#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 4.58 -0.23 9.51 2.96 -1.26 -4.94 118.68 129.30 2dyn s LEU 11 Ca 0.00 2.16 -0.27 0.00 -0.22 0.00 0.00 54.13 55.80 2dyn s LEU 11 Cb 0.00 -3.62 0.00 0.00 0.50 0.00 0.00 46.19 43.07 2dyn s LEU 11 CO 0.00 -0.04 0.95 -0.69 -1.32 0.00 0.00 176.35 175.25 2dyn s VAL 12 N -1.15 4.75 0.02 1.68 1.01 -1.26 -3.50 120.40 121.95 2dyn s VAL 12 Ca 0.43 1.84 -0.17 0.00 0.00 0.00 0.00 61.98 64.08 2dyn s VAL 12 Cb -0.30 -4.23 -0.35 0.00 0.00 0.00 0.00 36.38 31.50 2dyn s VAL 12 CO 0.38 -0.12 0.99 0.40 0.00 0.00 0.00 175.10 176.74 2dyn h ILE 13 N 5.42 1.32 -1.99 2.22 2.04 -0.15 -3.49 117.51 122.88 2dyn h ILE 13 Ca -0.21 -2.65 0.07 0.00 1.00 0.00 0.00 64.86 63.06 2dyn h ILE 13 Cb 1.08 3.05 -0.19 0.00 -0.74 0.00 0.00 36.82 40.02 2dyn h ILE 13 CO 0.93 0.79 0.46 -0.60 0.00 0.00 0.00 178.15 179.73 2dyn s ARG 14 N -2.60 0.79 -0.01 2.37 3.52 -1.00 -5.01 118.95 117.00 2dyn s ARG 14 Ca -0.10 -0.06 0.00 0.00 -0.13 0.00 0.00 55.73 55.45 2dyn s ARG 14 Cb 0.04 0.37 0.01 0.00 -1.56 0.00 0.00 34.95 33.80 2dyn s ARG 14 CO 0.93 -0.30 -0.00 0.15 -0.81 0.00 0.00 175.30 175.27 2dyn s LYS 15 N -2.10 0.11 -0.24 5.12 1.02 -1.26 -1.05 119.74 121.34 2dyn s LYS 15 Ca -0.00 0.03 -0.37 0.00 0.02 0.00 0.00 55.97 55.65 2dyn s LYS 15 Cb -0.01 -0.22 0.16 0.00 -0.52 0.00 0.00 37.83 37.24 2dyn s LYS 15 CO -0.02 -0.05 1.40 0.20 -0.92 0.00 0.00 175.35 175.96 2dyn s GLY 16 N 0.45 -0.27 0.27 -3.33 0.00 -0.83 -5.00 107.32 98.60 2dyn s GLY 16 Ca -0.04 1.69 -0.27 0.00 0.00 0.00 0.00 44.72 46.09 2dyn s GLY 16 CO -0.01 0.53 0.92 -0.98 0.00 0.00 0.00 173.10 173.55 2dyn s TRP 17 N -2.03 3.82 0.03 1.90 0.52 -1.26 -0.84 118.94 121.08 2dyn s TRP 17 Ca 0.13 1.80 -0.07 0.00 0.02 0.00 0.00 56.10 57.97 2dyn s TRP 17 Cb 0.01 -2.91 -0.00 0.00 -1.15 0.00 0.00 33.47 29.42 2dyn s TRP 17 CO -0.03 0.34 0.14 -0.51 0.02 0.00 0.00 176.95 176.90 2dyn s LEU 18 N -1.63 1.60 -0.22 2.99 1.43 -0.53 -4.93 118.68 117.38 2dyn s LEU 18 Ca 0.45 -0.38 -0.08 0.00 -1.03 0.00 0.00 54.13 53.09 2dyn s LEU 18 Cb -0.22 0.73 -0.04 0.00 0.03 0.00 0.00 46.19 46.69 2dyn s LEU 18 CO 0.27 -0.48 0.08 -0.89 0.23 0.00 0.00 176.35 175.56 2dyn s THR 19 N -2.19 4.69 -0.54 5.49 2.01 -1.02 -0.75 115.64 123.33 2dyn s THR 19 Ca -0.08 -0.06 -0.25 0.00 0.31 0.00 0.00 61.69 61.61 2dyn s THR 19 Cb -0.03 -3.16 0.04 0.00 0.01 0.00 0.00 72.50 69.36 2dyn s THR 19 CO -0.02 0.39 0.99 -0.63 -0.69 0.00 0.00 174.62 174.66 2dyn s ILE 20 N 0.98 4.33 -0.77 1.82 1.01 0.21 -0.11 121.20 128.67 2dyn s ILE 20 Ca 0.04 0.53 0.25 0.00 0.00 0.00 0.00 60.65 61.48 2dyn s ILE 20 Cb -0.14 -4.56 0.25 0.00 0.01 0.00 0.00 42.46 38.03 2dyn s ILE 20 CO 0.03 -1.10 1.77 -3.20 0.00 0.00 0.00 174.94 172.44 2dyn n ASN 21 N 7.61 0.51 -2.31 3.58 4.05 -0.00 -2.83 115.26 125.87 2dyn n ASN 21 Ca 0.04 0.57 -0.26 0.00 0.45 0.00 0.00 54.58 55.39 2dyn n ASN 21 Cb 0.48 -0.70 0.01 0.00 1.23 0.00 0.00 39.78 40.80 2dyn n ASN 21 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 177.26 173.75 2dyn n ASN 22 N -2.01 4.75 -4.77 1.20 6.94 -1.26 -4.69 115.26 115.42 2dyn n ASN 22 Ca 0.05 -3.71 -0.39 0.00 -0.02 0.00 0.00 54.58 50.51 2dyn n ASN 22 Cb 0.34 -0.42 -0.06 0.00 -2.36 0.00 0.00 39.78 37.29 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 -5.16 4.81 0.26 1.53 -1.09 -1.26 -4.99 121.20 115.31 2dyn s ILE 23 Ca 0.49 1.35 -0.30 0.00 -2.23 0.00 0.00 60.65 59.96 2dyn s ILE 23 Cb 0.40 -3.98 -0.10 0.00 -1.58 0.00 0.00 42.46 37.20 2dyn s ILE 23 CO -0.10 0.43 1.44 -0.83 -1.23 0.00 0.00 174.94 174.65 2dyn s GLY 24 N -0.36 2.39 0.44 6.18 0.00 -1.26 -4.16 107.32 110.55 2dyn s GLY 24 Ca 0.33 1.35 0.22 0.00 0.00 0.00 0.00 44.72 46.62 2dyn s GLY 24 CO 0.19 2.27 