#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v32 n SER 2 N 0.00 3.56 0.09 1.61 7.64 -1.26 -4.31 113.62 120.95 1v32 n SER 2 Ca 0.00 0.64 0.00 0.00 1.01 0.00 0.00 58.87 60.52 1v32 n SER 2 Cb 0.00 -1.48 0.00 0.00 -1.01 0.00 0.00 64.21 61.72 1v32 n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1v32 n SER 3 N 8.98 -1.59 0.00 6.43 2.88 -1.26 -5.07 113.62 124.00 1v32 n SER 3 Ca 0.26 0.59 0.00 0.00 -1.33 0.00 0.00 58.87 58.38 1v32 n SER 3 Cb 0.38 1.74 0.00 0.00 -0.75 0.00 0.00 64.21 65.59 1v32 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v32 n GLY 4 N -1.21 0.03 2.53 0.46 0.00 -1.26 -5.11 105.19 100.63 1v32 n GLY 4 Ca 0.00 -0.42 -0.27 0.00 0.00 0.00 0.00 46.02 45.33 1v32 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1v32 n SER 5 N 0.00 0.85 -2.67 1.61 2.88 -1.26 -4.95 113.62 110.07 1v32 n SER 5 Ca 0.00 -2.71 -0.03 0.00 -1.33 0.00 0.00 58.87 54.80 1v32 n SER 5 Cb 0.00 -0.63 0.04 0.00 -0.75 0.00 0.00 64.21 62.87 1v32 n SER 5 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1v32 n SER 6 N 2.35 -1.51 0.00 -3.46 3.41 -1.26 -5.02 113.62 108.13 1v32 n SER 6 Ca 0.26 -1.12 0.00 0.00 -0.26 0.00 0.00 58.87 57.75 1v32 n SER 6 Cb 0.44 0.77 0.00 0.00 -0.26 0.00 0.00 64.21 65.16 1v32 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v32 n GLY 7 N 2.47 4.56 3.72 5.00 0.00 -1.26 -5.10 105.19 114.57 1v32 n GLY 7 Ca 0.11 -1.72 -0.39 0.00 0.00 0.00 0.00 46.02 44.01 1v32 n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1v32 s LYS 8 N 3.71 4.37 1.09 1.61 2.20 -1.26 -5.05 119.74 126.41 1v32 s LYS 8 Ca 0.00 0.62 -0.19 0.00 -0.36 0.00 0.00 55.97 56.05 1v32 s LYS 8 Cb 0.00 -3.45 0.10 0.00 -1.51 0.00 0.00 37.83 32.97 1v32 s LYS 8 CO 0.00 0.09 -0.07 0.54 -0.36 0.00 0.00 175.35 175.55 1v32 n ARG 9 N 3.81 -1.68 -4.51 4.03 1.74 -1.26 -5.03 116.66 113.75 1v32 n ARG 9 Ca -0.04 -0.48 -0.25 0.00 -0.77 0.00 0.00 57.85 56.31 1v32 n ARG 9 Cb 0.51 -1.58 -0.09 0.00 -1.02 0.00 0.00 32.46 30.28 1v32 n ARG 9 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1v32 s PHE 10 N -2.17 1.88 -1.23 -1.55 5.36 -1.26 -5.06 117.98 113.95 1v32 s PHE 10 Ca 0.49 -1.10 -0.08 0.00 -0.96 0.00 0.00 56.93 55.29 1v32 s PHE 10 Cb -0.08 -1.27 0.20 0.00 -0.34 0.00 0.00 43.02 41.53 1v32 s PHE 10 CO 0.58 -0.10 1.79 0.39 -1.46 0.00 0.00 175.22 176.42 1v32 n GLU 11 N -0.85 3.86 -1.61 10.12 1.02 -1.26 -4.92 120.64 127.00 1v32 n GLU 11 Ca -0.06 -3.78 0.00 0.00 -0.02 0.00 0.00 57.16 53.30 1v32 n GLU 11 Cb 0.66 -2.82 0.00 0.00 -0.02 0.00 0.00 31.44 29.26 1v32 n GLU 11 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1v32 n PHE 12 N 3.18 -4.32 -3.24 -0.32 3.01 -1.26 -4.69 117.46 109.82 1v32 n PHE 12 Ca 0.37 2.34 -0.40 0.00 1.01 0.00 0.00 57.45 60.76 1v32 n PHE 12 Cb 0.35 -3.60 -0.02 0.00 -0.01 0.00 0.00 39.48 36.21 1v32 n PHE 12 CO 0.00 0.00 0.00 1.55 1.01 0.00 0.00 176.76 179.32 1v32 n VAL 13 N -2.50 4.41 0.00 -4.37 3.14 -1.02 -4.96 118.33 113.03 1v32 n VAL 13 Ca 0.00 -5.59 0.00 0.00 -2.96 0.00 0.00 64.34 55.79 1v32 n VAL 13 Cb 0.45 -2.24 0.00 0.00 -1.06 0.00 0.00 33.84 30.98 1v32 n VAL 13 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1v32 n GLY 14 N 1.72 0.64 0.10 7.55 0.00 -1.26 -4.42 105.19 109.51 1v32 n GLY 14 Ca 0.25 -1.59 -0.14 0.00 0.00 0.00 0.00 46.02 44.55 1v32 n GLY 14 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1v32 h TRP 