#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cuh s SER 2 N 0.00 4.46 0.03 1.61 0.01 -1.26 -4.99 113.70 113.56 2cuh s SER 2 Ca 0.00 1.07 -0.24 0.00 1.31 0.00 0.00 55.95 58.09 2cuh s SER 2 Cb 0.00 -1.73 -0.16 0.00 0.21 0.00 0.00 66.02 64.34 2cuh s SER 2 CO 0.00 -1.96 1.48 0.28 0.41 0.00 0.00 173.24 173.44 2cuh h SER 3 N -1.09 0.07 0.00 2.44 0.02 -2.11 -3.49 113.55 109.39 2cuh h SER 3 Ca -0.47 -0.29 0.00 0.00 -0.84 0.00 0.00 61.79 60.19 2cuh h SER 3 Cb 1.29 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.82 2cuh h SER 3 CO 0.62 0.34 0.00 0.61 -1.14 0.00 0.00 176.83 177.26 2cuh n GLY 4 N -0.33 -0.19 3.67 -3.77 0.00 -1.26 -5.14 105.19 98.17 2cuh n GLY 4 Ca -0.07 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.42 2cuh n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cuh s SER 5 N -4.00 3.69 -0.36 1.61 1.04 -1.26 -5.03 113.70 109.39 2cuh s SER 5 Ca 0.00 -1.59 -0.01 0.00 0.48 0.00 0.00 55.95 54.82 2cuh s SER 5 Cb 0.00 0.33 0.21 0.00 0.10 0.00 0.00 66.02 66.66 2cuh s SER 5 CO 0.00 -0.79 2.12 -0.24 0.98 0.00 0.00 173.24 175.31 2cuh n SER 6 N -1.19 6.56 0.00 7.02 2.88 -1.26 -4.71 113.62 122.92 2cuh n SER 6 Ca -0.13 -3.13 0.00 0.00 -1.33 0.00 0.00 58.87 54.28 2cuh n SER 6 Cb 0.67 -1.08 0.00 0.00 -0.75 0.00 0.00 64.21 63.05 2cuh n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cuh n GLY 7 N 0.34 0.89 0.00 0.46 0.00 -1.26 -5.14 105.19 100.47 2cuh n GLY 7 Ca 0.35 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.71 2cuh n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cuh n PRO 8 N 0.00 0.08 0.00 1.61 -0.04 -1.26 -5.02 135.00 130.37 2cuh n PRO 8 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2cuh n PRO 8 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2cuh n PRO 8 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2cuh n ASP 9 N -1.37 3.59 -2.04 3.54 8.00 -1.26 -4.86 116.55 122.16 2cuh n ASP 9 Ca 0.00 -0.13 -0.00 0.00 0.71 0.00 0.00 54.79 55.37 2cuh n ASP 9 Cb 0.00 0.97 0.00 0.00 -0.02 0.00 0.00 41.12 42.07 2cuh n ASP 9 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2cuh n GLY 10 N 2.05 1.54 3.76 0.44 0.00 -1.26 -4.75 105.19 106.96 2cuh n GLY 10 Ca 0.00 -2.07 -0.41 0.00 0.00 0.00 0.00 46.02 43.54 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 -2.16 4.44 0.15 1.61 0.04 -1.26 -4.55 135.00 133.26 2cuh s PRO 11 Ca 0.01 2.05 0.01 0.00 0.04 0.00 0.00 61.00 63.11 2cuh s PRO 11 Cb -0.00 -3.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.35 2cuh s PRO 11 CO 0.01 -0.10 -0.01 0.95 0.04 0.00 0.00 177.00 177.89 2cuh s THR 12 N -0.71 0.59 -1.42 1.26 -4.23 -1.24 -4.56 115.64 105.33 2cuh s THR 12 Ca 0.50 -1.96 -0.06 0.00 -1.18 0.00 0.00 61.69 59.00 2cuh s THR 12 Cb -0.37 -2.01 0.01 0.00 1.34 0.00 0.00 72.50 71.47 2cuh s THR 12 CO 0.45 -0.57 0.74 0.00 -0.54 0.00 0.00 174.62 174.70 2cuh n GLN 13 N -0.17 -5.52 -1.62 3.99 1.13 -1.26 -2.58 117.38 111.35 2cuh n GLN 13 Ca -0.08 0.84 -0.43 0.00 -1.94 0.00 0.00 57.00 55.39 2cuh n GLN 13 Cb 0.63 -5.64 -0.03 0.00 0.11 0.00 0.00 30.24 25.31 2cuh n GLN 13 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 2cuh s LEU 14 N -6.51 3.43 0.17 1.08 2.96 -1.26 -4.68 118.68 113.87 2cuh s LEU 14 Ca 0.37 1.84 0.11 0.00 -0.22 0.00 0.00 54.13 56.22 2cuh s LEU 14 Cb -0.16 -3.48 -0.04 0.00 0.50 0.00 0.00 46.19 43.01 2cuh s LEU 14 CO 0.45 -2.00 -0.21 -0.60 -1.32 0.00 0.00 176.35 172.67 2cuh s ARG 15 N 6.42 1.62 -0.35 1.98 3.52 -0.70 -4.93 118.95 126.51 2cuh s ARG 15 Ca 1.00 -1.39 -0.12 0.00 -0.13 0.00 0.00 55.73 55.09 2cuh s ARG 15 Cb -0.32 -1.95 0.01 0.00 -1.56 0.00 0.00 34.95 31.12 2cuh s ARG 15 CO 0.35 0.43 0.21 0.00 -0.81 0.00 0.00 175.30 175.48 2cuh s ALA 16 N -1.46 3.36 0.99 6.12 0.00 -1.26 -3.18 121.76 126.33 2cuh s ALA 16 Ca 0.20 -1.54 -0.13 0.00 0.00 0.00 0.00 