 0.00 0.00 0.00 0.00 23.12 19.70 2zjq s ALA 86 CO 0.75 -2.78 1.23 -0.97 0.00 0.00 0.00 175.76 173.99 2zjq h ASN 87 N 7.78 0.00 -0.16 0.00 -1.24 -1.58 2.49 115.58 122.87 2zjq h ASN 87 Ca 0.23 0.00 0.04 0.00 0.71 0.00 0.00 56.30 57.29 2zjq h ASN 87 Cb 0.94 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 39.94 2zjq h ASN 87 CO 1.15 0.00 -0.13 0.40 -1.29 0.00 0.00 177.43 177.56 2zjq h ILE 88 N 0.00 0.63 -3.44 2.57 2.04 -1.86 -3.40 117.51 114.04 2zjq h ILE 88 Ca 0.00 0.00 -0.54 0.00 1.00 0.00 0.00 64.86 65.32 2zjq h ILE 88 Cb 1.67 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 38.35 2zjq h ILE 88 CO 0.00 0.00 0.27 -1.81 0.00 0.00 0.00 178.15 176.61 2zjq s ASP 89 N -5.09 7.30 -0.46 1.72 1.01 0.84 -4.98 116.67 117.00 2zjq s ASP 89 Ca -0.14 1.56 0.06 0.00 0.71 0.00 0.00 52.55 54.73 2zjq s ASP 89 Cb 0.11 -2.52 0.29 0.00 1.01 0.00 0.00 42.92 41.80 2zjq s ASP 89 CO 0.68 -0.12 1.04 0.18 0.21 0.00 0.00 175.17 177.16 2zjq n LEU 90 N 3.35 -2.51 0.00 1.23 4.77 -1.26 -4.50 117.00 118.08 2zjq n LEU 90 Ca 0.02 -3.42 0.00 0.00 -0.03 0.00 0.00 56.01 52.58 2zjq n LEU 90 Cb 0.50 0.89 0.00 0.00 -2.33 0.00 0.00 43.42 42.48 2zjq n LEU 90 CO 0.50 2.01 0.00 0.59 -1.33 0.00 0.00 177.39 179.16 2zjq n ASN 91 N 0.93 0.00 0.00 -1.43 4.13 -1.26 -4.87 115.26 112.76 2zjq n ASN 91 Ca 0.07 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.33 2zjq n ASN 91 Cb 0.67 -0.36 0.00 0.00 -1.54 0.00 0.00 39.78 38.56 2zjq n ASN 91 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2zjq n ARG 92 N -2.34 0.00 -3.05 3.52 5.12 -1.26 -4.67 116.66 113.99 2zjq n ARG 92 Ca 0.00 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.51 2zjq n ARG 92 Cb 0.00 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.25 2zjq n ARG 92 CO 0.00 0.00 0.00 -1.59 -1.93 0.00 0.00 177.63 174.11 2zjq s LYS 93 N 0.00 4.19 0.00 5.56 0.00 -1.26 -3.74 119.74 124.49 2zjq s LYS 93 Ca 0.00 0.71 0.00 0.00 0.00 0.00 0.00 55.97 56.68 2zjq s LYS 93 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 37.83 34.22 2zjq s LYS 93 CO 0.00 -0.35 0.00 0.28 0.00 0.00 0.00 175.35 175.28 2zjq n VAL 94 N 4.93 0.00 -0.25 1.79 0.31 -1.26 -4.85 118.33 118.99 2zjq n VAL 94 Ca 0.01 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.45 2zjq n VAL 94 Cb 0.49 0.00 0.22 0.00 -0.91 0.00 0.00 33.84 33.64 2zjq n VAL 94 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2zjq n LEU 95 N 0.00 -0.07 -0.13 7.52 7.94 -1.25 0.23 117.00 131.24 2zjq n LEU 95 Ca 0.00 1.24 -0.08 0.00 -1.11 0.00 0.00 56.01 56.06 2zjq n LEU 95 Cb 0.00 -0.46 0.01 0.00 0.53 0.00 0.00 43.42 43.50 2zjq n LEU 95 CO 0.00 -1.26 1.04 0.00 -1.11 0.00 0.00 177.39 176.06 2zjq h ALA 96 N 1.46 0.53 -0.46 1.96 0.00 -1.88 -2.45 119.26 118.42 2zjq h ALA 96 Ca 0.45 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.39 2zjq h ALA 96 Cb 0.94 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 2zjq h ALA 96 CO -0.68 -0.03 0.19 0.22 0.00 0.00 0.00 179.25 178.95 2zjq h ASP 97 N 0.55 0.23 -0.04 0.00 1.82 0.25 0.92 116.42 120.15 2zjq h ASP 97 Ca 0.16 0.04 0.01 0.00 -0.39 0.00 0.00 57.03 56.85 2zjq h ASP 97 Cb -0.04 0.01 -0.00 0.00 0.68 0.00 0.00 39.33 39.98 2zjq h ASP 97 CO -0.05 0.17 0.18 0.40 -1.61 0.00 0.00 179.24 178.33 2zjq h ILE 98 N 0.38 0.09 0.13 2.25 2.04 -0.79 0.45 117.51 122.06 2zjq h ILE 98 Ca 0.21 0.00 -0.30 0.00 1.00 0.00 0.00 64.86 65.78 2zjq h ILE 98 Cb 0.18 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 2zjq h ILE 98 CO -0.19 0.00 -1.42 0.00 0.00 0.00 0.00 178.15 176.53 2zjq h ALA 99 N 1.69 0.18 0.03 1.87 0.00 0.11 -2.99 119.26 120.15 2zjq h ALA 99 Ca 0.02 -1.01 -0.24 0.00 0.00 0.00 0.00 54.91 53.68 2zjq h ALA 99 Cb 0.37 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2zjq h ALA 99 CO -0.00 1.05 -1.01 0.00 0.00 0.00 0.00 179.25 179.29 2zjq h ALA 100 N 0.51 0.30 0.00 0.00 0.00 0.20 -3.43 119.26 116.84 2zjq h ALA 100 Ca -0.20 -0.75 -0.17 0.00 0.00 0.00 0.00 54.91 53.79 2zjq h ALA 100 Cb 2.01 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.76 2zjq h ALA 100 CO 0.18 0.85 -1.59 0.54 0.00 0.00 0.00 179.25 179.23 2zjq n ARG 101 N -3.70 0.24 -3.34 0.00 1.74 0.01 -4.90 116.66 106.72 2zjq n ARG 101 Ca -0.07 0.08 -0.45 0.00 -0.77 0.00 0.00 57.85 56.63 2zjq n ARG 101 Cb 0.88 -1.05 -0.00 0.00 -1.02 0.00 0.00 32.46 31.27 2zjq n ARG 101 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2zjq s GLU 102 N -2.20 4.11 0.28 5.56 8.01 -1.13 -4.88 118.70 128.45 2zjq s GLU 102 Ca -0.14 -3.10 0.01 0.00 0.01 0.00 0.00 54.97 51.75 2zjq s GLU 102 Cb 0.05 -4.54 0.55 0.00 -4.31 0.00 0.00 34.13 25.88 2zjq s GLU 102 CO 0.21 -1.25 1.84 -1.35 0.01 0.00 0.00 175.26 174.72 2zjq h PRO 103 N 6.85 0.97 -0.00 0.39 0.11 -1.84 -2.39 132.00 136.10 2zjq h PRO 103 Ca 0.17 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 66.23 2zjq h PRO 103 Cb 0.90 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.77 2zjq h PRO 103 CO 0.97 0.64 -0.18 0.93 -0.21 0.00 0.00 178.00 180.16 2zjq h GLU 104 N 1.00 -0.21 0.00 1.05 5.08 -1.90 -0.87 114.58 118.72 2zjq h GLU 104 Ca 0.50 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.87 2zjq h GLU 104 Cb 0.49 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2zjq h GLU 104 CO -0.27 -0.14 0.00 0.00 -1.00 0.00 0.00 179.01 177.60 2zjq n ALA 105 N -2.66 -0.09 -0.17 3.43 0.00 -1.04 -1.20 120.51 118.79 2zjq n ALA 105 Ca -0.02 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.56 2zjq n ALA 105 Cb 0.13 0.23 0.27 0.00 0.00 0.00 0.00 19.45 20.08 2zjq n ALA 105 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2zjq n PHE 106 N -1.69 0.54 0.22 0.00 7.35 -0.93 0.40 117.46 123.35 2zjq n PHE 106 Ca 0.00 0.62 -0.17 0.00 -0.76 0.00 0.00 57.45 57.14 2zjq n PHE 106 Cb 0.00 -1.02 -0.09 0.00 0.35 0.00 0.00 39.48 38.72 2zjq n PHE 106 CO 0.00 0.00 0.00 -0.22 -0.76 0.00 0.00 176.76 175.78 2zjq h LYS 107 N 0.00 -0.84 -0.88 -4.13 1.63 0.34 0.14 116.57 112.83 2zjq h LYS 107 Ca 0.41 0.06 0.11 0.00 -0.85 0.00 0.00 60.65 60.37 2zjq h LYS 