#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ozo n THR 2 N 0.00 0.00 0.31 1.12 -2.24 -1.26 -4.80 114.28 107.40 1ozo n THR 2 Ca 0.00 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.61 1ozo n THR 2 Cb 0.00 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.15 1ozo n THR 2 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1ozo h GLU 3 N 0.00 -0.75 -0.36 -0.78 4.81 -2.04 0.19 114.58 115.63 1ozo h GLU 3 Ca 0.00 0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.32 1ozo h GLU 3 Cb 0.00 0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.52 1ozo h GLU 3 CO 0.00 -0.50 0.15 1.25 -0.73 0.00 0.00 179.01 179.17 1ozo h LEU 4 N -0.78 0.18 0.00 1.64 7.12 -1.98 -1.38 115.31 120.10 1ozo h LEU 4 Ca -0.07 0.03 -0.05 0.00 0.13 0.00 0.00 57.88 57.93 1ozo h LEU 4 Cb 0.62 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.75 1ozo h LEU 4 CO 0.10 0.14 -0.76 -0.33 -0.13 0.00 0.00 178.44 177.46 1ozo h GLU 5 N 0.31 0.00 -0.24 1.25 5.08 -1.91 -0.73 114.58 118.34 1ozo h GLU 5 Ca 0.16 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.39 1ozo h GLU 5 Cb 0.12 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 1ozo h GLU 5 CO -0.15 0.12 -0.38 0.00 -1.00 0.00 0.00 179.01 177.60 1ozo h ALA 6 N 1.82 0.37 0.05 3.43 0.00 -0.63 0.74 119.26 125.04 1ozo h ALA 6 Ca -0.03 -0.44 0.03 0.00 0.00 0.00 0.00 54.91 54.46 1ozo h ALA 6 Cb 1.16 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.84 1ozo h ALA 6 CO 0.02 0.46 -0.33 0.00 0.00 0.00 0.00 179.25 179.40 1ozo h ALA 7 N 0.64 -0.52 0.00 0.00 0.00 -1.14 0.35 119.26 118.60 1ozo h ALA 7 Ca 0.02 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1ozo h ALA 7 Cb 0.97 0.56 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1ozo h ALA 7 CO 0.09 -0.86 -0.17 1.98 0.00 0.00 0.00 179.25 180.29 1ozo h MET 8 N -0.51 0.00 -0.85 0.00 -1.53 -1.20 -0.16 114.93 110.68 1ozo h MET 8 Ca 0.05 0.00 0.20 0.00 -3.44 0.00 0.00 59.70 56.51 1ozo h MET 8 Cb 0.57 0.00 -0.15 0.00 -0.55 0.00 0.00 31.60 31.47 1ozo h MET 8 CO -0.24 0.17 -0.03 0.78 0.14 0.00 0.00 176.91 177.73 1ozo h GLY 9 N 1.75 0.92 1.63 1.39 0.00 0.03 -1.64 103.07 107.14 1ozo h GLY 9 Ca -0.00 0.16 -0.04 0.00 0.00 0.00 0.00 47.33 47.45 1ozo h GLY 9 CO 0.02 -0.36 0.02 -0.33 0.00 0.00 0.00 176.54 175.89 1ozo h MET 10 N 0.06 0.47 0.00 4.80 2.86 0.98 0.42 114.93 124.52 1ozo h MET 10 Ca 0.47 -0.09 -0.15 0.00 -2.06 0.00 0.00 59.70 57.87 1ozo h MET 10 Cb 0.85 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.41 1ozo h MET 10 CO -0.79 0.48 -0.80 -0.84 1.06 0.00 0.00 176.91 176.02 1ozo h ILE 11 N 0.46 1.08 0.00 -1.22 -2.65 -1.43 0.83 117.51 114.59 1ozo h ILE 11 Ca 0.10 -2.58 -0.05 0.00 1.03 0.00 0.00 64.86 63.36 1ozo h ILE 11 Cb 0.27 2.51 -0.01 0.00 -2.05 0.00 0.00 36.82 37.54 1ozo h ILE 11 CO 0.00 0.62 -0.22 0.40 0.03 0.00 0.00 178.15 178.98 1ozo h ILE 12 N 0.00 0.61 0.09 0.16 1.08 -1.06 -3.25 117.51 115.15 1ozo h ILE 12 Ca -0.03 -1.02 -0.21 0.00 -0.39 0.00 0.00 64.86 63.20 1ozo h ILE 12 Cb 1.55 1.68 0.02 0.00 -3.07 0.00 0.00 36.82 37.00 1ozo h ILE 12 CO 0.08 0.22 -0.88 -0.78 -0.69 0.00 0.00 178.15 176.10 1ozo h ASP 13 N 0.00 0.61 -0.01 1.72 3.58 0.65 0.11 116.42 123.09 1ozo h ASP 13 Ca -0.00 -0.85 0.00 0.00 