#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dzq n SER 2 N 0.00 -2.50 -3.91 1.61 7.64 -1.26 -4.99 113.62 110.21 2dzq n SER 2 Ca 0.00 0.61 -0.10 0.00 1.01 0.00 0.00 58.87 60.39 2dzq n SER 2 Cb 0.00 2.49 -0.11 0.00 -1.01 0.00 0.00 64.21 65.58 2dzq n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dzq s SER 3 N -2.00 0.10 0.00 6.43 1.04 -1.26 -5.00 113.70 113.01 2dzq s SER 3 Ca 0.00 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.16 2dzq s SER 3 Cb 0.00 0.15 0.00 0.00 0.10 0.00 0.00 66.02 66.27 2dzq s SER 3 CO 0.00 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 174.56 2dzq n GLY 4 N 1.83 1.06 3.73 7.32 0.00 -1.26 -4.93 105.19 112.93 2dzq n GLY 4 Ca -0.21 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 44.87 2dzq n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dzq s SER 5 N -4.00 7.17 -1.19 1.61 0.15 -1.26 -4.91 113.70 111.27 2dzq s SER 5 Ca 0.00 2.08 -0.19 0.00 0.70 0.00 0.00 55.95 58.54 2dzq s SER 5 Cb 0.00 -2.60 -0.03 0.00 -1.71 0.00 0.00 66.02 61.69 2dzq s SER 5 CO 0.00 -0.34 1.96 -0.24 1.20 0.00 0.00 173.24 175.82 2dzq n SER 6 N 2.95 3.65 0.00 5.45 2.88 -1.26 -4.54 113.62 122.75 2dzq n SER 6 Ca 0.05 -2.79 0.07 0.00 -1.33 0.00 0.00 58.87 54.87 2dzq n SER 6 Cb 0.46 -1.57 0.36 0.00 -0.75 0.00 0.00 64.21 62.71 2dzq n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dzq n GLY 7 N 4.93 -0.75 0.15 0.46 0.00 -1.26 -2.91 105.19 105.81 2dzq n GLY 7 Ca 0.49 -0.07 -0.07 0.00 0.00 0.00 0.00 46.02 46.37 2dzq n GLY 7 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dzq h LEU 8 N 0.00 0.20 -0.85 0.99 3.38 -1.96 -2.70 115.31 114.36 2dzq h LEU 8 Ca 0.00 0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.08 2dzq h LEU 8 Cb 0.13 -0.01 -0.11 0.00 0.09 0.00 0.00 40.66 40.76 2dzq h LEU 8 CO 0.00 0.15 -0.46 0.54 0.09 0.00 0.00 178.44 178.76 2dzq n ARG 9 N -4.98 -0.33 -0.15 1.13 1.74 -1.15 0.20 116.66 113.12 2dzq n ARG 9 Ca 0.00 1.29 -0.03 0.00 -0.77 0.00 0.00 57.85 58.34 2dzq n ARG 9 Cb 0.09 -1.90 0.06 0.00 -1.02 0.00 0.00 32.46 29.69 2dzq n ARG 9 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2dzq h LYS 10 N 0.00 0.29 0.14 5.56 1.79 -1.74 0.16 116.57 122.78 2dzq h LYS 10 Ca 0.18 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.63 2dzq h LYS 10 Cb 0.39 -0.07 -0.00 0.00 -1.58 0.00 0.00 32.23 30.97 2dzq h LYS 10 CO -0.81 0.19 -0.09 1.96 -1.08 0.00 0.00 179.45 179.62 2dzq h GLN 11 N 0.30 -0.23 -0.04 3.15 4.20 0.18 -2.27 115.11 120.40 2dzq h GLN 11 Ca 0.24 0.02 0.04 0.00 0.06 0.00 0.00 58.65 59.00 2dzq h GLN 11 Cb 0.27 0.05 -0.06 0.00 0.30 0.00 0.00 27.48 28.05 2dzq h GLN 11 CO -0.27 -0.15 -0.37 0.28 -0.67 0.00 0.00 178.83 177.65 2dzq h VAL 12 N -0.24 0.22 -0.86 -0.54 2.07 0.29 -0.15 116.25 117.05 2dzq h VAL 12 Ca -0.01 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.67 2dzq h VAL 12 Cb 0.20 0.22 -0.16 0.00 -1.52 0.00 0.00 31.29 30.04 2dzq h VAL 12 CO 0.01 0.00 -0.27 -0.33 0.02 0.00 0.00 177.57 176.99 2dzq h GLU 13 N -0.50 -0.02 -0.60 1.57 5.08 -0.52 0.96 114.58 120.55 2dzq h GLU 13 Ca 0.07 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.47 2dzq h GLU 13 Cb 0.60 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.81 2dzq h GLU 13 CO -0.32 -0.02 0.34 1.25 -1.00 0.00 0.00 179.01 179.26 2dzq h LEU 14 N -0.03 0.52 0.44 1.33 