#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nbt n THR 2 N 0.00 0.00 0.03 0.55 -2.24 -1.26 -1.43 114.28 109.92 2nbt n THR 2 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2nbt n THR 2 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2nbt n THR 2 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nbt s LEU 4 N -0.10 0.50 -0.40 0.00 1.43 -1.26 -2.84 118.68 116.02 2nbt s LEU 4 Ca 0.01 -1.16 0.09 0.00 -1.03 0.00 0.00 54.13 52.04 2nbt s LEU 4 Cb 0.01 -0.33 0.28 0.00 0.03 0.00 0.00 46.19 46.17 2nbt s LEU 4 CO 0.01 -0.42 0.65 -0.38 0.23 0.00 0.00 176.35 176.44 2nbt n ILE 5 N 5.26 -0.44 0.00 -0.59 5.41 -1.26 -1.55 119.36 126.19 2nbt n ILE 5 Ca -0.06 -3.66 0.00 0.00 1.00 0.00 0.00 62.75 60.03 2nbt n ILE 5 Cb 0.43 -0.89 0.00 0.00 -0.71 0.00 0.00 39.64 38.47 2nbt n ILE 5 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2nbt n SER 6 N 1.12 0.00 0.00 4.38 2.88 -1.26 -4.96 113.62 115.78 2nbt n SER 6 Ca 0.19 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 2nbt n SER 6 Cb 0.58 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.04 2nbt n SER 6 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2nbt n PRO 7 N 0.00 0.00 0.00 -1.46 -0.04 -1.26 -4.46 135.00 127.78 2nbt n PRO 7 Ca 0.00 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.60 2nbt n PRO 7 Cb 0.00 -0.18 0.49 0.00 -0.04 0.00 0.00 33.50 33.77 2nbt n PRO 7 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2nbt n SER 8 N 0.00 0.87 -3.32 3.54 3.41 -1.26 -4.96 113.62 111.90 2nbt n SER 8 Ca 0.00 -0.86 -0.17 0.00 -0.26 0.00 0.00 58.87 57.58 2nbt n SER 8 Cb 0.00 0.04 0.06 0.00 -0.26 0.00 0.00 64.21 64.05 2nbt n SER 8 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2nbt n SER 9 N -0.65 -6.52 -2.63 4.04 7.64 -1.26 -4.94 113.62 109.30 2nbt n SER 9 Ca 0.14 -0.69 -0.18 0.00 1.01 0.00 0.00 58.87 59.14 2nbt n SER 9 Cb 0.32 -4.82 0.01 0.00 -1.01 0.00 0.00 64.21 58.71 2nbt n SER 9 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2nbt n THR 10 N -3.23 1.65 -1.88 0.44 -2.24 -1.20 -4.98 114.28 102.85 2nbt n THR 10 Ca -0.07 -4.12 -0.33 0.00 -2.27 0.00 0.00 64.05 57.27 2nbt n THR 10 Cb 0.60 -0.36 0.03 0.00 -2.10 0.00 0.00 70.33 68.50 2nbt n THR 10 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2nbt s PRO 11 N -3.29 3.08 0.00 -0.78 0.04 -0.59 -4.52 135.00 128.93 2nbt s PRO 11 Ca 0.38 1.24 0.00 0.00 0.04 0.00 0.00 61.00 62.67 2nbt s PRO 11 Cb 0.42 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.96 2nbt s PRO 11 CO -0.08 -1.01 0.00 0.94 0.04 0.00 0.00 177.00 176.89 2nbt n GLN 12 N -2.30 0.00 0.00 4.56 7.27 -1.26 -4.88 117.38 120.77 2nbt n GLN 12 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.16 2nbt n GLN 12 Cb 0.53 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.18 2nbt n GLN 12 CO 0.00 0.00 0.00 2.41 0.07 0.00 0.00 177.06 179.54 2nbt n THR 13 N 0.00 0.00 0.00 1.69 -1.04 -1.26 -4.45 114.28 109.22 2nbt n THR 13 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2nbt n