#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c07 n TRP 10 N 0.00 1.65 -0.13 -1.42 4.27 -1.26 -4.89 117.44 115.65 1c07 n TRP 10 Ca 0.00 0.59 -0.10 0.00 -3.89 0.00 0.00 57.50 54.11 1c07 n TRP 10 Cb 0.00 -2.34 0.09 0.00 -1.36 0.00 0.00 31.31 27.70 1c07 n TRP 10 CO 0.00 0.00 0.00 1.33 -2.29 0.00 0.00 177.69 176.73 1c07 n VAL 11 N 1.27 0.00 -2.06 -1.67 0.24 0.12 -4.52 118.33 111.71 1c07 n VAL 11 Ca 0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.42 1c07 n VAL 11 Cb 0.29 -0.31 0.00 0.00 -1.47 0.00 0.00 33.84 32.35 1c07 n VAL 11 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 1c07 n VAL 12 N -3.76 -0.67 0.02 3.34 3.14 -1.26 -4.97 118.33 114.17 1c07 n VAL 12 Ca 0.04 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.42 1c07 n VAL 12 Cb 0.19 -1.67 0.00 0.00 -1.06 0.00 0.00 33.84 31.29 1c07 n VAL 12 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1c07 n SER 13 N 2.03 0.05 -0.68 6.55 7.64 -1.26 -4.62 113.62 123.32 1c07 n SER 13 Ca 0.00 0.06 0.00 0.00 1.01 0.00 0.00 58.87 59.94 1c07 n SER 13 Cb 0.00 0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 1c07 n SER 13 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1c07 n PRO 14 N -2.65 2.97 -0.15 1.43 -0.04 -1.26 -3.53 135.00 131.76 1c07 n PRO 14 Ca 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.43 1c07 n PRO 14 Cb 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.45 1c07 n PRO 14 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1c07 n ALA 15 N -3.00 -0.16 -0.26 0.55 0.00 -1.26 -0.36 120.51 116.03 1c07 n ALA 15 Ca 0.00 0.35 -0.07 0.00 0.00 0.00 0.00 53.44 53.71 1c07 n ALA 15 Cb 0.00 -0.10 -0.07 0.00 0.00 0.00 0.00 19.45 19.28 1c07 n ALA 15 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1c07 h GLU 16 N 0.00 -0.03 -0.29 0.00 5.08 -1.96 1.96 114.58 119.34 1c07 h GLU 16 Ca 0.09 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.52 1c07 h GLU 16 Cb 0.19 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1c07 h GLU 16 CO -0.37 -0.02 0.20 -0.22 -1.00 0.00 0.00 179.01 177.61 1c07 h LYS 17 N -0.03 0.11 -0.02 2.33 3.11 -0.74 -1.02 116.57 120.31 1c07 h LYS 17 Ca 0.10 -0.01 -0.14 0.00 -2.81 0.00 0.00 60.65 57.79 1c07 h LYS 17 Cb 0.28 -0.03 0.01 0.00 -1.00 0.00 0.00 32.23 31.50 1c07 h LYS 17 CO -0.59 0.07 -0.53 0.00 -2.81 0.00 0.00 179.45 175.59 1c07 h ALA 18 N 1.85 0.10 0.00 5.00 0.00 0.12 0.15 119.26 126.48 1c07 h ALA 18 Ca 0.13 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 1c07 h ALA 18 Cb 0.39 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1c07 h ALA 18 CO -0.02 0.32 -0.05 -0.22 0.00 0.00 0.00 179.25 179.28 1c07 h LYS 19 N -0.11 0.00 0.00 0.00 3.64 0.35 -2.13 116.57 118.32 1c07 h LYS 19 Ca -0.06 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.21 1c07 h LYS 19 Cb 1.23 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.03 1c07 h LYS 19 CO 0.11 0.05 -0.73 1.88 -2.27 0.00 0.00 179.45 178.49 1c07 h TYR 20 N 0.00 0.00 -1.15 1.91 0.05 -1.15 -2.80 116.97 113.83 1c07 h TYR 20 Ca -0.00 0.00 0.33 0.00 0.05 0.00 0.00 58.73 59.11 1c07 h TYR 20 Cb 0.10 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 37.79 1c07 h TYR 20 CO 0.00 0.93 0.91 0.22 -1.05 0.00 