5.85 -0.67 1.07 115.31 123.82 2dzq h LEU 14 Ca 0.38 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 59.10 2dzq h LEU 14 Cb 0.62 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.56 2dzq h LEU 14 CO -0.89 0.35 -0.27 0.25 -0.34 0.00 0.00 178.44 177.54 2dzq h LEU 15 N 0.65 -0.69 -0.25 2.25 5.85 0.25 1.59 115.31 124.95 2dzq h LEU 15 Ca 0.26 0.04 0.06 0.00 0.84 0.00 0.00 57.88 59.07 2dzq h LEU 15 Cb 0.12 0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.29 2dzq h LEU 15 CO -0.15 -0.42 -0.12 -0.26 -0.34 0.00 0.00 178.44 177.16 2dzq h PHE 16 N -0.67 -0.28 -0.15 1.25 -1.00 -0.06 0.79 116.94 116.82 2dzq h PHE 16 Ca -0.06 0.03 0.03 0.00 2.81 0.00 0.00 57.97 60.77 2dzq h PHE 16 Cb 0.54 0.16 -0.02 0.00 3.61 0.00 0.00 35.95 40.24 2dzq h PHE 16 CO -0.01 -0.18 -0.01 -0.91 -1.61 0.00 0.00 178.31 175.59 2dzq h ASN 17 N -0.08 -0.08 -0.10 2.17 4.21 0.13 0.18 115.58 122.00 2dzq h ASN 17 Ca 0.13 0.04 0.02 0.00 1.21 0.00 0.00 56.30 57.70 2dzq h ASN 17 Cb 0.28 0.07 -0.02 0.00 -1.12 0.00 0.00 38.32 37.53 2dzq h ASN 17 CO -0.30 -0.02 -0.02 0.74 -1.29 0.00 0.00 177.43 176.53 2dzq h THR 18 N 0.03 0.90 -0.57 2.81 2.02 0.31 -1.85 112.91 116.56 2dzq h THR 18 Ca 0.07 -0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.32 2dzq h THR 18 Cb 0.09 0.90 -0.06 0.00 -1.74 0.00 0.00 68.15 67.34 2dzq h THR 18 CO -0.13 0.00 0.24 0.03 0.37 0.00 0.00 175.52 176.03 2dzq h ARG 19 N 0.00 0.43 -0.68 6.66 2.47 0.99 -1.50 114.38 122.75 2dzq h ARG 19 Ca 0.05 -0.03 0.12 0.00 -1.26 0.00 0.00 59.98 58.86 2dzq h ARG 19 Cb 0.07 -0.10 -0.08 0.00 -1.65 0.00 0.00 29.97 28.21 2dzq h ARG 19 CO -0.10 0.28 0.25 -0.92 0.56 0.00 0.00 179.97 180.04 2dzq h TYR 20 N 0.44 0.44 -0.57 3.04 3.20 -0.13 -0.66 116.97 122.73 2dzq h TYR 20 Ca 0.27 0.03 0.12 0.00 3.14 0.00 0.00 58.73 62.29 2dzq h TYR 20 Cb 0.28 -0.09 -0.10 0.00 1.54 0.00 0.00 36.73 38.36 2dzq h TYR 20 CO -0.14 0.07 -0.10 0.00 -1.64 0.00 0.00 178.16 176.35 2dzq h ALA 21 N 1.49 0.43 -0.23 1.82 0.00 -0.63 1.03 119.26 123.16 2dzq h ALA 21 Ca 0.36 0.21 0.06 0.00 0.00 0.00 0.00 54.91 55.54 2dzq h ALA 21 Cb 0.50 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2dzq h ALA 21 CO -0.36 -0.42 0.17 -0.22 0.00 0.00 0.00 179.25 178.41 2dzq h LYS 22 N 0.03 0.03 0.00 0.00 3.64 -1.00 1.81 116.57 121.08 2dzq h LYS 22 Ca 0.28 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 2dzq h LYS 22 Cb 0.44 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 2dzq h LYS 22 CO -0.56 0.02 0.00 0.00 -2.27 0.00 0.00 179.45 176.64 2dzq h ALA 23 N 1.88 1.00 -0.01 5.00 0.00 0.16 -2.62 119.26 124.67 2dzq h ALA 23 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2dzq h ALA 23 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2dzq h ALA 23 CO -0.01 0.00 0.00 0.44 0.00 0.00 0.00 179.25 179.68 2dzq n ILE 24 N -2.48 0.84 -2.52 0.00 -5.35 0.26 -4.88 119.36 105.22 2dzq n ILE 24 Ca 0.03 -0.92 -0.14 0.00 -0.27 0.00 0.00 62.75 61.45 2dzq n ILE 24 Cb 0.33 0.58 0.01 0.00 -1.74 0.00 0.00 39.64 38.82 2dzq n ILE 24 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dzq n GLY 25 N -0.38 -0.14 3.73 3.28 0.00 0.40 -5.01 105.19 107.08 2dzq n GLY 25 Ca 0.00 -0.25 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 2dzq n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dzq s ILE 26 N -2.82 