1.82 -2.22 0.00 0.00 0.00 173.10 175.16 2dyn h ILE 25 N 3.46 0.56 -0.63 0.90 5.03 -1.91 0.19 117.51 125.11 2dyn h ILE 25 Ca -0.46 -0.10 0.18 0.00 -0.12 0.00 0.00 64.86 64.36 2dyn h ILE 25 Cb 1.22 0.25 -0.03 0.00 -3.03 0.00 0.00 36.82 35.23 2dyn h ILE 25 CO 0.76 0.05 0.48 0.24 -0.68 0.00 0.00 178.15 179.00 2dyn h MET 26 N 0.29 0.00 0.00 2.37 2.86 -2.00 0.36 114.93 118.81 2dyn h MET 26 Ca 0.53 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 58.07 2dyn h MET 26 Cb 1.53 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.17 2dyn h MET 26 CO -0.18 0.00 -1.64 1.17 1.06 0.00 0.00 176.91 177.33 2dyn n LYS 27 N -4.22 0.64 0.00 1.72 3.00 0.64 -5.01 118.16 114.93 2dyn n LYS 27 Ca 0.12 0.02 0.00 0.00 -0.00 0.00 0.00 58.31 58.45 2dyn n LYS 27 Cb 0.73 -1.68 0.00 0.00 0.00 0.00 0.00 35.03 34.08 2dyn n LYS 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2dyn n GLY 28 N 1.34 2.16 0.00 3.14 0.00 0.13 -5.06 105.19 106.89 2dyn n GLY 28 Ca -0.08 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 0.71 3.69 -0.02 0.00 -1.23 -4.72 105.19 103.62 2dyn n GLY 29 Ca 0.00 -2.08 -0.42 0.00 0.00 0.00 0.00 46.02 43.52 2dyn n GLY 29 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dyn s SER 30 N -4.00 6.48 0.15 1.61 0.15 -1.26 -4.43 113.70 112.39 2dyn s SER 30 Ca 0.00 2.68 0.02 0.00 0.70 0.00 0.00 55.95 59.35 2dyn s SER 30 Cb 0.00 -2.57 -0.04 0.00 -1.71 0.00 0.00 66.02 61.70 2dyn s SER 30 CO 0.00 -0.96 -0.02 -0.75 1.20 0.00 0.00 173.24 172.70 2dyn s LYS 31 N 2.64 1.01 -0.18 5.44 2.20 -1.13 -4.99 119.74 124.74 2dyn s LYS 31 Ca 0.78 -1.46 -0.08 0.00 -0.36 0.00 0.00 55.97 54.86 2dyn s LYS 31 Cb -0.44 -0.25 -0.04 0.00 -1.51 0.00 0.00 37.83 35.58 2dyn s LYS 31 CO 0.35 -0.08 0.07 -2.00 -0.36 0.00 0.00 175.35 173.32 2dyn s GLU 32 N -3.88 3.97 0.18 4.03 2.12 -1.26 -0.62 118.70 123.24 2dyn s GLU 32 Ca 0.20 -0.33 0.06 0.00 0.36 0.00 0.00 54.97 55.26 2dyn s GLU 32 Cb 0.06 -3.22 -0.05 0.00 0.26 0.00 0.00 34.13 31.18 2dyn s GLU 32 CO 0.01 0.30 -0.12 0.71 -0.54 0.00 0.00 175.26 175.61 2dyn s TYR 33 N 0.31 1.53 -0.42 5.30 2.02 0.07 -4.96 117.35 121.21 2dyn s TYR 33 Ca 0.04 -0.65 -0.21 0.00 -0.37 0.00 0.00 57.07 55.88 2dyn s TYR 33 Cb -0.12 -0.74 0.02 0.00 -0.40 0.00 0.00 41.96 40.72 2dyn s TYR 33 CO -0.00 0.24 0.64 -0.46 -1.57 0.00 0.00 175.55 174.40 2dyn s TRP 34 N -3.12 3.08 -0.03 2.71 -0.11 -0.54 -1.46 118.94 119.47 2dyn s TRP 34 Ca 0.20 0.02 -0.14 0.00 1.22 0.00 0.00 56.10 57.40 2dyn s TRP 34 Cb 0.01 -3.31 -0.05 0.00 -1.50 0.00 0.00 33.47 28.62 2dyn s TRP 34 CO 0.04 -0.82 0.38 -0.06 -4.62 0.00 0.00 176.95 171.87 2dyn s PHE 35 N 2.80 3.69 -0.19 5.86 0.40 -0.02 -0.42 117.98 130.10 2dyn s PHE 35 Ca 0.23 0.92 0.01 0.00 -0.60 0.00 0.00 56.93 57.49 2dyn s PHE 35 Cb -0.14 -2.28 0.04 0.00 0.51 0.00 0.00 43.02 41.15 2dyn s PHE 35 CO 0.18 0.60 -0.11 0.08 0.70 0.00 0.00 175.22 176.67 2dyn s VAL 36 N -0.88 1.65 -0.24 -0.44 1.01 0.73 -1.97 120.40 120.26 2dyn s VAL 36 Ca 0.23 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 61.23 2dyn s VAL 36 Cb -0.16 -1.68 -0.01 0.00 0.00 0.00 0.00 36.38 34.54 2dyn s VAL 36 CO 0.12 0.24 -0.01 -0.22 0.00 0.00 0.00 175.10 175.23 2dyn s LEU 37 N 1.41 3.13 0.46 3.92 2.96 -0.22 -0.94 118.68 129.41 2dyn s LEU 37 Ca 0.00 -0.44 0.05 0.00 -0.22 0.00 0.00 54.13 53.52 2dyn s LEU 37 Cb -0.15 -1.78 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 2dyn s LEU 37 CO -0.09 -0.05 0.07 0.42 -1.32 0.00 0.00 176.35 175.38 2dyn s THR 38 N 1.49 1.68 -0.67 3.68 -4.23 -0.05 0.62 115.64 118.16 2dyn s THR 38 Ca 0.05 -1.90 0.19 0.00 -1.18 0.00 0.00 61.69 58.85 2dyn s THR 38 Cb -0.15 -2.58 0.18 0.00 1.34 0.00 0.00 72.50 71.29 2dyn s THR 38 CO -0.01 0.00 1.57 0.00 -0.54 0.00 0.00 174.62 175.64 2dyn n ALA 39 N -1.21 1.56 -0.04 3.99 0.00 -1.23 -3.54 120.51 120.04 2dyn n ALA 39 Ca -0.10 0.04 -0.04 0.00 0.00 0.00 0.00 53.44 53.34 2dyn n ALA 39 Cb 0.66 -1.30 -0.05 0.00 0.00 0.00 0.00 19.45 18.76 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 -1.93 1.92 -4.13 0.00 1.02 -1.26 -4.86 120.64 111.40 2dyn n GLU 40 Ca 0.02 0.02 -0.09 0.00 -0.02 0.00 0.00 57.16 57.09 2dyn n GLU 40 Cb 0.18 -1.18 -0.10 0.00 -0.02 0.00 0.00 31.44 30.32 2dyn n GLU 40 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2dyn s ASN 41 N -4.21 0.50 -0.16 1.62 0.01 -1.23 -1.80 114.94 109.67 2dyn s ASN 41 Ca -0.06 -1.09 0.00 0.00 -0.71 0.00 0.00 52.86 50.99 2dyn s ASN 41 Cb 0.02 0.23 0.03 0.00 0.41 0.00 0.00 41.25 41.95 2dyn s ASN 41 CO 0.25 -0.64 -0.09 -0.22 -1.51 0.00 0.00 177.10 174.89 2dyn s LEU 42 N -2.99 1.79 0.16 0.60 2.96 -0.03 -0.87 118.68 120.30 2dyn s LEU 42 Ca 0.15 -0.64 0.10 0.00 -0.22 0.00 0.00 54.13 53.52 2dyn s LEU 42 Cb 0.07 -1.07 -0.04 0.00 0.50 0.00 0.00 46.19 45.65 2dyn s LEU 42 CO -0.04 -0.13 -0.23 -0.44 -1.32 0.00 0.00 176.35 174.18 2dyn s SER 43 N 1.53 3.16 -0.03 3.68 0.01 -0.12 -0.70 113.70 121.24 2dyn s SER 43 Ca 0.02 -0.81 0.01 0.00 1.31 0.00 0.00 55.95 56.48 2dyn s SER 43 Cb -0.15 -0.21 0.01 0.00 0.21 0.00 0.00 66.02 65.88 2dyn s SER 43 CO -0.09 0.10 -0.05 -1.66 0.41 0.00 0.00 173.24 171.95 2dyn s TRP 44 N -1.51 0.70 0.37 2.43 -2.14 -1.08 -0.20 118.94 117.52 2dyn s TRP 44 Ca 0.16 -0.17 0.08 0.00 2.66 0.00 0.00 56.10 58.83 2dyn s TRP 44 Cb -0.08 -0.58 -0.05 0.00 -3.10 0.00 0.00 33.47 29.66 2dyn s TRP 44 CO 0.08 -0.13 0.12 0.71 -2.66 0.00 0.00 176.95 175.06 2dyn s TYR 45 N 0.55 2.62 0.20 1.66 1.51 0.45 -0.84 117.35 123.50 2dyn s TYR 45 Ca -0.07 -0.48 -0.11 0.00 -1.01 0.00 0.00 57.07 55.40 2dyn s TYR 45 Cb -0.11 -1.72 0.13 0.00 -0.11 0.00 0.00 41.96 40.15 2dyn s TYR 45 CO 0.00 0.32 1.83 -0.22 -1.11 0.00 0.00 175.55 176.37 2dyn h LYS 46 N 1.58 0.97 -3.71 -0.62 3.64 -1.59 -1.44 116.57 115.40 2dyn h LYS 46 Ca -0.43 -0.10 -0.20 0.00 -1.27 0.00 0.00 60.65 58.66 2dyn h LYS 46 Cb 1.25 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 32.83 2dyn h LYS 46 CO 0.67 0.70 -0.01 0.16 -2.27 0.00 0.00 179.45 178.71 2dyn s ASP 47 N -5.97 0.67 0.00 4.20 1.47 -1.26 -4.43 116.67 111.34 2dyn s ASP 47 Ca -0.13 -1.41 0.13 0.00 1.18 0.00 0.00 52.55 52.31 2dyn s ASP 47 Cb 0.14 0.75 0.76 0.00 -0.34 0.00 0.00 42.92 44.24 2dyn s ASP 47 CO 0.79 -1.48 1.20 -0.90 0.68 0.00 0.00 175.17 175.45 2dyn n ASP 48 N -1.54 0.00 0.02 2.11 5.75 -1.26 -2.21 116.55 119.42 2dyn n ASP 48 Ca -0.03 -0.39 0.13 0.00 -0.01 0.00 0.00 54.79 54.49 2dyn n ASP 48 Cb 0.61 -0.00 0.33 0.00 -1.03 0.00 0.00 41.12 41.02 2dyn n ASP 48 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2dyn n GLU 49 N -1.00 0.08 -3.74 0.11 1.02 -1.26 -4.96 120.64 110.88 2dyn n GLU 49 Ca 0.10 0.03 -0.28 0.00 -0.02 0.00 0.00 57.16 56.99 2dyn n GLU 49 Cb 0.05 -1.56 0.04 0.00 -0.02 0.00 0.00 31.44 29.95 2dyn n GLU 49 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2dyn n GLU 50 N -1.68 -6.21 0.03 3.49 1.02 -0.94 -4.89 120.64 111.47 2dyn n GLU 50 Ca 0.05 0.68 -0.03 0.00 -0.02 0.00 0.00 57.16 57.85 2dyn n GLU 50 Cb 0.36 -5.63 -0.09 0.00 -0.02 0.00 0.00 31.44 26.07 2dyn n GLU 50 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2dyn h LYS 51 N -2.21 0.00 -4.12 3.49 1.57 -1.93 -3.43 116.57 109.93 2dyn h LYS 51 Ca -0.57 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 57.63 2dyn h LYS 51 Cb 1.37 0.00 -0.38 0.00 0.08 0.00 0.00 32.23 33.30 2dyn h LYS 51 CO 0.63 0.45 -0.78 -1.21 -0.57 0.00 0.00 179.45 177.97 2dyn s GLU 52 N -2.81 1.36 -0.38 3.15 2.02 -1.26 -5.07 118.70 115.70 2dyn