#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dyn s LEU 11 N 0.00 4.11 -0.09 9.51 2.96 -1.26 -5.05 118.68 128.86 2dyn s LEU 11 Ca 0.00 0.70 -0.24 0.00 -0.22 0.00 0.00 54.13 54.36 2dyn s LEU 11 Cb 0.00 -2.78 -0.03 0.00 0.50 0.00 0.00 46.19 43.88 2dyn s LEU 11 CO 0.00 -0.26 0.75 -0.69 -1.32 0.00 0.00 176.35 174.83 2dyn s VAL 12 N 2.02 4.99 -0.06 1.68 1.01 -1.26 -3.87 120.40 124.90 2dyn s VAL 12 Ca 0.25 1.53 -0.17 0.00 0.00 0.00 0.00 61.98 63.59 2dyn s VAL 12 Cb -0.16 -4.09 -0.30 0.00 0.00 0.00 0.00 36.38 31.84 2dyn s VAL 12 CO 0.09 0.18 0.73 0.40 0.00 0.00 0.00 175.10 176.51 2dyn h ILE 13 N 4.89 1.20 -1.97 2.22 2.04 -1.21 -3.49 117.51 121.19 2dyn h ILE 13 Ca -0.38 -2.49 0.03 0.00 1.00 0.00 0.00 64.86 63.02 2dyn h ILE 13 Cb 1.18 2.92 -0.19 0.00 -0.74 0.00 0.00 36.82 39.99 2dyn h ILE 13 CO 0.77 0.74 0.39 -0.60 0.00 0.00 0.00 178.15 179.45 2dyn s ARG 14 N -2.49 0.85 -0.01 2.37 3.52 -1.15 -5.03 118.95 117.02 2dyn s ARG 14 Ca -0.16 0.04 0.02 0.00 -0.13 0.00 0.00 55.73 55.50 2dyn s ARG 14 Cb 0.03 0.40 -0.00 0.00 -1.56 0.00 0.00 34.95 33.82 2dyn s ARG 14 CO 0.82 -0.30 -0.06 0.15 -0.81 0.00 0.00 175.30 175.10 2dyn s LYS 15 N -1.77 0.53 0.00 5.12 1.02 -1.26 -1.41 119.74 121.97 2dyn s LYS 15 Ca -0.03 -0.19 0.00 0.00 0.02 0.00 0.00 55.97 55.77 2dyn s LYS 15 Cb -0.00 -0.52 0.00 0.00 -0.52 0.00 0.00 37.83 36.79 2dyn s LYS 15 CO 0.01 0.10 0.00 0.41 -0.92 0.00 0.00 175.35 174.94 2dyn n GLY 16 N 3.11 0.33 3.82 -3.33 0.00 -0.85 -5.00 105.19 103.27 2dyn n GLY 16 Ca -0.15 -0.86 -0.37 0.00 0.00 0.00 0.00 46.02 44.64 2dyn n GLY 16 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dyn s TRP 17 N -2.00 3.73 0.04 1.61 0.52 -1.26 -0.48 118.94 121.10 2dyn s TRP 17 Ca 0.00 1.20 -0.05 0.00 0.02 0.00 0.00 56.10 57.27 2dyn s TRP 17 Cb 0.00 -2.45 -0.01 0.00 -1.15 0.00 0.00 33.47 29.85 2dyn s TRP 17 CO 0.00 0.53 0.09 -0.51 0.02 0.00 0.00 176.95 177.08 2dyn s LEU 18 N -1.42 1.83 -0.20 2.99 1.43 -0.79 -4.95 118.68 117.58 2dyn s LEU 18 Ca 0.32 -0.53 -0.07 0.00 -1.03 0.00 0.00 54.13 52.82 2dyn s LEU 18 Cb -0.18 0.58 -0.04 0.00 0.03 0.00 0.00 46.19 46.58 2dyn s LEU 18 CO 0.19 -0.50 0.06 -0.89 0.23 0.00 0.00 176.35 175.44 2dyn s THR 19 N -2.57 4.63 -0.47 5.49 2.01 -0.94 -1.04 115.64 122.75 2dyn s THR 19 Ca -0.05 -0.08 -0.24 0.00 0.31 0.00 0.00 61.69 61.62 2dyn s THR 19 Cb -0.01 -3.10 0.03 0.00 0.01 0.00 0.00 72.50 69.42 2dyn s THR 19 CO -0.04 0.43 0.86 -0.63 -0.69 0.00 0.00 174.62 174.55 2dyn s ILE 20 N 0.67 4.54 -0.20 1.82 1.01 -1.23 0.40 121.20 128.21 2dyn s ILE 20 Ca 0.03 0.52 0.21 0.00 0.00 0.00 0.00 60.65 61.40 2dyn s ILE 20 Cb -0.13 -4.40 0.21 0.00 0.01 0.00 0.00 42.46 38.15 2dyn s ILE 20 CO 0.02 -0.83 1.60 -1.13 0.00 0.00 0.00 174.94 174.60 2dyn h ASN 21 N 9.08 0.00 0.00 3.58 -1.24 -1.29 -3.38 115.58 122.33 2dyn h ASN 21 Ca -0.25 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.76 2dyn h ASN 21 Cb 1.08 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.13 2dyn h ASN 21 CO 1.01 0.24 -0.01 -0.46 -1.29 0.00 0.00 177.43 176.92 2dyn n ASN 22 N -3.20 1.99 -3.93 1.15 6.94 -1.26 -4.90 115.26 112.06 2dyn n ASN 22 Ca 0.02 -2.29 -0.30 0.00 -0.02 0.00 0.00 54.58 51.98 2dyn n ASN 22 Cb 0.59 -0.14 -0.15 0.00 -2.36 0.00 0.00 39.78 37.72 2dyn n ASN 22 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2dyn s ILE 23 N -1.52 2.00 0.00 1.53 1.01 -1.26 -4.88 121.20 118.08 2dyn s ILE 23 Ca 0.10 -2.37 0.00 0.00 0.00 0.00 0.00 60.65 58.38 2dyn s ILE 23 Cb 0.09 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 40.10 2dyn s ILE 23 CO 0.01 -0.68 0.00 0.61 0.00 0.00 0.00 174.94 174.88 2dyn n GLY 24 N 4.09 1.22 7.00 6.18 0.00 -1.26 -4.93 105.19 117.50 2dyn n GLY 24 Ca 0.03 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2dyn