0.00 178.16 179.18 1c07 h ASP 21 N -1.00 0.00 0.19 3.88 1.82 -0.59 1.84 116.42 122.55 1c07 h ASP 21 Ca -0.17 0.00 -0.26 0.00 -0.39 0.00 0.00 57.03 56.21 1c07 h ASP 21 Cb 0.95 0.00 0.03 0.00 0.68 0.00 0.00 39.33 40.98 1c07 h ASP 21 CO -0.10 0.00 -1.16 -0.33 -1.61 0.00 0.00 179.24 176.04 1c07 h GLU 22 N 0.00 0.39 -0.11 0.28 5.08 -1.49 -3.30 114.58 115.43 1c07 h GLU 22 Ca 0.55 -0.67 -0.15 0.00 -1.00 0.00 0.00 59.36 58.09 1c07 h GLU 22 Cb 2.37 0.25 -0.01 0.00 0.50 0.00 0.00 28.75 31.86 1c07 h GLU 22 CO -0.01 1.32 -0.57 0.82 -1.00 0.00 0.00 179.01 179.58 1c07 h ILE 23 N -0.15 1.36 -1.10 3.13 2.04 0.10 -2.77 117.51 120.12 1c07 h ILE 23 Ca -0.21 -1.87 0.30 0.00 1.00 0.00 0.00 64.86 64.09 1c07 h ILE 23 Cb 1.87 1.89 -0.07 0.00 -0.74 0.00 0.00 36.82 39.78 1c07 h ILE 23 CO 0.19 0.56 0.75 0.15 0.00 0.00 0.00 178.15 179.81 1c07 h PHE 24 N 0.26 0.31 0.00 1.37 3.04 0.23 2.69 116.94 124.84 1c07 h PHE 24 Ca 0.00 0.01 -0.03 0.00 3.98 0.00 0.00 57.97 61.93 1c07 h PHE 24 Cb 1.07 -0.09 -0.00 0.00 2.56 0.00 0.00 35.95 39.49 1c07 h PHE 24 CO 0.03 0.02 -0.13 -0.07 -2.02 0.00 0.00 178.31 176.14 1c07 h LEU 25 N 0.18 0.00 0.00 0.59 3.38 -1.60 0.32 115.31 118.18 1c07 h LEU 25 Ca 0.57 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.54 1c07 h LEU 25 Cb 1.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.63 1c07 h LEU 25 CO -0.15 0.13 -1.25 0.29 0.09 0.00 0.00 178.44 177.55 1c07 n LYS 26 N -3.62 0.37 -0.09 1.13 5.02 0.85 -4.47 118.16 117.34 1c07 n LYS 26 Ca -0.02 -0.06 -0.15 0.00 -2.02 0.00 0.00 58.31 56.07 1c07 n LYS 26 Cb 0.25 -1.47 -0.08 0.00 -0.02 0.00 0.00 35.03 33.71 1c07 n LYS 26 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1c07 h THR 27 N 0.00 0.59 0.00 -0.18 2.02 0.11 -3.39 112.91 112.07 1c07 h THR 27 Ca 0.00 -1.73 -0.34 0.00 0.77 0.00 0.00 66.41 65.11 1c07 h THR 27 Cb 0.62 1.41 0.03 0.00 -1.74 0.00 0.00 68.15 68.46 1c07 h THR 27 CO 0.00 0.20 2.11 -0.67 0.37 0.00 0.00 175.52 177.53 1c07 n ASP 28 N -4.52 3.14 -0.01 4.18 -0.08 0.10 -4.33 116.55 115.04 1c07 n ASP 28 Ca -0.21 -2.31 0.23 0.00 -1.51 0.00 0.00 54.79 50.98 1c07 n ASP 28 Cb 0.50 -0.92 0.62 0.00 2.34 0.00 0.00 41.12 43.66 1c07 n ASP 28 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1c07 h LYS 29 N 7.18 0.00 -0.33 -0.67 6.56 -1.84 0.69 116.57 128.17 1c07 h LYS 29 Ca 0.35 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.94 1c07 h LYS 29 Cb 0.23 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.89 1c07 h LYS 29 CO 1.46 0.00 0.00 -0.25 -2.06 0.00 0.00 179.45 178.60 1c07 n ASP 30 N -3.46 2.14 -2.76 0.86 8.00 -1.26 -4.90 116.55 115.16 1c07 n ASP 30 Ca 0.13 -1.90 -0.12 0.00 0.71 0.00 0.00 54.79 53.61 1c07 n ASP 30 Cb 0.97 -0.22 -0.01 0.00 -0.02 0.00 0.00 41.12 41.84 1c07 n ASP 30 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1c07 n MET 31 N 0.65 -2.66 -0.89 -1.24 2.81 0.24 -4.76 117.12 111.27 1c07 n MET 31 Ca 0.15 0.34 0.07 0.00 -1.81 0.00 0.00 57.70 56.46 1c07 n MET 31 Cb 0.37 -4.93 0.40 0.00 -0.71 0.00 0.00 33.22 28.35 1c07 n MET 31 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1c07 n ASP 32 N -1.84 5.70 -0.30 7.83 5.75 -1.26 -4.88 116.55 127.54 1c07 n ASP 32 Ca -0.06 -2.93 -0.04 0.00 -0.01 0.00 0.00 54.79 51.76 1c07 n ASP 32 Cb 0.55 -0.68 -0.02 0.00 -1.03 0.00 0.00 41.12 39.94 1c07 n ASP 32 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1c07 n GLY 33 N 0.61 0.50 2.88 6.12 0.00 -1.26 -4.92 105.19 109.12 1c07 n GLY 33 Ca 0.28 -0.07 -0.11 0.00 0.00 0.00 0.00 46.02 46.11 1c07 n GLY 33 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1c07 s PHE 34 N -1.60 -0.74 -0.05 1.61 0.08 -1.26 -4.02 117.98 112.00 1c07 s PHE 34 Ca 0.00 0.65 -0.20 0.00 0.12 0.00 0.00 56.93 57.50 1c07 s PHE 34 Cb 0.00 -0.07 -0.05 0.00 -0.57 0.00 0.00 43.02 42.33 1c07 s PHE 34 CO 0.00 -0.73 0.58 0.54 -0.10 0.00 0.00 175.22 175.51 1c07 s VAL 35 N 2.50 5.02 0.40 -0.44 0.11 -0.52 -4.66 120.40 122.82 1c07 s VAL 35 Ca 0.11 1.20 -0.07 0.00 -2.93 0.00 0.00 61.98 60.30 1c07 s VAL 35 Cb -0.15 -3.92 -0.05 0.00 -1.53 0.00 0.00 36.38 30.73 1c07 s VAL 35 CO -0.17 0.36 0.71 -0.94 -3.33 0.00 0.00 175.10 171.73 1c07 s SER 36 N 0.24 6.41 0.65 3.54 1.04 -1.26 0.30 113.70 124.62 1c07 s SER 36 Ca 0.31 0.93 0.23 0.00 0.48 0.00 0.00 55.95 57.90 1c07 s SER 36 Cb -0.17 -2.24 1.23 0.00 0.10 0.00 0.00 66.02 64.94 1c07 s SER 36 CO 0.15 -0.40 1.69 1.23 0.98 0.00 0.00 173.24 176.89 1c07 h GLY 37 N 0.99 0.00 1.54 7.32 0.00 -1.93 0.29 103.07 111.28 1c07 h GLY 37 Ca -0.47 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 46.74 1c07 h GLY 37 CO 0.63 0.00 -0.33 1.41 0.00 0.00 0.00 176.54 178.25 1c07 h LEU 38 N 0.00 0.54 0.00 3.11 -0.00 -1.96 -0.46 115.31 116.54 1c07 h LEU 38 Ca 0.06 -0.21 0.00 0.00 -0.00 0.00 0.00 57.88 57.73 1c07 h LEU 38 Cb 1.16 -0.15 0.00 0.00 -0.00 0.00 0.00 40.66 41.67 1c07 h LEU 38 CO -0.00 0.83 -0.41 -0.33 -0.00 0.00 0.00 178.44 178.54 1c07 h GLU 39 N 0.44 0.00 0.00 1.13 5.08 -0.73 -3.33 114.58 117.17 1c07 h GLU 39 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1c07 h GLU 39 Cb 0.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.04 1c07 h GLU 39 CO 0.06 0.00 0.31 -0.24 -1.00 0.00 0.00 179.01 178.15 1c07 h VAL 40 N -0.99 0.00 0.00 3.13 3.04 -1.61 -3.14 116.25 116.68 1c07 h VAL 40 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1c07 h VAL 40 Cb 0.41 0.55 0.00 0.00 -2.01 0.00 0.00 31.29 30.24 1c07 h VAL 40 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.57 175.42 1c07 n ARG 41 N -2.63 0.00 -0.31 4.17 0.63 -0.18 0.14 116.66 118.48 1c07 n ARG 41 Ca -0.02 0.44 0.16 0.00 -0.92 0.00 0.00 57.85 57.51 1c07 n ARG 41 Cb 0.35 -1.09 0.34 0.00 0.45 0.00 0.00 32.46 32.51 1c07 n ARG 41 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1c07 h GLU 42 N 0.00 0.23 -0.83 -0.14 5.08 -1.77 1.58 114.58 118.73 1c07 h GLU 42 Ca 0.00 -0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.46 1c07 h GLU 42 Cb 0.00 -0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.12 1c07 h GLU 42 CO 0.00 0.15 0.46 0.82 -1.00 0.00 0.00 179.01 179.44 1c07 h ILE 43 N 0.24 0.84 0.00 3.13 2.04 -1.32 -0.50 117.51 121.94 1c07 h ILE 43 Ca 0.60 -0.25 -0.21 0.00 1.00 0.00 0.00 64.86 66.00 1c07 h ILE 43 Cb 1.26 0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 1c07 h ILE 43 CO -0.64 0.13 -1.14 -0.26 0.00 0.00 0.00 178.15 176.24 1c07 h PHE 44 N 0.73 0.00 0.00 1.37 -1.00 1.05 -3.20 116.94 115.89 1c07 h PHE 44 Ca 0.42 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 61.19 1c07 h PHE 44 Cb 0.47 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.03 1c07 h PHE 44 CO -0.07 0.86 -0.04 -0.07 -1.61 0.00 0.00 178.31 177.37 1c07 h LEU 45 N 0.00 0.00 0.00 1.54 3.38 0.29 0.11 115.31 120.63 1c07 h LEU 45 Ca -0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1c07 h LEU 45 Cb 1.