51.96 50.48 2cuh s ALA 16 Cb -0.09 -2.59 0.18 0.00 0.00 0.00 0.00 23.12 20.62 2cuh s ALA 16 CO 0.10 -1.15 1.12 -0.48 0.00 0.00 0.00 175.76 175.34 2cuh s LEU 17 N 1.63 1.66 -0.22 0.00 0.05 -1.26 -4.94 118.68 115.60 2cuh s LEU 17 Ca 0.04 1.01 -0.29 0.00 0.05 0.00 0.00 54.13 54.94 2cuh s LEU 17 Cb -0.18 -3.19 -0.02 0.00 -2.05 0.00 0.00 46.19 40.75 2cuh s LEU 17 CO 0.08 -3.02 1.54 0.54 -0.55 0.00 0.00 176.35 174.93 2cuh s ASN 18 N -3.76 6.49 -0.22 1.48 2.20 -1.26 -4.91 114.94 114.97 2cuh s ASN 18 Ca 0.66 1.60 -0.29 0.00 -0.94 0.00 0.00 52.86 53.89 2cuh s ASN 18 Cb -0.16 -2.53 -0.03 0.00 -2.00 0.00 0.00 41.25 36.53 2cuh s ASN 18 CO 0.56 -1.16 1.74 -0.76 -2.94 0.00 0.00 177.10 174.53 2cuh s LEU 19 N 4.84 3.81 0.00 3.54 1.43 -1.26 -4.93 118.68 126.11 2cuh s LEU 19 Ca 0.68 1.67 0.00 0.00 -1.03 0.00 0.00 54.13 55.44 2cuh s LEU 19 Cb -0.24 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.45 2cuh s LEU 19 CO 0.27 -1.40 0.73 1.07 0.23 0.00 0.00 176.35 177.24 2cuh n THR 20 N 6.68 0.00 -3.60 5.49 5.66 -1.26 -4.32 114.28 122.93 2cuh n THR 20 Ca 0.21 1.23 -0.38 0.00 -3.05 0.00 0.00 64.05 62.05 2cuh n THR 20 Cb 0.45 -2.22 -0.06 0.00 -1.55 0.00 0.00 70.33 66.95 2cuh n THR 20 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 2cuh s GLU 21 N -1.90 3.23 -0.27 1.09 2.12 -1.26 -4.78 118.70 116.93 2cuh s GLU 21 Ca 0.00 -3.01 -0.03 0.00 0.36 0.00 0.00 54.97 52.28 2cuh s GLU 21 Cb 0.00 -4.01 0.03 0.00 0.26 0.00 0.00 34.13 30.41 2cuh s GLU 21 CO 0.00 -1.24 0.08 0.41 -0.54 0.00 0.00 175.26 173.97 2cuh n GLY 22 N 2.81 -0.38 3.27 -1.50 0.00 -1.26 -4.83 105.19 103.30 2cuh n GLY 22 Ca 0.18 0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.78 3.30 -0.07 1.61 5.36 -1.26 -4.55 117.98 120.58 2cuh s PHE 23 Ca 0.12 -1.46 -0.26 0.00 -0.96 0.00 0.00 56.93 54.37 2cuh s PHE 23 Cb -0.07 -2.53 -0.03 0.00 -0.34 0.00 0.00 43.02 40.05 2cuh s PHE 23 CO 0.14 -0.77 0.81 0.00 -1.46 0.00 0.00 175.22 173.94 2cuh s ALA 24 N 1.41 3.32 0.09 11.12 0.00 -1.26 -4.43 121.76 132.01 2cuh s ALA 24 Ca 0.00 0.23 0.02 0.00 0.00 0.00 0.00 51.96 52.22 2cuh s ALA 24 Cb -0.21 -3.12 -0.04 0.00 0.00 0.00 0.00 23.12 19.76 2cuh s ALA 24 CO 0.03 -0.25 -0.08 0.14 0.00 0.00 0.00 175.76 175.60 2cuh s VAL 25 N 1.14 0.74 0.12 0.00 -7.23 -1.26 -1.10 120.40 112.82 2cuh s VAL 25 Ca 0.42 -1.75 0.01 0.00 -1.81 0.00 0.00 61.98 58.85 2cuh s VAL 25 Cb -0.18 -1.46 -0.04 0.00 0.56 0.00 0.00 36.38 35.26 2cuh s VAL 25 CO 0.20 -0.73 0.27 -0.76 -0.31 0.00 0.00 175.10 173.77 2cuh s LEU 26 N -2.71 4.33 -0.07 1.32 1.43 -0.95 -4.55 118.68 117.48 2cuh s LEU 26 Ca 0.07 0.24 -0.03 0.00 -1.03 0.00 0.00 54.13 53.38 2cuh s LEU 26 Cb 0.01 -2.96 0.04 0.00 0.03 0.00 0.00 46.19 43.31 2cuh s LEU 26 CO -0.03 0.08 0.10 -2.28 0.23 0.00 0.00 176.35 174.45 2cuh s HIS 27 N -1.67 -0.00 0.12 0.29 2.46 -1.19 -2.94 115.29 112.35 2cuh s HIS 27 Ca 0.35 0.30 0.06 0.00 0.47 0.00 0.00 55.06 56.24 2cuh s HIS 27 Cb -0.12 -0.44 -0.04 0.00 -0.13 0.00 0.00 32.58 31.86 2cuh s HIS 27 CO 0.28 -0.26 -0.14 1.67 -2.47 0.00 0.00 174.74 173.82 2cuh s TRP 28 N 2.21 1.38 -0.18 3.88 -2.14 -1.25 -1.72 118.94 121.11 2cuh s TRP 28 Ca 0.04 -0.55 -0.15 0.00 2.66 0.00 0.00 56.10 58.11 2cuh s TRP 28 Cb -0.13 -0.73 -0.04 0.00 -3.10 0.00 0.00 33.47 29.47 2cuh s TRP 28 CO -0.05 0.13 0.35 0.21 -2.66 0.00 0.00 176.95 174.93 2cuh s LYS 29 N -2.57 4.21 -0.07 3.25 2.20 -1.07 -4.83 119.74 120.87 2cuh s LYS 29 Ca 0.08 0.15 -0.30 0.00 -0.36 0.00 0.00 55.97 55.53 2cuh s LYS 29 Cb -0.05 -3.49 -0.05 0.00 -1.51 0.00 0.00 37.83 32.73 2cuh s LYS 29 CO 0.03 0.09 1.50 -1.25 -0.36 0.00 0.00 175.35 175.36 2cuh s PRO 30 N 0.92 4.21 1.01 4.03 0.04 -1.26 -3.70 135.00 140.26 2cuh s PRO 30 Ca 0.18 2.02 -0.13 0.00 0.04 0.00 0.00 61.00 63.11 2cuh s PRO 30 Cb -0.14 -3.83 0.20 0.00 0.04 0.00 