n GLY 24 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2dyn n ILE 25 N 0.00 0.00 0.29 -0.61 2.08 -0.60 -1.60 119.36 118.92 2dyn n ILE 25 Ca 0.00 0.00 0.14 0.00 0.56 0.00 0.00 62.75 63.45 2dyn n ILE 25 Cb 0.00 0.00 0.84 0.00 -0.75 0.00 0.00 39.64 39.73 2dyn n ILE 25 CO 0.00 0.00 0.00 0.24 0.56 0.00 0.00 176.55 177.35 2dyn h MET 26 N 0.00 0.00 -0.35 0.38 2.86 -1.99 -0.61 114.93 115.22 2dyn h MET 26 Ca 0.00 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.48 2dyn h MET 26 Cb 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 2dyn h MET 26 CO 0.00 0.02 -0.42 -0.22 1.06 0.00 0.00 176.91 177.35 2dyn h LYS 27 N 0.00 0.89 0.00 1.72 3.64 -1.73 -3.44 116.57 117.65 2dyn h LYS 27 Ca -0.00 -0.49 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 2dyn h LYS 27 Cb 0.06 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 2dyn h LYS 27 CO 0.00 1.13 0.00 0.41 -2.27 0.00 0.00 179.45 178.73 2dyn n GLY 28 N 0.17 -1.93 7.00 5.01 0.00 -0.70 -5.13 105.19 109.60 2dyn n GLY 28 Ca -0.03 0.92 0.00 0.00 0.00 0.00 0.00 46.02 46.92 2dyn n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dyn n GLY 29 N 0.00 3.71 1.30 -0.02 0.00 -0.32 -4.36 105.19 105.50 2dyn n GLY 29 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2dyn n GLY 29 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dyn n SER 30 N 6.08 0.45 -1.08 1.61 7.64 -1.26 -1.56 113.62 125.50 2dyn n SER 30 Ca 0.00 0.14 0.00 0.00 1.01 0.00 0.00 58.87 60.02 2dyn n SER 30 Cb 0.00 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 2dyn n SER 30 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2dyn n LYS 31 N -3.24 -2.92 -3.98 1.43 4.76 -1.26 -4.58 118.16 108.37 2dyn n LYS 31 Ca 0.00 2.24 -0.32 0.00 -2.87 0.00 0.00 58.31 57.36 2dyn n LYS 31 Cb 0.15 -2.70 -0.05 0.00 -1.84 0.00 0.00 35.03 30.58 2dyn n LYS 31 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2dyn s GLU 32 N -4.78 3.25 0.15 1.97 2.02 -1.26 -3.55 118.70 116.50 2dyn s GLU 32 Ca 0.00 -0.47 0.08 0.00 0.02 0.00 0.00 54.97 54.60 2dyn s GLU 32 Cb 0.00 -2.95 -0.04 0.00 0.10 0.00 0.00 34.13 31.24 2dyn s GLU 32 CO 0.00 0.62 -0.18 0.71 0.02 0.00 0.00 175.26 176.44 2dyn s TYR 33 N -1.38 1.73 -0.31 1.61 2.02 -0.20 -4.96 117.35 115.86 2dyn s TYR 33 Ca 0.30 -0.48 -0.20 0.00 -0.37 0.00 0.00 57.07 56.32 2dyn s TYR 33 Cb -0.13 -0.88 -0.01 0.00 -0.40 0.00 0.00 41.96 40.54 2dyn s TYR 33 CO 0.22 0.28 0.60 -0.46 -1.57 0.00 0.00 175.55 174.62 2dyn s TRP 34 N -1.96 3.21 -0.01 2.71 -0.11 -0.59 -1.88 118.94 120.31 2dyn s TRP 34 Ca 0.13 0.51 -0.03 0.00 1.22 0.00 0.00 56.10 57.93 2dyn s TRP 34 Cb -0.06 -2.97 -0.04 0.00 -1.50 0.00 0.00 33.47 28.90 2dyn s TRP 34 CO 0.06 -0.48 0.20 -0.06 -4.62 0.00 0.00 176.95 172.04 2dyn s PHE 35 N 2.56 3.56 -0.21 5.86 0.40 0.37 0.15 117.98 130.67 2dyn s PHE 35 Ca 0.24 0.40 -0.02 0.00 -0.60 0.00 0.00 56.93 56.95 2dyn s PHE 35 Cb -0.15 -1.86 0.06 0.00 0.51 0.00 0.00 43.02 41.58 2dyn s PHE 35 CO 0.12 0.64 0.01 0.08 0.70 0.00 0.00 175.22 176.77 2dyn s VAL 36 N -1.31 0.82 -0.21 -0.44 1.01 0.11 -2.00 120.40 118.37 2dyn s VAL 36 Ca 0.27 -0.75 -0.09 0.00 0.00 0.00 0.00 61.98 61.40 2dyn s VAL 36 Cb -0.13 -1.26 -0.05 0.00 0.00 0.00 0.00 36.38 34.95 2dyn s VAL 36 CO 0.18 -0.18 0.12 -0.22 0.00 0.00 0.00 175.10 175.00 2dyn s LEU 37 N 1.72 3.99 0.46 3.92 2.96 -0.50 -0.96 118.68 130.27 2dyn s LEU 37 Ca -0.02 0.10 0.03 0.00 -0.22 0.00 0.00 54.13 54.02 2dyn s LEU 37 Cb -0.18 -2.04 -0.03 0.00 0.50 0.00 0.00 46.19 44.44 2dyn s LEU 37 CO -0.07 0.11 0.02 0.42 -1.32 0.00 0.00 176.35 175.51 2dyn s THR 38 N 0.75 1.29 -0.51 3.68 -4.23 0.39 -0.63 115.64 116.38 2dyn s THR 38 Ca 0.06 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.81 2dyn s THR 38 Cb -0.13 -2.42 0.25 