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.49 1c07 h LEU 45 CO 0.10 0.04 0.00 0.29 0.09 0.00 0.00 178.44 178.96 1c07 n LYS 46 N -3.37 0.09 -0.08 1.13 5.02 -0.33 -3.35 118.16 117.27 1c07 n LYS 46 Ca -0.02 0.09 -0.12 0.00 -2.02 0.00 0.00 58.31 56.24 1c07 n LYS 46 Cb 0.18 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.64 1c07 n LYS 46 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1c07 h THR 47 N 0.00 1.30 0.00 -0.18 1.35 -0.93 -3.47 112.91 110.98 1c07 h THR 47 Ca 0.00 -1.20 0.00 0.00 -0.55 0.00 0.00 66.41 64.66 1c07 h THR 47 Cb 0.35 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.37 1c07 h THR 47 CO 0.00 0.37 0.00 0.61 -0.25 0.00 0.00 175.52 176.25 1c07 n GLY 48 N -0.01 1.42 3.99 5.82 0.00 -1.21 -4.92 105.19 110.28 1c07 n GLY 48 Ca -0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.78 1c07 n GLY 48 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1c07 s LEU 49 N 0.00 3.69 0.92 0.99 2.01 -1.26 -5.07 118.68 119.96 1c07 s LEU 49 Ca 0.00 -0.16 -0.12 0.00 0.01 0.00 0.00 54.13 53.86 1c07 s LEU 49 Cb 0.00 -2.80 0.14 0.00 0.01 0.00 0.00 46.19 43.54 1c07 s LEU 49 CO 0.00 -0.72 1.12 -2.16 1.01 0.00 0.00 176.35 175.61 1c07 s PRO 50 N -4.40 1.08 0.00 1.29 0.04 -1.26 -4.90 135.00 126.86 1c07 s PRO 50 Ca 0.51 0.38 -0.25 0.00 0.04 0.00 0.00 61.00 61.68 1c07 s PRO 50 Cb -0.10 -1.82 -0.16 0.00 0.04 0.00 0.00 34.50 32.46 1c07 s PRO 50 CO 0.34 -2.26 1.17 0.66 0.04 0.00 0.00 177.00 176.96 1c07 h SER 51 N -1.54 -0.42 -0.03 6.66 4.64 -1.99 -2.75 113.55 118.12 1c07 h SER 51 Ca -0.51 -0.14 0.01 0.00 -0.47 0.00 0.00 61.79 60.68 1c07 h SER 51 Cb 1.33 0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 63.50 1c07 h SER 51 CO 0.61 -0.04 -0.24 0.74 -0.87 0.00 0.00 176.83 177.02 1c07 h THR 52 N -0.86 0.00 -0.86 2.95 2.02 -1.97 0.42 112.91 114.60 1c07 h THR 52 Ca -0.05 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.26 1c07 h THR 52 Cb 0.54 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 66.81 1c07 h THR 52 CO 0.08 0.00 -0.39 0.25 0.37 0.00 0.00 175.52 175.83 1c07 h LEU 53 N -0.28 -1.42 -0.61 2.58 5.85 -1.96 1.46 115.31 120.92 1c07 h LEU 53 Ca 0.01 0.29 0.02 0.00 0.84 0.00 0.00 57.88 59.04 1c07 h LEU 53 Cb 0.32 0.72 -0.04 0.00 0.37 0.00 0.00 40.66 42.03 1c07 h LEU 53 CO -0.18 -0.29 0.38 -0.07 -0.34 0.00 0.00 178.44 177.94 1c07 h LEU 54 N -0.06 0.64 -0.64 2.25 3.38 -1.09 0.76 115.31 120.55 1c07 h LEU 54 Ca 0.29 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.22 1c07 h LEU 54 Cb 0.57 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1c07 h LEU 54 CO -0.88 0.45 0.24 0.00 0.09 0.00 0.00 178.44 178.34 1c07 h ALA 55 N 1.25 0.83 -0.02 1.53 0.00 0.40 0.51 119.26 123.76 1c07 h ALA 55 Ca 0.24 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1c07 