#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cuh n SER 2 N 0.00 1.14 -4.02 1.61 7.64 -1.26 -4.85 113.62 113.87 2cuh n SER 2 Ca 0.00 -1.00 -0.08 0.00 1.01 0.00 0.00 58.87 58.80 2cuh n SER 2 Cb 0.00 -1.37 -0.10 0.00 -1.01 0.00 0.00 64.21 61.73 2cuh n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2cuh s SER 3 N 8.84 0.35 0.00 6.43 0.01 -1.26 -5.13 113.70 122.94 2cuh s SER 3 Ca 1.05 -0.75 0.00 0.00 1.31 0.00 0.00 55.95 57.56 2cuh s SER 3 Cb -0.36 0.17 0.00 0.00 0.21 0.00 0.00 66.02 66.04 2cuh s SER 3 CO 0.24 -0.48 0.00 0.61 0.41 0.00 0.00 173.24 174.02 2cuh n GLY 4 N 0.73 -0.63 3.51 3.44 0.00 -1.26 -4.86 105.19 106.12 2cuh n GLY 4 Ca -0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 2cuh n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2cuh n SER 5 N 0.00 -0.94 -4.24 1.61 7.64 -1.26 -4.92 113.62 111.51 2cuh n SER 5 Ca 0.00 0.48 -0.34 0.00 1.01 0.00 0.00 58.87 60.02 2cuh n SER 5 Cb 0.00 -1.30 0.13 0.00 -1.01 0.00 0.00 64.21 62.03 2cuh n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2cuh n SER 6 N -1.60 -2.70 -3.87 6.43 7.64 -1.26 -4.94 113.62 113.31 2cuh n SER 6 Ca 0.10 0.02 -0.30 0.00 1.01 0.00 0.00 58.87 59.69 2cuh n SER 6 Cb 0.52 -0.92 -0.10 0.00 -1.01 0.00 0.00 64.21 62.70 2cuh n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cuh n GLY 7 N 2.28 4.21 3.67 0.23 0.00 -1.26 -5.09 105.19 109.23 2cuh n GLY 7 Ca 0.01 -2.63 -0.29 0.00 0.00 0.00 0.00 46.02 43.12 2cuh n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cuh s PRO 8 N -1.66 0.34 0.00 1.61 0.04 -1.26 -4.99 135.00 129.08 2cuh s PRO 8 Ca 0.28 0.48 0.07 0.00 0.04 0.00 0.00 61.00 61.88 2cuh s PRO 8 Cb -0.01 -1.73 0.21 0.00 0.04 0.00 0.00 34.50 33.00 2cuh s PRO 8 CO -0.13 -2.78 1.17 -0.25 0.04 0.00 0.00 177.00 175.05 2cuh n ASP 9 N -4.21 2.62 -0.91 6.66 9.92 -1.26 -4.98 116.55 124.39 2cuh n ASP 9 Ca 0.05 -1.99 0.00 0.00 -0.53 0.00 0.00 54.79 52.32 2cuh n ASP 9 Cb 0.57 -0.16 0.00 0.00 -0.64 0.00 0.00 41.12 40.90 2cuh n ASP 9 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2cuh n GLY 10 N 0.19 5.52 3.68 0.44 0.00 -1.26 -4.70 105.19 109.05 2cuh n GLY 10 Ca 0.08 -2.11 -0.42 0.00 0.00 0.00 0.00 46.02 43.57 2cuh n GLY 10 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cuh s PRO 11 N -0.20 4.26 0.37 1.61 0.04 -1.26 -4.43 135.00 135.38 2cuh s PRO 11 Ca 0.00 2.02 0.04 0.00 0.04 0.00 0.00 61.00 63.10 2cuh s PRO 11 Cb 0.00 -3.62 -0.05 0.00 0.04 0.00 0.00 34.50 30.87 2cuh s PRO 11 CO 0.00 -0.63 0.07 0.95 0.04 0.00 0.00 177.00 177.43 2cuh s THR 12 N 2.61 1.12 -1.46 1.26 -4.23 -1.21 -4.49 115.64 109.24 2cuh s THR 12 Ca 0.66 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 59.07 2cuh s THR 12 Cb -0.32 -2.66 0.04 0.00 1.34 0.00 0.00 72.50 70.90 2cuh s THR 12 CO 0.27 0.00 0.89 0.00 -0.54 0.00 0.00 174.62 175.24 2cuh n GLN 13 N -0.81 -5.87 -1.84 3.99 6.02 -1.26 -1.83 117.38 115.79 2cuh n GLN 13 Ca -0.05 0.74 -0.42 0.00 -0.01 0.00 0.00 57.00 57.26 2cuh n GLN 13 Cb 0.66 -5.65 -0.03 0.00 1.02 0.00 0.00 30.24 26.24 2cuh n GLN 13 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 2cuh s LEU 14 N -7.05 4.37 0.12 1.08 2.96 -1.26 -4.59 118.68 114.32 2cuh s LEU 14 Ca 0.52 2.70 -0.03 0.00 -0.22 0.00 0.00 54.13 57.11 2cuh s LEU 14 Cb -0.24 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.82 2cuh s LEU 14 CO 0.64 -0.90 0.08 -0.60 -1.32 0.00 0.00 176.35 174.25 2cuh s ARG 15 N 1.52 0.91 -0.28 1.98 3.52 -0.84 -4.97 118.95 120.78 2cuh s ARG 15 Ca 0.73 -1.34 0.02 0.00 -0.13 0.00 0.00 55.73 55.01 2cuh s ARG 15 Cb -0.46 0.26 0.08 0.00 -1.56 0.00 0.00 34.95 33.28 2cuh s ARG 15 CO 0.32 -0.26 -0.01 0.00 -0.81 0.00 0.00 175.30 174.54 2cuh s ALA 16 N -4.01 2.30 0.67 6.12 0.00 -1.26 -3.28 121.76 122.31 2cuh s ALA 16 Ca 0.19 -1.85 -0.13 0.00 0.00 0.00 0.00 51.96 50.18 2cuh s ALA 16 Cb 0.07 -1.66 0.00 0.00 0.00 0.00 0.00 