0.00 34.50 30.76 2cuh s PRO 30 CO 0.06 -0.75 1.09 -1.25 0.04 0.00 0.00 177.00 176.19 2cuh s PRO 31 N 3.53 0.30 0.19 0.56 0.04 -1.26 -4.88 135.00 133.46 2cuh s PRO 31 Ca 0.67 0.48 -0.09 0.00 0.04 0.00 0.00 61.00 62.10 2cuh s PRO 31 Cb -0.30 -1.72 0.27 0.00 0.04 0.00 0.00 34.50 32.78 2cuh s PRO 31 CO 0.25 -2.81 1.14 0.94 0.04 0.00 0.00 177.00 176.55 2cuh n GLN 32 N -4.23 -0.11 -3.87 4.56 7.27 -1.26 -3.78 117.38 115.96 2cuh n GLN 32 Ca 0.05 1.13 -0.36 0.00 0.07 0.00 0.00 57.00 57.89 2cuh n GLN 32 Cb 0.57 -1.69 -0.13 0.00 2.41 0.00 0.00 30.24 31.41 2cuh n GLN 32 CO 0.00 0.00 0.00 1.21 0.07 0.00 0.00 177.06 178.34 2cuh s ASN 33 N -5.22 4.80 -0.16 1.69 2.47 -1.26 -5.07 114.94 112.18 2cuh s ASN 33 Ca -0.11 -0.27 -0.29 0.00 0.42 0.00 0.00 52.86 52.62 2cuh s ASN 33 Cb 0.18 -1.84 -0.03 0.00 -1.45 0.00 0.00 41.25 38.10 2cuh s ASN 33 CO 0.55 -0.01 1.57 -2.16 -3.72 0.00 0.00 177.10 173.32 2cuh s PRO 34 N 1.45 3.98 1.14 0.43 0.04 -1.25 -4.97 135.00 135.82 2cuh s PRO 34 Ca 0.05 1.82 -0.18 0.00 0.04 0.00 0.00 61.00 62.73 2cuh s PRO 34 Cb -0.15 -3.97 0.29 0.00 0.04 0.00 0.00 34.50 30.70 2cuh s PRO 34 CO 0.01 -1.06 0.64 1.33 0.04 0.00 0.00 177.00 177.96 2cuh n VAL 35 N 5.95 0.00 -0.10 -0.36 0.24 -1.26 -4.96 118.33 117.84 2cuh n VAL 35 Ca 0.17 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 62.30 2cuh n VAL 35 Cb 0.44 -0.73 -0.07 0.00 -1.47 0.00 0.00 33.84 32.01 2cuh n VAL 35 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2cuh n ASP 36 N -4.59 1.88 -3.79 -1.34 2.03 -1.17 -3.86 116.55 105.71 2cuh n ASP 36 Ca 0.10 0.44 -0.13 0.00 0.52 0.00 0.00 54.79 55.72 2cuh n ASP 36 Cb 0.45 -0.87 -0.14 0.00 -0.72 0.00 0.00 41.12 39.84 2cuh n ASP 36 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2cuh s THR 37 N -2.46 -0.03 -0.16 5.18 -4.23 -1.25 0.58 115.64 113.27 2cuh s THR 37 Ca -0.28 0.11 -0.18 0.00 -1.18 0.00 0.00 61.69 60.16 2cuh s THR 37 Cb 0.07 -0.16 -0.04 0.00 1.34 0.00 0.00 72.50 73.71 2cuh s THR 37 CO 0.45 0.04 0.49 -0.31 -0.54 0.00 0.00 174.62 174.75 2cuh s TYR 38 N 0.64 3.44 -0.47 3.99 2.02 0.94 -1.25 117.35 126.65 2cuh s TYR 38 Ca -0.05 0.81 -0.18 0.00 -0.37 0.00 0.00 57.07 57.28 2cuh s TYR 38 Cb -0.07 -2.60 0.04 0.00 -0.40 0.00 0.00 41.96 38.94 2cuh s TYR 38 CO -0.03 0.03 0.56 0.34 -1.57 0.00 0.00 175.55 174.88 2cuh s ASP 39 N 0.90 6.22 -0.12 2.29 2.15 -0.83 -3.06 116.67 124.21 2cuh s ASP 39 Ca 0.24 -0.81 -0.03 0.00 0.43 0.00 0.00 52.55 52.38 2cuh s ASP 39 Cb -0.15 -2.27 -0.03 0.00 -0.30 0.00 0.00 42.92 40.17 2cuh s ASP 39 CO 0.10 -0.77 -0.00 -0.63 -0.17 0.00 0.00 175.17 173.69 2cuh s ILE 40 N 2.43 4.24 -0.15 4.11 1.09 -1.19 -0.48 121.20 131.25 2cuh s ILE 40 Ca 0.14 -0.26 -0.01 0.00 -1.10 0.00 0.00 60.65 59.43 2cuh s ILE 40 Cb -0.18 -2.82 0.04 0.00 -1.06 0.00 0.00 42.46 38.43 2cuh s ILE 40 CO 0.13 0.55 -0.05 -1.58 -0.10 0.00 0.00 174.94 173.89 2cuh s GLN 41 N -0.34 1.36 -0.12 2.79 0.74 -0.17 -3.35 119.66 120.57 2cuh s GLN 41 Ca 0.07 -0.42 -0.02 0.00 0.05 0.00 0.00 55.36 55.03 2cuh s GLN 41 Cb -0.12 -1.87 -0.03 0.00 1.10 0.00 0.00 33.01 32.09 2cuh s GLN 41 CO 0.02 -0.40 -0.03 0.08 -0.55 0.00 0.00 175.29 174.40 2cuh s VAL 42 N 1.68 3.96 0.15 1.34 1.01 -1.02 -1.06 120.40 126.46 2cuh s VAL 42 Ca 0.02 -0.35 -0.08 0.00 0.00 0.00 0.00 61.98 61.56 2cuh s VAL 42 Cb -0.15 -2.69 -0.01 0.00 0.00 0.00 0.00 36.38 33.53 2cuh s VAL 42 CO -0.08 0.54 0.25 0.42 0.00 0.00 0.00 175.10 176.24 2cuh s THR 43 N -0.18 0.08 0.19 3.92 -4.23 -0.96 -1.90 115.64 112.56 2cuh s THR 43 Ca 0.03 -1.39 -0.22 0.00 -1.18 0.00 0.00 61.69 58.94 2cuh s THR 43 Cb -0.13 -1.78 0.06 0.00 1.34 0.00 0.00 72.50 71.99 2cuh s THR 43 CO 0.02 -0.36 0.62 0.00 -0.54 0.00 0.00 174.62 174.36 2cuh s ALA 44 N -3.96 -1.47 -1.02 3.99 0.00 -1.26 -2.18 121.76 115.86 2cuh s ALA 44 Ca 0.16 0.26 -0.24 