4.47 -0.02 -0.61 1.01 0.52 -4.92 121.20 118.83 2dzq s ILE 26 Ca 0.11 -0.41 -0.08 0.00 0.00 0.00 0.00 60.65 60.26 2dzq s ILE 26 Cb -0.05 -2.99 -0.30 0.00 0.01 0.00 0.00 42.46 39.13 2dzq s ILE 26 CO 0.13 0.43 0.77 0.28 0.00 0.00 0.00 174.94 176.55 2dzq h SER 27 N 4.45 0.54 -4.01 3.58 0.02 -1.94 -3.12 113.55 113.07 2dzq h SER 27 Ca -0.50 -0.77 -0.50 0.00 -0.84 0.00 0.00 61.79 59.18 2dzq h SER 27 Cb 1.18 -0.18 0.05 0.00 0.14 0.00 0.00 62.40 63.60 2dzq h SER 27 CO 0.59 1.64 0.28 -1.83 -1.14 0.00 0.00 176.83 176.37 2dzq s GLU 28 N -2.60 3.58 0.15 3.45 -1.05 -1.26 -4.96 118.70 116.01 2dzq s GLU 28 Ca -0.13 0.51 -0.30 0.00 -0.15 0.00 0.00 54.97 54.90 2dzq s GLU 28 Cb 0.06 -2.21 -0.07 0.00 -0.44 0.00 0.00 34.13 31.47 2dzq s GLU 28 CO 0.86 -0.41 1.13 -1.25 0.95 0.00 0.00 175.26 176.54 2dzq s PRO 29 N -4.98 4.55 0.34 -4.83 0.04 -1.26 -4.48 135.00 124.38 2dzq s PRO 29 Ca 0.52 1.74 0.08 0.00 0.04 0.00 0.00 61.00 63.38 2dzq s PRO 29 Cb -0.11 -3.29 -0.07 0.00 0.04 0.00 0.00 34.50 31.08 2dzq s PRO 29 CO 0.50 -0.01 -0.06 0.08 0.04 0.00 0.00 177.00 177.54 2dzq s VAL 30 N 0.07 2.02 0.58 -0.36 1.01 -0.76 -4.85 120.40 118.11 2dzq s VAL 30 Ca 0.52 -2.15 -0.19 0.00 0.00 0.00 0.00 61.98 60.17 2dzq s VAL 30 Cb -0.30 -2.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 2dzq s VAL 30 CO 0.34 -0.18 1.15 -0.54 0.00 0.00 0.00 175.10 175.87 2dzq s LYS 31 N -3.67 3.14 -0.24 2.72 1.02 -1.26 -4.05 119.74 117.41 2dzq s LYS 31 Ca 0.32 1.65 -0.04 0.00 0.02 0.00 0.00 55.97 57.92 2dzq s LYS 31 Cb 0.04 -1.97 0.00 0.00 -0.52 0.00 0.00 37.83 35.38 2dzq s LYS 31 CO 0.16 -1.03 -0.02 0.08 -0.92 0.00 0.00 175.35 173.62 2dzq s VAL 32 N -1.80 3.36 -1.12 3.17 1.01 -1.26 -4.96 120.40 118.81 2dzq s VAL 32 Ca 0.73 -0.66 -0.16 0.00 0.00 0.00 0.00 61.98 61.89 2dzq s VAL 32 Cb -0.25 -2.61 -0.07 0.00 0.00 0.00 0.00 36.38 33.45 2dzq s VAL 32 CO 0.31 0.31 2.14 -0.81 0.00 0.00 0.00 175.10 177.05 2dzq n PRO 33 N 4.78 2.25 -0.34 2.72 -0.04 -1.26 -4.77 135.00 138.34 2dzq n PRO 33 Ca -0.17 -2.12 -0.07 0.00 -0.04 0.00 0.00 63.50 61.10 2dzq n PRO 33 Cb 0.49 -3.00 -0.05 0.00 -0.04 0.00 0.00 33.50 30.90 2dzq n PRO 33 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2dzq n TYR 34 N 6.29 -0.27 -0.35 0.54 4.01 -1.26 0.40 117.16 126.53 2dzq n TYR 34 Ca 0.52 1.03 -0.06 0.00 -0.16 0.00 0.00 57.90 59.24 2dzq n TYR 34 Cb 0.36 -0.63 -0.02 0.00 -0.31 0.00 0.00 39.34 38.74 2dzq n TYR 34 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 2dzq h SER 35 N 0.00 -1.66 -0.87 7.72 0.02 -1.97 1.74 113.55 118.52 2dzq h SER 35 Ca 0.17 0.30 0.22 0.00 -0.84 0.00 0.00 61.79 61.64 2dzq h SER 35 Cb 0.38 0.80 -0.13 0.00 0.14 0.00 0.00 62.40 63.59 2dzq h SER 35 CO -0.79 -0.28 0.32 0.11 -1.14 0.00 0.00 176.83 175.05 2dzq h LYS 36 N -0.06 0.32 0.00 3.45 1.79 -0.44 1.70 116.57 123.32 2dzq h LYS 36 Ca 0.25 -0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 58.64 2dzq h LYS 36 Cb 0.53 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.10 2dzq h LYS 36 CO -0.89 0.21 -0.27 0.74 -1.08 0.00 0.00 179.45 178.15 2dzq h PHE 37 N 0.32 0.00 0.05 -1.35 -1.00 0.20 0.01 116.94 115.17 2dzq h PHE 37 Ca 0.54 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 61.32 2dzq h PHE 37 Cb 1.04 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.60 2dzq h PHE 