s GLU 52 Ca -0.02 -0.76 -0.16 0.00 0.02 0.00 0.00 54.97 54.05 2dyn s GLU 52 Cb 0.08 -2.37 0.01 0.00 0.10 0.00 0.00 34.13 31.96 2dyn s GLU 52 CO 0.81 -0.58 0.38 0.21 0.02 0.00 0.00 175.26 176.10 2dyn s LYS 53 N 1.55 3.28 0.09 1.61 2.20 -1.26 -1.52 119.74 125.70 2dyn s LYS 53 Ca -0.03 -0.66 -0.16 0.00 -0.36 0.00 0.00 55.97 54.76 2dyn s LYS 53 Cb -0.18 -3.90 -0.08 0.00 -1.51 0.00 0.00 37.83 32.17 2dyn s LYS 53 CO -0.07 -0.69 1.45 0.87 -0.36 0.00 0.00 175.35 176.55 2dyn h LYS 54 N 8.60 0.62 -2.50 4.03 1.79 -1.33 -3.48 116.57 124.29 2dyn h LYS 54 Ca -0.28 -0.28 0.13 0.00 -2.18 0.00 0.00 60.65 58.04 2dyn h LYS 54 Cb 1.13 -0.01 -0.09 0.00 -1.58 0.00 0.00 32.23 31.67 2dyn h LYS 54 CO 0.74 0.86 0.42 -0.47 -1.08 0.00 0.00 179.45 179.92 2dyn s TYR 55 N -4.55 -0.22 -0.08 -1.35 5.04 -1.23 -5.04 117.35 109.93 2dyn s TYR 55 Ca -0.13 -0.08 -0.03 0.00 -2.44 0.00 0.00 57.07 54.39 2dyn s TYR 55 Cb 0.08 0.63 0.04 0.00 0.35 0.00 0.00 41.96 43.06 2dyn s TYR 55 CO 0.80 -0.85 0.15 1.41 -1.34 0.00 0.00 175.55 175.71 2dyn s MET 56 N -3.41 0.03 0.02 4.97 -2.45 -1.26 -2.64 119.30 114.56 2dyn s MET 56 Ca 0.10 0.51 0.03 0.00 -1.25 0.00 0.00 55.69 55.08 2dyn s MET 56 Cb -0.02 -0.28 -0.04 0.00 1.25 0.00 0.00 34.83 35.74 2dyn s MET 56 CO -0.00 -0.29 -0.01 -0.51 1.05 0.00 0.00 175.02 175.26 2dyn s LEU 57 N 2.10 3.43 0.20 4.11 1.43 0.13 -4.95 118.68 125.12 2dyn s LEU 57 Ca 0.01 -0.08 -0.25 0.00 -1.03 0.00 0.00 54.13 52.79 2dyn s LEU 57 Cb -0.12 -2.02 -0.08 0.00 0.03 0.00 0.00 46.19 44.00 2dyn s LEU 57 CO -0.05 0.25 0.79 -0.55 0.23 0.00 0.00 176.35 177.02 2dyn s SER 58 N -1.72 7.34 0.00 2.29 0.15 -1.26 -0.85 113.70 119.65 2dyn s SER 58 Ca 0.21 1.64 0.30 0.00 0.70 0.00 0.00 55.95 58.79 2dyn s SER 58 Cb -0.11 -2.50 1.71 0.00 -1.71 0.00 0.00 66.02 63.41 2dyn s SER 58 CO 0.12 0.15 2.10 1.33 1.20 0.00 0.00 173.24 178.14 2dyn n VAL 59 N 1.32 0.02 -2.38 4.45 0.24 -0.75 -4.73 118.33 116.50 2dyn n VAL 59 Ca -0.04 0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.85 2dyn n VAL 59 Cb 0.49 -0.53 -0.04 0.00 -1.47 0.00 0.00 33.84 32.30 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 -2.17 7.11 -1.85 -1.34 1.01 -1.26 -3.09 116.67 115.07 2dyn s ASP 60 Ca 0.40 2.28 0.00 0.00 0.71 0.00 0.00 52.55 55.94 2dyn s ASP 60 Cb 0.20 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.52 2dyn s ASP 60 CO 0.38 -0.33 0.00 0.59 0.21 0.00 0.00 175.17 176.02 2dyn n ASN 61 N 2.06 -5.57 -4.62 0.27 3.02 -1.26 -4.95 115.26 104.21 2dyn n ASN 61 Ca 0.03 0.17 -0.34 0.00 -0.03 0.00 0.00 54.58 54.40 2dyn n ASN 61 Cb 0.44 -4.74 -0.10 0.00 -0.61 0.00 0.00 39.78 34.77 2dyn n ASN 61 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2dyn s LEU 62 N -5.54 3.68 0.33 3.41 2.96 -1.18 -1.26 118.68 121.08 2dyn s LEU 62 Ca 0.00 0.05 0.04 0.00 -0.22 0.00 0.00 54.13 54.00 2dyn s LEU 62 Cb 0.00 -1.91 -0.06 0.00 0.50 0.00 0.00 46.19 44.72 2dyn s LEU 62 CO 0.00 0.20 0.06 -0.54 -1.32 0.00 0.00 176.35 174.76 2dyn s LYS 63 N 0.17 1.66 0.01 1.98 1.02 0.18 -4.21 119.74 120.55 2dyn s LYS 63 Ca 0.03 -1.92 0.05 0.00 0.02 0.00 0.00 55.97 54.14 2dyn s LYS 63 Cb -0.13 -0.86 -0.02 0.00 -0.52 0.00 0.00 37.83 36.31 2dyn s LYS 63 CO 0.01 -0.20 -0.15 -1.17 -0.92 0.00 0.00 175.35 172.93 2dyn s LEU 64 N -3.49 2.08 0.19 3.17 0.20 -0.68 -1.15 118.68 119.00 2dyn s LEU 64 Ca 0.36 -0.34 -0.05 0.00 0.69 0.00 0.00 54.13 54.79 2dyn s LEU 64 Cb 0.09 -0.71 -0.03 0.00 -0.43 0.00 0.00 46.19 45.11 2dyn s LEU 64 CO 0.15 0.13 0.22 0.00 -0.29 0.00 0.00 176.35 176.56 2dyn s ARG 65 N -0.65 1.21 0.34 1.98 1.70 -0.13 -0.57 118.95 122.84 2dyn s ARG 65 Ca 0.04 -1.44 -0.05 0.00 -0.47 0.00 0.00 55.73 53.81 2dyn s ARG 65 Cb -0.06 0.33 -0.05 0.00 -0.57 0.00 