#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 1.73 -0.38 1.69 1.01 -1.26 -5.08 120.40 118.12 1p1d s VAL 19 Ca 0.00 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.24 1p1d s VAL 19 Cb 0.00 -1.59 0.13 0.00 0.00 0.00 0.00 36.38 34.92 1p1d s VAL 19 CO 0.00 0.49 0.20 0.68 0.00 0.00 0.00 175.10 176.46 1p1d s VAL 20 N 1.32 0.83 -0.30 2.92 -7.23 -1.26 -4.92 120.40 111.77 1p1d s VAL 20 Ca 0.03 -1.97 -0.29 0.00 -1.81 0.00 0.00 61.98 57.93 1p1d s VAL 20 Cb -0.13 -1.60 0.00 0.00 0.56 0.00 0.00 36.38 35.21 1p1d s VAL 20 CO -0.10 -0.87 1.32 -2.28 -0.31 0.00 0.00 175.10 172.86 1p1d s HIS 21 N 0.91 2.66 0.62 2.82 2.46 -1.26 -4.61 115.29 118.89 1p1d s HIS 21 Ca 0.16 0.85 -0.18 0.00 0.47 0.00 0.00 55.06 56.36 1p1d s HIS 21 Cb -0.22 -3.91 -0.04 0.00 -0.13 0.00 0.00 32.58 28.27 1p1d s HIS 21 CO -0.06 -1.77 1.00 0.25 -2.47 0.00 0.00 174.74 171.69 1p1d n THR 22 N 6.22 3.94 -3.89 0.89 -2.24 -1.26 -3.11 114.28 114.84 1p1d n THR 22 Ca 0.15 -0.50 -0.08 0.00 -2.27 0.00 0.00 64.05 61.34 1p1d n THR 22 Cb 0.47 -1.19 -0.04 0.00 -2.10 0.00 0.00 70.33 67.47 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 -2.87 1.59 0.26 -0.78 2.02 0.25 -4.90 118.70 114.27 1p1d s GLU 23 Ca 0.77 -1.07 0.08 0.00 0.02 0.00 0.00 54.97 54.78 1p1d s GLU 23 Cb -0.41 0.53 -0.04 0.00 0.10 0.00 0.00 34.13 34.32 1p1d s GLU 23 CO 0.46 -0.69 0.09 0.99 0.02 0.00 0.00 175.26 176.12 1p1d s THR 24 N -3.95 3.85 0.06 3.63 2.01 -1.26 -1.13 115.64 118.85 1p1d s THR 24 Ca 0.15 -1.69 -0.25 0.00 0.31 0.00 0.00 61.69 60.22 1p1d s THR 24 Cb -0.03 -3.08 0.06 0.00 0.01 0.00 0.00 72.50 69.46 1p1d s THR 24 CO 0.05 -0.36 0.58 -0.89 -0.69 0.00 0.00 174.62 173.32 1p1d s THR 25 N -2.25 0.01 0.25 -0.82 2.01 0.26 -4.93 115.64 110.17 1p1d s THR 25 Ca 0.32 -0.11 0.06 0.00 0.31 0.00 0.00 61.69 62.27 1p1d s THR 25 Cb -0.07 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.41 1p1d s THR 25 CO 0.22 -0.06 0.32 -1.83 -0.69 0.00 0.00 174.62 172.58 1p1d s GLU 26 N -2.60 3.28 0.07 4.92 1.03 -1.26 0.10 118.70 124.24 1p1d s GLU 26 Ca -0.04 -0.86 0.05 0.00 0.03 0.00 0.00 54.97 54.15 1p1d s GLU 26 Cb -0.01 -2.79 -0.03 0.00 -0.80 0.00 0.00 34.13 30.50 1p1d s GLU 26 CO -0.03 0.41 -0.14 0.08 -1.33 0.00 0.00 175.26 174.25 1p1d s VAL 27 N -2.03 1.08 -0.25 1.83 1.01 0.16 -4.84 120.40 117.36 1p1d s VAL 27 Ca 0.34 -1.30 0.01 0.00 0.00 0.00 0.00 61.98 61.03 1p1d s VAL 27 Cb -0.09 -1.05 0.06 0.00 0.00 0.00 0.00 36.38 35.30 1p1d s VAL 27 CO 0.28 -0.24 -0.06 -0.69 0.00 0.00 0.00 175.10 174.39 1p1d s VAL 28 N -1.30 1.66 -0.26 2.92 1.01 -1.26 -1.23 120.40 121.94 1p1d s VAL 28 Ca -0.02 -1.35 -0.07 0.00 0.00 0.00 0.00 61.98 60.54 1p1d s VAL 28 Cb -0.10 -1.92 -0.01 0.00 0.00 0.00 0.00 36.38 34.35 1p1d s VAL 28 CO 0.02 -0.12 0.07 -0.76 0.00 0.00 0.00 175.10 174.31 1p1d s LEU 29 N 1.33 3.54 0.30 3.92 2.01 0.77 -4.85 118.68 125.70 1p1d s LEU 29 Ca -0.05 -0.39 0.07 0.00 0.01 0.00 0.00 54.13 53.77 1p1d s LEU 29 Cb -0.19 -1.90 -0.03 0.00 0.01 0.00 0.00 46.19 44.08 1p1d s LEU 29 CO -0.06 -0.09 0.23 0.42 1.01 0.00 0.00 176.35 177.85 1p1d s THR 30 N 1.57 3.90 0.12 5.49 -4.23 -1.26 0.14 115.64 121.37 1p1d s THR 30 Ca 0.05 -1.43 -0.01 0.00 -1.18 0.00 0.00 61.69 59.12 1p1d s THR 30 Cb -0.16 -3.25 -0.04 0.00 1.34 0.00 0.00 72.50 70.39 1p1d s THR 30 CO 0.03 -0.26 0.30 0.00 -0.54 0.00 0.00 174.62 174.14 1p1d s ALA 31 N -2.24 3.92 0.06 3.99 0.00 -0.95 -3.72 121.76 122.82 1p1d s ALA 31 Ca 0.37 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.56 1p1d s ALA 31 Cb -0.07 -1.93 -0.03 0.00 0.00 0.00 0.00 23.12 21.10 1p1d s ALA 31 CO 0.25 0.68 -0.10 -0.51 0.00 0.00 0.00 175.76 176.08 1p1d s ASP 32 N -2.71 1.16 -0.03 0.00 1.01 -1.26 -4.88 116.67 109.96 1p1d s ASP 32 Ca 0.37 -0.61 0.01 0.00 0.71 0.00 0.00 52.55 53.03 1p1d s ASP 32 Cb -0.12 0.01 0.09 0.00 1.01 0.00 0.00 42.92 43.91 1p1d s ASP 32 CO 0.27 -0.18 0.67 -0.81 0.21 0.00 0.00 175.17 175.33 1p1d n PRO 33 N 1.27 1.40 0.06 8.23 -0.04 -1.26 -3.32 135.00 141.33 1p1d n PRO 33 Ca -0.21 -0.33 0.00 0.00 -0.04 0.00 0.00 63.50 62.91 1p1d n PRO 33 Cb 0.55 -1.55 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 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 0.09 0.19 -2.52 0.52 0.31 -1.26 -5.00 