#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i1o h LYS 13 N 0.00 0.00 -4.64 5.56 1.57 -1.92 -3.50 116.57 113.64 3i1o h LYS 13 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3i1o h LYS 13 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3i1o h LYS 13 CO 0.00 0.35 -0.34 1.04 -0.57 0.00 0.00 179.45 179.93 3i1o n GLN 14 N -3.17 -1.74 -0.04 3.15 6.02 -1.25 -4.96 117.38 115.39 3i1o n GLN 14 Ca 0.02 1.33 -0.17 0.00 -0.01 0.00 0.00 57.00 58.17 3i1o n GLN 14 Cb 0.68 -1.84 -0.14 0.00 1.02 0.00 0.00 30.24 29.96 3i1o n GLN 14 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 3i1o n VAL 15 N 2.05 1.65 0.00 5.09 0.31 -0.98 -4.96 118.33 121.49 3i1o n VAL 15 Ca -0.03 -0.69 0.00 0.00 -0.01 0.00 0.00 64.34 63.61 3i1o n VAL 15 Cb 0.05 -1.40 0.00 0.00 -0.91 0.00 0.00 33.84 31.58 3i1o n VAL 15 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3i1o n SER 16 N -3.28 0.00 -4.26 4.52 7.64 -1.25 -4.77 113.62 112.22 3i1o n SER 16 Ca -0.32 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.18 3i1o n SER 16 Cb 1.05 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 64.13 3i1o n SER 16 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3i1o s ASP 17 N 0.00 5.34 0.00 6.43 -0.00 -1.26 0.10 116.67 127.29 3i1o s ASP 17 Ca 0.00 -1.25 0.00 0.00 -0.00 0.00 0.00 52.55 51.30 3i1o s ASP 17 Cb 0.00 -1.88 0.00 0.00 -0.00 0.00 0.00 42.92 41.04 3i1o s ASP 17 CO 0.00 -0.37 0.00 0.61 -0.00 0.00 0.00 175.17 175.41 3i1o n GLY 18 N 4.80 6.60 2.94 0.21 0.00 0.19 -4.09 105.19 115.84 3i1o n GLY 18 Ca -0.11 -1.79 -0.13 0.00 0.00 0.00 0.00 46.02 43.99 3i1o n GLY 18 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i1o s VAL 19 N 0.08 0.21 -0.39 1.61 1.01 0.45 -2.03 120.40 121.34 3i1o s VAL 19 Ca 0.00 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.65 3i1o s VAL 19 Cb 0.00 -0.23 0.11 0.00 0.00 0.00 0.00 36.38 36.26 3i1o s VAL 19 CO 0.00 -0.09 0.13 0.00 0.00 0.00 0.00 175.10 175.14 3i1o s ALA 20 N -0.44 3.03 -0.22 5.51 0.00 0.46 -0.22 121.76 129.87 3i1o s ALA 20 Ca -0.03 -2.63 -0.22 0.00 0.00 0.00 0.00 51.96 49.08 3i1o s ALA 20 Cb -0.03 -2.14 -0.02 0.00 0.00 0.00 0.00 23.12 20.93 3i1o s ALA 20 CO -0.00 -1.77 0.68 -1.01 0.00 0.00 0.00 175.76 173.66 3i1o s HIS 21 N 0.82 3.33 -0.19 0.00 3.76 -0.30 -1.67 115.29 121.04 3i1o s HIS 21 Ca 0.11 0.95 -0.04 0.00 -0.15 0.00 0.00 55.06 55.93 3i1o s HIS 21 Cb -0.21 -2.88 -0.02 0.00 1.11 0.00 0.00 32.58 30.59 3i1o s HIS 21 CO -0.06 -0.28 -0.04 0.42 -0.85 0.00 0.00 174.74 173.93 3i1o s ILE 22 N 2.32 3.62 -0.92 0.60 1.09 -0.42 -1.26 121.20 126.22 3i1o s ILE 22 Ca 0.30 -0.43 -0.02 0.00 -1.10 0.00 0.00 60.65 59.39 3i1o s ILE 22 Cb -0.16 -2.61 0.23 0.00 -1.06 0.00 0.00 42.46 38.86 3i1o s ILE 22 CO 0.09 0.45 0.84 1.57 -0.10 0.00 0.00 174.94 177.79 3i1o n HIS 23 N 4.18 4.27 -2.60 3.97 -0.00 0.14 -3.10 115.22 122.08 3i1o n HIS 23 Ca -0.18 -4.08 -0.41 0.00 0.46 0.00 0.00 57.72 53.51 3i1o n HIS 23 Cb 0.52 -1.18 -0.03 0.00 -0.12 0.00 0.00 29.99 29.18 3i1o n HIS 23 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3i1o s ALA 24 N -1.45 2.81 1.00 1.57 0.00 -0.67 -2.20 121.76 122.83 3i1o s ALA 24 Ca 0.28 -2.34 -0.03 0.00 0.00 0.00 0.00 51.96 49.87 3i1o s ALA 24 Cb -0.06 -4.48 0.04 0.00 0.00 0.00 0.00 23.12 18.62 3i1o s ALA 24 CO -0.12 -3.53 0.22 -1.13 0.00 0.00 0.00 175.76 171.20 3i1o n SER 25 N 8.60 -0.09 0.05 0.00 3.41 -0.45 -2.65 113.62 122.49 3i1o n SER 25 Ca 0.32 -1.04 -0.04 0.00 -0.26 0.00 0.00 58.87 57.86 3i1o n SER 25 Cb 0.51 -0.17 -0.08 0.00 -0.26 0.00 0.00 64.21 64.20 3i1o n SER 25 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 3i1o h PHE 26 N -1.18 0.00 0.00 7.33 0.05 -1.95 -3.38 116.94 117.81 3i1o h PHE 26 Ca -0.07 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.72 3i1o h PHE 26 Cb 0.20 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.15 3i1o h PHE 26 CO 0.00 