23.12 21.53 2cuh s ALA 16 CO -0.01 -1.42 1.08 -0.51 0.00 0.00 0.00 175.76 174.90 2cuh s LEU 17 N 1.22 3.28 -1.02 0.00 1.02 -1.26 -4.94 118.68 116.99 2cuh s LEU 17 Ca 0.01 1.81 -0.23 0.00 0.02 0.00 0.00 54.13 55.74 2cuh s LEU 17 Cb -0.19 -4.52 0.04 0.00 0.02 0.00 0.00 46.19 41.54 2cuh s LEU 17 CO -0.09 -1.53 1.52 0.21 0.02 0.00 0.00 176.35 176.48 2cuh s ASN 18 N -3.13 6.35 0.50 2.29 2.47 -1.26 -4.95 114.94 117.21 2cuh s ASN 18 Ca 0.62 -1.40 0.01 0.00 0.42 0.00 0.00 52.86 52.51 2cuh s ASN 18 Cb -0.17 -2.57 0.01 0.00 -1.45 0.00 0.00 41.25 37.08 2cuh s ASN 18 CO 0.47 -1.64 0.72 -1.48 -3.72 0.00 0.00 177.10 171.44 2cuh s LEU 19 N 5.55 3.48 -0.38 3.21 -0.00 -1.26 -4.97 118.68 124.30 2cuh s LEU 19 Ca 0.49 0.17 -0.42 0.00 -0.00 0.00 0.00 54.13 54.37 2cuh s LEU 19 Cb -0.01 -3.05 -0.17 0.00 -0.00 0.00 0.00 46.19 42.96 2cuh s LEU 19 CO -0.08 -0.90 1.79 1.07 -0.00 0.00 0.00 176.35 178.23 2cuh n THR 20 N -2.20 0.17 -1.52 5.48 5.66 -1.26 -4.65 114.28 115.95 2cuh n THR 20 Ca 0.04 -0.05 -0.29 0.00 -3.05 0.00 0.00 64.05 60.70 2cuh n THR 20 Cb 0.58 -0.96 -0.14 0.00 -1.55 0.00 0.00 70.33 68.27 2cuh n THR 20 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 2cuh n GLU 21 N 5.45 0.30 0.00 1.09 0.28 -1.26 -2.56 120.64 123.94 2cuh n GLU 21 Ca 0.32 -0.17 0.00 0.00 -0.16 0.00 0.00 57.16 57.16 2cuh n GLU 21 Cb 0.06 -2.13 0.00 0.00 1.43 0.00 0.00 31.44 30.80 2cuh n GLU 21 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2cuh n GLY 22 N 6.15 0.20 3.17 -1.84 0.00 -1.26 -5.05 105.19 106.56 2cuh n GLY 22 Ca 0.58 0.18 -0.35 0.00 0.00 0.00 0.00 46.02 46.42 2cuh n GLY 22 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2cuh s PHE 23 N 0.00 3.33 -0.02 1.61 5.36 -1.06 -4.99 117.98 122.22 2cuh s PHE 23 Ca 0.00 -1.93 -0.03 0.00 -0.96 0.00 0.00 56.93 54.01 2cuh s PHE 23 Cb 0.00 -2.35 -0.04 0.00 -0.34 0.00 0.00 43.02 40.29 2cuh s PHE 23 CO 0.00 -0.83 0.18 0.00 -1.46 0.00 0.00 175.22 173.11 2cuh s ALA 24 N 1.25 3.95 0.16 11.12 0.00 -1.26 -4.62 121.76 132.35 2cuh s ALA 24 Ca -0.02 -0.75 0.02 0.00 0.00 0.00 0.00 51.96 51.21 2cuh s ALA 24 Cb -0.20 -1.89 -0.04 0.00 0.00 0.00 0.00 23.12 20.98 2cuh s ALA 24 CO -0.01 0.74 -0.02 0.14 0.00 0.00 0.00 175.76 176.61 2cuh s VAL 25 N -1.30 0.69 0.16 0.00 -7.23 -1.26 -2.21 120.40 109.25 2cuh s VAL 25 Ca 0.26 -1.97 -0.07 0.00 -1.81 0.00 0.00 61.98 58.39 2cuh s VAL 25 Cb -0.13 -2.02 -0.06 0.00 0.56 0.00 0.00 36.38 34.74 2cuh s VAL 25 CO 0.17 -0.57 0.43 -0.76 -0.31 0.00 0.00 175.10 174.06 2cuh s LEU 26 N -3.14 4.25 -0.09 1.32 1.43 -1.12 -4.78 118.68 116.55 2cuh s LEU 26 Ca 0.21 0.70 -0.01 0.00 -1.03 0.00 0.00 54.13 54.00 2cuh s LEU 26 Cb 0.06 -3.38 0.03 0.00 0.03 0.00 0.00 46.19 42.92 2cuh s LEU 26 CO 0.02 0.03 -0.00 -1.00 0.23 0.00 0.00 176.35 175.63 2cuh s HIS 27 N -1.68 0.78 0.12 0.29 3.76 -1.20 -3.50 115.29 113.85 2cuh s HIS 27 Ca 0.42 -0.29 0.06 0.00 -0.15 0.00 0.00 55.06 55.10 2cuh s HIS 27 Cb -0.12 -0.86 -0.04 0.00 1.11 0.00 0.00 32.58 32.67 2cuh s HIS 27 CO 0.23 -0.38 -0.14 1.67 -0.85 0.00 0.00 174.74 175.27 2cuh s TRP 28 N 1.94 1.39 -0.24 1.40 -2.14 -1.25 -1.98 118.94 118.07 2cuh s TRP 28 Ca 0.04 -0.54 -0.17 0.00 2.66 0.00 0.00 56.10 58.09 2cuh s TRP 28 Cb -0.13 -0.74 -0.03 0.00 -3.10 0.00 0.00 33.47 29.48 2cuh s TRP 28 CO -0.06 0.14 0.48 0.21 -2.66 0.00 0.00 176.95 175.06 2cuh s LYS 29 N -2.54 4.11 -0.07 3.25 2.20 -0.76 -4.86 119.74 121.06 2cuh s LYS 29 Ca 0.08 0.29 -0.30 0.00 -0.36 0.00 0.00 55.97 55.68 2cuh s LYS 29 Cb -0.06 -3.61 -0.05 0.00 -1.51 0.00 0.00 37.83 32.60 2cuh s LYS 29 CO 0.03 -0.25 1.50 -1.25 -0.36 0.00 0.00 175.35 175.02 2cuh s PRO 30 N 1.97 4.21 0.82 4.03 0.04 -1.26 -3.35 135.00 141.46 2cuh s PRO 30 Ca 0.21 2.01 -0.11 0.00 0.04 0.00 0.00 61.00 63.15 2cuh s PRO 30 Cb -0.15 -3.83 0.08 0.00 0.04 0.00 0.00 34.50 30.63 2cuh s PRO 30 CO 0.09 -0.75 1.09 -1.25 0.04 0.00 0.00 177.00 176.22 2cuh s PRO 31 N 3.53 1.89 0.16 0.56 0.04 -1.26 -4.90 135.00 135.01 2cuh s PRO 31 Ca 0.67 1.04 -0.13 0.00 0.04 0.00 0.00 61.00 62.61 2cuh s PRO 31 Cb -0.30 -1.86 0.15 0.00 0.04 0.00 0.00 34.50 32.53 2cuh s PRO 31 CO 0.25 -1.87 1.11 0.94 0.04 0.00 0.00 177.00 177.47 2cuh n GLN 32 N -3.66 -0.18 -3.59 4.56 0.00 -1.26 -3.82 117.38 109.44 2cuh n GLN 32 Ca 0.08 1.10 -0.38 0.00 -0.00 0.00 0.00 57.00 57.81 2cuh n GLN 32 Cb 0.54 -1.63 -0.10 0.00 0.00 0.00 0.00 30.24 29.04 2cuh n GLN 32 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.06 178.27 2cuh s ASN 33 N -5.27 6.08 -0.09 1.69 2.47 -1.26 -5.05 114.94 113.52 2cuh s ASN 33 Ca -0.10 0.07 -0.30 0.00 0.42 0.00 0.00 52.86 52.96 2cuh s ASN 33 Cb 0.14 -2.13 -0.04 0.00 -1.45 0.00 0.00 41.25 37.77 2cuh s ASN 33 CO 0.50 -0.03 1.52 -2.16 -3.72 0.00 0.00 177.10 173.22 2cuh s PRO 34 N 1.55 4.20 1.27 0.43 0.04 -1.25 -4.94 135.00 136.31 2cuh s PRO 34 Ca 0.08 2.01 -0.21 0.00 0.04 0.00 0.00 61.00 62.92 2cuh s PRO 34 Cb -0.15 -3.90 0.33 0.00 0.04 0.00 0.00 34.50 30.82 2cuh s PRO 34 CO 0.09 -0.79 0.82 1.33 0.04 0.00 0.00 177.00 178.49 2cuh n VAL 35 N 5.41 0.00 -0.07 -0.36 0.24 -1.26 -4.98 118.33 117.31 2cuh n VAL 35 Ca 0.16 -0.09 -0.05 0.00 -2.04 0.00 0.00 64.34 62.32 2cuh n VAL 35 Cb 0.43 -0.95 -0.02 0.00 -1.47 0.00 0.00 33.84 31.83 2cuh n VAL 35 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 2cuh h ASP 36 N -3.29 0.00 -4.41 -1.34 3.32 -1.91 -3.33 116.42 105.46 2cuh h ASP 36 Ca -0.36 -0.05 -0.18 0.00 0.02 0.00 0.00 57.03 56.46 2cuh h ASP 36 Cb 1.18 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.49 2cuh h ASP 36 CO 0.22 0.76 -0.63 0.42 -1.72 0.00 0.00 179.24 178.29 2cuh s THR 37 N -2.11 0.05 -0.19 0.35 -4.23 -1.25 0.35 115.64 108.60 2cuh s THR 37 Ca -0.13 -0.44 -0.10 0.00 -1.18 0.00 0.00 61.69 59.85 2cuh s THR 37 Cb 0.02 -0.23 -0.05 0.00 1.34 0.00 0.00 72.50 73.58 2cuh s THR 37 CO 0.21 -0.24 0.13 -0.31 -0.54 0.00 0.00 174.62 173.86 2cuh s TYR 38 N -0.74 3.41 -0.47 3.99 2.02 0.82 -1.35 117.35 125.03 2cuh s TYR 38 Ca -0.08 0.33 -0.17 0.00 -0.37 0.00 0.00 57.07 56.77 2cuh s TYR 38 Cb -0.05 -2.14 0.05 0.00 -0.40 0.00 0.00 41.96 39.42 2cuh s TYR 38 CO 0.00 0.31 0.50 0.34 -1.57 0.00 0.00 175.55 175.13 2cuh s ASP 39 N 0.27 6.19 -0.12 2.29 2.15 0.20 -2.90 116.67 124.75 2cuh s ASP 39 Ca 0.08 -1.00 -0.04 0.00 0.43 0.00 0.00 52.55 52.02 2cuh s ASP 39 Cb -0.11 -2.24 -0.03 0.00 -0.30 0.00 0.00 42.92 40.24 2cuh s ASP 39 CO -0.01 -0.73 0.01 -0.63 -0.17 0.00 0.00 175.17 173.64 2cuh s ILE 40 N 2.15 4.40 -0.10 4.11 1.09 -1.18 -1.45 121.20 130.23 2cuh s ILE 40 Ca 0.10 -0.20 -0.02 0.00 -1.10 0.00 0.00 60.65 59.43 2cuh s ILE 40 Cb -0.20 -2.90 0.04 0.00 -1.06 0.00 0.00 42.46 38.34 2cuh s ILE 40 CO 0.10 0.56 0.03 -1.58 -0.10 0.00 0.00 174.94 173.95 2cuh s GLN 41 N -0.40 0.38 -0.15 2.79 0.74 -0.94 -3.02 119.66 119.06 2cuh s GLN 41 Ca 0.08 0.07 -0.03 0.00 0.05 0.00 0.00 55.36 55.52 2cuh s GLN 41 Cb -0.12 -1.14 -0.03 0.00 1.10 0.00 0.00 33.01 32.82 2cuh s GLN 41 CO 0.02 -0.41 -0.04 0.08 -0.55 0.00 0.00 175.29 174.39 2cuh s VAL 42 N 2.02 3.86 0.29 1.34 1.01 -0.90 -1.39 120.40 126.64 2cuh s VAL 42 Ca 0.04 -0.37 -0.04 0.00 0.00 0.00 0.00 61.98 61.61 2cuh s VAL 42 Cb -0.13 -2.69 -0.01 0.00 0.00 0.00 0.00 36.38 33.55 2cuh s VAL 42 CO -0.06 0.50 0.39 0.42 0.00 0.00 0.00 175.10 176.36 2cuh s THR 43 N 0.32 0.00 -0.05 3.92 -4.23 -1.01 -0.89 115.64 113.71 2cuh s THR 43 Ca -0.04 -1.66 -0.30 0.00 -1.18 0.00 0.00 61.69 58.50 2cuh s THR 43 Cb -0.14 -2.50 0.11 0.00 1.34 0.00 0.00 72.50 71.31 2cuh s THR 43 CO 0.03 0.00 0.95 0.00 -0.54 0.00 0.00 174.62 175.06 2cuh s ALA 44 N -3.53 -1.87 -1.07 3.99 0.00 -1.26 -2.03 121.76 115.98 2cuh s ALA 44 Ca 0.31 1.15 0.14 0.00 0.00 0.00 0.00 51.96 53.56 2cuh s ALA 44 Cb 0.01 0.27 0.63 0.00 0.00 0.00 0.00 23.12 