0.42 0.00 0.00 57.03 56.60 1ozo h ASP 13 Cb 0.66 -0.19 -0.00 0.00 1.72 0.00 0.00 39.33 41.51 1ozo h ASP 13 CO 0.03 1.40 0.01 -0.37 -2.88 0.00 0.00 179.24 177.43 1ozo h VAL 14 N -0.09 0.77 0.02 2.25 -1.51 -0.98 0.49 116.25 117.19 1ozo h VAL 14 Ca -0.14 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.33 1ozo h VAL 14 Cb 1.62 0.99 0.00 0.00 -2.13 0.00 0.00 31.29 31.77 1ozo h VAL 14 CO 0.17 0.00 -0.01 0.15 -1.23 0.00 0.00 177.57 176.65 1ozo h PHE 15 N 0.00 -0.02 -0.09 5.19 3.57 -1.57 -3.07 116.94 120.94 1ozo h PHE 15 Ca 0.00 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.53 1ozo h PHE 15 Cb 0.02 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 38.76 1ozo h PHE 15 CO 0.00 0.43 0.17 0.77 -2.23 0.00 0.00 178.31 177.46 1ozo h SER 16 N -0.48 0.00 0.42 0.41 0.02 0.15 0.17 113.55 114.23 1ozo h SER 16 Ca -0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1ozo h SER 16 Cb 0.47 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.01 1ozo h SER 16 CO 0.00 0.00 -0.20 0.03 -1.14 0.00 0.00 176.83 175.52 1ozo h ARG 17 N 0.00 -0.54 0.05 3.45 -0.00 -0.19 -3.28 114.38 113.87 1ozo h ARG 17 Ca 0.04 0.04 -0.26 0.00 -0.50 0.00 0.00 59.98 59.30 1ozo h ARG 17 Cb 0.39 0.12 -0.02 0.00 0.00 0.00 0.00 29.97 30.46 1ozo h ARG 17 CO -0.00 -0.36 -1.41 1.88 0.00 0.00 0.00 179.97 180.08 1ozo h TYR 18 N -0.64 0.20 -0.00 3.04 0.05 -1.04 -3.34 116.97 115.24 1ozo h TYR 18 Ca -0.06 -0.15 0.00 0.00 0.05 0.00 0.00 58.73 58.58 1ozo h TYR 18 Cb 0.43 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.16 1ozo h TYR 18 CO 0.10 1.55 -0.06 -1.13 -1.05 0.00 0.00 178.16 177.57 1ozo n SER 19 N -4.12 0.31 -2.66 3.88 3.41 0.43 -4.91 113.62 109.95 1ozo n SER 19 Ca -0.30 -0.51 -0.21 0.00 -0.26 0.00 0.00 58.87 57.59 1ozo n SER 19 Cb 0.80 -0.13 0.01 0.00 -0.26 0.00 0.00 64.21 64.63 1ozo n SER 19 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ozo n GLY 20 N 1.25 -0.51 5.07 5.00 0.00 -1.19 -0.64 105.19 114.17 1ozo n GLY 20 Ca 0.16 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1ozo n GLY 20 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ozo n SER 21 N -2.18 0.00 -3.08 1.61 7.64 -1.22 -3.89 113.62 112.50 1ozo n SER 21 Ca -0.18 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.54 1ozo n SER 21 Cb 0.65 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.85 1ozo n SER 21 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1ozo n GLU 22 N 0.00 0.97 0.00 1.43 0.28 -1.23 -4.53 120.64 117.56 1ozo n GLU 22 Ca 0.00 -3.01 0.09 0.00 -0.16 0.00 0.00 57.16 54.08 1ozo n GLU 22 Cb 0.00 -1.53 0.49 0.00 1.43 0.00 0.00 31.44 31.84 1ozo n GLU 22 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ozo n GLY 23 N 0.38 -0.83 0.00 -1.84 0.00 0.19 -4.89 105.19 98.19 1ozo n GLY 23 Ca 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1ozo n GLY 23 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ozo n SER 24 N -1.22 0.00 0.16 1.61 7.64 -1.26 -3.44 113.62 117.11 1ozo n SER 24 Ca 0.10 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.84 1ozo n SER 24 Cb 0.13 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.26 1ozo n SER 24 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1ozo h THR 25 N 0.00 0.29 -3.63 0.44 