THR 13 Cb 0.42 -0.43 0.00 0.00 -1.82 0.00 0.00 70.33 68.50 2nbt n THR 13 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2nbt s PRO 15 N 0.00 4.20 0.15 0.00 0.04 -1.26 -4.82 135.00 133.31 2nbt s PRO 15 Ca 0.00 2.32 0.26 0.00 0.04 0.00 0.00 61.00 63.63 2nbt s PRO 15 Cb 0.00 -3.55 0.80 0.00 0.04 0.00 0.00 34.50 31.79 2nbt s PRO 15 CO 0.00 -0.72 1.72 0.09 0.04 0.00 0.00 177.00 178.13 2nbt n ASN 16 N 5.42 0.64 0.00 6.66 3.02 -1.26 -4.74 115.26 125.00 2nbt n ASN 16 Ca 0.16 0.46 0.00 0.00 -0.03 0.00 0.00 54.58 55.17 2nbt n ASN 16 Cb 0.40 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 39.02 2nbt n ASN 16 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2nbt n GLY 17 N 1.35 -0.51 3.90 7.41 0.00 -1.26 -5.11 105.19 110.98 2nbt n GLY 17 Ca 0.05 0.09 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 2nbt n GLY 17 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2nbt s GLN 18 N -0.82 3.56 -0.45 1.61 1.11 -1.26 -5.04 119.66 118.37 2nbt s GLN 18 Ca 0.00 -0.18 -0.29 0.00 0.01 0.00 0.00 55.36 54.90 2nbt s GLN 18 Cb 0.00 -2.94 0.02 0.00 -1.01 0.00 0.00 33.01 29.08 2nbt s GLN 18 CO 0.00 0.54 1.26 -0.51 0.01 0.00 0.00 175.29 176.59 2nbt s ASP 19 N -2.32 6.50 -0.15 5.90 1.11 -1.26 -4.63 116.67 121.82 2nbt s ASP 19 Ca 0.37 0.64 -0.04 0.00 0.18 0.00 0.00 52.55 53.70 2nbt s ASP 19 Cb -0.13 -2.55 0.07 0.00 1.07 0.00 0.00 42.92 41.38 2nbt s ASP 19 CO 0.24 -1.33 0.16 -0.63 1.18 0.00 0.00 175.17 174.79 2nbt s ILE 20 N 4.90 -0.23 0.32 0.77 1.01 -1.26 -2.94 121.20 123.76 2nbt s ILE 20 Ca 0.54 0.06 -0.15 0.00 0.00 0.00 0.00 60.65 61.10 2nbt s ILE 20 Cb -0.10 -0.49 -0.09 0.00 0.01 0.00 0.00 42.46 41.79 2nbt s ILE 20 CO 0.32 -0.08 0.73 0.00 0.00 0.00 0.00 174.94 175.90 2nbt s PHE 22 N -1.97 -0.69 -0.02 0.00 2.19 -1.01 -3.09 117.98 113.38 2nbt s PHE 22 Ca 0.54 1.50 0.07 0.00 0.33 0.00 0.00 56.93 59.37 2nbt s PHE 22 Cb -0.10 0.33 -0.02 0.00 -1.31 0.00 0.00 43.02 41.92 2nbt s PHE 22 CO 0.18 -0.36 -0.24 -1.17 1.83 0.00 0.00 175.22 175.45 2nbt s LEU 23 N 1.13 2.04 -0.20 6.12 2.96 -0.94 -1.50 118.68 128.29 2nbt s LEU 23 Ca -0.07 -0.44 0.01 0.00 -0.22 0.00 0.00 54.13 53.41 2nbt s LEU 23 Cb -0.06 -1.25 0.03 0.00 0.50 0.00 0.00 46.19 45.41 2nbt s LEU 23 CO -0.11 0.29 -0.17 -0.75 -1.32 0.00 0.00 176.35 174.30 2nbt s LYS 24 N -0.51 2.67 -0.35 1.98 2.20 0.66 -3.39 119.74 123.00 2nbt s LYS 24 Ca 0.08 -0.94 0.04 0.00 -0.36 0.00 0.00 55.97 54.78 2nbt s LYS 24 Cb -0.10 -2.61 0.10 0.00 -1.51 0.00 0.00 37.83 33.72 2nbt s LYS 24 CO -0.00 -0.32 0.07 0.00 -0.36 0.00 0.00 175.35 174.73 2nbt s ALA 25 N 1.26 2.90 0.36 3.13 0.00 -0.84 -0.25 121.76 128.33 2nbt s ALA 25 Ca 0.01 -2.58 -0.09 0.00 0.00 0.00 0.00 51.96 49.30 2nbt s ALA 25 Cb -0.15 -1.98 0.03 0.00 0.00 0.00 0.00 23.12 21.02 2nbt s ALA 25 CO -0.10 -1.72 0.64 1.14 0.00 0.00 0.00 175.76 175.71 2nbt s GLN 26 N 0.82 2.08 0.32 0.00 -2.07 -0.89 0.28 119.66 120.20 2nbt s GLN 26 Ca 0.11 -1.59 -0.28 0.00 -1.82 0.00 0.00 55.36 51.79 2nbt s GLN 