#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 2.86 -0.65 -1.42 -0.00 -1.26 -4.45 118.94 114.02 1c07 s TRP 10 Ca 0.00 1.45 0.24 0.00 -0.00 0.00 0.00 56.10 57.79 1c07 s TRP 10 Cb 0.00 -2.97 0.23 0.00 -0.00 0.00 0.00 33.47 30.73 1c07 s TRP 10 CO 0.00 -1.53 1.20 1.33 -0.00 0.00 0.00 176.95 177.95 1c07 n VAL 11 N -3.33 0.25 -2.92 5.86 0.24 0.32 -4.60 118.33 114.15 1c07 n VAL 11 Ca 0.08 -0.24 -0.14 0.00 -2.04 0.00 0.00 64.34 62.00 1c07 n VAL 11 Cb 0.54 0.04 0.01 0.00 -1.47 0.00 0.00 33.84 32.96 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 -2.01 -0.23 -0.06 3.34 3.14 -1.26 -4.98 118.33 116.27 1c07 n VAL 12 Ca 0.03 -2.52 -0.05 0.00 -2.96 0.00 0.00 64.34 58.83 1c07 n VAL 12 Cb 0.43 0.30 -0.12 0.00 -1.06 0.00 0.00 33.84 33.40 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 1.29 1.43 -3.21 6.55 2.88 -1.26 -3.73 113.62 117.58 1c07 n SER 13 Ca 0.14 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.68 1c07 n SER 13 Cb 0.61 0.96 0.00 0.00 -0.75 0.00 0.00 64.21 65.03 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 -2.48 1.88 -0.16 -1.46 -0.04 -1.26 -4.33 135.00 127.16 1c07 n PRO 14 Ca -0.21 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.29 1c07 n PRO 14 Cb 0.91 0.00 0.09 0.00 -0.04 0.00 0.00 33.50 34.46 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 -0.10 0.55 0.00 -1.26 -0.19 120.51 116.67 1c07 n ALA 15 Ca 0.00 0.49 -0.13 0.00 0.00 0.00 0.00 53.44 53.80 1c07 n ALA 15 Cb 0.00 -0.32 -0.09 0.00 0.00 0.00 0.00 19.45 19.04 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 -0.38 -0.91 0.00 5.08 -1.90 0.29 114.58 116.77 1c07 h GLU 16 Ca 0.24 0.03 0.15 0.00 -1.00 0.00 0.00 59.36 58.77 1c07 h GLU 16 Cb 0.43 0.09 -0.09 0.00 0.50 0.00 0.00 28.75 29.67 1c07 h GLU 16 CO -0.45 -0.25 0.52 -0.22 -1.00 0.00 0.00 179.01 177.61 1c07 h LYS 17 N -0.39 0.72 -0.48 2.33 3.11 -0.66 -0.51 116.57 120.69 1c07 h LYS 17 Ca 0.06 -0.04 -0.02 0.00 -2.81 0.00 0.00 60.65 57.84 1c07 h LYS 17 Cb 0.55 -0.16 -0.02 0.00 -1.00 0.00 0.00 32.23 31.60 1c07 h LYS 17 CO -0.51 0.48 0.23 0.00 -2.81 0.00 0.00 179.45 176.83 1c07 h ALA 18 N 1.57 0.62 -0.15 5.00 0.00 -0.86 0.38 119.26 125.82 1c07 h ALA 18 Ca 0.49 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.32 1c07 h ALA 18 Cb 0.66 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1c07 h ALA 18 CO -0.34 0.18 0.10 -0.22 0.00 0.00 0.00 179.25 178.98 1c07 h LYS 19 N 0.63 0.05 0.01 0.00 3.64 0.11 -2.42 116.57 118.59 1c07 h LYS 19 Ca 0.17 -0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.41 1c07 h LYS 19 Cb 0.12 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1c07 h LYS 19 CO -0.02 0.04 -0.69 1.88 -2.27 0.00 0.00 179.45 178.39 1c07 h TYR 20 N 0.06 0.03 -1.20 1.91 0.05 -0.58 -3.14 116.97 114.09 1c07 h TYR 20 Ca 0.07 -0.02 0.38 0.00 0.05 0.00 0.00 58.73 59.21 1c07 h TYR 20 Cb 0.20 -0.00 -0.12 0.00 1.01 0.00 0.00 36.73 37.81 1c07 h TYR 20 CO -0.00 1.27 0.76 0.22 -1.05 0.00 0.00 178.16 179.36 1c07 h ASP 21 N -0.96 0.33 0.02 3.88 1.82 -0.02 2.20 116.42 123.68 1c07 h ASP 21 Ca -0.19 0.13 -0.18 0.00 -0.39 0.00 0.00 57.03 56.41 1c07 h ASP 21 Cb 1.19 0.10 -0.00 0.00 0.68 0.00 0.00 39.33 41.30 1c07 h ASP 21 CO -0.10 -0.12 -0.61 -0.33 -1.61 0.00 0.00 179.24 176.47 1c07 h GLU 22 N 0.19 0.59 -0.21 0.28 5.08 -1.54 -3.16 114.58 115.81 1c07 h GLU 22 Ca 0.75 -0.40 -0.19 0.00 -1.00 0.00 0.00 59.36 58.52 1c07 h GLU 22 Cb 2.18 0.06 0.00 0.00 0.50 0.00 0.00 28.75 31.50 1c07 h GLU 22 CO -0.42 1.02 -0.61 0.82 -1.00 0.00 0.00 179.01 178.82 1c07 h ILE 23 N 0.44 1.29 -1.05 3.13 2.04 0.33 -2.98 117.51 120.71 1c07 h ILE 23 Ca -0.01 -1.81 0.28 0.00 1.00 0.00 0.00 64.86 64.32 1c07 h ILE 23 Cb 1.18 1.85 -0.11 0.00 -0.74 0.00 0.00 36.82 39.00 1c07 h ILE 23 CO 0.12 0.58 0.66 0.15 0.00 0.00 0.00 178.15 179.65 1c07 h PHE 24 N 0.51 0.75 0.00 1.37 3.04 0.37 2.88 116.94 125.86 1c07 h PHE 24 Ca -0.02 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.95 1c07 h PHE 24 Cb 1.23 -0.21 -0.00 0.00 2.56 0.00 0.00 35.95 39.52 1c07 h PHE 24 CO 0.09 0.03 -0.07 -0.07 -2.02 0.00 0.00 178.31 176.27 1c07 h LEU 25 N 0.41 0.00 0.00 0.59 3.38 -1.51 0.32 115.31 118.50 1c07 h LEU 25 Ca 0.63 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.60 1c07 h LEU 25 Cb 1.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.28 1c07 h LEU 25 CO -0.36 0.07 -1.28 0.29 0.09 0.00 0.00 178.44 177.24 1c07 n LYS 26 N -3.47 0.82 -0.08 1.13 4.76 0.87 -4.55 118.16 117.63 1c07 n LYS 26 Ca -0.02 -0.07 -0.10 0.00 -2.87 0.00 0.00 58.31 55.25 1c07 n LYS 26 Cb 0.20 -1.39 -0.05 0.00 -1.84 0.00 0.00 35.03 31.94 1c07 n LYS 26 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1c07 h THR 27 N 0.00 0.33 -0.10 -0.18 2.02 0.26 -3.41 112.91 111.83 1c07 h THR 27 Ca 0.00 -1.40 -0.18 0.00 0.77 0.00 0.00 66.41 65.60 1c07 h THR 27 Cb 0.61 0.78 0.03 0.00 -1.74 0.00 0.00 68.15 67.83 1c07 h THR 27 CO 0.00 0.11 0.48 -0.67 0.37 0.00 0.00 175.52 175.82 1c07 n ASP 28 N -4.58 1.47 0.00 4.18 2.03 0.10 -4.49 116.55 115.26 1c07 n ASP 28 Ca -0.14 -2.52 0.06 0.00 0.52 0.00 0.00 54.79 52.71 1c07 n ASP 28 Cb 0.37 -1.45 0.32 0.00 -0.72 0.00 0.00 41.12 39.64 1c07 n ASP 28 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1c07 n LYS 29 N 8.09 0.29 0.00 -0.67 5.02 -1.26 -2.04 118.16 127.59 1c07 n LYS 29 Ca 0.43 0.05 0.09 0.00 -2.02 0.00 0.00 58.31 56.86 1c07 n LYS 29 Cb 0.46 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 34.00 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 -1.08 2.04 -1.27 4.39 8.00 -1.26 -4.95 116.55 122.42 1c07 n ASP 30 Ca 0.07 -1.52 -0.15 0.00 0.71 0.00 0.00 54.79 53.90 1c07 n ASP 30 Cb 0.05 0.28 -0.07 0.00 -0.02 0.00 0.00 41.12 41.36 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 0.36 -1.51 -0.00 -1.24 2.81 -0.87 -4.78 117.12 111.90 1c07 n MET 31 Ca 0.09 0.98 0.14 0.00 -1.81 0.00 0.00 57.70 57.09 1c07 n MET 31 Cb 0.40 -5.30 0.51 0.00 -0.71 0.00 0.00 33.22 28.12 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 -1.00 1.54 0.00 7.83 5.68 -1.26 -4.89 116.55 124.45 1c07 n ASP 32 Ca -0.15 -1.52 0.00 0.00 -0.50 0.00 0.00 54.79 52.62 1c07 n ASP 32 Cb 0.58 