15 N 0.00 0.33 -1.09 1.61 5.08 -1.95 -3.47 115.95 116.46 1v32 h TRP 15 Ca 0.00 -0.24 -0.58 0.00 1.08 0.00 0.00 58.89 59.14 1v32 h TRP 15 Cb 0.00 -0.01 -0.08 0.00 -3.00 0.00 0.00 29.16 26.07 1v32 h TRP 15 CO 0.00 1.24 -0.43 0.20 -1.28 0.00 0.00 178.44 178.17 1v32 s GLY 16 N -4.81 2.43 0.33 11.11 0.00 -1.26 0.14 107.32 115.26 1v32 s GLY 16 Ca -0.05 -1.59 -0.10 0.00 0.00 0.00 0.00 44.72 42.98 1v32 s GLY 16 CO 0.85 -1.94 0.68 -0.45 0.00 0.00 0.00 173.10 172.24 1v32 s SER 17 N -4.04 6.59 0.30 1.64 0.15 -1.26 -2.43 113.70 114.65 1v32 s SER 17 Ca 0.34 1.06 0.07 0.00 0.70 0.00 0.00 55.95 58.12 1v32 s SER 17 Cb 0.01 -2.29 0.84 0.00 -1.71 0.00 0.00 66.02 62.88 1v32 s SER 17 CO 0.20 -0.26 1.42 -1.14 1.20 0.00 0.00 173.24 174.66 1v32 n ARG 18 N -0.80 -0.07 0.00 5.44 3.00 -1.26 -1.18 116.66 121.79 1v32 n ARG 18 Ca 0.02 1.33 0.00 0.00 -0.00 0.00 0.00 57.85 59.19 1v32 n ARG 18 Cb 0.53 -2.18 0.00 0.00 0.00 0.00 0.00 32.46 30.81 1v32 n ARG 18 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1v32 n GLN 19 N -5.25 0.00 0.08 -0.14 1.13 -1.26 0.18 117.38 112.12 1v32 n GLN 19 Ca 0.25 0.54 -0.12 0.00 -1.94 0.00 0.00 57.00 55.73 1v32 n GLN 19 Cb 0.83 -1.01 -0.05 0.00 0.11 0.00 0.00 30.24 30.12 1v32 n GLN 19 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1v32 h LEU 20 N 0.00 -0.75 0.00 1.08 5.85 -1.63 -1.74 115.31 118.12 1v32 h LEU 20 Ca 0.00 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1v32 h LEU 20 Cb 0.00 0.30 0.00 0.00 0.37 0.00 0.00 40.66 41.33 1v32 h LEU 20 CO 0.00 -0.33 0.00 -0.38 -0.34 0.00 0.00 178.44 177.39 1v32 n ILE 21 N -5.37 0.00 -0.26 4.05 2.08 -0.32 0.64 119.36 120.17 1v32 n ILE 21 Ca -0.05 1.20 -0.07 0.00 0.56 0.00 0.00 62.75 64.39 1v32 n ILE 21 Cb 0.29 -1.69 -0.06 0.00 -0.75 0.00 0.00 39.64 37.43 1v32 n ILE 21 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 1v32 n GLU 22 N -1.87 -0.27 -0.33 0.38 0.00 0.47 0.15 120.64 119.18 1v32 n GLU 22 Ca 0.00 1.23 0.25 0.00 0.00 0.00 0.00 57.16 58.64 1v32 n GLU 22 Cb 0.00 -1.82 0.49 0.00 0.00 0.00 0.00 31.44 30.12 1v32 n GLU 22 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 1v32 h PHE 23 N 0.00 0.89 -0.03 4.31 3.04 -0.36 1.00 116.94 125.79 1v32 h PHE 23 Ca 0.10 0.04 -0.25 0.00 3.98 0.00 0.00 57.97 61.84 1v32 h PHE 23 Cb 0.25 -0.22 0.02 0.00 2.56 0.00 0.00 35.95 38.55 1v32 h PHE 23 CO -0.92 -0.25 -0.94 -0.07 -2.02 0.00 0.00 178.31 174.11 1v32 h LEU 24 N 0.25 0.88 -0.22 0.59 3.38 0.71 -2.87 115.31 118.03 1v32 h LEU 24 Ca 0.76 -0.72 0.05 0.00 0.09 0.00 0.00 57.88 58.05 1v32 h LEU 24 Cb 1.79 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 42.22 1v32 h LEU 24 CO -0.65 1.48 -0.10 0.45 0.09 0.00 0.00 178.44 179.71 1v32 h HIS 25 N 0.36 -0.24 0.46 1.13 3.86 0.90 0.11 115.15 121.73 1v32 h HIS 25 Ca -0.11 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.11 1v32 h HIS 25 Cb 1.60 0.14 -0.02 0.00 1.06 0.00 0.00 27.41 30.19 1v32 h HIS 25 CO 0.11 -0.16 -0.46 0.77 0.86 0.00 0.00 177.93 179.05 1v32 h SER 26 N -0.08 -1.25 -1.63 2.45 0.02 -0.56 -0.43 113.55 112.07 1v32 h SER 26 Ca 0.12 0.10 0.50 0.00 -0.84 0.00 0.00 61.79 61.66 1v32 h SER 26 Cb 0.25 0.41 -0.10 0.00 0.14 0.00 0.00 62.40 63.10 1v32 h SER 26 CO -0.26 -0.60 1.13 -0.07 -1.14 0.00 0.00 176.83 175.88 1v32 h LEU 27 N -0.91 0.10 0.00 5.07 3.38 -1.25 -3.43 115.31 118.26 1v32 h LEU 27 Ca -0.06 