#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c07 s TRP 10 N 0.00 3.37 0.00 -1.42 1.48 -1.26 -4.64 118.94 116.48 1c07 s TRP 10 Ca 0.00 1.61 0.00 0.00 -1.06 0.00 0.00 56.10 56.65 1c07 s TRP 10 Cb 0.00 -2.84 0.00 0.00 -1.16 0.00 0.00 33.47 29.47 1c07 s TRP 10 CO 0.00 -0.05 0.00 1.33 -4.06 0.00 0.00 176.95 174.17 1c07 n VAL 11 N -0.44 0.00 -3.77 -0.66 0.24 0.76 -4.35 118.33 110.10 1c07 n VAL 11 Ca 0.06 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.07 1c07 n VAL 11 Cb 0.53 -0.97 0.01 0.00 -1.47 0.00 0.00 33.84 31.94 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 -2.27 -2.49 -0.08 3.34 3.14 -1.26 -4.89 118.33 113.82 1c07 n VAL 12 Ca 0.00 -0.20 -0.13 0.00 -2.96 0.00 0.00 64.34 61.05 1c07 n VAL 12 Cb 0.00 -2.18 -0.08 0.00 -1.06 0.00 0.00 33.84 30.52 1c07 n VAL 12 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1c07 n SER 13 N -1.94 2.47 -2.42 6.55 2.88 -1.26 -4.18 113.62 115.72 1c07 n SER 13 Ca -0.20 -0.04 0.00 0.00 -1.33 0.00 0.00 58.87 57.30 1c07 n SER 13 Cb 0.54 -0.31 0.00 0.00 -0.75 0.00 0.00 64.21 63.69 1c07 n SER 13 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1c07 n PRO 14 N -3.12 3.09 -0.16 -1.46 -0.04 -1.26 -4.30 135.00 127.74 1c07 n PRO 14 Ca -0.31 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.12 1c07 n PRO 14 Cb 0.81 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 34.23 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 -0.22 -0.35 0.55 0.00 -1.26 0.20 120.51 116.43 1c07 n ALA 15 Ca 0.00 0.34 -0.02 0.00 0.00 0.00 0.00 53.44 53.76 1c07 n ALA 15 Cb 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 19.45 19.40 1c07 n ALA 15 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1c07 n GLU 16 N -4.50 -0.23 -0.28 0.00 1.02 -1.26 0.16 120.64 115.55 1c07 n GLU 16 Ca 0.01 1.37 0.04 0.00 -0.02 0.00 0.00 57.16 58.56 1c07 n GLU 16 Cb 0.11 -2.02 0.18 0.00 -0.02 0.00 0.00 31.44 29.69 1c07 n GLU 16 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 1c07 h LYS 17 N 0.00 0.64 -0.26 3.49 3.11 -0.42 -1.10 116.57 122.03 1c07 h LYS 17 Ca 0.29 -0.04 -0.02 0.00 -2.81 0.00 0.00 60.65 58.07 1c07 h LYS 17 Cb 0.51 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.59 1c07 h LYS 17 CO -0.88 0.42 0.09 0.00 -2.81 0.00 0.00 179.45 176.28 1c07 h ALA 18 N 1.50 0.34 -0.33 5.00 0.00 0.16 0.45 119.26 126.37 1c07 h ALA 18 Ca 0.41 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.28 1c07 h ALA 18 Cb 0.50 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1c07 h ALA 18 CO -0.31 -0.04 0.25 -0.22 0.00 0.00 0.00 179.25 178.94 1c07 h LYS 19 N 0.27 0.00 0.00 0.00 3.64 0.43 -2.16 116.57 118.75 1c07 h LYS 19 Ca 0.09 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.30 1c07 h LYS 19 Cb 0.22 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 1c07 h LYS 19 CO -0.00 0.00 -1.03 1.88 -2.27 0.00 0.00 179.45 178.02 1c07 h TYR 20 N 0.00 0.00 -1.48 1.91 0.05 -0.65 -3.16 116.97 113.64 1c07 h TYR 20 Ca 0.16 0.00 0.43 0.00 0.05 0.00 0.00 58.73 59.37 1c07 h TYR 20 Cb 0.67 0.00 -0.07 0.00 1.01 0.00 0.00 36.73 38.33 1c07 h TYR 20 CO 0.00 1.12 1.05 0.22 -1.05 0.00 0.00 178.16 179.50 1c07 h ASP 21 N -1.00 0.06 0.64 3.88 1.82 0.09 2.17 116.42 124.08 1c07 h ASP 21 Ca -0.26 0.02 -0.27 0.00 -0.39 0.00 0.00 57.03 56.14 1c07 h ASP 21 Cb 1.10 0.02 0.00 0.00 0.68 0.00 0.00 39.33 41.13 1c07 h ASP 21 CO -0.15 -0.02 -1.24 -0.33 -1.61 0.00 0.00 179.24 175.89 1c07 h GLU 22 N 0.04 0.26 0.14 0.28 5.08 -1.53 -3.31 114.58 115.54 1c07 h GLU 22 Ca 0.74 -0.44 -0.29 0.00 -1.00 0.00 0.00 59.36 58.36 1c07 h GLU 22 Cb 2.80 0.17 0.02 0.00 0.50 0.00 0.00 28.75 32.23 1c07 h GLU 22 CO -0.08 1.21 -1.25 0.82 -1.00 0.00 0.00 179.01 178.70 1c07 h ILE 23 N 0.07 1.39 -1.11 3.13 2.04 0.30 -3.15 117.51 120.18 1c07 h ILE 23 Ca -0.13 -2.76 0.32 0.00 1.00 0.00 0.00 64.86 63.28 1c07 h ILE 23 Cb 1.97 2.84 -0.05 0.00 -0.74 0.00 0.00 36.82 40.83 1c07 h ILE 23 CO 0.20 0.82 0.79 0.15 0.00 0.00 0.00 178.15 180.11 1c07 h PHE 24 N 0.16 0.06 0.00 1.37 3.57 0.14 2.75 116.94 124.98 1c07 h PHE 24 Ca -0.17 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.29 1c07 h PHE 24 Cb 1.95 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 40.66 1c07 h PHE 24 CO 0.09 0.01 -0.22 -0.07 -2.23 0.00 0.00 178.31 175.88 1c07 h LEU 25 N 0.04 0.00 0.00 0.59 3.38 -1.65 0.36 115.31 118.03 1c07 h LEU 25 Ca 0.54 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.51 1c07 h LEU 25 Cb 2.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.82 1c07 h LEU 25 CO -0.03 0.22 -1.29 0.29 0.09 0.00 0.00 178.44 177.72 1c07 n LYS 26 N -3.66 0.24 -0.08 1.13 5.02 0.86 -4.46 118.16 117.22 1c07 n LYS 26 Ca -0.01 -0.06 -0.12 0.00 -2.02 0.00 0.00 58.31 56.10 1c07 n LYS 26 Cb 0.35 -1.52 -0.06 0.00 -0.02 0.00 0.00 35.03 33.77 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 0.44 0.00 -0.18 2.02 0.97 -3.40 112.91 112.76 1c07 h THR 27 Ca 0.00 -1.54 -0.62 0.00 0.77 0.00 0.00 66.41 65.02 1c07 h THR 27 Cb 0.69 1.04 0.03 0.00 -1.74 0.00 0.00 68.15 68.16 1c07 h THR 27 CO 0.00 0.15 2.53 -0.67 0.37 0.00 0.00 175.52 177.90 1c07 n ASP 28 N -4.55 3.26 0.13 4.18 -0.08 0.12 -4.25 116.55 115.36 1c07 n ASP 28 Ca -0.18 -2.65 0.07 0.00 -1.51 0.00 0.00 54.79 50.52 1c07 n ASP 28 Cb 0.44 -1.21 0.37 0.00 2.34 0.00 0.00 41.12 43.06 1c07 n ASP 28 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1c07 n LYS 29 N 6.35 0.09 -0.48 -0.67 5.02 -1.26 -0.93 118.16 126.28 1c07 n LYS 29 Ca 0.50 0.56 0.08 0.00 -2.02 0.00 0.00 58.31 57.43 1c07 n LYS 29 Cb 0.36 -1.94 0.30 0.00 -0.02 0.00 0.00 35.03 33.73 1c07 n LYS 29 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1c07 n ASP 30 N -2.00 3.95 -1.99 4.39 9.92 -1.26 -4.90 116.55 124.67 1c07 n ASP 30 Ca -0.01 -2.30 -0.03 0.00 -0.53 0.00 0.00 54.79 51.92 1c07 n ASP 30 Cb 0.16 -0.51 -0.01 0.00 -0.64 0.00 0.00 41.12 40.13 1c07 n ASP 30 CO 0.00 0.00 0.00 0.23 0.13 0.00 0.00 177.20 177.56 1c07 n MET 31 N 1.01 -2.18 -0.91 -1.24 2.81 -0.10 -4.71 117.12 111.79 1c07 n MET 31 Ca 0.22 0.17 -0.00 0.00 -1.81 0.00 0.00 57.70 56.28 1c07 n MET 31 Cb 0.72 -4.53 0.33 0.00 -0.71 0.00 0.00 33.22 29.03 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 -0.80 5.03 -1.48 7.83 5.68 -1.26 -4.87 116.55 126.68 