0.00 0.00 0.00 0.00 51.96 52.14 2cuh s ALA 44 Cb 0.04 0.87 -0.07 0.00 0.00 0.00 0.00 23.12 23.97 2cuh s ALA 44 CO -0.02 -0.83 1.94 -1.25 0.00 0.00 0.00 175.76 175.61 2cuh s PRO 45 N -3.80 2.52 0.00 0.00 0.04 -1.26 -3.13 135.00 129.37 2cuh s PRO 45 Ca 0.04 -0.67 0.00 0.00 0.04 0.00 0.00 61.00 60.41 2cuh s PRO 45 Cb -0.02 -5.14 0.00 0.00 0.04 0.00 0.00 34.50 29.38 2cuh s PRO 45 CO -0.08 -3.66 0.00 0.41 0.04 0.00 0.00 177.00 173.72 2cuh n GLY 46 N 6.40 2.53 3.77 0.56 0.00 -1.26 -5.09 105.19 112.10 2cuh n GLY 46 Ca 0.42 -0.81 -0.35 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.54 2.57 0.51 4.61 0.00 -1.18 -5.00 121.76 122.72 2cuh s ALA 47 Ca 0.00 0.78 -0.21 0.00 0.00 0.00 0.00 51.96 52.53 2cuh s ALA 47 Cb 0.00 -3.37 -0.06 0.00 0.00 0.00 0.00 23.12 19.68 2cuh s ALA 47 CO 0.00 -1.06 1.14 -1.25 0.00 0.00 0.00 175.76 174.60 2cuh s PRO 48 N -3.56 3.52 0.27 0.00 0.04 -1.26 -4.33 135.00 129.68 2cuh s PRO 48 Ca 0.72 1.68 -0.29 0.00 0.04 0.00 0.00 61.00 63.14 2cuh s PRO 48 Cb -0.24 -2.17 -0.10 0.00 0.04 0.00 0.00 34.50 32.03 2cuh s PRO 48 CO 0.33 -0.73 1.25 -1.25 0.04 0.00 0.00 177.00 176.65 2cuh s PRO 49 N -3.05 4.44 -0.10 0.56 0.04 -1.26 -4.76 135.00 130.87 2cuh s PRO 49 Ca 0.69 2.05 0.04 0.00 0.04 0.00 0.00 61.00 63.82 2cuh s PRO 49 Cb -0.26 -3.15 -0.00 0.00 0.04 0.00 0.00 34.50 31.13 2cuh s PRO 49 CO 0.30 -0.11 -0.24 -1.17 0.04 0.00 0.00 177.00 175.83 2cuh s LEU 50 N -1.08 2.11 -0.13 -3.56 2.96 -0.80 -5.05 118.68 113.14 2cuh s LEU 50 Ca 0.51 -0.55 0.01 0.00 -0.22 0.00 0.00 54.13 53.87 2cuh s LEU 50 Cb -0.36 -1.42 0.02 0.00 0.50 0.00 0.00 46.19 44.93 2cuh s LEU 50 CO 0.44 0.16 -0.14 -1.58 -1.32 0.00 0.00 176.35 173.92 2cuh s GLN 51 N 0.32 2.19 0.20 1.98 0.74 -1.26 -2.43 119.66 121.40 2cuh s GLN 51 Ca -0.18 -0.53 -0.02 0.00 0.05 0.00 0.00 55.36 54.68 2cuh s GLN 51 Cb -0.18 -1.97 -0.04 0.00 1.10 0.00 0.00 33.01 31.93 2cuh s GLN 51 CO 0.09 -0.17 0.15 0.00 -0.55 0.00 0.00 175.29 174.81 2cuh s ALA 52 N 1.31 1.03 0.17 1.58 0.00 -1.21 -5.10 121.76 119.54 2cuh s ALA 52 Ca 0.00 -1.61 -0.08 0.00 0.00 0.00 0.00 51.96 50.27 2cuh s ALA 52 Cb -0.14 1.33 -0.01 0.00 0.00 0.00 0.00 23.12 24.30 2cuh s ALA 52 CO -0.07 -0.61 0.27 -2.00 0.00 0.00 0.00 175.76 173.35 2cuh s GLU 53 N -4.14 1.17 -0.20 0.00 2.12 -1.26 -3.19 118.70 113.21 2cuh s GLU 53 Ca 0.37 -1.24 -0.26 0.00 0.36 0.00 0.00 54.97 54.19 2cuh s GLU 53 Cb 0.06 0.36 0.07 0.00 0.26 0.00 0.00 34.13 34.89 2cuh s GLU 53 CO 0.11 -0.42 0.69 -0.08 -0.54 0.00 0.00 175.26 175.02 2cuh s THR 54 N -3.99 0.00 0.56 -1.70 -1.32 -1.17 -4.97 115.64 103.05 2cuh s THR 54 Ca 0.20 -0.01 -0.19 0.00 -1.21 0.00 0.00 61.69 60.49 2cuh s THR 54 Cb 0.04 -0.98 -0.05 0.00 -1.51 0.00 0.00 72.50 70.00 2cuh s THR 54 CO 0.02 -0.00 1.12 -2.16 -2.21 0.00 0.00 174.62 171.39 2cuh s PRO 55 N -0.13 3.25 0.33 7.08 0.04 -1.26 -0.04 135.00 144.27 2cuh s PRO 55 Ca -0.04 1.57 0.16 0.00 0.04 0.00 0.00 61.00 62.73 2cuh s PRO 55 Cb -0.03 -2.00 0.87 0.00 0.04 0.00 0.00 34.50 33.38 2cuh s PRO 55 CO 0.04 -0.92 1.42 0.41 0.04 0.00 0.00 177.00 177.98 2cuh n GLY 56 N 0.02 -0.70 0.00 0.56 0.00 0.20 -0.53 105.19 104.74 2cuh n GLY 56 Ca 0.11 0.15 0.06 0.00 0.00 0.00 0.00 46.02 46.34 2cuh n GLY 56 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2cuh n SER 57 N -2.12 0.00 -4.14 1.61 2.88 -1.26 -4.66 113.62 105.93 2cuh n SER 57 Ca -0.01 -1.10 -0.28 0.00 -1.33 0.00 0.00 58.87 56.15 2cuh n SER 57 Cb 0.23 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.53 2cuh n SER 57 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2cuh s ALA 58 N -2.00 1.68 -0.29 -1.46 0.00 0.31 -5.02 121.76 114.99 2cuh s ALA 58 Ca 0.18 -0.72 0.09 0.00 0.00 0.00 0.00 51.96 51.50 2cuh s ALA 58 Cb 0.08 -0.62 0.51 0.00 0.00 0.00 0.00 23.12 23.10 2cuh s ALA 58 CO 0.14 0.25 1.47 1.33 