37 CO -0.19 0.27 -0.02 -0.07 -1.61 0.00 0.00 178.31 176.69 2dzq h LEU 38 N 0.00 -0.06 -1.57 1.54 3.38 1.09 -2.21 115.31 117.48 2dzq h LEU 38 Ca -0.00 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 2dzq h LEU 38 Cb 1.09 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.85 2dzq h LEU 38 CO 0.04 0.53 -0.13 0.24 0.09 0.00 0.00 178.44 179.20 2dzq h MET 39 N -1.00 0.00 -2.10 1.13 2.86 0.18 -3.26 114.93 112.74 2dzq h MET 39 Ca -0.01 0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 57.06 2dzq h MET 39 Cb 0.26 0.00 -0.41 0.00 0.06 0.00 0.00 31.60 31.52 2dzq h MET 39 CO 0.01 0.13 -0.87 0.72 1.06 0.00 0.00 176.91 177.97 2dzq n HIS 40 N -3.40 1.63 0.29 -0.22 8.25 -0.01 -4.88 115.22 116.88 2dzq n HIS 40 Ca -0.01 -3.86 0.14 0.00 -0.26 0.00 0.00 57.72 53.74 2dzq n HIS 40 Cb 0.32 -0.45 0.44 0.00 1.12 0.00 0.00 29.99 31.41 2dzq n HIS 40 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2dzq h PRO 41 N 3.98 0.00 0.18 -0.41 0.13 -1.44 0.35 132.00 134.78 2dzq h PRO 41 Ca 0.13 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.93 2dzq h PRO 41 Cb 0.77 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.91 2dzq h PRO 41 CO 0.65 0.00 -1.61 0.93 -0.23 0.00 0.00 178.00 177.73 2dzq h GLU 42 N 0.00 0.37 0.00 0.86 5.08 -1.90 -3.38 114.58 115.62 2dzq h GLU 42 Ca 0.00 -0.64 -0.05 0.00 -1.00 0.00 0.00 59.36 57.67 2dzq h GLU 42 Cb 0.72 0.24 -0.01 0.00 0.50 0.00 0.00 28.75 30.20 2dzq h GLU 42 CO 0.00 1.27 -0.33 0.93 -1.00 0.00 0.00 179.01 179.88 2dzq h GLU 43 N 0.10 0.00 -4.98 2.33 3.07 -1.92 -3.45 114.58 109.74 2dzq h GLU 43 Ca -0.29 0.00 -0.66 0.00 -0.50 0.00 0.00 59.36 57.91 2dzq h GLU 43 Cb 2.08 0.00 -0.28 0.00 -0.84 0.00 0.00 28.75 29.71 2dzq h GLU 43 CO 0.19 0.72 -0.72 -0.51 -1.40 0.00 0.00 179.01 177.29 2dzq s LEU 44 N -8.21 2.97 0.00 1.33 1.43 0.12 -1.65 118.68 114.68 2dzq s LEU 44 Ca -0.17 -0.45 -0.03 0.00 -1.03 0.00 0.00 54.13 52.45 2dzq s LEU 44 Cb 0.00 -1.74 0.01 0.00 0.03 0.00 0.00 46.19 44.49 2dzq s LEU 44 CO 0.49 -0.04 0.46 2.22 0.23 0.00 0.00 176.35 179.71 2dzq n PHE 45 N 4.79 -1.43 -4.67 0.29 1.16 -1.13 -3.81 117.46 112.64 2dzq n PHE 45 Ca -0.18 -2.01 -0.23 0.00 -1.87 0.00 0.00 57.45 53.17 2dzq n PHE 45 Cb 0.50 0.52 -0.15 0.00 -1.61 0.00 0.00 39.48 38.74 2dzq n PHE 45 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 2dzq s VAL 46 N -2.70 1.16 0.21 1.97 1.01 -1.26 -1.80 120.40 118.98 2dzq s VAL 46 Ca 0.24 -0.61 0.11 0.00 0.00 0.00 0.00 61.98 61.72 2dzq s VAL 46 Cb -0.01 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 2dzq s VAL 46 CO 0.17 0.33 -0.20 0.68 0.00 0.00 0.00 175.10 176.09 2dzq s VAL 47 N -0.20 2.58 0.00 2.92 -7.23 0.25 -4.65 120.40 114.06 2dzq s VAL 47 Ca 0.03 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.18 2dzq s VAL 47 Cb -0.07 -2.27 0.00 0.00 0.56 0.00 0.00 36.38 34.60 2dzq s VAL 47 CO 0.00 -0.17 0.00 0.61 -0.31 0.00 0.00 175.10 175.23 2dzq n GLY 48 N 0.04 3.33 3.29 2.32 0.00 -1.26 0.18 105.19 113.09 2dzq n GLY 48 Ca -0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 2dzq n GLY 48 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dzq n LEU 49 N 0.00 -2.28 0.00 0.99 4.77 -1.26 -4.17 117.00 115.05 2dzq n LEU 49 Ca 0.00 0.53 -0.23 0.00 -0.03 0.00 0.00 56.01 56.28 2dzq n LEU 49 Cb 0.00 -0.98 0.18 0.00 -2.33 0.00 0.00 