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1v32 h LEU 27 Cb 0.79 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1v32 h LEU 27 CO -0.05 -0.08 0.00 0.61 0.09 0.00 0.00 178.44 179.01 1v32 n GLY 28 N -1.74 1.31 3.57 0.83 0.00 -0.17 -5.07 105.19 103.92 1v32 n GLY 28 Ca 0.40 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.99 1v32 n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v32 s LYS 29 N -0.01 3.61 -0.55 1.61 -0.14 0.28 -4.96 119.74 119.58 1v32 s LYS 29 Ca 0.00 0.24 -0.26 0.00 -1.36 0.00 0.00 55.97 54.59 1v32 s LYS 29 Cb 0.00 -3.89 -0.04 0.00 -1.68 0.00 0.00 37.83 32.22 1v32 s LYS 29 CO 0.00 -1.11 2.12 0.34 -0.76 0.00 0.00 175.35 175.94 1v32 s ASP 30 N 2.12 4.88 -0.74 2.83 -1.08 -1.26 -4.17 116.67 119.26 1v32 s ASP 30 Ca 0.36 0.71 -0.14 0.00 -0.52 0.00 0.00 52.55 52.96 1v32 s ASP 30 Cb -0.11 -2.52 -0.12 0.00 -1.46 0.00 0.00 42.92 38.72 1v32 s ASP 30 CO 0.23 -2.61 1.92 0.35 0.52 0.00 0.00 175.17 175.59 1v32 n THR 31 N 7.59 1.85 -0.05 1.71 -2.24 -1.26 -4.24 114.28 117.63 1v32 n THR 31 Ca 0.28 -1.35 -0.16 0.00 -2.27 0.00 0.00 64.05 60.55 1v32 n THR 31 Cb 0.53 -2.17 -0.14 0.00 -2.10 0.00 0.00 70.33 66.45 1v32 n THR 31 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1v32 n SER 32 N 6.08 1.50 -4.62 3.42 7.64 -1.26 -4.97 113.62 121.41 1v32 n SER 32 Ca 0.44 0.14 -0.25 0.00 1.01 0.00 0.00 58.87 60.21 1v32 n SER 32 Cb 0.27 -0.30 -0.09 0.00 -1.01 0.00 0.00 64.21 63.08 1v32 n SER 32 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1v32 s GLU 33 N -2.55 2.03 0.23 1.43 0.41 -1.26 -5.03 118.70 113.96 1v32 s GLU 33 Ca -0.20 -1.82 -0.06 0.00 -0.41 0.00 0.00 54.97 52.49 1v32 s GLU 33 Cb 0.07 -1.87 0.35 0.00 -1.78 0.00 0.00 34.13 30.90 1v32 s GLU 33 CO 0.75 0.11 1.80 1.98 -0.49 0.00 0.00 175.26 179.40 1v32 h MET 34 N 1.82 0.67 -4.10 1.61 -1.53 -1.97 -3.48 114.93 107.95 1v32 h MET 34 Ca -0.43 -0.04 0.00 0.00 -3.44 0.00 0.00 59.70 55.79 1v32 h MET 34 Cb 1.25 -0.15 -0.03 0.00 -0.55 0.00 0.00 31.60 32.12 1v32 h MET 34 CO 0.69 0.44 -0.84 -0.89 0.14 0.00 0.00 176.91 176.45 1v32 n ILE 35 N -4.80-10.40 -1.00 1.77 5.41 -1.26 -4.92 119.36 104.16 1v32 n ILE 35 Ca 0.12 2.26 -0.35 0.00 1.00 0.00 0.00 62.75 65.79 1v32 n ILE 35 Cb 0.26 -5.40 0.09 0.00 -0.71 0.00 0.00 39.64 33.88 1v32 n ILE 35 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1v32 n SER 36 N 1.32 -2.12 -0.22 4.38 7.64 -1.26 -4.77 113.62 118.60 1v32 n SER 36 Ca -0.08 0.42 -0.06 0.00 1.01 0.00 0.00 58.87 60.16 1v32 n SER 36 Cb 0.12 -1.17 0.04 0.00 -1.01 0.00 0.00 64.21 62.20 1v32 n SER 36 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1v32 h ARG 37 N -1.03 0.82 -0.92 1.43 9.65 -1.96 -2.24 114.38 120.13 1v32 h ARG 37 Ca -0.44 -0.06 0.21 0.00 -1.10 0.00 0.00 59.98 58.59 1v32 h ARG 37 Cb 1.31 -0.18 -0.12 0.00 -1.39 0.00 0.00 29.97 29.59 1v32 h ARG 37 CO 0.37 0.56 0.46 -0.92 2.80 0.00 0.00 179.97 183.23 1v32 h TYR 38 N 0.83 0.77 0.87 2.20 5.03 -1.96 0.23 116.97 124.94 1v32 h TYR 38 Ca 0.22 0.04 -0.04 0.00 2.58 0.00 0.00 58.73 61.53 1v32 h TYR 38 Cb -0.07 -0.20 0.01 0.00 1.55 0.00 0.00 36.73 38.02 1v32 h TYR 38 CO -0.03 0.03 -0.43 0.22 -1.32 0.00 0.00 178.16 176.63 1v32 h ASP 39 N 0.50 -1.03 -0.25 -2.11 3.58 -1.74 0.14 116.42 115.51 1v32 h ASP 39 Ca 0.56 0.04 0.05 0.00 0.42 0.00 0.00 57.03 58.10 1v32 h ASP 39 Cb 1.03 0.27 -0.08 0.00 1.72 0.00 0.00 39.33 42.27 