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.56 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 1.18 0.56 2.79 6.12 0.00 -1.26 -5.00 105.19 109.57 1c07 n GLY 33 Ca 0.19 -0.27 -0.16 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.00 -0.49 -0.03 1.61 2.19 -1.26 -4.16 117.98 113.85 1c07 s PHE 34 Ca 0.00 0.15 -0.20 0.00 0.33 0.00 0.00 56.93 57.21 1c07 s PHE 34 Cb 0.00 -0.33 -0.05 0.00 -1.31 0.00 0.00 43.02 41.33 1c07 s PHE 34 CO 0.00 -0.79 0.58 0.54 1.83 0.00 0.00 175.22 177.39 1c07 s VAL 35 N 2.39 4.97 0.44 3.12 0.11 -0.93 -4.67 120.40 125.83 1c07 s VAL 35 Ca 0.09 1.21 -0.08 0.00 -2.93 0.00 0.00 61.98 60.27 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 -0.23 0.39 0.78 -0.44 -3.33 0.00 0.00 175.10 172.26 1c07 s SER 36 N 0.02 6.40 0.64 3.54 0.01 -1.26 0.19 113.70 123.24 1c07 s SER 36 Ca 0.31 1.04 0.26 0.00 1.31 0.00 0.00 55.95 58.87 1c07 s SER 36 Cb -0.18 -2.29 1.39 0.00 0.21 0.00 0.00 66.02 65.16 1c07 s SER 36 CO 0.16 -0.48 1.80 1.23 0.41 0.00 0.00 173.24 176.35 1c07 h GLY 37 N 0.78 0.00 1.85 3.44 0.00 -1.92 0.26 103.07 107.47 1c07 h GLY 37 Ca -0.47 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 46.71 1c07 h GLY 37 CO 0.63 0.00 -0.65 1.41 0.00 0.00 0.00 176.54 177.93 1c07 h LEU 38 N 0.00 0.18 0.00 3.11 -0.00 -1.94 -0.59 115.31 116.06 1c07 h LEU 38 Ca 0.08 -0.11 -0.03 0.00 -0.00 0.00 0.00 57.88 57.81 1c07 h LEU 38 Cb 1.02 -0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 41.63 1c07 h LEU 38 CO -0.00 0.78 -0.26 -0.33 -0.00 0.00 0.00 178.44 178.62 1c07 h GLU 39 N 0.11 0.00 0.00 1.13 5.08 -0.81 -3.26 114.58 116.83 1c07 h GLU 39 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1c07 h GLU 39 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1c07 h GLU 39 CO 0.10 0.47 0.00 1.55 -1.00 0.00 0.00 179.01 180.13 1c07 n VAL 40 N -4.65 1.72 0.00 3.13 3.14 -1.00 -3.46 118.33 117.20 1c07 n VAL 40 Ca -0.09 0.52 0.00 0.00 -2.96 0.00 0.00 64.34 61.81 1c07 n VAL 40 Cb 0.30 -1.50 0.00 0.00 -1.06 0.00 0.00 33.84 31.58 1c07 n VAL 40 CO 0.00 0.00 0.00 -1.14 -6.46 0.00 0.00 176.83 169.23 1c07 n ARG 41 N -1.66 0.00 -0.33 1.45 3.00 -0.23 0.11 116.66 119.01 1c07 n ARG 41 Ca 0.00 0.58 0.25 0.00 -0.00 0.00 0.00 57.85 58.68 1c07 n ARG 41 Cb 0.03 -1.35 0.48 0.00 0.00 0.00 0.00 32.46 31.62 1c07 n ARG 41 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1c07 h GLU 42 N 0.00 0.15 -0.81 -0.14 3.07 -1.77 2.58 114.58 117.66 1c07 h GLU 42 Ca 0.00 -0.01 0.01 0.00 -0.50 0.00 0.00 59.36 58.86 1c07 h GLU 42 Cb 0.00 -0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 27.84 1c07 h GLU 42 CO 0.00 0.10 0.53 0.82 -1.40 0.00 0.00 179.01 179.05 1c07 h ILE 43 N 0.15 1.21 0.06 3.13 2.04 -1.35 -1.57 117.51 121.18 1c07 h ILE 43 Ca 0.74 -0.40 -0.26 0.00 1.00 0.00 0.00 64.86 65.95 1c07 h ILE 43 Cb 1.78 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 1c07 h ILE 43 CO -0.71 0.21 -1.25 -0.26 0.00 0.00 0.00 178.15 176.14 1c07 h PHE 44 N 1.10 0.23 -0.09 1.37 0.04 1.08 -3.18 116.94 117.48 1c07 h PHE 44 Ca 0.29 -0.17 0.03 0.00 2.80 0.00 0.00 57.97 60.92 1c07 h PHE 44 Cb -0.11 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.02 1c07 h PHE 44 CO -0.01 1.16 0.09 -0.07 -0.60 0.00 0.00 178.31 178.87 1c07 h LEU 45 N 0.03 0.00 0.00 1.54 3.38 0.38 0.69 115.31 121.34 1c07 h LEU 45 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1c07 h LEU 45 Cb 1.