0.00 0.00 0.00 175.76 178.95 2cuh n VAL 59 N 3.40 2.55 -3.64 0.00 0.24 -1.26 -4.91 118.33 114.72 2cuh n VAL 59 Ca -0.20 -2.68 -0.08 0.00 -2.04 0.00 0.00 64.34 59.34 2cuh n VAL 59 Cb 0.53 -0.32 -0.07 0.00 -1.47 0.00 0.00 33.84 32.51 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 -2.47 -0.36 -0.34 -1.34 -4.77 -1.26 -3.74 116.67 102.38 2cuh s ASP 60 Ca 0.45 0.67 -0.00 0.00 -3.30 0.00 0.00 52.55 50.37 2cuh s ASP 60 Cb 0.40 0.67 0.11 0.00 -1.09 0.00 0.00 42.92 43.02 2cuh s ASP 60 CO 0.00 -0.14 0.15 -0.47 0.70 0.00 0.00 175.17 175.41 2cuh s TYR 61 N 0.08 1.48 -0.46 2.11 5.04 -1.15 -4.96 117.35 119.49 2cuh s TYR 61 Ca 0.04 -1.77 -0.28 0.00 -2.44 0.00 0.00 57.07 52.62 2cuh s TYR 61 Cb -0.05 -1.56 -0.01 0.00 0.35 0.00 0.00 41.96 40.69 2cuh s TYR 61 CO -0.08 -0.85 1.76 -1.25 -1.34 0.00 0.00 175.55 173.80 2cuh s PRO 62 N 1.34 3.09 -0.05 4.97 0.04 -1.26 -2.25 135.00 140.88 2cuh s PRO 62 Ca 0.12 1.02 -0.30 0.00 0.04 0.00 0.00 61.00 61.89 2cuh s PRO 62 Cb -0.19 -4.25 -0.02 0.00 0.04 0.00 0.00 34.50 30.08 2cuh s PRO 62 CO -0.18 -2.16 1.01 -0.51 0.04 0.00 0.00 177.00 175.20 2cuh s LEU 63 N 7.54 4.31 0.46 -3.56 1.43 -0.26 -4.95 118.68 123.65 2cuh s LEU 63 Ca 0.72 1.62 0.05 0.00 -1.03 0.00 0.00 54.13 55.49 2cuh s LEU 63 Cb -0.17 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.45 2cuh s LEU 63 CO 0.28 -0.37 0.14 -1.38 0.23 0.00 0.00 176.35 175.25 2cuh s HIS 64 N 1.55 2.23 -1.19 0.29 -3.43 -1.26 -4.10 115.29 109.39 2cuh s HIS 64 Ca 0.51 -0.74 -0.01 0.00 -0.80 0.00 0.00 55.06 54.02 2cuh s HIS 64 Cb -0.20 -1.83 -0.01 0.00 -1.43 0.00 0.00 32.58 29.11 2cuh s HIS 64 CO 0.23 0.13 0.97 -3.47 -2.00 0.00 0.00 174.74 170.60 2cuh n ASP 65 N -1.29 -2.56 -4.13 7.38 -0.08 -1.26 -5.00 116.55 109.61 2cuh n ASP 65 Ca -0.07 -0.65 -0.33 0.00 -1.51 0.00 0.00 54.79 52.24 2cuh n ASP 65 Cb 0.66 -5.05 -0.15 0.00 2.34 0.00 0.00 41.12 38.91 2cuh n ASP 65 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 2cuh s LEU 66 N -6.26 2.72 0.20 -2.67 1.43 -1.26 -5.09 118.68 107.74 2cuh s LEU 66 Ca 0.06 -0.87 -0.33 0.00 -1.03 0.00 0.00 54.13 51.96 2cuh s LEU 66 Cb -0.01 -1.55 -0.14 0.00 0.03 0.00 0.00 46.19 44.52 2cuh s LEU 66 CO 0.74 -0.08 1.47 0.52 0.23 0.00 0.00 176.35 179.23 2cuh n VAL 67 N 4.59 0.50 -1.57 -1.59 0.31 -1.26 -4.76 118.33 114.55 2cuh n VAL 67 Ca -0.18 -0.13 -0.30 0.00 -0.01 0.00 0.00 64.34 63.73 2cuh n VAL 67 Cb 0.47 -1.44 0.10 0.00 -0.91 0.00 0.00 33.84 32.06 2cuh n VAL 67 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2cuh s LEU 68 N 0.46 2.41 -1.52 7.52 2.01 -1.26 -3.94 118.68 124.35 2cuh s LEU 68 Ca 0.74 1.16 -0.13 0.00 0.01 0.00 0.00 54.13 55.91 2cuh s LEU 68 Cb -0.68 -3.68 0.08 0.00 0.01 0.00 0.00 46.19 41.91 2cuh s LEU 68 CO 0.45 -2.14 0.97 1.41 1.01 0.00 0.00 176.35 178.05 2cuh n HIS 69 N -3.52 -2.29 -3.73 0.29 8.25 -1.14 -4.97 115.22 108.10 2cuh n HIS 69 Ca 0.07 0.91 -0.12 0.00 -0.26 0.00 0.00 57.72 58.31 2cuh n HIS 69 Cb 0.57 -4.01 -0.13 0.00 1.12 0.00 0.00 29.99 27.55 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 -3.32 -0.04 -0.09 1.59 2.01 -1.25 -5.05 115.64 109.50 2cuh s THR 70 Ca 0.63 0.13 -0.30 0.00 0.31 0.00 0.00 61.69 62.47 2cuh s THR 70 Cb -0.32 -0.40 -0.04 0.00 0.01 0.00 0.00 72.50 71.75 2cuh s THR 70 CO 0.83 0.05 1.45 0.21 -0.69 0.00 0.00 174.62 176.47 2cuh s ASN 71 N 1.17 6.81 -0.12 3.53 3.84 -1.26 -3.81 114.94 125.10 2cuh s ASN 71 Ca -0.08 2.00 0.03 0.00 0.21 0.00 0.00 52.86 55.01 2cuh s ASN 71 Cb -0.09 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 38.07 2cuh s ASN 71 CO -0.08 -0.82 -0.22 -0.31 -2.79 0.00 0.00 177.10 172.88 2cuh s TYR 72 N 3.48 2.63 -0.24 0.43 2.02 -1.26 -4.52 117.35 119.89 2cuh s TYR 72 Ca 0.64 -1.18 -0.07 0.00 -0.37 0.00 0.00 57.07 56.09 2cuh s TYR 72 Cb -0.28 -1.77 -0.03 0.00 -0.40 0.00 0.00 