1c07 n ASP 32 Ca -0.04 -3.02 -0.17 0.00 -0.50 0.00 0.00 54.79 51.06 1c07 n ASP 32 Cb 0.38 -0.71 -0.07 0.00 -1.14 0.00 0.00 41.12 39.58 1c07 n ASP 32 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1c07 n GLY 33 N 0.20 1.62 2.88 6.12 0.00 -1.26 -4.89 105.19 109.86 1c07 n GLY 33 Ca 0.33 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.24 1c07 n GLY 33 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1c07 s PHE 34 N -2.44 -0.78 -0.09 1.61 2.19 -1.26 -3.68 117.98 113.53 1c07 s PHE 34 Ca 0.00 0.48 -0.21 0.00 0.33 0.00 0.00 56.93 57.53 1c07 s PHE 34 Cb 0.00 -0.14 -0.04 0.00 -1.31 0.00 0.00 43.02 41.53 1c07 s PHE 34 CO 0.00 -0.82 0.60 0.54 1.83 0.00 0.00 175.22 177.37 1c07 s VAL 35 N 2.50 5.11 0.35 3.12 0.11 0.75 -4.69 120.40 127.65 1c07 s VAL 35 Ca 0.11 1.22 -0.11 0.00 -2.93 0.00 0.00 61.98 60.26 1c07 s VAL 35 Cb -0.14 -3.94 -0.07 0.00 -1.53 0.00 0.00 36.38 30.70 1c07 s VAL 35 CO -0.23 0.29 0.71 -0.94 -3.33 0.00 0.00 175.10 171.60 1c07 s SER 36 N 0.72 6.61 0.63 3.54 1.04 -1.26 0.14 113.70 125.11 1c07 s SER 36 Ca 0.32 1.12 0.20 0.00 0.48 0.00 0.00 55.95 58.07 1c07 s SER 36 Cb -0.17 -2.31 0.95 0.00 0.10 0.00 0.00 66.02 64.59 1c07 s SER 36 CO 0.15 -0.28 1.49 1.23 0.98 0.00 0.00 173.24 176.80 1c07 h GLY 37 N 1.77 0.00 1.32 7.32 0.00 -1.93 0.43 103.07 111.99 1c07 h GLY 37 Ca -0.47 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.78 1c07 h GLY 37 CO 0.65 0.00 -0.00 1.41 0.00 0.00 0.00 176.54 178.60 1c07 h LEU 38 N 0.00 0.79 0.00 3.11 -0.00 -1.95 -0.19 115.31 117.08 1c07 h LEU 38 Ca 0.18 -0.20 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1c07 h LEU 38 Cb 1.77 -0.21 0.00 0.00 -0.00 0.00 0.00 40.66 42.22 1c07 h LEU 38 CO -0.00 0.86 -0.25 -0.33 -0.00 0.00 0.00 178.44 178.72 1c07 h GLU 39 N 0.76 0.00 -0.06 1.13 5.08 -0.41 -3.33 114.58 117.76 1c07 h GLU 39 Ca 0.15 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1c07 h GLU 39 Cb 0.47 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 1c07 h GLU 39 CO 0.02 0.00 0.47 -0.24 -1.00 0.00 0.00 179.01 178.26 1c07 h VAL 40 N -0.77 0.04 0.00 3.13 3.04 -1.64 -3.11 116.25 116.93 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 0.25 0.54 0.00 0.00 -2.01 0.00 0.00 31.29 30.07 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 -2.91 0.00 -0.36 4.17 0.63 -0.08 0.21 116.66 118.32 1c07 n ARG 41 Ca -0.00 0.43 0.28 0.00 -0.92 0.00 0.00 57.85 57.64 1c07 n ARG 41 Cb 0.53 -1.05 0.54 0.00 0.45 0.00 0.00 32.46 32.93 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 0.22 -0.77 -0.14 5.08 -1.77 0.79 114.58 118.01 1c07 h GLU 42 Ca 0.00 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1c07 h GLU 42 Cb 0.00 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.15 1c07 h GLU 42 CO 0.00 0.15 0.49 0.82 -1.00 0.00 0.00 179.01 179.47 1c07 h ILE 43 N 0.23 1.11 0.00 3.13 2.04 -1.13 -2.23 117.51 120.66 1c07 h ILE 43 Ca 0.75 -0.33 -0.21 0.00 1.00 0.00 0.00 64.86 66.08 1c07 h ILE 43 Cb 1.97 0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 38.10 1c07 h ILE 43 CO -0.53 0.17 -1.03 -0.26 0.00 0.00 0.00 178.15 176.50 1c07 h