0.00 34.95 34.59 2dyn s ARG 65 CO 0.00 -0.42 0.63 -0.51 -1.08 0.00 0.00 175.30 173.91 2dyn s ASP 66 N -3.08 6.42 -0.11 -2.89 1.01 -1.26 -0.06 116.67 116.70 2dyn s ASP 66 Ca 0.29 0.79 0.02 0.00 0.71 0.00 0.00 52.55 54.37 2dyn s ASP 66 Cb 0.05 -2.18 0.01 0.00 1.01 0.00 0.00 42.92 41.81 2dyn s ASP 66 CO 0.07 -0.30 -0.18 -0.69 0.21 0.00 0.00 175.17 174.29 2dyn s VAL 67 N -2.25 1.66 0.23 -1.27 1.01 -1.09 -4.80 120.40 113.90 2dyn s VAL 67 Ca 0.45 -0.75 -0.31 0.00 0.00 0.00 0.00 61.98 61.37 2dyn s VAL 67 Cb -0.10 -1.49 -0.10 0.00 0.00 0.00 0.00 36.38 34.68 2dyn s VAL 67 CO 0.33 0.47 1.53 -1.61 0.00 0.00 0.00 175.10 175.82 2dyn s GLU 68 N 0.82 4.21 -0.75 2.72 0.41 -1.26 -4.38 118.70 120.48 2dyn s GLU 68 Ca -0.09 2.41 -0.26 0.00 -0.41 0.00 0.00 54.97 56.62 2dyn s GLU 68 Cb -0.16 -3.10 -0.06 0.00 -1.78 0.00 0.00 34.13 29.03 2dyn s GLU 68 CO 0.00 -0.55 2.09 0.21 -0.49 0.00 0.00 175.26 176.53 2dyn s LYS 69 N 0.10 2.29 0.33 1.61 2.20 -1.26 -4.95 119.74 120.07 2dyn s LYS 69 Ca 0.64 0.35 -0.26 0.00 -0.36 0.00 0.00 55.97 56.35 2dyn s LYS 69 Cb -0.44 -4.76 -0.10 0.00 -1.51 0.00 0.00 37.83 31.01 2dyn s LYS 69 CO 0.40 -3.44 0.95 0.20 -0.36 0.00 0.00 175.35 173.10 2dyn s GLY 70 N 9.28 2.77 0.24 5.54 0.00 -1.26 -4.90 107.32 118.99 2dyn s GLY 70 Ca 0.78 0.52 -0.08 0.00 0.00 0.00 0.00 44.72 45.94 2dyn s GLY 70 CO 0.10 0.95 1.63 0.74 0.00 0.00 0.00 173.10 176.52 2dyn h PHE 71 N 3.06 -0.10 0.45 1.90 -1.00 -1.99 -0.04 116.94 119.23 2dyn h PHE 71 Ca -0.47 0.06 -0.02 0.00 2.81 0.00 0.00 57.97 60.34 2dyn h PHE 71 Cb 1.19 0.16 0.00 0.00 3.61 0.00 0.00 35.95 40.91 2dyn h PHE 71 CO 0.61 -0.24 -0.22 0.52 -1.61 0.00 0.00 178.31 177.37 2dyn h MET 72 N 0.09 -0.59 -2.15 1.51 2.86 -2.01 -3.06 114.93 111.58 2dyn h MET 72 Ca 0.39 0.04 -0.66 0.00 -2.06 0.00 0.00 59.70 57.41 2dyn h MET 72 Cb 0.68 0.13 -0.20 0.00 0.06 0.00 0.00 31.60 32.27 2dyn h MET 72 CO -0.66 -0.34 1.05 0.43 1.06 0.00 0.00 176.91 178.45 2dyn n SER 73 N -5.31 7.18 -4.28 1.22 7.64 -0.70 -4.91 113.62 114.46 2dyn n SER 73 Ca -0.11 -3.42 -0.28 0.00 1.01 0.00 0.00 58.87 56.07 2dyn n SER 73 Cb 0.28 -1.21 -0.09 0.00 -1.01 0.00 0.00 64.21 62.18 2dyn n SER 73 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dyn n SER 74 N 0.55 2.03 -2.60 6.43 2.88 -0.11 -4.07 113.62 118.73 2dyn n SER 74 Ca 0.53 -2.59 -0.12 0.00 -1.33 0.00 0.00 58.87 55.35 2dyn n SER 74 Cb 0.37 -1.46 -0.03 0.00 -0.75 0.00 0.00 64.21 62.34 2dyn n SER 74 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2dyn n LYS 75 N 8.01 0.48 -3.89 -1.46 4.81 -1.26 -5.07 118.16 119.78 2dyn n LYS 75 Ca 0.44 -2.29 -0.36 0.00 -0.87 0.00 0.00 58.31 55.24 2dyn n LYS 75 Cb 0.45 2.10 -0.13 0.00 0.02 0.00 0.00 35.03 37.48 2dyn n LYS 75 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 2dyn s HIS 76 N -3.28 3.05 0.07 5.64 3.76 -1.03 -4.64 115.29 118.86 2dyn s HIS 76 Ca 0.25 -0.51 0.06 0.00 -0.15 0.00 0.00 55.06 54.71 2dyn s HIS 76 Cb -0.00 -2.16 -0.03 0.00 1.11 0.00 0.00 32.58 31.50 2dyn s HIS 76 CO 0.18 -0.34 -0.15 0.42 -0.85 0.00 0.00 174.74 174.00 2dyn s ILE 77 N 1.35 1.20 0.11 0.60 1.01 -1.26 -0.44 121.20 123.78 2dyn s ILE 77 Ca 0.05 -1.29 -0.01 0.00 0.00 0.00 0.00 60.65 59.39 2dyn s ILE 77 Cb -0.15 -1.14 -0.04 0.00 0.01 0.00 0.00 42.46 41.15 2dyn s ILE 77 CO 0.02 -0.16 0.04 0.72 0.00 0.00 0.00 174.94 175.55 2dyn s PHE 78 N -1.19 0.78 0.04 3.97 -0.71 -0.41 -2.66 117.98 117.80 2dyn s PHE 78 Ca -0.00 -1.20 0.00 0.00 -1.04 0.00 0.00 56.93 54.69 2dyn s PHE 78 Cb -0.10 -0.46 -0.03 0.00 -1.21 0.00 0.00 43.02 41.23 2dyn s PHE 78 CO 0.02 -0.49 -0.04 0.00 -1.34 0.00 0.00 175.22 173.37 2dyn s ALA 79 N -4.02 0.41 -0.06 1.99 0.00 0.91 -0.28 121.76 120.72 2dyn s ALA 79 Ca 0.20 -0.89 