41.96 39.48 2cuh s TYR 72 CO 0.23 -0.51 0.05 0.99 -1.57 0.00 0.00 175.55 174.74 2cuh s THR 73 N 0.59 4.20 -0.03 -0.71 2.01 -0.93 -3.80 115.64 116.98 2cuh s THR 73 Ca -0.12 -0.21 0.02 0.00 0.31 0.00 0.00 61.69 61.69 2cuh s THR 73 Cb -0.17 -2.95 -0.03 0.00 0.01 0.00 0.00 72.50 69.36 2cuh s THR 73 CO 0.03 0.36 -0.06 0.00 -0.69 0.00 0.00 174.62 174.25 2cuh s ALA 74 N 1.53 3.02 -0.20 7.40 0.00 -1.23 -2.27 121.76 130.01 2cuh s ALA 74 Ca 0.06 -0.96 -0.00 0.00 0.00 0.00 0.00 51.96 51.05 2cuh s ALA 74 Cb -0.15 -1.19 0.05 0.00 0.00 0.00 0.00 23.12 21.84 2cuh s ALA 74 CO 0.03 0.60 -0.04 0.99 0.00 0.00 0.00 175.76 177.34 2cuh s THR 75 N -0.93 1.22 0.16 0.00 2.01 -0.23 -2.58 115.64 115.30 2cuh s THR 75 Ca 0.15 -0.89 -0.04 0.00 0.31 0.00 0.00 61.69 61.22 2cuh s THR 75 Cb -0.11 -1.49 -0.05 0.00 0.01 0.00 0.00 72.50 70.86 2cuh s THR 75 CO 0.05 -0.03 0.38 -0.69 -0.69 0.00 0.00 174.62 173.64 2cuh s VAL 76 N 1.56 5.18 0.26 3.82 1.01 0.62 -1.00 120.40 131.84 2cuh s VAL 76 Ca -0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 61.98 61.89 2cuh s VAL 76 Cb -0.17 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 2cuh s VAL 76 CO -0.07 -0.01 0.27 -0.13 0.00 0.00 0.00 175.10 175.16 2cuh s ARG 77 N -2.80 1.48 -0.19 2.72 0.52 0.37 -0.19 118.95 120.86 2cuh s ARG 77 Ca 0.41 -1.67 0.00 0.00 -0.52 0.00 0.00 55.73 53.95 2cuh s ARG 77 Cb -0.12 0.34 0.04 0.00 0.52 0.00 0.00 34.95 35.73 2cuh s ARG 77 CO 0.26 -0.54 -0.08 0.20 0.02 0.00 0.00 175.30 175.16 2cuh s GLY 78 N -3.19 1.14 -0.64 -3.53 0.00 -1.26 -1.97 107.32 97.86 2cuh s GLY 78 Ca 0.35 -1.06 -0.24 0.00 0.00 0.00 0.00 44.72 43.78 2cuh s GLY 78 CO 0.16 0.82 1.00 1.08 0.00 0.00 0.00 173.10 176.17 2cuh s LEU 79 N 1.50 4.13 -0.41 0.66 2.01 -0.38 -1.54 118.68 124.64 2cuh s LEU 79 Ca -0.01 -0.75 0.03 0.00 0.01 0.00 0.00 54.13 53.42 2cuh s LEU 79 Cb -0.16 -2.54 0.11 0.00 0.01 0.00 0.00 46.19 43.61 2cuh s LEU 79 CO -0.08 -1.44 0.15 -0.13 1.01 0.00 0.00 176.35 175.86 2cuh s ARG 80 N 4.28 1.58 3.47 1.70 0.52 -1.15 -3.02 118.95 126.32 2cuh s ARG 80 Ca 0.26 -2.10 0.00 0.00 -0.52 0.00 0.00 55.73 53.37 2cuh s ARG 80 Cb -0.14 -3.06 0.00 0.00 0.52 0.00 0.00 34.95 32.27 2cuh s ARG 80 CO 0.13 -1.03 0.00 0.41 0.02 0.00 0.00 175.30 174.83 2cuh n GLY 81 N 3.81 0.66 0.00 -3.53 0.00 -1.26 -2.61 105.19 102.26 2cuh n GLY 81 Ca 0.04 -0.78 0.05 0.00 0.00 0.00 0.00 46.02 45.33 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 -4.67 1.61 -0.04 -1.26 -4.73 135.00 126.39 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 -1.30 -0.10 0.00 -0.04 0.00 0.00 33.50 32.06 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 -1.81 3.97 0.15 3.54 0.02 -1.07 -5.16 114.94 114.58 2cuh s ASN 83 Ca 0.14 -1.47 0.06 0.00 -1.02 0.00 0.00 52.86 50.57 2cuh s ASN 83 Cb 0.06 -0.06 -0.04 0.00 0.02 0.00 0.00 41.25 41.23 2cuh s ASN 83 CO 0.11 -0.60 -0.14 -0.76 0.02 0.00 0.00 177.10 175.73 2cuh s LEU 84 N -3.77 2.47 0.55 0.60 1.43 -1.26 -2.95 118.68 115.74 2cuh s LEU 84 Ca 0.24 -0.90 0.07 0.00 -1.03 0.00 0.00 54.13 52.51 2cuh s LEU 84 Cb 0.07 -0.57 0.07 0.00 0.03 0.00 0.00 46.19 45.79 2cuh s LEU 84 CO 0.12 -0.18 0.76 0.42 0.23 0.00 0.00 176.35 177.71 2cuh s THR 85 N -2.54 2.45 0.08 5.49 -4.23 -0.59 -4.95 115.64 111.35 2cuh s THR 85 Ca 0.14 -0.90 -0.31 0.00 -1.18 0.00 0.00 61.69 59.45 2cuh s THR 85 Cb -0.03 -2.55 -0.08 0.00 1.34 0.00 0.00 72.50 71.18 2cuh s THR 85 CO 0.04 0.00 1.51 -0.94 -0.54 0.00 0.00 174.62 174.68 2cuh s SER 86 N -4.56 6.72 0.50 3.99 1.04 -1.26 -4.50 113.70 115.63 2cuh s SER 86 Ca 0.60 2.37 -0.21 0.00 0.48 0.00 0.00 55.95 59.18 2cuh s SER 86 Cb -0.07 -2.57 -0.07 0.00 0.10 0.00 0.00 66.02 63.41 2cuh s SER 86 CO 0.38 -0.77 1.15 -2.16 0.98 0.00 0.00 173.24 172.81 2cuh s PRO 87 N 1.97 3.58 -0.13 4.02 0.04 -1.26 -4.34 135.00 138.88 2cuh