0.79 -0.13 0.27 -0.18 0.00 0.00 178.31 179.06 3i1o n ASN 27 N -3.14 1.36 -3.60 2.17 2.04 -1.26 -4.78 115.26 108.05 3i1o n ASN 27 Ca -0.06 -2.31 -0.04 0.00 -0.44 0.00 0.00 54.58 51.74 3i1o n ASN 27 Cb 0.90 -0.22 -0.02 0.00 -2.53 0.00 0.00 39.78 37.90 3i1o n ASN 27 CO 0.00 0.00 0.00 0.21 -0.44 0.00 0.00 177.26 177.03 3i1o s ASN 28 N -1.62 -0.15 0.02 0.53 2.47 -1.26 -4.27 114.94 110.65 3i1o s ASN 28 Ca 0.13 -0.04 0.04 0.00 0.42 0.00 0.00 52.86 53.41 3i1o s ASN 28 Cb 0.11 0.18 -0.02 0.00 -1.45 0.00 0.00 41.25 40.08 3i1o s ASN 28 CO 0.01 -0.31 -0.12 -0.89 -3.72 0.00 0.00 177.10 172.07 3i1o s THR 29 N -2.52 0.98 -0.07 -5.21 2.01 -1.26 -1.34 115.64 108.22 3i1o s THR 29 Ca 0.10 -0.79 -0.00 0.00 0.31 0.00 0.00 61.69 61.30 3i1o s THR 29 Cb 0.00 -0.87 0.03 0.00 0.01 0.00 0.00 72.50 71.67 3i1o s THR 29 CO -0.05 0.08 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.31 3i1o s ILE 30 N -0.65 0.49 -0.25 1.82 1.01 -0.93 -2.55 121.20 120.15 3i1o s ILE 30 Ca 0.02 -0.00 0.01 0.00 0.00 0.00 0.00 60.65 60.68 3i1o s ILE 30 Cb -0.07 -0.59 0.04 0.00 0.01 0.00 0.00 42.46 41.86 3i1o s ILE 30 CO 0.01 0.26 -0.10 -0.69 0.00 0.00 0.00 174.94 174.41 3i1o s VAL 31 N 1.58 2.41 -0.23 2.92 1.01 -0.68 0.26 120.40 127.68 3i1o s VAL 31 Ca -0.01 -1.35 -0.01 0.00 0.00 0.00 0.00 61.98 60.62 3i1o s VAL 31 Cb -0.13 -2.30 0.02 0.00 0.00 0.00 0.00 36.38 33.97 3i1o s VAL 31 CO -0.04 0.11 -0.10 -0.89 0.00 0.00 0.00 175.10 174.19 3i1o s THR 32 N 1.20 2.71 -0.03 3.92 2.01 -0.39 -0.65 115.64 124.42 3i1o s THR 32 Ca -0.04 -0.94 -0.20 0.00 0.31 0.00 0.00 61.69 60.82 3i1o s THR 32 Cb -0.18 -2.30 -0.05 0.00 0.01 0.00 0.00 72.50 69.98 3i1o s THR 32 CO -0.06 0.32 0.58 -0.63 -0.69 0.00 0.00 174.62 174.14 3i1o s ILE 33 N 1.33 4.97 0.07 1.82 -1.09 0.23 -1.15 121.20 127.38 3i1o s ILE 33 Ca 0.02 1.20 -0.10 0.00 -2.23 0.00 0.00 60.65 59.54 3i1o s ILE 33 Cb -0.15 -3.91 0.00 0.00 -1.58 0.00 0.00 42.46 36.82 3i1o s ILE 33 CO -0.07 0.39 0.22 0.28 -1.23 0.00 0.00 174.94 174.53 3i1o s THR 34 N 0.00 0.12 1.01 2.92 -1.32 0.69 -1.37 115.64 117.69 3i1o s THR 34 Ca 0.30 -0.99 -0.12 0.00 -1.21 0.00 0.00 61.69 59.68 3i1o s THR 34 Cb -0.18 -1.13 0.19 0.00 -1.51 0.00 0.00 72.50 69.87 3i1o s THR 34 CO 0.16 -0.55 1.08 1.51 -2.21 0.00 0.00 174.62 174.61 3i1o s ASP 35 N -2.49 2.46 0.37 8.08 3.84 -0.82 0.17 116.67 128.27 3i1o s ASP 35 Ca 0.00 1.43 0.23 0.00 -0.00 0.00 0.00 52.55 54.22 3i1o s ASP 35 Cb 0.02 -2.12 1.27 0.00 -1.38 0.00 0.00 42.92 40.71 3i1o s ASP 35 CO -0.08 -3.27 1.70 0.08 -0.00 0.00 0.00 175.17 173.61 3i1o h ARG 36 N -1.98 0.00 -0.81 2.11 0.11 -1.83 -1.42 114.38 110.55 3i1o h ARG 36 Ca -0.54 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.54 3i1o h ARG 36 Cb 1.31 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.39 3i1o h ARG 36 CO 0.54 0.00 0.00 1.04 0.10 0.00 0.00 179.97 181.65 3i1o n GLN 37 N -2.34 2.33 -3.10 0.08 1.13 -1.26 -4.85 117.38 109.38 3i1o n GLN 37 Ca -0.02 -1.10 -0.21 0.00 -1.94 0.00 0.00 57.00 53.73 3i1o n GLN 37 Cb 0.08 -1.74 0.00 0.00 0.11 0.00 0.00 30.24 28.70 3i1o n GLN 37 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3i1o n GLY 38 N 0.27 -0.50 3.19 1.08 0.00 -0.54 -4.94 105.19 103.76 3i1o n GLY 38 Ca 0.10 0.08 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 3i1o n GLY 38 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3i1o s ASN 39 N -2.57 3.88 0.57 1.61 3.84 -1.25 -4.95 114.94 116.07 3i1o s ASN 39 Ca 0.29 -0.70 -0.18 0.00 0.21 0.00 0.00 52.86 52.48 3i1o s ASN 39 Cb -0.15 -1.61 -0.12 0.00 -0.55 0.00 0.00 41.25 38.83 3i1o s ASN 39 CO 0.36 -0.06 0.16 0.00 -2.79 0.00 0.00 177.10 174.78 3i1o n ALA 40 N 4.67 -2.27 0.02 1.71 0.00 -1.26 -1.94 120.51 121.44 3i1o n ALA 40 Ca -0.18 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.18 3i1o n ALA 40 Cb 0.49 -1.60 0.00 0.00 0.00 0.00 0.00 19.45 18.34 3i1o n ALA 40 