1.35 -1.95 -3.36 112.91 106.05 1ozo h THR 25 Ca 0.00 0.00 -0.79 0.00 -0.55 0.00 0.00 66.41 65.07 1ozo h THR 25 Cb 0.00 0.29 -0.28 0.00 -1.73 0.00 0.00 68.15 66.44 1ozo h THR 25 CO 0.00 0.00 0.34 -1.10 -0.25 0.00 0.00 175.52 174.51 1ozo s GLN 26 N -6.00 4.02 0.00 4.72 -0.21 -1.22 -4.89 119.66 116.07 1ozo s GLN 26 Ca -0.16 -3.01 0.00 0.00 0.02 0.00 0.00 55.36 52.21 1ozo s GLN 26 Cb 0.07 -4.51 0.00 0.00 1.00 0.00 0.00 33.01 29.57 1ozo s GLN 26 CO 0.64 -1.25 0.00 0.25 -2.12 0.00 0.00 175.29 172.80 1ozo n THR 27 N 3.05 0.00 -1.74 -0.19 -2.24 -1.26 -2.84 114.28 109.05 1ozo n THR 27 Ca 0.21 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.72 1ozo n THR 27 Cb 0.41 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.56 1ozo n THR 27 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ozo n LEU 28 N 0.00 2.55 -4.64 3.22 4.32 -0.47 -4.77 117.00 117.22 1ozo n LEU 28 Ca 0.00 -2.85 -0.36 0.00 -0.02 0.00 0.00 56.01 52.78 1ozo n LEU 28 Cb 0.00 -1.60 0.09 0.00 -1.62 0.00 0.00 43.42 40.29 1ozo n LEU 28 CO 0.00 -2.23 0.60 1.07 -1.22 0.00 0.00 177.39 175.61 1ozo n THR 29 N 7.96 3.01 -0.47 -5.08 5.66 -1.26 -2.38 114.28 121.71 1ozo n THR 29 Ca 0.44 -0.37 0.39 0.00 -3.05 0.00 0.00 64.05 61.46 1ozo n THR 29 Cb 0.46 -1.16 0.69 0.00 -1.55 0.00 0.00 70.33 68.77 1ozo n THR 29 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 175.07 172.52 1ozo h LYS 30 N -0.21 0.08 0.00 1.09 3.64 -1.91 0.96 116.57 120.22 1ozo h LYS 30 Ca -0.48 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 58.87 1ozo h LYS 30 Cb 1.33 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.13 1ozo h LYS 30 CO 0.48 0.06 -0.56 0.78 -2.27 0.00 0.00 179.45 177.93 1ozo h GLY 31 N 0.09 0.00 0.11 5.01 0.00 -1.97 -3.30 103.07 103.00 1ozo h GLY 31 Ca 0.78 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.91 1ozo h GLY 31 CO -0.25 0.00 -1.06 -2.09 0.00 0.00 0.00 176.54 173.14 1ozo h GLU 32 N 0.00 0.05 -0.96 4.80 4.81 -1.23 -3.40 114.58 118.65 1ozo h GLU 32 Ca -0.02 -0.08 0.28 0.00 -0.13 0.00 0.00 59.36 59.41 1ozo h GLU 32 Cb 1.11 0.03 -0.17 0.00 0.63 0.00 0.00 28.75 30.35 1ozo h GLU 32 CO 0.01 1.04 0.15 1.25 -0.73 0.00 0.00 179.01 180.73 1ozo h LEU 33 N -0.85 -0.25 -1.51 1.64 6.46 -1.19 -0.65 115.31 118.96 1ozo h LEU 33 Ca -0.28 0.26 -0.01 0.00 -0.12 0.00 0.00 57.88 57.74 1ozo h LEU 33 Cb 1.35 0.40 -0.02 0.00 -0.73 0.00 0.00 40.66 41.66 1ozo h LEU 33 CO -0.11 -0.32 0.23 0.07 -0.62 0.00 0.00 178.44 177.69 1ozo h LYS 34 N 0.05 0.56 -0.04 1.25 2.10 -1.77 -2.62 116.57 116.10 1ozo h LYS 34 Ca 0.62 -0.05 -0.22 0.00 -2.00 0.00 0.00 60.65 59.01 1ozo h LYS 34 Cb 1.35 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1ozo h LYS 34 CO -0.83 0.41 -0.87 0.28 -2.00 0.00 0.00 179.45 176.44 1ozo h VAL 35 N 0.57 1.37 -0.37 0.07 2.07 -1.35 -2.47 116.25 116.13 1ozo h VAL 35 Ca 0.15 -2.28 0.05 0.00 0.82 0.00 0.00 66.70 65.44 1ozo h VAL 35 Cb 0.01 2.27 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 1ozo h VAL 35 CO -0.03 0.69 0.11 0.25 0.02 0.00 0.00 177.57 178.61 1ozo h LEU 36 N 0.30 0.09 -1.39 2.57 5.85 -1.58 -3.34 115.31 117.81 1ozo h LEU 36 Ca -0.07 0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 1ozo h LEU 36 Cb 1.49 