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.65 1c07 h LEU 45 CO 0.15 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.97 1c07 n LYS 46 N -4.01 0.06 0.09 1.13 5.02 -0.64 -2.56 118.16 117.26 1c07 n LYS 46 Ca -0.01 0.20 -0.16 0.00 -2.02 0.00 0.00 58.31 56.33 1c07 n LYS 46 Cb 0.20 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.60 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 1.44 -0.10 -0.18 1.35 0.26 -3.48 112.91 112.20 1c07 h THR 47 Ca 0.00 -2.79 0.00 0.00 -0.55 0.00 0.00 66.41 63.07 1c07 h THR 47 Cb 0.24 2.74 0.00 0.00 -1.73 0.00 0.00 68.15 69.41 1c07 h THR 47 CO 0.00 0.82 0.00 0.61 -0.25 0.00 0.00 175.52 176.70 1c07 n GLY 48 N 1.31 1.34 3.81 5.82 0.00 -1.06 -4.79 105.19 111.63 1c07 n GLY 48 Ca -0.08 -0.20 -0.24 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.10 3.82 1.08 0.99 1.02 -1.26 -5.08 118.68 119.15 1c07 s LEU 49 Ca 0.00 -0.18 -0.18 0.00 0.02 0.00 0.00 54.13 53.80 1c07 s LEU 49 Cb 0.00 -2.40 0.24 0.00 0.02 0.00 0.00 46.19 44.06 1c07 s LEU 49 CO 0.00 0.02 1.23 -2.16 0.02 0.00 0.00 176.35 175.46 1c07 s PRO 50 N -3.43 -0.28 -0.07 1.29 0.04 -1.26 -4.92 135.00 126.38 1c07 s PRO 50 Ca 0.32 -0.27 -0.13 0.00 0.04 0.00 0.00 61.00 60.96 1c07 s PRO 50 Cb -0.09 -1.72 -0.09 0.00 0.04 0.00 0.00 34.50 32.63 1c07 s PRO 50 CO 0.24 -3.05 0.50 0.77 0.04 0.00 0.00 177.00 175.50 1c07 h SER 51 N -2.11 -0.21 -0.68 6.66 0.02 -1.99 -3.04 113.55 112.20 1c07 h SER 51 Ca -0.44 -0.16 0.12 0.00 -0.84 0.00 0.00 61.79 60.47 1c07 h SER 51 Cb 1.26 0.05 -0.09 0.00 0.14 0.00 0.00 62.40 63.77 1c07 h SER 51 CO 0.35 0.32 0.24 0.74 -1.14 0.00 0.00 176.83 177.34 1c07 h THR 52 N -1.02 0.68 0.02 -2.27 2.02 -1.99 -1.06 112.91 109.30 1c07 h THR 52 Ca -0.02 -0.13 0.01 0.00 0.77 0.00 0.00 66.41 67.04 1c07 h THR 52 Cb 0.36 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 1c07 h THR 52 CO 0.04 0.07 -0.09 0.25 0.37 0.00 0.00 175.52 176.16 1c07 h LEU 53 N 0.39 -0.26 -0.91 2.58 5.85 -1.96 0.26 115.31 121.25 1c07 h LEU 53 Ca 0.36 0.04 0.10 0.00 0.84 0.00 0.00 57.88 59.22 1c07 h LEU 53 Cb 0.52 0.11 -0.08 0.00 0.37 0.00 0.00 40.66 41.59 1c07 h LEU 53 CO -0.38 -0.14 0.55 -0.07 -0.34 0.00 0.00 178.44 178.06 1c07 h LEU 54 N -0.17 0.81 -0.82 2.25 3.38 -1.24 1.36 115.31 120.87 1c07 h LEU 54 Ca 0.03 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1c07 h LEU 54 Cb 0.20 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1c07 h LEU 54 CO -0.08 0.46 0.30 0.00 0.09 0.00 0.00 178.44 179.20 1c07 h ALA 55 N 1.48 1.06 -0.26 1.53 0.00 -0.33 1.44 119.26 124.17 1c07 h ALA 55 Ca 0.43 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 55.02 1c07 h ALA 55 Cb 0.38 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1c07 h ALA 55 