43.42 40.28 2dzq n LEU 49 CO 0.00 -4.35 0.58 -0.81 -1.33 0.00 0.00 177.39 171.48 2dzq n PRO 50 N 0.77 -1.83 -2.68 3.23 -0.04 -1.26 -4.99 135.00 128.21 2dzq n PRO 50 Ca 0.07 -1.48 -0.39 0.00 -0.04 0.00 0.00 63.50 61.66 2dzq n PRO 50 Cb 0.50 -1.17 -0.06 0.00 -0.04 0.00 0.00 33.50 32.74 2dzq n PRO 50 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2dzq s GLU 51 N -5.09 4.68 -1.24 0.54 2.56 -1.26 -3.37 118.70 115.51 2dzq s GLU 51 Ca 0.57 1.52 0.00 0.00 0.00 0.00 0.00 54.97 57.06 2dzq s GLU 51 Cb -0.03 -3.08 0.00 0.00 2.00 0.00 0.00 34.13 33.02 2dzq s GLU 51 CO 0.42 0.33 0.00 0.41 -0.56 0.00 0.00 175.26 175.86 2dzq n GLY 52 N 1.10 -0.22 3.13 -1.50 0.00 -1.26 -5.00 105.19 101.45 2dzq n GLY 52 Ca -0.00 -0.28 -0.13 0.00 0.00 0.00 0.00 46.02 45.62 2dzq n GLY 52 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dzq s ILE 53 N -2.72 0.01 0.00 -0.61 1.01 -1.22 -5.12 121.20 112.55 2dzq s ILE 53 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 60.65 60.54 2dzq s ILE 53 Cb 0.00 -0.38 0.00 0.00 0.01 0.00 0.00 42.46 42.09 2dzq s ILE 53 CO 0.00 -0.06 0.00 -0.24 0.00 0.00 0.00 174.94 174.64 2dzq n SER 54 N 2.65 0.03 -4.42 3.58 2.88 -1.26 -4.56 113.62 112.52 2dzq n SER 54 Ca -0.14 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.00 2dzq n SER 54 Cb 0.58 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.93 2dzq n SER 54 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 2dzq s LEU 55 N 0.00 4.47 0.23 2.46 2.96 -1.26 -5.03 118.68 122.50 2dzq s LEU 55 Ca 0.00 -0.75 -0.22 0.00 -0.22 0.00 0.00 54.13 52.94 2dzq s LEU 55 Cb 0.00 -2.03 0.04 0.00 0.50 0.00 0.00 46.19 44.70 2dzq s LEU 55 CO 0.00 -0.30 0.72 -0.13 -1.32 0.00 0.00 176.35 175.33 2dzq s ARG 56 N 1.60 1.57 0.13 1.98 0.52 -1.26 -4.96 118.95 118.53 2dzq s ARG 56 Ca 0.04 -0.80 -0.34 0.00 -0.52 0.00 0.00 55.73 54.10 2dzq s ARG 56 Cb -0.18 0.58 -0.16 0.00 0.52 0.00 0.00 34.95 35.70 2dzq s ARG 56 CO 0.07 -0.71 1.18 0.54 0.02 0.00 0.00 175.30 176.40 2dzq n ARG 57 N -0.43 0.99 -1.12 3.54 1.74 -1.26 -4.76 116.66 115.36 2dzq n ARG 57 Ca -0.08 0.35 -0.33 0.00 -0.77 0.00 0.00 57.85 57.03 2dzq n ARG 57 Cb 0.61 -1.88 -0.02 0.00 -1.02 0.00 0.00 32.46 30.15 2dzq n ARG 57 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2dzq n PRO 58 N 1.93 2.57 0.00 5.56 -0.04 -1.26 -2.79 135.00 140.97 2dzq n PRO 58 Ca 0.17 -1.90 0.00 0.00 -0.04 0.00 0.00 63.50 61.72 2dzq n PRO 58 Cb 0.21 -2.75 0.00 0.00 -0.04 0.00 0.00 33.50 30.92 2dzq n PRO 58 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2dzq n ASN 59 N 4.84 0.00 0.31 3.54 6.94 -1.26 -4.50 115.26 125.12 2dzq n ASN 59 Ca 0.56 0.00 0.19 0.00 -0.02 0.00 0.00 54.58 55.32 2dzq n ASN 59 Cb 0.24 0.17 1.05 0.00 -2.36 0.00 0.00 39.78 38.88 2dzq n ASN 59 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2dzq s PHE 61 N -4.36 1.46 0.16 0.00 0.40 -1.26 -5.08 117.98 109.30 2dzq s PHE 61 Ca -0.05 0.34 0.07 0.00 -0.60 0.00 0.00 56.93 56.68 2dzq s PHE 61 Cb 0.14 -4.05 -0.04 0.00 0.51 0.00 0.00 43.02 39.58 2dzq s PHE 61 CO 0.46 -2.80 0.02 0.20 0.70 0.00 0.00 175.22 173.80 2dzq s GLY 62 N -4.78 1.75 0.18 4.36 0.00 -1.26 -4.91 107.32 102.66 2dzq s GLY 62 Ca 0.74 -1.31 -0.25 0.00 0.00 0.00 0.00 44.72 43.89 2dzq s GLY 62 CO 0.53 -1.33 1.55 -2.22 0.00 0.00 0.00 173.10 171.64 2dzq h ILE 63 N 2.43 0.02 -0.62 0.90 5.03 -1.98 1.11 117.51 124.41 2dzq h ILE 63 Ca -0.47 0.00 0.12 0.00 -0.12 0.00 0.00 64.86 64.39 2dzq h ILE 63 Cb 1.20 0.02 -0.12 0.00 -3.03 0.00 0.00 36.82 34.89 2dzq h ILE 63 CO 0.59 0.00 -0.17 0.00 -0.68 0.00 0.00 178.15 177.89 2dzq h ALA 64 N 0.77 0.39 0.98 1.87 0.00 -1.99 0.25 119.26 121.52 2dzq h ALA 64 Ca 0.22 0.24 -0.05 0.00 0.00 0.00 0.00 54.91 55.32 2dzq h ALA 64 Cb 0.52 0.49 0.01 0.00 0.00 0.00 0.00 17.79 18.81 2dzq h ALA 64 CO -0.86 -0.44 -0.47 0.87 0.00 0.00 0.00 179.25 178.35 2dzq h LYS 65 N -0.01 -1.27 -0.98 0.00 1.57 -0.18 -0.64 116.57 115.06 2dzq h LYS 65 Ca 0.30 0.09 0.24 0.00 -1.87 0.00 0.00 60.65 59.40 2dzq h LYS 65 Cb 0.46 0.29 -0.18 0.00 0.08 0.00 0.00 32.23 32.88 2dzq h LYS 65 CO -0.65 -0.84 -0.09 1.28 -0.57 0.00 0.00 179.45 178.58 2dzq n LEU 66 N -5.60 -0.22 0.41 2.94 4.77 0.32 0.20 117.00 119.83 2dzq n LEU 66 Ca -0.16 1.67 -0.19 0.00 -0.03 0.00 0.00 56.01 57.30 2dzq n LEU 66 Cb 0.52 -0.56 -0.09 0.00 -2.33 0.00 0.00 43.42 40.95 2dzq n LEU 66 CO 0.39 -1.65 0.61 0.03 -1.33 0.00 0.00 177.39 175.44 2dzq h ARG 67 N 0.00 -1.01 -0.71 3.23 3.08 -0.23 -1.56 114.38 117.19 2dzq h ARG 67 Ca 0.54 0.07 0.06 0.00 0.07 0.00 0.00 59.98 60.72 2dzq h ARG 67 Cb 1.01 0.23 -0.09 0.00 0.08 0.00 0.00 29.97 31.20 2dzq h ARG 67 CO -0.96 -0.67 -0.45 -0.22 -1.07 0.00 0.00 179.97 176.60 2dzq h LYS 68 N -1.05 -0.04 -0.65 0.04 1.63 0.13 1.16 116.57 117.79 2dzq h LYS 68 Ca -0.10 0.00 0.12 0.00 -0.85 0.00 0.00 60.65 59.83 2dzq h LYS 68 Cb 0.82 0.01 -0.12 0.00 -0.60 0.00 0.00 32.23 32.33 2dzq h LYS 68 CO 0.15 -0.03 -0.26 0.82 -3.45 0.00 0.00 179.45 176.68 2dzq h ILE 69 N -0.05 0.23 -0.97 2.00 2.04 -1.05 1.04 117.51 120.75 2dzq h ILE 69 Ca 0.11 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.05 2dzq h ILE 69 Cb 0.34 0.23 -0.07 0.00 -0.74 0.00 0.00 36.82 36.58 2dzq h ILE 69 CO -0.69 0.00 0.62 -0.07 0.00 0.00 0.00 178.15 178.02 2dzq h LEU 70 N -0.08 0.96 -1.21 1.44 3.38 0.88 0.31 115.31 120.98 2dzq h LEU 70 Ca 0.28 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.22 2dzq h LEU 70 Cb 0.54 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2dzq h LEU 70 CO -0.70 0.59 -0.25 -0.33 0.09 0.00 0.00 178.44 177.84 2dzq h GLU 71 N 1.07 0.00 -0.60 1.13 5.08 0.83 -2.51 114.58 119.58 2dzq h GLU 71 Ca 0.43 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.47 2dzq h GLU 71 Cb 0.27 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 29.33 2dzq h GLU 71 CO -0.18 0.25 0.18 0.00 -1.00 0.00 0.00 179.01 178.25 2dzq n ALA 72 N -2.26 4.86 0.29 3.43 0.00 0.28 -4.69 120.51 122.42 2dzq n ALA 72 Ca -0.00 -3.10 -0.11 0.00 0.00 0.00 0.00 53.44 50.22 2dzq n ALA 72 Cb 0.42 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.81 2dzq n ALA 72 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2dzq h SER 73 N 1.06 -0.63 -0.89 0.00 0.87 -0.35 0.59 113.55 114.20 2dzq h SER 73 Ca 0.38 0.02 0.24 0.00 -1.23 0.00 0.00 61.79 61.21 2dzq h SER 73 Cb 2.05 0.16 -0.14 0.00 -0.44 0.00 0.00 62.40 64.03 2dzq h SER 73 CO 0.68 -0.40 0.28 0.78 -0.53 0.00 0.00 176.83 177.64 2dzq h ASN 74 N -0.85 0.07 -0.09 6.23 2.35 -1.83 0.34 115.58 121.80 2dzq h ASN 74 Ca -0.08 0.19 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 2dzq h ASN 74 Cb 0.57 0.25 -0.00 0.00 0.05 0.00 0.00 38.32 39.18 2dzq h ASN 