26 Cb -0.20 0.54 -0.09 0.00 -1.09 0.00 0.00 33.01 32.17 2nbt s GLN 26 CO -0.08 -0.92 1.07 0.00 -1.32 0.00 0.00 175.29 174.04 2nbt s ASP 28 N -1.13 2.82 0.21 0.00 2.15 -1.26 -4.84 116.67 114.62 2nbt s ASP 28 Ca 0.49 -0.58 0.00 0.00 0.43 0.00 0.00 52.55 52.88 2nbt s ASP 28 Cb -0.28 -1.14 0.00 0.00 -0.30 0.00 0.00 42.92 41.20 2nbt s ASP 28 CO 0.36 -0.10 0.00 0.29 -0.17 0.00 0.00 175.17 175.55 2nbt n LYS 29 N 4.78 -4.89 0.00 4.34 5.02 -1.26 -4.28 118.16 121.87 2nbt n LYS 29 Ca -0.15 3.52 0.00 0.00 -2.02 0.00 0.00 58.31 59.66 2nbt n LYS 29 Cb 0.49 -3.74 0.00 0.00 -0.02 0.00 0.00 35.03 31.76 2nbt n LYS 29 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2nbt n PHE 30 N 1.49 0.00 -1.83 2.13 3.72 -1.26 -4.48 117.46 117.23 2nbt n PHE 30 Ca 0.00 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.30 2nbt n PHE 30 Cb 0.00 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.52 2nbt n PHE 30 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2nbt n SER 32 N -0.86 0.00 0.00 0.00 7.64 -1.26 -4.84 113.62 114.30 2nbt n SER 32 Ca -0.10 -1.00 0.00 0.00 1.01 0.00 0.00 58.87 58.78 2nbt n SER 32 Cb 0.44 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 2nbt n SER 32 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2nbt n ILE 33 N 0.00 0.00 0.00 0.44 5.41 -1.26 -4.84 119.36 119.10 2nbt n ILE 33 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2nbt n ILE 33 Cb 0.50 -0.29 0.00 0.00 -0.71 0.00 0.00 39.64 39.14 2nbt n ILE 33 CO 0.00 0.00 0.00 -2.11 0.00 0.00 0.00 176.55 174.44 2nbt n ARG 34 N -1.03 6.36 0.00 0.38 1.85 -1.26 -5.13 116.66 117.83 2nbt n ARG 34 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2nbt n ARG 34 Cb 0.17 -0.47 0.00 0.00 -1.05 0.00 0.00 32.46 31.11 2nbt n ARG 34 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2nbt n GLY 35 N 0.94 -1.83 3.77 2.89 0.00 -1.26 -4.89 105.19 104.81 2nbt n GLY 35 Ca 0.00 -1.57 -0.38 0.00 0.00 0.00 0.00 46.02 44.07 2nbt n GLY 35 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2nbt s PRO 36 N 0.00 3.94 0.32 1.61 0.04 -1.26 -4.42 135.00 135.23 2nbt s PRO 36 Ca 0.00 1.82 0.10 0.00 0.04 0.00 0.00 61.00 62.97 2nbt s PRO 36 Cb 0.00 -2.58 -0.06 0.00 0.04 0.00 0.00 34.50 31.90 2nbt s PRO 36 CO 0.00 -0.41 -0.12 0.08 0.04 0.00 0.00 177.00 176.59 2nbt s VAL 37 N -1.46 2.38 -0.07 -0.36 1.01 -0.04 -4.93 120.40 116.93 2nbt s VAL 37 Ca 0.59 -2.25 0.03 0.00 0.00 0.00 0.00 61.98 60.35 2nbt s VAL 37 Cb -0.30 -2.54 0.00 0.00 0.00 0.00 0.00 36.38 33.54 2nbt s VAL 37 CO 0.37 -0.27 -0.17 -0.51 0.00 0.00 0.00 175.10 174.52 2nbt s ILE 38 N -2.56 1.52 -0.01 2.22 2.07 -1.26 -2.08 121.20 121.09 2nbt s ILE 38 Ca 0.32 -0.72 -0.02 0.00 -1.41 0.00 0.00 60.65 58.82 2nbt s ILE 38 Cb -0.00 -1.33 -0.00 0.00 0.13 0.00 0.00 42.46 41.25 2nbt s ILE 38 CO 0.16 0.44 0.04 -0.70 -1.91 0.00 0.00 174.94 172.97 2nbt s GLU 39 N 0.39 0.17 0.21 3.50 2.12 0.66 -5.00 118.70 120.74 2nbt s GLU 39 Ca -0.13 -0.16 -0.03 0.00 0.36 0.00 0.00 54.97 55.01 2nbt s