#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dzq s SER 2 N 0.00 3.03 0.43 1.61 0.01 -1.26 -5.13 113.70 112.40 2dzq s SER 2 Ca 0.00 -1.47 -0.21 0.00 1.31 0.00 0.00 55.95 55.58 2dzq s SER 2 Cb 0.00 -0.20 -0.14 0.00 0.21 0.00 0.00 66.02 65.89 2dzq s SER 2 CO 0.00 -0.39 0.25 -1.20 0.41 0.00 0.00 173.24 172.31 2dzq n SER 3 N 4.89 -2.15 -4.32 2.44 7.64 -1.26 -4.85 113.62 116.02 2dzq n SER 3 Ca 0.00 0.82 -0.45 0.00 1.01 0.00 0.00 58.87 60.26 2dzq n SER 3 Cb 0.41 -0.98 0.00 0.00 -1.01 0.00 0.00 64.21 62.64 2dzq n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dzq n GLY 4 N 2.13 4.14 0.22 0.23 0.00 -1.26 -4.71 105.19 105.93 2dzq n GLY 4 Ca 0.11 -2.46 -0.08 0.00 0.00 0.00 0.00 46.02 43.60 2dzq n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dzq n SER 5 N 3.23 1.81 -3.48 1.61 7.64 -1.26 -4.82 113.62 118.34 2dzq n SER 5 Ca 0.27 0.30 -0.27 0.00 1.01 0.00 0.00 58.87 60.19 2dzq n SER 5 Cb 0.39 -0.68 -0.09 0.00 -1.01 0.00 0.00 64.21 62.82 2dzq n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dzq n SER 6 N -4.31 3.17 0.00 6.43 7.64 -1.26 -4.87 113.62 120.42 2dzq n SER 6 Ca -0.12 -3.30 0.05 0.00 1.01 0.00 0.00 58.87 56.51 2dzq n SER 6 Cb 0.44 -0.68 0.27 0.00 -1.01 0.00 0.00 64.21 63.23 2dzq n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dzq n GLY 7 N 1.15 -0.71 0.12 0.23 0.00 -1.26 -2.81 105.19 101.90 2dzq n GLY 7 Ca 0.27 -0.05 -0.08 0.00 0.00 0.00 0.00 46.02 46.17 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 -0.06 -0.92 0.99 3.38 -1.97 -2.30 115.31 114.44 2dzq h LEU 8 Ca 0.00 0.05 0.14 0.00 0.09 0.00 0.00 57.88 58.16 2dzq h LEU 8 Cb 0.13 0.08 -0.15 0.00 0.09 0.00 0.00 40.66 40.81 2dzq h LEU 8 CO 0.00 0.00 -0.36 0.54 0.09 0.00 0.00 178.44 178.72 2dzq n ARG 9 N -5.13 -0.21 -0.21 1.13 1.74 -1.12 0.20 116.66 113.05 2dzq n ARG 9 Ca -0.01 1.41 -0.05 0.00 -0.77 0.00 0.00 57.85 58.43 2dzq n ARG 9 Cb 0.12 -2.10 0.06 0.00 -1.02 0.00 0.00 32.46 29.52 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 0.72 0.35 5.56 1.79 -1.66 -0.32 116.57 123.00 2dzq h LYS 10 Ca 0.32 -0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.73 2dzq h LYS 10 Cb 0.55 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 31.04 2dzq h LYS 10 CO -0.91 0.47 -0.17 1.96 -1.08 0.00 0.00 179.45 179.73 2dzq h GLN 11 N 0.74 -0.45 -0.47 3.15 4.20 0.25 -2.41 115.11 120.12 2dzq h GLN 11 Ca 0.24 0.03 0.09 0.00 0.06 0.00 0.00 58.65 59.08 2dzq h GLN 11 Cb 0.01 0.10 -0.10 0.00 0.30 0.00 0.00 27.48 27.79 2dzq h GLN 11 CO -0.10 -0.23 -0.27 0.28 -0.67 0.00 0.00 178.83 177.85 2dzq h VAL 12 N -0.59 0.28 -0.51 -0.54 2.07 0.25 0.17 116.25 117.39 2dzq h VAL 12 Ca -0.05 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.56 2dzq h VAL 12 Cb 0.43 0.28 -0.10 0.00 -1.52 0.00 0.00 31.29 30.38 2dzq h VAL 12 CO 0.08 0.00 -0.34 -0.33 0.02 0.00 0.00 177.57 177.00 2dzq h GLU 13 N -0.17 -0.20 -0.53 1.57 4.39 -0.93 0.49 114.58 119.21 2dzq h GLU 13 Ca 0.21 0.01 0.07 0.00 0.34 0.00 0.00 59.36 59.99 2dzq h GLU 13 Cb 0.51 0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 29.14 2dzq h GLU 13 CO -0.57 -0.13 0.21 1.25 -1.16 0.00 0.00 179.01 178.61 2dzq h LEU 14 N -0.21 0.25 0.26 1.33 5.85 -0.57 1.32 115.31 123.54 2dzq h LEU 14 Ca 0.20 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.98 2dzq h LEU 14 Cb 0.55 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 2dzq h LEU 14 CO -0.62 0.17 -0.38 0.25 -0.34 0.00 0.00 178.44 177.52 2dzq h LEU 15 N 0.41 -1.07 0.63 2.25 5.85 0.21 1.51 115.31 125.11 2dzq h LEU 15 Ca 0.25 0.11 -0.03 0.00 0.84 0.00 0.00 57.88 59.05 2dzq h LEU 15 Cb 0.25 0.38 0.01 0.00 0.37 0.00 0.00 40.66 41.67 2dzq h LEU 15 CO -0.23 -0.49 -0.30 -0.26 -0.34 0.00 0.00 178.44 176.81 2dzq h PHE 16 N -0.70 -0.79 -0.80 1.25 -1.00 0.43 0.55 116.94 115.89 2dzq h PHE 16 Ca -0.00 -0.02 0.14 0.00 2.81 0.00 0.00 57.97 60.90 2dzq h PHE 16 Cb 0.67 0.26 -0.09 0.00 3.61 0.00 0.00 35.95 40.40 2dzq h PHE 16 CO -0.27 -0.46 0.36 -0.91 -1.61 0.00 0.00 178.31 175.42 2dzq h ASN 17 N -0.93 0.39 0.62 2.17 4.21 0.18 0.15 115.58 122.38 2dzq h ASN 17 Ca -0.09 0.10 -0.03 0.00 1.21 0.00 0.00 56.30 57.49 2dzq h ASN 17 Cb 0.68 0.05 0.01 0.00 -1.12 0.00 0.00 38.32 37.93 2dzq h ASN 17 CO 0.14 0.16 -0.30 0.74 -1.29 0.00 0.00 177.43 176.88 2dzq h THR 18 N 0.52 0.00 -0.93 2.81 2.02 0.24 0.73 112.91 118.30 2dzq h THR 18 Ca 0.44 -0.18 0.27 0.00 0.77 0.00 0.00 66.41 67.71 2dzq h THR 18 Cb 0.64 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.89 2dzq h THR 18 CO -0.38 0.00 0.23 0.03 0.37 0.00 0.00 175.52 175.77 2dzq h ARG 19 N -1.01 0.12 -0.63 6.66 2.47 0.57 0.68 114.38 123.24 2dzq h ARG 19 Ca -0.08 -0.01 0.11 0.00 -1.26 0.00 0.00 59.98 58.73 2dzq h ARG 19 Cb 0.64 -0.03 -0.08 0.00 -1.65 0.00 0.00 29.97 28.85 2dzq h ARG 19 CO 0.14 0.08 0.22 -0.92 0.56 0.00 0.00 179.97 180.05 2dzq h TYR 20 N 0.13 0.37 -0.70 3.04 3.20 -0.64 -0.85 116.97 121.53 2dzq h TYR 20 Ca 0.61 0.03 0.15 0.00 3.14 0.00 0.00 58.73 62.66 2dzq h TYR 20 Cb 1.32 -0.07 -0.13 0.00 1.54 0.00 0.00 36.73 39.39 2dzq h TYR 20 CO -0.29 0.06 -0.09 0.00 -1.64 0.00 0.00 178.16 176.20 2dzq h ALA 21 N 1.46 0.58 -0.35 1.82 0.00 0.61 1.48 119.26 124.85 2dzq h ALA 21 Ca 0.33 0.25 0.05 0.00 0.00 0.00 0.00 54.91 55.54 2dzq h ALA 21 Cb 0.44 0.46 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 2dzq h ALA 21 CO -0.35 -0.42 0.24 -0.22 0.00 0.00 0.00 179.25 178.50 2dzq h LYS 22 N 0.04 0.25 0.00 0.00 3.64 -1.07 1.79 116.57 121.21 2dzq h LYS 22 Ca 0.35 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.72 2dzq h LYS 22 Cb 0.58 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 2dzq h LYS 22 CO -0.67 0.16 0.00 0.00 -2.27 0.00 0.00 179.45 176.67 2dzq n ALA 23 N -2.53 1.76 -0.02 5.00 0.00 0.49 -2.06 120.51 123.15 2dzq n ALA 23 Ca 0.04 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2dzq n ALA 23 Cb 0.23 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.27 2dzq n ALA 23 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2dzq n ILE 24 N -2.29 0.43 -2.32 0.00 -5.35 0.23 -4.87 119.36 105.19 2dzq n ILE 24 Ca 0.03 -0.70 -0.11 0.00 -0.27 0.00 0.00 62.75 61.70 2dzq n ILE 24 Cb 0.26 0.80 0.00 0.00 -1.74 0.00 0.00 39.64 38.96 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 -0.21 -0.02 3.88 3.28 0.00 0.49 -5.02 105.19 107.58 2dzq n GLY 25 Ca 0.00 -0.41 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.62 