0.03 0.00 0.00 0.00 0.00 51.96 51.30 2dyn s ALA 79 Cb 0.08 0.17 -0.03 0.00 0.00 0.00 0.00 23.12 23.34 2dyn s ALA 79 CO -0.01 -0.21 -0.12 -0.51 0.00 0.00 0.00 175.76 174.92 2dyn s LEU 80 N -2.09 2.88 0.06 0.00 1.43 0.18 -0.95 118.68 120.19 2dyn s LEU 80 Ca -0.05 -0.14 -0.08 0.00 -1.03 0.00 0.00 54.13 52.83 2dyn s LEU 80 Cb -0.03 -1.60 -0.01 0.00 0.03 0.00 0.00 46.19 44.58 2dyn s LEU 80 CO -0.04 0.35 0.15 0.72 0.23 0.00 0.00 176.35 177.76 2dyn s PHE 81 N -0.72 0.17 -0.16 0.29 -0.12 -0.30 -0.60 117.98 116.53 2dyn s PHE 81 Ca 0.11 -0.52 -0.13 0.00 -0.05 0.00 0.00 56.93 56.34 2dyn s PHE 81 Cb -0.11 -0.10 -0.05 0.00 -0.63 0.00 0.00 43.02 42.14 2dyn s PHE 81 CO 0.01 -0.46 0.27 1.21 -0.05 0.00 0.00 175.22 176.20 2dyn s ASN 82 N -2.49 6.41 0.40 1.98 3.84 -1.26 -0.65 114.94 123.17 2dyn s ASN 82 Ca 0.00 0.47 0.26 0.00 0.21 0.00 0.00 52.86 53.80 2dyn s ASN 82 Cb 0.02 -2.17 0.75 0.00 -0.55 0.00 0.00 41.25 39.30 2dyn s ASN 82 CO -0.07 0.12 1.74 0.71 -2.79 0.00 0.00 177.10 176.81 2dyn h THR 83 N 4.65 0.00 0.01 -5.21 1.35 -1.55 -3.29 112.91 108.86 2dyn h THR 83 Ca -0.42 -0.69 -0.37 0.00 -0.55 0.00 0.00 66.41 64.38 2dyn h THR 83 Cb 1.16 1.66 -0.07 0.00 -1.73 0.00 0.00 68.15 69.18 2dyn h THR 83 CO 0.75 0.00 -2.36 -0.62 -0.25 0.00 0.00 175.52 173.04 2dyn n GLU 84 N -2.82 0.67 -3.81 4.72 4.71 -1.26 -5.00 120.64 117.84 2dyn n GLU 84 Ca 0.03 0.10 -0.21 0.00 -0.01 0.00 0.00 57.16 57.08 2dyn n GLU 84 Cb 0.43 -1.55 -0.03 0.00 -1.01 0.00 0.00 31.44 29.28 2dyn n GLU 84 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 2dyn s GLN 85 N -2.51 3.03 -0.12 3.49 -1.52 -1.24 -5.04 119.66 115.75 2dyn s GLN 85 Ca -0.21 -1.05 -0.14 0.00 -1.95 0.00 0.00 55.36 52.01 2dyn s GLN 85 Cb 0.07 -2.68 -0.26 0.00 -0.22 0.00 0.00 33.01 29.92 2dyn s GLN 85 CO 0.73 0.22 0.47 -0.09 -0.25 0.00 0.00 175.29 176.37 2dyn h ARG 86 N 1.18 0.23 -5.13 2.91 2.43 -1.94 -3.41 114.38 110.66 2dyn h ARG 86 Ca -0.47 -0.39 -0.64 0.00 -0.81 0.00 0.00 59.98 57.67 2dyn h ARG 86 Cb 1.25 0.15 -0.21 0.00 -0.42 0.00 0.00 29.97 30.73 2dyn h ARG 86 CO 0.58 1.19 -0.62 -0.80 -1.51 0.00 0.00 179.97 178.80 2dyn s ASN 87 N -7.03 5.13 -0.02 -3.80 0.01 -1.26 -4.30 114.94 103.66 2dyn s ASN 87 Ca -0.21 -0.12 -0.21 0.00 -0.71 0.00 0.00 52.86 51.61 2dyn s ASN 87 Cb 0.05 -1.89 -0.28 0.00 0.41 0.00 0.00 41.25 39.54 2dyn s ASN 87 CO 0.75 0.07 0.98 0.58 -1.51 0.00 0.00 177.10 177.98 2dyn h VAL 88 N 5.27 1.47 -3.39 1.60 2.07 -1.42 -3.45 116.25 118.40 2dyn h VAL 88 Ca -0.36 -2.36 -0.38 0.00 0.82 0.00 0.00 66.70 64.42 2dyn h VAL 88 Cb 1.18 2.95 -0.36 0.00 -1.52 0.00 0.00 31.29 33.54 2dyn h VAL 88 CO 0.62 0.68 -0.75 -0.47 0.02 0.00 0.00 177.57 177.67 2dyn s TYR 89 N -2.75 0.42 0.00 1.57 5.04 -1.24 -5.00 117.35 115.39 2dyn s TYR 89 Ca -0.13 -0.03 0.00 0.00 -2.44 0.00 0.00 57.07 54.47 2dyn s TYR 89 Cb 0.02 -0.56 0.00 0.00 0.35 0.00 0.00 41.96 41.77 2dyn s TYR 89 CO 0.83 -0.20 0.00 1.63 -1.34 0.00 0.00 175.55 176.47 2dyn n LYS 90 N 4.60 0.00 -0.48 4.97 5.02 -1.26 -0.61 118.16 130.40 2dyn n LYS 90 Ca -0.17 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.20 2dyn n LYS 90 Cb 0.50 0.00 0.27 0.00 -0.02 0.00 0.00 35.03 35.79 2dyn n LYS 90 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2dyn n ASP 91 N 5.88 4.08 -4.67 4.39 -0.08 -1.26 -4.79 116.55 120.10 2dyn n ASP 91 Ca 0.00 -2.72 -0.38 0.00 -1.51 0.00 0.00 54.79 50.18 2dyn n ASP 91 Cb 0.00 -0.51 -0.07 0.00 2.34 0.00 0.00 41.12 42.88 2dyn n ASP 91 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 2dyn s TYR 92 N -2.31 3.38 0.20 -0.67 2.02 0.22 -4.95 117.35 115.23 2dyn s TYR 92 Ca 0.41 0.64 0.30 0.00 -0.37 0.00 0.00 57.07 58.05 2dyn s TYR 92 Cb 0.31 -2.53 1.27 0.00 -0.40 0.00 