0.00 1.34 0.00 0.00 72.50 71.54 2dyn s THR 38 CO 0.02 0.00 1.72 0.00 -0.54 0.00 0.00 174.62 175.81 2dyn n ALA 39 N -1.12 1.72 -0.07 3.99 0.00 -1.25 -3.39 120.51 120.39 2dyn n ALA 39 Ca -0.13 0.07 -0.08 0.00 0.00 0.00 0.00 53.44 53.31 2dyn n ALA 39 Cb 0.67 -1.39 -0.11 0.00 0.00 0.00 0.00 19.45 18.62 2dyn n ALA 39 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2dyn n GLU 40 N -2.23 1.56 -3.68 0.00 1.02 -1.26 -4.90 120.64 111.14 2dyn n GLU 40 Ca 0.02 0.01 -0.10 0.00 -0.02 0.00 0.00 57.16 57.08 2dyn n GLU 40 Cb 0.25 -1.36 -0.03 0.00 -0.02 0.00 0.00 31.44 30.29 2dyn n GLU 40 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2dyn s ASN 41 N -4.84 -0.36 -0.20 1.62 4.22 -1.22 -2.10 114.94 112.06 2dyn s ASN 41 Ca -0.09 -0.37 -0.02 0.00 -2.14 0.00 0.00 52.86 50.24 2dyn s ASN 41 Cb 0.04 0.63 0.00 0.00 1.28 0.00 0.00 41.25 43.21 2dyn s ASN 41 CO 0.55 -1.12 -0.10 -0.22 -2.04 0.00 0.00 177.10 174.16 2dyn s LEU 42 N -2.85 2.61 0.10 3.54 2.96 0.11 -0.46 118.68 124.68 2dyn s LEU 42 Ca 0.07 -0.49 0.10 0.00 -0.22 0.00 0.00 54.13 53.60 2dyn s LEU 42 Cb -0.03 -1.64 -0.04 0.00 0.50 0.00 0.00 46.19 44.99 2dyn s LEU 42 CO -0.03 -0.01 -0.27 -0.44 -1.32 0.00 0.00 176.35 174.29 2dyn s SER 43 N 1.38 3.25 -0.01 3.68 0.01 -0.13 0.19 113.70 122.08 2dyn s SER 43 Ca 0.05 -0.70 0.04 0.00 1.31 0.00 0.00 55.95 56.65 2dyn s SER 43 Cb -0.14 -0.24 -0.01 0.00 0.21 0.00 0.00 66.02 65.84 2dyn s SER 43 CO -0.07 0.20 -0.13 -1.66 0.41 0.00 0.00 173.24 172.00 2dyn s TRP 44 N -0.98 1.18 0.42 2.43 -2.14 -0.73 0.08 118.94 119.20 2dyn s TRP 44 Ca 0.13 -0.23 0.05 0.00 2.66 0.00 0.00 56.10 58.71 2dyn s TRP 44 Cb -0.10 -0.76 -0.05 0.00 -3.10 0.00 0.00 33.47 29.45 2dyn s TRP 44 CO 0.05 -0.03 0.03 0.71 -2.66 0.00 0.00 176.95 175.05 2dyn s TYR 45 N -0.27 2.18 0.24 1.66 1.51 0.12 -1.04 117.35 121.76 2dyn s TYR 45 Ca 0.04 -0.86 -0.02 0.00 -1.01 0.00 0.00 57.07 55.22 2dyn s TYR 45 Cb -0.05 -1.58 0.29 0.00 -0.11 0.00 0.00 41.96 40.50 2dyn s TYR 45 CO -0.00 0.24 1.70 0.87 -1.11 0.00 0.00 175.55 177.25 2dyn h LYS 46 N 1.74 0.74 -3.14 -0.62 1.79 -1.66 -1.55 116.57 113.87 2dyn h LYS 46 Ca -0.43 -0.25 -0.01 0.00 -2.18 0.00 0.00 60.65 57.79 2dyn h LYS 46 Cb 1.26 -0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 31.82 2dyn h LYS 46 CO 0.75 0.83 0.19 0.16 -1.08 0.00 0.00 179.45 180.30 2dyn s ASP 47 N -6.71 -0.03 0.00 0.86 -4.77 -1.26 -4.46 116.67 100.30 2dyn s ASP 47 Ca -0.09 -0.96 0.08 0.00 -3.30 0.00 0.00 52.55 48.29 2dyn s ASP 47 Cb 0.14 0.77 0.46 0.00 -1.09 0.00 0.00 42.92 43.20 2dyn s ASP 47 CO 0.82 -1.49 1.01 -0.90 0.70 0.00 0.00 175.17 175.31 2dyn n ASP 48 N -0.97 0.00 0.12 2.11 5.75 -1.26 -1.40 116.55 120.90 2dyn n ASP 48 Ca -0.06 -0.10 0.13 0.00 -0.01 0.00 0.00 54.79 54.75 2dyn n ASP 48 Cb 0.60 -0.10 0.36 0.00 -1.03 0.00 0.00 41.12 40.94 2dyn n ASP 48 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 2dyn h GLU 49 N 0.00 0.00 -3.11 0.11 4.39 -2.00 -3.47 114.58 110.51 2dyn h GLU 49 Ca 0.00 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.45 2dyn h GLU 49 Cb 0.03 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.64 2dyn h GLU 49 CO 0.00 0.00 -0.29 0.39 -1.16 0.00 0.00 179.01 177.95 2dyn n GLU 50 N -2.38 -1.94 -0.00 2.33 1.02 -0.49 -4.84 120.64 114.33 2dyn n GLU 50 Ca 0.05 0.63 0.14 0.00 -0.02 0.00 0.00 57.16 57.96 2dyn n GLU 50 Cb 0.45 -5.12 0.51 0.00 -0.02 0.00 0.00 31.44 27.25 2dyn n GLU 50 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2dyn n LYS 51 N -2.51 1.69 -3.37 3.49 2.85 -1.26 -4.63 118.16 114.41 2dyn n LYS 51 Ca -0.14 -1.00 -0.17 0.00 -1.05 0.00 0.00 58.31 55.95 2dyn n LYS 51 Cb 0.55 -1.47 -0.08 0.00 -0.65 0.00 0.00 35.03 33.37 2dyn n LYS 51 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 