#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fom s GLU 19 N 0.00 0.81 0.32 1.47 -1.05 -1.26 -5.12 118.70 113.87 2fom s GLU 19 Ca 0.00 -1.15 -0.28 0.00 -0.15 0.00 0.00 54.97 53.39 2fom s GLU 19 Cb 0.00 -0.44 -0.13 0.00 -0.44 0.00 0.00 34.13 33.12 2fom s GLU 19 CO 0.00 0.06 1.19 -0.25 0.95 0.00 0.00 175.26 177.21 2fom n ASP 20 N 0.54 2.24 0.00 0.83 9.92 -1.26 -4.74 116.55 124.08 2fom n ASP 20 Ca -0.16 1.20 0.00 0.00 -0.53 0.00 0.00 54.79 55.30 2fom n ASP 20 Cb 0.58 -1.41 0.00 0.00 -0.64 0.00 0.00 41.12 39.64 2fom n ASP 20 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2fom n GLY 21 N 0.93 -2.31 3.79 0.44 0.00 -0.70 -4.96 105.19 102.38 2fom n GLY 21 Ca 0.06 -1.41 -0.36 0.00 0.00 0.00 0.00 46.02 44.31 2fom n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fom s ALA 22 N -1.80 3.73 0.11 4.61 0.00 -1.26 -0.52 121.76 126.63 2fom s ALA 22 Ca 0.00 -0.57 0.09 0.00 0.00 0.00 0.00 51.96 51.48 2fom s ALA 22 Cb 0.00 -2.18 -0.04 0.00 0.00 0.00 0.00 23.12 20.90 2fom s ALA 22 CO 0.00 0.32 -0.23 0.71 0.00 0.00 0.00 175.76 176.56 2fom s TYR 23 N -0.19 1.94 0.29 0.00 1.51 0.02 -4.98 117.35 115.94 2fom s TYR 23 Ca 0.14 -0.41 -0.12 0.00 -1.01 0.00 0.00 57.07 55.67 2fom s TYR 23 Cb -0.12 -1.06 -0.08 0.00 -0.11 0.00 0.00 41.96 40.59 2fom s TYR 23 CO 0.03 0.24 0.65 1.03 -1.11 0.00 0.00 175.55 176.39 2fom s ARG 24 N -1.94 3.88 -0.24 -0.62 0.52 -1.26 -1.24 118.95 118.04 2fom s ARG 24 Ca 0.09 0.46 -0.04 0.00 -0.52 0.00 0.00 55.73 55.71 2fom s ARG 24 Cb -0.10 -2.53 0.01 0.00 0.52 0.00 0.00 34.95 32.85 2fom s ARG 24 CO 0.05 0.21 -0.02 0.42 0.02 0.00 0.00 175.30 175.97 2fom s ILE 25 N -1.95 3.34 -0.06 1.52 1.01 0.41 -4.87 121.20 120.61 2fom s ILE 25 Ca 0.51 -0.69 0.06 0.00 0.00 0.00 0.00 60.65 60.53 2fom s ILE 25 Cb -0.11 -2.61 -0.01 0.00 0.01 0.00 0.00 42.46 39.74 2fom s ILE 25 CO 0.21 0.29 -0.25 -0.54 0.00 0.00 0.00 174.94 174.65 2fom s LYS 26 N 1.44 2.56 -0.21 2.79 1.02 -1.26 -1.05 119.74 125.03 2fom s LYS 26 Ca 0.04 -0.90 -0.08 0.00 0.02 0.00 0.00 55.97 55.05 2fom s LYS 26 Cb -0.15 -2.16 -0.04 0.00 -0.52 0.00 0.00 37.83 34.96 2fom s LYS 26 CO -0.03 0.38 0.07 -1.14 -0.92 0.00 0.00 175.35 173.71 2fom s GLN 27 N -0.15 3.86 0.24 1.68 0.74 0.32 -4.88 119.66 121.47 2fom s GLN 27 Ca -0.04 -0.39 -0.30 0.00 0.05 0.00 0.00 55.36 54.68 2fom s GLN 27 Cb -0.14 -3.28 -0.09 0.00 1.10 0.00 0.00 33.01 30.60 2fom s GLN 27 CO 0.04 0.09 0.97 0.21 -0.55 0.00 0.00 175.29 176.05 2fom s LYS 28 N 0.87 4.81 0.14 1.67 2.20 -1.26 -1.29 119.74 126.89 2fom s LYS 28 Ca 0.04 1.55 0.02 0.00 -0.36 0.00 0.00 55.97 57.21 2fom s LYS 28 Cb -0.14 -3.27 -0.01 0.00 -1.51 0.00 0.00 37.83 32.91 2fom s LYS 28 CO 0.03 0.45 0.14 0.41 -0.36 0.00 0.00 175.35 176.02 2fom n GLY 29 N 1.47 3.31 0.27 5.54 0.00 -0.43 -4.97 105.19 110.38 2fom n GLY 29 Ca -0.02 -1.67 0.15 0.00 0.00 0.00 0.00 46.02 44.48 2fom n GLY 29 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2fom h ILE 30 N 1.43 0.26 -0.04 -0.61 3.07 -2.03 -1.59 117.51 118.00 2fom h ILE 30 Ca -0.10 -0.62 0.00 0.00 1.55 0.00 0.00 64.86 65.68 2fom h ILE 30 Cb 0.49 1.49 0.00 0.00 -0.27 0.00 0.00 36.82 38.53 2fom h ILE 30 CO 0.14 0.08 0.00 0.18 -1.05 0.00 0.00 178.15 177.50 2fom n LEU 31 N -3.27 1.46 0.00 0.16 4.77 -1.26 -5.05 117.00 113.81 2fom n LEU 31 Ca -0.00 -0.51 0.00 0.00 -0.03 0.00 0.00 56.01 55.46 2fom n LEU 31 Cb 0.30 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 2fom n LEU 31 CO 0.29 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 2fom n GLY 32 N 1.16 -0.39 3.81 -0.72 0.00 -0.60 -5.04 105.19 103.40 2fom n GLY 32 Ca 0.19 -2.20 -0.36 0.00 0.00 0.00 0.00 46.02 43.64 2fom n GLY 32 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2fom s TYR 33 N 0.00 3.65 -0.10 1.61 2.02 -1.26 -1.31 117.35 121.95 2fom s TYR 33 Ca 0.00 1.47 0.02 0.00 -0.37 0.00 0.00 57.07 58.18 2fom s TYR 33 Cb 0.00 -2.68 -0.02 0.00 -0.40 0.00 0.00 41.96 38.86 2fom s TYR 33 CO 0.00 0.30 -0.16 -1.12 -1.57 0.00 0.00 175.55 173.00 2fom s SER 34 N -1.67 3.83 -0.35 2.29 0.01 -0.41 -4.93 113.70 112.48 2fom s SER 34 Ca 0.45 -0.34 -0.29 0.00 1.31 0.00 0.00 55.95 57.08 2fom s SER 34 Cb -0.17 -1.35 0.02 0.00 0.21 0.00 0.00 66.02 64.73 2fom s SER 34 CO 0.21 0.21 1.16 -1.58 0.41 0.00 0.00 173.24 173.65 2fom s GLN 35 N 0.06 3.94 0.04 12.44 0.74 -1.26 -0.52 119.66 135.09 2fom s GLN 35 Ca -0.06 1.02 0.22 0.00 0.05 0.00 0.00 55.36 56.59 2fom s GLN 35 Cb -0.15 -3.82 -0.17 0.00 1.10 0.00 0.00 33.01 29.98 2fom s GLN 35 CO 0.05 -1.07 0.76 0.44 -0.55 0.00 0.00 175.29 174.92 2fom n ILE 36 N 6.19 0.16 -1.40 -2.34 -5.35 -0.21 -4.79 119.36 111.61 2fom n ILE 36 Ca 0.13 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.22 2fom n ILE 36 Cb 0.47 0.10 0.00 0.00 -1.74 0.00 0.00 39.64 38.47 2fom n ILE 36 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2fom n GLY 37 N 1.30 -0.68 3.69 3.28 0.00 -1.13 -4.68 105.19 106.98 2fom n GLY 37 Ca -0.01 -0.47 -0.09 0.00 0.00 0.00 0.00 46.02 45.46 2fom