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3i1o n LEU 41 N 1.51 0.02 -3.63 0.00 4.77 -0.47 -4.70 117.00 114.50 3i1o n LEU 41 Ca 0.09 0.07 -0.11 0.00 -0.03 0.00 0.00 56.01 56.03 3i1o n LEU 41 Cb 0.48 0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.54 3i1o n LEU 41 CO 0.52 -0.44 0.60 -0.83 -1.33 0.00 0.00 177.39 175.91 3i1o s GLY 42 N -4.96 -0.32 0.10 -0.72 0.00 -0.65 -5.01 107.32 95.75 3i1o s GLY 42 Ca 0.00 2.36 0.02 0.00 0.00 0.00 0.00 44.72 47.10 3i1o s GLY 42 CO 0.00 1.75 -0.07 0.66 0.00 0.00 0.00 173.10 175.45 3i1o s TRP 43 N 0.21 0.89 -0.02 1.90 1.48 -1.26 0.76 118.94 122.90 3i1o s TRP 43 Ca 0.01 -0.91 -0.27 0.00 -1.06 0.00 0.00 56.10 53.87 3i1o s TRP 43 Cb -0.05 -0.52 0.06 0.00 -1.16 0.00 0.00 33.47 31.81 3i1o s TRP 43 CO -0.03 -0.15 0.61 0.00 -4.06 0.00 0.00 176.95 173.33 3i1o s ALA 44 N -3.59 -1.58 0.41 2.67 0.00 0.18 -4.92 121.76 114.94 3i1o s ALA 44 Ca 0.12 1.06 0.04 0.00 0.00 0.00 0.00 51.96 53.17 3i1o s ALA 44 Cb 0.05 0.10 -0.03 0.00 0.00 0.00 0.00 23.12 23.24 3i1o s ALA 44 CO -0.05 -0.39 0.11 0.95 0.00 0.00 0.00 175.76 176.38 3i1o s THR 45 N -1.49 0.72 0.00 0.00 -4.23 -1.26 -1.68 115.64 107.71 3i1o s THR 45 Ca -0.10 -2.00 -0.22 0.00 -1.18 0.00 0.00 61.69 58.19 3i1o s THR 45 Cb -0.01 -2.38 -0.12 0.00 1.34 0.00 0.00 72.50 71.32 3i1o s THR 45 CO 0.07 0.00 0.96 0.00 -0.54 0.00 0.00 174.62 175.11 3i1o h ALA 46 N 1.79 -0.85 -1.07 3.99 0.00 -1.74 -2.97 119.26 118.41 3i1o h ALA 46 Ca -0.37 -0.18 0.29 0.00 0.00 0.00 0.00 54.91 54.66 3i1o h ALA 46 Cb 1.27 0.31 -0.11 0.00 0.00 0.00 0.00 17.79 19.26 3i1o h ALA 46 CO 0.60 -0.79 0.67 0.78 0.00 0.00 0.00 179.25 180.51 3i1o h GLY 47 N -1.16 1.47 2.00 0.00 0.00 -1.87 0.45 103.07 103.96 3i1o h GLY 47 Ca -0.08 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.03 3i1o h GLY 47 CO 0.14 -0.24 0.00 0.61 0.00 0.00 0.00 176.54 177.04 3i1o n GLY 48 N -1.43 -1.28 0.97 4.60 0.00 -1.20 -1.45 105.19 105.40 3i1o n GLY 48 Ca 0.28 -0.02 0.09 0.00 0.00 0.00 0.00 46.02 46.37 3i1o n GLY 48 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3i1o n SER 49 N -1.79 2.81 -1.92 1.61 7.64 0.16 -4.92 113.62 117.21 3i1o n SER 49 Ca 0.04 -1.98 -0.01 0.00 1.01 0.00 0.00 58.87 57.93 3i1o n SER 49 Cb 0.26 -0.33 0.01 0.00 -1.01 0.00 0.00 64.21 63.14 3i1o n SER 49 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3i1o n GLY 50 N 1.35 -0.22 2.92 0.23 0.00 -0.53 -5.08 105.19 103.85 3i1o n GLY 50 Ca 0.18 -0.04 -0.14 0.00 0.00 0.00 0.00 46.02 46.02 3i1o n GLY 50 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3i1o s PHE 51 N -3.03 -0.18 -0.01 1.61 0.08 -1.21 -5.02 117.98 110.22 3i1o s PHE 51 Ca 0.04 0.53 0.06 0.00 0.12 0.00 0.00 56.93 57.67 3i1o s PHE 51 Cb -0.01 -0.11 -0.01 0.00 -0.57 0.00 0.00 43.02 42.32 3i1o s PHE 51 CO 0.19 -0.19 -0.18 1.03 -0.10 0.00 0.00 175.22 175.97 3i1o s ARG 52 N 1.38 1.48 7.94 0.44 1.81 -1.26 -4.05 118.95 126.70 3i1o s ARG 52 Ca -0.07 -0.67 0.00 0.00 -1.72 0.00 0.00 55.73 53.27 3i1o s ARG 52 Cb -0.12 -1.44 0.00 0.00 -0.45 0.00 0.00 34.95 32.94 3i1o s ARG 52 CO -0.06 0.39 0.00 0.41 -0.68 0.00 0.00 175.30 175.36 3i1o n GLY 53 N 2.59 3.63 0.29 -3.53 0.00 -1.26 -3.54 105.19 103.37 3i1o n GLY 53 Ca -0.15 -0.08 0.06 0.00 0.00 0.00 0.00 46.02 45.85 3i1o n GLY 53 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3i1o h SER 54 N 0.00 -0.46 -0.62 1.61 4.64 -1.96 -0.74 113.55 116.02 3i1o h SER 54 Ca 0.00 0.22 -0.06 0.00 -0.47 0.00 0.00 61.79 61.48 3i1o h SER 54 Cb 0.00 0.40 -0.03 0.00 -0.31 0.00 0.00 62.40 62.47 3i1o h SER 54 CO 0.00 -0.22 0.15 0.03 -0.87 0.00 0.00 176.83 175.92 3i1o h ARG 55 N 0.07 0.99 -0.85 4.77 -0.00 -1.94 -2.95 114.38 114.47 3i1o h ARG 55 Ca 0.43 -0.24 0.20 0.00 -0.50 0.00 0.00 59.98 59.87 3i1o h ARG 55 Cb 0.77 -0.13 -0.16 0.00 0.00 0.00 0.00 29.97 30.44 3i1o h ARG 55 CO -0.74 0.90 -0.12 1.17 0.00 0.00 0.00 179.97 181.18 3i1o n