177.40 175.35 2dyn s GLU 52 N -1.99 0.53 0.17 -1.58 2.12 -1.26 -5.10 118.70 111.58 2dyn s GLU 52 Ca 0.37 -0.60 -0.30 0.00 0.36 0.00 0.00 54.97 54.81 2dyn s GLU 52 Cb 0.21 -0.70 -0.07 0.00 0.26 0.00 0.00 34.13 33.83 2dyn s GLU 52 CO 0.33 -1.14 0.96 0.21 -0.54 0.00 0.00 175.26 175.09 2dyn s LYS 53 N 1.77 4.75 -0.17 4.30 2.20 -1.26 -1.82 119.74 129.52 2dyn s LYS 53 Ca 0.14 1.49 0.05 0.00 -0.36 0.00 0.00 55.97 57.29 2dyn s LYS 53 Cb -0.15 -3.33 -0.22 0.00 -1.51 0.00 0.00 37.83 32.62 2dyn s LYS 53 CO -0.14 0.32 0.16 1.63 -0.36 0.00 0.00 175.35 176.96 2dyn n LYS 54 N 2.25 0.69 -3.61 4.03 4.76 -0.20 -4.94 118.16 121.13 2dyn n LYS 54 Ca 0.01 0.18 -0.04 0.00 -2.87 0.00 0.00 58.31 55.58 2dyn n LYS 54 Cb 0.48 -1.62 -0.03 0.00 -1.84 0.00 0.00 35.03 32.02 2dyn n LYS 54 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 2dyn s TYR 55 N -2.54 -0.12 -0.13 2.13 5.04 -1.16 -5.02 117.35 115.56 2dyn s TYR 55 Ca -0.21 0.13 -0.00 0.00 -2.44 0.00 0.00 57.07 54.54 2dyn s TYR 55 Cb 0.07 0.50 0.03 0.00 0.35 0.00 0.00 41.96 42.91 2dyn s TYR 55 CO 0.74 -0.15 -0.07 1.41 -1.34 0.00 0.00 175.55 176.13 2dyn s MET 56 N -1.86 1.54 -0.18 4.97 -2.45 -1.26 -1.77 119.30 118.28 2dyn s MET 56 Ca 0.08 -0.32 -0.03 0.00 -1.25 0.00 0.00 55.69 54.17 2dyn s MET 56 Cb -0.01 -1.69 -0.02 0.00 1.25 0.00 0.00 34.83 34.36 2dyn s MET 56 CO -0.05 -0.30 -0.06 -1.17 1.05 0.00 0.00 175.02 174.50 2dyn s LEU 57 N 1.69 2.98 0.45 4.11 2.96 0.13 -4.96 118.68 126.03 2dyn s LEU 57 Ca 0.04 -0.29 -0.24 0.00 -0.22 0.00 0.00 54.13 53.43 2dyn s LEU 57 Cb -0.13 -1.73 -0.08 0.00 0.50 0.00 0.00 46.19 44.76 2dyn s LEU 57 CO -0.08 0.08 1.19 -0.55 -1.32 0.00 0.00 176.35 175.67 2dyn s SER 58 N 0.87 6.20 0.00 3.68 0.15 -1.26 0.07 113.70 123.41 2dyn s SER 58 Ca -0.01 2.37 0.29 0.00 0.70 0.00 0.00 55.95 59.29 2dyn s SER 58 Cb -0.15 -2.61 1.18 0.00 -1.71 0.00 0.00 66.02 62.73 2dyn s SER 58 CO 0.01 -0.90 1.82 1.33 1.20 0.00 0.00 173.24 176.70 2dyn n VAL 59 N -0.35 0.00 -1.96 4.45 0.24 -0.89 -4.81 118.33 115.00 2dyn n VAL 59 Ca 0.07 -0.21 -0.42 0.00 -2.04 0.00 0.00 64.34 61.73 2dyn n VAL 59 Cb 0.47 0.35 -0.03 0.00 -1.47 0.00 0.00 33.84 33.16 2dyn n VAL 59 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2dyn s ASP 60 N -2.00 6.62 -0.79 -1.34 1.01 -1.26 -2.40 116.67 116.51 2dyn s ASP 60 Ca 0.39 2.54 0.00 0.00 0.71 0.00 0.00 52.55 56.19 2dyn s ASP 60 Cb 0.21 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.56 2dyn s ASP 60 CO 0.34 -0.82 0.00 0.59 0.21 0.00 0.00 175.17 175.49 2dyn n ASN 61 N 4.46 -4.47 -4.86 0.27 3.02 -1.26 -4.96 115.26 107.46 2dyn n ASN 61 Ca 0.14 0.19 -0.36 0.00 -0.03 0.00 0.00 54.58 54.52 2dyn n ASN 61 Cb 0.40 -2.63 -0.06 0.00 -0.61 0.00 0.00 39.78 36.88 2dyn n ASN 61 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2dyn s LEU 62 N -1.70 4.40 0.28 3.41 1.43 -1.01 -1.14 118.68 124.35 2dyn s LEU 62 Ca 0.00 0.80 0.02 0.00 -1.03 0.00 0.00 54.13 53.92 2dyn s LEU 62 Cb 0.00 -2.73 -0.05 0.00 0.03 0.00 0.00 46.19 43.44 2dyn s LEU 62 CO 0.00 0.26 0.09 -0.54 0.23 0.00 0.00 176.35 176.39 2dyn s LYS 63 N -1.52 1.48 0.08 1.70 1.02 -0.52 -4.37 119.74 117.61 2dyn s LYS 63 Ca 0.28 -1.81 0.07 0.00 0.02 0.00 0.00 55.97 54.52 2dyn s LYS 63 Cb -0.15 -0.39 -0.03 0.00 -0.52 0.00 0.00 37.83 36.74 2dyn s LYS 63 CO 0.15 -0.28 -0.18 -1.17 -0.92 0.00 0.00 175.35 172.94 2dyn s LEU 64 N -3.36 2.26 0.02 3.17 0.20 -0.56 -1.80 118.68 118.62 2dyn s LEU 64 Ca 0.37 -0.62 -0.19 0.00 0.69 0.00 0.00 54.13 54.38 2dyn s LEU 64 Cb 0.08 -0.77 0.04 0.00 -0.43 0.00 0.00 46.19 45.11 2dyn s LEU 64 CO 0.14 0.03 0.43 0.00 -0.29 0.00 0.00 176.35 176.67 2dyn s ARG 65 N -1.69 0.89 0.46 1.98 1.70 -0.80 0.16 118.95 121.65 2dyn s ARG 65 Ca 0.04 -0.24 -0.17 0.00 -0.47 0.00 0.00 55.73 