n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fom s ALA 38 N -1.00 -0.54 0.11 4.61 0.00 0.66 -0.44 121.76 125.15 2fom s ALA 38 Ca 0.00 -0.73 -0.14 0.00 0.00 0.00 0.00 51.96 51.09 2fom s ALA 38 Cb 0.00 0.96 0.05 0.00 0.00 0.00 0.00 23.12 24.13 2fom s ALA 38 CO 0.00 -0.92 0.68 0.41 0.00 0.00 0.00 175.76 175.92 2fom n GLY 39 N -0.44 0.80 3.08 0.00 0.00 -0.37 -4.10 105.19 104.16 2fom n GLY 39 Ca -0.03 -1.06 -0.27 0.00 0.00 0.00 0.00 46.02 44.66 2fom n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fom s VAL 40 N -2.23 1.44 -0.21 1.61 1.01 -0.09 -0.80 120.40 121.13 2fom s VAL 40 Ca 0.15 -0.64 -0.11 0.00 0.00 0.00 0.00 61.98 61.38 2fom s VAL 40 Cb -0.02 -1.29 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 2fom s VAL 40 CO 0.03 0.42 0.19 -0.47 0.00 0.00 0.00 175.10 175.27 2fom s TYR 41 N 0.69 3.38 -0.16 5.22 6.14 0.33 -0.43 117.35 132.51 2fom s TYR 41 Ca -0.13 0.35 -0.09 0.00 0.64 0.00 0.00 57.07 57.84 2fom s TYR 41 Cb -0.16 -2.26 0.06 0.00 0.42 0.00 0.00 41.96 40.02 2fom s TYR 41 CO 0.03 0.17 0.39 0.21 0.64 0.00 0.00 175.55 177.00 2fom s LYS 42 N 0.72 0.38 -1.53 4.97 2.20 0.07 -1.72 119.74 124.84 2fom s LYS 42 Ca 0.10 0.74 -0.11 0.00 -0.36 0.00 0.00 55.97 56.34 2fom s LYS 42 Cb -0.13 -0.01 0.08 0.00 -1.51 0.00 0.00 37.83 36.27 2fom s LYS 42 CO 0.02 -0.15 0.79 0.39 -0.36 0.00 0.00 175.35 176.05 2fom n GLU 43 N 4.12 -4.41 -0.48 4.03 1.02 -1.26 -1.45 120.64 122.21 2fom n GLU 43 Ca -0.23 0.50 0.00 0.00 -0.02 0.00 0.00 57.16 57.42 2fom n GLU 43 Cb 0.55 -5.17 0.00 0.00 -0.02 0.00 0.00 31.44 26.80 2fom n GLU 43 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2fom n GLY 44 N -1.65 1.09 3.24 0.62 0.00 -1.26 -5.03 105.19 102.21 2fom n GLY 44 Ca -0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 2fom n GLY 44 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fom s THR 45 N -3.11 1.78 -0.18 2.61 2.01 -0.53 -4.67 115.64 113.54 2fom s THR 45 Ca 0.00 -0.95 -0.08 0.00 0.31 0.00 0.00 61.69 60.97 2fom s THR 45 Cb 0.00 -1.49 -0.04 0.00 0.01 0.00 0.00 72.50 70.98 2fom s THR 45 CO 0.00 0.50 0.09 0.12 -0.69 0.00 0.00 174.62 174.65 2fom s PHE 46 N -0.41 3.35 -0.09 4.92 5.36 -0.51 -0.75 117.98 129.86 2fom s PHE 46 Ca 0.05 0.24 0.04 0.00 -0.96 0.00 0.00 56.93 56.30 2fom s PHE 46 Cb -0.10 -2.07 0.00 0.00 -0.34 0.00 0.00 43.02 40.51 2fom s PHE 46 CO 0.00 0.30 -0.23 -1.01 -1.46 0.00 0.00 175.22 172.82 2fom s HIS 47 N 0.11 2.45 0.00 10.12 3.76 0.43 -0.58 115.29 131.57 2fom s HIS 47 Ca 0.07 -0.97 0.00 0.00 -0.15 0.00 0.00 55.06 54.01 2fom s HIS 47 Cb -0.12 -1.64 0.00 0.00 1.11 0.00 0.00 32.58 31.93 2fom s HIS 47 CO -0.00 -0.39 0.00 -2.37 -0.85 0.00 0.00 174.74 171.13 2fom n THR 48 N 3.49 0.00 -3.65 1.30 5.66 -0.57 -0.91 114.28 119.59 2fom n THR 48 Ca -0.19 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.44 2fom n THR 48 Cb 0.53 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.25 2fom n THR 48 CO 0.00 0.00 0.00 -0.04 -3.05 0.00 0.00 175.07 171.98 2fom s MET 49 N -1.30 3.72 0.22 1.09 -1.94 -1.26 -1.41 119.30 118.42 2fom s MET 49 Ca 0.00 0.17 -0.08 0.00 -1.71 0.00 0.00 55.69 54.08 2fom s MET 49 Cb 0.00 -3.17 0.32 0.00 2.01 0.00 0.00 34.83 33.98 2fom s MET 49 CO 0.00 0.70 1.78 2.35 -0.01 0.00 0.00 175.02 179.84 2fom h TRP 50 N 4.62 0.61 0.00 -0.03 2.91 -1.42 -1.61 115.95 121.03 2fom h TRP 50 Ca -0.52 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 59.50 2fom h TRP 50 Cb 1.22 -0.17 -0.00 0.00 -0.51 0.00 0.00 29.16 29.70 2fom h TRP 50 CO 0.72 0.22 -0.10 1.12 -1.03 0.00 0.00 178.44 179.36 2fom h HIS 51 N 0.58 0.00 -0.01 2.65 2.07 -1.95 0.26 115.15 118.75 2fom h HIS 51 Ca 0.34 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.85 2fom h HIS 51 Cb 0.35 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.33 2fom h HIS 51 CO -0.11 0.10 -0.04 0.28 -3.07 0.00 0.00 177.93 175.09 2fom h VAL 52 N 0.00 1.48 0.00 6.12 2.07 -1.64 -3.40 116.25 120.89 2fom h VAL 52 Ca -0.00 -1.47 -0.02 0.00 0.82 0.00 0.00 66.70 66.03 2fom h VAL 52 Cb 0.34 2.44 -0.00 0.00 -1.52 0.00 0.00 31.29 32.54 2fom h VAL 52 CO 0.01 0.39 -1.62 0.35 0.02 0.00 0.00 177.57 176.73 2fom n THR 53 N -4.75 0.09 -2.97 2.57 -2.24 -1.12 -4.98 114.28 100.88 2fom n THR 53 Ca -0.09 -0.32 -0.17 0.00 -2.27 0.00 0.00 64.05 61.20 2fom n THR 53 Cb 0.33 0.11 -0.01 0.00 -2.10 0.00 0.00 70.33 68.67 2fom n THR 53 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2fom n ARG 54 N -2.00 -2.89 -0.37 -0.78 1.74 0.89 -1.17 116.66 112.07 2fom n ARG 54 Ca -0.04 0.45 0.00 0.00 -0.77 0.00 0.00 57.85 57.49 2fom n ARG 54 Cb 0.40 -5.10 0.00 0.00 -1.02 0.00 0.00 32.46 26.74 2fom n ARG 54 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2fom n GLY 55 N -0.96 0.81 3.75 -0.13 0.00 -1.26 -5.04 105.19 102.35 2fom n GLY 55 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 2fom n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fom n ALA 56 N -0.76 1.81 -1.77 4.61 0.00 -0.32 -4.64 120.51 119.44 2fom n ALA 56 Ca 0.00 0.19 -0.40 0.00 0.00 0.00 0.00 53.44 53.23 2fom n ALA 56 Cb 0.00 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.08 2fom n ALA 56 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2fom s VAL 57 N -1.24 2.27 0.15 0.00 1.01 -1.26 -4.79 120.40 116.54 2fom s VAL 57 Ca 0.66 0.25 0.07 0.00 0.00 0.00 0.00 61.98 62.97 2fom s VAL 57 Cb -0.43 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 2fom s VAL 57 CO 0.53 0.05 -0.04 -0.76 0.00 0.00 0.00 175.10 174.88 2fom s LEU 58 N -2.35 3.21 -0.01 3.92 1.43 -0.73 -4.98 118.68 119.16 2fom s LEU 58 Ca 0.56 -0.40 0.07 0.00 -1.03 0.00 0.00 54.13 53.33 2fom s LEU 58 Cb -0.43 -1.91 -0.02 0.00 0.03 0.00 0.00 46.19 43.86 2fom s LEU 58 CO 0.56 0.12 -0.21 -0.04 0.23 0.00 0.00 176.35 177.01 2fom s MET 59 N -2.67 1.72 -0.15 1.70 -1.94 -1.26 -0.58 119.30 116.12 2fom s MET 59 Ca 0.25 -0.77 -0.03 0.00 -1.71 0.00 0.00 55.69 53.43 2fom s MET 59 Cb -0.10 -1.67 0.05 0.00 2.01 0.00 0.00 34.83 35.12 2fom s MET 59 CO 0.17 0.46 0.05 -1.58 -0.01 0.00 0.00 175.02 174.10 2fom s HIS 60 N -0.51 0.66 -1.48 -0.03 5.04 0.48 -4.88 115.29 114.56 2fom s HIS 60 Ca 0.08 -0.50 -0.09 0.00 -1.54 0.00 0.00 55.06 53.01 2fom s HIS 60 Cb -0.08 -0.85 0.06 0.00 0.04 0.00 0.00 32.58 31.75 2fom s HIS 60 CO -0.01 -0.50 0.78 1.63 -2.34 0.00 0.00 174.74 174.30 2fom n LYS 61 N 5.15 -4.57 -0.56 2.88 5.02 -1.26 -1.41 118.16 123.41 2fom n LYS 61 Ca -0.08 0.53 0.00 0.00 -2.02 0.00 0.00 58.31 56.74 2fom n LYS 61 Cb 0.48 -5.17 0.00 0.00 -0.02 0.00 0.00 35.03 30.33 2fom n LYS 61 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2fom n GLY 62 N -1.67 1.31 3.63 0.72 0.00 -1.26 -5.03 105.19 102.89 2fom n GLY 62 Ca -0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 2fom n GLY 62 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2fom s LYS 63 N -0.21 4.00 0.25 1.61 2.20 -0.50 -5.09 119.74 121.99 2fom s LYS 63 Ca 0.00 -0.32 -0.30 0.00 -0.36 0.00 0.00 55.97 55.00 2fom s LYS 63 Cb 0.00 -3.41 -0.09 0.00 -1.51 0.00 0.00 37.83 32.82 2fom s LYS 63 CO 0.00 0.11 0.95 0.50 -0.36 0.00 0.00 175.35 176.55 2fom s ARG 64 N 0.88 4.82 -0.03 4.03 3.00 -1.26 -0.39 118.95 130.00 2fom s ARG 64 Ca 0.06 1.50 0.04 0.00 -1.00 0.00 0.00 55.73 56.32 2fom s ARG 64 Cb -0.13 -3.22 -0.00 0.00 0.00 0.00 0.00 34.95 31.59 2fom s ARG 64 CO 0.03 0.47 -0.14 0.96 0.00 0.00 0.00 175.30 176.62 2fom s ILE 65 N -1.22 1.12 0.07 4.11 -4.36 0.25 -4.96 121.20 116.21 2fom s ILE 65 Ca 0.42 -0.57 0.04 0.00 -0.26 0.00 0.00 60.65 60.28 2fom s ILE 65 Cb -0.26 -0.96 -0.04 0.00 1.25 0.00 0.00 42.46 42.45 2fom s ILE 65 CO 0.32 0.33 0.00 -1.61 0.24 0.00 0.00 174.94 174.22 2fom s GLU 66 N -0.07 2.62 0.32 0.37 2.02 -1.26 -1.78 118.70 120.92 2fom s GLU 66 Ca 0.00 -0.77 -0.29 0.00 0.02 0.00 0.00 54.97 53.92 2fom s GLU 66 Cb -0.08 -2.58 -0.11 0.00 0.10 0.00 0.00 34.13 31.46 2fom s GLU 66 CO 0.01 0.56 1.52 -1.25 0.02 0.00 0.00 175.26 176.12 2fom s PRO 67 N -2.11 4.15 -0.04 0.39 0.04 -1.26 -2.21 135.00 133.95 2fom s PRO 67 Ca 0.24 2.53 0.03 0.00 0.04 0.00 0.00 61.00 63.84 2fom s PRO 67 Cb -0.12 -3.01 -0.05 0.00 0.04 0.00 0.00 34.50 31.36 2fom s PRO 67 CO 0.16 -0.55 0.00 0.43 0.04 0.00 0.00 177.00 177.09 2fom n SER 68 N 1.49 3.94 -3.67 6.66 7.64 0.71 -4.78 113.62 125.61 2fom n SER 68 Ca 0.05 -0.01 -0.15 0.00 1.01 0.00 0.00 58.87 59.78 2fom n SER 68 Cb 0.39 0.48 -0.08 0.00 -1.01 0.00 0.00 64.21 63.98 2fom n SER 68 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 2fom s TRP 69 N -2.10 -0.51 0.03 1.43 -0.00 -0.95 -4.94 118.94 111.90 2fom s TRP 69 Ca -0.03 1.10 -0.05 0.00 -0.00 0.00 0.00 56.10 57.12 2fom s TRP 69 Cb 0.01 0.23 -0.01 0.00 -0.00 0.00 0.00 33.47 33.70 2fom s TRP 69 CO 0.16 -0.39 0.07 0.00 -0.00 0.00 0.00 176.95 176.79 2fom s ALA 70 N -0.44 -0.05 -0.33 5.86 0.00 -1.26 -0.48 121.76 125.06 2fom s ALA 70 Ca -0.06 -0.52 -0.00 0.00 0.00 0.00 0.00 51.96 51.38 2fom s ALA 70 Cb -0.03 0.20 0.11 0.00 0.00 0.00 0.00 23.12 23.40 2fom s ALA 70 CO 0.04 -0.27 0.13 0.34 0.00 0.00 0.00 175.76 175.99 2fom s ASP 71 N -1.90 3.92 0.22 0.00 -1.08 -0.05 -5.00 116.67 112.79 2fom s ASP 71 Ca -0.08 -1.82 -0.07 0.00 -0.52 0.00 0.00 52.55 50.06 2fom s ASP 71 Cb -0.04 -0.87 0.18 0.00 -1.46 0.00 0.00 42.92 40.74 2fom s ASP 71 CO -0.03 -0.39 1.80 0.58 0.52 0.00 0.00 175.17 177.66 2fom h VAL 72 N 6.23 1.26 -0.45 1.11 2.07 -1.96 -0.92 116.25 123.58 2fom h VAL 72 Ca -0.11 -0.77 0.02 0.00 0.82 0.00 0.00 66.70 66.66 2fom h VAL 72 Cb 1.00 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2fom h VAL 72 CO 0.46 0.33 0.30 0.11 0.02 0.00 0.00 177.57 178.79 2fom h LYS 73 N 1.20 0.55 -0.01 1.57 6.56 -1.95 -1.29 116.57 123.19 2fom h LYS 73 Ca 0.28 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.84 2fom h LYS 73 Cb 0.16 -0.12 0.00 0.00 -0.57 0.00 0.00 32.23 31.70 2fom h LYS 73 CO -0.03 0.36 -0.10 1.63 -2.06 0.00 0.00 179.45 179.25 2fom n LYS 74 N -4.47 1.45 -3.37 3.15 5.02 -0.86 -4.95 118.16 114.13 2fom n LYS 74 Ca 0.04 -0.91 -0.19 0.00 -2.02 0.00 