24.03 2cuh s ALA 44 CO 0.17 -0.65 1.45 -0.35 0.00 0.00 0.00 175.76 176.37 2cuh n PRO 45 N -0.17 0.03 -2.36 0.00 -0.04 -1.26 -3.31 135.00 127.89 2cuh n PRO 45 Ca -0.07 0.24 -0.00 0.00 -0.04 0.00 0.00 63.50 63.62 2cuh n PRO 45 Cb 0.61 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.62 2cuh n PRO 45 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2cuh n GLY 46 N -0.04 1.57 3.27 0.55 0.00 -1.26 -5.11 105.19 104.17 2cuh n GLY 46 Ca 0.04 -0.69 -0.12 0.00 0.00 0.00 0.00 46.02 45.25 2cuh n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cuh s ALA 47 N -1.72 -0.75 0.48 4.61 0.00 -1.21 -5.07 121.76 118.11 2cuh s ALA 47 Ca 0.21 0.07 -0.22 0.00 0.00 0.00 0.00 51.96 52.02 2cuh s ALA 47 Cb 0.33 0.33 -0.07 0.00 0.00 0.00 0.00 23.12 23.71 2cuh s ALA 47 CO -0.08 -0.42 1.15 -1.25 0.00 0.00 0.00 175.76 175.16 2cuh s PRO 48 N -2.55 3.66 0.44 0.00 0.04 -1.26 -4.17 135.00 131.16 2cuh s PRO 48 Ca -0.05 1.73 -0.24 0.00 0.04 0.00 0.00 61.00 62.48 2cuh s PRO 48 Cb -0.01 -2.30 -0.08 0.00 0.04 0.00 0.00 34.50 32.15 2cuh s PRO 48 CO -0.03 -0.62 1.18 -1.25 0.04 0.00 0.00 177.00 176.31 2cuh s PRO 49 N -2.85 3.87 -0.03 0.56 0.04 -1.26 -4.75 135.00 130.58 2cuh s PRO 49 Ca 0.66 1.82 0.03 0.00 0.04 0.00 0.00 61.00 63.55 2cuh s PRO 49 Cb -0.27 -2.52 0.00 0.00 0.04 0.00 0.00 34.50 31.75 2cuh s PRO 49 CO 0.33 -0.47 -0.12 -1.17 0.04 0.00 0.00 177.00 175.61 2cuh s LEU 50 N -2.80 1.81 -0.05 -3.56 2.96 -0.07 -5.02 118.68 111.93 2cuh s LEU 50 Ca 0.61 -0.25 0.01 0.00 -0.22 0.00 0.00 54.13 54.28 2cuh s LEU 50 Cb -0.30 -0.70 0.02 0.00 0.50 0.00 0.00 46.19 45.71 2cuh s LEU 50 CO 0.37 0.09 -0.06 -1.58 -1.32 0.00 0.00 176.35 173.84 2cuh s GLN 51 N 0.19 1.07 0.27 1.98 2.00 -1.26 -2.12 119.66 121.80 2cuh s GLN 51 Ca -0.04 -0.18 -0.10 0.00 -2.00 0.00 0.00 55.36 53.03 2cuh s GLN 51 Cb -0.10 -1.03 -0.00 0.00 0.80 0.00 0.00 33.01 32.68 2cuh s GLN 51 CO 0.01 -0.08 0.47 0.00 -0.50 0.00 0.00 175.29 175.20 2cuh s ALA 52 N 0.95 0.01 0.04 1.58 0.00 -1.17 -5.08 121.76 118.09 2cuh s ALA 52 Ca -0.10 -1.04 -0.11 0.00 0.00 0.00 0.00 51.96 50.70 2cuh s ALA 52 Cb -0.14 1.09 0.01 0.00 0.00 0.00 0.00 23.12 24.07 2cuh s ALA 52 CO 0.00 -0.83 0.24 -2.00 0.00 0.00 0.00 175.76 173.17 2cuh s GLU 53 N -3.75 0.74 0.01 0.00 2.12 -1.26 -3.08 118.70 113.48 2cuh s GLU 53 Ca 0.25 -0.59 -0.13 0.00 0.36 0.00 0.00 54.97 54.85 2cuh s GLU 53 Cb -0.00 0.31 0.02 0.00 0.26 0.00 0.00 34.13 34.72 2cuh s GLU 53 CO 0.11 -0.23 0.27 -0.08 -0.54 0.00 0.00 175.26 174.80 2cuh s THR 54 N -2.61 0.07 0.51 -1.70 -1.32 -1.14 -4.97 115.64 104.47 2cuh s THR 54 Ca -0.05 -0.61 -0.21 0.00 -1.21 0.00 0.00 61.69 59.62 2cuh s THR 54 Cb -0.01 -0.71 -0.06 0.00 -1.51 0.00 0.00 72.50 70.21 2cuh s THR 54 CO -0.04 -0.33 1.14 -2.16 -2.21 0.00 0.00 174.62 171.02 2cuh s PRO 55 N -1.79 3.52 0.44 7.08 0.04 -1.26 -0.12 135.00 142.90 2cuh s PRO 55 Ca -0.11 1.68 0.20 0.00 0.04 0.00 0.00 61.00 62.82 2cuh s PRO 55 Cb -0.04 -2.17 1.16 0.00 0.04 0.00 0.00 34.50 33.49 2cuh s PRO 55 CO 0.01 -0.72 1.85 0.78 0.04 0.00 0.00 177.00 178.95 2cuh h GLY 56 N 1.55 0.77 1.24 0.56 0.00 -0.22 0.18 103.07 107.15 2cuh h GLY 56 Ca -0.50 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 46.68 2cuh h GLY 56 CO 0.58 -0.02 0.34 0.23 0.00 0.00 0.00 176.54 177.67 2cuh h SER 57 N 0.33 0.00 -3.62 0.19 0.87 -1.83 -3.41 113.55 106.08 2cuh h SER 57 Ca 0.48 0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 60.54 2cuh h SER 57 Cb 1.33 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.27 2cuh h SER 57 CO -0.17 0.00 0.05 0.00 -0.53 0.00 0.00 176.83 176.18 2cuh s ALA 58 N -3.78 3.40 -0.03 6.23 0.00 0.64 -4.99 121.76 123.22 2cuh s ALA 58 Ca -0.02 -0.16 0.05 0.00 0.00 0.00 0.00 51.96 51.82 2cuh s ALA 58 Cb 0.06 -2.64 0.07 0.00 0.00 0.00 0.00 23.12 20.61 2cuh s ALA 58 CO 0.20 0.23 0.92 1.33 0.00 0.00 0.00 175.76 178.43 2cuh