h ALA 55 Cb -0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1c07 h ALA 55 CO -0.08 0.47 -0.24 1.25 0.00 0.00 0.00 179.25 180.65 1c07 h HIS 56 N 0.90 0.04 0.00 0.00 -0.00 0.28 -0.38 115.15 116.00 1c07 h HIS 56 Ca 0.21 -0.00 -0.07 0.00 -0.00 0.00 0.00 60.37 60.51 1c07 h HIS 56 Cb 0.24 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 27.63 1c07 h HIS 56 CO 0.02 0.27 -0.32 0.82 -0.00 0.00 0.00 177.93 178.71 1c07 h ILE 57 N 0.03 0.72 -0.09 6.26 2.04 0.20 -2.07 117.51 124.60 1c07 h ILE 57 Ca 0.00 -1.44 -0.02 0.00 1.00 0.00 0.00 64.86 64.40 1c07 h ILE 57 Cb 0.44 1.93 -0.00 0.00 -0.74 0.00 0.00 36.82 38.45 1c07 h ILE 57 CO 0.03 0.32 -0.01 -0.25 0.00 0.00 0.00 178.15 178.24 1c07 h TRP 58 N 0.00 0.18 -0.24 1.37 2.91 0.82 -1.21 115.95 119.78 1c07 h TRP 58 Ca -0.00 -0.03 -0.08 0.00 1.13 0.00 0.00 58.89 59.90 1c07 h TRP 58 Cb 0.91 -0.05 -0.01 0.00 -0.51 0.00 0.00 29.16 29.50 1c07 h TRP 58 CO 0.00 0.44 -0.20 0.77 -1.03 0.00 0.00 178.44 178.42 1c07 h SER 59 N -0.13 0.42 0.32 2.65 0.02 -1.45 1.17 113.55 116.54 1c07 h SER 59 Ca 0.02 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1c07 h SER 59 Cb 0.37 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.80 1c07 h SER 59 CO 0.01 0.63 0.00 -0.11 -1.14 0.00 0.00 176.83 176.22 1c07 n LEU 60 N -4.16 0.00 -0.01 5.07 7.94 -0.79 -3.14 117.00 121.91 1c07 n LEU 60 Ca -0.00 0.30 -0.01 0.00 -1.11 0.00 0.00 56.01 55.18 1c07 n LEU 60 Cb 0.36 -0.30 -0.01 0.00 0.53 0.00 0.00 43.42 44.00 1c07 n LEU 60 CO 0.41 -0.14 -0.57 0.00 -1.11 0.00 0.00 177.39 175.98 1c07 n ASP 62 N -2.34 3.04 -0.11 0.00 5.75 0.39 -4.46 116.55 118.81 1c07 n ASP 62 Ca -0.03 -2.06 0.26 0.00 -0.01 0.00 0.00 54.79 52.95 1c07 n ASP 62 Cb 0.55 -0.81 0.72 0.00 -1.03 0.00 0.00 41.12 40.55 1c07 n ASP 62 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 1c07 h THR 63 N 2.52 0.52 0.00 2.12 1.35 -1.84 0.79 112.91 118.36 1c07 h THR 63 Ca 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.99 1c07 h THR 63 Cb 0.79 0.57 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 1c07 h THR 63 CO 0.43 0.00 0.31 0.11 -0.25 0.00 0.00 175.52 176.12 1c07 h LYS 64 N 0.00 0.00 -6.72 4.72 1.79 -1.90 -3.45 116.57 111.02 1c07 h LYS 64 Ca 0.37 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 58.30 1c07 h LYS 64 Cb 1.57 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 32.14 1c07 h LYS 64 CO -0.00 0.00 -0.94 -0.25 -1.08 0.00 0.00 179.45 177.17 1c07 n ASP 65 N -2.80 -1.27 0.00 0.86 8.00 0.28 -4.83 116.55 116.79 1c07 n ASP 65 Ca -0.02 -1.14 0.00 0.00 0.71 0.00 0.00 54.79 54.34 1c07 n ASP 65 Cb 0.36 -2.41 0.00 0.00 -0.02 0.00 0.00 41.12 39.04 1c07 n ASP 65 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1c07 n GLY 67 N 0.93 0.59 0.71 0.00 0.00 -1.26 -5.07 105.19 101.08 1c07 n GLY 67 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 1c07 n GLY 67 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1c07 n LYS 68 N -1.26 0.92 -3.96 1.61 2.85 -1.26 -4.59 118.16 112.47 1c07 n LYS 68 Ca 0.00 -0.73 -0.31 0.00 -1.05 0.00 0.00 58.31 56.22 1c07 n LYS 68 Cb 0.00 0.38 -0.15 0.00 -0.65 0.00 0.00 35.03 34.61 1c07 n LYS 68 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1c07 