PHE 44 N 0.95 0.00 0.00 1.37 0.04 0.49 -3.13 116.94 116.66 1c07 h PHE 44 Ca 0.31 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.08 1c07 h PHE 44 Cb 0.02 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.17 1c07 h PHE 44 CO -0.03 0.97 0.00 -0.07 -0.60 0.00 0.00 178.31 178.57 1c07 h LEU 45 N 0.00 0.00 0.00 1.54 3.38 -0.39 -0.52 115.31 119.32 1c07 h LEU 45 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1c07 h LEU 45 Cb 1.77 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.52 1c07 h LEU 45 CO 0.12 0.00 -0.19 0.29 0.09 0.00 0.00 178.44 178.75 1c07 n LYS 46 N -2.35 0.20 0.03 1.13 5.02 -0.89 -3.54 118.16 117.76 1c07 n LYS 46 Ca 0.00 0.13 0.04 0.00 -2.02 0.00 0.00 58.31 56.46 1c07 n LYS 46 Cb 0.16 -1.69 0.18 0.00 -0.02 0.00 0.00 35.03 33.65 1c07 n LYS 46 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1c07 n THR 47 N -2.02 1.57 -1.90 -0.18 -2.24 -0.20 -4.78 114.28 104.52 1c07 n THR 47 Ca 0.05 0.45 -0.08 0.00 -2.27 0.00 0.00 64.05 62.21 1c07 n THR 47 Cb 0.41 -1.39 -0.01 0.00 -2.10 0.00 0.00 70.33 67.24 1c07 n THR 47 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1c07 n GLY 48 N -1.02 0.30 4.01 3.38 0.00 -1.23 -4.96 105.19 105.67 1c07 n GLY 48 Ca 0.01 -0.60 -0.18 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.08 3.44 0.00 0.99 1.02 -1.26 -5.12 118.68 115.66 1c07 s LEU 49 Ca 0.00 -0.60 0.00 0.00 0.02 0.00 0.00 54.13 53.55 1c07 s LEU 49 Cb 0.00 -2.25 0.00 0.00 0.02 0.00 0.00 46.19 43.96 1c07 s LEU 49 CO 0.00 -0.96 0.00 -0.81 0.02 0.00 0.00 176.35 174.60 1c07 n PRO 50 N -1.97 1.96 -0.03 1.29 -0.04 -1.26 -5.02 135.00 129.93 1c07 n PRO 50 Ca 0.10 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.53 1c07 n PRO 50 Cb 0.60 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 34.05 1c07 n PRO 50 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1c07 n SER 51 N 0.00 0.86 -0.30 3.54 2.88 -1.26 -4.58 113.62 114.76 1c07 n SER 51 Ca 0.00 0.14 0.11 0.00 -1.33 0.00 0.00 58.87 57.79 1c07 n SER 51 Cb 0.00 -0.51 0.34 0.00 -0.75 0.00 0.00 64.21 63.28 1c07 n SER 51 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1c07 h THR 52 N -0.38 0.85 -0.49 2.46 1.03 -1.98 -2.61 112.91 111.79 1c07 h THR 52 Ca 0.00 -0.27 0.10 0.00 -0.01 0.00 0.00 66.41 66.23 1c07 h THR 52 Cb 0.38 0.00 -0.10 0.00 -1.07 0.00 0.00 68.15 67.36 1c07 h THR 52 CO 0.00 0.14 -0.28 0.25 -0.01 0.00 0.00 175.52 175.62 1c07 h LEU 53 N 0.78 -0.96 -0.31 0.00 5.85 -1.97 2.07 115.31 120.77 1c07 h LEU 53 Ca 0.47 0.20 -0.01 0.00 0.84 0.00 0.00 57.88 59.37 1c07 h LEU 53 Cb 0.66 0.49 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 1c07 h LEU 53 CO -0.23 -0.29 0.14 -0.07 -0.34 0.00 0.00 178.44 177.66 1c07 h LEU 54 N -0.17 0.41 -1.17 2.25 -0.00 -1.71 0.96 115.31 115.88 1c07 h LEU 54 Ca 0.22 -0.13 -0.04 0.00 -0.00 0.00 0.00 57.88 57.92 1c07 h LEU 54 Cb 0.52 -0.10 -0.02 0.00 -0.00 0.00 0.00 40.66 41.05 1c07 h LEU 54 CO -0.59 0.43 0.13 0.00 -0.00 0.00 0.00 178.44 178.41 1c07 h ALA 55 N 1.00 1.33 0.00 1.53 0.00 -1.12 0.19 119.26 122.19 1c07 h ALA 55 Ca 0.11 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 