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.56 1ozo h LEU 36 CO 0.16 0.09 -0.29 0.24 -0.34 0.00 0.00 178.44 178.30 1ozo h MET 37 N 0.25 0.00 0.00 1.25 2.86 -1.05 0.13 114.93 118.37 1ozo h MET 37 Ca 0.17 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.80 1ozo h MET 37 Cb 0.17 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.83 1ozo h MET 37 CO -0.20 0.29 -0.05 0.93 1.06 0.00 0.00 176.91 178.94 1ozo h GLU 38 N 0.00 0.00 0.00 1.72 5.08 -1.66 -1.26 114.58 118.46 1ozo h GLU 38 Ca -0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.05 1ozo h GLU 38 Cb 0.60 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.81 1ozo h GLU 38 CO 0.04 0.05 -2.01 1.63 -1.00 0.00 0.00 179.01 177.72 1ozo n LYS 39 N -3.80 0.42 -0.00 2.33 4.76 -0.54 -4.40 118.16 116.93 1ozo n LYS 39 Ca -0.03 0.18 0.05 0.00 -2.87 0.00 0.00 58.31 55.65 1ozo n LYS 39 Cb 0.15 -1.21 -0.06 0.00 -1.84 0.00 0.00 35.03 32.07 1ozo n LYS 39 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1ozo n GLU 40 N -3.92 3.04 -0.85 1.97 -0.58 0.34 -4.49 120.64 116.14 1ozo n GLU 40 Ca -0.37 -0.02 0.05 0.00 -0.42 0.00 0.00 57.16 56.40 1ozo n GLU 40 Cb 0.75 -1.02 0.15 0.00 -0.57 0.00 0.00 31.44 30.75 1ozo n GLU 40 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1ozo n LEU 41 N -1.36 2.18 -4.72 -4.62 4.32 -0.89 -4.98 117.00 106.93 1ozo n LEU 41 Ca 0.01 -3.32 -0.43 0.00 -0.02 0.00 0.00 56.01 52.26 1ozo n LEU 41 Cb 0.17 -0.37 -0.02 0.00 -1.62 0.00 0.00 43.42 41.59 1ozo n LEU 41 CO 0.20 1.12 1.11 -0.81 -1.22 0.00 0.00 177.39 177.79 1ozo n PRO 42 N -0.64 2.40 0.00 3.23 -0.04 -0.53 -2.04 135.00 137.37 1ozo n PRO 42 Ca 0.15 0.85 0.00 0.00 -0.04 0.00 0.00 63.50 64.46 1ozo n PRO 42 Cb 0.82 -2.56 0.00 0.00 -0.04 0.00 0.00 33.50 31.73 1ozo n PRO 42 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ozo n GLY 43 N 1.80 2.73 0.28 0.55 0.00 -1.26 -4.82 105.19 104.47 1ozo n GLY 43 Ca 0.08 -0.62 0.14 0.00 0.00 0.00 0.00 46.02 45.62 1ozo n GLY 43 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1ozo h PHE 44 N 0.00 0.00 0.00 1.61 0.04 -1.75 -2.01 116.94 114.83 1ozo h PHE 44 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1ozo h PHE 44 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 1ozo h PHE 44 CO 0.00 0.07 0.00 1.28 -0.60 0.00 0.00 178.31 179.06 1ozo n LEU 45 N -3.65 0.00 0.20 1.54 4.77 -1.26 -1.51 117.00 117.09 1ozo n LEU 45 Ca -0.02 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.10 1ozo n LEU 45 Cb 0.17 -0.00 0.70 0.00 -2.33 0.00 0.00 43.42 41.96 1ozo n LEU 45 CO 0.28 -0.00 0.92 1.56 -1.33 0.00 0.00 177.39 178.82 1ozo h GLN 46 N 0.00 0.00 0.00 3.23 4.20 -1.75 -3.21 115.11 117.59 1ozo h GLN 46 Ca 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1ozo h GLN 46 Cb 0.00 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.78 1ozo h GLN 46 CO 0.00 0.00 -0.90 0.45 -0.67 0.00 0.00 178.83 177.71 1ozo n SER 47 N -2.47 1.82 0.00 1.46 2.88 -0.57 -5.04 113.62 111.71 1ozo n SER 47 Ca -0.01 0.30 0.00 0.00 -1.33 0.00 0.00 58.87 57.83 1ozo n SER 47 Cb 0.10 -0.68 0.00 0.00 -0.75 0.00 0.00 64.21 62.87 1ozo n SER 47 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ozo n GLY 48 N 1.74 2.36 0.00 0.46 0.00 -1.05 -4.52 105.19 104.18 1ozo n GLY 48 