GLU 39 Cb -0.15 0.07 -0.04 0.00 0.26 0.00 0.00 34.13 34.27 2nbt s GLU 39 CO 0.05 -0.03 0.18 1.14 -0.54 0.00 0.00 175.26 176.06 2nbt s GLN 40 N -0.52 1.25 0.00 4.30 -2.07 -1.26 0.24 119.66 121.60 2nbt s GLN 40 Ca -0.06 -1.58 0.00 0.00 -1.82 0.00 0.00 55.36 51.90 2nbt s GLN 40 Cb -0.04 0.30 0.00 0.00 -1.09 0.00 0.00 33.01 32.18 2nbt s GLN 40 CO -0.00 -0.43 0.00 0.41 -1.32 0.00 0.00 175.29 173.95 2nbt n GLY 41 N -0.29 -0.24 3.12 2.60 0.00 -0.57 -4.96 105.19 104.86 2nbt n GLY 41 Ca 0.02 -0.63 -0.15 0.00 0.00 0.00 0.00 46.02 45.26 2nbt n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nbt s VAL 43 N -1.75 0.00 0.00 0.00 1.01 -1.26 -4.89 120.40 113.50 2nbt s VAL 43 Ca -0.03 -1.71 0.00 0.00 0.00 0.00 0.00 61.98 60.24 2nbt s VAL 43 Cb -0.07 -2.60 0.00 0.00 0.00 0.00 0.00 36.38 33.71 2nbt s VAL 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.10 175.10 2nbt n ALA 44 N -0.57 0.00 -2.62 5.51 0.00 -1.26 -4.81 120.51 116.76 2nbt n ALA 44 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.16 2nbt n ALA 44 Cb 0.62 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.91 2nbt n ALA 44 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2nbt s THR 45 N 0.00 1.93 -0.10 0.00 2.01 -1.26 -4.91 115.64 113.32 2nbt s THR 45 Ca 0.00 -1.02 -0.31 0.00 0.31 0.00 0.00 61.69 60.67 2nbt s THR 45 Cb 0.00 -1.63 -0.09 0.00 0.01 0.00 0.00 72.50 70.80 2nbt s THR 45 CO 0.00 0.54 2.04 0.00 -0.69 0.00 0.00 174.62 176.51 2nbt s PRO 47 N 5.03 1.68 -0.08 0.00 0.04 -1.26 -4.80 135.00 135.61 2nbt s PRO 47 Ca 0.95 1.01 -0.02 0.00 0.04 0.00 0.00 61.00 62.98 2nbt s PRO 47 Cb -0.51 -1.84 -0.06 0.00 0.04 0.00 0.00 34.50 32.12 2nbt s PRO 47 CO 0.44 -2.00 1.35 0.00 0.04 0.00 0.00 177.00 176.83 2nbt n GLN 48 N -3.75 0.60 0.00 4.56 10.64 -1.26 -4.88 117.38 123.29 2nbt n GLN 48 Ca 0.08 -0.39 0.00 0.00 -1.83 0.00 0.00 57.00 54.86 2nbt n GLN 48 Cb 0.54 -1.74 0.00 0.00 -0.86 0.00 0.00 30.24 28.18 2nbt n GLN 48 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 2nbt n PHE 49 N 3.19 -0.17 -3.64 2.61 3.01 -1.26 -4.92 117.46 116.28 2nbt n PHE 49 Ca 0.13 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.53 2nbt n PHE 49 Cb 0.21 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.61 2nbt n PHE 49 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 2nbt s ARG 50 N 0.00 0.30 0.00 -1.08 6.06 -1.26 -5.01 118.95 117.96 2nbt s ARG 50 Ca 0.00 0.38 0.00 0.00 -2.50 0.00 0.00 55.73 53.61 2nbt s ARG 50 Cb 0.00 0.13 0.00 0.00 0.06 0.00 0.00 34.95 35.14 2nbt s ARG 50 CO 0.00 -0.04 0.71 -1.13 -2.50 0.00 0.00 175.30 172.34 2nbt n SER 51 N 2.19 0.26 -0.52 -2.12 3.41 -1.26 -3.36 113.62 112.22 2nbt n SER 51 Ca -0.13 -1.69 0.06 0.00 -0.26 0.00 0.00 58.87 56.85 2nbt n SER 51 Cb 0.56 -0.13 0.19 0.00 -0.26 0.00 0.00 64.21 64.57 2nbt n SER 51 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2nbt n ASN 52 N -0.32 2.17 -1.67 4.04 5.15 -1.26 -5.02 115.26 118.35 2nbt n ASN 52 Ca 0.00 -3.56 0.00 0.00 -0.60 0.00 0.00 54.58 