LYS 56 N -4.34 -0.07 -1.19 0.04 4.81 -0.28 -0.33 118.16 116.79 3i1o n LYS 56 Ca 0.04 1.30 -0.26 0.00 -0.87 0.00 0.00 58.31 58.51 3i1o n LYS 56 Cb 0.24 -2.00 0.13 0.00 0.02 0.00 0.00 35.03 33.42 3i1o n LYS 56 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 3i1o n SER 57 N -5.32 5.37 -4.63 3.14 3.41 -1.11 -4.52 113.62 109.96 3i1o n SER 57 Ca 0.16 -3.57 -0.32 0.00 -0.26 0.00 0.00 58.87 54.89 3i1o n SER 57 Cb 0.52 -0.89 -0.10 0.00 -0.26 0.00 0.00 64.21 63.48 3i1o n SER 57 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3i1o s THR 58 N -3.65 3.80 0.21 6.66 -4.23 0.55 -4.35 115.64 114.64 3i1o s THR 58 Ca 0.56 -0.82 -0.10 0.00 -1.18 0.00 0.00 61.69 60.15 3i1o s THR 58 Cb 0.45 -2.70 0.17 0.00 1.34 0.00 0.00 72.50 71.76 3i1o s THR 58 CO 0.05 0.31 1.70 1.55 -0.54 0.00 0.00 174.62 177.70 3i1o h PRO 59 N 4.20 0.24 -0.17 3.99 0.13 -1.87 0.96 132.00 139.48 3i1o h PRO 59 Ca -0.48 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.60 3i1o h PRO 59 Cb 1.17 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 3i1o h PRO 59 CO 0.55 0.16 -0.02 0.35 -0.23 0.00 0.00 178.00 178.82 3i1o h PHE 60 N 0.25 0.25 0.00 1.56 3.57 -1.96 0.32 116.94 120.93 3i1o h PHE 60 Ca 0.32 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.81 3i1o h PHE 60 Cb 0.49 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.15 3i1o h PHE 60 CO -0.26 0.28 0.00 0.00 -2.23 0.00 0.00 178.31 176.10 3i1o h ALA 61 N 1.74 1.00 0.05 2.41 0.00 -1.09 -2.79 119.26 120.57 3i1o h ALA 61 Ca 0.06 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.73 3i1o h ALA 61 Cb 0.20 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3i1o h ALA 61 CO 0.01 0.00 -1.26 0.00 0.00 0.00 0.00 179.25 178.00 3i1o h ALA 62 N 2.08 0.23 0.00 0.00 0.00 0.57 -3.31 119.26 118.83 3i1o h ALA 62 Ca 0.00 -1.12 -0.03 0.00 0.00 0.00 0.00 54.91 53.76 3i1o h ALA 62 Cb 0.50 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 3i1o h ALA 62 CO 0.00 0.74 -0.12 -0.56 0.00 0.00 0.00 179.25 179.30 3i1o h GLN 63 N -0.68 0.00 0.00 0.00 3.07 -0.88 0.42 115.11 117.04 3i1o h GLN 63 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.43 3i1o h GLN 63 Cb 1.48 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.04 3i1o h GLN 63 CO -0.08 0.12 0.00 1.33 0.09 0.00 0.00 178.83 180.30 3i1o n VAL 64 N -4.34 0.65 -0.08 1.86 0.24 -1.06 -1.13 118.33 114.47 3i1o n VAL 64 Ca -0.03 -0.03 -0.21 0.00 -2.04 0.00 0.00 64.34 62.03 3i1o n VAL 64 Cb 0.20 -0.81 -0.12 0.00 -1.47 0.00 0.00 33.84 31.63 3i1o n VAL 64 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3i1o n ALA 65 N -1.73 1.16 -0.09 2.33 0.00 0.48 -2.38 120.51 120.28 3i1o n ALA 65 Ca 0.04 -0.88 -0.09 0.00 0.00 0.00 0.00 53.44 52.51 3i1o n ALA 65 Cb 0.33 -0.30 -0.02 0.00 0.00 0.00 0.00 19.45 19.46 3i1o n ALA 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i1o h ALA 66 N -0.16 0.39 -0.30 0.00 0.00 -0.28 0.22 119.26 119.13 3i1o h ALA 66 Ca -0.53 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.17 3i1o h ALA 66 Cb 1.85 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.52 3i1o h ALA 66 CO -0.09 -0.12 -0.49 1.49 0.00 0.00 0.00 179.25 180.04 3i1o h GLU 67 N 0.39 0.84 -0.03 0.00 4.81 -1.33 -1.74 114.58 117.52 3i1o h GLU 67 Ca 0.11 -0.50 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 3i1o h GLU 67 Cb 0.00 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.43 3i1o h GLU 67 CO -0.02 1.13 0.00 -2.13 -0.73 0.00 0.00 179.01 177.26 3i1o n ARG 68 N -4.02 0.66 -2.48 1.92 0.63 -0.99 -1.17 116.66 111.22 3i1o n ARG 68 Ca -0.03 0.00 -0.25 0.00 -0.92 0.00 0.00 57.85 56.65 3i1o n ARG 68 Cb 0.60 -1.02 0.00 0.00 0.45 0.00 0.00 32.46 32.50 3i1o n ARG 68 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3i1o n ALA 70 N -0.45 0.00 0.30 0.00 0.00 -1.03 -4.74 120.51 114.59 3i1o n ALA 70 Ca 0.36 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.99 