n VAL 59 N -0.73 0.78 -3.60 0.00 0.24 -1.26 -4.99 118.33 108.77 2cuh n VAL 59 Ca 0.02 -0.88 -0.08 0.00 -2.04 0.00 0.00 64.34 61.36 2cuh n VAL 59 Cb 0.53 0.43 -0.05 0.00 -1.47 0.00 0.00 33.84 33.28 2cuh n VAL 59 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 2cuh s ASP 60 N -1.23 -0.30 -0.22 -1.34 1.47 -1.26 -3.77 116.67 110.01 2cuh s ASP 60 Ca 0.08 0.39 -0.04 0.00 1.18 0.00 0.00 52.55 54.16 2cuh s ASP 60 Cb 0.07 0.33 0.08 0.00 -0.34 0.00 0.00 42.92 43.05 2cuh s ASP 60 CO 0.01 -0.24 0.10 -0.47 0.68 0.00 0.00 175.17 175.24 2cuh s TYR 61 N -0.83 0.45 0.19 2.11 6.14 -1.23 -4.98 117.35 119.20 2cuh s TYR 61 Ca 0.01 -0.67 -0.30 0.00 0.64 0.00 0.00 57.07 56.75 2cuh s TYR 61 Cb -0.01 -0.87 -0.09 0.00 0.42 0.00 0.00 41.96 41.41 2cuh s TYR 61 CO -0.02 -0.65 1.31 -1.25 0.64 0.00 0.00 175.55 175.57 2cuh s PRO 62 N 2.05 4.39 -0.12 4.97 0.04 -1.26 -2.79 135.00 142.28 2cuh s PRO 62 Ca 0.04 2.04 -0.04 0.00 0.04 0.00 0.00 61.00 63.08 2cuh s PRO 62 Cb -0.16 -3.20 -0.04 0.00 0.04 0.00 0.00 34.50 31.14 2cuh s PRO 62 CO -0.19 -0.25 0.04 -0.51 0.04 0.00 0.00 177.00 176.13 2cuh s LEU 63 N -0.06 3.77 0.48 -3.56 1.43 -0.94 -4.98 118.68 114.82 2cuh s LEU 63 Ca 0.57 0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.86 2cuh s LEU 63 Cb -0.36 -1.90 -0.02 0.00 0.03 0.00 0.00 46.19 43.93 2cuh s LEU 63 CO 0.38 0.32 0.03 -1.38 0.23 0.00 0.00 176.35 175.92 2cuh s HIS 64 N -0.52 1.93 -1.12 0.29 -3.43 -1.26 -4.34 115.29 106.84 2cuh s HIS 64 Ca 0.10 -0.98 -0.06 0.00 -0.80 0.00 0.00 55.06 53.31 2cuh s HIS 64 Cb -0.12 -1.54 0.01 0.00 -1.43 0.00 0.00 32.58 29.50 2cuh s HIS 64 CO 0.02 0.15 0.97 -0.25 -2.00 0.00 0.00 174.74 173.64 2cuh n ASP 65 N -1.22 -5.17 -4.57 7.38 9.92 -1.26 -5.01 116.55 116.63 2cuh n ASP 65 Ca -0.15 -0.46 -0.34 0.00 -0.53 0.00 0.00 54.79 53.31 2cuh n ASP 65 Cb 0.67 -4.31 -0.11 0.00 -0.64 0.00 0.00 41.12 36.72 2cuh n ASP 65 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2cuh s LEU 66 N -6.20 3.21 -0.27 0.64 1.02 -1.26 -4.99 118.68 110.83 2cuh s LEU 66 Ca 0.42 -0.04 -0.29 0.00 0.02 0.00 0.00 54.13 54.24 2cuh s LEU 66 Cb -0.19 -1.72 0.01 0.00 0.02 0.00 0.00 46.19 44.31 2cuh s LEU 66 CO 0.61 0.31 1.14 -0.69 0.02 0.00 0.00 176.35 177.75 2cuh s VAL 67 N -0.52 4.44 0.00 -1.59 1.01 -1.26 -4.96 120.40 117.52 2cuh s VAL 67 Ca 0.08 1.69 0.00 0.00 0.00 0.00 0.00 61.98 63.75 2cuh s VAL 67 Cb -0.12 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 31.99 2cuh s VAL 67 CO 0.02 -0.35 0.55 0.18 0.00 0.00 0.00 175.10 175.50 2cuh n LEU 68 N 6.84 0.00 -3.68 3.92 7.99 -1.26 -1.62 117.00 129.19 2cuh n LEU 68 Ca 0.13 0.55 -0.42 0.00 -0.01 0.00 0.00 56.01 56.26 2cuh n LEU 68 Cb 0.46 -0.19 -0.02 0.00 -0.11 0.00 0.00 43.42 43.57 2cuh n LEU 68 CO 0.58 -0.19 2.49 1.41 -1.51 0.00 0.00 177.39 180.18 2cuh n HIS 69 N -1.82 2.89 -3.64 -1.77 8.25 -1.26 -2.75 115.22 115.13 2cuh n HIS 69 Ca 0.00 -2.55 -0.09 0.00 -0.26 0.00 0.00 57.72 54.82 2cuh n HIS 69 Cb 0.00 -2.24 -0.07 0.00 1.12 0.00 0.00 29.99 28.80 2cuh n HIS 69 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2cuh s THR 70 N 3.83 0.00 -0.11 1.59 2.01 -0.64 -5.08 115.64 117.24 2cuh s THR 70 Ca 0.51 0.00 -0.25 0.00 0.31 0.00 0.00 61.69 62.26 2cuh s THR 70 Cb 0.14 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.63 2cuh s THR 70 CO -0.01 0.00 0.78 0.21 -0.69 0.00 0.00 174.62 174.90 2cuh s ASN 71 N 0.87 7.00 -0.14 3.53 3.84 -1.26 -3.91 114.94 124.87 2cuh s ASN 71 Ca -0.04 1.21 0.02 0.00 0.21 0.00 0.00 52.86 54.27 2cuh s ASN 71 Cb -0.05 -2.44 0.01 0.00 -0.55 0.00 0.00 41.25 38.22 2cuh s ASN 71 CO -0.10 -0.25 -0.21 -0.31 -2.79 0.00 0.00 177.10 173.45 2cuh s TYR 72 N 1.40 2.68 -0.28 0.43 1.51 -1.25 -4.66 117.35 117.18 2cuh s TYR 72 Ca 0.39 -1.25 -0.09 0.00 -1.01 0.00 0.00 57.07 55.11 2cuh s TYR 72 Cb -0.18 -1.82 -0.03 0.00 -0.11 0.00 0.00 41.96 39.82 2cuh s