s LEU 69 N 0.00 3.66 0.00 -5.58 1.43 0.15 -4.74 118.68 113.59 1c07 s LEU 69 Ca 0.04 -1.75 0.00 0.00 -1.03 0.00 0.00 54.13 51.39 1c07 s LEU 69 Cb 0.00 -1.38 0.00 0.00 0.03 0.00 0.00 46.19 44.84 1c07 s LEU 69 CO 0.03 -0.33 0.00 -0.24 0.23 0.00 0.00 176.35 176.04 1c07 n SER 70 N 4.47 -1.34 0.00 2.29 2.88 -1.26 -1.43 113.62 119.23 1c07 n SER 70 Ca -0.03 -0.24 0.00 0.00 -1.33 0.00 0.00 58.87 57.27 1c07 n SER 70 Cb 0.42 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.88 1c07 n SER 70 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1c07 n LYS 71 N -1.59 0.00 -0.08 -1.46 4.76 -1.26 -1.63 118.16 116.90 1c07 n LYS 71 Ca 0.00 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.41 1c07 n LYS 71 Cb 0.00 -0.88 -0.03 0.00 -1.84 0.00 0.00 35.03 32.29 1c07 n LYS 71 CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 1c07 h ASP 72 N 0.00 -0.53 -1.05 4.39 5.19 -1.97 0.30 116.42 122.75 1c07 h ASP 72 Ca 0.00 0.08 0.43 0.00 -0.62 0.00 0.00 57.03 56.91 1c07 h ASP 72 Cb 0.00 0.23 -0.17 0.00 0.18 0.00 0.00 39.33 39.57 1c07 h ASP 72 CO 0.00 -0.07 0.59 0.00 -3.12 0.00 0.00 179.24 176.64 1c07 n GLN 73 N -3.51 -0.06 -0.03 3.56 3.00 -1.26 0.29 117.38 119.37 1c07 n GLN 73 Ca 0.00 1.34 -0.04 0.00 -0.01 0.00 0.00 57.00 58.29 1c07 n GLN 73 Cb 0.07 -2.45 0.18 0.00 0.00 0.00 0.00 30.24 28.04 1c07 n GLN 73 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.06 177.41 1c07 h PHE 74 N 0.00 0.66 0.00 1.08 3.57 0.53 -0.79 116.94 122.00 1c07 h PHE 74 Ca 0.85 -0.13 0.00 0.00 3.53 0.00 0.00 57.97 62.22 1c07 h PHE 74 Cb 2.32 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 40.90 1c07 h PHE 74 CO -0.01 0.74 0.00 0.00 -2.23 0.00 0.00 178.31 176.81 1c07 n ALA 75 N -2.49 2.11 -0.04 2.41 0.00 0.83 -3.27 120.51 120.06 1c07 n ALA 75 Ca 0.00 -0.10 -0.22 0.00 0.00 0.00 0.00 53.44 53.13 1c07 n ALA 75 Cb 0.38 -1.36 -0.13 0.00 0.00 0.00 0.00 19.45 18.34 1c07 n ALA 75 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1c07 n LEU 76 N -1.34 2.30 -0.07 0.00 7.94 -0.33 -3.76 117.00 121.75 1c07 n LEU 76 Ca 0.09 0.30 -0.07 0.00 -1.11 0.00 0.00 56.01 55.22 1c07 n LEU 76 Cb 0.20 -1.05 -0.01 0.00 0.53 0.00 0.00 43.42 43.09 1c07 n LEU 76 CO 0.18 0.61 0.74 0.00 -1.11 0.00 0.00 177.39 177.80 1c07 h ALA 77 N -0.19 0.01 -0.86 1.96 0.00 -1.45 0.41 119.26 119.14 1c07 h ALA 77 Ca -0.40 0.10 0.14 0.00 0.00 0.00 0.00 54.91 54.75 1c07 h ALA 77 Cb 1.72 0.41 -0.07 0.00 0.00 0.00 0.00 17.79 19.85 1c07 h ALA 77 CO -0.05 -0.58 0.56 0.74 0.00 0.00 0.00 179.25 179.91 1c07 h PHE 78 N -0.16 0.78 -0.01 0.00 0.04 -1.74 0.18 116.94 116.02 1c07 h PHE 78 Ca 0.15 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.95 1c07 h PHE 78 Cb 0.38 -0.25 -0.00 0.00 2.20 0.00 0.00 35.95 38.29 1c07 h PHE 78 CO -0.36 0.30 0.31 1.25 -0.60 0.00 0.00 178.31 179.21 1c07 h HIS 79 N 0.67 0.00 0.00 -0.55 2.76 -1.00 0.52 115.15 117.55 1c07 h HIS 79 Ca 0.43 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.60 1c07 h HIS 79 Cb 0.69 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.65 1c07 h HIS 79 CO -0.00 0.00 -1.95 1.28 -1.30 0.00 0.00 177.93 175.96 1c07 n LEU 80 N -2.93 0.04 0.06 0.26 4.77 0.60 -4.26 117.00 115.54 