5.09 -0.08 -0.61 1.01 0.49 -4.92 121.20 119.57 2dzq s ILE 26 Ca 0.04 -0.57 0.02 0.00 0.00 0.00 0.00 60.65 60.14 2dzq s ILE 26 Cb -0.02 -3.50 -0.25 0.00 0.01 0.00 0.00 42.46 38.70 2dzq s ILE 26 CO 0.05 0.09 0.51 -1.20 0.00 0.00 0.00 174.94 174.39 2dzq n SER 27 N 0.19 1.53 -4.93 3.58 7.64 -1.26 -3.42 113.62 116.94 2dzq n SER 27 Ca -0.06 0.31 -0.25 0.00 1.01 0.00 0.00 58.87 59.88 2dzq n SER 27 Cb 0.52 -0.48 0.02 0.00 -1.01 0.00 0.00 64.21 63.25 2dzq n SER 27 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2dzq s GLU 28 N -2.58 3.06 0.19 1.43 0.41 -1.26 -4.99 118.70 114.97 2dzq s GLU 28 Ca -0.14 -0.24 -0.30 0.00 -0.41 0.00 0.00 54.97 53.88 2dzq s GLU 28 Cb 0.07 -2.44 -0.08 0.00 -1.78 0.00 0.00 34.13 29.91 2dzq s GLU 28 CO 0.80 -0.41 1.11 -1.25 -0.49 0.00 0.00 175.26 175.01 2dzq s PRO 29 N -4.73 4.59 0.32 0.39 0.04 -1.26 -4.47 135.00 129.88 2dzq s PRO 29 Ca 0.50 1.75 0.08 0.00 0.04 0.00 0.00 61.00 63.37 2dzq s PRO 29 Cb -0.10 -3.26 -0.06 0.00 0.04 0.00 0.00 34.50 31.12 2dzq s PRO 29 CO 0.41 0.08 -0.07 0.08 0.04 0.00 0.00 177.00 177.54 2dzq s VAL 30 N -0.36 1.95 0.51 -0.36 1.01 0.23 -4.86 120.40 118.52 2dzq s VAL 30 Ca 0.49 -2.15 -0.22 0.00 0.00 0.00 0.00 61.98 60.10 2dzq s VAL 30 Cb -0.30 -2.59 -0.06 0.00 0.00 0.00 0.00 36.38 33.43 2dzq s VAL 30 CO 0.36 -0.22 1.24 -0.54 0.00 0.00 0.00 175.10 175.93 2dzq s LYS 31 N -3.67 3.40 -0.27 2.72 1.02 -1.26 -4.08 119.74 117.60 2dzq s LYS 31 Ca 0.32 1.93 -0.05 0.00 0.02 0.00 0.00 55.97 58.19 2dzq s LYS 31 Cb 0.04 -2.26 0.01 0.00 -0.52 0.00 0.00 37.83 35.09 2dzq s LYS 31 CO 0.15 -0.89 0.02 0.08 -0.92 0.00 0.00 175.35 173.78 2dzq s VAL 32 N -1.48 3.54 -1.15 3.17 1.01 -1.26 -4.97 120.40 119.27 2dzq s VAL 32 Ca 0.69 -0.75 -0.14 0.00 0.00 0.00 0.00 61.98 61.78 2dzq s VAL 32 Cb -0.33 -2.78 -0.07 0.00 0.00 0.00 0.00 36.38 33.21 2dzq s VAL 32 CO 0.39 0.18 2.23 -0.81 0.00 0.00 0.00 175.10 177.08 2dzq n PRO 33 N 4.79 2.39 -0.33 2.72 -0.04 -1.26 -4.76 135.00 138.52 2dzq n PRO 33 Ca -0.16 -2.04 -0.05 0.00 -0.04 0.00 0.00 63.50 61.21 2dzq n PRO 33 Cb 0.48 -2.90 -0.03 0.00 -0.04 0.00 0.00 33.50 31.01 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 5.69 -0.19 -0.30 0.54 4.01 -1.26 0.53 117.16 126.17 2dzq n TYR 34 Ca 0.54 1.01 -0.07 0.00 -0.16 0.00 0.00 57.90 59.23 2dzq n TYR 34 Cb 0.31 -0.67 -0.02 0.00 -0.31 0.00 0.00 39.34 38.65 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 -1.61 -0.87 7.72 0.02 -1.97 1.49 113.55 118.33 2dzq h SER 35 Ca 0.20 0.28 0.22 0.00 -0.84 0.00 0.00 61.79 61.65 2dzq h SER 35 Cb 0.40 0.76 -0.13 0.00 0.14 0.00 0.00 62.40 63.57 2dzq h SER 35 CO -0.78 -0.30 0.30 0.11 -1.14 0.00 0.00 176.83 175.02 2dzq h LYS 36 N -0.11 0.28 0.00 3.45 1.79 -0.31 1.79 116.57 123.47 2dzq h LYS 36 Ca 0.23 -0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 58.62 2dzq h LYS 36 Cb 0.54 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.12 2dzq h LYS 36 CO -0.83 0.19 -0.30 0.74 -1.08 0.00 0.00 179.45 178.17 2dzq h PHE 37 N 0.29 0.00 0.04 -1.35 -1.00 0.15 0.61 116.94 115.68 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 1.06 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.62 2dzq h PHE 37 