TYR 72 CO 0.17 -0.56 0.14 0.99 -1.11 0.00 0.00 175.55 175.17 2cuh s THR 73 N 0.76 4.77 -0.05 -0.71 2.01 -0.86 -3.78 115.64 117.78 2cuh s THR 73 Ca -0.08 -0.10 -0.01 0.00 0.31 0.00 0.00 61.69 61.81 2cuh s THR 73 Cb -0.16 -3.30 -0.04 0.00 0.01 0.00 0.00 72.50 69.02 2cuh s THR 73 CO -0.00 0.24 0.02 0.00 -0.69 0.00 0.00 174.62 174.18 2cuh s ALA 74 N 1.67 3.36 -0.25 7.40 0.00 -1.22 -2.39 121.76 130.34 2cuh s ALA 74 Ca 0.06 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.18 2cuh s ALA 74 Cb -0.16 -1.47 0.06 0.00 0.00 0.00 0.00 23.12 21.55 2cuh s ALA 74 CO 0.07 0.63 -0.06 0.99 0.00 0.00 0.00 175.76 177.39 2cuh s THR 75 N -1.01 1.69 -0.06 0.00 2.01 -0.48 -2.92 115.64 114.86 2cuh s THR 75 Ca 0.17 -1.37 -0.11 0.00 0.31 0.00 0.00 61.69 60.69 2cuh s THR 75 Cb -0.12 -1.94 -0.05 0.00 0.01 0.00 0.00 72.50 70.41 2cuh s THR 75 CO 0.07 -0.13 0.28 -0.69 -0.69 0.00 0.00 174.62 173.47 2cuh s VAL 76 N 1.31 5.25 0.03 3.82 1.01 0.29 -2.20 120.40 129.91 2cuh s VAL 76 Ca -0.05 0.55 -0.00 0.00 0.00 0.00 0.00 61.98 62.47 2cuh s VAL 76 Cb -0.19 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.59 2cuh s VAL 76 CO -0.07 0.59 -0.03 -0.13 0.00 0.00 0.00 175.10 175.47 2cuh s ARG 77 N -0.98 0.40 -0.23 2.72 0.52 -0.53 -0.17 118.95 120.68 2cuh s ARG 77 Ca 0.19 -0.77 -0.06 0.00 -0.52 0.00 0.00 55.73 54.57 2cuh s ARG 77 Cb -0.14 0.14 -0.03 0.00 0.52 0.00 0.00 34.95 35.44 2cuh s ARG 77 CO 0.09 -0.07 0.04 0.20 0.02 0.00 0.00 175.30 175.58 2cuh s GLY 78 N -1.86 1.74 -0.55 -3.53 0.00 -1.26 -0.62 107.32 101.23 2cuh s GLY 78 Ca -0.10 -1.08 -0.23 0.00 0.00 0.00 0.00 44.72 43.31 2cuh s GLY 78 CO -0.03 0.42 0.89 1.08 0.00 0.00 0.00 173.10 175.46 2cuh s LEU 79 N 1.39 4.27 -0.42 0.66 2.01 -0.46 -1.77 118.68 124.36 2cuh s LEU 79 Ca 0.05 -0.50 0.03 0.00 0.01 0.00 0.00 54.13 53.72 2cuh s LEU 79 Cb -0.15 -2.73 0.12 0.00 0.01 0.00 0.00 46.19 43.44 2cuh s LEU 79 CO 0.02 -1.19 0.15 -0.13 1.01 0.00 0.00 176.35 176.22 2cuh s ARG 80 N 3.73 1.59 3.69 1.70 1.81 -1.18 -2.79 118.95 127.50 2cuh s ARG 80 Ca 0.27 -2.11 0.00 0.00 -1.72 0.00 0.00 55.73 52.17 2cuh s ARG 80 Cb -0.14 -3.06 0.00 0.00 -0.45 0.00 0.00 34.95 31.30 2cuh s ARG 80 CO 0.17 -1.03 0.00 0.41 -0.68 0.00 0.00 175.30 174.17 2cuh n GLY 81 N 3.79 0.88 0.00 -3.53 0.00 -1.26 -2.40 105.19 102.67 2cuh n GLY 81 Ca 0.04 -0.69 0.05 0.00 0.00 0.00 0.00 46.02 45.42 2cuh n GLY 81 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cuh n PRO 82 N 0.00 0.49 -4.52 1.61 -0.04 -1.26 -4.74 135.00 126.54 2cuh n PRO 82 Ca 0.00 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.16 2cuh n PRO 82 Cb 0.00 -1.31 -0.07 0.00 -0.04 0.00 0.00 33.50 32.08 2cuh n PRO 82 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2cuh s ASN 83 N -1.82 4.21 0.19 3.54 0.01 -1.01 -5.16 114.94 114.91 2cuh s ASN 83 Ca 0.15 -1.48 0.06 0.00 -0.71 0.00 0.00 52.86 50.87 2cuh s ASN 83 Cb 0.07 0.27 -0.05 0.00 0.41 0.00 0.00 41.25 41.95 2cuh s ASN 83 CO 0.11 -0.81 -0.11 -0.76 -1.51 0.00 0.00 177.10 174.03 2cuh s LEU 84 N -3.93 2.51 0.52 0.60 1.43 -1.26 -3.13 118.68 115.42 2cuh s LEU 84 Ca 0.19 -1.05 0.08 0.00 -1.03 0.00 0.00 54.13 52.32 2cuh s LEU 84 Cb 0.02 -0.52 0.05 0.00 0.03 0.00 0.00 46.19 45.78 2cuh s LEU 84 CO 0.10 -0.27 0.63 0.42 0.23 0.00 0.00 176.35 177.46 2cuh s THR 85 N -3.14 2.27 -0.00 5.49 -4.23 -0.73 -4.92 115.64 110.37 2cuh s THR 85 Ca 0.21 -1.13 -0.30 0.00 -1.18 0.00 0.00 61.69 59.29 2cuh s THR 85 Cb 0.01 -2.40 -0.06 0.00 1.34 0.00 0.00 72.50 71.39 2cuh s THR 85 CO 0.05 0.00 1.52 -0.44 -0.54 0.00 0.00 174.62 175.21 2cuh s SER 86 N -4.47 6.74 0.41 3.99 0.01 -1.26 -4.58 113.70 114.55 2cuh s SER 86 Ca 0.54 2.22 -0.25 0.00 1.31 0.00 0.00 55.95 59.77 2cuh s SER 86 Cb -0.06 -2.55 -0.08 0.00 0.21 0.00 0.00 66.02 63.54 2cuh s SER 86 CO 0.33 -0.82 1.18 -2.16 0.41 0.00 0.00 173.24 172.19 2cuh s PRO 87 N 2.92 3.98 -0.16 12.44 0.04 -1.26 -4.46 135.00 148.49 2cuh s PRO 87 Ca 0.68 1.86 0.00 0.00 0.04 0.00 0.00 61.00 63.58 2cuh s PRO 87 Cb -0.34 -2.63 0.04 0.00 0.04 0.00 0.00 34.50 31.61 2cuh s PRO 87 CO 0.28 -0.39 -0.09 0.00 0.04 0.00 0.00 177.00 176.85 2cuh s ALA 88 N -1.42 1.67 0.25 8.56 0.00 0.76 -4.96 121.76 126.61 2cuh s ALA 88 Ca 0.58 -0.90 0.11 0.00 0.00 0.00 0.00 51.96 51.75 2cuh s ALA 88 Cb -0.31 -1.12 -0.05 0.00 0.00 0.00 0.00 23.12 21.65 2cuh s ALA 88 CO 0.39 -0.66 -0.15 0.45 0.00 0.00 0.00 175.76 175.80 2cuh s SER 89 N 1.55 3.89 0.00 0.00 0.15 -1.26 -0.55 113.70 117.48 2cuh s SER 89 Ca 0.02 -0.84 -0.27 0.00 0.70 0.00 0.00 55.95 55.55 2cuh s SER 89 Cb -0.15 -0.48 0.06 0.00 -1.71 0.00 0.00 66.02 63.75 2cuh s SER 89 CO -0.08 0.05 0.62 -0.51 1.20 0.00 0.00 173.24 174.52 2cuh s ILE 90 N -2.20 0.01 -0.26 6.45 2.07 -1.15 -4.97 121.20 121.16 2cuh s ILE 90 Ca 0.28 -0.07 -0.06 0.00 -1.41 0.00 0.00 60.65 59.40 2cuh s ILE 90 Cb -0.06 -0.98 -0.00 0.00 0.13 0.00 0.00 42.46 41.55 2cuh s ILE 90 CO 0.15 -0.04 0.03 0.42 -1.91 0.00 0.00 174.94 173.60 2cuh s THR 91 N -1.84 3.79 -0.08 4.00 -4.23 -1.26 -3.38 115.64 112.63 2cuh s THR 91 Ca -0.08 -0.52 0.00 0.00 -1.18 0.00 0.00 61.69 59.91 2cuh s THR 91 Cb -0.01 -2.84 0.02 0.00 1.34 0.00 0.00 72.50 71.02 2cuh s THR 91 CO 0.04 0.26 -0.07 0.72 -0.54 0.00 0.00 174.62 175.02 2cuh s PHE 92 N 1.51 1.26 0.25 3.99 -0.71 -1.25 -5.01 117.98 118.02 2cuh s PHE 92 Ca 0.04 -0.53 -0.30 0.00 -1.04 0.00 0.00 56.93 55.11 2cuh s PHE 92 Cb -0.16 -1.05 -0.09 0.00 -1.21 0.00 0.00 43.02 40.52 2cuh s PHE 92 CO 0.00 -0.37 0.95 0.99 -1.34 0.00 0.00 175.22 175.45 2cuh s THR 93 N 1.32 4.04 -0.37 -4.49 2.01 -1.26 -3.97 115.64 112.91 2cuh s THR 93 Ca -0.03 2.04 0.07 0.00 0.31 0.00 0.00 61.69 64.07 2cuh s THR 93 Cb -0.14 -4.29 0.64 0.00 0.01 0.00 0.00 72.50 68.72 2cuh s THR 93 CO -0.03 0.47 1.73 0.35 -0.69 0.00 0.00 174.62 176.45 2cuh n THR 94 N 1.42 2.75 -2.26 -0.82 -2.24 -1.21 -4.17 114.28 107.75 2cuh n THR 94 Ca -0.02 -1.52 -0.03 0.00 -2.27 0.00 0.00 64.05 60.22 2cuh n THR 94 Cb 0.47 -0.45 -0.02 0.00 -2.10 0.00 0.00 70.33 68.23 2cuh n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cuh n GLY 95 N -0.40 0.86 2.10 3.38 0.00 -1.11 -4.20 105.19 105.81 2cuh n GLY 95 Ca 0.42 -0.36 -0.16 0.00 0.00 0.00 0.00 46.02 45.92 2cuh n GLY 95 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2cuh n LEU 96 N 0.02 5.57 0.26 0.99 7.94 -1.26 -4.45 117.00 126.08 2cuh n LEU 96 Ca -0.14 -3.24 0.14 0.00 -1.11 0.00 0.00 56.01 51.66 2cuh n LEU 96 Cb 0.87 -1.36 0.69 0.00 0.53 0.00 0.00 43.42 44.15 2cuh n LEU 96 CO -0.10 1.62 0.95 -0.33 -1.11 0.00 0.00 177.39 178.43 2cuh h GLU 97 N 3.59 0.00 -5.72 1.96 5.08 -1.96 -3.44 114.58 114.10 2cuh h GLU 97 Ca 0.31 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 58.13 2cuh h GLU 97 Cb 1.19 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.30 2cuh h GLU 97 CO 0.55 0.10 -0.69 0.00 -1.00 0.00 0.00 179.01 177.97 2cuh s ALA 98 N -3.87 2.55 1.10 3.43 0.00 -1.26 -5.13 121.76 118.57 2cuh s ALA 98 Ca -0.01 -1.94 -0.08 0.00 0.00 0.00 0.00 51.96 49.93 2cuh s ALA 98 Cb 0.11 0.05 0.12 0.00 0.00 0.00 0.00 23.12 23.40 2cuh s ALA 98 CO 0.57 0.02 0.42 -0.35 0.00 0.00 0.00 175.76 176.42 2cuh n PRO 99 N -0.64 -1.83 -0.27 0.00 -0.04 -1.26 -4.82 135.00 126.14 2cuh n PRO 99 Ca -0.05 -0.66 0.25 0.00 -0.04 0.00 0.00 63.50 62.99 2cuh n PRO 99 Cb 0.63 -0.62 0.46 0.00 -0.04 0.00 0.00 33.50 33.93 2cuh n PRO 99 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2cuh n ARG 100 N -2.78 -0.05 -3.04 0.54 1.85 -1.26 -3.04 116.66 108.88 2cuh n ARG 100 Ca 0.06 1.17 -0.44 0.00 -1.00 0.00 0.00 57.85 57.63 2cuh n ARG 100 Cb 0.22 -2.07 -0.03 0.00 -1.05 0.00 0.00 32.46 29.53 2cuh n ARG 100 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 2cuh s ASP 101 N -4.65 6.42 0.05 2.89 -1.08 -1.26 -4.84 