0.00 58.31 55.24 2fom n LYS 74 Cb 0.10 -1.48 0.06 0.00 -0.02 0.00 0.00 35.03 33.69 2fom n LYS 74 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2fom n ASP 75 N 0.02 -5.38 -4.26 4.39 2.03 -0.45 -4.93 116.55 107.96 2fom n ASP 75 Ca 0.16 -0.43 -0.26 0.00 0.52 0.00 0.00 54.79 54.78 2fom n ASP 75 Cb 0.38 -4.12 -0.14 0.00 -0.72 0.00 0.00 41.12 36.52 2fom n ASP 75 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2fom s LEU 76 N -6.02 2.18 -0.10 -2.67 1.43 -0.64 -1.35 118.68 111.51 2fom s LEU 76 Ca 0.45 -0.55 -0.10 0.00 -1.03 0.00 0.00 54.13 52.91 2fom s LEU 76 Cb -0.20 -0.98 0.03 0.00 0.03 0.00 0.00 46.19 45.06 2fom s LEU 76 CO 0.58 0.15 0.28 -0.51 0.23 0.00 0.00 176.35 177.08 2fom s ILE 77 N -0.84 0.00 0.12 -0.59 2.07 -0.50 -0.87 121.20 120.59 2fom s ILE 77 Ca 0.08 -0.02 0.10 0.00 -1.41 0.00 0.00 60.65 59.40 2fom s ILE 77 Cb -0.09 -0.40 -0.04 0.00 0.13 0.00 0.00 42.46 42.06 2fom s ILE 77 CO 0.02 -0.01 -0.25 -0.94 -1.91 0.00 0.00 174.94 171.86 2fom s SER 78 N 0.10 3.04 -0.12 4.50 1.04 0.37 -1.51 113.70 121.12 2fom s SER 78 Ca -0.00 -0.73 0.03 0.00 0.48 0.00 0.00 55.95 55.72 2fom s SER 78 Cb -0.02 -0.19 0.01 0.00 0.10 0.00 0.00 66.02 65.92 2fom s SER 78 CO 0.00 0.13 -0.21 -0.31 0.98 0.00 0.00 173.24 173.84 2fom s TYR 79 N -1.13 2.47 0.00 5.02 1.51 0.25 -0.21 117.35 125.26 2fom s TYR 79 Ca 0.12 -1.18 0.00 0.00 -1.01 0.00 0.00 57.07 55.00 2fom s TYR 79 Cb -0.10 -1.69 0.00 0.00 -0.11 0.00 0.00 41.96 40.06 2fom s TYR 79 CO 0.06 -0.54 0.00 0.41 -1.11 0.00 0.00 175.55 174.37 2fom n GLY 80 N 3.97 0.75 0.00 0.71 0.00 -0.94 -1.42 105.19 108.26 2fom n GLY 80 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2fom n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fom n GLY 81 N -2.01 0.80 3.90 -0.02 0.00 -1.26 -4.78 105.19 101.82 2fom n GLY 81 Ca 0.00 -1.01 -0.29 0.00 0.00 0.00 0.00 46.02 44.71 2fom n GLY 81 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fom s GLY 82 N 0.00 1.70 0.08 -0.02 0.00 -1.26 -4.51 107.32 103.31 2fom s GLY 82 Ca 0.00 -0.96 -0.33 0.00 0.00 0.00 0.00 44.72 43.43 2fom s GLY 82 CO 0.00 -0.30 1.79 1.87 0.00 0.00 0.00 173.10 176.46 2fom n TRP 83 N -3.67 2.47 0.38 1.90 -0.00 -1.26 -4.91 117.44 112.35 2fom n TRP 83 Ca 0.12 -0.02 0.06 0.00 -0.00 0.00 0.00 57.50 57.66 2fom n TRP 83 Cb 0.60 -2.67 -0.08 0.00 -0.00 0.00 0.00 31.31 29.16 2fom n TRP 83 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 2fom n LYS 84 N 5.36 2.25 -2.21 5.87 4.76 -1.26 -5.02 118.16 127.91 2fom n LYS 84 Ca 0.19 -0.03 -0.41 0.00 -2.87 0.00 0.00 58.31 55.18 2fom n LYS 84 Cb 0.33 -1.13 -0.03 0.00 -1.84 0.00 0.00 35.03 32.37 2fom n LYS 84 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2fom s LEU 85 N -2.96 4.41 0.00 -0.35 1.43 -1.26 -4.92 118.68 115.03 2fom s LEU 85 Ca 0.02 2.41 0.00 0.00 -1.03 0.00 0.00 54.13 55.52 2fom s LEU 85 Cb 0.09 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.70 2fom s LEU 85 CO 0.49 -0.53 0.27 -1.84 0.23 0.00 0.00 176.35 174.97 2fom n GLU 86 N 2.65 1.79 -1.99 1.70 0.28 -1.25 -5.01 120.64 118.81 2fom n GLU 86 Ca 0.06 -0.27 -0.38 0.00 -0.16 0.00 0.00 57.16 56.40 2fom n GLU 86 Cb 0.43 -0.75 0.01 0.00 1.43 0.00 0.00 31.44 32.56 2fom n GLU 86 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2fom s GLY 87 N -0.33 2.87 -0.11 -1.84 0.00 -0.33 -4.94 107.32 102.64 2fom s GLY 87 Ca 0.00 1.21 -0.01 0.00 0.00 0.00 0.00 44.72 45.92 2fom s GLY 87 CO 0.00 1.74 -0.04 -0.54 0.00 0.00 0.00 173.10 174.27 2fom s GLU 88 N -2.60 1.10 0.34 2.90 2.02 -1.26 -4.37 118.70 116.83 2fom s GLU 88 Ca 0.64 -0.16 -0.20 0.00 0.02 0.00 0.00 54.97 55.26 2fom s GLU 88 Cb -0.37 -1.45 -0.10 0.00 0.10 0.00 0.00 34.13 32.31 2fom s GLU 88 CO 0.46 -0.33 0.85 -0.46 0.02 0.00 0.00 175.26 175.79 2fom s TRP 89 N 1.81 3.48 0.03 1.61 -0.00 -1.26 -5.03 118.94 119.58 2fom s TRP 89 Ca 0.04 1.50 0.06 0.00 -0.00 0.00 0.00 56.10 57.69 2fom s TRP 89 Cb -0.13 -2.73 -0.02 0.00 -0.00 0.00 0.00 33.47 30.58 2fom s TRP 89 CO -0.07 0.11 -0.17 -1.59 -0.00 0.00 0.00 176.95 175.23 2fom s LYS 90 N -2.64 1.15 0.17 5.86 -2.85 -1.26 -5.08 119.74 115.09 2fom s LYS 90 Ca 0.53 -0.77 -0.33 0.00 -1.00 0.00 0.00 55.97 54.40 2fom s LYS 90 Cb -0.13 -1.18 -0.15 0.00 -2.06 0.00 0.00 37.83 34.30 2fom s LYS 90 CO 0.18 0.30 1.26 -1.91 0.10 0.00 0.00 175.35 175.28 2fom n GLU 91 N 2.05 1.34 0.00 1.78 2.13 -1.26 -2.01 120.64 124.68 2fom n GLU 91 Ca -0.17 0.48 0.00 0.00 0.66 0.00 0.00 57.16 58.13 2fom n GLU 91 Cb 0.54 -2.04 0.00 0.00 0.27 0.00 0.00 31.44 30.21 2fom n GLU 91 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2fom n GLY 92 N 2.21 2.91 3.78 8.31 0.00 -1.26 -5.04 105.19 116.09 2fom n GLY 92 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 2fom n GLY 92 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fom s GLU 93 N -0.49 4.55 0.30 1.61 2.02 -0.85 -5.04 118.70 120.80 2fom s GLU 93 Ca 0.00 1.16 -0.09 0.00 0.02 0.00 0.00 54.97 56.06 2fom s GLU 93 Cb 0.00 -3.19 -0.06 0.00 0.10 0.00 0.00 