1c07 h ALA 55 Cb 0.13 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1c07 h ALA 55 CO -0.01 0.48 -0.58 1.25 0.00 0.00 0.00 179.25 180.39 1c07 h HIS 56 N 0.70 0.00 0.00 0.00 -0.00 0.41 -2.35 115.15 113.91 1c07 h HIS 56 Ca 0.16 0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.49 1c07 h HIS 56 Cb 0.23 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.64 1c07 h HIS 56 CO 0.01 0.58 -0.20 0.82 -0.00 0.00 0.00 177.93 179.14 1c07 h ILE 57 N 0.00 0.39 -0.33 6.26 2.04 0.24 -2.40 117.51 123.72 1c07 h ILE 57 Ca -0.01 -1.33 -0.04 0.00 1.00 0.00 0.00 64.86 64.48 1c07 h ILE 57 Cb 1.07 2.01 -0.01 0.00 -0.74 0.00 0.00 36.82 39.14 1c07 h ILE 57 CO 0.08 0.20 0.05 -0.25 0.00 0.00 0.00 178.15 178.22 1c07 h TRP 58 N 0.00 0.59 -0.03 1.37 2.91 -0.13 0.13 115.95 120.79 1c07 h TRP 58 Ca -0.00 -0.09 -0.15 0.00 1.13 0.00 0.00 58.89 59.78 1c07 h TRP 58 Cb 0.99 -0.16 -0.02 0.00 -0.51 0.00 0.00 29.16 29.46 1c07 h TRP 58 CO 0.00 0.63 -0.67 1.03 -1.03 0.00 0.00 178.44 178.40 1c07 h SER 59 N 0.38 0.16 1.02 2.65 0.87 -1.50 1.43 113.55 118.56 1c07 h SER 59 Ca 0.10 -0.10 -0.03 0.00 -1.23 0.00 0.00 61.79 60.53 1c07 h SER 59 Cb 0.36 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.27 1c07 h SER 59 CO 0.01 0.78 -0.12 0.25 -0.53 0.00 0.00 176.83 177.22 1c07 h LEU 60 N 0.09 0.00 0.00 2.23 5.85 -1.09 -3.19 115.31 119.20 1c07 h LEU 60 Ca -0.01 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.43 1c07 h LEU 60 Cb 1.20 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.18 1c07 h LEU 60 CO 0.10 0.12 -2.04 0.00 -0.34 0.00 0.00 178.44 176.28 1c07 n ASP 62 N -2.60 4.98 -0.15 0.00 2.03 0.49 -4.53 116.55 116.76 1c07 n ASP 62 Ca -0.25 -2.31 0.14 0.00 0.52 0.00 0.00 54.79 52.89 1c07 n ASP 62 Cb 0.98 -1.15 0.49 0.00 -0.72 0.00 0.00 41.12 40.73 1c07 n ASP 62 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1c07 h THR 63 N 2.70 0.83 0.00 5.18 1.35 -1.82 0.40 112.91 121.54 1c07 h THR 63 Ca 0.36 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 66.07 1c07 h THR 63 Cb 0.72 0.35 0.00 0.00 -1.73 0.00 0.00 68.15 67.49 1c07 h THR 63 CO 0.85 0.08 0.15 0.11 -0.25 0.00 0.00 175.52 176.46 1c07 h LYS 64 N 0.44 0.00 -6.89 4.72 6.56 -1.91 -3.45 116.57 116.03 1c07 h LYS 64 Ca 0.35 0.00 -0.58 0.00 -1.06 0.00 0.00 60.65 59.36 1c07 h LYS 64 Cb 0.76 0.00 -0.09 0.00 -0.57 0.00 0.00 32.23 32.33 1c07 h LYS 64 CO -0.11 0.00 -0.98 -0.25 -2.06 0.00 0.00 179.45 176.05 1c07 n ASP 65 N -2.52 -1.66 -0.00 0.86 9.92 0.14 -4.83 116.55 118.46 1c07 n ASP 65 Ca -0.02 -1.24 0.00 0.00 -0.53 0.00 0.00 54.79 53.01 1c07 n ASP 65 Cb 0.19 -1.93 0.00 0.00 -0.64 0.00 0.00 41.12 38.74 1c07 n ASP 65 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1c07 n GLY 67 N -0.43 2.74 3.68 0.00 0.00 -1.26 -4.99 105.19 104.93 1c07 n GLY 67 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1c07 n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c07 s LYS 68 N -0.41 2.13 -0.24 1.61 1.02 -1.26 -4.46 119.74 118.13 1c07 s LYS 68 Ca 0.00 -2.35 -0.04 0.00 0.02 0.00 0.00 55.97 53.60 1c07 s LYS 68 Cb 0.00 -1.16 0.00 0.00 -0.52 0.00 0.00 