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1ozo n GLY 48 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ozo n LYS 49 N -1.91 0.00 -0.46 1.61 0.00 -1.26 -4.79 118.16 111.34 1ozo n LYS 49 Ca 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 58.31 58.36 1ozo n LYS 49 Cb 0.00 0.00 0.20 0.00 -0.00 0.00 0.00 35.03 35.23 1ozo n LYS 49 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1ozo n ASP 50 N 0.00 2.80 0.00 -5.58 8.00 -1.24 -4.93 116.55 115.60 1ozo n ASP 50 Ca 0.00 -3.36 0.00 0.00 0.71 0.00 0.00 54.79 52.14 1ozo n ASP 50 Cb 0.00 -0.54 0.00 0.00 -0.02 0.00 0.00 41.12 40.56 1ozo n ASP 50 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1ozo n LYS 51 N -1.01 0.00 -0.19 -1.24 0.00 -1.26 -4.56 118.16 109.90 1ozo n LYS 51 Ca 0.23 0.00 0.06 0.00 0.00 0.00 0.00 58.31 58.60 1ozo n LYS 51 Cb 0.84 -3.84 0.14 0.00 0.00 0.00 0.00 35.03 32.17 1ozo n LYS 51 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1ozo n ASP 52 N 0.00 2.85 -3.87 3.14 8.00 -1.26 -4.59 116.55 120.82 1ozo n ASP 52 Ca 0.00 -2.47 -0.12 0.00 0.71 0.00 0.00 54.79 52.90 1ozo n ASP 52 Cb 0.00 -0.30 -0.07 0.00 -0.02 0.00 0.00 41.12 40.73 1ozo n ASP 52 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ozo s ALA 53 N -1.84 0.66 0.00 2.24 0.00 -1.26 -4.55 121.76 117.01 1ozo s ALA 53 Ca 0.24 -1.41 0.00 0.00 0.00 0.00 0.00 51.96 50.79 1ozo s ALA 53 Cb 0.18 1.24 0.00 0.00 0.00 0.00 0.00 23.12 24.54 1ozo s ALA 53 CO 0.08 -0.73 0.00 0.28 0.00 0.00 0.00 175.76 175.39 1ozo n VAL 54 N -0.40 0.00 -0.20 0.00 0.31 -1.26 -3.67 118.33 113.11 1ozo n VAL 54 Ca 0.01 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.35 1ozo n VAL 54 Cb 0.63 0.00 0.11 0.00 -0.91 0.00 0.00 33.84 33.67 1ozo n VAL 54 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1ozo h ASP 55 N 0.00 -0.10 0.81 4.52 3.58 -1.91 -2.76 116.42 120.55 1ozo h ASP 55 Ca 0.00 0.13 -0.19 0.00 0.42 0.00 0.00 57.03 57.38 1ozo h ASP 55 Cb 0.00 0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.23 1ozo h ASP 55 CO 0.00 -0.04 -0.91 0.11 -2.88 0.00 0.00 179.24 175.52 1ozo h LYS 56 N 0.20 0.06 0.00 0.28 1.79 -1.80 0.30 116.57 117.40 1ozo h LYS 56 Ca 0.32 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.71 1ozo h LYS 56 Cb 0.50 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.17 1ozo h LYS 56 CO -0.45 0.92 0.00 1.28 -1.08 0.00 0.00 179.45 180.12 1ozo n LEU 57 N -3.52 0.00 -0.03 2.94 7.99 -1.13 -1.51 117.00 121.74 1ozo n LEU 57 Ca -0.02 0.17 -0.08 0.00 -0.01 0.00 0.00 56.01 56.08 1ozo n LEU 57 Cb 0.85 -0.17 -0.03 0.00 -0.11 0.00 0.00 43.42 43.97 1ozo n LEU 57 CO 0.47 -0.13 -0.56 -0.11 -1.51 0.00 0.00 177.39 175.55 1ozo n LEU 58 N -1.17 1.19 0.21 2.23 0.00 -0.97 -4.83 117.00 113.66 1ozo n LEU 58 Ca 0.05 0.19 0.14 0.00 0.00 0.00 0.00 56.01 56.38 1ozo n LEU 58 Cb 0.05 -0.44 0.76 0.00 0.00 0.00 0.00 43.42 43.79 1ozo n LEU 58 CO 0.05 -0.21 1.12 0.11 0.00 0.00 0.00 177.39 178.47 1ozo h LYS 59 N -0.42 0.00 0.00 1.96 1.79 -0.04 0.21 116.57 120.07 1ozo h LYS 59 Ca -0.13 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.34 1ozo h LYS 59 Cb 0.79 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.44 1ozo h LYS 59 CO -0.08 0.00 0.00 -0.25 -1.08 0.00 0.00 179.45 178.04 