1v32 h ASP 39 CO -0.48 -0.72 -0.45 0.58 -2.88 0.00 0.00 179.24 175.29 1v32 h VAL 40 N -1.18 0.11 -0.18 2.25 2.07 -1.13 0.31 116.25 118.50 1v32 h VAL 40 Ca -0.12 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.42 1v32 h VAL 40 Cb 0.91 0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.74 1v32 h VAL 40 CO 0.19 0.00 -0.29 -1.28 0.02 0.00 0.00 177.57 176.21 1v32 h SER 41 N -0.44 -0.96 -0.83 0.57 0.87 -0.51 0.61 113.55 112.87 1v32 h SER 41 Ca 0.09 0.12 0.20 0.00 -1.23 0.00 0.00 61.79 60.98 1v32 h SER 41 Cb 0.62 0.39 -0.15 0.00 -0.44 0.00 0.00 62.40 62.82 1v32 h SER 41 CO -0.48 -0.22 0.02 -0.78 -0.53 0.00 0.00 176.83 174.84 1v32 h ASP 42 N -0.23 -0.37 -0.52 6.23 1.82 -0.17 1.55 116.42 124.73 1v32 h ASP 42 Ca 0.03 0.22 0.01 0.00 -0.39 0.00 0.00 57.03 56.90 1v32 h ASP 42 Cb 0.32 0.38 -0.03 0.00 0.68 0.00 0.00 39.33 40.69 1v32 h ASP 42 CO -0.29 -0.22 0.34 0.74 -1.61 0.00 0.00 179.24 178.20 1v32 h THR 43 N 0.09 1.12 0.15 2.25 2.02 0.18 -0.17 112.91 118.55 1v32 h THR 43 Ca 0.47 -0.23 -0.01 0.00 0.77 0.00 0.00 66.41 67.41 1v32 h THR 43 Cb 0.87 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 1v32 h THR 43 CO -0.74 0.12 -0.07 0.40 0.37 0.00 0.00 175.52 175.60 1v32 h ILE 44 N 0.68 0.98 -0.99 3.11 2.04 0.74 0.23 117.51 124.30 1v32 h ILE 44 Ca 0.19 -0.99 0.20 0.00 1.00 0.00 0.00 64.86 65.26 1v32 h ILE 44 Cb -0.05 1.54 -0.10 0.00 -0.74 0.00 0.00 36.82 37.48 1v32 h ILE 44 CO -0.04 0.22 0.62 0.00 0.00 0.00 0.00 178.15 178.94 1v32 h ALA 45 N -0.02 1.81 0.11 1.87 0.00 0.14 0.82 119.26 123.99 1v32 h ALA 45 Ca -0.02 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1v32 h ALA 45 Cb 0.51 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1v32 h ALA 45 CO 0.03 -0.17 -0.05 -0.22 0.00 0.00 0.00 179.25 178.85 1v32 h LYS 46 N 0.68 -0.14 -0.44 0.00 3.64 -0.95 -3.10 116.57 116.25 1v32 h LYS 46 Ca 0.56 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 60.03 1v32 h LYS 46 Cb 0.99 0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.77 1v32 h LYS 46 CO -0.34 0.33 0.04 -0.92 -2.27 0.00 0.00 179.45 176.30 1v32 h TYR 47 N -0.71 0.05 -0.64 1.91 3.20 0.95 1.46 116.97 123.19 1v32 h TYR 47 Ca -0.01 0.03 0.12 0.00 3.14 0.00 0.00 58.73 62.00 1v32 h TYR 47 Cb 0.54 0.04 -0.12 0.00 1.54 0.00 0.00 36.73 38.73 1v32 h TYR 47 CO 0.09 -0.05 -0.29 0.82 -1.64 0.00 0.00 178.16 177.10 1v32 h ILE 48 N 0.16 0.20 -0.09 1.81 2.04 0.55 0.12 117.51 122.30 1v32 h ILE 48 Ca 0.22 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.94 1v32 h ILE 48 Cb 0.31 0.20 0.01 0.00 -0.74 0.00 0.00 36.82 36.60 1v32 h ILE 48 CO -0.33 0.00 -0.49 -1.28 0.00 0.00 0.00 178.15 176.05 1v32 h SER 49 N -0.11 0.58 -0.67 1.72 0.87 -1.23 1.53 113.55 116.24 1v32 h SER 49 Ca 0.27 -0.65 0.06 0.00 -1.23 0.00 0.00 61.79 60.24 1v32 h SER 49 Cb 0.54 -0.17 -0.08 0.00 -0.44 0.00 0.00 62.40 62.25 1v32 h SER 49 CO -0.70 1.14 -0.44 0.50 -0.53 0.00 0.00 176.83 176.80 1v32 h LYS 50 N 0.06 -0.05 -0.00 2.24 3.64 0.36 -2.22 116.57 120.60 1v32 h LYS 50 Ca -0.04 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1v32 h LYS 50 Cb 1.14 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 1v32 h LYS 50 CO 0.10 -0.03 -0.02 0.93 -2.27 0.00 0.00 179.45 178.16 1v32 h GLU 51 N -0.05 0.02 0.00 1.90 4.39 -0.93 -3.49 114.58 116.42 1v32 h GLU 51 Ca 0.11 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1v32 