#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p1d s VAL 19 N 0.00 0.37 0.38 5.09 -7.23 -1.26 -5.15 120.40 112.60 1p1d s VAL 19 Ca 0.00 -0.03 0.05 0.00 -1.81 0.00 0.00 61.98 60.20 1p1d s VAL 19 Cb 0.00 -0.43 -0.07 0.00 0.56 0.00 0.00 36.38 36.44 1p1d s VAL 19 CO 0.00 0.19 0.03 0.68 -0.31 0.00 0.00 175.10 175.69 1p1d s VAL 20 N 0.97 1.60 -0.20 1.32 -7.23 -1.26 -4.93 120.40 110.67 1p1d s VAL 20 Ca -0.10 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.02 1p1d s VAL 20 Cb -0.14 -2.85 0.07 0.00 0.56 0.00 0.00 36.38 34.02 1p1d s VAL 20 CO -0.01 0.00 0.10 -2.28 -0.31 0.00 0.00 175.10 172.60 1p1d s HIS 21 N -2.96 0.26 0.20 2.82 2.46 -1.26 -4.94 115.29 111.88 1p1d s HIS 21 Ca 0.34 -0.47 -0.32 0.00 0.47 0.00 0.00 55.06 55.07 1p1d s HIS 21 Cb 0.09 -0.76 -0.14 0.00 -0.13 0.00 0.00 32.58 31.64 1p1d s HIS 21 CO 0.16 -0.59 1.38 0.25 -2.47 0.00 0.00 174.74 173.47 1p1d n THR 22 N 5.26 0.73 -3.79 0.89 -2.24 -1.26 -3.36 114.28 110.50 1p1d n THR 22 Ca -0.07 -0.18 -0.10 0.00 -2.27 0.00 0.00 64.05 61.43 1p1d n THR 22 Cb 0.47 -1.30 -0.07 0.00 -2.10 0.00 0.00 70.33 67.33 1p1d n THR 22 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1p1d s GLU 23 N -0.14 0.84 0.01 -0.78 2.02 -0.45 -4.99 118.70 115.22 1p1d s GLU 23 Ca 0.72 -0.74 0.03 0.00 0.02 0.00 0.00 54.97 55.00 1p1d s GLU 23 Cb -0.72 0.36 -0.03 0.00 0.10 0.00 0.00 34.13 33.83 1p1d s GLU 23 CO 0.48 -0.28 -0.05 0.95 0.02 0.00 0.00 175.26 176.38 1p1d s THR 24 N -3.28 3.73 0.10 3.63 -4.23 -1.26 -1.66 115.64 112.68 1p1d s THR 24 Ca 0.00 -0.79 -0.02 0.00 -1.18 0.00 0.00 61.69 59.71 1p1d s THR 24 Cb 0.02 -2.64 -0.04 0.00 1.34 0.00 0.00 72.50 71.18 1p1d s THR 24 CO -0.08 0.36 0.04 -0.89 -0.54 0.00 0.00 174.62 173.51 1p1d s THR 25 N -1.04 0.14 0.24 3.99 2.01 0.12 -4.97 115.64 116.12 1p1d s THR 25 Ca 0.18 -1.83 0.06 0.00 0.31 0.00 0.00 61.69 60.42 1p1d s THR 25 Cb -0.11 -1.83 -0.03 0.00 0.01 0.00 0.00 72.50 70.53 1p1d s THR 25 CO 0.09 -0.65 0.22 -1.83 -0.69 0.00 0.00 174.62 171.76 1p1d s GLU 26 N -3.99 3.03 -0.10 4.92 1.03 -1.26 0.19 118.70 122.51 1p1d s GLU 26 Ca 0.17 -0.97 -0.08 0.00 0.03 0.00 0.00 54.97 54.12 1p1d s GLU 26 Cb 0.07 -2.64 0.03 0.00 -0.80 0.00 0.00 34.13 30.80 1p1d s GLU 26 CO -0.03 0.42 0.26 0.08 -1.33 0.00 0.00 175.26 174.66 1p1d s VAL 27 N -2.06 -0.01 -0.18 1.83 1.01 0.12 -4.87 120.40 116.24 1p1d s VAL 27 Ca 0.33 0.05 -0.01 0.00 0.00 0.00 0.00 61.98 62.35 1p1d s VAL 27 Cb -0.08 -0.38 0.00 0.00 0.00 0.00 0.00 36.38 35.91 1p1d s VAL 27 CO 0.26 0.02 -0.13 0.54 0.00 0.00 0.00 175.10 175.79 1p1d s VAL 28 N 0.57 2.72 -0.21 2.92 0.11 -1.26 -0.92 120.40 124.34 1p1d s VAL 28 Ca -0.04 -0.73 -0.02 0.00 -2.93 0.00 0.00 61.98 58.27 1p1d s VAL 28 Cb -0.05 -2.18 0.01 0.00 -1.53 0.00 0.00 36.38 32.63 1p1d s VAL 28 CO -0.03 0.49 -0.11 -0.76 -3.33 0.00 0.00 175.10 171.37 1p1d s LEU 29 N 1.13 2.67 0.29 2.54 1.02 -0.42 -4.84 118.68 121.07 1p1d s LEU 29 Ca 0.01 -0.59 0.06 0.00 0.02 0.00 0.00 54.13 53.63 1p1d s LEU 29 Cb -0.14 -1.63 -0.02 0.00 0.02 0.00 0.00 46.19 44.42 1p1d s LEU 29 CO -0.05 -0.03 0.34 0.42 0.02 0.00 0.00 176.35 177.05 1p1d s THR 30 N 1.38 4.39 -0.42 5.49 -4.23 -1.26 0.12 115.64 121.10 1p1d s THR 30 Ca 0.04 -1.16 -0.09 0.00 -1.18 0.00 0.00 61.69 59.31 1p1d s THR 30 Cb -0.14 -3.49 0.09 0.00 1.34 0.00 0.00 72.50 70.29 1p1d s THR 30 CO -0.07 -0.25 0.26 0.00 -0.54 0.00 0.00 174.62 174.02 1p1d s ALA 31 N -2.14 3.29 0.55 3.99 0.00 -0.90 -4.41 121.76 122.15 1p1d s ALA 31 Ca 0.38 -2.23 -0.17 0.00 0.00 0.00 0.00 51.96 49.94 1p1d s ALA 31 Cb -0.08 -2.65 -0.05 0.00 0.00 0.00 0.00 23.12 20.34 1p1d s ALA 31 CO 0.28 -1.69 1.04 0.34 0.00 0.00 0.00 175.76 175.73 1p1d s ASP 32 N 2.17 6.03 0.00 0.00 2.15 -1.01 -4.76 116.67 121.25 1p1d s ASP 32 Ca 0.04 1.83 0.06 0.00 0.43 0.00 0.00 52.55 54.90 1p1d s ASP 32 Cb -0.23 -2.54 0.35 0.00 -0.30 0.00 0.00 42.92 40.20 1p1d s ASP 32 CO 0.01 -0.99 1.11 -0.81 -0.17 0.00 0.00 175.17 174.32 1p1d n PRO 33 N -1.67 0.87 -0.02 4.34 -0.04 -1.26 -1.09 135.00 136.14 1p1d n PRO 33 Ca 0.09 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.52 1p1d n PRO 33 Cb 0.53 -1.11 -0.01 0.00 -0.04 0.00 0.00 33.50 32.87 1p1d n PRO 33 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1p1d n VAL 34 N -0.61 0.20 -0.10 0.52 0.31 -1.26 -4.91 118.33 112.48 1p1d n VAL 34 Ca 0.04 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1p1d n VAL 34 Cb 0.02 -1.11 0.00 0.00 -0.91 0.00 0.00 33.84 31.84 1p1d n VAL 34 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1p1d n THR 35 N -2.90 0.00 0.00 2.52 5.66 -1.24 -5.07 114.28 113.25 1p1d n THR 35 Ca -0.07 -0.16 0.00 0.00 -3.05 0.00 0.00 64.05 60.78 1p1d n THR 35 Cb 0.56 1.10 0.00 0.00 -1.55 0.00 0.00 70.33 70.43 1p1d n THR 35 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1p1d n GLY 36 N 0.27 0.75 2.85 1.09 0.00 -0.25 -4.35 105.19 105.56 1p1d n GLY 36 Ca 0.00 0.50 -0.26 0.00 0.00 0.00 0.00 46.02 46.26 1p1d n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1p1d s PHE 37 N 0.00 1.22 -0.38 1.61 0.40 -1.26 -2.41 117.98 117.16 1p1d s PHE 37 Ca 0.00 -0.60 0.05 0.00 -0.60 0.00 0.00 56.93 55.79 1p1d s PHE 37 Cb 0.00 -1.09 0.61 0.00 0.51 0.00 0.00 43.02 43.05 1p1d s PHE 37 CO 0.00 -0.47 1.77 0.41 0.70 0.00 0.00 175.22 177.63 1p1d n GLY 38 N 5.01 3.96 3.10 4.36 0.00 -1.26 -4.89 105.19 115.46 1p1d n GLY 38 Ca -0.10 -0.93 -0.26 0.00 0.00 0.00 0.00 46.02 44.73 1p1d n GLY 38 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1p1d s ILE 39 N -2.84 1.34 -0.02 -0.61 -4.36 -1.26 0.84 121.20 114.29 1p1d s ILE 39 Ca 0.50 -0.64 0.07 0.00 -0.26 0.00 0.00 60.65 60.32 1p1d s ILE 39 Cb 0.41 -1.17 -0.02 0.00 1.25 0.00 0.00 42.46 42.93 1p1d s ILE 39 CO 0.10 0.39 -0.23 0.00 0.24 0.00 0.00 174.94 175.45 1p1d s GLN 40 N 0.26 1.86 0.14 0.37 -2.07 -0.73 -5.01 119.66 114.49 1p1d s GLN 40 Ca -0.08 -0.82 0.05 0.00 -1.82 0.00 0.00 55.36 52.69 1p1d s GLN 40 Cb -0.13 -1.80 -0.04 0.00 -1.09 0.00 0.00 33.01 29.95 1p1d s GLN 40 CO 0.03 0.49 -0.12 -0.48 -1.32 0.00 0.00 175.29 173.89 1p1d s LEU 41 N -0.53 2.47 0.42 2.60 -0.00 -1.26 -0.08 118.68 122.30 1p1d s LEU 41 Ca 0.09 -0.92 0.07 0.00 -0.00 0.00 0.00 54.13 53.37 1p1d s LEU 41 Cb -0.09 -0.47 -0.04 0.00 -0.00 0.00 0.00 46.19 45.59 1p1d s LEU 41 CO -0.01 -0.23 0.23 0.00 -0.00 0.00 0.00 176.35 176.35 1p1d s GLN 42 N -3.23 2.30 -0.07 1.48 -2.07 0.76 -4.88 119.66 113.95 1p1d s GLN 42 Ca 0.14 -1.77 0.10 0.00 -1.82 0.00 0.00 55.36 52.00 1p1d s GLN 42 Cb -0.01 -2.08 0.15 0.00 -1.09 0.00 0.00 33.01 29.97 1p1d s GLN 42 CO 0.02 -0.14 1.04 0.41 -1.32 0.00 0.00 175.29 175.30 1p1d n GLY 43 N -1.32 2.86 2.70 2.60 0.00 -1.26 -1.13 105.19 