118.33 110.65 1p1d n VAL 34 Ca 0.03 0.06 -0.03 0.00 -0.01 0.00 0.00 64.34 64.39 1p1d n VAL 34 Cb 0.37 -0.82 0.09 0.00 -0.91 0.00 0.00 33.84 32.56 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 -3.07 0.01 -1.42 2.52 5.66 -1.26 -5.14 114.28 111.58 1p1d n THR 35 Ca 0.00 -0.80 -0.44 0.00 -3.05 0.00 0.00 64.05 59.76 1p1d n THR 35 Cb 0.08 0.89 -0.01 0.00 -1.55 0.00 0.00 70.33 69.74 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 -1.21 -1.68 2.94 1.09 0.00 -1.21 -3.37 105.19 101.76 1p1d n GLY 36 Ca -0.20 0.17 -0.01 0.00 0.00 0.00 0.00 46.02 45.97 1p1d n GLY 36 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1p1d n PHE 37 N -0.47 -2.93 -0.98 1.61 3.01 -1.24 -4.76 117.46 111.71 1p1d n PHE 37 Ca 0.13 1.13 -0.12 0.00 1.01 0.00 0.00 57.45 59.60 1p1d n PHE 37 Cb 0.34 -3.98 0.24 0.00 -0.01 0.00 0.00 39.48 36.07 1p1d n PHE 37 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1p1d n GLY 38 N -1.47 3.83 3.47 1.37 0.00 -1.22 -4.92 105.19 106.25 1p1d n GLY 38 Ca 0.02 -0.96 -0.31 0.00 0.00 0.00 0.00 46.02 44.76 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 -2.93 2.92 -0.04 -0.61 -4.36 -1.26 0.46 121.20 115.37 1p1d s ILE 39 Ca 0.53 -1.01 -0.11 0.00 -0.26 0.00 0.00 60.65 59.79 1p1d s ILE 39 Cb 0.43 -2.20 -0.05 0.00 1.25 0.00 0.00 42.46 41.89 1p1d s ILE 39 CO 0.12 0.42 0.30 -1.10 0.24 0.00 0.00 174.94 174.92 1p1d s GLN 40 N -1.21 3.72 -0.21 0.37 -0.21 0.31 -4.95 119.66 117.48 1p1d s GLN 40 Ca 0.14 0.18 -0.03 0.00 0.02 0.00 0.00 55.36 55.66 1p1d s GLN 40 Cb -0.11 -3.20 -0.01 0.00 1.00 0.00 0.00 33.01 30.70 1p1d s GLN 40 CO 0.04 0.72 -0.06 -0.51 -2.12 0.00 0.00 175.29 173.36 1p1d s LEU 41 N -1.11 2.86 0.72 2.90 1.02 -1.26 -0.00 118.68 123.81 1p1d s LEU 41 Ca 0.21 -0.38 -0.07 0.00 0.02 0.00 0.00 54.13 53.90 1p1d s LEU 41 Cb -0.15 -1.72 0.07 0.00 0.02 0.00 0.00 46.19 44.41 1p1d s LEU 41 CO 0.10 0.01 1.04 -1.58 0.02 0.00 0.00 176.35 175.94 1p1d s GLN 42 N 1.29 2.15 -0.43 1.70 0.74 0.40 -4.81 119.66 120.71 1p1d s GLN 42 Ca 0.04 -0.21 0.05 0.00 0.05 0.00 0.00 55.36 55.29 1p1d s GLN 42 Cb -0.14 -2.14 0.31 0.00 1.10 0.00 0.00 33.01 32.14 1p1d s GLN 42 CO -0.02 -1.30 1.16 0.41 -0.55 0.00 0.00 175.29 174.99 1p1d n GLY 43 N -2.98 0.03 0.00 2.59 0.00 -1.26 -1.57 105.19 102.00 1p1d n GLY 43 Ca 0.08 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.34 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 0.56 0.00 0.00 1.61 2.88 -1.26 -4.87 113.62 112.54 1p1d n SER 44 Ca 0.04 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.58 1p1d n SER 44 Cb 0.71 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.17 1p1d n SER 44 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1p1d n VAL 45 N 0.00 0.00 -0.31 2.46 0.31 -1.26 -4.85 118.33 114.68 1p1d n VAL 45 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 64.34 64.47 1p1d n VAL 45 Cb 0.00 -0.43 0.30 0.00 -0.91 0.00 0.00 33.84 32.80 1p1d n VAL 45 CO 0.00 0.00 0.00 2.19 -1.32 0.00 0.00 176.83 177.70 1p1d h PHE 46 N 0.00 0.22 -6.65 3.52 -0.00 -1.99 -3.45 116.94 108.59 1p1d h PHE 46 Ca 0.00 0.06 -0.44 0.00 -0.00 0.00 0.00 57.97 57.59 1p1d h PHE 46 Cb 0.00 0.05 0.01 0.00 -0.00 0.00 0.00 35.95 36.01 1p1d h PHE 46 CO 0.00 -0.31 -1.14 0.00 -0.00 0.00 0.00 178.31 176.86 1p1d n ALA 47 N -2.83 -2.58 0.00 12.09 0.00 -1.26 -4.96 120.51 120.96 1p1d n ALA 47 Ca 0.23 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1p1d n ALA 47 Cb 0.74 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.78 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 -1.53 0.00 -1.55 0.00 5.66 -1.26 -5.15 114.28 110.45 1p1d n THR 48 Ca -0.21 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.79 1p1d n THR 48 Cb 0.69 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.47 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 -4.44 0.00 1.09 2.13 -1.26 -4.90 120.64 113.26 1p1d n GLU 49 Ca 0.00 3.30 0.00 0.00 0.66 0.00 0.00 57.16 61.12 1p1d n GLU 49 Cb 0.00 -3.70 0.00 0.00 0.27 0.00 0.00 31.44 28.01 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 -0.74 0.00 0.00 6.31 -1.04 -1.26 -4.95 114.28 112.60 1p1d n THR 50 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1p1d n THR 50 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1p1d