37.83 36.15 1c07 s LYS 68 CO 0.00 -0.44 -0.02 -0.51 -0.92 0.00 0.00 175.35 173.46 1c07 s LEU 69 N -3.79 3.13 1.02 3.17 1.43 0.36 -4.81 118.68 119.19 1c07 s LEU 69 Ca 0.10 -0.53 -0.16 0.00 -1.03 0.00 0.00 54.13 52.51 1c07 s LEU 69 Cb 0.01 -1.75 0.21 0.00 0.03 0.00 0.00 46.19 44.68 1c07 s LEU 69 CO 0.07 -0.07 1.20 -0.44 0.23 0.00 0.00 176.35 177.33 1c07 s SER 70 N 1.46 2.57 0.00 2.29 0.01 -1.26 -0.18 113.70 118.58 1c07 s SER 70 Ca 0.04 0.59 0.00 0.00 1.31 0.00 0.00 55.95 57.89 1c07 s SER 70 Cb -0.15 -0.86 0.00 0.00 0.21 0.00 0.00 66.02 65.22 1c07 s SER 70 CO -0.02 -3.10 0.27 0.29 0.41 0.00 0.00 173.24 171.09 1c07 n LYS 71 N -4.07 0.00 -0.38 12.44 4.76 -1.24 -0.21 118.16 129.47 1c07 n LYS 71 Ca 0.12 0.09 0.32 0.00 -2.87 0.00 0.00 58.31 55.97 1c07 n LYS 71 Cb 0.59 -0.77 0.58 0.00 -1.84 0.00 0.00 35.03 33.59 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 0.34 0.97 4.39 3.32 -1.95 -0.03 116.42 123.46 1c07 h ASP 72 Ca 0.00 0.19 -0.05 0.00 0.02 0.00 0.00 57.03 57.19 1c07 h ASP 72 Cb 0.00 0.17 0.01 0.00 0.22 0.00 0.00 39.33 39.73 1c07 h ASP 72 CO 0.00 -0.25 -0.47 1.56 -1.72 0.00 0.00 179.24 178.36 1c07 h GLN 73 N 0.12 -1.26 -0.92 3.56 1.08 -1.75 -0.27 115.11 115.67 1c07 h GLN 73 Ca 0.81 0.09 0.24 0.00 -1.45 0.00 0.00 58.65 58.33 1c07 h GLN 73 Cb 2.24 0.29 -0.06 0.00 -0.05 0.00 0.00 27.48 29.89 1c07 h GLN 73 CO -0.58 -0.84 0.63 0.35 -0.95 0.00 0.00 178.83 177.44 1c07 h PHE 74 N -1.34 0.34 0.00 2.96 3.57 0.13 1.49 116.94 124.09 1c07 h PHE 74 Ca -0.13 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.38 1c07 h PHE 74 Cb 1.00 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.64 1c07 h PHE 74 CO 0.00 0.07 0.00 0.00 -2.23 0.00 0.00 178.31 176.16 1c07 n ALA 75 N -2.59 2.17 -0.01 2.41 0.00 -0.65 -3.35 120.51 118.49 1c07 n ALA 75 Ca 0.20 -0.08 -0.15 0.00 0.00 0.00 0.00 53.44 53.41 1c07 n ALA 75 Cb 0.83 -1.42 -0.14 0.00 0.00 0.00 0.00 19.45 18.73 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 -1.58 1.81 -0.26 0.00 0.00 0.51 -3.82 117.00 113.65 1c07 n LEU 76 Ca 0.06 0.29 0.02 0.00 0.00 0.00 0.00 56.01 56.39 1c07 n LEU 76 Cb 0.31 -0.51 0.24 0.00 0.00 0.00 0.00 43.42 43.46 1c07 n LEU 76 CO 0.24 0.64 1.25 0.00 0.00 0.00 0.00 177.39 179.52 1c07 h ALA 77 N 0.50 1.49 -0.40 1.96 0.00 -1.42 -0.73 119.26 120.66 1c07 h ALA 77 Ca -0.37 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 1c07 h ALA 77 Cb 2.03 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 19.51 1c07 h ALA 77 CO 0.08 0.43 0.03 0.74 0.00 0.00 0.00 179.25 180.53 1c07 h PHE 78 N 1.03 0.65 -0.27 0.00 -1.00 -1.70 -0.90 116.94 114.74 1c07 h PHE 78 Ca 0.33 -0.07 0.08 0.00 2.81 0.00 0.00 57.97 61.12 1c07 h PHE 78 Cb 0.02 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 39.38 1c07 h PHE 78 CO -0.00 0.60 0.49 1.25 -1.61 0.00 0.00 178.31 179.05 1c07 h HIS 79 N 0.59 0.00 0.00 -0.55 2.76 -1.23 1.07 115.15 117.80 1c07 h HIS 79 Ca 0.13 0.00 -0.09 0.00 -2.20 0.00 0.00 60.37 58.21 1c07 h HIS 79 Cb 0.34 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.28 1c07 h HIS 79 CO 0.01 0.00 -1.73 1.28 -1.30 0.00 0.00 177.93 