CO -0.24 0.66 -0.37 1.25 0.00 0.00 0.00 179.25 180.55 1c07 h HIS 56 N 1.14 0.69 -0.12 0.00 -0.00 0.27 -1.11 115.15 116.02 1c07 h HIS 56 Ca 0.26 -0.19 -0.15 0.00 -0.00 0.00 0.00 60.37 60.28 1c07 h HIS 56 Cb 0.23 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.41 27.48 1c07 h HIS 56 CO 0.02 0.87 -0.58 0.82 -0.00 0.00 0.00 177.93 179.06 1c07 h ILE 57 N 0.49 1.35 -0.18 6.26 2.04 0.27 -2.02 117.51 125.73 1c07 h ILE 57 Ca 0.05 -1.89 -0.02 0.00 1.00 0.00 0.00 64.86 63.99 1c07 h ILE 57 Cb 0.86 1.90 -0.01 0.00 -0.74 0.00 0.00 36.82 38.84 1c07 h ILE 57 CO 0.07 0.57 0.03 -0.25 0.00 0.00 0.00 178.15 178.58 1c07 h TRP 58 N 0.30 0.31 -0.09 1.37 2.91 0.24 -2.46 115.95 118.53 1c07 h TRP 58 Ca -0.00 -0.04 -0.05 0.00 1.13 0.00 0.00 58.89 59.93 1c07 h TRP 58 Cb 1.11 -0.09 -0.01 0.00 -0.51 0.00 0.00 29.16 29.66 1c07 h TRP 58 CO 0.03 0.45 -0.17 0.77 -1.03 0.00 0.00 178.44 178.49 1c07 h SER 59 N 0.09 0.13 0.54 2.65 0.02 -1.17 1.73 113.55 117.53 1c07 h SER 59 Ca 0.05 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1c07 h SER 59 Cb 0.30 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.81 1c07 h SER 59 CO 0.00 0.32 0.00 0.18 -1.14 0.00 0.00 176.83 176.19 1c07 n LEU 60 N -4.27 0.00 -0.00 5.07 4.77 -0.76 -3.45 117.00 118.35 1c07 n LEU 60 Ca -0.01 0.49 -0.00 0.00 -0.03 0.00 0.00 56.01 56.45 1c07 n LEU 60 Cb 0.28 -0.49 -0.00 0.00 -2.33 0.00 0.00 43.42 40.87 1c07 n LEU 60 CO 0.38 -0.22 -0.52 0.00 -1.33 0.00 0.00 177.39 175.70 1c07 n ASP 62 N -2.35 2.54 -0.16 0.00 -0.08 0.57 -4.55 116.55 112.53 1c07 n ASP 62 Ca -0.01 -2.24 0.05 0.00 -1.51 0.00 0.00 54.79 51.08 1c07 n ASP 62 Cb 0.51 -0.83 0.35 0.00 2.34 0.00 0.00 41.12 43.50 1c07 n ASP 62 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 1c07 h THR 63 N 3.85 1.06 0.00 5.18 1.35 -1.84 -0.16 112.91 122.35 1c07 h THR 63 Ca 0.28 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.88 1c07 h THR 63 Cb 0.18 0.24 0.00 0.00 -1.73 0.00 0.00 68.15 66.83 1c07 h THR 63 CO 1.36 0.14 0.19 0.11 -0.25 0.00 0.00 175.52 177.06 1c07 h LYS 64 N 0.76 0.00 -6.61 4.72 6.56 -1.89 -3.45 116.57 116.66 1c07 h LYS 64 Ca 0.28 0.00 -0.52 0.00 -1.06 0.00 0.00 60.65 59.35 1c07 h LYS 64 Cb 0.15 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 31.76 1c07 h LYS 64 CO -0.08 0.00 -0.93 -0.25 -2.06 0.00 0.00 179.45 176.13 1c07 n ASP 65 N -2.35 -1.48 0.00 0.86 9.92 -0.07 -4.84 116.55 118.59 1c07 n ASP 65 Ca -0.01 -1.10 0.00 0.00 -0.53 0.00 0.00 54.79 53.15 1c07 n ASP 65 Cb 0.22 -2.66 0.00 0.00 -0.64 0.00 0.00 41.12 38.04 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 2.75 -0.14 3.42 0.00 0.00 -1.26 -5.13 105.19 104.83 1c07 n GLY 67 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 0.00 1.75 -0.36 1.61 1.02 -1.26 -4.50 119.74 117.99 1c07 s LYS 68 Ca 0.00 -2.02 -0.10 0.00 0.02 0.00 0.00 55.97 53.87 1c07 s LYS 68 Cb 0.00 -0.38 0.03 0.00 -0.52 0.00 0.00 37.83 36.96 1c07 s LYS 68 CO 0.00 -0.44 0.18 -1.17 -0.92 0.00 0.00 175.35 173.00 1c07 s LEU 69 N -3.48 4.54 1.40 3.17 0.20 0.50 -4.75 118.68 120.26 1c07 s LEU 69 