n THR 50 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1p1d n LEU 51 N 0.00 0.00 -0.61 -4.42 4.77 -1.26 -4.95 117.00 110.53 1p1d n LEU 51 Ca 0.00 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 1p1d n LEU 51 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1p1d n LEU 51 CO 0.00 0.00 -0.07 -0.24 -1.33 0.00 0.00 177.39 175.75 1p1d n SER 52 N -0.46 -5.06 -4.51 -1.43 2.88 -1.26 -4.84 113.62 98.94 1p1d n SER 52 Ca 0.00 0.18 -0.44 0.00 -1.33 0.00 0.00 58.87 57.28 1p1d n SER 52 Cb 0.00 -3.59 -0.06 0.00 -0.75 0.00 0.00 64.21 59.81 1p1d n SER 52 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1p1d n SER 53 N -0.72 2.26 -4.65 -3.46 2.88 -1.26 -4.80 113.62 103.87 1p1d n SER 53 Ca -0.07 0.12 -0.43 0.00 -1.33 0.00 0.00 58.87 57.16 1p1d n SER 53 Cb 0.50 -1.38 -0.02 0.00 -0.75 0.00 0.00 64.21 62.56 1p1d n SER 53 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1p1d s PRO 54 N 7.02 4.06 -0.40 -1.46 0.04 -1.26 -4.61 135.00 138.39 1p1d s PRO 54 Ca 1.07 1.68 -0.38 0.00 0.04 0.00 0.00 61.00 63.42 1p1d s PRO 54 Cb -0.61 -3.89 -0.16 0.00 0.04 0.00 0.00 34.50 29.88 1p1d s PRO 54 CO 0.40 -0.94 1.35 -2.30 0.04 0.00 0.00 177.00 175.54 1p1d n PRO 55 N 7.08 0.00 -4.57 0.56 -0.01 -1.23 -4.67 135.00 132.16 1p1d n PRO 55 Ca 0.16 0.00 -0.31 0.00 -0.01 0.00 0.00 63.50 63.34 1p1d n PRO 55 Cb 0.45 -1.21 -0.07 0.00 -0.01 0.00 0.00 33.50 32.66 1p1d n PRO 55 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 175.50 174.98 1p1d s LEU 56 N 2.73 2.51 -0.07 2.45 1.02 -0.61 -1.69 118.68 125.03 1p1d s LEU 56 Ca 0.86 -1.51 0.02 0.00 0.02 0.00 0.00 54.13 53.52 1p1d s LEU 56 Cb -1.21 -0.88 -0.03 0.00 0.02 0.00 0.00 46.19 44.10 1p1d s LEU 56 CO 0.64 -0.80 -0.10 -0.63 0.02 0.00 0.00 176.35 175.48 1p1d s ILE 57 N -2.81 3.37 -0.06 -0.59 -1.09 -1.26 0.15 121.20 118.92 1p1d s ILE 57 Ca 0.17 -0.60 0.01 0.00 -2.23 0.00 0.00 60.65 58.00 1p1d s ILE 57 Cb 0.03 -2.37 -0.01 0.00 -1.58 0.00 0.00 42.46 38.53 1p1d s ILE 57 CO 0.09 0.58 0.11 -1.54 -1.23 0.00 0.00 174.94 172.96 1p1d n SER 58 N 2.46 0.20 -3.57 3.58 3.41 0.99 -2.95 113.62 117.74 1p1d n SER 58 Ca -0.18 -0.60 -0.06 0.00 -0.26 0.00 0.00 58.87 57.77 1p1d n SER 58 Cb 0.53 0.85 -0.03 0.00 -0.26 0.00 0.00 64.21 65.30 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 -0.94 -0.21 0.06 7.33 5.04 -1.20 -4.91 117.35 122.52 1p1d s TYR 59 Ca 0.00 0.19 0.03 0.00 -2.44 0.00 0.00 57.07 54.85 1p1d s TYR 59 Cb 0.01 0.51 -0.03 0.00 0.35 0.00 0.00 41.96 42.80 1p1d s TYR 59 CO 0.03 -0.30 -0.08 0.42 -1.34 0.00 0.00 175.55 174.28 1p1d s ILE 60 N -2.30 0.68 0.19 3.14 -1.09 -1.26 0.11 121.20 120.67 1p1d s ILE 60 Ca 0.07 -1.34 0.05 0.00 -2.23 0.00 0.00 60.65 57.19 1p1d s ILE 60 Cb -0.01 -0.96 -0.04 0.00 -1.58 0.00 0.00 42.46 39.87 1p1d s ILE 60 CO -0.05 -0.49 0.20 -0.70 -1.23 0.00 0.00 174.94 172.67 1p1d s GLU 61 N -2.20 3.05 -0.75 2.79 -6.30 0.17 -4.91 118.70 110.56 1p1d s GLU 61 Ca -0.03 -0.86 -0.02 0.00 -2.50 0.00 0.00 54.97 51.56 1p1d s GLU 61 Cb -0.06 -2.70 0.33 0.00 0.00 0.00 0.00 34.13 31.70 1p1d s GLU 61 CO -0.00 0.46 2.12 0.00 0.02 0.00 0.00 175.26 177.86 1p1d n ALA 62 N -0.69 6.44 0.00 6.30 0.00 -1.26 -4.47 120.51 126.83 1p1d n ALA 62 Ca -0.08 -3.78 0.00 0.00 0.00 0.00 0.00 53.44 49.58 1p1d n ALA 62 Cb 0.56 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 18.05 1p1d n ALA 62 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1p1d n ASP 63 N -0.42 0.00 -1.43 0.00 -0.08 -1.26 -5.16 116.55 108.20 1p1d n ASP 63 Ca 0.54 0.00 -0.03 0.00 -1.51 0.00 0.00 54.79 53.80 1p1d n ASP 63 Cb 0.37 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.83 1p1d n ASP 63 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1p1d n SER 64 N 0.00 -0.45 0.00 1.67 7.64 -1.26 -4.70 113.62 116.51 1p1d n SER 64 Ca 0.00 -1.39 0.11 0.00 1.01 0.00 0.00 58.87 58.60 1p1d n SER 64 Cb 0.00 0.78 -0.00 0.00 -1.01 0.00 0.00 64.21 63.97 1p1d n SER 64 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1p1d n PRO 65 N -0.13 0.02 0.01 1.43 -0.04 -1.26 -3.84 135.00 131.18 1p1d n PRO 65 Ca -0.01 -0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.40 1p1d n PRO 65 Cb 0.14 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.06 