h GLU 51 Cb 0.33 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.98 1v32 h GLU 51 CO -0.66 0.69 0.00 0.41 -1.16 0.00 0.00 179.01 178.29 1v32 n GLY 52 N 0.73 0.94 0.16 -3.84 0.00 0.68 -5.03 105.19 98.83 1v32 n GLY 52 Ca -0.09 -0.05 0.07 0.00 0.00 0.00 0.00 46.02 45.95 1v32 n GLY 52 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1v32 h LEU 53 N 0.00 0.00 -9.17 0.99 4.07 0.17 -3.47 115.31 107.91 1v32 h LEU 53 Ca 0.00 0.00 -0.52 0.00 0.08 0.00 0.00 57.88 57.44 1v32 h LEU 53 Cb 0.00 0.00 0.24 0.00 1.08 0.00 0.00 40.66 41.98 1v32 h LEU 53 CO 0.00 0.28 -1.88 0.18 -1.08 0.00 0.00 178.44 175.94 1v32 n LEU 54 N -3.06 -4.06 -4.50 1.67 4.77 -1.24 -0.09 117.00 110.47 1v32 n LEU 54 Ca 0.01 0.12 -0.32 0.00 -0.03 0.00 0.00 56.01 55.79 1v32 n LEU 54 Cb 0.66 -0.76 -0.12 0.00 -2.33 0.00 0.00 43.42 40.86 1v32 n LEU 54 CO 0.39 -4.45 -0.45 -0.62 -1.33 0.00 0.00 177.39 170.93 1v32 s ASP 55 N -1.21 4.11 0.15 -1.43 2.15 -1.25 -4.43 116.67 114.76 1v32 s ASP 55 Ca 0.43 -0.28 -0.02 0.00 0.43 0.00 0.00 52.55 53.10 1v32 s ASP 55 Cb -0.10 -0.82 -0.03 0.00 -0.30 0.00 0.00 42.92 41.68 1v32 s ASP 55 CO 0.75 0.29 1.36 1.55 -0.17 0.00 0.00 175.17 178.95 1v32 h PRO 56 N 4.76 0.38 0.00 4.34 0.13 -1.96 -2.16 132.00 137.49 1v32 h PRO 56 Ca -0.47 -0.37 -0.03 0.00 -0.87 0.00 0.00 66.00 64.25 1v32 h PRO 56 Cb 1.16 0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 1v32 h PRO 56 CO 0.50 1.04 -0.14 1.03 -0.23 0.00 0.00 178.00 180.20 1v32 h SER 57 N 0.23 0.00 -0.26 1.44 0.87 -2.01 -3.41 113.55 110.41 1v32 h SER 57 Ca -0.06 0.00 0.25 0.00 -1.23 0.00 0.00 61.79 60.75 1v32 h SER 57 Cb 1.47 0.00 -0.21 0.00 -0.44 0.00 0.00 62.40 63.22 1v32 h SER 57 CO 0.15 0.14 0.14 0.21 -0.53 0.00 0.00 176.83 176.93 1v32 s ASN 58 N -6.28 -0.38 0.39 6.23 2.47 -1.15 -5.02 114.94 111.20 1v32 s ASN 58 Ca -0.03 0.20 0.06 0.00 0.42 0.00 0.00 52.86 53.51 1v32 s ASN 58 Cb 0.13 1.30 0.77 0.00 -1.45 0.00 0.00 41.25 42.01 1v32 s ASN 58 CO 0.60 -0.07 2.00 0.11 -3.72 0.00 0.00 177.10 176.03 1v32 h LYS 59 N 7.87 0.55 -0.45 0.43 6.56 -1.64 -0.39 116.57 129.51 1v32 h LYS 59 Ca -0.12 -0.06 0.13 0.00 -1.06 0.00 0.00 60.65 59.54 1v32 h LYS 59 Cb 1.17 -0.11 -0.02 0.00 -0.57 0.00 0.00 32.23 32.70 1v32 h LYS 59 CO -0.12 0.43 0.62 0.87 -2.06 0.00 0.00 179.45 179.18 1v32 h LYS 60 N 0.56 0.00 -6.91 3.15 1.79 -1.95 -3.40 116.57 109.80 1v32 h LYS 60 Ca 0.14 0.00 -0.47 0.00 -2.18 0.00 0.00 60.65 58.14 1v32 h LYS 60 Cb 0.05 0.00 0.06 0.00 -1.58 0.00 0.00 32.23 30.76 1v32 h LYS 60 CO -0.02 0.00 0.01 0.15 -1.08 0.00 0.00 179.45 178.51 1v32 s LYS 61 N -4.45 1.98 -0.06 3.15 1.02 -0.16 -2.62 119.74 118.61 1v32 s LYS 61 Ca -0.04 -1.27 -0.03 0.00 0.02 0.00 0.00 55.97 54.66 1v32 s LYS 61 Cb 0.13 -2.46 0.04 0.00 -0.52 0.00 0.00 37.83 35.01 1v32 s LYS 61 CO 0.45 -1.16 0.13 0.08 -0.92 0.00 0.00 175.35 173.93 1v32 s VAL 62 N -2.93 -0.05 -0.50 3.17 1.01 0.13 -3.87 120.40 117.37 1v32 s VAL 62 Ca 0.64 0.17 -0.13 0.00 0.00 0.00 0.00 61.98 62.66 1v32 s VAL 62 Cb -0.06 -0.22 0.11 0.00 0.00 0.00 0.00 36.38 36.22 1v32 s VAL 62 CO 0.42 0.07 0.41 -0.69 0.00 0.00 0.00 175.10 175.31 1v32 s VAL 63 N 1.07 4.81 0.57 2.92 1.01 0.87 -0.59 120.40 131.06 1v32 s VAL 63 Ca -0.08 -1.51 -0.20 0.00 0.00 0.00 0.00 61.98 60.18 1v32 s VAL 63 Cb -0.11 -4.06 -0.05 0.00 0.00 0.00 0.00 36.38 32.16 1v32 s VAL 63 CO -0.05 -0.76 