CO -0.21 0.30 -0.02 -0.07 -1.61 0.00 0.00 178.31 176.70 2dzq h LEU 38 N 0.00 -0.05 -1.50 1.54 3.38 1.12 -2.19 115.31 117.61 2dzq h LEU 38 Ca -0.00 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.66 2dzq h LEU 38 Cb 1.07 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 2dzq h LEU 38 CO 0.04 0.58 -0.13 0.24 0.09 0.00 0.00 178.44 179.26 2dzq h MET 39 N -1.00 0.00 -2.10 1.13 2.86 0.20 -3.27 114.93 112.76 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 0.33 0.00 -0.40 0.00 0.06 0.00 0.00 31.60 31.58 2dzq h MET 39 CO 0.01 0.13 -0.88 0.72 1.06 0.00 0.00 176.91 177.95 2dzq n HIS 40 N -3.35 1.59 0.24 -0.22 8.25 0.20 -4.88 115.22 117.06 2dzq n HIS 40 Ca -0.00 -3.85 0.13 0.00 -0.26 0.00 0.00 57.72 53.74 2dzq n HIS 40 Cb 0.33 -0.45 0.40 0.00 1.12 0.00 0.00 29.99 31.39 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 3.93 0.00 0.12 -0.41 0.13 -1.45 0.44 132.00 134.76 2dzq h PRO 41 Ca 0.13 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.97 2dzq h PRO 41 Cb 0.77 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.90 2dzq h PRO 41 CO 0.64 0.06 -1.40 0.93 -0.23 0.00 0.00 178.00 178.01 2dzq h GLU 42 N 0.00 0.25 0.00 0.86 4.39 -1.90 -3.37 114.58 114.80 2dzq h GLU 42 Ca -0.00 -0.42 -0.10 0.00 0.34 0.00 0.00 59.36 59.18 2dzq h GLU 42 Cb 0.80 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.59 2dzq h GLU 42 CO 0.01 1.14 -0.65 0.93 -1.16 0.00 0.00 179.01 179.28 2dzq h GLU 43 N 0.07 0.00 -4.95 2.33 3.07 -1.91 -3.45 114.58 109.73 2dzq h GLU 43 Ca -0.19 0.00 -0.66 0.00 -0.50 0.00 0.00 59.36 58.01 2dzq h GLU 43 Cb 1.99 0.00 -0.28 0.00 -0.84 0.00 0.00 28.75 29.62 2dzq h GLU 43 CO 0.18 0.66 -0.71 -0.51 -1.40 0.00 0.00 179.01 177.23 2dzq s LEU 44 N -8.11 3.10 0.00 1.33 1.43 0.15 -2.06 118.68 114.52 2dzq s LEU 44 Ca -0.20 -0.50 -0.02 0.00 -1.03 0.00 0.00 54.13 52.38 2dzq s LEU 44 Cb 0.02 -1.75 0.01 0.00 0.03 0.00 0.00 46.19 44.50 2dzq s LEU 44 CO 0.46 -0.06 0.45 2.22 0.23 0.00 0.00 176.35 179.64 2dzq n PHE 45 N 4.79 -1.37 -4.67 0.29 1.16 -1.15 -3.83 117.46 112.68 2dzq n PHE 45 Ca -0.17 -2.11 -0.23 0.00 -1.87 0.00 0.00 57.45 53.07 2dzq n PHE 45 Cb 0.50 0.51 -0.15 0.00 -1.61 0.00 0.00 39.48 38.72 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 -2.76 1.14 0.21 1.97 1.01 -1.26 -1.78 120.40 118.92 2dzq s VAL 46 Ca 0.26 -0.61 0.11 0.00 0.00 0.00 0.00 61.98 61.74 2dzq s VAL 46 Cb -0.01 -0.95 -0.05 0.00 0.00 0.00 0.00 36.38 35.37 2dzq s VAL 46 CO 0.19 0.32 -0.20 0.68 0.00 0.00 0.00 175.10 176.09 2dzq s VAL 47 N -0.31 2.53 0.00 2.92 -7.23 0.23 -4.65 120.40 113.90 2dzq s VAL 47 Ca 0.05 -2.06 0.00 0.00 -1.81 0.00 0.00 61.98 58.16 2dzq s VAL 47 Cb -0.06 -2.25 0.00 0.00 0.56 0.00 0.00 36.38 34.63 2dzq s VAL 47 CO -0.00 -0.19 0.00 0.61 -0.31 0.00 0.00 175.10 175.21 2dzq n GLY 48 N 0.00 3.37 3.35 2.32 0.00 -1.26 0.19 105.19 113.16 2dzq n GLY 48 Ca -0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.05 0.00 0.99 4.77 -1.26 -4.12 117.00 116.32 2dzq n LEU 49 Ca 0.00 0.51 -0.20 0.00 -0.03 0.00 0.00 56.01 56.29 2dzq n LEU 49 Cb 0.00 -1.09 0.15 0.00 -2.33 0.00 0.00 43.42 40.16 2dzq n LEU 49 CO 0.00 -3.89 0.51 -0.81 -1.33 0.00 0.00 177.39 171.87 2dzq n PRO 