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 2.98 -0.13 0.00 0.55 0.00 -1.88 -1.76 119.26 119.00 1p1d h ALA 66 Ca 0.00 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 1p1d h ALA 66 Cb 0.51 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1p1d h ALA 66 CO 0.00 -0.13 -0.52 1.49 0.00 0.00 0.00 179.25 180.08 1p1d h GLU 67 N -1.02 0.00 -0.17 0.00 4.57 -1.85 -3.00 114.58 113.11 1p1d h GLU 67 Ca -0.01 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 57.98 1p1d h GLU 67 Cb 0.24 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 1p1d h GLU 67 CO 0.02 0.52 -0.65 0.00 -1.18 0.00 0.00 179.01 177.72 1p1d h ARG 68 N 0.00 0.65 -1.14 1.92 -0.00 -1.70 -3.02 114.38 111.10 1p1d h ARG 68 Ca -0.01 -0.47 0.33 0.00 -0.50 0.00 0.00 59.98 59.33 1p1d h ARG 68 Cb 0.98 0.08 -0.05 0.00 0.00 0.00 0.00 29.97 30.97 1p1d h ARG 68 CO 0.07 1.09 0.81 0.00 0.00 0.00 0.00 179.97 181.94 1p1d n GLY 70 N -1.74 0.69 1.41 0.00 0.00 -1.14 -4.30 105.19 100.10 1p1d n GLY 70 Ca 0.25 -0.69 -0.03 0.00 0.00 0.00 0.00 46.02 45.54 1p1d n GLY 70 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1p1d n VAL 71 N -3.10 0.06 -4.18 1.61 0.31 -1.26 -4.22 118.33 107.55 1p1d n VAL 71 Ca -0.00 -0.50 -0.17 0.00 -0.01 0.00 0.00 64.34 63.66 1p1d n VAL 71 Cb 0.51 0.72 -0.12 0.00 -0.91 0.00 0.00 33.84 34.03 1p1d n VAL 71 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1p1d s LEU 72 N -0.68 2.21 -0.01 7.52 1.43 -1.26 -4.88 118.68 123.00 1p1d s LEU 72 Ca 0.11 -0.48 -0.09 0.00 -1.03 0.00 0.00 54.13 52.63 1p1d s LEU 72 Cb 0.16 -0.38 0.01 0.00 0.03 0.00 0.00 46.19 46.01 1p1d s LEU 72 CO -0.06 -0.07 0.19 -1.58 0.23 0.00 0.00 176.35 175.06 1p1d s GLN 73 N -1.31 0.50 -0.55 1.70 2.00 -1.26 -4.94 119.66 115.81 1p1d s GLN 73 Ca -0.03 -0.27 -0.22 0.00 -2.00 0.00 0.00 55.36 52.83 1p1d s GLN 73 Cb -0.08 0.22 -0.20 0.00 0.80 0.00 0.00 33.01 33.74 1p1d s GLN 73 CO 0.01 -0.12 1.81 -0.89 -0.50 0.00 0.00 175.29 175.60 1p1d n ILE 74 N 1.58 1.31 0.00 -2.34 5.41 -1.26 -3.01 119.36 121.05 1p1d n ILE 74 Ca -0.21 -1.09 0.00 0.00 1.00 0.00 0.00 62.75 62.45 1p1d n ILE 74 Cb 0.56 -2.19 0.00 0.00 -0.71 0.00 0.00 39.64 37.30 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 4.57 0.00 3.85 7.39 0.00 -1.15 -4.77 105.19 115.08 1p1d n GLY 75 Ca 0.46 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.19 1p1d n GLY 75 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1p1d n ASP 76 N 0.00 0.04 -3.04 1.61 9.92 -1.16 -4.75 116.55 119.16 1p1d n ASP 76 Ca 0.00 -1.47 -0.18 0.00 -0.53 0.00 0.00 54.79 52.61 1p1d n ASP 76 Cb 0.00 -1.02 -0.03 0.00 -0.64 0.00 0.00 41.12 39.43 1p1d n ASP 76 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1p1d n ARG 77 N -3.85 0.72 -2.01 -1.24 1.74 -1.22 -3.96 116.66 106.85 1p1d n ARG 77 Ca 0.17 -2.70 -0.42 0.00 -0.77 0.00 0.00 57.85 54.13 1p1d n ARG 77 Cb 0.58 -1.31 -0.02 0.00 -1.02 0.00 0.00 32.46 30.68 1p1d n ARG 77 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1p1d s VAL 78 N -0.49 2.69 -0.12 1.55 1.01 -0.68 -3.57 120.40 120.79 1p1d s VAL 78 Ca 0.34 0.55 0.13 0.00 0.00 0.00 0.00 61.98 63.00 1p1d s VAL 78 Cb 0.19 -3.35 -0.18 0.00 0.00 0.00 0.00 36.38 33.03 1p1d s VAL 78 CO -0.16 0.08 0.10 0.80 0.00 0.00 0.00 175.10 175.91 1p1d n MET 79 N 2.75 1.49 -3.67 2.72 1.56 -0.08 -3.56 117.12 118.34 1p1d n MET 79 Ca 0.08 -0.03 -0.14 0.00 -0.27 0.00 0.00 57.70 57.35 1p1d n MET 79 Cb 0.40 -1.36 -0.14 0.00 2.15 0.00 0.00 33.22 34.27 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 -2.46 -0.48 -0.43 -5.12 0.00 -1.26 -1.80 121.76 110.20 1p1d s ALA 80 Ca -0.07 0.87 -0.10 0.00 0.00 0.00 0.00 51.96 52.66 1p1d s ALA 80 Cb 0.05 -0.97 0.08 0.00 0.00 0.00 0.00 23.12 22.28 1p1d s ALA 80 CO 0.59 -0.61 0.29 0.42 0.00 0.00 0.00 175.76 176.44 1p1d s ILE 81 N 2.36 4.43 -1.85 0.00 1.01 0.43 -3.21 121.20 124.37 1p1d s ILE 81 Ca 0.01 -1.33 0.00 0.00 0.00 0.00 0.00 60.65 59.33 1p1d s ILE 81 Cb -0.12 -3.70 0.00 0.00 0.01 0.00 0.00 42.46 38.65 1p1d s ILE 81 CO -0.08 -0.52 0.00 0.59 0.00 0.00 0.00 174.94 174.93 1p1d n ASN 82 N 4.97 -4.76 0.00 3.58 4.13 -0.65 -0.91 115.26 121.62 1p1d n ASN 82 Ca -0.10 0.40 0.00 0.00 1.68 0.00 0.00 54.58 56.55 1p1d n ASN 82 Cb 0.43 -4.24 0.00 0.00 -1.54 0.00 0.00 39.78 34.43 