54.89 2dyn s ARG 65 Cb -0.10 0.40 -0.09 0.00 -0.57 0.00 0.00 34.95 34.59 2dyn s ARG 65 CO 0.03 -0.29 0.93 -0.51 -1.08 0.00 0.00 175.30 174.39 2dyn s ASP 66 N -1.74 6.74 -0.12 -2.89 1.01 -1.26 -0.78 116.67 117.63 2dyn s ASP 66 Ca -0.08 1.55 -0.04 0.00 0.71 0.00 0.00 52.55 54.70 2dyn s ASP 66 Cb -0.02 -2.49 0.05 0.00 1.01 0.00 0.00 42.92 41.47 2dyn s ASP 66 CO 0.01 -0.46 0.09 0.54 0.21 0.00 0.00 175.17 175.56 2dyn s VAL 67 N -2.39 -0.12 -0.34 -1.27 0.11 -1.06 -4.88 120.40 110.45 2dyn s VAL 67 Ca 0.59 0.09 -0.19 0.00 -2.93 0.00 0.00 61.98 59.54 2dyn s VAL 67 Cb -0.10 -0.40 -0.00 0.00 -1.53 0.00 0.00 36.38 34.35 2dyn s VAL 67 CO 0.24 -0.08 0.58 -0.70 -3.33 0.00 0.00 175.10 171.81 2dyn s GLU 68 N 2.17 3.69 -0.06 1.54 2.12 -1.26 -4.01 118.70 122.89 2dyn s GLU 68 Ca 0.03 0.01 -0.31 0.00 0.36 0.00 0.00 54.97 55.06 2dyn s GLU 68 Cb -0.14 -3.79 0.08 0.00 0.26 0.00 0.00 34.13 30.53 2dyn s GLU 68 CO -0.07 -0.67 0.73 0.21 -0.54 0.00 0.00 175.26 174.92 2dyn s LYS 69 N 2.56 0.99 0.00 4.30 2.20 -1.26 -5.09 119.74 123.44 2dyn s LYS 69 Ca 0.22 0.22 0.00 0.00 -0.36 0.00 0.00 55.97 56.05 2dyn s LYS 69 Cb -0.15 0.47 0.00 0.00 -1.51 0.00 0.00 37.83 36.64 2dyn s LYS 69 CO 0.14 -0.31 0.00 0.41 -0.36 0.00 0.00 175.35 175.22 2dyn n GLY 70 N 0.84 0.79 2.53 5.54 0.00 -1.26 -4.85 105.19 108.78 2dyn n GLY 70 Ca -0.18 -0.26 -0.19 0.00 0.00 0.00 0.00 46.02 45.39 2dyn n GLY 70 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2dyn n PHE 71 N 0.00 -0.13 0.11 1.61 7.35 -1.26 -4.69 117.46 120.44 2dyn n PHE 71 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2dyn n PHE 71 Cb 0.00 -3.34 0.00 0.00 0.35 0.00 0.00 39.48 36.49 2dyn n PHE 71 CO 0.00 0.00 0.00 -0.12 -0.76 0.00 0.00 176.76 175.88 2dyn n MET 72 N -2.50 0.00 -4.75 -4.13 1.56 -1.26 -5.08 117.12 100.96 2dyn n MET 72 Ca -0.20 0.00 -0.26 0.00 -0.27 0.00 0.00 57.70 56.97 2dyn n MET 72 Cb 0.64 -0.09 -0.17 0.00 2.15 0.00 0.00 33.22 35.76 2dyn n MET 72 CO 0.00 0.00 0.00 -1.12 -0.73 0.00 0.00 175.97 174.12 2dyn s SER 73 N -5.14 2.08 -0.16 6.12 0.01 -1.26 -5.09 113.70 110.27 2dyn s SER 73 Ca 0.00 -0.36 -0.36 0.00 1.31 0.00 0.00 55.95 56.54 2dyn s SER 73 Cb 0.00 -0.88 -0.13 0.00 0.21 0.00 0.00 66.02 65.22 2dyn s SER 73 CO 0.00 0.08 1.86 -1.20 0.41 0.00 0.00 173.24 174.39 2dyn n SER 74 N 3.62 3.09 -3.63 2.44 7.64 -1.26 -4.92 113.62 120.61 2dyn n SER 74 Ca -0.21 0.98 -0.14 0.00 1.01 0.00 0.00 58.87 60.50 2dyn n SER 74 Cb 0.52 -1.30 -0.06 0.00 -1.01 0.00 0.00 64.21 62.36 2dyn n SER 74 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2dyn s LYS 75 N 4.04 0.93 -0.09 1.43 2.20 -1.26 -5.01 119.74 121.98 2dyn s LYS 75 Ca 0.95 -0.17 0.00 0.00 -0.36 0.00 0.00 55.97 56.39 2dyn s LYS 75 Cb -0.81 0.42 0.02 0.00 -1.51 0.00 0.00 37.83 35.95 2dyn s LYS 75 CO 0.56 -0.31 -0.08 -1.01 -0.36 0.00 0.00 175.35 174.15 2dyn s HIS 76 N -2.00 1.35 0.12 4.03 3.76 -1.10 -4.94 115.29 116.52 2dyn s HIS 76 Ca -0.08 -0.60 0.10 0.00 -0.15 0.00 0.00 55.06 54.33 2dyn s HIS 76 Cb -0.01 -1.11 -0.04 0.00 1.11 0.00 0.00 32.58 32.53 2dyn s HIS 76 CO 0.01 -0.41 -0.22 0.42 -0.85 0.00 0.00 174.74 173.69 2dyn s ILE 77 N 1.40 2.57 -0.01 0.60 -1.09 -1.26 -1.13 121.20 122.28 2dyn s ILE 77 Ca -0.01 -1.62 -0.12 0.00 -2.23 0.00 0.00 60.65 56.67 2dyn s ILE 77 Cb -0.13 -2.16 0.02 0.00 -1.58 0.00 0.00 42.46 38.60 2dyn s ILE 77 CO -0.04 0.10 0.25 0.72 -1.23 0.00 0.00 174.94 174.74 2dyn s PHE 78 N -1.10 -0.11 0.09 3.97 -0.71 -0.87 -2.56 117.98 116.70 2dyn s PHE 78 Ca 0.16 0.16 0.05 0.00 -1.04 0.00 0.00 56.93 56.26 2dyn s PHE 78 Cb -0.10 0.05 -0.03 0.00 -1.21 0.00 0.00 43.02 41.72 2dyn s PHE 78 CO 0.08 -0.34 -0.12 0.00 -1.34 0.00 0.00 175.22 173.50 2dyn s ALA 79 N -1.26 1.20 -0.11 1.99 0.00 0.04 -0.43 121.76 123.19 