50 N 0.01 -1.66 -2.72 3.23 -0.04 -1.26 -4.99 135.00 127.57 2dzq n PRO 50 Ca 0.07 -1.29 -0.38 0.00 -0.04 0.00 0.00 63.50 61.86 2dzq n PRO 50 Cb 0.51 -1.02 -0.06 0.00 -0.04 0.00 0.00 33.50 32.89 2dzq n PRO 50 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2dzq s GLU 51 N -4.83 4.65 -1.34 0.54 1.03 -1.26 -3.42 118.70 114.06 2dzq s GLU 51 Ca 0.50 1.45 0.00 0.00 0.03 0.00 0.00 54.97 56.95 2dzq s GLU 51 Cb -0.03 -2.98 0.00 0.00 -0.80 0.00 0.00 34.13 30.32 2dzq s GLU 51 CO 0.36 0.32 0.00 0.41 -1.33 0.00 0.00 175.26 175.02 2dzq n GLY 52 N 0.92 -0.24 3.11 -3.83 0.00 -1.26 -4.99 105.19 98.90 2dzq n GLY 52 Ca 0.01 -0.23 -0.12 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.77 0.02 0.00 -0.61 1.01 -1.22 -5.13 121.20 112.50 2dzq s ILE 53 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.50 2dzq s ILE 53 Cb 0.00 -0.35 0.00 0.00 0.01 0.00 0.00 42.46 42.12 2dzq s ILE 53 CO 0.00 -0.08 0.00 -0.24 0.00 0.00 0.00 174.94 174.62 2dzq n SER 54 N 2.58 0.14 -4.52 3.58 2.88 -1.26 -4.58 113.62 112.44 2dzq n SER 54 Ca -0.15 0.00 -0.39 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 4.25 0.07 2.46 2.96 -1.26 -5.04 118.68 122.13 2dzq s LEU 55 Ca 0.00 -0.32 -0.27 0.00 -0.22 0.00 0.00 54.13 53.32 2dzq s LEU 55 Cb 0.00 -2.10 0.09 0.00 0.50 0.00 0.00 46.19 44.68 2dzq s LEU 55 CO 0.00 -0.17 0.96 -0.13 -1.32 0.00 0.00 176.35 175.69 2dzq s ARG 56 N 1.71 0.96 0.29 1.98 0.52 -1.26 -4.93 118.95 118.21 2dzq s ARG 56 Ca 0.06 -0.47 -0.29 0.00 -0.52 0.00 0.00 55.73 54.51 2dzq s ARG 56 Cb -0.17 0.37 -0.13 0.00 0.52 0.00 0.00 34.95 35.54 2dzq s ARG 56 CO 0.09 -0.43 1.24 0.54 0.02 0.00 0.00 175.30 176.76 2dzq n ARG 57 N -0.37 1.83 -0.91 3.54 1.74 -1.26 -4.79 116.66 116.44 2dzq n ARG 57 Ca -0.07 0.65 -0.23 0.00 -0.77 0.00 0.00 57.85 57.43 2dzq n ARG 57 Cb 0.61 -2.19 -0.06 0.00 -1.02 0.00 0.00 32.46 29.81 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 1.10 2.38 0.00 5.56 -0.04 -1.26 -3.12 135.00 139.61 2dzq n PRO 58 Ca 0.09 -1.45 0.00 0.00 -0.04 0.00 0.00 63.50 62.10 2dzq n PRO 58 Cb 0.33 -2.37 0.00 0.00 -0.04 0.00 0.00 33.50 31.42 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 3.51 0.08 0.15 3.54 6.94 -1.26 -4.58 115.26 123.64 2dzq n ASN 59 Ca 0.51 0.00 0.03 0.00 -0.02 0.00 0.00 54.58 55.10 2dzq n ASN 59 Cb 0.34 0.00 0.42 0.00 -2.36 0.00 0.00 39.78 38.18 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 -4.68 2.53 0.20 0.00 0.08 -1.26 -5.05 117.98 109.80 2dzq s PHE 61 Ca -0.05 1.50 0.05 0.00 0.12 0.00 0.00 56.93 58.55 2dzq s PHE 61 Cb 0.15 -3.07 -0.04 0.00 -0.57 0.00 0.00 43.02 39.50 2dzq s PHE 61 CO 0.72 -1.90 0.22 0.20 -0.10 0.00 0.00 175.22 174.36 2dzq s GLY 62 N -3.40 1.55 0.20 4.36 0.00 -1.26 -4.85 107.32 103.92 2dzq s GLY 62 Ca 0.62 -1.23 -0.23 0.00 0.00 0.00 0.00 44.72 43.88 2dzq s GLY 62 CO 0.56 -1.25 1.55 -2.22 0.00 0.00 0.00 173.10 171.74 2dzq h ILE 63 N 1.66 0.00 -0.46 0.90 5.03 -1.96 1.45 117.51 124.14 2dzq h ILE 63 Ca -0.49 0.00 0.09 0.00 -0.12 0.00 0.00 64.86 64.34 2dzq h ILE 63 Cb 1.21 0.00 -0.10 0.00 -3.03 0.00 0.00 36.82 34.91 2dzq h ILE 63 CO 0.63 0.00 -0.28 0.00 -0.68 0.00 0.00 178.15 177.82 2dzq h ALA 64 N 1.04 -0.04 0.68 1.87 0.00 -1.99 