1ozo n ASP 60 N -4.15 0.26 0.00 0.86 9.92 -0.57 -4.27 116.55 118.61 1ozo n ASP 60 Ca 0.00 0.54 0.00 0.00 -0.53 0.00 0.00 54.79 54.80 1ozo n ASP 60 Cb 0.24 -0.61 0.00 0.00 -0.64 0.00 0.00 41.12 40.11 1ozo n ASP 60 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ozo n LEU 61 N -1.76 0.13 0.00 0.64 -0.00 -0.69 -4.72 117.00 110.60 1ozo n LEU 61 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.06 1ozo n LEU 61 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.71 1ozo n LEU 61 CO 0.23 0.02 0.00 -0.67 -0.00 0.00 0.00 177.39 176.97 1ozo n ASP 62 N -1.08 0.00 0.24 1.45 -0.08 -0.02 -0.30 116.55 116.75 1ozo n ASP 62 Ca 0.00 0.00 0.17 0.00 -1.51 0.00 0.00 54.79 53.45 1ozo n ASP 62 Cb 0.15 0.00 0.80 0.00 2.34 0.00 0.00 41.12 44.41 1ozo n ASP 62 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ozo h ALA 63 N 0.00 1.65 0.00 -1.67 0.00 -1.85 -0.69 119.26 116.70 1ozo h ALA 63 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ozo h ALA 63 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1ozo h ALA 63 CO 0.00 -0.44 -0.51 -0.97 0.00 0.00 0.00 179.25 177.33 1ozo h ASN 64 N 0.00 0.00 0.00 0.00 -0.00 -1.03 -3.46 115.58 111.09 1ozo h ASN 64 Ca 0.08 -0.03 0.00 0.00 -0.00 0.00 0.00 56.30 56.34 1ozo h ASN 64 Cb 0.80 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.12 1ozo h ASN 64 CO -0.00 0.02 0.00 0.61 -0.00 0.00 0.00 177.43 178.06 1ozo n GLY 65 N 1.19 -0.44 2.12 1.57 0.00 -0.37 -4.94 105.19 104.33 1ozo n GLY 65 Ca 0.02 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1ozo n GLY 65 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ozo n ASP 66 N -1.97 -2.31 0.00 1.61 2.03 -0.61 -5.04 116.55 110.26 1ozo n ASP 66 Ca 0.00 0.68 0.00 0.00 0.52 0.00 0.00 54.79 55.99 1ozo n ASP 66 Cb 0.00 2.26 0.00 0.00 -0.72 0.00 0.00 41.12 42.66 1ozo n ASP 66 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ozo n ALA 67 N -3.40 0.00 -1.70 -1.67 0.00 -1.25 -4.81 120.51 107.68 1ozo n ALA 67 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 1ozo n ALA 67 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1ozo n ALA 67 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ozo s GLN 68 N 0.00 1.98 -0.03 0.00 -0.21 -1.26 -4.62 119.66 115.51 1ozo s GLN 68 Ca 0.00 0.57 -0.30 0.00 0.02 0.00 0.00 55.36 55.65 1ozo s GLN 68 Cb 0.00 -4.75 -0.05 0.00 1.00 0.00 0.00 33.01 29.21 1ozo s GLN 68 CO 0.00 -3.83 1.37 0.08 -2.12 0.00 0.00 175.29 170.78 1ozo s VAL 69 N 12.84 3.86 0.67 1.09 1.01 -1.00 -4.82 120.40 134.04 1ozo s VAL 69 Ca 0.87 1.21 0.05 0.00 0.00 0.00 0.00 61.98 64.11 1ozo s VAL 69 Cb -0.13 -3.78 0.12 0.00 0.00 0.00 0.00 36.38 32.60 1ozo s VAL 69 CO 0.12 -0.02 0.92 -0.62 0.00 0.00 0.00 175.10 175.50 1ozo s ASP 70 N 1.91 4.63 0.24 3.32 -1.08 -1.26 -1.37 116.67 123.06 1ozo s ASP 70 Ca 0.62 -0.68 0.05 0.00 -0.52 0.00 0.00 52.55 52.02 1ozo s ASP 70 Cb -0.29 0.29 0.26 0.00 -1.46 0.00 0.00 42.92 41.71 1ozo s ASP 70 CO 0.25 -1.69 1.56 2.19 0.52 0.00 0.00 175.17 178.00 1ozo h PHE 71 N -0.23 0.25 0.32 -5.34 -5.15 -1.98 -1.42 116.94 103.38 1ozo h PHE 71 Ca -0.32 -0.10 -0.00 0.00 -0.20 0.00 0.00 57.97 57.35 1ozo h PHE 71 Cb 1.28 -0.04 -0.02 0.00 0.22 0.00 0.00 35.95 37.38 1ozo h PHE 71 CO 0.08 0.76 -0.29 