3i1o n ALA 70 Cb 0.69 0.00 0.88 0.00 0.00 0.00 0.00 19.45 21.02 3i1o n ALA 70 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3i1o h ASP 71 N 0.00 0.00 0.00 0.00 3.45 -1.38 -2.86 116.42 115.63 3i1o h ASP 71 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3i1o h ASP 71 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 3i1o h ASP 71 CO 0.00 0.00 -0.31 0.00 -1.57 0.00 0.00 179.24 177.36 3i1o n ALA 72 N -2.08 1.69 0.00 3.45 0.00 -1.26 -4.86 120.51 117.45 3i1o n ALA 72 Ca -0.01 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.68 3i1o n ALA 72 Cb 0.22 -0.31 0.00 0.00 0.00 0.00 0.00 19.45 19.36 3i1o n ALA 72 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3i1o n VAL 73 N 0.00 0.00 0.41 0.00 0.24 -1.21 -4.72 118.33 113.04 3i1o n VAL 73 Ca 0.00 -0.18 -0.04 0.00 -2.04 0.00 0.00 64.34 62.08 3i1o n VAL 73 Cb 0.62 0.71 0.07 0.00 -1.47 0.00 0.00 33.84 33.78 3i1o n VAL 73 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 3i1o n LYS 74 N -0.77 1.62 -0.02 7.34 4.81 -1.08 -3.93 118.16 126.12 3i1o n LYS 74 Ca 0.00 -0.86 0.13 0.00 -0.87 0.00 0.00 58.31 56.71 3i1o n LYS 74 Cb 0.00 -1.47 0.57 0.00 0.02 0.00 0.00 35.03 34.15 3i1o n LYS 74 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3i1o n GLU 75 N 0.09 1.43 -0.19 1.64 -0.58 -1.26 -2.47 120.64 119.31 3i1o n GLU 75 Ca 0.14 -0.64 0.05 0.00 -0.42 0.00 0.00 57.16 56.28 3i1o n GLU 75 Cb 0.72 -1.42 0.14 0.00 -0.57 0.00 0.00 31.44 30.31 3i1o n GLU 75 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3i1o n TYR 76 N -0.18 0.48 -3.22 -0.32 4.01 -1.25 -4.42 117.16 112.25 3i1o n TYR 76 Ca 0.18 -0.22 -0.22 0.00 -0.16 0.00 0.00 57.90 57.47 3i1o n TYR 76 Cb 0.25 -0.04 0.01 0.00 -0.31 0.00 0.00 39.34 39.25 3i1o n TYR 76 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3i1o n GLY 77 N 0.91 -0.50 3.69 2.72 0.00 -1.03 -2.31 105.19 108.67 3i1o n GLY 77 Ca 0.11 0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 3i1o n GLY 77 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3i1o s ILE 78 N -3.00 3.29 -0.00 -0.61 -0.00 -1.26 -3.91 121.20 115.72 3i1o s ILE 78 Ca 0.35 0.75 -0.00 0.00 -0.00 0.00 0.00 60.65 61.75 3i1o s ILE 78 Cb -0.18 -3.48 -0.00 0.00 -0.00 0.00 0.00 42.46 38.80 3i1o s ILE 78 CO 0.44 0.00 -0.00 0.11 -0.00 0.00 0.00 174.94 175.49 3i1o h LYS 79 N 7.96 0.00 -5.57 0.37 1.79 0.32 -3.47 116.57 117.98 3i1o h LYS 79 Ca -0.41 0.00 -0.67 0.00 -2.18 0.00 0.00 60.65 57.40 3i1o h LYS 79 Cb 1.19 0.00 -0.27 0.00 -1.58 0.00 0.00 32.23 31.57 3i1o h LYS 79 CO 0.91 0.00 -0.78 -0.80 -1.08 0.00 0.00 179.45 177.70 3i1o s ASN 80 N -3.36 3.88 -0.02 0.86 0.01 0.17 -1.32 114.94 115.16 3i1o s ASN 80 Ca -0.00 -0.33 0.03 0.00 -0.71 0.00 0.00 52.86 51.84 3i1o s ASN 80 Cb 0.00 -1.39 -0.00 0.00 0.41 0.00 0.00 41.25 40.27 3i1o s ASN 80 CO 0.00 0.21 -0.09 -1.48 -1.51 0.00 0.00 177.10 174.23 3i1o s LEU 81 N 0.10 1.86 0.27 0.60 -0.00 -0.92 0.55 118.68 121.13 3i1o s LEU 81 Ca -0.07 -0.18 -0.21 0.00 -0.00 0.00 0.00 54.13 53.68 3i1o s LEU 81 Cb -0.15 -0.51 -0.09 0.00 -0.00 0.00 0.00 46.19 45.44 3i1o s LEU 81 CO 0.05 0.08 0.79 -1.83 -0.00 0.00 0.00 176.35 175.43 3i1o s GLU 82 N 0.06 4.30 -0.10 1.48 1.03 -0.86 -2.81 118.70 121.81 3i1o s GLU 82 Ca -0.01 0.96 -0.04 0.00 0.03 0.00 0.00 54.97 55.91 3i1o s GLU 82 Cb -0.07 -2.78 -0.04 0.00 -0.80 0.00 0.00 34.13 30.44 3i1o s GLU 82 CO 0.00 0.32 0.09 0.08 -1.33 0.00 0.00 175.26 174.42 3i1o s VAL 83 N -1.62 5.01 -0.16 1.83 1.01 0.17 -0.41 120.40 126.23 3i1o s VAL 83 Ca 0.47 -0.01 -0.00 0.00 0.00 0.00 0.00 61.98 62.43 3i1o s VAL 83 Cb -0.16 -3.17 0.04 0.00 0.00 0.00 0.00 36.38 33.09 3i1o s VAL 83 CO 0.21 0.59 -0.06 -0.04 0.00 0.00 0.00 175.10 175.80 3i1o s MET 84 N -1.05 1.49 -0.08 2.72 -1.94 -0.67 -0.98 119.30 118.78 3i1o s MET 84 Ca 0.15 -0.49 0.01 0.00 -1.71 0.00 0.00 55.69 53.66 3i1o s MET 84 Cb -0.12 -1.95 -0.02 0.00 2.01 0.00 