0.24 119.26 121.05 2dzq h ALA 64 Ca 0.27 0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.29 2dzq h ALA 64 Cb 0.53 0.65 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2dzq h ALA 64 CO -0.96 -0.65 -0.34 0.87 0.00 0.00 0.00 179.25 178.16 2dzq h LYS 65 N -0.19 -0.90 -0.99 0.00 1.57 -0.10 -0.66 116.57 115.30 2dzq h LYS 65 Ca 0.20 0.06 0.20 0.00 -1.87 0.00 0.00 60.65 59.24 2dzq h LYS 65 Cb 0.51 0.21 -0.19 0.00 0.08 0.00 0.00 32.23 32.84 2dzq h LYS 65 CO -0.56 -0.60 -0.25 -0.07 -0.57 0.00 0.00 179.45 177.40 2dzq h LEU 66 N -0.94 -0.92 0.66 2.94 3.38 0.26 0.33 115.31 121.02 2dzq h LEU 66 Ca -0.09 0.30 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 2dzq h LEU 66 Cb 0.73 0.62 0.00 0.00 0.09 0.00 0.00 40.66 42.10 2dzq h LEU 66 CO 0.14 -0.33 -0.35 0.03 0.09 0.00 0.00 178.44 178.03 2dzq h ARG 67 N -0.00 -0.89 -0.43 1.13 3.08 -0.19 -1.86 114.38 115.22 2dzq h ARG 67 Ca 0.48 0.06 0.04 0.00 0.07 0.00 0.00 59.98 60.62 2dzq h ARG 67 Cb 0.72 0.20 -0.05 0.00 0.08 0.00 0.00 29.97 30.92 2dzq h ARG 67 CO -1.02 -0.59 -0.25 0.87 -1.07 0.00 0.00 179.97 177.90 2dzq h LYS 68 N -0.93 -0.00 -0.76 0.04 6.56 0.11 1.32 116.57 122.91 2dzq h LYS 68 Ca -0.09 0.00 0.13 0.00 -1.06 0.00 0.00 60.65 59.63 2dzq h LYS 68 Cb 0.72 0.00 -0.14 0.00 -0.57 0.00 0.00 32.23 32.25 2dzq h LYS 68 CO 0.13 -0.00 -0.33 0.82 -2.06 0.00 0.00 179.45 178.01 2dzq h ILE 69 N -0.00 0.12 -0.96 1.86 2.04 -1.08 1.44 117.51 120.93 2dzq h ILE 69 Ca 0.07 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.03 2dzq h ILE 69 Cb 0.18 0.12 -0.07 0.00 -0.74 0.00 0.00 36.82 36.30 2dzq h ILE 69 CO -0.40 0.00 0.61 -0.07 0.00 0.00 0.00 178.15 178.29 2dzq h LEU 70 N -0.08 0.89 -1.36 1.44 3.38 0.54 0.56 115.31 120.68 2dzq h LEU 70 Ca 0.30 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.29 2dzq h LEU 70 Cb 0.57 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 2dzq h LEU 70 CO -0.81 0.52 -0.04 -0.33 0.09 0.00 0.00 178.44 177.87 2dzq h GLU 71 N 0.98 0.00 -0.35 1.13 5.08 1.11 -2.32 114.58 120.21 2dzq h GLU 71 Ca 0.45 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.68 2dzq h GLU 71 Cb 0.40 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.57 2dzq h GLU 71 CO -0.21 0.04 -0.00 0.00 -1.00 0.00 0.00 179.01 177.84 2dzq n ALA 72 N -2.12 3.83 0.10 3.43 0.00 0.21 -4.74 120.51 121.23 2dzq n ALA 72 Ca 0.01 -2.79 -0.04 0.00 0.00 0.00 0.00 53.44 50.61 2dzq n ALA 72 Cb 0.33 -0.77 -0.02 0.00 0.00 0.00 0.00 19.45 18.99 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 1.31 -0.28 -0.94 0.00 0.87 -0.03 1.07 113.55 115.55 2dzq h SER 73 Ca 0.15 0.02 0.28 0.00 -1.23 0.00 0.00 61.79 61.02 2dzq h SER 73 Cb 1.64 0.08 -0.15 0.00 -0.44 0.00 0.00 62.40 63.53 2dzq h SER 73 CO 0.36 -0.17 0.32 0.78 -0.53 0.00 0.00 176.83 177.59 2dzq h ASN 74 N -0.27 0.09 -0.08 6.23 4.21 -1.85 0.60 115.58 124.50 2dzq h ASN 74 Ca -0.02 0.22 -0.01 0.00 1.21 0.00 0.00 56.30 57.69 2dzq h ASN 74 Cb 0.22 0.27 -0.00 0.00 -1.12 0.00 0.00 38.32 37.69 2dzq h ASN 74 CO 0.03 -0.22 0.02 0.28 -1.29 0.00 0.00 177.43 176.25 2dzq h SER 75 N 0.18 0.13 -2.74 5.81 0.02 -1.80 -3.44 113.55 111.70 2dzq h SER 75 Ca 0.64 -0.23 -0.56 0.00 -0.84 0.00 0.00 61.79 