176.19 1c07 n LEU 80 N -3.28 0.35 0.01 0.26 4.77 -0.37 -4.02 117.00 114.72 1c07 n LEU 80 Ca 0.04 0.15 -0.10 0.00 -0.03 0.00 0.00 56.01 56.07 1c07 n LEU 80 Cb 0.62 0.08 -0.08 0.00 -2.33 0.00 0.00 43.42 41.71 1c07 n LEU 80 CO 0.20 0.07 0.35 0.40 -1.33 0.00 0.00 177.39 177.08 1c07 h ILE 81 N 0.00 0.94 -1.07 -0.08 1.08 0.14 -3.23 117.51 115.29 1c07 h ILE 81 Ca -0.12 -1.35 0.29 0.00 -0.39 0.00 0.00 64.86 63.30 1c07 h ILE 81 Cb 1.31 1.65 -0.11 0.00 -3.07 0.00 0.00 36.82 36.60 1c07 h ILE 81 CO 0.01 0.27 0.67 -1.28 -0.69 0.00 0.00 178.15 177.13 1c07 h SER 82 N -0.89 0.47 0.13 1.72 0.87 -1.05 1.06 113.55 115.86 1c07 h SER 82 Ca -0.01 0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.66 1c07 h SER 82 Cb 0.55 0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.56 1c07 h SER 82 CO 0.02 0.02 -0.03 1.56 -0.53 0.00 0.00 176.83 177.88 1c07 h GLN 83 N 0.38 0.00 0.00 2.24 4.20 -1.69 -0.83 115.11 119.40 1c07 h GLN 83 Ca 0.66 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 59.34 1c07 h GLN 83 Cb 1.63 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.41 1c07 h GLN 83 CO -0.39 0.03 -1.16 1.17 -0.67 0.00 0.00 178.83 177.80 1c07 n LYS 84 N -3.53 0.61 -0.07 1.46 3.00 0.36 0.29 118.16 120.28 1c07 n LYS 84 Ca -0.03 0.11 -0.05 0.00 -0.00 0.00 0.00 58.31 58.34 1c07 n LYS 84 Cb 0.12 -1.80 -0.02 0.00 0.00 0.00 0.00 35.03 33.34 1c07 n LYS 84 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1c07 n LEU 85 N -2.68 1.81 -0.25 3.14 4.77 -0.45 -3.30 117.00 120.05 1c07 n LEU 85 Ca -0.02 0.63 0.12 0.00 -0.03 0.00 0.00 56.01 56.71 1c07 n LEU 85 Cb 0.60 -0.87 0.25 0.00 -2.33 0.00 0.00 43.42 41.07 1c07 n LEU 85 CO 0.41 -0.45 0.51 -0.38 -1.33 0.00 0.00 177.39 176.14 1c07 n ILE 86 N -4.61 0.00 0.00 -0.08 2.08 -0.45 -4.34 119.36 111.96 1c07 n ILE 86 Ca -0.08 -0.13 0.00 0.00 0.56 0.00 0.00 62.75 63.10 1c07 n ILE 86 Cb 0.28 0.59 0.00 0.00 -0.75 0.00 0.00 39.64 39.77 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 -0.70 1.93 -0.90 0.38 4.76 -1.14 -5.00 118.16 117.50 1c07 n LYS 87 Ca 0.10 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.54 1c07 n LYS 87 Cb 0.37 -0.83 0.00 0.00 -1.84 0.00 0.00 35.03 32.73 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 1.71 0.58 3.88 0.72 0.00 0.35 -4.88 105.19 107.55 1c07 n GLY 88 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.63 4.74 0.36 -0.61 1.01 0.83 -4.76 121.20 120.14 1c07 s ILE 89 Ca 0.00 0.69 0.07 0.00 0.00 0.00 0.00 60.65 61.41 1c07 s ILE 89 Cb 0.00 -3.86 -0.01 0.00 0.01 0.00 0.00 42.46 38.59 1c07 s ILE 89 CO 0.00 -1.06 0.41 1.51 0.00 0.00 0.00 174.94 175.80 1c07 s ASP 90 N -4.16 5.60 0.46 3.58 -4.77 -1.26 -2.12 116.67 114.00 1c07 s ASP 90 Ca 0.53 -0.38 -0.23 0.00 -3.30 0.00 0.00 52.55 49.17 1c07 s ASP 90 Cb -0.11 -1.00 -0.07 0.00 -1.09 0.00 0.00 42.92 40.66 1c07 s ASP 90 CO 0.52 -0.47 1.21 -2.16 0.70 0.00 0.00 175.17 174.96 1c07 s PRO 91 N -4.13 3.70 0.08 2.11 0.04 -1.26 -4.95 135.00 130.59 1c07 s PRO 91 Ca 0.45 1.89 -0.31 0.00 0.04 0.00 0.00 61.00 63.07 1c07 s PRO 91 Cb -0.08 -2.44 -0.07 0.00 0.04 0.00 0.00 34.50 31.95 1c07 s