0.00 34.83 34.74 3i1o s MET 84 CO 0.05 -0.40 -0.11 0.08 -0.01 0.00 0.00 175.02 174.63 3i1o s VAL 85 N 1.63 3.33 -0.14 -6.03 1.01 -0.77 -1.31 120.40 118.13 3i1o s VAL 85 Ca 0.01 -0.60 -0.11 0.00 0.00 0.00 0.00 61.98 61.28 3i1o s VAL 85 Cb -0.15 -2.36 0.04 0.00 0.00 0.00 0.00 36.38 33.91 3i1o s VAL 85 CO -0.08 0.57 0.35 -1.59 0.00 0.00 0.00 175.10 174.36 3i1o s LYS 86 N -0.44 0.40 0.00 2.72 -2.85 -1.18 -0.07 119.74 118.32 3i1o s LYS 86 Ca 0.06 0.53 0.00 0.00 -1.00 0.00 0.00 55.97 55.56 3i1o s LYS 86 Cb -0.12 0.15 0.00 0.00 -2.06 0.00 0.00 37.83 35.80 3i1o s LYS 86 CO 0.02 -0.07 0.00 0.41 0.10 0.00 0.00 175.35 175.81 3i1o n GLY 87 N 3.17 0.75 0.00 0.59 0.00 -1.26 -1.68 105.19 106.77 3i1o n GLY 87 Ca -0.15 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 43.90 3i1o n GLY 87 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3i1o n PRO 88 N 1.05 3.48 0.00 1.61 -0.04 -1.08 -4.83 135.00 135.19 3i1o n PRO 88 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 3i1o n PRO 88 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 3i1o n PRO 88 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3i1o n GLY 89 N 5.00 -1.94 0.00 0.55 0.00 -1.26 -4.05 105.19 103.49 3i1o n GLY 89 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.62 3i1o n GLY 89 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3i1o n PRO 90 N 0.00 0.00 0.00 1.61 -0.04 -1.26 -3.90 135.00 131.41 3i1o n PRO 90 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 3i1o n PRO 90 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 3i1o n PRO 90 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3i1o n GLY 91 N 0.00 0.00 4.43 0.55 0.00 -1.26 -4.27 105.19 104.64 3i1o n GLY 91 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3i1o n GLY 91 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3i1o n ARG 92 N -0.18 0.00 0.05 1.61 3.00 -1.25 0.66 116.66 120.55 3i1o n ARG 92 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.85 57.78 3i1o n ARG 92 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 32.46 32.34 3i1o n ARG 92 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.63 178.68 3i1o h GLU 93 N 0.00 0.00 0.02 -0.14 4.11 -1.89 -3.38 114.58 113.31 3i1o h GLU 93 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3i1o h GLU 93 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3i1o h GLU 93 CO 0.00 0.91 -0.08 1.03 0.07 0.00 0.00 179.01 180.94 3i1o h SER 94 N 0.00 -0.24 -0.96 3.06 0.87 0.01 -2.90 113.55 113.39 3i1o h SER 94 Ca -0.06 0.02 0.16 0.00 -1.23 0.00 0.00 61.79 60.69 3i1o h SER 94 Cb 1.81 0.09 -0.16 0.00 -0.44 0.00 0.00 62.40 63.69 3i1o h SER 94 CO 0.12 -0.09 -0.33 1.07 -0.53 0.00 0.00 176.83 177.07 3i1o n THR 95 N -2.88 -0.48 -0.25 2.23 5.66 -0.67 0.34 114.28 118.23 3i1o n THR 95 Ca -0.01 2.24 0.06 0.00 -3.05 0.00 0.00 64.05 63.29 3i1o n THR 95 Cb 0.06 -3.00 0.18 0.00 -1.55 0.00 0.00 70.33 66.02 3i1o n THR 95 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 175.07 172.42 3i1o h ILE 96 N 0.00 0.40 -0.33 1.09 2.04 -1.70 -1.51 117.51 117.49 3i1o h ILE 96 Ca 0.37 -0.06 0.03 0.00 1.00 0.00 0.00 64.86 66.21 3i1o h ILE 96 Cb 0.61 0.22 -0.04 0.00 -0.74 0.00 0.00 36.82 36.87 3i1o h ILE 96 CO -0.97 0.03 -0.21 0.03 0.00 0.00 0.00 178.15 177.04 3i1o h ARG 97 N 0.16 -0.01 -0.98 2.37 3.08 0.09 0.16 114.38 119.25 3i1o h ARG 97 Ca 0.42 0.00 0.18 0.00 0.07 0.00 0.00 59.98 60.66 3i1o h ARG 97 Cb 0.75 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.70 3i1o h ARG 97 CO -0.61 -0.01 0.58 0.00 -1.07 0.00 0.00 179.97 178.87 3i1o h ALA 98 N -0.51 1.60 -0.43 0.04 0.00 -1.30 -1.01 119.26 117.66 3i1o h ALA 98 Ca 0.05 0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.07 3i1o h ALA 98 Cb 0.15 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3i1o h ALA 98 CO -0.32 -0.05 0.23 1.25 0.00 0.00 0.00 179.25 180.36 3i1o h LEU 99 N 0.75 