60.80 2dzq h SER 75 Cb 1.41 -0.03 0.20 0.00 0.14 0.00 0.00 62.40 64.12 2dzq h SER 75 CO -0.70 0.33 -0.92 -0.38 -1.14 0.00 0.00 176.83 174.02 2dzq n ILE 76 N -4.89 0.72 -3.59 3.27 5.41 0.37 -4.14 119.36 116.50 2dzq n ILE 76 Ca -0.06 -0.40 -0.01 0.00 1.00 0.00 0.00 62.75 63.27 2dzq n ILE 76 Cb 0.15 -0.41 -0.06 0.00 -0.71 0.00 0.00 39.64 38.61 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 -2.43 0.33 -0.66 0.38 0.74 0.49 -4.85 119.66 113.66 2dzq s GLN 77 Ca 0.56 0.62 -0.22 0.00 0.05 0.00 0.00 55.36 56.37 2dzq s GLN 77 Cb -0.31 0.14 0.08 0.00 1.10 0.00 0.00 33.01 34.02 2dzq s GLN 77 CO 0.67 -0.08 0.93 -0.06 -0.55 0.00 0.00 175.29 176.20 2dzq s PHE 78 N 1.54 2.75 -0.05 1.67 0.40 -1.26 0.78 117.98 123.81 2dzq s PHE 78 Ca -0.08 -0.66 -0.24 0.00 -0.60 0.00 0.00 56.93 55.35 2dzq s PHE 78 Cb -0.04 -4.25 -0.04 0.00 0.51 0.00 0.00 43.02 39.20 2dzq s PHE 78 CO -0.15 -1.58 0.73 0.08 0.70 0.00 0.00 175.22 175.00 2dzq s VAL 79 N 3.77 5.00 -0.14 -0.44 1.01 -0.74 -4.44 120.40 124.42 2dzq s VAL 79 Ca 0.21 1.51 -0.03 0.00 0.00 0.00 0.00 61.98 63.67 2dzq s VAL 79 Cb -0.17 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.11 2dzq s VAL 79 CO 0.08 0.26 -0.05 -0.63 0.00 0.00 0.00 175.10 174.76 2dzq s ILE 80 N 0.70 3.76 -0.07 2.22 -1.09 -1.26 -2.96 121.20 122.50 2dzq s ILE 80 Ca 0.39 -0.41 -0.02 0.00 -2.23 0.00 0.00 60.65 58.38 2dzq s ILE 80 Cb -0.18 -2.63 -0.04 0.00 -1.58 0.00 0.00 42.46 38.03 2dzq s ILE 80 CO 0.19 0.51 -0.08 0.29 -1.23 0.00 0.00 174.94 174.62 2dzq n LYS 81 N 3.39 0.17 -3.60 2.79 4.76 -0.87 -4.94 118.16 119.85 2dzq n LYS 81 Ca -0.18 0.06 -0.29 0.00 -2.87 0.00 0.00 58.31 55.03 2dzq n LYS 81 Cb 0.53 -0.96 -0.14 0.00 -1.84 0.00 0.00 35.03 32.62 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 -2.14 0.66 0.29 1.97 0.52 -1.25 -4.96 118.95 114.04 2dzq s ARG 82 Ca -0.10 -1.23 0.26 0.00 -0.52 0.00 0.00 55.73 54.14 2dzq s ARG 82 Cb 0.03 -1.65 0.89 0.00 0.52 0.00 0.00 34.95 34.75 2dzq s ARG 82 CO 0.15 -1.10 1.76 -1.00 0.02 0.00 0.00 175.30 175.12 2dzq h PRO 83 N 7.53 0.00 -0.16 3.54 0.13 -1.94 -3.06 132.00 138.04 2dzq h PRO 83 Ca -0.06 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.12 2dzq h PRO 83 Cb 0.98 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.10 2dzq h PRO 83 CO 0.40 0.00 0.18 1.05 -0.23 0.00 0.00 178.00 179.40 2dzq h GLU 84 N 0.00 0.00 -0.26 0.86 4.11 -1.92 -0.02 114.58 117.34 2dzq h GLU 84 Ca 0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.37 2dzq h GLU 84 Cb 0.60 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 2dzq h GLU 84 CO 0.00 0.00 -0.07 -0.07 0.07 0.00 0.00 179.01 178.94 2dzq h LEU 85 N 0.00 0.52 -0.38 3.06 3.38 -1.97 -3.25 115.31 116.67 2dzq h LEU 85 Ca 0.08 -0.37 0.04 0.00 0.09 0.00 0.00 57.88 57.71 2dzq h LEU 85 Cb 0.43 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 2dzq h LEU 85 CO -0.00 0.77 -0.26 -0.07 0.09 0.00 0.00 178.44 178.97 2dzq h LEU 86 N 0.26 -0.95 -7.93 1.67 3.38 -1.20 -2.92 115.31 107.63 2dzq h LEU 86 Ca 0.06 0.14 -0.66 0.00 0.09 0.00 0.00 57.88 57.51 2dzq h LEU 86 Cb 0.55 0.41 -0.11 0.00 0.09 0.00 0.00 40.66 41.61 2dzq h LEU 86 CO 0.03 -0.13 1.78 0.28 0.09 0.00 0.00 178.44 180.49 