PRO 91 CO 0.29 -0.63 1.44 -1.25 0.04 0.00 0.00 177.00 176.90 1c07 s PRO 92 N -2.66 4.28 0.02 0.56 0.04 -1.26 -4.91 135.00 131.08 1c07 s PRO 92 Ca 0.64 2.10 -0.03 0.00 0.04 0.00 0.00 61.00 63.75 1c07 s PRO 92 Cb -0.31 -3.39 -0.01 0.00 0.04 0.00 0.00 34.50 30.83 1c07 s PRO 92 CO 0.38 -0.53 0.46 0.72 0.04 0.00 0.00 177.00 178.07 1c07 n HIS 93 N 4.60 -0.04 -3.33 0.56 8.25 -1.26 -4.60 115.22 119.40 1c07 n HIS 93 Ca 0.13 0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.71 1c07 n HIS 93 Cb 0.42 -0.28 0.00 0.00 1.12 0.00 0.00 29.99 31.25 1c07 n HIS 93 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1c07 n VAL 94 N -2.93 0.00 -3.09 1.59 0.24 -1.26 -4.91 118.33 107.97 1c07 n VAL 94 Ca 0.00 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 62.07 1c07 n VAL 94 Cb 0.03 -0.23 0.01 0.00 -1.47 0.00 0.00 33.84 32.17 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 3.75 0.37 1.34 1.43 -1.26 -5.01 118.68 119.29 1c07 s LEU 95 Ca 0.00 0.31 0.06 0.00 -1.03 0.00 0.00 54.13 53.47 1c07 s LEU 95 Cb 0.00 -3.19 -0.07 0.00 0.03 0.00 0.00 46.19 42.96 1c07 s LEU 95 CO 0.00 -0.59 0.01 0.42 0.23 0.00 0.00 176.35 176.41 1c07 s THR 96 N -2.49 1.79 -0.37 5.49 -4.23 -1.26 -4.99 115.64 109.58 1c07 s THR 96 Ca 0.46 -2.03 0.24 0.00 -1.18 0.00 0.00 61.69 59.18 1c07 s THR 96 Cb -0.10 -2.87 0.25 0.00 1.34 0.00 0.00 72.50 71.12 1c07 s THR 96 CO 0.37 -0.04 1.72 1.55 -0.54 0.00 0.00 174.62 177.68 1c07 h PRO 97 N 1.93 0.00 0.00 3.99 0.13 -1.99 -0.12 132.00 135.93 1c07 h PRO 97 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1c07 h PRO 97 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1c07 h PRO 97 CO 0.76 0.00 -0.69 0.93 -0.23 0.00 0.00 178.00 178.76 1c07 h GLU 98 N 0.00 0.00 0.01 0.86 3.07 -1.95 -3.33 114.58 113.24 1c07 h GLU 98 Ca 0.00 0.00 -0.35 0.00 -0.50 0.00 0.00 59.36 58.51 1c07 h GLU 98 Cb 0.28 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.12 1c07 h GLU 98 CO 0.00 0.00 -2.20 -0.12 -1.40 0.00 0.00 179.01 175.29 1c07 n MET 99 N -2.31 0.67 -2.36 2.33 1.56 -0.28 0.27 117.12 117.00 1c07 n MET 99 Ca 0.02 0.10 -0.41 0.00 -0.27 0.00 0.00 57.70 57.15 1c07 n MET 99 Cb 0.47 -1.60 -0.04 0.00 2.15 0.00 0.00 33.22 34.21 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 -2.52 3.30 1.05 1.12 1.01 -0.22 -4.75 121.20 120.19 1c07 s ILE 100 Ca -0.12 1.26 -0.16 0.00 0.00 0.00 0.00 60.65 61.63 1c07 s ILE 100 Cb 0.07 -3.80 0.22 0.00 0.01 0.00 0.00 42.46 38.96 1c07 s ILE 100 CO 0.80 0.28 1.17 -2.16 0.00 0.00 0.00 174.94 175.03 1c07 s PRO 101 N -1.29 -0.02 0.00 2.79 0.04 -1.26 -4.81 135.00 130.45 1c07 s PRO 101 Ca 0.47 -0.03 0.00 0.00 0.04 0.00 0.00 61.00 61.48 1c07 s PRO 101 Cb -0.34 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1c07 s PRO 101 CO 0.43 -2.92 0.00 -0.35 0.04 0.00 0.00 177.00 174.20 1c07 n PRO 102 N -4.21 0.89 -0.24 0.56 -0.04 -1.26 -5.12 135.00 125.59 1c07 n PRO 102 Ca 0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 1c07 n PRO 102 Cb 0.59 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.05 1c07 n PRO 102 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91