2dyn s ALA 79 Ca -0.13 -1.14 -0.04 0.00 0.00 0.00 0.00 51.96 50.64 2dyn s ALA 79 Cb -0.06 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 2dyn s ALA 79 CO 0.03 0.05 0.04 -0.51 0.00 0.00 0.00 175.76 175.38 2dyn s LEU 80 N -2.22 3.78 0.00 0.00 1.43 -0.39 -1.90 118.68 119.39 2dyn s LEU 80 Ca 0.04 0.19 -0.05 0.00 -1.03 0.00 0.00 54.13 53.27 2dyn s LEU 80 Cb -0.06 -1.90 -0.00 0.00 0.03 0.00 0.00 46.19 44.26 2dyn s LEU 80 CO 0.01 0.34 0.09 0.72 0.23 0.00 0.00 176.35 177.74 2dyn s PHE 81 N -0.62 0.08 -0.16 0.29 -0.71 -0.74 -0.94 117.98 115.18 2dyn s PHE 81 Ca 0.11 -0.19 -0.20 0.00 -1.04 0.00 0.00 56.93 55.61 2dyn s PHE 81 Cb -0.12 -0.08 -0.03 0.00 -1.21 0.00 0.00 43.02 41.58 2dyn s PHE 81 CO 0.02 -0.24 0.58 1.21 -1.34 0.00 0.00 175.22 175.45 2dyn s ASN 82 N -1.25 6.70 0.43 1.98 3.84 -1.26 -1.44 114.94 123.94 2dyn s ASN 82 Ca -0.13 0.84 0.24 0.00 0.21 0.00 0.00 52.86 54.02 2dyn s ASN 82 Cb -0.08 -2.33 0.46 0.00 -0.55 0.00 0.00 41.25 38.76 2dyn s ASN 82 CO 0.01 -0.16 1.65 0.71 -2.79 0.00 0.00 177.10 176.52 2dyn h THR 83 N 4.99 0.00 -0.03 -5.21 1.35 -1.50 -3.22 112.91 109.30 2dyn h THR 83 Ca -0.36 -0.92 0.00 0.00 -0.55 0.00 0.00 66.41 64.59 2dyn h THR 83 Cb 1.16 1.91 0.00 0.00 -1.73 0.00 0.00 68.15 69.50 2dyn h THR 83 CO 0.76 0.00 -0.01 -0.62 -0.25 0.00 0.00 175.52 175.40 2dyn n GLU 84 N -3.03 2.21 -4.16 4.72 -0.58 -1.26 -4.97 120.64 113.57 2dyn n GLU 84 Ca 0.04 -1.77 -0.10 0.00 -0.42 0.00 0.00 57.16 54.90 2dyn n GLU 84 Cb 0.50 -1.46 -0.10 0.00 -0.57 0.00 0.00 31.44 29.81 2dyn n GLU 84 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2dyn s GLN 85 N -2.01 0.87 0.07 3.49 -0.21 -1.22 -5.05 119.66 115.60 2dyn s GLN 85 Ca 0.29 -1.38 0.13 0.00 0.02 0.00 0.00 55.36 54.42 2dyn s GLN 85 Cb 0.20 0.01 -0.16 0.00 1.00 0.00 0.00 33.01 34.06 2dyn s GLN 85 CO 0.31 -0.13 0.97 -0.09 -2.12 0.00 0.00 175.29 174.23 2dyn h ARG 86 N 2.92 0.00 -4.70 2.91 2.43 -1.93 -3.42 114.38 112.59 2dyn h ARG 86 Ca -0.35 0.00 -0.62 0.00 -0.81 0.00 0.00 59.98 58.20 2dyn h ARG 86 Cb 1.18 0.00 -0.36 0.00 -0.42 0.00 0.00 29.97 30.37 2dyn h ARG 86 CO 0.63 0.57 -0.83 -0.80 -1.51 0.00 0.00 179.97 178.03 2dyn s ASN 87 N -6.22 2.96 0.32 -3.80 0.01 -1.26 -4.35 114.94 102.60 2dyn s ASN 87 Ca -0.02 -0.63 0.12 0.00 -0.71 0.00 0.00 52.86 51.62 2dyn s ASN 87 Cb 0.09 -1.24 0.52 0.00 0.41 0.00 0.00 41.25 41.02 2dyn s ASN 87 CO 0.81 -0.08 1.70 1.62 -1.51 0.00 0.00 177.10 179.65 2dyn h VAL 88 N 6.14 1.36 -2.32 1.60 3.04 -1.29 -3.44 116.25 121.34 2dyn h VAL 88 Ca -0.36 -1.76 -0.04 0.00 -1.01 0.00 0.00 66.70 63.54 2dyn h VAL 88 Cb 1.12 1.95 -0.24 0.00 -2.01 0.00 0.00 31.29 32.11 2dyn h VAL 88 CO 0.53 0.50 -0.23 -0.47 -1.01 0.00 0.00 177.57 176.88 2dyn s TYR 89 N -3.85 -0.95 0.00 3.17 5.04 -1.23 -4.89 117.35 114.64 2dyn s TYR 89 Ca -0.02 1.79 0.00 0.00 -2.44 0.00 0.00 57.07 56.40 2dyn s TYR 89 Cb 0.13 0.48 0.00 0.00 0.35 0.00 0.00 41.96 42.93 2dyn s TYR 89 CO 0.75 -0.51 0.00 1.63 -1.34 0.00 0.00 175.55 176.07 2dyn n LYS 90 N 5.04 0.00 -0.98 4.97 5.02 -1.26 -1.08 118.16 129.86 2dyn n LYS 90 Ca -0.14 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.05 2dyn n LYS 90 Cb 0.52 0.00 0.24 0.00 -0.02 0.00 0.00 35.03 35.77 2dyn n LYS 90 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2dyn n ASP 91 N 3.86 3.85 -4.72 4.39 5.75 -1.26 -4.80 116.55 123.62 2dyn n ASP 91 Ca 0.00 -3.46 -0.36 0.00 -0.01 0.00 0.00 54.79 50.97 2dyn n ASP 91 Cb 0.00 -0.73 -0.08 0.00 -1.03 0.00 0.00 41.12 39.28 2dyn n ASP 91 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 2dyn s TYR 92 N -3.14 3.41 0.19 2.11 1.51 -0.24 -4.99 117.35 116.20 2dyn s TYR 92 Ca 0.52 0.38 -0.10 0.00 -1.01 0.00 0.00 57.07 56.86 2dyn s TYR 92 Cb 0.44 -2.22 0.12 0.00 -0.11 0.00 0.00 41.96 