1.08 0.00 0.00 0.00 0.00 175.10 175.37 1v32 n ASP 65 N -0.74 1.33 0.13 0.00 -0.08 -1.26 -4.87 116.55 111.06 1v32 n ASP 65 Ca 0.13 0.21 0.00 0.00 -1.51 0.00 0.00 54.79 53.62 1v32 n ASP 65 Cb 0.46 -0.49 0.00 0.00 2.34 0.00 0.00 41.12 43.43 1v32 n ASP 65 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1v32 n LYS 66 N -3.85 0.00 -0.14 -0.67 3.00 -1.26 -4.86 118.16 110.39 1v32 n LYS 66 Ca -0.13 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.13 1v32 n LYS 66 Cb 0.40 0.00 0.01 0.00 0.00 0.00 0.00 35.03 35.44 1v32 n LYS 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1v32 h ARG 67 N 0.00 -0.12 -0.78 1.64 3.08 -1.98 0.95 114.38 117.18 1v32 h ARG 67 Ca 0.00 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 1v32 h ARG 67 Cb 0.00 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 1v32 h ARG 67 CO 0.00 -0.08 0.32 -0.07 -1.07 0.00 0.00 179.97 179.07 1v32 h LEU 68 N -0.13 1.06 0.51 3.04 3.38 -1.94 -1.55 115.31 119.68 1v32 h LEU 68 Ca 0.21 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1v32 h LEU 68 Cb 0.46 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1v32 h LEU 68 CO -0.53 0.93 -0.25 0.58 0.09 0.00 0.00 178.44 179.26 1v32 h VAL 69 N 1.13 0.48 0.00 1.22 2.07 -0.94 0.94 116.25 121.14 1v32 h VAL 69 Ca 0.26 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.78 1v32 h VAL 69 Cb 0.20 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1v32 h VAL 69 CO -0.02 0.00 0.09 -0.07 0.02 0.00 0.00 177.57 177.59 1v32 h LEU 70 N -0.70 0.00 0.00 2.57 3.38 0.10 1.47 115.31 122.14 1v32 h LEU 70 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1v32 h LEU 70 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1v32 h LEU 70 CO 0.11 0.00 -0.06 0.25 0.09 0.00 0.00 178.44 178.83 1v32 h LEU 71 N 0.00 0.00 0.00 1.67 5.85 -0.01 -3.43 115.31 119.39 1v32 h LEU 71 Ca 0.00 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.58 1v32 h LEU 71 Cb 0.18 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1v32 h LEU 71 CO 0.00 0.10 -0.87 -0.26 -0.34 0.00 0.00 178.44 177.07 1v32 h PHE 72 N -0.15 0.00 0.00 1.25 0.04 0.11 -3.45 116.94 114.74 1v32 h PHE 72 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1v32 h PHE 72 Cb 0.06 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.21 1v32 h PHE 72 CO -0.02 1.09 0.00 0.41 -0.60 0.00 0.00 178.31 179.18 1v32 n GLY 73 N 1.51 0.88 3.95 -1.45 0.00 0.50 -5.00 105.19 105.59 1v32 n GLY 73 Ca -0.23 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.57 1v32 n GLY 73 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1v32 s THR 74 N -2.00 4.90 -0.17 2.61 -4.23 -1.26 -4.95 115.64 110.53 1v32 s THR 74 Ca 0.00 -0.64 -0.23 0.00 -1.18 0.00 0.00 61.69 59.64 1v32 s THR 74 Cb 0.00 -3.77 -0.21 0.00 1.34 0.00 0.00 72.50 69.87 1v32 s THR 74 CO 0.00 -0.44 0.42 -0.09 -0.54 0.00 0.00 174.62 173.97 1v32 h ARG 75 N 0.81 0.00 -6.38 3.99 9.65 -1.95 -3.39 114.38 117.11 1v32 h ARG 75 Ca -0.49 0.00 -0.63 0.00 -1.10 0.00 0.00 59.98 57.76 1v32 h ARG 75 Cb 1.23 0.00 -0.25 0.00 -1.39 0.00 0.00 29.97 29.56 1v32 h ARG 75 CO 0.60 0.91 -0.86 0.95 2.80 0.00 0.00 179.97 184.38 1v32 s THR 76 N -2.26 1.88 0.12 0.20 -4.23 -1.26 0.19 115.64 110.27 1v32 s THR 76 Ca -0.23 -1.35 -0.09 0.00 -1.18 0.00 0.00 61.69 58.85 1v32 s THR 76 Cb 0.02 -1.64 -0.00 0.00 1.34 0.00 0.00 72.50 72.22 1v32 s THR 76 CO 0.59 0.22 0.23 