0.35 0.12 0.00 5.85 -0.10 0.20 115.31 122.48 3i1o h LEU 99 Ca 0.56 0.02 0.01 0.00 0.84 0.00 0.00 57.88 59.31 3i1o h LEU 99 Cb 0.85 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.81 3i1o h LEU 99 CO -0.38 0.25 -0.16 -1.13 -0.34 0.00 0.00 178.44 176.68 3i1o h ASN 100 N 0.46 -0.45 -0.37 1.25 -1.24 0.09 -3.22 115.58 112.10 3i1o h ASN 100 Ca 0.18 0.05 0.06 0.00 0.71 0.00 0.00 56.30 57.30 3i1o h ASN 100 Cb 0.06 0.16 -0.08 0.00 0.73 0.00 0.00 38.32 39.19 3i1o h ASN 100 CO -0.11 -0.24 -0.49 0.00 -1.29 0.00 0.00 177.43 175.30 3i1o h ALA 101 N 0.49 -0.61 -0.89 1.57 0.00 -0.07 -1.51 119.26 118.24 3i1o h ALA 101 Ca 0.02 0.03 0.25 0.00 0.00 0.00 0.00 54.91 55.20 3i1o h ALA 101 Cb 0.34 0.99 -0.17 0.00 0.00 0.00 0.00 17.79 18.95 3i1o h ALA 101 CO -0.07 -0.96 0.02 0.00 0.00 0.00 0.00 179.25 178.24 3i1o n ALA 102 N -3.06 0.46 0.00 0.00 0.00 0.58 -4.77 120.51 113.72 3i1o n ALA 102 Ca -0.02 0.96 0.00 0.00 0.00 0.00 0.00 53.44 54.38 3i1o n ALA 102 Cb 0.35 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 19.10 3i1o n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i1o n GLY 103 N -1.45 2.13 2.41 0.00 0.00 -0.57 -5.13 105.19 102.58 3i1o n GLY 103 Ca 0.21 -0.22 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 3i1o n GLY 103 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3i1o n PHE 104 N 0.00 -0.27 -2.96 1.61 3.01 -1.23 -4.85 117.46 112.76 3i1o n PHE 104 Ca 0.00 0.69 -0.42 0.00 1.01 0.00 0.00 57.45 58.73 3i1o n PHE 104 Cb 0.00 -1.39 -0.05 0.00 -0.01 0.00 0.00 39.48 38.02 3i1o n PHE 104 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 3i1o s ARG 105 N -0.64 3.69 -0.75 -1.08 3.00 -0.43 -4.59 118.95 118.15 3i1o s ARG 105 Ca 0.47 0.23 -0.27 0.00 -1.00 0.00 0.00 55.73 55.17 3i1o s ARG 105 Cb -0.68 -3.83 0.02 0.00 0.00 0.00 0.00 34.95 30.46 3i1o s ARG 105 CO 0.40 -0.90 1.39 -1.50 0.00 0.00 0.00 175.30 174.68 3i1o s ILE 106 N 3.14 3.68 -0.11 4.11 2.07 -1.26 -2.16 121.20 130.67 3i1o s ILE 106 Ca 0.31 0.27 -0.21 0.00 -1.41 0.00 0.00 60.65 59.61 3i1o s ILE 106 Cb -0.13 -4.78 -0.18 0.00 0.13 0.00 0.00 42.46 37.50 3i1o s ILE 106 CO 0.18 -1.72 0.63 0.74 -1.91 0.00 0.00 174.94 172.87 3i1o h THR 107 N 6.24 1.21 -2.35 4.00 2.02 -1.90 -3.48 112.91 118.65 3i1o h THR 107 Ca -0.23 -1.78 -0.05 0.00 0.77 0.00 0.00 66.41 65.12 3i1o h THR 107 Cb 1.06 2.24 -0.24 0.00 -1.74 0.00 0.00 68.15 69.47 3i1o h THR 107 CO 1.28 0.39 -0.19 0.21 0.37 0.00 0.00 175.52 177.58 3i1o s ASN 108 N -5.92 -0.68 -0.52 4.18 2.47 -1.26 -4.99 114.94 108.22 3i1o s ASN 108 Ca -0.13 1.18 -0.10 0.00 0.42 0.00 0.00 52.86 54.23 3i1o s ASN 108 Cb -0.02 1.22 0.13 0.00 -1.45 0.00 0.00 41.25 41.14 3i1o s ASN 108 CO 0.50 -0.22 0.40 -0.63 -3.72 0.00 0.00 177.10 173.43 3i1o s ILE 109 N 1.83 4.36 0.21 -5.21 1.01 -1.26 0.41 121.20 122.54 3i1o s ILE 109 Ca -0.08 -1.93 0.02 0.00 0.00 0.00 0.00 60.65 58.66 3i1o s ILE 109 Cb -0.08 -3.85 -0.03 0.00 0.01 0.00 0.00 42.46 38.51 3i1o s ILE 109 CO -0.16 -0.81 0.36 0.42 0.00 0.00 0.00 174.94 174.74 3i1o s THR 110 N 1.15 5.26 -0.09 2.92 -4.23 -0.15 -5.00 115.64 115.50 3i1o s THR 110 Ca 0.08 -0.69 -0.00 0.00 -1.18 0.00 0.00 61.69 59.90 3i1o s THR 110 Cb -0.25 -3.79 0.02 0.00 1.34 0.00 0.00 72.50 69.83 3i1o s THR 110 CO -0.01 -0.23 -0.05 -0.62 -0.54 0.00 0.00 174.62 173.17 3i1o s ASP 111 N -3.52 1.83 -0.37 3.99 3.68 -1.26 -1.86 116.67 119.16 3i1o s ASP 111 Ca 0.36 -0.21 0.11 0.00 2.13 0.00 0.00 52.55 54.93 3i1o s ASP 111 Cb -0.10 -0.67 0.44 0.00 -1.45 0.00 0.00 42.92 41.14 3i1o s ASP 111 CO 0.29 -0.13 1.06 1.33 0.13 0.00 0.00 175.17 177.86 3i1o n VAL 112 N 4.83 1.82 -2.08 1.11 0.24 0.90 -4.92 118.33 120.23 3i1o n VAL 112 Ca -0.13 -4.07 -0.42 0.00 -2.04 0.00 0.00 64.34 57.68 3i1o n VAL 112 Cb 0.50 -0.40 -0.03 0.00 -1.47 0.00 0.00 33.84 32.44 3i1o n VAL 112 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3i1o s THR 