74 CO 0.12 -0.14 0.02 0.28 -1.65 0.00 0.00 177.43 176.06 2dzq h SER 75 N 0.23 0.13 -2.67 5.81 0.02 -1.85 -3.44 113.55 111.78 2dzq h SER 75 Ca 0.57 -0.25 -0.56 0.00 -0.84 0.00 0.00 61.79 60.71 2dzq h SER 75 Cb 1.16 -0.04 0.20 0.00 0.14 0.00 0.00 62.40 63.87 2dzq h SER 75 CO -0.64 0.35 -0.95 -0.38 -1.14 0.00 0.00 176.83 174.06 2dzq n ILE 76 N -4.88 0.72 -3.62 3.27 5.41 0.21 -4.20 119.36 116.27 2dzq n ILE 76 Ca -0.06 -0.42 -0.02 0.00 1.00 0.00 0.00 62.75 63.25 2dzq n ILE 76 Cb 0.16 -0.38 -0.06 0.00 -0.71 0.00 0.00 39.64 38.65 2dzq n ILE 76 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 2dzq s GLN 77 N -2.30 0.34 -0.68 0.38 0.74 0.48 -4.86 119.66 113.76 2dzq s GLN 77 Ca 0.56 0.60 -0.21 0.00 0.05 0.00 0.00 55.36 56.36 2dzq s GLN 77 Cb -0.32 0.10 0.09 0.00 1.10 0.00 0.00 33.01 33.98 2dzq s GLN 77 CO 0.67 -0.07 0.91 -0.06 -0.55 0.00 0.00 175.29 176.19 2dzq s PHE 78 N 1.41 2.84 0.00 1.67 0.40 -1.26 0.85 117.98 123.89 2dzq s PHE 78 Ca -0.08 -0.81 -0.25 0.00 -0.60 0.00 0.00 56.93 55.18 2dzq s PHE 78 Cb -0.04 -4.21 -0.04 0.00 0.51 0.00 0.00 43.02 39.24 2dzq s PHE 78 CO -0.15 -1.52 0.79 0.08 0.70 0.00 0.00 175.22 175.12 2dzq s VAL 79 N 3.42 4.86 -0.13 -0.44 1.01 -0.75 -4.47 120.40 123.90 2dzq s VAL 79 Ca 0.21 1.66 -0.01 0.00 0.00 0.00 0.00 61.98 63.84 2dzq s VAL 79 Cb -0.17 -4.13 -0.02 0.00 0.00 0.00 0.00 36.38 32.06 2dzq s VAL 79 CO 0.06 0.29 -0.11 -0.63 0.00 0.00 0.00 175.10 174.71 2dzq s ILE 80 N 0.43 3.26 -0.10 2.22 -1.09 -1.26 -2.85 121.20 121.82 2dzq s ILE 80 Ca 0.41 -0.59 -0.02 0.00 -2.23 0.00 0.00 60.65 58.22 2dzq s ILE 80 Cb -0.20 -2.38 -0.05 0.00 -1.58 0.00 0.00 42.46 38.25 2dzq s ILE 80 CO 0.22 0.52 -0.10 0.29 -1.23 0.00 0.00 174.94 174.64 2dzq n LYS 81 N 3.47 0.22 -3.64 2.79 4.76 -0.66 -4.92 118.16 120.18 2dzq n LYS 81 Ca -0.18 0.07 -0.29 0.00 -2.87 0.00 0.00 58.31 55.04 2dzq n LYS 81 Cb 0.53 -1.02 -0.13 0.00 -1.84 0.00 0.00 35.03 32.56 2dzq n LYS 81 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2dzq s ARG 82 N -2.18 0.87 0.23 1.97 0.52 -1.25 -4.95 118.95 114.16 2dzq s ARG 82 Ca -0.13 -1.49 0.25 0.00 -0.52 0.00 0.00 55.73 53.84 2dzq s ARG 82 Cb 0.04 -1.89 0.90 0.00 0.52 0.00 0.00 34.95 34.53 2dzq s ARG 82 CO 0.19 -1.12 1.75 -0.35 0.02 0.00 0.00 175.30 175.79 2dzq n PRO 83 N 4.12 0.22 0.32 3.54 -0.04 -1.26 -2.87 135.00 139.03 2dzq n PRO 83 Ca 0.06 0.32 0.19 0.00 -0.04 0.00 0.00 63.50 64.03 2dzq n PRO 83 Cb 0.37 -1.83 1.08 0.00 -0.04 0.00 0.00 33.50 33.08 2dzq n PRO 83 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2dzq h GLU 84 N 0.00 0.00 -0.17 0.54 4.11 -2.03 -1.10 114.58 115.93 2dzq h GLU 84 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.35 2dzq h GLU 84 Cb 0.55 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 2dzq h GLU 84 CO 0.00 0.00 -0.20 -0.07 0.07 0.00 0.00 179.01 178.81 2dzq h LEU 85 N 0.00 0.47 0.00 3.06 3.38 -1.97 -3.34 115.31 116.91 2dzq h LEU 85 Ca -0.00 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.48 2dzq h LEU 85 Cb 0.01 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2dzq h LEU 85 CO 0.00 0.87 0.00 0.18 0.09 0.00 0.00 178.44 179.58 2dzq n LEU 86 N -4.48 0.00 -3.99 1.67 4.77 -0.42 -4.79 117.00 109.77 2dzq n LEU 86 Ca -0.06 0.48 -0.38 0.00 -0.03 0.00 0.00 56.01 56.02 2dzq n LEU 86 Cb 0.40 