1p1d n ASN 82 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1p1d n GLY 83 N -0.40 1.31 3.61 7.41 0.00 -1.26 -5.05 105.19 110.81 1p1d n GLY 83 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 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 -1.59 3.74 0.92 -0.61 -1.09 -0.09 -4.98 121.20 117.51 1p1d s ILE 84 Ca 0.00 0.78 -0.12 0.00 -2.23 0.00 0.00 60.65 59.08 1p1d s ILE 84 Cb 0.00 -3.91 0.14 0.00 -1.58 0.00 0.00 42.46 37.12 1p1d s ILE 84 CO 0.00 -0.52 1.11 -2.16 -1.23 0.00 0.00 174.94 172.15 1p1d s PRO 85 N 5.03 1.07 0.00 2.79 0.04 -1.26 -0.43 135.00 142.24 1p1d s PRO 85 Ca 0.69 0.47 0.00 0.00 0.04 0.00 0.00 61.00 62.20 1p1d s PRO 85 Cb -0.19 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.53 1p1d s PRO 85 CO 0.31 -2.28 0.45 0.25 0.04 0.00 0.00 177.00 175.77 1p1d n THR 86 N -3.86 0.00 0.39 1.26 -2.24 -0.75 -4.80 114.28 104.28 1p1d n THR 86 Ca 0.06 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.96 1p1d n THR 86 Cb 0.58 0.78 0.15 0.00 -2.10 0.00 0.00 70.33 69.74 1p1d n THR 86 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1p1d h GLU 87 N 0.00 0.00 -0.80 -0.78 4.81 -1.87 -3.37 114.58 112.56 1p1d h GLU 87 Ca 0.00 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.91 1p1d h GLU 87 Cb 1.03 0.00 -0.40 0.00 0.63 0.00 0.00 28.75 30.01 1p1d h GLU 87 CO 0.00 0.00 -1.16 -3.47 -0.73 0.00 0.00 179.01 173.65 1p1d n ASP 88 N -2.44 1.56 -3.74 1.04 -0.08 -1.26 -4.71 116.55 106.91 1p1d n ASP 88 Ca 0.03 -2.49 -0.08 0.00 -1.51 0.00 0.00 54.79 50.74 1p1d n ASP 88 Cb 0.48 -0.51 -0.03 0.00 2.34 0.00 0.00 41.12 43.41 1p1d n ASP 88 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1p1d s SER 89 N -3.38 -0.09 0.48 1.67 0.01 -1.26 -5.08 113.70 106.06 1p1d s SER 89 Ca 0.27 -0.85 -0.19 0.00 1.31 0.00 0.00 55.95 56.49 1p1d s SER 89 Cb 0.41 0.69 -0.09 0.00 0.21 0.00 0.00 66.02 67.24 1p1d s SER 89 CO 0.01 -1.32 0.99 -0.89 0.41 0.00 0.00 173.24 172.44 1p1d s THR 90 N -3.68 4.25 0.30 1.44 2.01 -1.26 -4.10 115.64 114.60 1p1d s THR 90 Ca 0.17 1.28 0.11 0.00 0.31 0.00 0.00 61.69 63.56 1p1d s THR 90 Cb -0.04 -3.58 0.00 0.00 0.01 0.00 0.00 72.50 68.89 1p1d s THR 90 CO 0.09 -0.43 1.66 2.19 -0.69 0.00 0.00 174.62 177.45 1p1d h PHE 91 N 1.42 0.00 -1.00 4.92 -0.00 -1.89 -3.12 116.94 117.26 1p1d h PHE 91 Ca -0.48 -0.00 0.12 0.00 -0.00 0.00 0.00 57.97 57.61 1p1d h PHE 91 Cb 1.19 -0.00 -0.08 0.00 -0.00 0.00 0.00 35.95 37.06 1p1d h PHE 91 CO 0.61 0.56 0.63 1.05 -0.00 0.00 0.00 178.31 181.16 1p1d h GLU 92 N 0.00 0.94 -0.61 6.09 4.11 -1.93 0.07 114.58 123.26 1p1d h GLU 92 Ca -0.01 -0.06 -0.01 0.00 0.07 0.00 0.00 59.36 59.36 1p1d h GLU 92 Cb 0.99 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 30.00 1p1d h GLU 92 CO 0.07 0.62 0.34 1.05 0.07 0.00 0.00 179.01 181.16 1p1d h GLU 93 N 0.97 0.83 -0.19 1.06 -0.00 -1.95 -1.03 114.58 114.27 1p1d h GLU 93 Ca 0.50 -0.08 -0.10 0.00 -0.00 0.00 0.00 59.36 59.68 1p1d h GLU 93 Cb 0.52 -0.17 -0.01 0.00 -0.00 0.00 0.00 28.75 29.09 1p1d h GLU 93 CO -0.27 0.61 -0.29 0.00 -0.00 0.00 0.00 179.01 179.06 1p1d h ALA 94 N 1.53 1.14 -0.37 1.06 0.00 -1.14 -2.30 119.26 119.18 1p1d h ALA 94 Ca 0.22 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1p1d h ALA 94 Cb 0.02 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1p1d h ALA 94 CO -0.04 0.55 -0.12 -0.97 0.00 0.00 0.00 179.25 178.67 1p1d h ASN 95 N 0.33 0.64 0.31 0.00 -0.00 -0.49 -2.10 115.58 114.27 1p1d h ASN 95 Ca 0.05 -0.18 -0.02 0.00 -0.00 0.00 0.00 56.30 56.15 1p1d h ASN 95 Cb 0.69 -0.17 0.00 0.00 -0.00 0.00 0.00 38.32 38.84 1p1d h ASN 95 CO 0.05 0.79 -0.15 1.56 -0.00 0.00 0.00 177.43 179.68 1p1d h GLN 96 N 0.59 -0.40 -0.89 6.67 1.08 -0.98 -0.87 115.11 120.31 1p1d h GLN 96 Ca 0.10 0.03 0.15 0.00 -1.45 0.00 0.00 58.65 57.48 1p1d h GLN 96 Cb 0.56 0.09 -0.10 0.00 -0.05 0.00 0.00 27.48 27.98 1p1d h GLN 96 CO 0.04 -0.07 0.49 1.37 -0.95 0.00 0.00 178.83 179.70 1p1d h LEU 97 N -0.93 0.62 0.35 1.46 8.10 -1.44 0.24 115.31 123.71 1p1d h LEU 97 Ca -0.04 0.09 -0.02 0.00 0.11 0.00 0.00 57.88 58.02 1p1d h LEU 97 Cb 0.51 -0.02 0.00 0.00 -0.44 0.00 0.00 40.66 40.72 1p1d h LEU 97 CO 0.07 0.26 -0.17 -0.07 -4.11 0.00 0.00 178.44 174.42 1p1d h LEU 98 N 0.69 -0.40 -1.95 0.17 3.38 -1.42 