109.64 1p1d n GLY 43 Ca 0.00 -0.58 -0.34 0.00 0.00 0.00 0.00 46.02 45.10 1p1d n GLY 43 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1p1d n SER 44 N -0.81 5.12 0.03 1.61 2.88 -1.26 -4.12 113.62 117.07 1p1d n SER 44 Ca 0.08 -3.49 -0.08 0.00 -1.33 0.00 0.00 58.87 54.05 1p1d n SER 44 Cb 0.58 -0.91 0.08 0.00 -0.75 0.00 0.00 64.21 63.21 1p1d n SER 44 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1p1d h VAL 45 N 3.14 1.34 0.00 2.46 2.07 -1.87 -3.41 116.25 119.98 1p1d h VAL 45 Ca 0.22 -1.85 0.00 0.00 0.82 0.00 0.00 66.70 65.89 1p1d h VAL 45 Cb 0.59 1.85 0.00 0.00 -1.52 0.00 0.00 31.29 32.21 1p1d h VAL 45 CO 1.04 0.57 -0.40 2.22 0.02 0.00 0.00 177.57 181.02 1p1d n PHE 46 N -3.93 0.00 -3.27 1.57 1.16 -1.26 -5.10 117.46 106.62 1p1d n PHE 46 Ca -0.03 0.00 -0.15 0.00 -1.87 0.00 0.00 57.45 55.40 1p1d n PHE 46 Cb 0.61 0.29 0.02 0.00 -1.61 0.00 0.00 39.48 38.78 1p1d n PHE 46 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1p1d n ALA 47 N -2.67 -2.24 0.00 1.98 0.00 -1.26 -5.01 120.51 111.32 1p1d n ALA 47 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1p1d n ALA 47 Cb 0.20 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.34 1p1d n ALA 47 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1p1d n THR 48 N 0.64 0.00 -2.89 0.00 5.66 -1.26 -5.06 114.28 111.37 1p1d n THR 48 Ca -0.03 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.87 1p1d n THR 48 Cb 0.54 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.33 1p1d n THR 48 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1p1d n GLU 49 N 0.00 -2.41 0.00 1.09 2.13 -1.26 -4.80 120.64 115.39 1p1d n GLU 49 Ca 0.00 2.11 0.00 0.00 0.66 0.00 0.00 57.16 59.93 1p1d n GLU 49 Cb 0.00 -5.39 0.00 0.00 0.27 0.00 0.00 31.44 26.32 1p1d n GLU 49 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1p1d n THR 50 N -0.23 0.00 -0.91 6.31 -1.04 -1.26 -5.10 114.28 112.06 1p1d n THR 50 Ca 0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 1p1d n THR 50 Cb 0.45 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.96 1p1d n THR 50 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1p1d n LEU 51 N 0.00 0.00 0.00 -4.42 -0.00 -1.26 -4.71 117.00 106.61 1p1d n LEU 51 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1p1d n LEU 51 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1p1d n LEU 51 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 177.39 177.15 1p1d n SER 52 N 0.00 -2.71 -4.55 1.45 2.88 -1.26 -5.00 113.62 104.43 1p1d n SER 52 Ca 0.00 0.00 -0.46 0.00 -1.33 0.00 0.00 58.87 57.08 1p1d n SER 52 Cb 0.00 -0.46 -0.02 0.00 -0.75 0.00 0.00 64.21 62.97 1p1d n SER 52 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1p1d n SER 53 N 1.86 0.74 -4.74 -3.46 7.64 -1.26 -4.86 113.62 109.54 1p1d n SER 53 Ca 0.00 1.16 -0.42 0.00 1.01 0.00 0.00 58.87 60.63 1p1d n SER 53 Cb 0.02 -1.20 -0.02 0.00 -1.01 0.00 0.00 64.21 61.99 1p1d n SER 53 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1p1d s PRO 54 N -1.26 4.16 0.33 1.43 0.04 -1.26 -4.78 135.00 133.67 1p1d s PRO 54 Ca 0.62 2.50 -0.26 0.00 0.04 0.00 0.00 61.00 63.90 1p1d s PRO 54 Cb -0.78 -3.07 -0.13 0.00 0.04 0.00 0.00 34.50 30.56 1p1d s PRO 54 CO 0.58 -0.61 0.91 -2.30 0.04 0.00 0.00 177.00 175.62 1p1d n PRO 55 N 2.83 1.16 -3.63 0.56 -0.02 -1.26 -4.68 135.00 129.96 1p1d n PRO 55 Ca 0.10 0.41 -0.21 0.00 -2.02 0.00 0.00 63.50 61.78 1p1d n PRO 55 Cb 0.38 -1.79 -0.17 0.00 -0.02 0.00 0.00 33.50 31.90 1p1d n PRO 55 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1p1d s LEU 56 N 0.57 0.14 0.37 2.45 1.02 -0.28 -3.70 118.68 119.25 1p1d s LEU 56 Ca 0.61 -0.11 -0.27 0.00 0.02 0.00 0.00 54.13 54.37 1p1d s LEU 56 Cb -0.67 -0.05 -0.10 0.00 0.02 0.00 0.00 46.19 45.40 1p1d s LEU 56 CO 0.59 -0.29 1.31 -0.63 0.02 0.00 0.00 176.35 177.35 1p1d s ILE 57 N 2.20 2.65 -0.04 -0.59 -1.09 -1.25 -0.17 121.20 122.90 1p1d s ILE 57 Ca 0.04 0.61 0.06 0.00 -2.23 0.00 0.00 60.65 59.13 1p1d s ILE 57 Cb -0.14 -3.38 -0.09 0.00 -1.58 0.00 0.00 42.46 37.28 1p1d s ILE 57 CO -0.06 0.12 0.07 -1.54 -1.23 0.00 0.00 174.94 172.30 1p1d n SER 58 N 0.45 3.42 -3.91 3.58 3.41 0.89 -0.63 113.62 120.82 1p1d n SER 58 Ca 0.02 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.53 1p1d n SER 58 Cb 0.43 0.91 -0.09 0.00 -0.26 0.00 0.00 64.21 65.19 1p1d n SER 58 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1p1d s TYR 59 N -2.28 0.17 0.04 7.33 5.04 -1.09 -4.91 117.35 121.64 1p1d s TYR 59 Ca -0.03 -0.45 0.01 0.00 -2.44 0.00 0.00 57.07 54.16 1p1d s TYR 59 Cb 0.03 -0.12 -0.02 0.00 0.35 0.00 0.00 41.96 42.19 1p1d s TYR 59 CO 0.27 -0.37 -0.06 0.42 -1.34 0.00 0.00 175.55 174.48 1p1d s ILE 60 N -2.52 0.39 0.05 3.14 -1.09 -1.26 -1.77 121.20 118.14 1p1d s ILE 60 Ca -0.06 -1.12 -0.00 0.00 -2.23 0.00 0.00 60.65 57.24 1p1d s ILE 60 Cb -0.02 -0.62 -0.04 0.00 -1.58 0.00 0.00 42.46 40.21 1p1d s ILE 60 CO -0.04 -0.49 0.18 -0.70 -1.23 0.00 0.00 174.94 172.66 1p1d s GLU 61 N -1.82 3.34 -0.55 2.79 2.56 0.25 -4.93 118.70 120.33 1p1d s GLU 61 Ca -0.10 -0.45 -0.02 0.00 0.00 0.00 0.00 54.97 54.40 1p1d s GLU 61 Cb -0.08 -3.00 0.25 0.00 2.00 0.00 0.00 34.13 33.31 1p1d s GLU 61 CO -0.01 0.62 2.25 0.00 -0.56 0.00 0.00 175.26 177.56 1p1d n ALA 62 N 0.49 6.10 0.00 6.30 0.00 -1.26 -4.03 120.51 128.11 1p1d n ALA 62 Ca -0.07 -3.01 0.00 0.00 0.00 0.00 0.00 53.44 50.36 1p1d n ALA 62 Cb 0.51 -1.83 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1p1d n ALA 62 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1p1d n ASP 63 N 0.01 0.00 -3.92 0.00 5.68 -1.26 -5.15 116.55 111.91 1p1d n ASP 63 Ca 0.48 0.00 -0.15 0.00 -0.50 0.00 0.00 54.79 54.62 1p1d n ASP 63 Cb 0.52 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 40.35 1p1d n ASP 63 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 1p1d s SER 64 N 0.00 0.48 0.19 -1.12 0.01 -1.26 -4.91 113.70 107.09 1p1d s SER 64 Ca 0.00 -0.07 0.10 0.00 1.31 0.00 0.00 55.95 57.30 1p1d s SER 64 Cb 0.00 -0.09 0.57 0.00 0.21 0.00 0.00 66.02 66.71 1p1d s SER 64 CO 0.00 0.03 1.26 -0.81 0.41 0.00 0.00 173.24 174.13 1p1d n PRO 65 N 3.15 0.07 0.32 12.44 -0.04 -1.26 -1.36 135.00 148.31 1p1d n PRO 65 Ca -0.15 0.53 -0.15 0.00 -0.04 0.00 0.00 63.50 63.69 1p1d n PRO 65 Cb 0.57 -1.83 -0.08 0.00 -0.04 0.00 0.00 33.50 32.13 1p1d n PRO 65 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1p1d h ALA 66 N 1.68 -0.83 0.03 0.55 0.00 -1.85 -1.84 119.26 116.99 1p1d h ALA 66 Ca 0.00 -0.20 -0.22 0.00 0.00 0.00 0.00 54.91 54.48 1p1d h ALA 66 Cb 0.21 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1p1d h ALA 66 CO 0.00 -0.83 -1.06 1.49 0.00 0.00 0.00 179.25 178.85 1p1d h GLU 67 N -1.10 0.05 -0.49 0.00 4.57 -1.77 -3.24 114.58 112.60 1p1d h GLU 67 Ca -0.09 -0.09 0.06 0.00 -1.18 0.00 0.00 59.36 58.06 1p1d h GLU 67 Cb 0.68 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.28 1p1d h GLU 67 CO 0.14 1.04 0.33 0.00 -1.18 0.00 0.00 179.01 179.33 1p1d h ARG 68 N 0.01 0.40 -1.04 1.92 -0.00 -1.26 -0.61 114.38 113.80 1p1d h ARG 68 Ca -0.04 -0.02 0.30 0.00 -0.50 0.00 0.00 59.98 59.72 1p1d h ARG 68 Cb 1.81 -0.09 -0.05 0.00 0.00 0.00 0.00 29.97 31.65 1p1d h ARG 68 CO 0.14 0.27 0.74 0.00 0.00 0.00 0.00 179.97 181.13 1p1d n GLY 70 N -1.72 0.87 1.17 0.00 0.00 -0.24 -4.47 105.19 100.80 1p1d n GLY 70 Ca 0.22 -0.59 -0.02 0.00 0.00 0.00 0.00 46.02 45.63 1p1d n GLY 70 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1p1d n VAL 71 N -2.73 0.00 -3.88 1.61 0.24 -1.26 -4.58 118.33 107.73 1p1d n VAL 71 Ca 0.00 -0.40 -0.24 0.00 -2.04 0.00 0.00 64.34 61.66 1p1d n VAL 71 Cb 0.18 0.68 -0.17 0.00 -1.47 0.00 0.00 33.84 33.07 1p1d n VAL 71 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1p1d s LEU 72 N 0.00 0.88 0.07 1.34 1.43 -1.26 -4.99 118.68 116.15 1p1d s LEU 72 Ca 0.14 -0.16 0.02 0.00 -1.03 0.00 0.00 54.13 53.10 1p1d s LEU 72 Cb 0.16 -0.56 -0.03 0.00 0.03 0.00 0.00 46.19 45.78 1p1d s LEU 72 CO -0.07 -0.15 -0.07 -1.10 0.23 0.00 0.00 176.35 175.19 1p1d s GLN 73 N 1.72 0.67 -0.85 1.70 1.11 -1.26 -4.71 119.66 118.03 1p1d s GLN 73 Ca 0.02 -1.04 -0.24 0.00 0.01 0.00 0.00 55.36 54.11 1p1d s GLN 73 Cb -0.13 -0.24 -0.17 0.00 -1.01 0.00 0.00 33.01 31.46 1p1d s GLN 73 CO -0.05 0.01 2.30 -0.89 0.01 0.00 0.00 175.29 176.67 1p1d n ILE 74 N 0.72 0.00 0.00 1.08 5.41 -1.26 -2.20 119.36 123.11 1p1d n ILE 74 Ca -0.18 -0.39 0.00 0.00 1.00 0.00 0.00 62.75 63.19 1p1d n ILE 74 Cb 0.58 -1.81 0.00 0.00 -0.71 0.00 0.00 39.64 37.69 1p1d n ILE 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1p1d n GLY 75 N 6.52 0.38 3.73 7.39 0.00 0.20 -4.80 105.19 118.62 1p1d n GLY 75 Ca 0.46 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.09 1p1d n GLY 75 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1p1d s ASP 76 N -0.73 7.01 -0.58 1.61 -1.08 -0.93 -4.70 116.67 117.27 1p1d s ASP 76 Ca 0.00 1.22 -0.21 0.00 -0.52 0.00 0.00 52.55 53.04 1p1d s ASP 76 Cb 0.00 -2.41 0.07 0.00 -1.46 0.00 0.00 42.92 39.13 1p1d s ASP 76 CO 0.00 -0.03 0.78 -0.60 0.52 0.00 0.00 175.17 175.84 1p1d s ARG 77 N 0.38 3.12 -0.21 4.34 3.52 -1.25 -3.73 118.95 125.12 1p1d s ARG 77 Ca 0.36 -0.95 -0.24 0.00 -0.13 0.00 0.00 55.73 54.77 1p1d s ARG 77 Cb -0.18 -4.19 -0.01 0.00 -1.56 0.00 0.00 34.95 29.01 1p1d s ARG 77 CO 0.18 -1.52 0.79 0.08 -0.81 0.00 0.00 175.30 174.02 1p1d s VAL 78 N 3.19 4.89 -0.06 7.11 1.01 -1.24 -3.76 120.40 131.53 1p1d s VAL 78 Ca 0.18 1.51 0.14 0.00 0.00 0.00 0.00 61.98 63.80 1p1d s VAL 78 Cb -0.19 -4.09 -0.22 0.00 0.00 0.00 0.00 36.38 31.88 1p1d s VAL 78 CO 0.10 -0.00 0.65 0.80 0.00 0.00 0.00 175.10 176.65 1p1d n MET 79 N 5.55 0.63 -3.68 2.72 1.56 0.46 -4.32 117.12 120.05 1p1d n MET 79 Ca 0.04 0.27 -0.14 0.00 -0.27 0.00 0.00 57.70 57.59 1p1d n MET 79 Cb 0.48 -1.78 -0.08 0.00 2.15 0.00 0.00 33.22 33.99 1p1d n MET 79 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1p1d s ALA 80 N -2.65 -1.28 -0.26 -5.12 0.00 -1.25 -4.41 121.76 106.79 1p1d s ALA 80 Ca -0.05 1.24 0.02 0.00 0.00 0.00 0.00 51.96 53.17 1p1d s ALA 80 Cb 0.08 -0.54 0.06 0.00 0.00 0.00 0.00 23.12 22.71 1p1d s ALA 80 CO 0.82 -0.27 -0.10 0.42 0.00 0.00 0.00 175.76 176.63 1p1d s ILE 81 N -0.26 2.26 -2.22 0.00 1.01 0.11 -3.26 121.20 118.84 1p1d s ILE 81 Ca -0.04 -1.58 0.00 0.00 0.00 0.00 0.00 60.65 59.02 1p1d s ILE 81 Cb -0.03 -2.32 0.00 0.00 0.01 0.00 0.00 42.46 40.12 1p1d s ILE 81 CO 0.03 -0.02 0.00 0.59 0.00 0.00 0.00 174.94 175.54 1p1d n ASN 82 N 4.46 -5.53 0.00 3.58 3.02 0.11 -1.67 115.26 119.22 1p1d n ASN 82 Ca -0.14 0.51 0.00 0.00 -0.03 0.00 0.00 54.58 54.92 1p1d n ASN 82 Cb 0.42 -4.88 0.00 0.00 -0.61 0.00 0.00 39.78 34.72 1p1d n ASN 82 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p1d n GLY 83 N -0.40 1.68 3.64 7.41 0.00 -1.26 -4.99 105.19 111.27 1p1d n GLY 83 Ca -0.21 -0.42 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 1p1d n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p1d s ILE 84 N -0.89 3.74 0.36 -0.61 1.01 -0.67 -4.89 121.20 119.25 1p1d s ILE 84 Ca 0.00 0.86 0.07 0.00 0.00 0.00 0.00 60.65 61.58 1p1d s ILE 84 Cb 0.00 -3.68 0.16 0.00 0.01 0.00 0.00 42.46 38.95 1p1d s ILE 84 CO 0.00 -0.22 1.90 1.55 0.00 0.00 0.00 174.94 178.17 1p1d h PRO 85 N 10.11 0.40 0.00 2.79 0.13 -1.88 0.32 132.00 143.86 1p1d h PRO 85 Ca -0.34 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1p1d h PRO 85 Cb 1.15 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1p1d h PRO 85 CO 0.99 0.46 0.00 0.25 -0.23 0.00 0.00 178.00 179.47 1p1d n THR 86 N -4.29 0.00 0.13 1.56 -2.24 -1.26 -4.18 114.28 104.01 1p1d n THR 86 Ca 0.01 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.89 1p1d n THR 86 Cb 0.25 -0.15 0.04 0.00 -2.10 0.00 0.00 70.33 68.37 1p1d n THR 86 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1p1d h GLU 87 N 2.05 0.00 -1.42 -0.78 5.08 -1.90 -3.34 114.58 114.28 1p1d h GLU 87 Ca 0.00 0.00 -0.71 0.00 -1.00 0.00 0.00 59.36 57.65 1p1d h GLU 87 Cb 0.02 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 28.97 1p1d h GLU 87 CO 0.00 0.05 0.80 -0.25 -1.00 0.00 0.00 179.01 178.61 1p1d n ASP 88 N -2.84 7.37 -3.08 1.42 8.00 -1.26 -4.95 116.55 121.21 1p1d n ASP 88 Ca 0.00 -3.81 0.03 0.00 0.71 0.00 0.00 54.79 51.73 1p1d n ASP 88 Cb 0.58 -0.96 0.01 0.00 -0.02 0.00 0.00 41.12 40.72 1p1d n ASP 88 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1p1d n SER 89 N -0.73 -0.74 -4.80 -2.24 7.64 -1.25 -5.15 113.62 106.35 1p1d n SER 89 Ca 0.57 -1.05 -0.31 0.00 1.01 0.00 0.00 58.87 59.10 1p1d n SER 89 Cb 0.50 1.12 0.07 0.00 -1.01 0.00 0.00 64.21 64.89 1p1d n SER 89 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1p1d s THR 90 N -2.02 3.53 0.25 0.44 2.01 -1.26 -4.82 115.64 113.77 1p1d s THR 90 Ca 0.22 0.50 0.11 0.00 0.31 0.00 0.00 61.69 62.83 1p1d s THR 90 Cb -0.00 -3.20 -0.04 0.00 0.01 0.00 0.00 72.50 69.27 1p1d s THR 90 CO -0.02 -0.65 1.58 2.19 -0.69 0.00 0.00 174.62 177.03 1p1d h PHE 91 N -0.94 0.00 -0.49 4.92 -0.00 -1.92 -3.12 116.94 115.40 1p1d h PHE 91 Ca -0.45 0.00 0.11 0.00 -0.00 0.00 0.00 57.97 57.63 1p1d h PHE 91 Cb 1.24 0.00 -0.03 0.00 -0.00 0.00 0.00 35.95 37.16 1p1d h PHE 91 CO 0.55 0.65 0.34 0.93 -0.00 0.00 0.00 178.31 180.77 1p1d h GLU 92 N 0.00 0.18 0.33 6.09 5.08 -1.95 -1.80 114.58 122.51 1p1d h GLU 92 Ca -0.01 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1p1d h GLU 92 Cb 1.16 