0.27 -0.54 0.00 0.00 174.62 175.40 1v32 s ILE 77 N -0.86 0.11 -0.07 2.99 -4.36 0.25 -4.94 121.20 114.31 1v32 s ILE 77 Ca 0.09 -1.25 -0.24 0.00 -0.26 0.00 0.00 60.65 59.00 1v32 s ILE 77 Cb -0.09 -1.54 -0.04 0.00 1.25 0.00 0.00 42.46 42.04 1v32 s ILE 77 CO 0.02 -0.50 0.71 -0.36 0.24 0.00 0.00 174.94 175.06 1v32 s PHE 78 N -3.90 3.57 0.61 1.37 0.40 -1.26 0.21 117.98 118.97 1v32 s PHE 78 Ca 0.10 1.25 0.31 0.00 -0.60 0.00 0.00 56.93 57.99 1v32 s PHE 78 Cb 0.04 -2.82 1.70 0.00 0.51 0.00 0.00 43.02 42.45 1v32 s PHE 78 CO -0.07 0.06 1.95 -0.09 0.70 0.00 0.00 175.22 177.78 1v32 h ARG 79 N 6.81 0.00 -0.61 0.44 2.43 -1.76 1.38 114.38 123.06 1v32 h ARG 79 Ca -0.40 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 1v32 h ARG 79 Cb 1.19 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1v32 h ARG 79 CO 0.76 0.00 0.00 0.00 -1.51 0.00 0.00 179.97 179.22 1v32 n MET 80 N -2.85 2.66 -0.03 0.20 0.00 -1.26 -4.09 117.12 111.75 1v32 n MET 80 Ca -0.02 -2.52 0.01 0.00 0.00 0.00 0.00 57.70 55.16 1v32 n MET 80 Cb 0.32 -1.54 -0.10 0.00 0.00 0.00 0.00 33.22 31.90 1v32 n MET 80 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1v32 n LYS 81 N 1.54 1.14 -0.09 3.17 4.76 0.47 -4.63 118.16 124.52 1v32 n LYS 81 Ca 0.22 -0.07 -0.03 0.00 -2.87 0.00 0.00 58.31 55.57 1v32 n LYS 81 Cb 0.61 -1.33 -0.02 0.00 -1.84 0.00 0.00 35.03 32.45 1v32 n LYS 81 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1v32 h VAL 82 N 0.00 0.00 -0.87 -0.18 2.07 -1.59 1.51 116.25 117.20 1v32 h VAL 82 Ca -0.17 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.44 1v32 h VAL 82 Cb 1.19 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.84 1v32 h VAL 82 CO 0.01 0.00 -0.55 0.22 0.02 0.00 0.00 177.57 177.27 1v32 h TYR 83 N -0.00 -1.74 -0.07 1.57 5.03 -1.84 0.25 116.97 120.17 1v32 h TYR 83 Ca 0.04 0.12 0.04 0.00 2.58 0.00 0.00 58.73 61.50 1v32 h TYR 83 Cb 0.10 0.87 -0.05 0.00 1.55 0.00 0.00 36.73 39.20 1v32 h TYR 83 CO -0.94 -0.40 -0.24 -0.44 -1.32 0.00 0.00 178.16 174.82 1v32 h ASP 84 N -0.09 -0.71 -1.00 -2.11 5.19 -1.34 0.25 116.42 116.61 1v32 h ASP 84 Ca 0.17 0.11 0.31 0.00 -0.62 0.00 0.00 57.03 57.00 1v32 h ASP 84 Cb 0.47 0.31 -0.15 0.00 0.18 0.00 0.00 39.33 40.14 1v32 h ASP 84 CO -0.87 -0.29 0.56 -0.07 -3.12 0.00 0.00 179.24 175.45 1v32 h LEU 85 N -0.33 0.52 -8.23 1.55 3.38 0.47 -3.26 115.31 109.41 1v32 h LEU 85 Ca 0.08 0.19 -0.36 0.00 0.09 0.00 0.00 57.88 57.88 1v32 h LEU 85 Cb 0.45 0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.27 1v32 h LEU 85 CO -0.26 -0.11 0.89 -0.76 0.09 0.00 0.00 178.44 178.29 1v32 s LEU 86 N -10.43 3.23 0.00 1.67 1.43 0.61 -4.08 118.68 111.11 1v32 s LEU 86 Ca -0.10 -0.73 0.00 0.00 -1.03 0.00 0.00 54.13 52.27 1v32 s LEU 86 Cb 0.30 -2.56 0.00 0.00 0.03 0.00 0.00 46.19 43.96 1v32 s LEU 86 CO 0.79 -2.52 0.00 1.21 0.23 0.00 0.00 176.35 176.06 1v32 n GLU 87 N 8.89 0.00 0.00 1.70 2.13 -1.23 -4.84 120.64 127.28 1v32 n GLU 87 Ca 0.37 0.00 0.16 0.00 0.66 0.00 0.00 57.16 58.35 1v32 n GLU 87 Cb 0.48 0.00 0.87 0.00 0.27 0.00 0.00 31.44 33.06 1v32 n GLU 87 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1v32 n LYS 88 N -2.51 0.77 -1.30 5.31 5.02 -1.26 -3.15 118.16 121.04 1v32 n LYS 88 Ca 0.00 -0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.02 1v32 n LYS 88 Cb 0.00 -1.50 0.12 0.00 -0.02 0.00 0.00 35.03 33.63 1v32 n LYS 88 