0.84 115.31 116.60 1p1d h LEU 98 Ca 0.49 -0.15 0.23 0.00 0.09 0.00 0.00 57.88 58.54 1p1d h LEU 98 Cb 0.68 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 1p1d h LEU 98 CO -0.36 0.01 0.63 0.08 0.09 0.00 0.00 178.44 178.90 1p1d h ARG 99 N -0.91 0.00 -0.66 1.13 -0.00 -0.67 0.30 114.38 113.58 1p1d h ARG 99 Ca -0.05 0.00 -0.48 0.00 -0.00 0.00 0.00 59.98 59.45 1p1d h ARG 99 Cb 0.53 0.00 -0.39 0.00 -0.00 0.00 0.00 29.97 30.12 1p1d h ARG 99 CO 0.08 0.00 -0.80 -3.47 -0.00 0.00 0.00 179.97 175.78 1p1d n ASP 100 N -4.08 4.49 -2.13 0.08 2.03 0.79 -4.77 116.55 112.96 1p1d n ASP 100 Ca 0.16 -3.71 -0.27 0.00 0.52 0.00 0.00 54.79 51.49 1p1d n ASP 100 Cb 0.92 -0.36 0.11 0.00 -0.72 0.00 0.00 41.12 41.07 1p1d n ASP 100 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1p1d n SER 101 N -0.74 5.72 -0.06 1.67 7.64 0.29 -4.40 113.62 123.73 1p1d n SER 101 Ca 0.40 -3.74 0.05 0.00 1.01 0.00 0.00 58.87 56.60 1p1d n SER 101 Cb 0.94 -0.83 0.08 0.00 -1.01 0.00 0.00 64.21 63.39 1p1d n SER 101 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1p1d n SER 102 N -0.98 2.03 -0.04 6.43 7.64 -1.26 -4.43 113.62 123.01 1p1d n SER 102 Ca 0.57 -2.56 -0.14 0.00 1.01 0.00 0.00 58.87 57.75 1p1d n SER 102 Cb 1.02 -0.24 -0.09 0.00 -1.01 0.00 0.00 64.21 63.88 1p1d n SER 102 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1p1d h ILE 103 N 0.42 1.42 -0.10 0.44 5.03 -1.92 -3.10 117.51 119.70 1p1d h ILE 103 Ca 0.00 -1.46 0.00 0.00 -0.12 0.00 0.00 64.86 63.28 1p1d h ILE 103 Cb 0.83 2.21 0.00 0.00 -3.03 0.00 0.00 36.82 36.83 1p1d h ILE 103 CO 0.00 0.41 0.00 0.35 -0.68 0.00 0.00 178.15 178.23 1p1d n THR 104 N -4.61 0.13 -1.44 -0.27 -2.24 -1.26 -4.89 114.28 99.70 1p1d n THR 104 Ca -0.08 -0.24 -0.15 0.00 -2.27 0.00 0.00 64.05 61.31 1p1d n THR 104 Cb 0.38 0.19 -0.06 0.00 -2.10 0.00 0.00 70.33 68.73 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 -0.02 -5.21 -3.61 3.42 7.64 -1.17 -4.91 113.62 109.76 1p1d n SER 105 Ca 0.16 0.37 -0.07 0.00 1.01 0.00 0.00 58.87 60.35 1p1d n SER 105 Cb 0.26 -4.03 -0.05 0.00 -1.01 0.00 0.00 64.21 59.38 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 -3.23 0.36 -0.07 1.43 1.02 -1.26 -2.23 119.74 115.76 1p1d s LYS 106 Ca 0.00 0.08 -0.06 0.00 0.02 0.00 0.00 55.97 56.01 1p1d s LYS 106 Cb 0.00 0.17 0.02 0.00 -0.52 0.00 0.00 37.83 37.50 1p1d s LYS 106 CO 0.00 -0.11 0.18 0.08 -0.92 0.00 0.00 175.35 174.58 1p1d s VAL 107 N -1.09 -0.01 -0.17 3.17 1.01 0.38 -4.90 120.40 118.79 1p1d s VAL 107 Ca 0.03 0.03 -0.02 0.00 0.00 0.00 0.00 61.98 62.02 1p1d s VAL 107 Cb -0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 36.38 36.09 1p1d s VAL 107 CO -0.03 0.01 -0.09 0.42 0.00 0.00 0.00 175.10 175.41 1p1d s THR 108 N 0.27 3.20 0.34 3.92 -4.23 -1.26 -0.16 115.64 117.72 1p1d s THR 108 Ca -0.01 -0.58 0.09 0.00 -1.18 0.00 0.00 61.69 60.01 1p1d s THR 108 Cb -0.03 -2.39 -0.06 0.00 1.34 0.00 0.00 72.50 71.36 1p1d s THR 108 CO -0.01 0.48 -0.07 -0.76 -0.54 0.00 0.00 174.62 173.72 1p1d s LEU 109 N 0.85 2.78 -0.27 4.79 1.43 -0.36 -1.64 118.68 126.27 1p1d s LEU 109 Ca -0.03 -1.16 0.01 0.00 -1.03 0.00 0.00 54.13 51.92 1p1d s LEU 109 Cb -0.15 -1.07 0.08 0.00 0.03 0.00 0.00 46.19 45.08 1p1d s LEU 109 CO 0.01 -0.21 0.01 -1.61 0.23 0.00 0.00 176.35 174.77 1p1d s GLU 110 N -3.63 1.30 0.08 1.70 2.02 -1.20 0.37 118.70 119.35 1p1d s GLU 110 Ca 0.33 -1.12 0.03 0.00 0.02 0.00 0.00 54.97 54.23 1p1d s GLU 110 Cb 0.02 -2.52 -0.04 0.00 0.10 0.00 0.00 34.13 31.69 1p1d s GLU 110 CO 0.17 -0.75 0.10 0.96 0.02 0.00 0.00 175.26 175.76 1p1d s ILE 111 N 1.40 4.65 -0.20 -1.63 -4.36 0.29 -0.90 121.20 120.45 1p1d s ILE 111 Ca 0.01 -0.73 0.01 0.00 -0.26 0.00 0.00 60.65 59.68 1p1d s ILE 111 Cb -0.18 -3.25 0.04 0.00 1.25 0.00 0.00 42.46 40.31 1p1d s ILE 111 CO -0.11 0.12 -0.11 -0.70 0.24 0.00 0.00 174.94 174.38 1p1d s GLU 112 N -2.44 2.08 0.30 0.37 2.12 -1.23 0.90 118.70 120.79 1p1d s GLU 112 Ca 0.30 -0.84 0.03 0.00 0.36 0.00 0.00 54.97 54.83 1p1d s GLU 112 Cb -0.12 -2.41 -0.04 0.00 0.26 0.00 0.00 34.13 31.82 1p1d s GLU 112 CO 0.23 -0.41 0.16 -0.59 -0.54 0.00 0.00 175.26 174.10 1p1d s PHE 113 N 1.39 1.59 0.31 5.30 -0.12 -0.29 -4.77 117.98 121.41 1p1d s PHE 113 Ca -0.01 -1.36 -0.06 0.00 -0.05 0.00 