34.13 30.98 2fom s GLU 93 CO 0.00 0.53 0.62 -1.21 0.02 0.00 0.00 175.26 175.22 2fom s GLU 94 N -1.31 3.76 0.38 1.61 2.02 -1.26 -4.35 118.70 119.55 2fom s GLU 94 Ca 0.38 0.26 0.04 0.00 0.02 0.00 0.00 54.97 55.67 2fom s GLU 94 Cb -0.22 -2.57 -0.04 0.00 0.10 0.00 0.00 34.13 31.40 2fom s GLU 94 CO 0.26 0.19 0.10 0.14 0.02 0.00 0.00 175.26 175.97 2fom s VAL 95 N -2.05 0.78 -0.07 2.63 -7.23 -0.20 -4.59 120.40 109.68 2fom s VAL 95 Ca 0.48 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.69 2fom s VAL 95 Cb -0.11 -2.49 -0.00 0.00 0.56 0.00 0.00 36.38 34.34 2fom s VAL 95 CO 0.26 0.00 -0.22 -1.10 -0.31 0.00 0.00 175.10 173.73 2fom s GLN 96 N -3.79 2.48 -0.27 4.82 -0.21 -0.07 -0.82 119.66 121.80 2fom s GLN 96 Ca 0.28 -0.79 -0.22 0.00 0.02 0.00 0.00 55.36 54.65 2fom s GLN 96 Cb 0.05 -2.01 -0.01 0.00 1.00 0.00 0.00 33.01 32.04 2fom s GLN 96 CO 0.14 0.25 0.70 0.08 -2.12 0.00 0.00 175.29 174.34 2fom s VAL 97 N 0.13 4.91 -1.16 1.09 1.01 -0.08 -0.46 120.40 125.84 2fom s VAL 97 Ca -0.10 1.19 -0.14 0.00 0.00 0.00 0.00 61.98 62.93 2fom s VAL 97 Cb -0.15 -4.02 0.17 0.00 0.00 0.00 0.00 36.38 32.38 2fom s VAL 97 CO 0.05 -0.07 1.36 -0.22 0.00 0.00 0.00 175.10 176.22 2fom s LEU 98 N 2.68 5.17 -0.05 3.92 0.20 -0.21 -1.17 118.68 129.21 2fom s LEU 98 Ca 0.29 -2.90 -0.30 0.00 0.69 0.00 0.00 54.13 51.91 2fom s LEU 98 Cb -0.15 -2.38 -0.03 0.00 -0.43 0.00 0.00 46.19 43.20 2fom s LEU 98 CO 0.09 -0.76 1.08 0.00 -0.29 0.00 0.00 176.35 176.48 2fom s ALA 99 N 1.52 3.38 -0.65 5.97 0.00 -0.02 -3.94 121.76 128.01 2fom s ALA 99 Ca 0.40 0.53 -0.05 0.00 0.00 0.00 0.00 51.96 52.84 2fom s ALA 99 Cb -0.04 -3.44 0.17 0.00 0.00 0.00 0.00 23.12 19.81 2fom s ALA 99 CO -0.02 -0.55 0.50 -0.51 0.00 0.00 0.00 175.76 175.18 2fom s LEU 100 N 1.75 5.58 0.22 0.00 1.43 -1.26 -2.02 118.68 124.37 2fom s LEU 100 Ca 0.52 -2.75 -0.13 0.00 -1.03 0.00 0.00 54.13 50.74 2fom s LEU 100 Cb -0.22 -1.93 -0.08 0.00 0.03 0.00 0.00 46.19 43.99 2fom s LEU 100 CO 0.22 -0.43 0.60 -1.61 0.23 0.00 0.00 176.35 175.37 2fom s GLU 101 N 0.08 3.95 0.12 1.70 2.02 -1.26 -4.12 118.70 121.20 2fom s GLU 101 Ca 0.16 0.49 -0.35 0.00 0.02 0.00 0.00 54.97 55.29 2fom s GLU 101 Cb -0.19 -2.72 -0.16 0.00 0.10 0.00 0.00 34.13 31.16 2fom s GLU 101 CO -0.04 0.35 1.38 -2.30 0.02 0.00 0.00 175.26 174.66 2fom n PRO 102 N 0.23 1.44 -0.94 0.39 -0.02 -1.26 -1.72 135.00 133.12 2fom n PRO 102 Ca -0.01 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2fom n PRO 102 Cb 0.52 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 2fom n PRO 102 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fom n GLY 103 N 2.66 0.62 3.14 -1.23 0.00 -1.26 -5.01 105.19 104.11 2fom n GLY 103 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 2fom n GLY 103 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fom s LYS 104 N -0.30 1.12 0.88 1.61 1.02 -0.70 -5.14 119.74 118.23 2fom s LYS 104 Ca 0.00 -0.63 -0.11 0.00 0.02 0.00 0.00 55.97 55.25 2fom s LYS 104 Cb 0.00 -1.11 0.12 0.00 -0.52 0.00 0.00 37.83 36.33 2fom s LYS 104 CO 0.00 0.29 1.15 -0.80 -0.92 0.00 0.00 175.35 175.08 2fom s ASN 105 N -0.67 3.20 0.45 2.83 0.01 -1.26 -4.29 114.94 115.21 2fom s ASN 105 Ca 0.04 2.19 -0.25 0.00 -0.71 0.00 0.00 52.86 54.14 2fom s ASN 105 Cb -0.07 -2.57 -0.08 0.00 0.41 0.00 0.00 41.25 38.94 2fom s ASN 105 CO 0.00 -2.92 1.35 -0.81 -1.51 0.00 0.00 177.10 173.21 2fom n PRO 106 N -3.98 2.02 -3.81 -0.60 -0.04 -1.26 -4.74 135.00 122.59 2fom n PRO 106 Ca 0.12 0.72 -0.13 0.00 -0.04 0.00 0.00 63.50 64.17 2fom n PRO 106 Cb 0.52 -2.51 -0.14 0.00 -0.04 0.00 0.00 33.50 31.32 2fom n PRO 106 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2fom s ARG 107 N -2.41 0.03 -0.16 0.54 3.52 -0.86 -5.00 118.95 114.62 2fom s ARG 107 Ca 0.63 0.17 -0.18 0.00 -0.13 0.00 0.00 55.73 56.22 2fom s ARG 107 Cb -0.47 -0.10 -0.04 0.00 -1.56 0.00 0.00 34.95 32.79 2fom s ARG 107 CO 0.56 -0.09 0.48 0.00 -0.81 0.00 0.00 175.30 175.44 2fom s ALA 108 N 0.58 3.51 -0.16 6.12 0.00 -1.26 -0.84 121.76 129.71 2fom s ALA 108 Ca -0.05 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 51.60 2fom s ALA 108 Cb -0.06 -2.70 0.03 0.00 0.00 0.00 0.00 23.12 20.38 2fom s ALA 108 CO -0.02 -0.20 -0.12 0.08 0.00 0.00 0.00 175.76 175.50 2fom s VAL 109 N 1.08 1.54 0.20 0.00 1.01 -0.32 -4.96 120.40 118.96 2fom s VAL 109 Ca 0.24 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 61.19 2fom s VAL 109 Cb -0.15 -1.52 -0.08 0.00 0.00 0.00 0.00 36.38 34.63 2fom s VAL 109 CO 0.10 0.35 0.95 -1.58 0.00 0.00 0.00 175.10 174.91 2fom s GLN 110 N 1.48 4.81 0.06 2.72 0.74 -1.26 -0.91 119.66 127.30 2fom s GLN 110 Ca 0.03 1.48 -0.17 0.00 0.05 0.00 0.00 55.36 56.75 2fom s GLN 110 Cb -0.14 -3.31 0.03 0.00 1.10 0.00 0.00 33.01 30.69 2fom s GLN 110 CO -0.10 0.42 0.39 -0.08 -0.55 0.00 0.00 175.29 175.37 2fom s THR 111 N -0.81 0.07 -0.37 -0.34 -1.32 0.00 -4.97 115.64 107.89 2fom s THR 111 Ca 0.43 -0.54 -0.12 0.00 -1.21 0.00 0.00 61.69 60.25 2fom s THR 111 Cb -0.25 -1.01 0.02 0.00 -1.51 0.00 0.00 72.50 69.75 2fom s THR 111 CO 0.31 -0.30 0.22 -0.75 -2.21 0.00 0.00 174.62 171.90 2fom s LYS 112 N -2.84 2.92 0.88 7.08 2.20 -1.26 -1.03 119.74 127.68 2fom s LYS 112 Ca -0.03 -1.03 -0.11 0.00 -0.36 0.00 0.00 55.97 54.45 2fom s LYS 112 Cb 0.00 -3.76 0.13 0.00 -1.51 0.00 0.00 37.83 32.68 2fom s LYS 112 CO -0.05 -0.68 1.16 -2.14 -0.36 0.00 0.00 175.35 173.28 2fom s PRO 113 N 1.59 1.24 0.30 4.03 0.02 -1.26 -4.97 135.00 135.94 2fom s PRO 113 Ca 0.03 1.59 0.11 0.00 0.02 0.00 0.00 61.00 62.74 2fom s PRO 113 Cb -0.19 -1.75 -0.05 0.00 0.02 0.00 0.00 34.50 32.53 2fom s PRO 113 CO 0.07 -2.48 -0.11 0.20 -0.33 0.00 0.00 177.00 174.36 2fom s GLY 114 N -2.57 1.93 -0.10 0.52 0.00 -0.10 -4.76 107.32 102.25 2fom s GLY 114 Ca 0.68 -1.89 -0.18 0.00 0.00 0.00 0.00 44.72 43.33 2fom s GLY 114 CO 0.56 -1.92 0.47 1.08 0.00 0.00 0.00 173.10 173.29 2fom s LEU 115 N -3.59 4.30 0.01 0.66 1.43 -1.26 -0.75 118.68 119.48 2fom s LEU 115 Ca 0.32 0.83 0.05 0.00 -1.03 0.00 0.00 54.13 54.30 2fom s LEU 115 Cb -0.03 -2.69 -0.02 0.00 0.03 0.00 0.00 46.19 43.48 2fom s LEU 115 CO 0.17 0.03 -0.15 -0.36 0.23 0.00 0.00 176.35 176.27 2fom s PHE 116 N 0.46 1.35 0.28 0.29 0.40 0.12 -4.95 117.98 115.93 2fom s PHE 116 Ca 0.26 -0.30 -0.28 0.00 -0.60 0.00 0.00 56.93 56.00 2fom s PHE 116 Cb -0.15 -0.83 -0.09 0.00 0.51 0.00 0.00 43.02 42.45 2fom s PHE 116 CO 0.11 0.01 0.97 0.15 0.70 0.00 0.00 175.22 177.16 2fom s LYS 117 N -0.74 4.69 0.26 0.44 3.01 -1.26 -0.20 119.74 125.94 2fom s LYS 117 Ca 0.04 1.49 0.03 0.00 -1.01 0.00 0.00 55.97 56.53 2fom s LYS 117 Cb -0.07 -3.06 -0.04 0.00 -1.01 0.00 0.00 37.83 33.65 2fom s LYS 117 CO 0.00 0.35 0.20 0.95 0.51 0.00 0.00 175.35 177.36 2fom s THR 118 N -1.35 0.00 0.29 2.17 -4.23 -1.15 -1.44 115.64 109.94 2fom s THR 118 Ca 0.46 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.96 2fom s THR 118 Cb -0.24 -2.50 0.16 0.00 1.34 0.00 0.00 72.50 71.26 2fom s THR 118 CO 0.31 0.00 1.84 0.78 -0.54 0.00 0.00 174.62 177.01 2fom h ASN 119 N 2.39 0.74 -0.15 3.99 2.35 -1.94 -3.23 115.58 119.74 2fom h ASN 119 Ca -0.31 -0.13 -0.20 0.00 -0.55 0.00 0.00 56.30 55.12 2fom h ASN 119 Cb 1.24 -0.19 0.01 0.00 0.05 0.00 0.00 38.32 39.43 2fom h ASN 119 CO 0.45 0.73 -0.69 0.71 -1.65 0.00 0.00 177.43 176.98 2fom h THR 120 N 0.78 1.30 0.00 2.81 1.35 -1.97 -3.49 112.91 113.69 2fom h THR 120 Ca 0.17 -1.91 0.00 0.00 -0.55 0.00 0.00 66.41 64.12 2fom h THR 120 Cb 0.27 2.02 0.00 0.00 -1.73 0.00 0.00 68.15 68.71 2fom h THR 120 CO -0.00 0.60 0.00 0.61 -0.25 0.00 0.00 175.52 176.48 2fom n GLY 121 N 0.68 -0.90 3.43 5.82 0.00 -1.22 -5.14 105.19 107.86 2fom n GLY 121 Ca -0.07 0.65 -0.12 0.00 0.00 0.00 0.00 46.02 46.47 2fom n GLY 121 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fom s THR 122 N 1.37 -0.01 0.15 2.61 2.01 -1.26 -2.93 115.64 117.58 2fom s THR 122 Ca 0.00 0.02 0.06 0.00 0.31 0.00 0.00 61.69 62.08 2fom s THR 122 Cb 0.00 -0.76 -0.04 0.00 0.01 0.00 0.00 72.50 71.71 2fom s THR 122 CO 0.00 0.01 -0.12 0.27 -0.69 0.00 0.00 174.62 174.08 2fom s ILE 123 N 0.71 1.33 0.01 1.82 -4.36 0.72 -4.62 121.20 116.81 2fom s ILE 123 Ca -0.03 -1.96 -0.14 0.00 -0.26 0.00 0.00 60.65 58.26 2fom s ILE 123 Cb -0.05 -1.76 -0.06 0.00 1.25 0.00 0.00 42.46 41.85 2fom s ILE 123 CO -0.05 -0.60 0.40 -0.83 0.24 0.00 0.00 174.94 174.10 2fom s GLY 124 N -2.92 2.44 0.01 6.27 0.00 0.33 0.12 107.32 113.56 2fom s GLY 124 Ca 0.15 -0.26 -0.24 0.00 0.00 0.00 0.00 44.72 44.36 2fom s GLY 124 CO 0.03 0.07 0.55 0.00 0.00 0.00 0.00 173.10 173.75 2fom s ALA 125 N -1.14 -1.42 0.29 3.20 0.00 0.07 -0.42 121.76 122.34 2fom s ALA 125 Ca 0.25 0.81 0.08 0.00 0.00 0.00 0.00 51.96 53.11 2fom s ALA 125 Cb -0.16 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.14 2fom s ALA 125 CO 0.14 -0.43 0.13 0.14 0.00 0.00 0.00 175.76 175.73 2fom s VAL 126 N -1.89 3.64 0.47 0.00 -7.23 -0.46 -0.92 120.40 114.01 2fom s VAL 126 Ca -0.08 -1.65 -0.22 0.00 -1.81 0.00 0.00 61.98 58.22 2fom s VAL 126 Cb -0.01 -3.08 -0.07 0.00 0.56 0.00 0.00 36.38 33.78 2fom s VAL 126 CO 0.03 -0.29 1.13 -0.55 -0.31 0.00 0.00 175.10 175.10 2fom s SER 127 N -3.81 6.18 -1.27 4.85 0.15 -1.26 -0.47 113.70 118.07 2fom s SER 127 Ca 0.35 2.20 -0.17 0.00 0.70 0.00 0.00 55.95 59.03 2fom s SER 127 Cb -0.06 -2.59 0.10 0.00 -1.71 0.00 0.00 66.02 61.76 2fom s SER 127 CO 0.23 -0.91 1.64 -0.76 1.20 0.00 0.00 173.24 174.65 2fom s LEU 128 N -3.18 4.19 -0.14 3.45 1.43 -1.26 -4.71 118.68 118.45 2fom s LEU 128 Ca 0.65 -2.59 0.16 0.00 -1.03 0.00 0.00 54.13 51.32 2fom s LEU 128 Cb -0.25 -2.53 0.43 0.00 0.03 0.00 0.00 46.19 43.87 2fom s LEU 128 CO 0.30 -1.05 1.32 0.47 0.23 0.00 0.00 176.35 177.62 2fom n ASP 129 N 7.61 3.35 -4.30 2.29 8.00 -1.26 -4.99 116.55 127.25 2fom n ASP 129 Ca 0.45 -2.87 -0.16 0.00 0.71 0.00 0.00 54.79 52.93 2fom n ASP 129 Cb 0.45 -0.46 -0.10 0.00 -0.02 0.00 0.00 41.12 40.99 2fom n ASP 129 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2fom s