Ca 0.31 -0.97 -0.23 0.00 0.69 0.00 0.00 54.13 53.93 1c07 s LEU 69 Cb 0.04 -1.98 0.36 0.00 -0.43 0.00 0.00 46.19 44.18 1c07 s LEU 69 CO 0.17 -0.35 0.96 -0.94 -0.29 0.00 0.00 176.35 175.89 1c07 s SER 70 N 1.53 -0.89 0.00 3.68 1.04 -1.26 -2.18 113.70 115.62 1c07 s SER 70 Ca 0.02 0.78 0.00 0.00 0.48 0.00 0.00 55.95 57.22 1c07 s SER 70 Cb -0.19 -1.08 0.00 0.00 0.10 0.00 0.00 66.02 64.85 1c07 s SER 70 CO 0.06 -5.25 0.40 0.29 0.98 0.00 0.00 173.24 169.72 1c07 n LYS 71 N -5.55 0.00 -0.27 4.02 4.76 -1.26 -2.06 118.16 117.80 1c07 n LYS 71 Ca 0.13 0.14 0.05 0.00 -2.87 0.00 0.00 58.31 55.76 1c07 n LYS 71 Cb 0.60 -0.90 0.19 0.00 -1.84 0.00 0.00 35.03 33.08 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 0.46 -0.46 4.39 5.19 -1.97 -2.76 116.42 121.26 1c07 h ASP 72 Ca 0.00 0.08 0.05 0.00 -0.62 0.00 0.00 57.03 56.54 1c07 h ASP 72 Cb 0.00 0.01 -0.07 0.00 0.18 0.00 0.00 39.33 39.45 1c07 h ASP 72 CO 0.00 0.22 -0.42 1.56 -3.12 0.00 0.00 179.24 177.48 1c07 h GLN 73 N 0.59 -0.17 -1.04 3.56 4.20 -1.80 0.94 115.11 121.39 1c07 h GLN 73 Ca 0.42 0.01 0.26 0.00 0.06 0.00 0.00 58.65 59.40 1c07 h GLN 73 Cb 0.55 0.04 -0.09 0.00 0.30 0.00 0.00 27.48 28.28 1c07 h GLN 73 CO -0.34 -0.12 0.67 0.35 -0.67 0.00 0.00 178.83 178.73 1c07 h PHE 74 N -0.18 0.63 0.00 2.96 3.57 -1.12 2.35 116.94 125.15 1c07 h PHE 74 Ca 0.08 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1c07 h PHE 74 Cb 0.38 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 38.94 1c07 h PHE 74 CO -0.81 0.07 0.00 0.00 -2.23 0.00 0.00 178.31 175.33 1c07 n ALA 75 N -2.48 1.80 0.00 2.41 0.00 0.31 -2.68 120.51 119.88 1c07 n ALA 75 Ca 0.25 -0.07 -0.20 0.00 0.00 0.00 0.00 53.44 53.43 1c07 n ALA 75 Cb 0.88 -1.23 -0.14 0.00 0.00 0.00 0.00 19.45 18.95 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 -1.31 2.39 -0.36 0.00 0.00 0.79 -4.14 117.00 114.38 1c07 n LEU 76 Ca 0.06 0.24 0.05 0.00 0.00 0.00 0.00 56.01 56.36 1c07 n LEU 76 Cb 0.12 -0.93 0.22 0.00 0.00 0.00 0.00 43.42 42.82 1c07 n LEU 76 CO 0.11 0.79 1.25 0.00 0.00 0.00 0.00 177.39 179.54 1c07 h ALA 77 N 0.21 1.48 -0.25 1.96 0.00 -1.39 0.65 119.26 121.91 1c07 h ALA 77 Ca -0.41 -0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.58 1c07 h ALA 77 Cb 2.03 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 19.56 1c07 h ALA 77 CO 0.09 0.32 0.19 0.74 0.00 0.00 0.00 179.25 180.59 1c07 h PHE 78 N 1.07 0.00 0.00 0.00 0.04 -1.72 0.64 116.94 116.97 1c07 h PHE 78 Ca 0.46 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 61.21 1c07 h PHE 78 Cb 0.34 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.49 1c07 h PHE 78 CO -0.00 0.00 -0.12 1.25 -0.60 0.00 0.00 178.31 178.84 1c07 h HIS 79 N 0.00 0.00 0.00 -0.55 2.76 -1.04 0.24 115.15 116.57 1c07 h HIS 79 Ca 0.12 0.00 -0.44 0.00 -2.20 0.00 0.00 60.37 57.85 1c07 h HIS 79 Cb 0.50 0.00 -0.07 0.00 1.55 0.00 0.00 27.41 29.39 1c07 h HIS 79 CO 0.00 0.12 -2.49 1.28 -1.30 0.00 0.00 177.93 175.55 1c07 n LEU 80 N -3.89 2.07 0.03 0.26 4.77 0.81 -4.17 117.00 116.88 1c07 n LEU 80 Ca -0.02 0.25 0.04 0.00 -0.03 