2dzq s THR 87 N -4.15 4.23 -0.11 0.22 -1.32 -1.23 -4.75 115.64 108.53 2dzq s THR 87 Ca -0.06 -1.64 -0.19 0.00 -1.21 0.00 0.00 61.69 58.60 2dzq s THR 87 Cb 0.05 -5.09 -0.16 0.00 -1.51 0.00 0.00 72.50 65.79 2dzq s THR 87 CO 0.28 -1.91 0.59 -0.08 -2.21 0.00 0.00 174.62 171.29 2dzq h GLU 88 N 8.29 -0.05 -0.22 7.08 4.81 -1.69 -3.48 114.58 129.33 2dzq h GLU 88 Ca 0.33 0.00 0.25 0.00 -0.13 0.00 0.00 59.36 59.82 2dzq h GLU 88 Cb 0.92 0.01 -0.27 0.00 0.63 0.00 0.00 28.75 30.04 2dzq h GLU 88 CO 1.40 0.53 0.51 0.20 -0.73 0.00 0.00 179.01 180.91 2dzq s GLY 89 N -3.79 0.25 0.06 1.92 0.00 -1.26 -5.12 107.32 99.39 2dzq s GLY 89 Ca -0.12 3.61 0.01 0.00 0.00 0.00 0.00 44.72 48.22 2dzq s GLY 89 CO 0.45 3.37 -0.06 0.54 0.00 0.00 0.00 173.10 177.39 2dzq s VAL 90 N 2.07 0.50 -0.36 1.40 0.11 -1.26 -5.12 120.40 117.74 2dzq s VAL 90 Ca 0.00 -1.53 0.00 0.00 -2.93 0.00 0.00 61.98 57.53 2dzq s VAL 90 Cb -0.01 -1.15 0.14 0.00 -1.53 0.00 0.00 36.38 33.83 2dzq s VAL 90 CO -0.16 -0.70 0.22 -0.75 -3.33 0.00 0.00 175.10 170.38 2dzq s LYS 91 N -2.86 0.64 -0.18 1.54 2.20 -1.26 -5.10 119.74 114.72 2dzq s LYS 91 Ca 0.01 -1.44 0.01 0.00 -0.36 0.00 0.00 55.97 54.19 2dzq s LYS 91 Cb -0.01 -1.40 0.02 0.00 -1.51 0.00 0.00 37.83 34.93 2dzq s LYS 91 CO -0.04 -1.22 -0.19 -2.00 -0.36 0.00 0.00 175.35 171.55 2dzq s GLU 92 N 0.94 2.86 -0.87 4.03 -6.30 -1.26 -5.06 118.70 113.04 2dzq s GLU 92 Ca 0.19 -0.82 -0.25 0.00 -2.50 0.00 0.00 54.97 51.59 2dzq s GLU 92 Cb -0.21 -2.53 0.00 0.00 0.00 0.00 0.00 34.13 31.39 2dzq s GLU 92 CO -0.00 -0.23 1.65 -1.25 0.02 0.00 0.00 175.26 175.44 2dzq s PRO 93 N 1.31 3.03 0.39 4.30 0.04 -1.26 -4.97 135.00 137.84 2dzq s PRO 93 Ca 0.04 -0.42 -0.26 0.00 0.04 0.00 0.00 61.00 60.41 2dzq s PRO 93 Cb -0.13 -4.90 -0.09 0.00 0.04 0.00 0.00 34.50 29.42 2dzq s PRO 93 CO -0.12 -2.66 1.16 -1.12 0.04 0.00 0.00 177.00 174.30 2dzq s SER 94 N 6.26 6.61 0.00 6.66 0.01 -1.26 -4.95 113.70 127.02 2dzq s SER 94 Ca 0.55 2.34 0.00 0.00 1.31 0.00 0.00 55.95 60.15 2dzq s SER 94 Cb -0.06 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.56 2dzq s SER 94 CO 0.02 -0.62 0.00 0.61 0.41 0.00 0.00 173.24 173.67 2dzq n GLY 95 N 0.66 -1.87 3.69 3.44 0.00 -1.26 -5.14 105.19 104.71 2dzq n GLY 95 Ca 0.04 0.87 -0.42 0.00 0.00 0.00 0.00 46.02 46.51 2dzq n GLY 95 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dzq s PRO 96 N 0.00 4.34 -0.06 1.61 0.04 -1.26 -5.02 135.00 134.66 2dzq s PRO 96 Ca 0.00 1.70 -0.08 0.00 0.04 0.00 0.00 61.00 62.66 2dzq s PRO 96 Cb 0.00 -3.56 0.02 0.00 0.04 0.00 0.00 34.50 31.00 2dzq s PRO 96 CO 0.00 -0.46 0.21 -1.12 0.04 0.00 0.00 177.00 175.67 2dzq s SER 97 N 1.52 -0.18 -0.17 6.66 0.01 -1.26 -5.07 113.70 115.21 2dzq s SER 97 Ca 0.57 0.29 -0.13 0.00 1.31 0.00 0.00 55.95 57.99 2dzq s SER 97 Cb -0.25 0.40 -0.06 0.00 0.21 0.00 0.00 66.02 66.31 2dzq s SER 97 CO 0.22 -0.16 -0.21 -0.24 0.41 0.00 0.00 173.24 173.26 2dzq n SER 98 N 2.53 1.86 0.00 2.44 2.88 -1.26 -5.35 113.62 116.72 2dzq n SER 98 Ca -0.15 0.51 0.00 0.00 -1.33 0.00 0.00 58.87 57.90 2dzq n SER 98 Cb 0.58 -0.84 0.00 0.00 -0.75 0.00 0.00 64.21 63.20 2dzq n SER 98 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42