s PRO 87 Ca 0.68 1.70 -0.02 0.00 0.04 0.00 0.00 61.00 63.40 2cuh s PRO 87 Cb -0.37 -2.22 0.04 0.00 0.04 0.00 0.00 34.50 31.99 2cuh s PRO 87 CO 0.30 -0.69 0.01 0.00 0.04 0.00 0.00 177.00 176.67 2cuh s ALA 88 N -1.65 0.87 0.28 8.56 0.00 0.73 -4.97 121.76 125.59 2cuh s ALA 88 Ca 0.68 -0.41 0.11 0.00 0.00 0.00 0.00 51.96 52.34 2cuh s ALA 88 Cb -0.26 -0.95 -0.05 0.00 0.00 0.00 0.00 23.12 21.86 2cuh s ALA 88 CO 0.31 -0.77 -0.14 0.45 0.00 0.00 0.00 175.76 175.61 2cuh s SER 89 N 1.91 3.83 -0.01 0.00 0.15 -1.26 -0.28 113.70 118.04 2cuh s SER 89 Ca 0.02 -0.95 -0.19 0.00 0.70 0.00 0.00 55.95 55.53 2cuh s SER 89 Cb -0.14 -0.43 0.04 0.00 -1.71 0.00 0.00 66.02 63.77 2cuh s SER 89 CO -0.07 0.01 0.42 -0.51 1.20 0.00 0.00 173.24 174.29 2cuh s ILE 90 N -2.48 0.04 -0.35 6.45 2.07 -1.06 -4.98 121.20 120.90 2cuh s ILE 90 Ca 0.31 -0.35 -0.12 0.00 -1.41 0.00 0.00 60.65 59.08 2cuh s ILE 90 Cb -0.05 -0.76 -0.00 0.00 0.13 0.00 0.00 42.46 41.78 2cuh s ILE 90 CO 0.16 -0.19 0.21 -0.89 -1.91 0.00 0.00 174.94 172.32 2cuh s THR 91 N -1.46 4.91 -0.03 4.00 2.01 -1.26 -3.54 115.64 120.27 2cuh s THR 91 Ca -0.12 -0.47 0.01 0.00 0.31 0.00 0.00 61.69 61.42 2cuh s THR 91 Cb -0.03 -3.59 0.03 0.00 0.01 0.00 0.00 72.50 68.92 2cuh s THR 91 CO 0.05 -0.06 -0.00 0.72 -0.69 0.00 0.00 174.62 174.63 2cuh s PHE 92 N 1.65 0.34 0.43 4.92 -0.12 -1.25 -5.08 117.98 118.88 2cuh s PHE 92 Ca 0.05 -0.02 -0.22 0.00 -0.05 0.00 0.00 56.93 56.68 2cuh s PHE 92 Cb -0.18 -0.41 -0.09 0.00 -0.63 0.00 0.00 43.02 41.71 2cuh s PHE 92 CO 0.08 -0.13 1.05 0.99 -0.05 0.00 0.00 175.22 177.16 2cuh s THR 93 N 0.94 3.75 0.16 -4.49 2.01 -1.26 -3.99 115.64 112.75 2cuh s THR 93 Ca -0.10 1.24 -0.00 0.00 0.31 0.00 0.00 61.69 63.13 2cuh s THR 93 Cb -0.13 -3.59 -0.04 0.00 0.01 0.00 0.00 72.50 68.75 2cuh s THR 93 CO -0.01 -0.09 0.33 0.42 -0.69 0.00 0.00 174.62 174.57 2cuh s THR 94 N -1.79 5.26 -0.52 -0.82 -4.23 -1.25 -4.71 115.64 107.58 2cuh s THR 94 Ca 0.62 -0.38 -0.11 0.00 -1.18 0.00 0.00 61.69 60.63 2cuh s THR 94 Cb -0.20 -3.70 0.01 0.00 1.34 0.00 0.00 72.50 69.96 2cuh s THR 94 CO 0.24 -0.07 0.62 0.61 -0.54 0.00 0.00 174.62 175.49 2cuh n GLY 95 N -0.36 -1.29 2.82 3.99 0.00 -1.26 -2.91 105.19 106.19 2cuh n GLY 95 Ca -0.05 1.03 -0.39 0.00 0.00 0.00 0.00 46.02 46.61 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 -0.73 7.16 -0.07 0.99 7.94 -1.26 -4.54 117.00 126.49 2cuh n LEU 96 Ca 0.08 -5.01 -0.10 0.00 -1.11 0.00 0.00 56.01 49.87 2cuh n LEU 96 Cb 0.47 -1.02 -0.07 0.00 0.53 0.00 0.00 43.42 43.33 2cuh n LEU 96 CO 0.49 1.88 -0.05 -0.33 -1.11 0.00 0.00 177.39 178.27 2cuh h GLU 97 N 3.21 0.00 -3.59 1.96 3.07 -1.97 -3.47 114.58 113.80 2cuh h GLU 97 Ca 0.53 0.00 -0.46 0.00 -0.50 0.00 0.00 59.36 58.92 2cuh h GLU 97 Cb 0.18 0.00 -0.39 0.00 -0.84 0.00 0.00 28.75 27.70 2cuh h GLU 97 CO 1.32 0.54 -0.76 0.00 -1.40 0.00 0.00 179.01 178.70 2cuh s ALA 98 N -2.43 0.77 -2.00 3.43 0.00 -1.26 -5.00 121.76 115.26 2cuh s ALA 98 Ca -0.15 -0.32 0.15 0.00 0.00 0.00 0.00 51.96 51.64 2cuh s ALA 98 Cb 0.01 -0.91 0.92 0.00 0.00 0.00 0.00 23.12 23.14 2cuh s ALA 98 CO 0.39 -0.75 1.34 -0.35 0.00 0.00 0.00 175.76 176.39 2cuh n PRO 99 N 5.13 0.49 0.17 0.00 -0.04 -1.26 -3.44 135.00 136.05 2cuh n PRO 99 Ca -0.08 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.47 2cuh n PRO 99 Cb 0.49 -1.49 0.47 0.00 -0.04 0.00 0.00 33.50 32.92 2cuh n PRO 99 CO 0.00 0.00 0.00 0.07 -0.04 0.00 0.00 175.50 175.53 2cuh h ARG 100 N 0.00 0.00 0.00 0.54 0.11 -2.00 -3.32 114.38 109.71 2cuh h ARG 100 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2cuh h ARG 100 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 2cuh h ARG 100 CO 0.00 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 179.82 2cuh n ASP 101 N -2.17 0.00 -4.59 0.08 8.00 -1.22 -5.08 116.55 111.56 