0.00 0.00 56.01 56.24 1c07 n LEU 80 Cb 0.22 -0.80 0.43 0.00 -2.33 0.00 0.00 43.42 40.93 1c07 n LEU 80 CO 0.32 0.62 1.11 0.40 -1.33 0.00 0.00 177.39 178.51 1c07 h ILE 81 N -0.79 1.11 0.00 -0.08 2.04 0.08 -1.14 117.51 118.72 1c07 h ILE 81 Ca -0.66 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 64.93 1c07 h ILE 81 Cb 1.64 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.36 1c07 h ILE 81 CO -0.36 0.12 0.00 -1.28 0.00 0.00 0.00 178.15 176.63 1c07 h SER 82 N 0.48 0.00 0.70 1.72 0.87 -0.70 -3.01 113.55 113.61 1c07 h SER 82 Ca 0.13 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 1c07 h SER 82 Cb 0.01 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 1c07 h SER 82 CO -0.02 0.00 -0.77 1.67 -0.53 0.00 0.00 176.83 177.17 1c07 n GLN 83 N -2.88 0.29 0.05 2.24 7.27 -0.45 -3.96 117.38 119.94 1c07 n GLN 83 Ca 0.02 0.05 0.12 0.00 0.07 0.00 0.00 57.00 57.25 1c07 n GLN 83 Cb 0.34 -1.65 0.11 0.00 2.41 0.00 0.00 30.24 31.45 1c07 n GLN 83 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 1c07 n LYS 84 N -2.05 0.32 -0.08 3.69 3.00 -1.13 0.19 118.16 122.10 1c07 n LYS 84 Ca 0.03 0.06 -0.11 0.00 -0.00 0.00 0.00 58.31 58.29 1c07 n LYS 84 Cb 0.44 -1.67 -0.05 0.00 0.00 0.00 0.00 35.03 33.75 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 -2.11 1.83 0.02 3.14 4.77 -1.24 -3.44 117.00 119.96 1c07 n LEU 85 Ca 0.02 0.56 0.11 0.00 -0.03 0.00 0.00 56.01 56.68 1c07 n LEU 85 Cb 0.45 -0.90 -0.13 0.00 -2.33 0.00 0.00 43.42 40.51 1c07 n LEU 85 CO 0.38 -0.22 -0.56 -0.38 -1.33 0.00 0.00 177.39 175.28 1c07 n ILE 86 N -4.55 0.14 0.21 -0.08 2.08 -1.25 -4.39 119.36 111.52 1c07 n ILE 86 Ca -0.16 -0.50 0.06 0.00 0.56 0.00 0.00 62.75 62.71 1c07 n ILE 86 Cb 0.41 -0.06 -0.08 0.00 -0.75 0.00 0.00 39.64 39.16 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 -2.34 1.47 -3.22 0.38 4.76 -1.09 -5.00 118.16 113.12 1c07 n LYS 87 Ca -0.03 -0.07 -0.23 0.00 -2.87 0.00 0.00 58.31 55.11 1c07 n LYS 87 Cb 0.56 -1.19 0.05 0.00 -1.84 0.00 0.00 35.03 32.61 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 1.61 -0.53 3.82 0.72 0.00 0.40 -4.86 105.19 106.35 1c07 n GLY 88 Ca -0.00 0.18 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 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 -3.23 4.65 0.35 -0.61 1.01 0.49 -4.85 121.20 119.00 1c07 s ILE 89 Ca 0.41 -0.97 0.06 0.00 0.00 0.00 0.00 60.65 60.14 1c07 s ILE 89 Cb -0.18 -3.36 -0.01 0.00 0.01 0.00 0.00 42.46 38.92 1c07 s ILE 89 CO 0.50 -0.08 0.49 -1.81 0.00 0.00 0.00 174.94 174.05 1c07 s ASP 90 N -3.05 5.95 0.63 3.58 1.01 -1.26 -3.28 116.67 120.24 1c07 s ASP 90 Ca 0.31 -0.14 -0.15 0.00 0.71 0.00 0.00 52.55 53.28 1c07 s ASP 90 Cb -0.10 -1.25 -0.02 0.00 1.01 0.00 0.00 42.92 42.56 1c07 s ASP 90 CO 0.24 -0.47 1.08 -2.16 0.21 0.00 0.00 175.17 174.07 1c07 s PRO 91 N -4.22 3.08 1.18 8.23 0.04 -1.26 -5.02 135.00 137.04 1c07 s PRO 91 Ca 0.46 1.27 -0.20 0.00 0.04 0.00 0.00 61.00 62.57 1c07 s PRO 91 Cb -0.10 -2.00 0.29 0.00 0.04 0.00 0.00 34.50 32.74 1c07 s PRO 91 CO 0.32 -1.01 1.03 -0.35 0.04 0.00 0.00 177.00 