40.18 2dyn s TYR 92 CO 0.09 0.25 1.76 0.00 -1.11 0.00 0.00 175.55 176.54 2dyn h ARG 93 N 6.78 1.03 -3.78 -0.62 2.47 -1.86 -1.73 114.38 116.67 2dyn h ARG 93 Ca -0.41 -0.17 -0.08 0.00 -1.26 0.00 0.00 59.98 58.06 2dyn h ARG 93 Cb 1.16 -0.17 -0.14 0.00 -1.65 0.00 0.00 29.97 29.16 2dyn h ARG 93 CO 0.75 0.84 -0.35 1.14 0.56 0.00 0.00 179.97 182.91 2dyn s GLN 94 N -5.60 0.88 -0.45 0.04 -2.07 -1.26 -3.28 119.66 107.91 2dyn s GLN 94 Ca -0.13 -0.96 -0.12 0.00 -1.82 0.00 0.00 55.36 52.33 2dyn s GLN 94 Cb 0.14 0.35 0.08 0.00 -1.09 0.00 0.00 33.01 32.50 2dyn s GLN 94 CO 0.81 -0.29 0.34 -1.17 -1.32 0.00 0.00 175.29 173.66 2dyn s LEU 95 N -2.86 5.46 -0.26 2.60 2.96 -0.11 -4.93 118.68 121.54 2dyn s LEU 95 Ca 0.06 -1.47 -0.24 0.00 -0.22 0.00 0.00 54.13 52.26 2dyn s LEU 95 Cb 0.05 -2.09 -0.00 0.00 0.50 0.00 0.00 46.19 44.64 2dyn s LEU 95 CO -0.10 -0.62 0.82 -1.61 -1.32 0.00 0.00 176.35 173.52 2dyn s GLU 96 N 1.53 4.13 -0.15 1.98 2.02 -1.26 -1.26 118.70 125.68 2dyn s GLU 96 Ca 0.04 0.84 -0.02 0.00 0.02 0.00 0.00 54.97 55.85 2dyn s GLU 96 Cb -0.24 -3.67 -0.02 0.00 0.10 0.00 0.00 34.13 30.30 2dyn s GLU 96 CO 0.04 -0.56 -0.08 -0.51 0.02 0.00 0.00 175.26 174.17 2dyn s LEU 97 N 2.87 2.96 -0.08 1.80 1.43 0.42 -0.76 118.68 127.33 2dyn s LEU 97 Ca 0.34 -0.25 0.00 0.00 -1.03 0.00 0.00 54.13 53.19 2dyn s LEU 97 Cb -0.15 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 2dyn s LEU 97 CO 0.09 0.14 -0.07 0.00 0.23 0.00 0.00 176.35 176.74 2dyn s ALA 98 N 0.51 2.96 0.28 4.21 0.00 0.16 -2.04 121.76 127.84 2dyn s ALA 98 Ca -0.06 -0.88 0.10 0.00 0.00 0.00 0.00 51.96 51.12 2dyn s ALA 98 Cb -0.15 -1.27 -0.05 0.00 0.00 0.00 0.00 23.12 21.65 2dyn s ALA 98 CO 0.03 0.51 -0.15 0.00 0.00 0.00 0.00 175.76 176.15 2dyn h GLU 100 N 2.27 0.56 -5.22 0.00 4.81 -1.95 -2.90 114.58 112.15 2dyn h GLU 100 Ca -0.40 -0.58 -0.50 0.00 -0.13 0.00 0.00 59.36 57.75 2dyn h GLU 100 Cb 1.25 0.16 -0.14 0.00 0.63 0.00 0.00 28.75 30.65 2dyn h GLU 100 CO 0.64 1.20 -0.59 0.95 -0.73 0.00 0.00 179.01 180.48 2dyn s THR 101 N -3.35 1.16 0.19 0.32 -4.23 -1.26 -4.66 115.64 103.81 2dyn s THR 101 Ca -0.08 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.42 2dyn s THR 101 Cb 0.08 -2.73 -0.07 0.00 1.34 0.00 0.00 72.50 71.11 2dyn s THR 101 CO 0.89 0.00 1.49 -0.61 -0.54 0.00 0.00 174.62 175.85 2dyn h GLN 102 N 2.03 0.43 -0.42 3.99 5.75 -1.97 -2.97 115.11 121.95 2dyn h GLN 102 Ca -0.40 -0.31 0.03 0.00 -0.15 0.00 0.00 58.65 57.82 2dyn h GLN 102 Cb 1.25 0.05 -0.04 0.00 1.07 0.00 0.00 27.48 29.81 2dyn h GLN 102 CO 0.69 0.92 0.21 0.93 -2.65 0.00 0.00 178.83 178.93 2dyn h GLU 103 N 0.31 0.41 -0.39 1.69 4.39 -1.99 -1.57 114.58 117.43 2dyn h GLU 103 Ca -0.01 -0.02 -0.07 0.00 0.34 0.00 0.00 59.36 59.59 2dyn h GLU 103 Cb 1.18 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.72 2dyn h GLU 103 CO 0.11 0.27 -0.07 1.49 -1.16 0.00 0.00 179.01 179.65 2dyn h GLU 104 N 0.42 0.66 -0.04 2.33 4.81 -1.96 -0.68 114.58 120.13 2dyn h GLU 104 Ca 0.18 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2dyn h GLU 104 Cb 0.09 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 2dyn h GLU 104 CO -0.13 0.73 0.00 0.28 -0.73 0.00 0.00 179.01 179.16 2dyn h VAL 105 N 0.62 1.24 -0.04 0.32 2.07 -1.30 -0.90 116.25 118.26 2dyn h VAL 105 Ca 0.12 -0.72 -0.03 0.00 0.82 0.00 0.00 66.70 66.89 2dyn h VAL 105 Cb 0.48 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 2dyn h VAL 105 CO 0.03 0.19 -0.12 0.44 0.02 0.00 0.00 177.57 178.13 2dyn h ASP 106 N -0.22 0.05 -0.23 0.57 3.32 -1.17 0.55 116.42 119.29 2dyn h ASP 106 Ca 0.01 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 2dyn h ASP 106 Cb 0.31 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 2dyn h ASP 106 CO 0.00 0.18 -0.04 -1.28 -1.72 0.00 0.00 179.24 176.39 2dyn h SER 107 N 0.06 0.43 -0.27 6.45 0.87 -0.82 -2.54 113.55 117.73 2dyn h SER 107 Ca 0.01 -0.35 -0.15 0.00 -1.23 0.00 0.00 61.79 60.08 2dyn h SER 107 Cb 0.25 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 2dyn h SER 107 CO 0.02 0.68 -0.37 -0.50 -0.53 0.00 0.00 176.83 176.12 2dyn h TRP 108 N 0.18 0.96 -0.61 2.24 4.06 -0.60 -2.88 115.95 119.30 2dyn h TRP 108 Ca 0.06 -0.28 0.06 0.00 2.06 0.00 0.00 58.89 60.79 2dyn h TRP 108 Cb 0.48 -0.21 -0.05 0.00 -1.00 0.00 0.00 29.16 28.38 2dyn h TRP 108 CO 0.05 1.05 0.31 0.87 -3.56 0.00 0.00 178.44 177.16 2dyn h LYS 109 N 0.67 0.57 -0.50 0.49 1.57 -0.87 0.13 116.57 118.63 2dyn h LYS 109 Ca 0.06 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 2dyn h LYS 109 Cb 0.93 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.09 2dyn h LYS 109 CO 0.09 0.38 0.22 0.00 -0.57 0.00 0.00 179.45 179.56 2dyn h ALA 110 N 1.34 1.45 -0.26 3.86 0.00 -1.39 -1.52 119.26 122.74 2dyn h ALA 110 Ca 0.28 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 2dyn h ALA 110 Cb 0.20 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2dyn h ALA 110 CO -0.19 0.43 -0.21 0.77 0.00 0.00 0.00 179.25 180.04 2dyn h SER 111 N 0.70 0.64 -0.13 0.00 0.02 -0.98 -3.00 113.55 110.80 2dyn h SER 111 Ca 0.17 -0.45 -0.00 0.00 -0.84 0.00 0.00 61.79 60.66 2dyn h SER 111 Cb 0.11 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 2dyn h SER 111 CO -0.02 0.96 0.08 -0.26 -1.14 0.00 0.00 176.83 176.44 2dyn h PHE 112 N 0.33 0.20 -0.89 3.45 0.04 -0.58 -1.25 116.94 118.24 2dyn h PHE 112 Ca 0.05 0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.86 2dyn h PHE 112 Cb 0.76 -0.07 -0.05 0.00 2.20 0.00 0.00 35.95 38.79 2dyn h PHE 112 CO 0.07 0.15 0.58 1.25 -0.60 0.00 0.00 178.31 179.77 2dyn h LEU 113 N 0.21 0.94 -1.32 1.54 7.12 -1.14 0.06 115.31 122.73 2dyn h LEU 113 Ca 0.06 -0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.06 2dyn h LEU 113 Cb 0.02 -0.21 0.00 0.00 -0.53 0.00 0.00 40.66 39.94 2dyn h LEU 113 CO -0.01 0.64 0.00 0.03 -0.13 0.00 0.00 178.44 178.97 2dyn h ARG 114 N 1.09 0.00 -0.14 1.25 3.08 -1.21 -2.36 114.38 116.09 2dyn h ARG 114 Ca 0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.41 2dyn h ARG 114 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2dyn h ARG 114 CO -0.11 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.79 2dyn n ALA 115 N -2.00 2.48 -0.64 0.04 0.00 -0.09 -4.91 120.51 115.39 2dyn n ALA 115 Ca 0.01 -0.71 0.00 0.00 0.00 0.00 0.00 53.44 52.74 2dyn n ALA 115 Cb 0.27 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 18.81 2dyn n ALA 115 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dyn n GLY 116 N 1.34 0.65 3.39 0.00 0.00 -0.89 -4.89 105.19 104.79 2dyn n GLY 116 Ca 0.17 -0.26 -0.45 0.00 0.00 0.00 0.00 46.02 45.48 2dyn n GLY 116 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dyn s VAL 117 N -2.00 5.04 0.14 1.61 1.01 -0.63 -4.93 120.40 120.64 2dyn s VAL 117 Ca 0.00 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.03 2dyn s VAL 117 Cb 0.00 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 2dyn s VAL 117 CO 0.00 -0.82 0.26 -0.31 0.00 0.00 0.00 175.10 174.23 2dyn s TYR 118 N 2.13 3.45 0.59 5.22 2.02 -1.26 -3.59 117.35 125.92 2dyn s TYR 118 Ca 0.08 0.12 -0.18 0.00 -0.37 0.00 0.00 57.07 56.72 2dyn s TYR 118 Cb -0.24 -1.66 -0.04 0.00 -0.40 0.00 0.00 41.96 39.62 2dyn s TYR 118 CO 0.07 0.53 1.16 -1.25 -1.57 0.00 0.00 175.55 174.49 2dyn s PRO 119 N -3.12 3.05 0.00 -1.71 0.04 -1.26 -1.49 135.00 130.51 2dyn s PRO 119 Ca 0.34 1.67 0.12 0.00 0.04 0.00 0.00 61.00 63.17 2dyn s PRO 119 Cb -0.11 -1.96 0.71 0.00 0.04 0.00 0.00 34.50 33.18 2dyn s PRO 119 CO 0.28 -1.10 1.14 -1.91 0.04 0.00 0.00 177.00 175.45