1c07 n LEU 80 Ca -0.02 -0.02 -0.03 0.00 -0.03 0.00 0.00 56.01 55.91 1c07 n LEU 80 Cb 0.36 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.44 1c07 n LEU 80 CO 0.14 0.01 0.20 0.40 -1.33 0.00 0.00 177.39 176.81 1c07 h ILE 81 N 0.00 0.00 -1.88 -0.08 1.08 0.39 -3.15 117.51 113.87 1c07 h ILE 81 Ca 0.00 -0.22 0.55 0.00 -0.39 0.00 0.00 64.86 64.80 1c07 h ILE 81 Cb 0.97 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.64 1c07 h ILE 81 CO 0.00 0.00 1.36 0.77 -0.69 0.00 0.00 178.15 179.59 1c07 h SER 82 N -0.41 0.00 -0.76 1.72 4.64 -1.63 1.27 113.55 118.38 1c07 h SER 82 Ca -0.02 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.28 1c07 h SER 82 Cb 0.14 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.20 1c07 h SER 82 CO 0.03 0.00 0.39 1.56 -0.87 0.00 0.00 176.83 177.94 1c07 h GLN 83 N 0.00 1.09 0.00 4.77 4.20 -1.72 -2.08 115.11 121.36 1c07 h GLN 83 Ca 0.89 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 59.46 1c07 h GLN 83 Cb 3.61 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 31.19 1c07 h GLN 83 CO -0.01 0.83 -0.42 1.17 -0.67 0.00 0.00 178.83 179.73 1c07 n LYS 84 N -4.33 0.26 -0.03 1.46 3.00 0.43 0.27 118.16 119.22 1c07 n LYS 84 Ca 0.08 0.12 -0.01 0.00 -0.00 0.00 0.00 58.31 58.50 1c07 n LYS 84 Cb 0.12 -1.71 -0.00 0.00 0.00 0.00 0.00 35.03 33.44 1c07 n LYS 84 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 1c07 h LEU 85 N 0.00 0.00 0.03 3.14 3.38 -0.93 -3.29 115.31 117.64 1c07 h LEU 85 Ca 0.00 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.61 1c07 h LEU 85 Cb 0.73 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.42 1c07 h LEU 85 CO 0.00 0.36 -2.21 -0.38 0.09 0.00 0.00 178.44 176.30 1c07 n ILE 86 N -3.66 1.56 1.45 1.22 2.08 -0.84 -4.24 119.36 116.93 1c07 n ILE 86 Ca -0.02 -0.70 0.14 0.00 0.56 0.00 0.00 62.75 62.73 1c07 n ILE 86 Cb 0.06 -1.21 0.50 0.00 -0.75 0.00 0.00 39.64 38.24 1c07 n ILE 86 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 1c07 n LYS 87 N -3.16 1.50 -1.80 0.38 4.76 -1.00 -4.90 118.16 113.95 1c07 n LYS 87 Ca -0.34 -0.87 -0.04 0.00 -2.87 0.00 0.00 58.31 54.18 1c07 n LYS 87 Cb 1.06 -1.48 -0.01 0.00 -1.84 0.00 0.00 35.03 32.75 1c07 n LYS 87 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1c07 n GLY 88 N 1.21 -0.05 3.90 0.72 0.00 0.40 -4.79 105.19 106.57 1c07 n GLY 88 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1c07 n GLY 88 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c07 s ILE 89 N -1.78 5.15 0.37 -0.61 1.01 0.77 -4.79 121.20 121.32 1c07 s ILE 89 Ca 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 60.65 60.69 1c07 s ILE 89 Cb 0.00 -3.63 -0.03 0.00 0.01 0.00 0.00 42.46 38.81 1c07 s ILE 89 CO 0.00 0.02 0.59 -1.81 0.00 0.00 0.00 174.94 173.74 1c07 s ASP 90 N -2.46 6.30 0.64 3.58 1.11 -1.26 -2.02 116.67 122.55 1c07 s ASP 90 Ca 0.41 0.56 -0.15 0.00 0.18 0.00 0.00 52.55 53.55 1c07 s ASP 90 Cb -0.12 -2.08 -0.01 0.00 1.07 0.00 0.00 42.92 41.78 1c07 s ASP 90 CO 0.25 -0.34 1.09 -2.16 1.18 0.00 0.00 175.17 175.19 1c07 s PRO 91 N -4.34 2.98 0.36 8.23 0.04 -1.26 -4.97 135.00 136.03 1c07 s PRO 91 Ca 0.42 1.33 -0.27 0.00 0.04 0.00 0.00 61.00 62.51 1c07 s PRO 91 Cb -0.10 