177.03 1c07 n PRO 92 N -2.24 -3.13 0.00 0.56 -0.04 -1.26 -5.03 135.00 123.86 1c07 n PRO 92 Ca 0.09 -1.65 0.00 0.00 -0.04 0.00 0.00 63.50 61.90 1c07 n PRO 92 Cb 0.52 -1.57 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 1c07 n PRO 92 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1c07 n HIS 93 N -4.80 0.00 -3.22 0.54 8.25 -1.26 -4.99 115.22 109.75 1c07 n HIS 93 Ca 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.60 1c07 n HIS 93 Cb 0.56 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.67 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 0.00 0.00 -1.83 1.59 0.24 -1.26 -4.89 118.33 112.18 1c07 n VAL 94 Ca 0.00 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 61.93 1c07 n VAL 94 Cb 0.00 -0.59 0.05 0.00 -1.47 0.00 0.00 33.84 31.83 1c07 n VAL 94 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1c07 s LEU 95 N 0.00 3.73 0.26 1.34 2.96 -1.26 -4.98 118.68 120.73 1c07 s LEU 95 Ca 0.00 2.63 0.04 0.00 -0.22 0.00 0.00 54.13 56.58 1c07 s LEU 95 Cb 0.00 -4.45 -0.05 0.00 0.50 0.00 0.00 46.19 42.19 1c07 s LEU 95 CO 0.00 -1.69 0.01 0.42 -1.32 0.00 0.00 176.35 173.77 1c07 s THR 96 N -1.39 1.11 0.30 3.68 -4.23 -1.26 -5.01 115.64 108.83 1c07 s THR 96 Ca 0.76 -2.04 0.23 0.00 -1.18 0.00 0.00 61.69 59.47 1c07 s THR 96 Cb -0.37 -2.47 0.23 0.00 1.34 0.00 0.00 72.50 71.23 1c07 s THR 96 CO 0.42 -0.23 1.93 1.55 -0.54 0.00 0.00 174.62 177.75 1c07 h PRO 97 N 2.37 0.00 0.00 3.99 0.13 -1.96 0.20 132.00 136.73 1c07 h PRO 97 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1c07 h PRO 97 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1c07 h PRO 97 CO 0.66 0.21 -0.04 0.39 -0.23 0.00 0.00 178.00 178.99 1c07 n GLU 98 N -3.62 0.11 -0.08 0.86 1.02 -1.26 -3.54 120.64 114.13 1c07 n GLU 98 Ca -0.01 0.09 -0.08 0.00 -0.02 0.00 0.00 57.16 57.13 1c07 n GLU 98 Cb 0.34 -1.62 -0.13 0.00 -0.02 0.00 0.00 31.44 30.01 1c07 n GLU 98 CO 0.00 0.00 0.00 -0.12 1.18 0.00 0.00 177.13 178.19 1c07 n MET 99 N -1.82 1.32 -2.42 3.49 1.56 -0.43 -0.52 117.12 118.30 1c07 n MET 99 Ca 0.06 -0.01 -0.42 0.00 -0.27 0.00 0.00 57.70 57.07 1c07 n MET 99 Cb 0.38 -1.42 -0.03 0.00 2.15 0.00 0.00 33.22 34.30 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 -2.40 4.13 0.75 1.12 1.01 0.57 -4.91 121.20 121.47 1c07 s ILE 100 Ca -0.09 1.49 -0.11 0.00 0.00 0.00 0.00 60.65 61.94 1c07 s ILE 100 Cb 0.05 -3.96 0.04 0.00 0.01 0.00 0.00 42.46 38.60 1c07 s ILE 100 CO 0.66 0.03 1.08 -2.16 0.00 0.00 0.00 174.94 174.56 1c07 s PRO 101 N 1.89 2.48 0.59 2.79 0.04 -1.26 -4.91 135.00 136.62 1c07 s PRO 101 Ca 0.58 0.73 -0.16 0.00 0.04 0.00 0.00 61.00 62.19 1c07 s PRO 101 Cb -0.27 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 1c07 s PRO 101 CO 0.25 -1.36 1.06 -1.25 0.04 0.00 0.00 177.00 175.73 1c07 s PRO 102 N -5.14 3.32 0.00 0.56 0.04 -1.26 -5.16 135.00 127.37 1c07 s PRO 102 Ca 0.59 1.23 0.00 0.00 0.04 0.00 0.00 61.00 62.86 1c07 s PRO 102 Cb -0.14 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.37 1c07 s PRO 102 CO 0.54 -0.81 0.16 0.43 0.04 0.00 0.00 177.00 177.36