1.03 -2.00 0.00 0.00 178.31 177.89 1ozo h SER 72 N 0.14 -0.78 -0.19 -0.68 0.87 -1.97 0.15 113.55 111.09 1ozo h SER 72 Ca -0.01 0.07 0.04 0.00 -1.23 0.00 0.00 61.79 60.66 1ozo h SER 72 Cb 1.13 0.26 -0.04 0.00 -0.44 0.00 0.00 62.40 63.31 1ozo h SER 72 CO 0.09 -0.42 -0.07 -0.33 -0.53 0.00 0.00 176.83 175.57 1ozo h GLU 73 N -0.63 -0.04 0.60 2.24 5.08 -1.80 -1.43 114.58 118.61 1ozo h GLU 73 Ca -0.02 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1ozo h GLU 73 Cb 0.57 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.83 1ozo h GLU 73 CO -0.04 -0.02 -0.29 0.35 -1.00 0.00 0.00 179.01 178.00 1ozo h PHE 74 N -0.04 -0.75 -0.29 4.33 3.57 -1.21 -1.82 116.94 120.73 1ozo h PHE 74 Ca 0.10 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 1ozo h PHE 74 Cb 0.19 0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.16 1ozo h PHE 74 CO -0.23 -0.44 0.03 0.97 -2.23 0.00 0.00 178.31 176.41 1ozo h ILE 75 N -0.90 1.16 0.12 1.41 6.09 -0.52 0.24 117.51 125.11 1ozo h ILE 75 Ca -0.08 -0.61 -0.01 0.00 -1.37 0.00 0.00 64.86 62.79 1ozo h ILE 75 Cb 0.65 0.91 0.00 0.00 0.47 0.00 0.00 36.82 38.85 1ozo h ILE 75 CO 0.14 0.21 -0.06 0.58 -3.07 0.00 0.00 178.15 175.95 1ozo h VAL 76 N 0.42 1.00 -0.69 2.19 2.07 -1.31 -2.18 116.25 117.75 1ozo h VAL 76 Ca 0.10 -0.46 0.04 0.00 0.82 0.00 0.00 66.70 67.20 1ozo h VAL 76 Cb 0.23 1.29 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 1ozo h VAL 76 CO 0.00 0.11 0.41 0.15 0.02 0.00 0.00 177.57 178.27 1ozo h PHE 77 N -0.37 0.77 -0.48 1.57 3.57 -0.49 -2.42 116.94 119.09 1ozo h PHE 77 Ca -0.02 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.60 1ozo h PHE 77 Cb 0.30 -0.25 -0.08 0.00 2.79 0.00 0.00 35.95 38.72 1ozo h PHE 77 CO -0.00 0.41 -0.00 0.28 -2.23 0.00 0.00 178.31 176.77 1ozo h VAL 78 N 0.79 0.63 0.00 1.41 2.07 -0.56 0.31 116.25 120.90 1ozo h VAL 78 Ca 0.29 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.77 1ozo h VAL 78 Cb 0.09 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1ozo h VAL 78 CO -0.14 0.02 0.00 0.00 0.02 0.00 0.00 177.57 177.47 1ozo n ALA 79 N -2.65 1.31 0.02 1.67 0.00 -0.82 -0.98 120.51 119.06 1ozo n ALA 79 Ca 0.05 0.03 -0.22 0.00 0.00 0.00 0.00 53.44 53.30 1ozo n ALA 79 Cb 0.26 -1.19 -0.14 0.00 0.00 0.00 0.00 19.45 18.38 1ozo n ALA 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ozo h ALA 80 N 2.19 0.26 -0.70 0.00 0.00 -0.51 -3.41 119.26 117.10 1ozo h ALA 80 Ca 0.00 -1.22 0.14 0.00 0.00 0.00 0.00 54.91 53.84 1ozo h ALA 80 Cb 0.13 0.57 -0.10 0.00 0.00 0.00 0.00 17.79 18.39 1ozo h ALA 80 CO 0.00 1.04 0.20 0.82 0.00 0.00 0.00 179.25 181.31 1ozo h ILE 81 N -0.10 0.60 0.00 0.00 1.08 0.13 0.21 117.51 119.43 1ozo h ILE 81 Ca -0.36 -0.11 0.00 0.00 -0.39 0.00 0.00 64.86 64.00 1ozo h ILE 81 Cb 1.93 0.25 0.00 0.00 -3.07 0.00 0.00 36.82 35.92 1ozo h ILE 81 CO 0.09 0.06 0.16 1.07 -0.69 0.00 0.00 178.15 178.84 1ozo n THR 82 N -5.10 1.24 -0.09 -0.27 5.66 -0.68 -0.15 114.28 114.90 1ozo n THR 82 Ca 0.13 0.57 -0.15 0.00 -3.05 0.00 0.00 64.05 61.54 1ozo n THR 82 Cb 0.40 -1.57 -0.07 0.00 -1.55 0.00 0.00 70.33 67.54 1ozo n THR 82 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1ozo n SER 83 N -1.57 2.04 0.00 1.09 3.41 0.46 -4.72 113.62 114.33 1ozo