0.00 41.96 40.60 2dyn s TYR 92 CO 0.13 -0.00 1.96 0.00 -1.57 0.00 0.00 175.55 176.07 2dyn h ARG 93 N 7.33 0.00 -1.91 -0.62 3.08 -1.86 -1.25 114.38 119.16 2dyn h ARG 93 Ca -0.36 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.66 2dyn h ARG 93 Cb 1.16 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 31.00 2dyn h ARG 93 CO 0.72 0.10 0.23 1.14 -1.07 0.00 0.00 179.97 181.10 2dyn s GLN 94 N -3.77 0.87 -0.37 0.04 -2.07 -1.26 -4.36 119.66 108.73 2dyn s GLN 94 Ca -0.00 0.56 -0.19 0.00 -1.82 0.00 0.00 55.36 53.91 2dyn s GLN 94 Cb 0.10 0.42 0.00 0.00 -1.09 0.00 0.00 33.01 32.44 2dyn s GLN 94 CO 0.58 -0.20 0.53 -1.17 -1.32 0.00 0.00 175.29 173.71 2dyn s LEU 95 N -0.44 4.42 -0.31 2.60 2.96 0.23 -4.90 118.68 123.24 2dyn s LEU 95 Ca -0.04 -0.14 -0.17 0.00 -0.22 0.00 0.00 54.13 53.56 2dyn s LEU 95 Cb -0.02 -2.60 -0.02 0.00 0.50 0.00 0.00 46.19 44.05 2dyn s LEU 95 CO 0.04 -0.55 0.46 -1.61 -1.32 0.00 0.00 176.35 173.37 2dyn s GLU 96 N 2.45 3.83 -0.16 1.98 2.02 -1.26 -0.64 118.70 126.91 2dyn s GLU 96 Ca 0.19 -0.02 -0.04 0.00 0.02 0.00 0.00 54.97 55.12 2dyn s GLU 96 Cb -0.15 -3.73 -0.03 0.00 0.10 0.00 0.00 34.13 30.32 2dyn s GLU 96 CO 0.14 -0.46 -0.03 -0.51 0.02 0.00 0.00 175.26 174.42 2dyn s LEU 97 N 2.24 3.22 0.16 1.80 1.43 0.62 -0.82 118.68 127.32 2dyn s LEU 97 Ca 0.17 -0.16 0.09 0.00 -1.03 0.00 0.00 54.13 53.21 2dyn s LEU 97 Cb -0.16 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.24 2dyn s LEU 97 CO 0.11 0.14 -0.13 0.00 0.23 0.00 0.00 176.35 176.71 2dyn s ALA 98 N 0.51 2.85 0.05 4.21 0.00 0.85 -1.29 121.76 128.94 2dyn s ALA 98 Ca -0.03 -1.43 0.00 0.00 0.00 0.00 0.00 51.96 50.51 2dyn s ALA 98 Cb -0.14 -0.70 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 2dyn s ALA 98 CO 0.03 0.52 -0.05 0.00 0.00 0.00 0.00 175.76 176.26 2dyn h GLU 100 N 3.91 -0.22 -6.02 0.00 4.39 -1.99 -2.73 114.58 111.92 2dyn h GLU 100 Ca -0.34 0.01 -0.55 0.00 0.34 0.00 0.00 59.36 58.82 2dyn h GLU 100 Cb 1.18 0.05 -0.08 0.00 -0.10 0.00 0.00 28.75 29.80 2dyn h GLU 100 CO 0.52 -0.12 -0.52 0.95 -1.16 0.00 0.00 179.01 178.69 2dyn s THR 101 N -6.01 2.68 0.23 1.13 -4.23 -1.26 -4.52 115.64 103.65 2dyn s THR 101 Ca -0.14 -1.70 0.04 0.00 -1.18 0.00 0.00 61.69 58.71 2dyn s THR 101 Cb 0.05 -2.97 -0.06 0.00 1.34 0.00 0.00 72.50 70.86 2dyn s THR 101 CO 0.65 -0.10 1.53 -0.61 -0.54 0.00 0.00 174.62 175.55 2dyn h GLN 102 N 1.49 0.21 -0.39 3.99 5.75 -1.96 -3.13 115.11 121.08 2dyn h GLN 102 Ca -0.43 -0.16 -0.02 0.00 -0.15 0.00 0.00 58.65 57.89 2dyn h GLN 102 Cb 1.25 0.03 -0.02 0.00 1.07 0.00 0.00 27.48 29.81 2dyn h GLN 102 CO 0.66 0.79 0.16 0.93 -2.65 0.00 0.00 178.83 178.72 2dyn h GLU 103 N 0.15 0.54 -0.14 1.69 3.07 -1.99 -2.00 114.58 115.91 2dyn h GLU 103 Ca -0.01 -0.07 -0.14 0.00 -0.50 0.00 0.00 59.36 58.65 2dyn h GLU 103 Cb 1.17 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.97 2dyn h GLU 103 CO 0.10 0.45 -0.50 1.49 -1.40 0.00 0.00 179.01 179.15 2dyn h GLU 104 N 0.54 0.36 -0.13 2.33 4.81 -1.96 -1.43 114.58 119.10 2dyn h GLU 104 Ca 0.14 -0.21 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 2dyn h GLU 104 Cb 0.10 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 2dyn h GLU 104 CO -0.01 0.78 -0.03 0.28 -0.73 0.00 0.00 179.01 179.30 2dyn h VAL 105 N 0.29 1.29 -0.93 0.32 2.07 -1.42 -1.93 116.25 115.93 2dyn h VAL 105 Ca 0.01 -0.96 0.03 0.00 0.82 0.00 0.00 66.70 66.60 2dyn h VAL 105 Cb 0.98 1.65 -0.05 0.00 -1.52 0.00 0.00 31.29 32.35 2dyn h VAL 105 CO 0.08 0.28 0.61 0.44 0.02 0.00 0.00 177.57 179.01 2dyn h ASP 106 N -0.05 1.03 -0.13 0.57 3.32 -1.31 -0.21 116.42 119.64 2dyn h ASP 106 Ca 0.03 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 2dyn h ASP 106 Cb 0.45 