0.00 56.93 55.46 1p1d s PHE 113 Cb -0.16 -0.86 -0.05 0.00 -0.63 0.00 0.00 43.02 41.32 1p1d s PHE 113 CO -0.08 -0.51 0.59 -0.51 -0.05 0.00 0.00 175.22 174.66 1p1d s ASP 114 N -3.37 6.45 -0.53 1.98 1.11 -1.26 -0.58 116.67 120.46 1p1d s ASP 114 Ca 0.36 0.78 -0.21 0.00 0.18 0.00 0.00 52.55 53.66 1p1d s ASP 114 Cb 0.05 -2.17 0.06 0.00 1.07 0.00 0.00 42.92 41.93 1p1d s ASP 114 CO 0.17 -0.24 0.74 -0.69 1.18 0.00 0.00 175.17 176.33 1p1d s VAL 115 N -2.16 4.71 -0.28 -1.27 1.01 -1.18 -4.90 120.40 116.33 1p1d s VAL 115 Ca 0.45 -0.31 -0.23 0.00 0.00 0.00 0.00 61.98 61.89 1p1d s VAL 115 Cb -0.11 -4.40 0.13 0.00 0.00 0.00 0.00 36.38 32.00 1p1d s VAL 115 CO 0.31 -0.95 1.00 0.00 0.00 0.00 0.00 175.10 175.46 1p1d s ALA 116 N 3.07 -2.04 0.00 5.51 0.00 0.38 -4.39 121.76 124.29 1p1d s ALA 116 Ca 0.19 1.98 0.10 0.00 0.00 0.00 0.00 51.96 54.23 1p1d s ALA 116 Cb -0.18 -1.50 0.16 0.00 0.00 0.00 0.00 23.12 21.60 1p1d s ALA 116 CO 0.13 -0.27 0.99 0.39 0.00 0.00 0.00 175.76 177.00 1p1d n GLU 117 N 2.65 0.00 -1.77 0.00 -0.58 -1.24 -4.60 120.64 115.10 1p1d n GLU 117 Ca -0.14 -1.22 -0.01 0.00 -0.42 0.00 0.00 57.16 55.37 1p1d n GLU 117 Cb 0.56 -0.06 0.01 0.00 -0.57 0.00 0.00 31.44 31.38 1p1d n GLU 117 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1p1d n SER 118 N 0.18 -2.86 -4.90 1.62 2.88 -1.26 -4.28 113.62 105.00 1p1d n SER 118 Ca -0.03 -0.06 -0.33 0.00 -1.33 0.00 0.00 58.87 57.13 1p1d n SER 118 Cb 0.84 -1.51 -0.05 0.00 -0.75 0.00 0.00 64.21 62.74 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 -3.03 5.30 -0.40 2.46 -7.23 -1.26 -2.75 120.40 113.49 1p1d s VAL 119 Ca 0.03 -0.04 0.01 0.00 -1.81 0.00 0.00 61.98 60.18 1p1d s VAL 119 Cb -0.00 -3.60 0.12 0.00 0.56 0.00 0.00 36.38 33.46 1p1d s VAL 119 CO 0.12 0.22 0.19 0.27 -0.31 0.00 0.00 175.10 175.59 1p1d s ILE 120 N -1.45 1.28 0.57 -0.62 -5.25 -0.78 -4.96 121.20 109.99 1p1d s ILE 120 Ca 0.33 -2.23 0.04 0.00 -0.99 0.00 0.00 60.65 57.80 1p1d s ILE 120 Cb -0.13 -1.92 0.11 0.00 2.95 0.00 0.00 42.46 43.47 1p1d s ILE 120 CO 0.22 -0.83 0.79 -0.81 -1.79 0.00 0.00 174.94 172.52 1p1d n PRO 121 N 3.92 0.33 0.00 0.37 -0.04 -1.26 -2.30 135.00 136.02 1p1d n PRO 121 Ca 0.06 -2.58 0.00 0.00 -0.04 0.00 0.00 63.50 60.94 1p1d n PRO 121 Cb 0.37 -0.39 0.00 0.00 -0.04 0.00 0.00 33.50 33.44 1p1d n PRO 121 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1p1d n SER 122 N -2.65 0.00 -2.14 3.54 2.88 -1.07 -4.95 113.62 109.23 1p1d n SER 122 Ca 0.14 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.68 1p1d n SER 122 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 1p1d n SER 122 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1p1d n SER 123 N 0.00 -9.07 0.00 -3.46 7.64 -1.26 -4.44 113.62 103.03 1p1d n SER 123 Ca 0.00 1.45 0.00 0.00 1.01 0.00 0.00 58.87 61.33 1p1d n SER 123 Cb 0.00 -5.17 0.00 0.00 -1.01 0.00 0.00 64.21 58.03 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 1.98 2.08 3.12 0.23 0.00 0.61 -4.86 105.19 108.35 1p1d n GLY 124 Ca 0.00 -0.31 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 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 0.00 2.93 -0.21 2.61 2.01 -1.26 -2.00 115.64 119.72 1p1d s THR 125 Ca 0.00 -1.78 -0.03 0.00 0.31 0.00 0.00 61.69 60.19 1p1d s THR 125 Cb 0.00 -2.87 -0.00 0.00 0.01 0.00 0.00 72.50 69.64 1p1d s THR 125 CO 0.00 -0.38 -0.07 0.12 -0.69 0.00 0.00 174.62 173.60 1p1d s PHE 126 N 1.15 2.92 0.14 4.92 2.19 0.77 -2.61 117.98 127.46 1p1d s PHE 126 Ca 0.02 -1.02 0.06 0.00 0.33 0.00 0.00 56.93 56.32 1p1d s PHE 126 Cb -0.21 -2.05 -0.04 0.00 -1.31 0.00 0.00 43.02 39.41 1p1d s PHE 126 CO -0.03 -0.55 0.00 -1.01 1.83 0.00 0.00 175.22 175.45 1p1d s HIS 127 N 1.34 2.91 -0.33 10.12 3.76 -0.97 0.31 115.29 132.43 1p1d s HIS 127 Ca 0.04 -0.09 -0.00 0.00 -0.15 0.00 0.00 55.06 54.86 1p1d s HIS 127 Cb -0.14 -1.45 0.11 0.00 1.11 0.00 0.00 32.58 32.21 1p1d s HIS 127 CO -0.04 0.50 0.12 0.14 -0.85 0.00 0.00 174.74 174.60 1p1d s VAL 128 N -1.55 1.02 -0.55 -0.90 -7.23 -0.39 -1.86 120.40 108.94 1p1d s VAL 128 Ca 0.27 -1.63 -0.23 0.00 -1.81 0.00 0.00 61.98 58.57 1p1d s VAL 128 Cb -0.10 -1.76 0.04 0.00 0.56 0.00 0.00 36.38 35.12 1p1d s VAL 128 CO 0.19 -0.71 0.91 -0.54 -0.31 0.00 0.00 175.10 174.63 1p1d