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.37 1c07 s PRO 91 CO 0.37 -1.10 1.19 -1.25 0.04 0.00 0.00 177.00 176.25 1c07 s PRO 92 N -4.09 4.26 0.18 0.56 0.04 -1.26 -4.93 135.00 129.77 1c07 s PRO 92 Ca 0.66 1.93 -0.27 0.00 0.04 0.00 0.00 61.00 63.36 1c07 s PRO 92 Cb -0.19 -2.89 0.03 0.00 0.04 0.00 0.00 34.50 31.49 1c07 s PRO 92 CO 0.40 -0.17 1.55 0.45 0.04 0.00 0.00 177.00 179.27 1c07 h HIS 93 N 3.09 -1.59 -2.76 0.56 3.86 -2.00 -3.43 115.15 112.87 1c07 h HIS 93 Ca -0.48 0.12 0.00 0.00 -1.16 0.00 0.00 60.37 58.84 1c07 h HIS 93 Cb 1.23 0.82 0.00 0.00 1.06 0.00 0.00 27.41 30.52 1c07 h HIS 93 CO 0.56 -0.39 0.00 1.33 0.86 0.00 0.00 177.93 180.29 1c07 n VAL 94 N -5.34 0.00 -3.54 2.45 0.24 -1.26 -4.94 118.33 105.94 1c07 n VAL 94 Ca 0.04 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 61.97 1c07 n VAL 94 Cb 0.31 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.62 1c07 n VAL 94 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1c07 s LEU 95 N 0.00 4.31 0.62 1.34 1.43 -1.26 -4.98 118.68 120.13 1c07 s LEU 95 Ca 0.00 0.63 -0.05 0.00 -1.03 0.00 0.00 54.13 53.68 1c07 s LEU 95 Cb 0.00 -2.42 0.03 0.00 0.03 0.00 0.00 46.19 43.83 1c07 s LEU 95 CO 0.00 0.16 0.91 0.42 0.23 0.00 0.00 176.35 178.08 1c07 s THR 96 N 0.04 2.97 -0.11 5.49 -4.23 -1.26 -4.90 115.64 113.63 1c07 s THR 96 Ca 0.19 -0.24 0.29 0.00 -1.18 0.00 0.00 61.69 60.75 1c07 s THR 96 Cb -0.14 -3.20 0.31 0.00 1.34 0.00 0.00 72.50 70.81 1c07 s THR 96 CO 0.06 -0.20 1.87 1.55 -0.54 0.00 0.00 174.62 177.37 1c07 h PRO 97 N -0.27 0.00 0.00 3.99 0.13 -1.98 -0.55 132.00 133.32 1c07 h PRO 97 Ca -0.45 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.50 1c07 h PRO 97 Cb 1.29 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.39 1c07 h PRO 97 CO 0.59 0.00 -1.19 0.93 -0.23 0.00 0.00 178.00 178.10 1c07 h GLU 98 N 0.00 0.00 0.00 0.86 5.08 -1.92 -3.23 114.58 115.37 1c07 h GLU 98 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1c07 h GLU 98 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1c07 h GLU 98 CO 0.00 0.52 -0.24 -0.12 -1.00 0.00 0.00 179.01 178.16 1c07 n MET 99 N -3.09 0.15 -3.36 2.33 1.56 -0.33 0.12 117.12 114.50 1c07 n MET 99 Ca -0.07 0.08 -0.41 0.00 -0.27 0.00 0.00 57.70 57.04 1c07 n MET 99 Cb 0.88 -1.63 -0.09 0.00 2.15 0.00 0.00 33.22 34.53 1c07 n MET 99 CO 0.00 0.00 0.00 0.42 -0.73 0.00 0.00 175.97 175.66 1c07 s ILE 100 N -3.07 5.13 0.63 1.12 1.01 -0.51 -4.88 121.20 120.63 1c07 s ILE 100 Ca 0.11 0.13 -0.15 0.00 0.00 0.00 0.00 60.65 60.73 1c07 s ILE 100 Cb 0.15 -3.86 -0.02 0.00 0.01 0.00 0.00 42.46 38.75 1c07 s ILE 100 CO 0.63 -0.13 1.09 -2.16 0.00 0.00 0.00 174.94 174.37 1c07 s PRO 101 N 2.12 3.02 0.71 2.79 0.04 -1.26 -4.92 135.00 137.50 1c07 s PRO 101 Ca 0.14 1.33 -0.12 0.00 0.04 0.00 0.00 61.00 62.38 1c07 s PRO 101 Cb -0.16 -1.98 0.02 0.00 0.04 0.00 0.00 34.50 32.42 1c07 s PRO 101 CO 0.12 -1.07 1.08 -1.25 0.04 0.00 0.00 177.00 175.92 1c07 s PRO 102 N -4.06 2.68 0.00 0.56 0.04 -1.26 -5.13 135.00 127.83 1c07 s PRO 102 Ca 0.66 1.13 0.08 0.00 0.04 0.00 0.00 61.00 62.91 1c07 s PRO 102 Cb -0.19 -1.95 0.06 0.00 0.04 0.00 0.00 34.50 32.46 1c07 s PRO 102 CO 0.39 -1.32 0.75 0.43 0.04 0.00 0.00 177.00 177.29