n SER 83 Ca -0.00 0.05 0.08 0.00 -0.26 0.00 0.00 58.87 58.73 1ozo n SER 83 Cb 0.17 -0.39 0.40 0.00 -0.26 0.00 0.00 64.21 64.12 1ozo n SER 83 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ozo n ALA 84 N -3.37 1.89 -0.08 7.33 0.00 0.33 -3.15 120.51 123.47 1ozo n ALA 84 Ca -0.33 -0.08 0.25 0.00 0.00 0.00 0.00 53.44 53.29 1ozo n ALA 84 Cb 0.79 -1.25 0.63 0.00 0.00 0.00 0.00 19.45 19.62 1ozo n ALA 84 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1ozo h SER 85 N 0.00 0.00 0.01 0.00 0.02 -0.81 -2.08 113.55 110.69 1ozo h SER 85 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ozo h SER 85 Cb 0.12 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.66 1ozo h SER 85 CO 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 1ozo n HIS 86 N -3.56 0.00 0.00 3.45 1.44 -1.19 -1.57 115.22 113.79 1ozo n HIS 86 Ca 0.16 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.87 1ozo n HIS 86 Cb 1.06 -0.11 0.00 0.00 0.12 0.00 0.00 29.99 31.06 1ozo n HIS 86 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 1ozo n LYS 87 N -1.11 0.00 0.00 -1.40 0.00 -0.79 0.10 118.16 114.97 1ozo n LYS 87 Ca 0.01 0.12 0.00 0.00 0.00 0.00 0.00 58.31 58.43 1ozo n LYS 87 Cb 0.01 -1.66 0.00 0.00 0.00 0.00 0.00 35.03 33.37 1ozo n LYS 87 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1ozo n TYR 88 N -0.99 0.00 0.00 5.64 4.01 -1.26 -4.93 117.16 119.62 1ozo n TYR 88 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1ozo n TYR 88 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 1ozo n TYR 88 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1ozo n PHE 89 N -0.10 0.00 -0.33 -0.72 3.72 0.11 -4.61 117.46 115.53 1ozo n PHE 89 Ca 0.00 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.48 1ozo n PHE 89 Cb 0.10 0.00 0.28 0.00 -0.94 0.00 0.00 39.48 38.92 1ozo n PHE 89 CO 0.00 0.00 0.00 1.05 -0.05 0.00 0.00 176.76 177.76 1ozo h GLU 90 N 0.00 0.88 -0.31 -1.08 9.09 -1.96 -0.53 114.58 120.67 1ozo h GLU 90 Ca 0.00 -0.05 -0.03 0.00 0.05 0.00 0.00 59.36 59.32 1ozo h GLU 90 Cb 0.00 -0.20 -0.02 0.00 -1.65 0.00 0.00 28.75 26.88 1ozo h GLU 90 CO 0.00 0.58 0.01 0.36 0.05 0.00 0.00 179.01 180.01 1ozo n LYS 91 N -4.59 2.92 -4.12 1.06 0.00 -1.26 -4.90 118.16 107.26 1ozo n LYS 91 Ca 0.18 -2.91 -0.33 0.00 -0.00 0.00 0.00 58.31 55.25 1ozo n LYS 91 Cb 0.38 -1.88 -0.05 0.00 -0.00 0.00 0.00 35.03 33.47 1ozo n LYS 91 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1ozo n THR 92 N -0.52 -1.39 0.00 0.58 -2.24 -0.21 -4.04 114.28 106.47 1ozo n THR 92 Ca 0.24 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 1ozo n THR 92 Cb 0.95 -1.27 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 1ozo n THR 92 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ozo n GLY 93 N -2.30 0.67 0.00 3.38 0.00 -1.24 -1.41 105.19 104.30 1ozo n GLY 93 Ca -0.23 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1ozo n GLY 93 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1ozo n LEU 94 N 0.00 0.00 0.00 0.99 -0.00 -0.61 -4.62 117.00 112.76 1ozo n LEU 94 Ca 0.00 -0.42 0.00 0.00 -0.00 0.00 0.00 56.01 55.59 1ozo n LEU 94 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1ozo n LEU 94 CO 0.00 0.42 0.16 1.17 -0.00 0.00 0.00 177.39 179.14