2cuh n ASP 101 Ca -0.01 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.11 2cuh n ASP 101 Cb 0.22 0.00 0.05 0.00 -0.02 0.00 0.00 41.12 41.38 2cuh n ASP 101 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2cuh n LEU 102 N -2.31 3.29 -4.76 0.64 -0.00 -1.25 -4.90 117.00 107.70 2cuh n LEU 102 Ca 0.00 0.78 -0.41 0.00 -0.00 0.00 0.00 56.01 56.38 2cuh n LEU 102 Cb 0.00 -1.36 -0.02 0.00 -0.00 0.00 0.00 43.42 42.04 2cuh n LEU 102 CO 0.00 -2.08 1.04 -0.70 -0.00 0.00 0.00 177.39 175.65 2cuh s GLU 103 N -2.70 4.30 -0.13 1.47 2.56 -1.26 -4.70 118.70 118.24 2cuh s GLU 103 Ca 0.75 2.28 -0.06 0.00 0.00 0.00 0.00 54.97 57.95 2cuh s GLU 103 Cb -0.41 -3.08 0.05 0.00 2.00 0.00 0.00 34.13 32.69 2cuh s GLU 103 CO 0.48 -0.31 0.29 0.00 -0.56 0.00 0.00 175.26 175.16 2cuh s ALA 104 N -0.72 -0.70 0.06 6.30 0.00 -1.26 -5.05 121.76 120.40 2cuh s ALA 104 Ca 0.53 1.13 -0.19 0.00 0.00 0.00 0.00 51.96 53.43 2cuh s ALA 104 Cb -0.41 -0.80 -0.07 0.00 0.00 0.00 0.00 23.12 21.84 2cuh s ALA 104 CO 0.50 -0.32 0.56 -1.59 0.00 0.00 0.00 175.76 174.92 2cuh s LYS 105 N 1.56 4.19 0.03 0.00 -2.85 -1.26 -5.08 119.74 116.33 2cuh s LYS 105 Ca -0.07 0.72 0.00 0.00 -1.00 0.00 0.00 55.97 55.62 2cuh s LYS 105 Cb -0.10 -3.24 -0.02 0.00 -2.06 0.00 0.00 37.83 32.40 2cuh s LYS 105 CO -0.10 0.63 -0.04 -2.00 0.10 0.00 0.00 175.35 173.94 2cuh s GLU 106 N -1.05 0.39 0.86 1.78 2.56 -1.26 -5.14 118.70 116.84 2cuh s GLU 106 Ca 0.29 -0.73 -0.17 0.00 0.00 0.00 0.00 54.97 54.36 2cuh s GLU 106 Cb -0.19 0.08 -0.13 0.00 2.00 0.00 0.00 34.13 35.89 2cuh s GLU 106 CO 0.19 -0.05 -0.49 1.33 -0.56 0.00 0.00 175.26 175.67 2cuh n VAL 107 N 1.33 0.10 -4.60 3.70 0.24 -1.26 -4.98 118.33 112.85 2cuh n VAL 107 Ca -0.22 -0.47 -0.30 0.00 -2.04 0.00 0.00 64.34 61.31 2cuh n VAL 107 Cb 0.56 -0.08 -0.13 0.00 -1.47 0.00 0.00 33.84 32.72 2cuh n VAL 107 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2cuh s THR 108 N -2.02 2.39 0.83 3.34 -4.23 -1.26 -5.13 115.64 109.56 2cuh s THR 108 Ca 0.47 -1.50 -0.11 0.00 -1.18 0.00 0.00 61.69 59.36 2cuh s THR 108 Cb -0.27 -2.01 0.09 0.00 1.34 0.00 0.00 72.50 71.65 2cuh s THR 108 CO 0.77 0.23 1.09 -2.16 -0.54 0.00 0.00 174.62 174.00 2cuh s PRO 109 N -1.69 1.78 0.12 3.99 0.04 -1.26 -5.07 135.00 132.92 2cuh s PRO 109 Ca 0.14 1.00 0.07 0.00 0.04 0.00 0.00 61.00 62.25 2cuh s PRO 109 Cb -0.10 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.54 2cuh s PRO 109 CO 0.05 -1.93 -0.09 -1.54 0.04 0.00 0.00 177.00 173.53 2cuh s SER 110 N -3.41 4.42 0.05 6.66 1.04 -1.26 -5.13 113.70 116.08 2cuh s SER 110 Ca 0.62 -0.41 -0.27 0.00 0.48 0.00 0.00 55.95 56.37 2cuh s SER 110 Cb -0.18 -0.84 0.09 0.00 0.10 0.00 0.00 66.02 65.19 2cuh s SER 110 CO 0.56 0.16 0.78 -0.83 0.98 0.00 0.00 173.24 174.89 2cuh s GLY 111 N -2.39 -0.52 0.98 7.32 0.00 -1.26 -5.17 107.32 106.28 2cuh s GLY 111 Ca 0.23 0.83 -0.12 0.00 0.00 0.00 0.00 44.72 45.65 2cuh s GLY 111 CO 0.15 0.27 1.09 2.56 0.00 0.00 0.00 173.10 177.17 2cuh s PRO 112 N -3.34 0.55 0.36 2.90 0.04 -1.26 -5.09 135.00 129.16 2cuh s PRO 112 Ca 0.03 0.57 0.04 0.00 0.04 0.00 0.00 61.00 61.68 2cuh s PRO 112 Cb -0.01 -1.75 -0.05 0.00 0.04 0.00 0.00 34.50 32.73 2cuh s PRO 112 CO -0.10 -2.66 0.08 -1.54 0.04 0.00 0.00 177.00 172.82 2cuh s SER 113 N -3.44 2.51 0.33 6.66 1.04 -1.26 -5.17 113.70 114.37 2cuh s SER 113 Ca 0.65 -1.49 0.05 0.00 0.48 0.00 0.00 55.95 55.64 2cuh s SER 113 Cb -0.18 0.15 -0.03 0.00 0.10 0.00 0.00 66.02 66.05 2cuh s SER 113 CO 0.57 -0.73 0.22 -0.44 0.98 0.00 0.00 173.24 173.84 2cuh s SER 114 N -3.53 1.75 0.00 7.02 0.01 -1.26 -5.38 113.70 112.30 2cuh s SER 114 Ca 0.31 -1.68 0.00 0.00 1.31 0.00 0.00 55.95 55.89 2cuh s SER 114 Cb 0.06 0.51 0.00 0.00 0.21 0.00 0.00 66.02 66.80 2cuh s SER 114 CO 0.15 -0.99 0.00 0.61 0.41 0.00 0.00 173.24 173.42