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.51 2dzq n LEU 86 CO 0.41 0.00 -0.15 0.35 -1.33 0.00 0.00 177.39 176.67 2dzq n THR 87 N -0.82 -2.20 -1.39 -5.08 -2.24 -1.23 -4.88 114.28 96.46 2dzq n THR 87 Ca 0.00 -0.44 -0.29 0.00 -2.27 0.00 0.00 64.05 61.05 2dzq n THR 87 Cb 0.00 -1.88 0.13 0.00 -2.10 0.00 0.00 70.33 66.48 2dzq n THR 87 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2dzq s GLU 88 N -6.82 1.36 -0.25 -0.78 2.02 -1.26 -5.08 118.70 107.89 2dzq s GLU 88 Ca 0.37 0.59 -0.18 0.00 0.02 0.00 0.00 54.97 55.77 2dzq s GLU 88 Cb -0.21 -1.84 0.07 0.00 0.10 0.00 0.00 34.13 32.25 2dzq s GLU 88 CO 0.80 -2.11 0.63 0.20 0.02 0.00 0.00 175.26 174.81 2dzq s GLY 89 N -3.72 -0.52 0.22 -1.39 0.00 -1.26 -5.14 107.32 95.51 2dzq s GLY 89 Ca 0.63 2.02 -0.30 0.00 0.00 0.00 0.00 44.72 47.07 2dzq s GLY 89 CO 0.55 1.91 1.43 0.54 0.00 0.00 0.00 173.10 177.53 2dzq s VAL 90 N 0.97 2.79 0.10 1.40 0.11 -1.26 -5.01 120.40 119.50 2dzq s VAL 90 Ca -0.05 0.64 0.03 0.00 -2.93 0.00 0.00 61.98 59.67 2dzq s VAL 90 Cb -0.05 -3.41 -0.04 0.00 -1.53 0.00 0.00 36.38 31.35 2dzq s VAL 90 CO -0.09 0.09 -0.09 -0.75 -3.33 0.00 0.00 175.10 170.94 2dzq s LYS 91 N -0.07 0.84 -0.34 1.54 2.20 -1.26 -5.12 119.74 117.52 2dzq s LYS 91 Ca 0.60 -1.23 -0.03 0.00 -0.36 0.00 0.00 55.97 54.95 2dzq s LYS 91 Cb -0.41 -0.40 0.19 0.00 -1.51 0.00 0.00 37.83 35.70 2dzq s LYS 91 CO 0.40 0.04 0.88 -2.00 -0.36 0.00 0.00 175.35 174.31 2dzq s GLU 92 N -3.22 0.41 0.23 4.03 2.12 -1.26 -5.15 118.70 115.86 2dzq s GLU 92 Ca 0.08 -0.04 -0.30 0.00 0.36 0.00 0.00 54.97 55.07 2dzq s GLU 92 Cb 0.00 0.07 -0.09 0.00 0.26 0.00 0.00 34.13 34.38 2dzq s GLU 92 CO -0.02 -0.62 1.10 -1.25 -0.54 0.00 0.00 175.26 173.93 2dzq s PRO 93 N 2.14 4.62 -0.15 4.30 0.04 -1.26 -5.03 135.00 139.67 2dzq s PRO 93 Ca 0.16 1.76 -0.29 0.00 0.04 0.00 0.00 61.00 62.67 2dzq s PRO 93 Cb -0.01 -3.23 0.10 0.00 0.04 0.00 0.00 34.50 31.40 2dzq s PRO 93 CO -0.14 0.16 0.86 0.45 0.04 0.00 0.00 177.00 178.37 2dzq s SER 94 N -0.54 -0.52 0.00 6.66 0.15 -1.26 -5.19 113.70 113.00 2dzq s SER 94 Ca 0.47 0.68 0.00 0.00 0.70 0.00 0.00 55.95 57.79 2dzq s SER 94 Cb -0.31 0.57 0.00 0.00 -1.71 0.00 0.00 66.02 64.58 2dzq s SER 94 CO 0.38 -0.40 0.00 0.61 1.20 0.00 0.00 173.24 175.03 2dzq n GLY 95 N 1.17 4.84 0.18 9.45 0.00 -1.26 -5.06 105.19 114.52 2dzq n GLY 95 Ca -0.14 -1.83 -0.14 0.00 0.00 0.00 0.00 46.02 43.91 2dzq n GLY 95 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dzq h PRO 96 N 0.00 0.52 -3.46 1.61 0.13 -2.07 -3.50 132.00 125.23 2dzq h PRO 96 Ca 0.00 -0.50 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2dzq h PRO 96 Cb 0.00 0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.26 2dzq h PRO 96 CO 0.00 1.14 -0.86 0.43 -0.23 0.00 0.00 178.00 178.47 2dzq n SER 97 N -3.81 -8.02 -3.52 1.44 7.64 -1.26 -4.98 113.62 101.10 2dzq n SER 97 Ca -0.07 1.31 -0.25 0.00 1.01 0.00 0.00 58.87 60.88 2dzq n SER 97 Cb 0.80 -4.47 -0.14 0.00 -1.01 0.00 0.00 64.21 59.39 2dzq n SER 97 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dzq s SER 98 N -3.83 2.63 0.00 6.43 0.15 -1.26 -5.33 113.70 112.49 2dzq s SER 98 Ca 0.00 -0.89 0.00 0.00 0.70 0.00 0.00 55.95 55.76 2dzq s SER 98 Cb 0.00 -0.07 0.00 0.00 -1.71 0.00 0.00 66.02 64.24 2dzq s SER 98 CO 0.00 -0.39 0.00 0.61 1.20 0.00 0.00 173.24 174.66