107 Cb 1.04 0.19 -0.13 0.00 -0.60 0.00 0.00 32.23 32.73 2zjq h LYS 107 CO -0.42 -0.56 -0.49 0.00 -3.45 0.00 0.00 179.45 174.53 2zjq h ALA 108 N -0.81 -0.29 -0.60 5.00 0.00 0.80 0.52 119.26 123.87 2zjq h ALA 108 Ca -0.04 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2zjq h ALA 108 Cb 0.79 1.16 -0.03 0.00 0.00 0.00 0.00 17.79 19.71 2zjq h ALA 108 CO -0.14 -0.83 0.39 -0.07 0.00 0.00 0.00 179.25 178.59 2zjq h LEU 109 N -0.07 0.71 0.00 0.00 3.38 -1.32 0.55 115.31 118.55 2zjq h LEU 109 Ca 0.22 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2zjq h LEU 109 Cb 0.51 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2zjq h LEU 109 CO -0.88 0.53 0.00 0.52 0.09 0.00 0.00 178.44 178.70 2zjq n VAL 110 N -4.65 0.00 -0.26 1.22 0.31 0.46 -1.31 118.33 114.10 2zjq n VAL 110 Ca 0.04 1.05 0.28 0.00 -0.01 0.00 0.00 64.34 65.71 2zjq n VAL 110 Cb 0.03 -1.79 0.66 0.00 -0.91 0.00 0.00 33.84 31.83 2zjq n VAL 110 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 2zjq h ASP 111 N 0.00 0.15 -0.97 4.52 3.58 -1.32 0.32 116.42 122.71 2zjq h ASP 111 Ca 0.00 0.03 0.14 0.00 0.42 0.00 0.00 57.03 57.61 2zjq h ASP 111 Cb 0.00 -0.00 -0.08 0.00 1.72 0.00 0.00 39.33 40.97 2zjq h ASP 111 CO 0.00 0.04 0.61 0.00 -2.88 0.00 0.00 179.24 177.01 2zjq h ALA 112 N 1.53 1.64 0.20 -0.78 0.00 0.87 -2.41 119.26 120.32 2zjq h ALA 112 Ca 0.51 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.44 2zjq h ALA 112 Cb 1.77 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.39 2zjq h ALA 112 CO -0.10 0.10 -0.10 1.03 0.00 0.00 0.00 179.25 180.19 2zjq h SER 113 N 0.87 -0.23 -1.53 0.00 0.87 0.96 -3.18 113.55 111.32 2zjq h SER 113 Ca 0.49 -0.29 0.48 0.00 -1.23 0.00 0.00 61.79 61.25 2zjq h SER 113 Cb 0.61 0.06 -0.11 0.00 -0.44 0.00 0.00 62.40 62.52 2zjq h SER 113 CO -0.26 0.29 1.04 -0.09 -0.53 0.00 0.00 176.83 177.28 2zjq h ARG 114 N -0.89 0.04 -2.12 2.24 2.43 -1.34 1.13 114.38 115.86 2zjq h ARG 114 Ca -0.03 -0.00 -0.76 0.00 -0.81 0.00 0.00 59.98 58.38 2zjq h ARG 114 Cb 0.50 -0.01 -0.26 0.00 -0.42 0.00 0.00 29.97 29.79 2zjq h ARG 114 CO 0.05 0.03 1.07 0.09 -1.51 0.00 0.00 179.97 179.69 2zjq n ASN 115 N -4.43 7.43 -0.02 -3.80 3.02 -0.93 -2.32 115.26 114.20 2zjq n ASN 115 Ca 0.39 -3.71 0.00 0.00 -0.03 0.00 0.00 54.58 51.23 2zjq n ASN 115 Cb 1.63 -1.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 2zjq n ASN 115 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2zjq n ALA 116 N -0.17 0.48 -2.00 5.41 0.00 0.38 -4.97 120.51 119.64 2zjq n ALA 116 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.96 2zjq n ALA 116 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.71 2zjq n ALA 116 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2zjq n ARG 117 N 0.00 0.00 0.00 0.00 0.63 -0.72 -4.83 116.66 111.74 2zjq n ARG 117 Ca 0.00 0.00 0.15 0.00 -0.92 0.00 0.00 57.85 57.08 2zjq n ARG 117 Cb 0.22 0.00 0.73 0.00 0.45 0.00 0.00 32.46 33.86 2zjq n ARG 117 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16