50.42 2nbt n ASN 52 Cb 0.07 -0.51 0.00 0.00 -0.53 0.00 0.00 39.78 38.80 2nbt n ASN 52 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 2nbt n TYR 53 N -1.18 -1.73 0.02 1.20 4.02 -1.21 -5.01 117.16 113.26 2nbt n TYR 53 Ca 0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.09 2nbt n TYR 53 Cb 0.74 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 40.05 2nbt n TYR 53 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 2nbt n ARG 54 N -0.58 3.43 0.00 -0.72 3.00 0.14 -4.98 116.66 116.95 2nbt n ARG 54 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2nbt n ARG 54 Cb 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 32.46 31.69 2nbt n ARG 54 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2nbt n SER 55 N -1.27 0.00 -4.25 6.15 2.88 -0.98 -4.97 113.62 111.19 2nbt n SER 55 Ca 0.00 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.22 2nbt n SER 55 Cb 0.01 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.31 2nbt n SER 55 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 2nbt s LEU 56 N 0.00 2.22 -0.29 2.46 1.98 -1.26 -1.98 118.68 121.81 2nbt s LEU 56 Ca 0.00 -0.51 0.03 0.00 -2.89 0.00 0.00 54.13 50.76 2nbt s LEU 56 Cb 0.00 -1.45 0.07 0.00 0.66 0.00 0.00 46.19 45.47 2nbt s LEU 56 CO 0.00 0.16 -0.05 -0.22 -1.89 0.00 0.00 176.35 174.35 2nbt s LEU 57 N 0.36 3.92 -0.05 -0.68 0.20 -1.22 -4.97 118.68 116.25 2nbt s LEU 57 Ca -0.17 -1.68 0.01 0.00 0.69 0.00 0.00 54.13 52.98 2nbt s LEU 57 Cb -0.17 -1.57 -0.03 0.00 -0.43 0.00 0.00 46.19 43.98 2nbt s LEU 57 CO 0.08 -0.26 -0.06 0.00 -0.29 0.00 0.00 176.35 175.82 2nbt n THR 60 N -1.71 0.00 -3.85 0.00 -2.24 -1.26 -4.83 114.28 100.40 2nbt n THR 60 Ca -0.01 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.67 2nbt n THR 60 Cb 0.18 -1.03 -0.06 0.00 -2.10 0.00 0.00 70.33 67.33 2nbt n THR 60 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2nbt s THR 61 N -1.83 0.05 0.07 4.28 -4.23 -1.15 -4.67 115.64 108.16 2nbt s THR 61 Ca 0.00 -1.08 0.02 0.00 -1.18 0.00 0.00 61.69 59.45 2nbt s THR 61 Cb 0.00 -1.67 -0.04 0.00 1.34 0.00 0.00 72.50 72.13 2nbt s THR 61 CO 0.00 -0.24 0.11 -0.62 -0.54 0.00 0.00 174.62 173.33 2nbt s ASP 62 N -2.91 5.75 -1.34 3.99 2.15 -1.26 -3.90 116.67 119.15 2nbt s ASP 62 Ca 0.12 0.07 -0.04 0.00 0.43 0.00 0.00 52.55 53.13 2nbt s ASP 62 Cb 0.02 -1.62 0.02 0.00 -0.30 0.00 0.00 42.92 41.04 2nbt s ASP 62 CO -0.02 0.18 0.89 0.59 -0.17 0.00 0.00 175.17 176.63 2nbt n ASN 63 N 0.46 -2.81 -0.21 -0.34 5.03 -1.13 -4.88 115.26 111.37 2nbt n ASN 63 Ca -0.08 -0.73 0.08 0.00 0.87 0.00 0.00 54.58 54.72 2nbt n ASN 63 Cb 0.51 -4.36 0.14 0.00 -1.02 0.00 0.00 39.78 35.05 2nbt n ASN 63 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2nbt s ASN 65 N -2.76 1.99 0.00 0.00 3.84 -1.26 -5.08 114.94 111.67 2nbt s ASN 65 Ca 0.30 -0.63 0.00 0.00 0.21 0.00 0.00 52.86 52.74 2nbt s ASN 65 Cb 0.27 -0.09 0.00 0.00 -0.55 0.00 0.00 41.25 40.89 2nbt s ASN 65 CO 0.01 -0.02 0.00 1.57 -2.79 0.00 0.00 177.10 175.87