PHE 130 N -2.54 1.46 0.39 1.24 0.08 -1.26 -5.13 117.98 112.22 2fom s PHE 130 Ca 0.36 -1.17 -0.26 0.00 0.12 0.00 0.00 56.93 55.97 2fom s PHE 130 Cb 0.29 -0.84 -0.11 0.00 -0.57 0.00 0.00 43.02 41.79 2fom s PHE 130 CO 0.08 -0.34 1.26 0.45 -0.10 0.00 0.00 175.22 176.57 2fom n SER 131 N -0.42 2.53 0.16 1.36 2.88 -1.26 -4.86 113.62 114.01 2fom n SER 131 Ca -0.01 1.14 0.19 0.00 -1.33 0.00 0.00 58.87 58.86 2fom n SER 131 Cb 0.66 -1.48 0.78 0.00 -0.75 0.00 0.00 64.21 63.42 2fom n SER 131 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2fom h PRO 132 N 2.22 0.00 0.00 -1.46 0.11 -1.99 -0.55 132.00 130.32 2fom h PRO 132 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2fom h PRO 132 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2fom h PRO 132 CO 0.61 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.81 2fom n GLY 133 N -1.42 -0.87 0.07 -0.55 0.00 -1.26 -2.06 105.19 99.09 2fom n GLY 133 Ca 0.04 -0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.11 2fom n GLY 133 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2fom n THR 134 N -1.29 0.45 -1.63 2.61 -1.04 -0.21 -3.27 114.28 109.91 2fom n THR 134 Ca 0.08 -0.11 -0.53 0.00 -2.04 0.00 0.00 64.05 61.45 2fom n THR 134 Cb 0.14 -0.64 -0.06 0.00 -1.82 0.00 0.00 70.33 67.95 2fom n THR 134 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2fom n SER 135 N -1.97 1.92 0.00 8.00 7.64 -0.87 -1.14 113.62 127.20 2fom n SER 135 Ca 0.06 1.10 0.00 0.00 1.01 0.00 0.00 58.87 61.04 2fom n SER 135 Cb 0.37 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.37 2fom n SER 135 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2fom n GLY 136 N 3.02 1.66 3.77 0.23 0.00 0.28 -0.25 105.19 113.89 2fom n GLY 136 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 2fom n GLY 136 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fom s SER 137 N -1.63 6.00 0.35 1.61 0.01 -0.29 -3.41 113.70 116.33 2fom s SER 137 Ca 0.00 2.43 -0.25 0.00 1.31 0.00 0.00 55.95 59.44 2fom s SER 137 Cb 0.00 -2.61 -0.10 0.00 0.21 0.00 0.00 66.02 63.52 2fom s SER 137 CO 0.00 -1.04 0.98 -2.16 0.41 0.00 0.00 173.24 171.43 2fom s PRO 138 N -2.69 4.44 -0.26 12.44 0.04 -1.25 -0.53 135.00 147.19 2fom s PRO 138 Ca 0.64 1.38 -0.04 0.00 0.04 0.00 0.00 61.00 63.02 2fom s PRO 138 Cb -0.32 -2.70 0.01 0.00 0.04 0.00 0.00 34.50 31.53 2fom s PRO 138 CO 0.39 0.14 0.01 0.42 0.04 0.00 0.00 177.00 177.99 2fom s ILE 139 N -1.65 3.49 0.10 0.56 1.01 -0.14 -1.05 121.20 123.52 2fom s ILE 139 Ca 0.53 -0.73 0.07 0.00 0.00 0.00 0.00 60.65 60.52 2fom s ILE 139 Cb -0.19 -2.74 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 2fom s ILE 139 CO 0.25 0.21 -0.13 0.68 0.00 0.00 0.00 174.94 175.94 2fom s VAL 140 N 1.44 3.18 0.56 2.92 -7.23 0.39 -0.17 120.40 121.49 2fom s VAL 140 Ca 0.03 -1.31 0.01 0.00 -1.81 0.00 0.00 61.98 58.90 2fom s VAL 140 Cb -0.16 -2.46 0.11 0.00 0.56 0.00 0.00 36.38 34.43 2fom s VAL 140 CO -0.01 0.14 0.77 -0.90 -0.31 0.00 0.00 175.10 174.79 2fom n ASP 141 N 0.85 1.17 0.15 4.85 5.68 -0.07 -0.89 116.55 128.28 2fom n ASP 141 Ca -0.14 -1.95 0.12 0.00 -0.50 0.00 0.00 54.79 52.31 2fom n ASP 141 Cb 0.52 -0.49 0.54 0.00 -1.14 0.00 0.00 41.12 40.55 2fom n ASP 141 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2fom n LYS 142 N -2.40 0.19 -0.03 0.11 5.02 -1.26 -0.67 118.16 119.12 2fom n LYS 142 Ca 0.13 0.49 0.13 0.00 -2.02 0.00 0.00 58.31 57.05 2fom n LYS 142 Cb 0.47 -1.92 0.46 0.00 -0.02 0.00 0.00 35.03 34.02 2fom n LYS 142 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2fom n LYS 143 N -2.29 1.73 -1.03 1.97 5.02 -1.26 -4.92 118.16 117.37 2fom n LYS 143 Ca 0.01 -1.07 -0.01 0.00 -2.02 0.00 0.00 58.31 55.22 2fom n LYS 143 Cb 0.18 -1.46 -0.01 0.00 -0.02 0.00 0.00 35.03 33.73 2fom n LYS 143 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2fom n GLY 144 N 1.18 0.49 3.87 0.72 0.00 0.16 -5.03 105.19 106.57 2fom n GLY 144 Ca 0.18 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 2fom n GLY 144 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fom s LYS 145 N -0.95 3.81 -0.37 1.61 -0.14 -1.26 -4.83 119.74 117.61 2fom s LYS 145 Ca 0.00 0.30 -0.21 0.00 -1.36 0.00 0.00 55.97 54.70 2fom s LYS 145 Cb 0.00 -2.61 0.01 0.00 -1.68 0.00 0.00 37.83 33.54 2fom s LYS 145 CO 0.00 0.28 0.67 0.08 -0.76 0.00 0.00 175.35 175.62 2fom s VAL 146 N -1.87 4.84 -0.39 3.17 1.01 -1.26 -0.89 120.40 125.00 2fom s VAL 146 Ca 0.48 0.59 0.23 0.00 0.00 0.00 0.00 61.98 63.28 2fom s VAL 146 Cb -0.11 -4.13 0.07 0.00 0.00 0.00 0.00 36.38 32.21 2fom s VAL 146 CO 0.22 -0.39 1.22 -0.37 0.00 0.00 0.00 175.10 175.78 2fom h VAL 147 N 5.73 0.00 0.00 2.92 -1.51 -0.76 -0.85 116.25 121.77 2fom h VAL 147 Ca -0.26 -0.85 0.00 0.00 -1.23 0.00 0.00 66.70 64.37 2fom h VAL 147 Cb 1.10 1.45 0.00 0.00 -2.13 0.00 0.00 31.29 31.72 2fom h VAL 147 CO 0.86 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.81 2fom n GLY 148 N 1.21 -1.14 3.36 5.19 0.00 -1.19 -4.74 105.19 107.87 2fom n GLY 148 Ca 