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 2dyn h ASP 106 CO 0.01 0.72 0.08 -1.28 -1.72 0.00 0.00 179.24 177.05 2dyn h SER 107 N 1.20 0.16 -0.01 6.45 0.87 -1.08 -2.19 113.55 118.95 2dyn h SER 107 Ca 0.36 -0.06 -0.10 0.00 -1.23 0.00 0.00 61.79 60.77 2dyn h SER 107 Cb -0.03 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 2dyn h SER 107 CO -0.10 0.17 -0.28 -0.50 -0.53 0.00 0.00 176.83 175.60 2dyn h TRP 108 N 0.13 0.50 -0.67 2.24 4.06 -0.81 -2.64 115.95 118.76 2dyn h TRP 108 Ca 0.05 -0.11 0.01 0.00 2.06 0.00 0.00 58.89 60.90 2dyn h TRP 108 Cb 0.05 -0.12 -0.04 0.00 -1.00 0.00 0.00 29.16 28.05 2dyn h TRP 108 CO -0.05 0.68 0.43 0.87 -3.56 0.00 0.00 178.44 176.81 2dyn h LYS 109 N 0.39 0.85 -0.68 0.49 1.57 -0.80 0.11 116.57 118.51 2dyn h LYS 109 Ca 0.05 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2dyn h LYS 109 Cb 0.69 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 2dyn h LYS 109 CO 0.05 0.56 0.43 0.00 -0.57 0.00 0.00 179.45 179.92 2dyn h ALA 110 N 1.26 0.86 -0.50 3.86 0.00 -1.17 -0.98 119.26 122.59 2dyn h ALA 110 Ca 0.25 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 2dyn h ALA 110 Cb -0.07 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 2dyn h ALA 110 CO -0.07 0.31 0.07 0.77 0.00 0.00 0.00 179.25 180.33 2dyn h SER 111 N 0.92 0.75 -0.05 0.00 0.02 -0.98 -2.45 113.55 111.75 2dyn h SER 111 Ca 0.25 -0.15 -0.09 0.00 -0.84 0.00 0.00 61.79 60.95 2dyn h SER 111 Cb -0.07 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.26 2dyn h SER 111 CO -0.05 0.77 -0.23 -0.26 -1.14 0.00 0.00 176.83 175.93 2dyn h PHE 112 N 0.76 0.51 -0.69 3.45 0.04 0.07 -2.74 116.94 118.33 2dyn h PHE 112 Ca 0.16 -0.10 0.01 0.00 2.80 0.00 0.00 57.97 60.84 2dyn h PHE 112 Cb 0.36 -0.13 -0.04 0.00 2.20 0.00 0.00 35.95 38.34 2dyn h PHE 112 CO 0.02 0.66 0.45 -0.07 -0.60 0.00 0.00 178.31 178.77 2dyn h LEU 113 N 0.41 0.77 -2.55 1.54 3.38 -0.73 -0.44 115.31 117.70 2dyn h LEU 113 Ca 0.06 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2dyn h LEU 113 Cb 0.63 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 2dyn h LEU 113 CO 0.04 0.55 -0.00 -0.09 0.09 0.00 0.00 178.44 179.03 2dyn h ARG 114 N 0.91 0.00 -0.01 1.13 9.65 -1.29 0.28 114.38 125.05 2dyn h ARG 114 Ca 0.26 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.14 2dyn h ARG 114 Cb -0.07 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.51 2dyn h ARG 114 CO -0.07 0.00 -0.33 0.00 2.80 0.00 0.00 179.97 182.37 2dyn n ALA 115 N -2.28 3.24 -0.01 2.80 0.00 -0.25 -4.94 120.51 119.07 2dyn n ALA 115 Ca -0.03 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.92 2dyn n ALA 115 Cb 0.08 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.52 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 1.37 0.38 3.57 0.00 0.00 0.09 -4.87 105.19 105.72 2dyn n GLY 116 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.13 3.67 0.29 1.61 1.01 -0.72 -4.96 120.40 119.17 2dyn s VAL 117 Ca 0.00 0.53 -0.01 0.00 0.00 0.00 0.00 61.98 62.50 2dyn s VAL 117 Cb 0.00 -4.34 -0.04 0.00 0.00 0.00 0.00 36.38 32.00 2dyn s VAL 117 CO 0.00 -1.14 0.51 -0.31 0.00 0.00 0.00 175.10 174.16 2dyn s TYR 118 N 6.70 3.49 0.79 5.22 2.02 -1.26 -3.73 117.35 130.58 2dyn s TYR 118 Ca 0.55 0.43 -0.11 0.00 -0.37 0.00 0.00 57.07 57.57 2dyn s TYR 118 Cb -0.12 -1.95 0.07 0.00 -0.40 0.00 0.00 41.96 39.57 2dyn s TYR 118 CO 0.23 0.20 1.10 -1.25 -1.57 0.00 0.00 175.55 174.26 2dyn s PRO 119 N -3.83 2.11 0.00 -1.71 0.04 -1.26 -1.69 135.00 128.65 2dyn s PRO 119 Ca 0.41 0.65 0.28 0.00 0.04 0.00 0.00 61.00 62.38 2dyn s PRO 119 Cb -0.10 -1.92 1.03 0.00 0.04 0.00 0.00 34.50 33.55 2dyn s PRO 119 CO 0.32 -1.61 1.74 -1.91 0.04 0.00 0.00 177.00 175.58