113 N -4.48 3.17 0.09 3.34 2.01 -1.21 -4.71 115.64 113.84 3i1o s THR 113 Ca 0.39 0.76 -0.33 0.00 0.31 0.00 0.00 61.69 62.82 3i1o s THR 113 Cb 0.42 -3.49 -0.13 0.00 0.01 0.00 0.00 72.50 69.31 3i1o s THR 113 CO -0.08 0.04 1.72 -0.81 -0.69 0.00 0.00 174.62 174.80 3i1o n PRO 114 N 4.53 2.34 -3.70 4.92 -0.04 -1.26 -4.96 135.00 136.83 3i1o n PRO 114 Ca 0.13 0.85 -0.30 0.00 -0.04 0.00 0.00 63.50 64.14 3i1o n PRO 114 Cb 0.41 -2.67 -0.13 0.00 -0.04 0.00 0.00 33.50 31.07 3i1o n PRO 114 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 3i1o s ILE 115 N 2.14 1.24 0.61 0.52 2.07 -1.26 -5.04 121.20 121.47 3i1o s ILE 115 Ca 0.83 -2.31 -0.19 0.00 -1.41 0.00 0.00 60.65 57.56 3i1o s ILE 115 Cb -0.63 -1.88 -0.03 0.00 0.13 0.00 0.00 42.46 40.05 3i1o s ILE 115 CO 0.41 -0.87 1.19 -0.81 -1.91 0.00 0.00 174.94 172.95 3i1o n PRO 116 N 3.78 1.16 -0.88 3.50 -0.04 -1.26 -4.87 135.00 136.38 3i1o n PRO 116 Ca 0.07 0.44 -0.15 0.00 -0.04 0.00 0.00 63.50 63.83 3i1o n PRO 116 Cb 0.36 -2.41 0.02 0.00 -0.04 0.00 0.00 33.50 31.43 3i1o n PRO 116 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3i1o n HIS 117 N -1.65 1.27 -1.79 0.54 8.25 -1.26 -4.79 115.22 115.79 3i1o n HIS 117 Ca 0.14 -1.81 -0.01 0.00 -0.26 0.00 0.00 57.72 55.78 3i1o n HIS 117 Cb 0.47 -0.94 0.00 0.00 1.12 0.00 0.00 29.99 30.64 3i1o n HIS 117 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3i1o n ASN 118 N 0.62 -3.31 0.00 0.41 5.03 -1.26 -5.09 115.26 111.66 3i1o n ASN 118 Ca 0.27 0.16 0.00 0.00 0.87 0.00 0.00 54.58 55.88 3i1o n ASN 118 Cb 0.57 -1.96 0.00 0.00 -1.02 0.00 0.00 39.78 37.37 3i1o n ASN 118 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3i1o n GLY 119 N -0.33 0.61 3.73 7.41 0.00 -1.26 -5.07 105.19 110.28 3i1o n GLY 119 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 3i1o n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i1o n ARG 121 N 3.02 1.21 -2.63 0.00 1.74 -1.26 -5.01 116.66 113.73 3i1o n ARG 121 Ca -0.00 0.45 -0.29 0.00 -0.77 0.00 0.00 57.85 57.23 3i1o n ARG 121 Cb 0.50 -2.14 -0.01 0.00 -1.02 0.00 0.00 32.46 29.79 3i1o n ARG 121 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 3i1o s PRO 122 N -2.38 3.65 0.02 5.56 0.02 -1.26 -5.02 135.00 135.60 3i1o s PRO 122 Ca 0.69 0.39 -0.30 0.00 0.02 0.00 0.00 61.00 61.79 3i1o s PRO 122 Cb -0.48 -2.34 -0.08 0.00 0.02 0.00 0.00 34.50 31.62 3i1o s PRO 122 CO 0.53 -0.18 1.86 -1.25 -0.33 0.00 0.00 177.00 177.62 3i1o s PRO 123 N -4.42 4.15 0.06 5.54 0.04 -1.26 -4.91 135.00 134.21 3i1o s PRO 123 Ca 0.50 2.49 -0.12 0.00 0.04 0.00 0.00 61.00 63.90 3i1o s PRO 123 Cb -0.10 -4.03 -0.03 0.00 0.04 0.00 0.00 34.50 30.38 3i1o s PRO 123 CO 0.40 -0.90 1.22 -0.22 0.04 0.00 0.00 177.00 177.53 3i1o h LYS 124 N 9.98 -0.02 0.00 4.56 3.64 -2.05 -3.43 116.57 129.25 3i1o h LYS 124 Ca -0.46 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 3i1o h LYS 124 Cb 1.22 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 3i1o h LYS 124 CO 0.94 -0.02 0.00 1.63 -2.27 0.00 0.00 179.45 179.74 3i1o n LYS 125 N -3.88 0.00 -0.49 1.90 5.02 -1.26 -4.92 118.16 114.53 3i1o n LYS 125 Ca 0.00 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.14 3i1o n LYS 125 Cb 0.11 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.13 3i1o n LYS 125 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3i1o n ARG 126 N 14.00 0.00 0.00 1.97 5.12 -1.26 -4.96 116.66 131.53 3i1o n ARG 126 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 3i1o n ARG 126 Cb 0.00 -0.41 0.00 0.00 -1.16 0.00 0.00 32.46 30.89 3i1o n ARG 126 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 3i1o n ARG 127 N 0.73 0.00 0.00 5.56 0.63 -1.26 -5.25 116.66 117.07 3i1o n ARG 127 Ca 0.02 0.00 0.14 0.00 -0.92 0.00 0.00 57.85 57.10 3i1o n ARG 127 Cb 0.20 0.00 0.58 0.00 0.45 0.00 0.00 32.46 33.69 3i1o n ARG 127 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40