0.02 -1.00 -0.31 0.00 0.00 0.00 0.00 46.02 44.73 2fom n GLY 148 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fom s LEU 149 N 0.00 2.23 0.41 0.99 1.43 -1.26 -0.97 118.68 121.52 2fom s LEU 149 Ca 0.00 -0.47 -0.26 0.00 -1.03 0.00 0.00 54.13 52.37 2fom s LEU 149 Cb 0.00 -1.37 -0.09 0.00 0.03 0.00 0.00 46.19 44.76 2fom s LEU 149 CO 0.00 0.30 1.32 -0.47 0.23 0.00 0.00 176.35 177.73 2fom s TYR 150 N -0.72 2.76 0.00 0.29 5.04 0.31 -4.23 117.35 120.81 2fom s TYR 150 Ca 0.11 1.39 0.00 0.00 -2.44 0.00 0.00 57.07 56.13 2fom s TYR 150 Cb -0.10 -3.71 0.00 0.00 0.35 0.00 0.00 41.96 38.50 2fom s TYR 150 CO 0.01 -2.22 0.00 0.41 -1.34 0.00 0.00 175.55 172.41 2fom n GLY 151 N 0.65 1.17 3.44 8.97 0.00 -1.26 -0.56 105.19 117.60 2fom n GLY 151 Ca 0.04 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.62 2fom n GLY 151 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2fom s ASN 152 N -2.00 6.77 -0.15 1.61 2.47 -1.26 -4.92 114.94 117.45 2fom s ASN 152 Ca 0.00 -2.38 -0.29 0.00 0.42 0.00 0.00 52.86 50.61 2fom s ASN 152 Cb 0.00 -2.38 -0.02 0.00 -1.45 0.00 0.00 41.25 37.40 2fom s ASN 152 CO 0.00 -0.92 1.33 -0.83 -3.72 0.00 0.00 177.10 172.96 2fom s GLY 153 N 3.24 1.61 0.07 1.21 0.00 -1.26 -0.96 107.32 111.24 2fom s GLY 153 Ca 0.34 0.52 0.07 0.00 0.00 0.00 0.00 44.72 45.64 2fom s GLY 153 CO -0.07 2.60 -0.18 0.14 0.00 0.00 0.00 173.10 175.58 2fom s VAL 154 N 3.64 1.49 -0.14 1.40 1.01 -0.35 -4.96 120.40 122.49 2fom s VAL 154 Ca 0.58 -1.34 -0.17 0.00 0.00 0.00 0.00 61.98 61.05 2fom s VAL 154 Cb -0.23 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 2fom s VAL 154 CO 0.17 -0.03 0.42 -0.69 0.00 0.00 0.00 175.10 174.97 2fom s VAL 155 N -1.07 5.22 0.69 2.92 1.01 -1.26 -1.61 120.40 126.31 2fom s VAL 155 Ca 0.04 0.82 -0.04 0.00 0.00 0.00 0.00 61.98 62.80 2fom s VAL 155 Cb -0.09 -3.76 0.08 0.00 0.00 0.00 0.00 36.38 32.61 2fom s VAL 155 CO 0.03 0.33 0.98 0.42 0.00 0.00 0.00 175.10 176.85 2fom s THR 156 N 0.70 2.32 0.43 3.92 -4.23 0.35 -4.74 115.64 114.39 2fom s THR 156 Ca 0.23 -0.42 0.11 0.00 -1.18 0.00 0.00 61.69 60.44 2fom s THR 156 Cb -0.14 -2.90 0.20 0.00 1.34 0.00 0.00 72.50 70.99 2fom s THR 156 CO 0.08 0.00 1.99 0.08 -0.54 0.00 0.00 174.62 176.23 2fom h ARG 157 N -0.50 0.18 0.00 3.99 -0.00 -1.58 -1.75 114.38 114.72 2fom h ARG 157 Ca -0.42 -0.03 0.00 0.00 -0.00 0.00 0.00 59.98 59.53 2fom h ARG 157 Cb 1.29 -0.03 0.00 0.00 -0.00 0.00 0.00 29.97 31.23 2fom h ARG 157 CO 0.52 0.26 0.00 -1.13 -0.00 0.00 0.00 179.97 179.62 2fom n SER 158 N -4.36 0.00 0.00 0.08 3.41 -1.26 -4.88 113.62 106.61 2fom n SER 158 Ca -0.01 -0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.49 2fom n SER 158 Cb 0.20 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 2fom n SER 158 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fom n GLY 159 N 0.98 0.71 3.90 5.00 0.00 -0.66 -5.06 105.19 110.07 2fom n GLY 159 Ca 0.13 -0.65 -0.32 0.00 0.00 0.00 0.00 46.02 45.18 2fom n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fom s ALA 160 N -2.00 3.84 -0.15 4.61 0.00 -1.26 -4.88 121.76 121.92 2fom s ALA 160 Ca 0.00 -0.60 -0.10 0.00 0.00 0.00 0.00 51.96 51.26 2fom s ALA 160 Cb 0.00 -2.07 -0.05 0.00 0.00 0.00 0.00 23.12 21.00 2fom s ALA 160 CO 0.00 0.69 0.17 0.71 0.00 0.00 0.00 175.76 177.34 2fom s TYR 161 N -1.57 3.51 0.27 0.00 1.51 -1.26 -0.50 117.35 119.31 2fom s TYR 161 Ca 0.38 0.48 0.02 0.00 -1.01 0.00 0.00 57.07 56.94 2fom s TYR 161 Cb -0.13 -2.11 -0.05 0.00 -0.11 0.00 0.00 41.96 39.56 2fom s TYR 161 CO 0.24 0.47 0.10 0.14 -1.11 0.00 0.00 175.55 175.39 2fom s VAL 162 N -0.23 0.63 -0.50 0.71 -7.23 -0.63 -4.66 120.40 108.49 2fom s VAL 162 Ca 0.13 -2.00 -0.14 0.00 -1.81 0.00 0.00 61.98 58.16 2fom s VAL 162 Cb -0.12 -2.65 0.11 0.00 0.56 0.00 0.00 36.38 34.28 2fom s VAL 162 CO 0.02 0.00 0.42 -0.55 -0.31 0.00 0.00 175.10 174.68 2fom s SER 163 N -3.35 6.02 0.34 4.85 0.15 0.38 -1.21 113.70 120.88 2fom s SER 163 Ca 0.37 -1.66 -0.28 0.00 0.70 0.00 0.00 55.95 55.09 2fom s SER 163 Cb 0.08 -2.14 -0.10 0.00 -1.71 0.00 0.00 66.02 62.15 2fom s SER 163 CO 0.14 -0.74 1.22 0.00 1.20 0.00 0.00 173.24 175.07 2fom s ALA 164 N 1.55 3.38 0.00 5.45 0.00 -0.13 -1.36 121.76 130.65 2fom s ALA 164 Ca 0.04 1.10 0.00 0.00 0.00 0.00 0.00 51.96 53.10 2fom s ALA 164 Cb -0.27 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.43 2fom s ALA 164 CO 0.03 -0.51 0.00 0.44 0.00 0.00 0.00 175.76 175.72 2fom n ILE 165 N 0.68 0.00 -3.62 0.00 -5.35 0.43 -4.61 119.36 106.88 2fom n ILE 165 Ca 0.01 0.00 -0.15 0.00 -0.27 0.00 0.00 62.75 62.34 2fom n ILE 165 Cb 0.44 0.37 -0.07 0.00 -1.74 0.00 0.00 39.64 38.63 2fom n ILE 165 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2fom s ALA 166 N -1.65 -1.56 -2.71 -1.28 0.00 -1.07 -4.63 121.76 108.87 2fom s ALA 166 Ca 0.00 1.51 0.22 0.00 0.00 0.00 0.00 51.96 53.68 2fom s ALA 166 Cb 0.00 -0.61 0.17 0.00 0.00 0.00 0.00 23.12 22.68 2fom s ALA 166 CO 0.00 -0.32 1.19 0.09 0.00 0.00 0.00 175.76 176.72