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.37 1p1d h GLU 92 CO 0.08 0.12 -0.16 0.93 -1.00 0.00 0.00 179.01 178.98 1p1d h GLU 93 N 0.18 -0.43 -0.84 2.33 5.08 -1.94 0.57 114.58 119.54 1p1d h GLU 93 Ca 0.23 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.72 1p1d h GLU 93 Cb 0.66 0.10 -0.08 0.00 0.50 0.00 0.00 28.75 29.93 1p1d h GLU 93 CO -0.04 -0.24 0.48 0.00 -1.00 0.00 0.00 179.01 178.22 1p1d h ALA 94 N 0.14 1.22 -0.68 3.43 0.00 -1.51 0.58 119.26 122.43 1p1d h ALA 94 Ca -0.05 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1p1d h ALA 94 Cb 0.39 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1p1d h ALA 94 CO 0.07 0.09 0.12 -0.91 0.00 0.00 0.00 179.25 178.63 1p1d h ASN 95 N 0.79 1.07 -0.22 0.00 -0.26 -1.02 -2.19 115.58 113.75 1p1d h ASN 95 Ca 0.41 -0.25 -0.08 0.00 -0.56 0.00 0.00 56.30 55.82 1p1d h ASN 95 Cb 0.40 -0.28 -0.02 0.00 -1.06 0.00 0.00 38.32 37.36 1p1d h ASN 95 CO -0.26 1.06 -0.10 -0.61 -1.06 0.00 0.00 177.43 176.45 1p1d h GLN 96 N 1.05 0.60 -0.03 0.81 5.75 0.25 -2.30 115.11 121.24 1p1d h GLN 96 Ca 0.21 -0.18 0.02 0.00 -0.15 0.00 0.00 58.65 58.55 1p1d h GLN 96 Cb 0.43 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.90 1p1d h GLN 96 CO 0.01 0.70 -0.08 -0.07 -2.65 0.00 0.00 178.83 176.73 1p1d h LEU 97 N 0.55 -0.25 -0.52 -2.39 3.38 0.65 -1.78 115.31 114.96 1p1d h LEU 97 Ca 0.10 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.14 1p1d h LEU 97 Cb 0.51 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 1p1d h LEU 97 CO 0.03 -0.12 0.32 -0.07 0.09 0.00 0.00 178.44 178.69 1p1d h LEU 98 N -0.13 0.51 -1.20 1.67 4.07 -1.27 1.15 115.31 120.11 1p1d h LEU 98 Ca 0.04 0.00 0.20 0.00 0.08 0.00 0.00 57.88 58.21 1p1d h LEU 98 Cb 0.19 -0.11 -0.09 0.00 1.08 0.00 0.00 40.66 41.73 1p1d h LEU 98 CO -0.11 0.36 0.62 0.03 -1.08 0.00 0.00 178.44 178.26 1p1d h ARG 99 N 0.63 0.60 -0.78 1.13 3.08 -0.92 -1.01 114.38 117.10 1p1d h ARG 99 Ca 0.21 -0.04 -0.52 0.00 0.07 0.00 0.00 59.98 59.70 1p1d h ARG 99 Cb 0.01 -0.13 -0.43 0.00 0.08 0.00 0.00 29.97 29.50 1p1d h ARG 99 CO -0.09 0.40 -0.84 -0.25 -1.07 0.00 0.00 179.97 178.11 1p1d n ASP 100 N -4.67 4.57 -0.89 7.04 8.00 -0.50 -4.72 116.55 125.38 1p1d n ASP 100 Ca 0.22 -3.58 0.10 0.00 0.71 0.00 0.00 54.79 52.25 1p1d n ASP 100 Cb 0.65 -0.36 0.27 0.00 -0.02 0.00 0.00 41.12 41.65 1p1d n ASP 100 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1p1d n SER 101 N -0.68 2.63 -1.45 -2.24 3.41 0.39 -4.01 113.62 111.67 1p1d n SER 101 Ca 0.40 -1.91 0.09 0.00 -0.26 0.00 0.00 58.87 57.19 1p1d n SER 101 Cb 0.93 -0.24 0.33 0.00 -0.26 0.00 0.00 64.21 64.97 1p1d n SER 101 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1p1d n SER 102 N 0.94 4.62 -0.04 4.04 3.41 -1.26 -4.02 113.62 121.31 1p1d n SER 102 Ca 0.18 -2.53 -0.13 0.00 -0.26 0.00 0.00 58.87 56.12 1p1d n SER 102 Cb 0.45 -0.56 -0.08 0.00 -0.26 0.00 0.00 64.21 63.77 1p1d n SER 102 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1p1d h ILE 103 N 3.62 1.35 -0.51 -1.33 2.04 -1.89 -3.01 117.51 117.76 1p1d h ILE 103 Ca 0.00 -1.17 0.00 0.00 1.00 0.00 0.00 64.86 64.69 1p1d h ILE 103 Cb 1.45 1.93 0.00 0.00 -0.74 0.00 0.00 36.82 39.46 1p1d h ILE 103 CO 0.24 0.33 0.00 0.35 0.00 0.00 0.00 178.15 179.07 1p1d n THR 104 N -4.70 0.99 -2.03 -0.27 -2.24 -1.26 -4.90 114.28 99.87 1p1d n THR 104 Ca -0.07 -0.78 -0.13 0.00 -2.27 0.00 0.00 64.05 60.80 1p1d n THR 104 Cb 0.30 0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.71 1p1d n THR 104 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1p1d n SER 105 N 0.94 -3.87 -3.48 3.42 7.64 -1.14 -4.89 113.62 112.25 1p1d n SER 105 Ca 0.18 0.23 -0.12 0.00 1.01 0.00 0.00 58.87 60.18 1p1d n SER 105 Cb 0.56 -3.40 -0.03 0.00 -1.01 0.00 0.00 64.21 60.32 1p1d n SER 105 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1p1d s LYS 106 N -4.29 1.04 -0.30 1.43 -0.14 -1.26 -2.11 119.74 114.12 1p1d s LYS 106 Ca 0.00 -0.21 0.04 0.00 -1.36 0.00 0.00 55.97 54.44 1p1d s LYS 106 Cb 0.00 0.48 0.18 0.00 -1.68 0.00 0.00 37.83 36.81 1p1d s LYS 106 CO 0.00 -0.42 0.50 0.08 -0.76 0.00 0.00 175.35 174.75 1p1d s VAL 107 N -2.78 -0.81 -0.07 3.17 1.01 0.33 -4.76 120.40 116.48 1p1d s VAL 107 Ca -0.01 -0.17 -0.19 0.00 0.00 0.00 0.00 61.98 61.62 1p1d s VAL 107 Cb -0.01 -0.96 -0.05 0.00 0.00 0.00 0.00 36.38 35.37 1p1d s VAL 107 CO -0.06 -0.15 0.51 -0.89 0.00 0.00 0.00 175.10 174.51 1p1d s THR 108 N 2.63 5.09 0.05 3.92 2.01 -1.26 -1.30 115.64 126.77 1p1d s THR 108 Ca 0.10 1.04 -0.03 0.00 0.31 0.00 0.00 61.69 63.11 1p1d s THR 108 Cb -0.11 -3.84 -0.02 0.00 0.01 0.00 0.00 72.50 68.53 1p1d s THR 108 CO -0.27 0.38 0.04 -1.48 -0.69 0.00 0.00 174.62 172.60 1p1d s LEU 109 N 0.22 2.10 -0.16 4.42 2.34 -0.09 0.06 118.68 127.56 1p1d s LEU 109 Ca 0.28 -0.74 -0.02 0.00 0.06 0.00 0.00 54.13 53.70 1p1d s LEU 109 Cb -0.16 0.43 -0.02 0.00 -0.56 0.00 0.00 46.19 45.87 1p1d s LEU 109 CO 0.13 -0.55 -0.08 -1.61 -1.06 0.00 0.00 176.35 173.18 1p1d s GLU 110 N -3.16 3.50 0.04 1.48 2.02 -1.20 0.12 118.70 121.49 1p1d s GLU 110 Ca -0.00 -0.61 0.06 0.00 0.02 0.00 0.00 54.97 54.44 1p1d s GLU 110 Cb 0.02 -2.82 -0.03 0.00 0.10 0.00 0.00 34.13 31.40 1p1d s GLU 110 CO -0.07 0.14 -0.14 0.96 0.02 0.00 0.00 175.26 176.17 1p1d s ILE 111 N 0.59 3.12 -0.23 -1.63 -4.36 0.13 -0.40 121.20 118.42 1p1d s ILE 111 Ca -0.05 -1.10 -0.01 0.00 -0.26 0.00 0.00 60.65 59.23 1p1d s ILE 111 Cb -0.15 -2.36 0.03 0.00 1.25 0.00 0.00 42.46 41.23 1p1d s ILE 111 CO 0.03 0.30 -0.10 -0.70 0.24 0.00 0.00 174.94 174.72 1p1d s GLU 112 N -1.60 2.81 0.33 0.37 2.12 -1.25 0.11 118.70 121.60 1p1d s GLU 112 Ca 0.17 -0.98 0.03 0.00 0.36 0.00 0.00 54.97 54.55 1p1d s GLU 112 Cb -0.11 -2.89 -0.04 0.00 0.26 0.00 0.00 34.13 31.36 1p1d s GLU 112 CO 0.08 -0.37 0.13 -0.59 -0.54 0.00 0.00 175.26 173.96 1p1d s PHE 113 N 1.29 1.70 -0.14 5.30 -0.12 -0.66 -4.86 117.98 120.49 1p1d s PHE 113 Ca 0.00 -1.26 -0.03 0.00 -0.05 0.00 0.00 56.93 55.59 1p1d s PHE 113 Cb -0.16 -1.01 -0.03 0.00 -0.63 0.00 0.00 43.02 41.19 1p1d s PHE 113 CO -0.06 -0.36 -0.04 -0.51 -0.05 0.00 0.00 175.22 174.20 1p1d s ASP 114 N -3.45 4.80 -0.42 1.98 1.11 -1.26 -1.34 116.67 118.09 1p1d s ASP 114 Ca 0.33 -0.10 -0.27 0.00 0.18 0.00 0.00 52.55 52.68 1p1d s ASP 114 Cb 0.05 -1.69 -0.03 0.00 1.07 0.00 0.00 42.92 42.32 1p1d s ASP 114 CO 0.16 0.20 1.95 0.68 1.18 0.00 0.00 175.17 179.34 1p1d s VAL 115 N 0.15 3.33 -0.30 -1.27 -7.23 -1.21 -4.88 120.40 108.99 1p1d s VAL 115 Ca -0.01 0.29 -0.09 0.00 -1.81 0.00 0.00 61.98 60.35 1p1d s VAL 115 Cb -0.14 -3.57 0.18 0.00 0.56 0.00 0.00 36.38 33.41 1p1d s VAL 115 CO 0.03 -0.45 0.93 0.00 -0.31 0.00 0.00 175.10 175.29 1p1d s ALA 116 N 8.41 -3.20 -0.26 1.32 0.00 0.29 -4.27 121.76 124.05 1p1d s ALA 116 Ca 0.81 1.49 0.18 0.00 0.00 0.00 0.00 51.96 54.45 1p1d s ALA 116 Cb -0.20 -2.47 0.49 0.00 0.00 0.00 0.00 23.12 20.94 1p1d s ALA 116 CO 0.29 -1.52 1.14 -1.91 0.00 0.00 0.00 175.76 173.76 1p1d n GLU 117 N 5.42 2.21 -2.31 0.00 4.07 -1.24 -4.73 120.64 124.07 1p1d n GLU 117 Ca -0.03 -3.64 -0.01 0.00 -0.06 0.00 0.00 57.16 53.42 1p1d n GLU 117 Cb 0.54 -1.75 0.00 0.00 -0.06 0.00 0.00 31.44 30.17 1p1d n GLU 117 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1p1d n SER 118 N -0.60 -6.01 -4.00 4.31 2.88 -1.26 -3.63 113.62 105.32 1p1d n SER 118 Ca 0.18 0.90 -0.29 0.00 -1.33 0.00 0.00 58.87 58.33 1p1d n SER 118 Cb 0.86 -3.89 -0.17 0.00 -0.75 0.00 0.00 64.21 60.26 1p1d n SER 118 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1p1d s VAL 119 N -1.18 1.46 -0.47 2.46 -7.23 -1.26 -0.37 120.40 113.82 1p1d s VAL 119 Ca 0.02 -0.56 -0.13 0.00 -1.81 0.00 0.00 61.98 59.49 1p1d s VAL 119 Cb -0.00 -1.38 0.09 0.00 0.56 0.00 0.00 36.38 35.64 1p1d s VAL 119 CO 0.52 0.44 0.37 0.27 -0.31 0.00 0.00 175.10 176.39 1p1d s ILE 120 N 1.50 4.87 0.29 -0.62 -5.25 -0.07 -4.98 121.20 116.93 1p1d s ILE 120 Ca 0.04 -1.29 -0.16 0.00 -0.99 0.00 0.00 60.65 58.25 1p1d s ILE 120 Cb -0.13 -3.98 -0.09 0.00 2.95 0.00 0.00 42.46 41.21 1p1d s ILE 120 CO -0.10 -0.62 0.73 -2.16 -1.79 0.00 0.00 174.94 171.00 1p1d s PRO 121 N 1.55 4.08 0.00 0.37 0.04 -1.26 -2.24 135.00 137.53 1p1d s PRO 121 Ca 0.04 0.73 0.02 0.00 0.04 0.00 0.00 61.00 61.82 1p1d s PRO 121 Cb -0.25 -2.58 0.03 0.00 0.04 0.00 0.00 34.50 31.75 1p1d s PRO 121 CO 0.04 0.24 0.76 0.43 0.04 0.00 0.00 177.00 178.50 1p1d n SER 122 N -0.01 -0.13 -2.23 6.66 7.64 -1.21 -5.02 113.62 119.32 1p1d n SER 122 Ca 0.02 -1.48 0.00 0.00 1.01 0.00 0.00 58.87 58.41 1p1d n SER 122 Cb 0.52 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 1p1d n SER 122 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1p1d n SER 123 N 0.04 -8.51 0.00 6.43 7.64 -1.26 -4.42 113.62 113.54 1p1d n SER 123 Ca -0.05 1.64 0.00 0.00 1.01 0.00 0.00 58.87 61.47 1p1d n SER 123 Cb 0.63 -4.87 0.00 0.00 -1.01 0.00 0.00 64.21 58.97 1p1d n SER 123 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1p1d n GLY 124 N 1.90 2.34 2.87 0.23 0.00 -1.24 -4.90 105.19 106.40 1p1d n GLY 124 Ca 0.00 -0.52 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 1p1d n GLY 124 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p1d s THR 125 N -0.38 1.43 -0.25 2.61 2.01 -1.26 -2.07 115.64 117.73 1p1d s THR 125 Ca 0.00 -1.54 -0.06 0.00 0.31 0.00 0.00 61.69 60.39 1p1d s THR 125 Cb 0.00 -1.94 -0.02 0.00 0.01 0.00 0.00 72.50 70.55 1p1d s THR 125 CO 0.00 -0.45 0.05 0.12 -0.69 0.00 0.00 174.62 173.65 1p1d s PHE 126 N 1.37 3.06 -0.24 4.92 2.19 -0.21 -3.33 117.98 125.74 1p1d s PHE 126 Ca 0.05 -0.59 -0.09 0.00 0.33 0.00 0.00 56.93 56.63 1p1d s PHE 126 Cb -0.18 -2.21 -0.04 0.00 -1.31 0.00 0.00 43.02 39.28 1p1d s PHE 126 CO -0.14 -0.42 0.12 -1.01 1.83 0.00 0.00 175.22 175.60 1p1d s HIS 127 N 1.57 3.23 -0.80 10.12 3.76 -0.95 0.19 115.29 132.41 1p1d s HIS 127 Ca 0.06 0.01 -0.12 0.00 -0.15 0.00 0.00 55.06 54.86 1p1d s HIS 127 Cb -0.15 -2.24 0.21 0.00 1.11 0.00 0.00 32.58 31.51 1p1d s HIS 127 CO 0.02 -0.06 0.72 0.08 -0.85 0.00 0.00 174.74 174.65 1p1d s VAL 128 N 1.15 5.35 -0.76 -0.90 1.01 0.48 -0.90 120.40 125.83 1p1d s VAL 128 Ca 0.06 -2.54 -0.25 0.00 0.00 0.00 0.00 61.98 59.25 1p1d s VAL 128 Cb -0.14 -4.32 0.05 0.00 0.00 0.00 0.00 36.38 31.97 1p1d s VAL 128 CO 0.05 -1.01 1.21 -0.54 0.00 0.00 0.00 175.10 174.81 1p1d s LYS 129 N 0.13 3.23 0.03 2.72 1.02 0.51 -2.19 119.74 125.19 1p1d s LYS 129 Ca 0.18 -0.58 0.06 0.00 0.02 0.00 0.00 55.97 55.65 1p1d s LYS 129 Cb -0.12 -4.37 -0.02 0.00 -0.52 0.00 0.00 37.83 32.80 1p1d s LYS 129 CO -0.08 -2.05 -0.18 -0.48 -0.92 0.00 0.00 175.35 171.64 1p1d s LEU 130 N 5.06 2.14 -0.08 3.17 2.34 -0.98 -3.99 118.68 126.32 1p1d s LEU 130 Ca 0.33 -0.46 -0.30 0.00 0.06 0.00 0.00 54.13 53.76 1p1d s LEU 130 Cb -0.09 -0.85 -0.05 0.00 -0.56 0.00 0.00 46.19 44.65 1p1d s LEU 130 CO 0.10 0.13 1.58 -2.16 -1.06 0.00 0.00 176.35 174.94 1p1d s PRO 131 N -1.01 4.16 0.36 1.48 0.04 -1.26 -1.63 135.00 137.15 1p1d s PRO 131 Ca 0.06 2.07 -0.11 0.00 0.04 0.00 0.00 61.00 63.05 1p1d s PRO 131 Cb -0.08 -3.95 -0.07 0.00 0.04 0.00 0.00 34.50 30.44 1p1d s PRO 131 CO 0.01 -0.85 0.73 0.15 0.04 0.00 0.00 177.00 177.08 1p1d s LYS 132 N 3.99 3.82 0.00 4.56 3.01 -0.87 -4.80 119.74 129.44 1p1d s LYS 132 Ca 0.70 0.46 0.00 0.00 -1.01 0.00 0.00 55.97 56.12 1p1d s LYS 132 Cb -0.31 -2.44 0.00 0.00 -1.01 0.00 0.00 37.83 34.07 1p1d s LYS 132 CO 0.27 0.05 0.00 1.63 0.51 0.00 0.00 175.35 177.81 1p1d n LYS 133 N -0.98 1.18 -1.24 1.68 5.02 -1.26 -3.36 118.16 119.19 1p1d n LYS 133 Ca 0.02 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.03 1p1d n LYS 133 Cb 0.54 0.00 0.13 0.00 -0.02 0.00 0.00 35.03 35.67 1p1d n LYS 133 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1p1d n HIS 134 N -0.75 3.05 -2.10 2.13 8.25 -1.26 -3.89 115.22 120.64 1p1d n HIS 134 Ca 0.00 -2.38 0.00 0.00 -0.26 0.00 0.00 57.72 55.08 1p1d n HIS 134 Cb 0.00 -1.17 0.00 0.00 1.12 0.00 0.00 29.99 29.94 1p1d n HIS 134 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1p1d n SER 135 N -0.96 -2.00 0.00 0.41 2.88 -1.26 -5.08 113.62 107.61 1p1d n SER 135 Ca 0.59 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.13 1p1d n SER 135 Cb 1.15 -0.50 0.00 0.00 -0.75 0.00 0.00 64.21 64.11 1p1d n SER 135 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1p1d n VAL 136 N -1.30 0.00 -2.98 2.46 0.31 -1.26 -4.94 118.33 110.61 1p1d n VAL 136 Ca 0.00 0.00 -0.44 0.00 -0.01 0.00 0.00 64.34 63.89 1p1d n VAL 136 Cb 0.50 0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 33.38 1p1d n VAL 136 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1p1d s GLU 137 N 1.56 3.14 -0.41 5.55 2.12 -1.26 -4.98 118.70 124.42 1p1d s GLU 137 Ca 0.00 -0.83 0.03 0.00 0.36 0.00 0.00 54.97 54.53 1p1d s GLU 137 Cb 0.00 -4.17 0.11 0.00 0.26 0.00 0.00 34.13 30.34 1p1d s GLU 137 CO 0.00 -1.54 0.15 -1.17 -0.54 0.00 0.00 175.26 172.17 1p1d s LEU 138 N 3.38 4.05 -0.23 2.70 2.96 -1.26 -4.74 118.68 125.53 1p1d s LEU 138 Ca 0.20 -2.46 -0.03 0.00 -0.22 0.00 0.00 54.13 51.62 1p1d s LEU 138 Cb -0.18 -1.47 0.02 0.00 0.50 0.00 0.00 46.19 45.06 1p1d s LEU 138 CO 0.12 -0.32 2.62 0.61 -1.32 0.00 0.00 176.35 178.06 1p1d n GLY 139 N 3.83 3.66 3.65 7.98 0.00 -1.26 -4.89 105.19 118.16 1p1d n GLY 139 Ca 0.04 -1.18 -0.39 0.00 0.00 0.00 0.00 46.02 44.49 1p1d n GLY 139 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p1d s ILE 140 N -1.14 5.13 -0.42 -0.61 1.01 -1.26 -1.10 121.20 122.81 1p1d s ILE 140 Ca 0.43 0.85 -0.06 0.00 0.00 0.00 0.00 60.65 61.87 1p1d s ILE 140 Cb 0.26 -3.80 0.10 0.00 0.01 0.00 0.00 42.46 39.04 1p1d s ILE 140 CO -0.07 0.18 0.23 -0.89 0.00 0.00 0.00 174.94 174.40 1p1d s THR 141 N 1.67 3.68 0.47 2.92 2.01 0.19 -4.96 115.64 121.61 1p1d s THR 141 Ca 0.22 -1.80 -0.01 0.00 0.31 0.00 0.00 61.69 60.40 1p1d s THR 141 Cb -0.15 -3.41 -0.01 0.00 0.01 0.00 0.00 72.50 68.95 1p1d s THR 141 CO 0.09 -0.63 0.71 -0.63 -0.69 0.00 0.00 174.62 173.47 1p1d s ILE 142 N 1.26 4.06 -0.01 1.82 1.01 -1.26 0.17 121.20 128.25 1p1d s ILE 142 Ca 0.05 -0.37 -0.29 0.00 0.00 0.00 0.00 60.65 60.05 1p1d s ILE 142 Cb -0.23 -3.52 0.10 0.00 0.01 0.00 0.00 42.46 38.82 1p1d s ILE 142 CO -0.02 -0.40 1.28 -0.55 0.00 0.00 0.00 174.94 175.25 1p1d s SER 143 N -4.21 -0.01 -0.07 3.58 0.15 -0.27 -4.79 113.70 108.07 1p1d s SER 143 Ca 0.49 -0.19 0.02 0.00 0.70 0.00 0.00 55.95 56.96 1p1d s SER 143 Cb -0.10 0.16 0.01 0.00 -1.71 0.00 0.00 66.02 64.38 1p1d s SER 143 CO 0.39 -0.30 -0.11 -0.55 1.20 0.00 0.00 173.24 173.87 1p1d s SER 144 N -3.55 1.70 0.08 5.45 0.15 -1.26 -0.79 113.70 115.48 1p1d s SER 144 Ca 0.25 -0.28 -0.28 0.00 0.70 0.00 0.00 55.95 56.33 1p1d s SER 144 Cb 0.01 -0.79 -0.13 0.00 -1.71 0.00 0.00 66.02 63.41 1p1d s SER 144 CO -0.02 0.02 1.44 -0.65 1.20 0.00 0.00 173.24 175.23 1p1d h PRO 145 N 7.05 -0.66 -3.88 5.44 0.11 -1.94 -3.42 132.00 134.71 1p1d h PRO 145 Ca -0.32 0.04 -0.45 0.00 0.11 0.00 0.00 66.00 65.39 1p1d h PRO 145 Cb 1.18 0.15 -0.37 0.00 0.11 0.00 0.00 31.00 32.07 1p1d h PRO 145 CO 0.47 -0.44 -0.78 -1.54 -0.21 0.00 0.00 178.00 175.51 1p1d s SER 146 N -4.10 1.58 -0.75 -2.05 1.04 -1.26 -5.04 113.70 103.12 1p1d s SER 146 Ca -0.14 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.16 1p1d s SER 146 Cb 0.04 -0.53 0.37 0.00 0.10 0.00 0.00 66.02 66.00 1p1d s SER 146 CO 0.48 -0.15 1.71 -0.24 0.98 0.00 0.00 173.24 176.03 1p1d n SER 147 N 4.87 6.62 -2.90 7.02 2.88 -1.26 -4.43 113.62 126.43 1p1d n SER 147 Ca -0.12 -3.79 -0.17 0.00 -1.33 0.00 0.00 58.87 53.46 1p1d n SER 147 Cb 0.50 -0.89 -0.01 0.00 -0.75 0.00 0.00 64.21 63.06 1p1d n SER 147 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1p1d n ARG 148 N -0.46 1.65 0.00 -1.46 1.85 -1.26 -5.05 116.66 111.92 1p1d n ARG 148 Ca 0.48 -3.69 0.00 0.00 -1.00 0.00 0.00 57.85 53.65 1p1d n ARG 148 Cb 0.36 -1.70 0.00 0.00 -1.05 0.00 0.00 32.46 30.07 1p1d n ARG 148 CO 0.00 0.00 0.00 0.36 -0.01 0.00 0.00 177.63 177.98 1p1d n LYS 149 N 0.00 0.00 -1.96 2.89 -0.00 -1.26 -5.07 118.16 112.77 1p1d n LYS 149 Ca 0.22 0.00 -0.25 0.00 -0.00 0.00 0.00 58.31 58.29 1p1d n LYS 149 Cb 0.67 0.00 -0.07 0.00 -0.00 0.00 0.00 35.03 35.63 1p1d n LYS 149 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1p1d s PRO 150 N -2.00 2.22 0.00 -1.58 0.04 -1.26 -3.64 135.00 128.78 1p1d s PRO 150 Ca 0.00 -0.77 0.00 0.00 0.04 0.00 0.00 61.00 60.27 1p1d s PRO 150 Cb 0.00 -5.13 0.00 0.00 0.04 0.00 0.00 34.50 29.41 1p1d s PRO 150 CO 0.00 -4.16 0.00 0.41 0.04 0.00 0.00 177.00 173.29 1p1d n GLY 151 N 6.14 -1.63 3.35 0.56 0.00 -1.26 -5.09 105.19 107.25 1p1d n GLY 151 Ca 0.43 0.58 -0.26 0.00 0.00 0.00 0.00 46.02 46.78 1p1d n GLY 151 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1p1d n ASP 152 N 0.00 -6.05 -2.91 1.61 5.75 -1.24 -4.59 116.55 109.12 1p1d n ASP 152 Ca 0.00 0.09 0.00 0.00 -0.01 0.00 0.00 54.79 54.87 1p1d n ASP 152 Cb 0.00 -2.05 0.00 0.00 -1.03 0.00 0.00 41.12 38.04 1p1d n ASP 152 CO 0.00 0.00 0.00 -0.81 -0.11 0.00 0.00 177.20 176.28 1p1d n PRO 153 N 0.21 -0.68 -4.25 0.11 -0.04 -1.26 -4.69 135.00 124.40 1p1d n PRO 153 Ca -0.05 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.19 1p1d n PRO 153 Cb 0.60 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.93 1p1d n PRO 153 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1p1d s LEU 154 N 0.00 2.29 0.08 1.53 2.01 -1.25 -4.55 118.68 118.79 1p1d s LEU 154 Ca 0.00 -0.66 -0.18 0.00 0.01 0.00 0.00 54.13 53.30 1p1d s LEU 154 Cb 0.00 -0.76 0.04 0.00 0.01 0.00 0.00 46.19 45.48 1p1d s LEU 154 CO 0.00 0.02 0.43 0.68 1.01 0.00 0.00 176.35 178.48 1p1d s VAL 155 N -1.19 0.06 0.34 -1.59 -7.23 0.03 0.47 120.40 111.29 1p1d s VAL 155 Ca 0.04 -0.46 -0.11 0.00 -1.81 0.00 0.00 61.98 59.63 1p1d s VAL 155 Cb -0.10 -1.04 -0.07 0.00 0.56 0.00 0.00 36.38 35.73 1p1d s VAL 155 CO 0.04 -0.25 0.71 -0.63 -0.31 0.00 0.00 175.10 174.65 1p1d s ILE 156 N -3.03 4.79 0.00 -0.62 1.09 -1.26 -1.12 121.20 121.06 1p1d s ILE 156 Ca -0.02 0.65 0.00 0.00 -1.10 0.00 0.00 60.65 60.18 1p1d s ILE 156 Cb 0.00 -3.68 0.00 0.00 -1.06 0.00 0.00 42.46 37.73 1p1d s ILE 156 CO -0.06 -0.33 0.00 -1.20 -0.10 0.00 0.00 174.94 173.24 1p1d n SER 157 N -0.80 2.04 -3.64 3.58 7.64 0.44 -4.17 113.62 118.70 1p1d n SER 157 Ca 0.02 -0.02 -0.03 0.00 1.01 0.00 0.00 58.87 59.85 1p1d n SER 157 Cb 0.53 0.45 -0.06 0.00 -1.01 0.00 0.00 64.21 64.13 1p1d n SER 157 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1p1d s ASP 158 N -0.86 -0.08 -0.03 6.43 2.15 -1.20 -4.92 116.67 118.16 1p1d s ASP 158 Ca 0.00 0.13 0.01 0.00 0.43 0.00 0.00 52.55 53.12 1p1d s ASP 158 Cb 0.00 0.12 0.02 0.00 -0.30 0.00 0.00 42.92 42.76 1p1d s ASP 158 CO 0.00 -0.04 -0.02 -0.63 -0.17 0.00 0.00 175.17 174.31 1p1d s ILE 159 N -0.35 0.29 0.18 4.11 1.09 -1.21 0.55 121.20 125.87 1p1d s ILE 159 Ca 0.07 -0.02 -0.31 0.00 -1.10 0.00 0.00 60.65 59.29 1p1d s ILE 159 Cb -0.03 -0.34 -0.10 0.00 -1.06 0.00 0.00 42.46 40.92 1p1d s ILE 159 CO -0.12 0.15 1.58 -0.75 -0.10 0.00 0.00 174.94 175.71 1p1d s LYS 160 N 0.77 4.20 0.00 2.79 2.47 -0.26 -4.86 119.74 124.84 1p1d s LYS 160 Ca -0.08 2.40 0.15 0.00 -1.56 0.00 0.00 55.97 56.88 1p1d s LYS 160 Cb -0.12 -3.13 0.92 0.00 -1.46 0.00 0.00 37.83 34.04 1p1d s LYS 160 CO -0.01 -0.62 1.34 1.17 0.16 0.00 0.00 175.35 177.39 1p1d n LYS 161 N 3.78 0.53 0.00 4.03 0.00 -1.26 -2.42 118.16 122.81 1p1d n LYS 161 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.44 1p1d n LYS 161 Cb 0.38 -1.46 0.00 0.00 0.00 0.00 0.00 35.03 33.95 1p1d n LYS 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1p1d n GLY 162 N 0.06 -0.92 3.88 3.14 0.00 -1.26 -4.82 105.19 105.27 1p1d n GLY 162 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 1p1d n GLY 162 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1p1d s SER 163 N -0.01 6.58 0.59 1.61 0.15 -1.02 -4.58 113.70 117.03 1p1d s SER 163 Ca 0.00 0.70 0.29 0.00 0.70 0.00 0.00 55.95 57.64 1p1d s SER 163 Cb 0.00 -2.14 1.35 0.00 -1.71 0.00 0.00 66.02 63.52 1p1d s SER 163 CO 0.00 0.16 1.74 -0.37 1.20 0.00 0.00 173.24 175.97 1p1d h VAL 164 N 2.74 0.26 0.02 4.45 -1.51 -1.88 -2.43 116.25 117.91 1p1d h VAL 164 Ca -0.49 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 64.98 1p1d h VAL 164 Cb 1.19 0.44 -0.00 0.00 -2.13 0.00 0.00 31.29 30.79 1p1d h VAL 164 CO 0.68 0.00 -0.03 0.00 -1.23 0.00 0.00 177.57 176.99 1p1d h ALA 165 N 1.21 -0.70 0.00 5.19 0.00 -1.93 -2.00 119.26 121.03 1p1d h ALA 165 Ca 0.31 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 1p1d h ALA 165 Cb 1.70 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 19.84 1p1d h ALA 165 CO -0.00 -0.71 -0.13 1.25 0.00 0.00 0.00 179.25 179.66 1p1d h HIS 166 N -0.05 0.00 -1.00 0.00 6.17 -1.64 -2.58 115.15 116.05 1p1d h HIS 166 Ca -0.00 0.00 0.08 0.00 0.71 0.00 0.00 60.37 61.16 1p1d h HIS 166 Cb 0.05 0.00 -0.07 0.00 2.52 0.00 0.00 27.41 29.91 1p1d h HIS 166 CO -0.15 0.13 0.64 -0.09 0.71 0.00 0.00 177.93 179.17 1p1d h ARG 167 N 0.00 1.09 -0.85 5.26 9.65 -1.06 -0.99 114.38 127.48 1p1d h ARG 167 Ca -0.00 -0.07 0.25 0.00 -1.10 0.00 0.00 59.98 59.06 1p1d h ARG 167 Cb 0.33 -0.25 -0.03 0.00 -1.39 0.00 0.00 29.97 28.62 1p1d h ARG 167 CO 0.02 0.72 0.74 1.79 2.80 0.00 0.00 179.97 186.04 1p1d h THR 168 N 1.13 0.35 -4.16 0.20 1.35 -0.94 0.82 112.91 111.66 1p1d h THR 168 Ca 0.44 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.30 1p1d h THR 168 Cb 0.24 0.45 0.00 0.00 -1.73 0.00 0.00 68.15 67.11 1p1d h THR 168 CO -0.19 0.00 -0.03 0.61 -0.25 0.00 0.00 175.52 175.66 1p1d n GLY 169 N -1.65 -0.79 0.00 5.82 0.00 -0.38 -3.64 105.19 104.55 1p1d n GLY 169 Ca 0.18 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.37 1p1d n GLY 169 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1p1d n THR 170 N -1.28 0.00 -1.40 2.61 5.66 -1.26 -4.96 114.28 113.66 1p1d n THR 170 Ca 0.01 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.67 1p1d n THR 170 Cb 0.47 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.17 1p1d n THR 170 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1p1d n LEU 171 N 0.00 2.69 0.00 1.09 7.94 -1.26 -4.88 117.00 122.58 1p1d n LEU 171 Ca 0.00 -2.65 -0.02 0.00 -1.11 0.00 0.00 56.01 52.23 1p1d n LEU 171 Cb 0.00 -1.31 0.01 0.00 0.53 0.00 0.00 43.42 42.66 1p1d n LEU 171 CO 0.00 -1.73 0.06 1.21 -1.11 0.00 0.00 177.39 175.82 1p1d n GLU 172 N 7.80 0.31 -3.76 1.96 4.07 -1.26 -4.85 120.64 124.92 1p1d n GLU 172 Ca 0.46 -0.22 -0.36 0.00 -0.06 0.00 0.00 57.16 56.98 1p1d n GLU 172 Cb 0.44 -0.08 -0.13 0.00 -0.06 0.00 0.00 31.44 31.61 1p1d n GLU 172 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1p1d s LEU 173 N 0.00 3.43 0.00 4.31 1.43 -1.26 -4.48 118.68 122.11 1p1d s LEU 173 Ca 0.06 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 52.95 1p1d s LEU 173 Cb -0.00 -1.92 0.00 0.00 0.03 0.00 0.00 46.19 44.30 1p1d s LEU 173 CO 0.04 -0.04 0.00 0.61 0.23 0.00 0.00 176.35 177.20 1p1d n GLY 174 N 4.92 1.85 3.90 -3.19 0.00 -1.26 -5.07 105.19 106.34 1p1d n GLY 174 Ca -0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 1p1d n GLY 174 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1p1d s ASP 175 N -2.00 4.92 0.01 1.61 1.01 -1.26 -5.04 116.67 115.92 1p1d s ASP 175 Ca 0.00 -0.91 0.08 0.00 0.71 0.00 0.00 52.55 52.42 1p1d s ASP 175 Cb 0.00 -0.16 -0.03 0.00 1.01 0.00 0.00 42.92 43.74 1p1d s ASP 175 CO 0.00 -0.87 -0.23 -0.75 0.21 0.00 0.00 175.17 173.53 1p1d s LYS 176 N -4.24 2.05 -0.12 8.23 2.47 -1.26 -4.05 119.74 122.82 1p1d s LYS 176 Ca 0.45 -0.97 -0.06 0.00 -1.56 0.00 0.00 55.97 53.83 1p1d s LYS 176 Cb -0.03 -2.10 -0.04 0.00 -1.46 0.00 0.00 37.83 34.20 1p1d s LYS 176 CO 0.27 0.55 0.10 -1.17 0.16 0.00 0.00 175.35 175.26 1p1d s LEU 177 N -1.03 4.14 -0.03 5.43 2.96 0.18 -0.52 118.68 129.81 1p1d s LEU 177 Ca 0.12 0.35 -0.00 0.00 -0.22 0.00 0.00 54.13 54.37 1p1d s LEU 177 Cb -0.10 -2.00 -0.02 0.00 0.50 0.00 0.00 46.19 44.57 1p1d s LEU 177 CO 0.02 0.37 -0.03 -0.11 -1.32 0.00 0.00 176.35 175.27 1p1d n LEU 178 N 2.23 2.21 -3.98 -0.68 7.94 -0.42 -3.84 117.00 120.46 1p1d n LEU 178 Ca -0.19 -0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 54.61 1p1d n LEU 178 Cb 0.54 -0.11 -0.07 0.00 0.53 0.00 0.00 43.42 44.31 1p1d n LEU 178 CO 0.31 0.42 -0.04 0.00 -1.11 0.00 0.00 177.39 176.97 1p1d s ALA 179 N -2.07 0.08 -0.21 1.96 0.00 -1.25 -0.72 121.76 119.56 1p1d s ALA 179 Ca -0.05 -0.94 -0.05 0.00 0.00 0.00 0.00 51.96 50.92 1p1d s ALA 179 Cb 0.01 0.88 0.07 0.00 0.00 0.00 0.00 23.12 24.08 1p1d s ALA 179 CO 0.07 -0.64 0.10 0.42 0.00 0.00 0.00 175.76 175.71 1p1d s ILE 180 N -3.98 -0.04 0.00 0.00 -1.09 0.15 -1.84 121.20 114.40 1p1d s ILE 180 Ca 0.18 -0.36 0.00 0.00 -2.23 0.00 0.00 60.65 58.24 1p1d s ILE 180 Cb 0.04 -0.72 0.00 0.00 -1.58 0.00 0.00 42.46 40.19 1p1d s ILE 180 CO 0.01 -0.41 0.00 -0.67 -1.23 0.00 0.00 174.94 172.64 1p1d n ASP 181 N 5.25 0.00 0.00 3.58 2.03 0.11 -1.67 116.55 125.86 1p1d n ASP 181 Ca -0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.24 1p1d n ASP 181 Cb 0.47 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.87 1p1d n ASP 181 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 1p1d n ASN 182 N 1.36 1.35 -4.90 1.67 6.94 -1.26 -4.80 115.26 115.63 1p1d n ASN 182 Ca 0.00 0.00 -0.28 0.00 -0.02 0.00 0.00 54.58 54.28 1p1d n ASN 182 Cb 0.00 0.20 -0.01 0.00 -2.36 0.00 0.00 39.78 37.60 1p1d n ASN 182 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1p1d s ILE 183 N -0.92 4.88 -0.12 1.53 -1.09 -0.67 -5.09 121.20 119.72 1p1d s ILE 183 Ca 0.00 0.31 0.02 0.00 -2.23 0.00 0.00 60.65 58.75 1p1d s ILE 183 Cb 0.00 -3.81 0.01 0.00 -1.58 0.00 0.00 42.46 37.09 1p1d s ILE 183 CO 0.00 -0.68 -0.17 -0.13 -1.23 0.00 0.00 174.94 172.73 1p1d s ARG 184 N -4.30 2.47 0.00 2.79 0.52 -1.26 0.30 118.95 119.46 1p1d s ARG 184 Ca 0.48 -0.65 0.29 0.00 -0.52 0.00 0.00 55.73 55.33 1p1d s ARG 184 Cb -0.10 -2.08 1.52 0.00 0.52 0.00 0.00 34.95 34.80 1p1d s ARG 184 CO 0.38 -0.07 2.02 1.28 0.02 0.00 0.00 175.30 178.93 1p1d n LEU 185 N 4.24 0.00 -0.41 2.53 7.99 0.10 -3.80 117.00 127.65 1p1d n LEU 185 Ca -0.19 0.23 0.40 0.00 -0.01 0.00 0.00 56.01 56.44 1p1d n LEU 185 Cb 0.51 -0.23 0.75 0.00 -0.11 0.00 0.00 43.42 44.34 1p1d n LEU 185 CO 0.24 -0.01 1.37 -2.24 -1.51 0.00 0.00 177.39 175.24 1p1d h ASP 186 N 0.00 0.00 -1.04 -1.43 2.03 -1.81 -1.57 116.42 112.61 1p1d h ASP 186 Ca 0.00 0.00 -0.36 0.00 -0.73 0.00 0.00 57.03 55.94 1p1d h ASP 186 Cb 0.22 0.00 -0.38 0.00 -0.83 0.00 0.00 39.33 38.34 1p1d h ASP 186 CO 0.00 0.00 -1.13 -1.20 -1.03 0.00 0.00 179.24 175.88 1p1d n SER 187 N -4.01 1.08 -3.51 4.15 7.64 -1.25 -4.94 113.62 112.79 1p1d n SER 187 Ca 0.30 -2.74 -0.12 0.00 1.01 0.00 0.00 58.87 57.33 1p1d n SER 187 Cb 1.47 -0.40 -0.03 0.00 -1.01 0.00 0.00 64.21 64.24 1p1d n SER 187 