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1v32 n HIS 89 N -1.12 2.86 -3.71 2.13 8.25 -1.26 -4.79 115.22 117.58 1v32 n HIS 89 Ca 0.20 -2.38 -0.12 0.00 -0.26 0.00 0.00 57.72 55.15 1v32 n HIS 89 Cb 0.16 -1.06 -0.10 0.00 1.12 0.00 0.00 29.99 30.12 1v32 n HIS 89 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1v32 s TYR 90 N -3.56 -0.54 0.00 4.41 1.51 -1.19 -4.06 117.35 113.92 1v32 s TYR 90 Ca 0.58 1.27 0.00 0.00 -1.01 0.00 0.00 57.07 57.91 1v32 s TYR 90 Cb 0.48 0.21 0.00 0.00 -0.11 0.00 0.00 41.96 42.53 1v32 s TYR 90 CO 0.03 -0.27 0.00 1.17 -1.11 0.00 0.00 175.55 175.37 1v32 n LYS 91 N 3.17 3.27 -1.55 -0.62 4.81 0.37 -4.96 118.16 122.65 1v32 n LYS 91 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.28 1v32 n LYS 91 Cb 0.57 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.62 1v32 n LYS 91 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1v32 n GLU 92 N 0.00 -4.44 -1.41 1.64 0.00 -1.26 -4.79 120.64 110.38 1v32 n GLU 92 Ca 0.00 3.31 -0.46 0.00 0.00 0.00 0.00 57.16 60.01 1v32 n GLU 92 Cb 0.00 -3.73 -0.02 0.00 0.00 0.00 0.00 31.44 27.69 1v32 n GLU 92 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1v32 n ASN 93 N -0.92 -1.15 -3.18 4.31 4.13 -1.26 -4.96 115.26 112.23 1v32 n ASN 93 Ca 0.00 1.05 0.05 0.00 1.68 0.00 0.00 54.58 57.36 1v32 n ASN 93 Cb 0.01 -1.00 -0.03 0.00 -1.54 0.00 0.00 39.78 37.22 1v32 n ASN 93 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1v32 s GLN 94 N -1.14 0.08 0.23 3.52 1.03 -1.26 -5.14 119.66 116.97 1v32 s GLN 94 Ca 0.62 0.16 -0.31 0.00 0.04 0.00 0.00 55.36 55.87 1v32 s GLN 94 Cb -0.81 0.09 -0.15 0.00 0.03 0.00 0.00 33.01 32.18 1v32 s GLN 94 CO 0.58 -0.06 1.16 -3.47 -2.54 0.00 0.00 175.29 170.96 1v32 n ASP 95 N 5.13 1.61 0.00 12.60 -0.08 -1.26 -4.92 116.55 129.63 1v32 n ASP 95 Ca -0.08 1.16 0.00 0.00 -1.51 0.00 0.00 54.79 54.36 1v32 n ASP 95 Cb 0.55 -1.28 0.00 0.00 2.34 0.00 0.00 41.12 42.72 1v32 n ASP 95 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1v32 n SER 96 N 1.75 0.00 -1.14 1.67 7.64 -1.26 -5.16 113.62 117.12 1v32 n SER 96 Ca 0.12 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.14 1v32 n SER 96 Cb 0.29 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.45 1v32 n SER 96 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v32 n GLY 97 N 0.00 -1.44 0.07 0.23 0.00 -1.26 -4.98 105.19 97.81 1v32 n GLY 97 Ca 0.00 -0.92 -0.02 0.00 0.00 0.00 0.00 46.02 45.08 1v32 n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v32 h PRO 98 N 0.00 -0.13 0.00 1.61 0.13 -2.01 -3.52 132.00 128.08 1v32 h PRO 98 Ca 0.02 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1v32 h PRO 98 Cb 0.94 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.10 1v32 h PRO 98 CO 0.01 -0.09 0.00 -1.13 -0.23 0.00 0.00 178.00 176.56 1v32 n SER 99 N -3.21 0.00 -2.35 1.44 3.41 -1.26 -5.14 113.62 106.52 1v32 n SER 99 Ca -0.02 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.59 1v32 n SER 99 Cb 0.05 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1v32 n SER 99 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1v32 n SER 100 N 1.36 -7.45 0.00 4.04 2.88 -1.26 -5.28 113.62 107.90 1v32 n SER 100 Ca 0.00 1.71 0.00 0.00 -1.33 0.00 0.00 58.87 59.25 1v32 n SER 100 Cb 0.00 -4.68 0.00 0.00 -0.75 0.00 0.00 64.21 58.78 1v32 n SER 100 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42