116.67 114.20 2cuh s ASP 101 Ca -0.08 -1.76 0.10 0.00 -0.52 0.00 0.00 52.55 50.28 2cuh s ASP 101 Cb 0.28 -2.34 -0.22 0.00 -1.46 0.00 0.00 42.92 39.18 2cuh s ASP 101 CO 0.65 -1.07 1.00 -0.07 0.52 0.00 0.00 175.17 176.21 2cuh h LEU 102 N 10.02 0.00 -7.56 -1.34 3.38 -1.86 -3.43 115.31 114.53 2cuh h LEU 102 Ca -0.08 -0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.26 2cuh h LEU 102 Cb 1.06 -0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.41 2cuh h LEU 102 CO 1.07 1.00 -0.75 -1.61 0.09 0.00 0.00 178.44 178.24 2cuh s GLU 103 N -2.66 1.38 0.22 1.13 0.41 -1.26 -5.01 118.70 112.91 2cuh s GLU 103 Ca -0.02 -1.46 0.05 0.00 -0.41 0.00 0.00 54.97 53.14 2cuh s GLU 103 Cb 0.09 -2.76 -0.02 0.00 -1.78 0.00 0.00 34.13 29.67 2cuh s GLU 103 CO 0.82 -0.85 0.18 0.00 -0.49 0.00 0.00 175.26 174.92 2cuh n ALA 104 N 4.50 0.47 -2.65 5.21 0.00 -1.26 -5.17 120.51 121.61 2cuh n ALA 104 Ca -0.02 -1.28 -0.29 0.00 0.00 0.00 0.00 53.44 51.84 2cuh n ALA 104 Cb 0.42 1.03 -0.09 0.00 0.00 0.00 0.00 19.45 20.82 2cuh n ALA 104 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2cuh s LYS 105 N -2.89 2.38 0.21 0.00 -2.85 -1.26 -5.14 119.74 110.19 2cuh s LYS 105 Ca 0.26 -0.95 0.08 0.00 -1.00 0.00 0.00 55.97 54.36 2cuh s LYS 105 Cb 0.01 -2.43 -0.05 0.00 -2.06 0.00 0.00 37.83 33.31 2cuh s LYS 105 CO 0.18 0.51 -0.14 -1.21 0.10 0.00 0.00 175.35 174.80 2cuh s GLU 106 N -2.39 1.35 -0.23 1.78 0.41 -1.26 -5.15 118.70 113.21 2cuh s GLU 106 Ca 0.25 -1.61 -0.07 0.00 -0.41 0.00 0.00 54.97 53.13 2cuh s GLU 106 Cb -0.11 -1.13 0.11 0.00 -1.78 0.00 0.00 34.13 31.22 2cuh s GLU 106 CO 0.17 0.17 0.49 0.08 -0.49 0.00 0.00 175.26 175.68 2cuh s VAL 107 N -2.97 -0.76 -0.20 2.63 1.01 -1.26 -5.14 120.40 113.70 2cuh s VAL 107 Ca 0.23 0.09 -0.05 0.00 0.00 0.00 0.00 61.98 62.26 2cuh s VAL 107 Cb -0.00 -0.78 -0.02 0.00 0.00 0.00 0.00 36.38 35.57 2cuh s VAL 107 CO 0.07 0.03 0.00 -0.89 0.00 0.00 0.00 175.10 174.32 2cuh s THR 108 N 2.70 3.97 0.96 3.92 2.01 -1.26 -5.11 115.64 122.83 2cuh s THR 108 Ca -0.00 -0.31 -0.16 0.00 0.31 0.00 0.00 61.69 61.53 2cuh s THR 108 Cb -0.12 -2.80 0.24 0.00 0.01 0.00 0.00 72.50 69.83 2cuh s THR 108 CO -0.15 0.42 0.85 -0.81 -0.69 0.00 0.00 174.62 174.24 2cuh n PRO 109 N 4.28 -2.69 -3.59 4.92 -0.04 -1.26 -5.10 135.00 131.53 2cuh n PRO 109 Ca -0.17 -1.36 -0.15 0.00 -0.04 0.00 0.00 63.50 61.78 2cuh n PRO 109 Cb 0.52 -1.28 -0.07 0.00 -0.04 0.00 0.00 33.50 32.63 2cuh n PRO 109 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2cuh s SER 110 N -3.80 -0.66 0.00 3.54 1.04 -1.26 -5.12 113.70 107.43 2cuh s SER 110 Ca 0.55 1.06 0.00 0.00 0.48 0.00 0.00 55.95 58.04 2cuh s SER 110 Cb -0.05 0.99 0.00 0.00 0.10 0.00 0.00 66.02 67.06 2cuh s SER 110 CO 0.42 -0.38 0.00 0.61 0.98 0.00 0.00 173.24 174.87 2cuh n GLY 111 N 1.85 -1.72 3.63 7.32 0.00 -1.26 -5.18 105.19 109.84 2cuh n GLY 111 Ca -0.15 0.92 -0.29 0.00 0.00 0.00 0.00 46.02 46.49 2cuh n GLY 111 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cuh s PRO 112 N 0.00 -0.53 -0.18 1.61 0.04 -1.26 -5.09 135.00 129.59 2cuh s PRO 112 Ca 0.00 0.18 -0.31 0.00 0.04 0.00 0.00 61.00 60.91 2cuh s PRO 112 Cb 0.00 -1.66 0.14 0.00 0.04 0.00 0.00 34.50 33.03 2cuh s PRO 112 CO 0.00 -3.30 1.11 0.45 0.04 0.00 0.00 177.00 175.30 2cuh s SER 113 N -3.70 -0.25 -0.22 6.66 0.15 -1.26 -5.19 113.70 109.90 2cuh s SER 113 Ca 0.68 0.19 -0.29 0.00 0.70 0.00 0.00 55.95 57.23 2cuh s SER 113 Cb -0.14 0.22 0.16 0.00 -1.71 0.00 0.00 66.02 64.55 2cuh s SER 113 CO 0.57 -0.28 1.16 -0.94 1.20 0.00 0.00 173.24 174.95 2cuh s SER 114 N -1.45 -0.22 0.00 5.45 1.04 -1.26 -5.38 113.70 111.88 2cuh s SER 114 Ca 0.04 0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.72 2cuh s SER 114 Cb -0.01 0.19 0.00 0.00 0.10 0.00 0.00 66.02 66.31 2cuh s SER 114 CO -0.03 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.60