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p1d s SER 189 N -2.67 0.97 0.06 0.00 1.04 -1.26 -4.84 113.70 107.00 1p1d s SER 189 Ca 0.01 0.81 -0.16 0.00 0.48 0.00 0.00 55.95 57.09 1p1d s SER 189 Cb 0.00 -1.18 -0.19 0.00 0.10 0.00 0.00 66.02 64.76 1p1d s SER 189 CO -0.11 -4.11 1.23 0.00 0.98 0.00 0.00 173.24 171.23 1p1d h MET 190 N -2.57 0.64 -0.62 4.02 -0.00 -1.86 -3.16 114.93 111.38 1p1d h MET 190 Ca -0.48 -0.56 0.18 0.00 -0.00 0.00 0.00 59.70 58.84 1p1d h MET 190 Cb 1.31 0.13 -0.02 0.00 -0.00 0.00 0.00 31.60 33.01 1p1d h MET 190 CO 0.39 1.18 0.45 0.93 -0.00 0.00 0.00 176.91 179.85 1p1d h GLU 191 N 0.28 0.00 0.23 -0.10 4.39 -1.99 -0.85 114.58 116.54 1p1d h GLU 191 Ca -0.06 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 1p1d h GLU 191 Cb 1.35 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.00 1p1d h GLU 191 CO 0.14 0.00 -0.11 -0.44 -1.16 0.00 0.00 179.01 177.44 1p1d h ASP 192 N 0.00 -0.27 -0.98 1.42 3.32 -1.92 -0.33 116.42 117.67 1p1d h ASP 192 Ca 0.29 -0.05 0.09 0.00 0.02 0.00 0.00 57.03 57.38 1p1d h ASP 192 Cb 1.18 0.07 -0.07 0.00 0.22 0.00 0.00 39.33 40.73 1p1d h ASP 192 CO -0.00 -0.12 0.63 0.00 -1.72 0.00 0.00 179.24 178.02 1p1d h ALA 193 N 0.36 1.49 -0.90 3.45 0.00 -1.27 0.68 119.26 123.08 1p1d h ALA 193 Ca -0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1p1d h ALA 193 Cb 0.30 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1p1d h ALA 193 CO 0.05 0.32 0.49 0.28 0.00 0.00 0.00 179.25 180.39 1p1d h VAL 194 N 1.06 1.26 -0.02 0.00 2.07 -1.03 0.59 116.25 120.18 1p1d h VAL 194 Ca 0.45 -0.65 0.01 0.00 0.82 0.00 0.00 66.70 67.33 1p1d h VAL 194 Cb 0.32 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 1p1d h VAL 194 CO -0.20 0.29 -0.03 -0.61 0.02 0.00 0.00 177.57 177.04 1p1d h GLN 195 N 1.26 -0.04 0.00 1.57 5.75 0.87 -0.62 115.11 123.90 1p1d h GLN 195 Ca 0.32 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.77 1p1d h GLN 195 Cb 0.03 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.58 1p1d h GLN 195 CO -0.05 -0.03 -0.24 0.82 -2.65 0.00 0.00 178.83 176.68 1p1d h ILE 196 N -0.04 0.66 -0.62 2.39 2.04 -0.92 0.27 117.51 121.29 1p1d h ILE 196 Ca 0.02 -1.07 0.04 0.00 1.00 0.00 0.00 64.86 64.85 1p1d h ILE 196 Cb 0.07 1.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.81 1p1d h ILE 196 CO -0.05 0.24 0.41 0.25 0.00 0.00 0.00 178.15 179.00 1p1d h LEU 197 N 0.00 0.60 0.01 1.44 5.85 0.17 -0.60 115.31 122.79 1p1d h LEU 197 Ca -0.00 -0.01 -0.39 0.00 0.84 0.00 0.00 57.88 58.32 1p1d h LEU 197 Cb 0.67 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.50 1p1d h LEU 197 CO 0.03 0.41 -2.45 0.00 -0.34 0.00 0.00 178.44 176.10 1p1d n GLN 198 N -4.47 0.65 0.27 1.25 10.64 -0.79 -4.27 117.38 120.67 1p1d n GLN 198 Ca 0.08 0.17 0.18 0.00 -1.83 0.00 0.00 57.00 55.60 1p1d n GLN 198 Cb 0.16 -1.53 0.93 0.00 -0.86 0.00 0.00 30.24 28.93 1p1d n GLN 198 CO 0.00 0.00 0.00 0.37 -1.83 0.00 0.00 177.06 175.60 1p1d h GLN 199 N -0.07 0.00 -1.59 2.61 -0.00 -0.41 -0.45 115.11 115.20 1p1d h GLN 199 Ca -0.58 0.00 -0.42 0.00 -0.00 0.00 0.00 58.65 57.66 1p1d h GLN 199 Cb 1.89 0.00 -0.17 0.00 0.00 0.00 0.00 27.48 29.20 1p1d h GLN 199 CO -0.10 0.00 0.47 0.00 0.00 0.00 0.00 178.83 179.20 1p1d n GLU 201 N 0.33 1.34 0.00 0.00 0.28 -0.18 -1.89 120.64 120.51 1p1d n GLU 201 Ca 0.39 -1.28 0.00 0.00 -0.16 0.00 0.00 57.16 56.11 1p1d n GLU 201 Cb 0.57 -2.44 0.00 0.00 1.43 0.00 0.00 31.44 31.00 1p1d n GLU 201 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1p1d n ASP 202 N 5.37 0.00 0.00 -1.84 8.00 -1.21 -4.65 116.55 122.21 1p1d n ASP 202 Ca 0.35 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.85 1p1d n ASP 202 Cb 0.17 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.27 1p1d n ASP 202 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1p1d n LEU 203 N -0.24 0.00 -4.63 0.64 0.00 -0.79 -2.06 117.00 109.91 1p1d n LEU 203 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 56.01 55.67 1p1d n LEU 203 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 43.42 43.32 1p1d n LEU 203 CO 0.00 0.00 -0.33 -0.69 0.00 0.00 0.00 177.39 176.37 1p1d s VAL 204 N 0.00 4.09 -0.36 1.96 1.01 -0.65 -4.82 120.40 121.63 1p1d s VAL 204 Ca 0.00 -0.33 -0.07 0.00 0.00 0.00 0.00 61.98 61.58 1p1d s VAL 204 Cb 0.00 -2.71 0.05 0.00 0.00 0.00 0.00 36.38 33.72 1p1d s VAL 204 CO 0.00 0.59 0.15 -0.75 0.00 0.00 0.00 175.10 175.09 1p1d s LYS 205 N -0.71 2.57 -0.42 2.72 2.20 -1.25 -2.33 119.74 122.52 1p1d s LYS 205 Ca 0.11 -1.29 -0.23 0.00 -0.36 0.00 0.00 55.97 54.20 1p1d s LYS 205 Cb -0.12 -3.55 0.02 0.00 -1.51 0.00 0.00 37.83 32.68 1p1d s LYS 205 CO 0.02 -0.76 0.75 -0.51 -0.36 0.00 0.00 175.35 174.49 1p1d s LEU 206 N 1.39 4.25 -0.81 5.43 1.02 -0.93 0.09 118.68 129.12 1p1d s LEU 206 Ca 0.00 0.01 -0.18 0.00 0.02 0.00 0.00 54.13 53.98 1p1d s LEU 206 Cb -0.21 -2.93 0.14 0.00 0.02 0.00 0.00 46.19 43.21 1p1d s LEU 206 CO 0.02 -0.82 0.94 -0.75 0.02 0.00 0.00 176.35 175.77 1p1d s LYS 207 N 3.12 3.43 0.48 1.70 2.20 -0.77 -0.39 119.74 129.52 1p1d s LYS 207 Ca 0.29 -1.72 -0.02 0.00 -0.36 0.00 0.00 55.97 54.15 1p1d s LYS 207 Cb -0.13 -4.61 -0.01 0.00 -1.51 0.00 0.00 37.83 31.58 1p1d s LYS 207 CO 0.20 -1.63 0.73 0.42 -0.36 0.00 0.00 175.35 174.72 1p1d s ILE 208 N 2.28 4.17 -0.23 5.43 -1.09 0.13 -1.31 121.20 130.58 1p1d s ILE 208 Ca 0.24 -0.26 -0.06 0.00 -2.23 0.00 0.00 60.65 58.34 1p1d s ILE 208 Cb -0.11 -3.57 -0.02 0.00 -1.58 0.00 0.00 42.46 37.17 1p1d s ILE 208 CO -0.04 -0.47 0.03 -0.13 -1.23 0.00 0.00 174.94 173.10 1p1d s ARG 209 N -4.67 3.58 0.09 2.79 0.52 0.32 -1.05 118.95 120.54 1p1d s ARG 209 Ca 0.49 -0.52 -0.01 0.00 -0.52 0.00 0.00 55.73 55.17 1p1d s ARG 209 Cb -0.10 -3.21 -0.04 0.00 0.52 0.00 0.00 34.95 32.12 1p1d s ARG 209 CO 0.41 -0.16 0.26 0.15 0.02 0.00 0.00 175.30 175.98 1p1d s LYS 210 N 1.48 3.49 0.00 3.54 -0.14 -0.88 -4.27 119.74 122.96 1p1d s LYS 210 Ca 0.06 -0.36 0.00 0.00 -1.36 0.00 0.00 55.97 54.30 1p1d s LYS 210 Cb -0.15 -2.98 0.00 0.00 -1.68 0.00 0.00 37.83 33.02 1p1d s LYS 210 CO 0.01 0.56 0.00 -3.47 -0.76 0.00 0.00 175.35 171.70 1p1d n ASP 211 N 0.14 0.00 -4.34 2.83 2.03 -1.26 -3.61 116.55 112.34 1p1d n ASP 211 Ca -0.04 0.00 -0.29 0.00 0.52 0.00 0.00 54.79 54.97 1p1d n ASP 211 Cb 0.51 0.00 0.24 0.00 -0.72 0.00 0.00 41.12 41.15 1p1d n ASP 211 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1p1d n GLU 212 N 0.00 -2.43 0.00 -0.67 1.02 -1.26 -5.16 120.64 112.15 1p1d n GLU 212 Ca 0.00 -0.69 0.15 0.00 -0.02 0.00 0.00 57.16 56.60 1p1d n GLU 212 Cb 0.00 -1.98 0.70 0.00 -0.02 0.00 0.00 31.44 30.14 1p1d n GLU 212 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84