s LYS 129 N 1.38 3.30 -0.05 4.82 -0.14 -1.11 -2.25 119.74 125.68 1p1d s LYS 129 Ca 0.11 -0.36 0.03 0.00 -1.36 0.00 0.00 55.97 54.39 1p1d s LYS 129 Cb -0.19 -4.07 0.00 0.00 -1.68 0.00 0.00 37.83 31.90 1p1d s LYS 129 CO -0.20 -1.47 -0.14 -0.48 -0.76 0.00 0.00 175.35 172.30 1p1d s LEU 130 N 3.81 1.79 0.25 3.17 2.34 -0.92 -4.27 118.68 124.84 1p1d s LEU 130 Ca 0.28 -0.31 -0.30 0.00 0.06 0.00 0.00 54.13 53.87 1p1d s LEU 130 Cb -0.14 -0.85 -0.10 0.00 -0.56 0.00 0.00 46.19 44.55 1p1d s LEU 130 CO 0.18 0.09 1.34 -2.16 -1.06 0.00 0.00 176.35 174.74 1p1d s PRO 131 N 0.33 4.35 0.25 1.48 0.04 -1.26 -0.35 135.00 139.83 1p1d s PRO 131 Ca -0.08 2.16 0.11 0.00 0.04 0.00 0.00 61.00 63.23 1p1d s PRO 131 Cb -0.13 -3.14 -0.05 0.00 0.04 0.00 0.00 34.50 31.23 1p1d s PRO 131 CO 0.03 -0.28 -0.18 0.21 0.04 0.00 0.00 177.00 176.82 1p1d s LYS 132 N -0.61 1.74 0.00 4.56 2.20 -0.97 -4.79 119.74 121.86 1p1d s LYS 132 Ca 0.55 -1.63 0.00 0.00 -0.36 0.00 0.00 55.97 54.53 1p1d s LYS 132 Cb -0.39 -1.86 0.00 0.00 -1.51 0.00 0.00 37.83 34.07 1p1d s LYS 132 CO 0.43 0.36 0.00 1.63 -0.36 0.00 0.00 175.35 177.41 1p1d n LYS 133 N -0.38 2.42 0.34 4.03 4.01 -1.26 -2.25 118.16 125.07 1p1d n LYS 133 Ca -0.07 0.00 -0.18 0.00 -0.51 0.00 0.00 58.31 57.55 1p1d n LYS 133 Cb 0.59 0.00 -0.09 0.00 -0.51 0.00 0.00 35.03 35.02 1p1d n LYS 133 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1p1d h HIS 134 N 0.53 -0.96 0.00 2.13 3.86 -1.98 -3.37 115.15 115.36 1p1d h HIS 134 Ca 0.00 -0.01 -0.18 0.00 -1.16 0.00 0.00 60.37 59.02 1p1d h HIS 134 Cb 0.00 0.34 -0.13 0.00 1.06 0.00 0.00 27.41 28.68 1p1d h HIS 134 CO 0.00 -0.56 -0.21 0.43 0.86 0.00 0.00 177.93 178.46 1p1d n SER 135 N -5.50 -1.61 -4.83 2.45 7.64 -1.26 -4.86 113.62 105.64 1p1d n SER 135 Ca -0.13 -2.20 -0.31 0.00 1.01 0.00 0.00 58.87 57.24 1p1d n SER 135 Cb 0.39 0.94 0.04 0.00 -1.01 0.00 0.00 64.21 64.57 1p1d n SER 135 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1p1d s VAL 136 N 0.15 4.14 -0.38 0.44 1.01 -1.26 -4.89 120.40 119.61 1p1d s VAL 136 Ca 0.15 0.73 -0.38 0.00 0.00 0.00 0.00 61.98 62.48 1p1d s VAL 136 Cb 0.32 -3.49 -0.14 0.00 0.00 0.00 0.00 36.38 33.07 1p1d s VAL 136 CO -0.07 -0.87 2.09 1.21 0.00 0.00 0.00 175.10 177.45 1p1d n GLU 137 N -2.92 0.81 -3.97 2.72 2.13 -1.26 -4.92 120.64 113.23 1p1d n GLU 137 Ca 0.07 0.24 -0.34 0.00 0.66 0.00 0.00 57.16 57.79 1p1d n GLU 137 Cb 0.54 -2.14 -0.14 0.00 0.27 0.00 0.00 31.44 29.96 1p1d n GLU 137 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1p1d s LEU 138 N 6.27 3.45 -0.42 4.31 1.43 -1.26 -4.51 118.68 127.96 1p1d s LEU 138 Ca 1.10 -1.11 -0.03 0.00 -1.03 0.00 0.00 54.13 53.07 1p1d s LEU 138 Cb -1.07 -1.65 0.14 0.00 0.03 0.00 0.00 46.19 43.64 1p1d s LEU 138 CO 0.57 -0.18 2.46 0.61 0.23 0.00 0.00 176.35 180.03 1p1d n GLY 139 N 4.61 4.33 3.45 -3.19 0.00 -1.26 -4.90 105.19 108.23 1p1d n GLY 139 Ca -0.15 -1.62 -0.33 0.00 0.00 0.00 0.00 46.02 43.92 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 -2.40 3.57 -0.05 -0.61 1.01 -1.26 -1.34 121.20 120.11 1p1d s ILE 140 Ca 0.49 -0.48 0.03 0.00 0.00 0.00 0.00 60.65 60.70 1p1d s ILE 140 Cb 0.34 -2.54 0.00 0.00 0.01 0.00 0.00 42.46 40.27 1p1d s ILE 140 CO -0.13 0.51 -0.16 -0.89 0.00 0.00 0.00 174.94 174.27 1p1d s THR 141 N 0.32 1.35 0.31 2.92 2.01 -0.43 -4.97 115.64 117.15 1p1d s THR 141 Ca -0.06 -0.64 0.07 0.00 0.31 0.00 0.00 61.69 61.36 1p1d s THR 141 Cb -0.15 -1.18 -0.03 0.00 0.01 0.00 0.00 72.50 71.15 1p1d s THR 141 CO 0.04 0.40 0.28 -0.63 -0.69 0.00 0.00 174.62 174.02 1p1d s ILE 142 N 0.28 3.90 -0.30 1.82 1.01 -1.26 0.99 121.20 127.65 1p1d s ILE 142 Ca -0.09 -1.34 -0.14 0.00 0.00 0.00 0.00 60.65 59.08 1p1d s ILE 142 Cb -0.13 -3.29 0.14 0.00 0.01 0.00 0.00 42.46 39.19 1p1d s ILE 142 CO 0.03 -0.23 0.87 -0.94 0.00 0.00 0.00 174.94 174.68 1p1d s SER 143 N -3.96 -0.74 -0.30 3.58 1.04 0.84 -4.47 113.70 109.68 1p1d s SER 143 Ca 0.39 1.06 -0.26 0.00 0.48 0.00 0.00 55.95 57.62 1p1d s SER 143 Cb -0.07 1.70 0.01 0.00 0.10 0.00 0.00 66.02 67.76 1p1d s SER 143 CO 0.27 -0.15 0.90 -0.94 0.98 0.00 0.00 173.24 174.29 1p1d s SER 144 N 2.25 6.78 1.21 7.02 1.04 -1.26 -0.87 113.70 129.87 1p1d s SER 144 Ca -0.05 0.84 -0.12 0.00 0.48 0.00 0.00 55.95 57.10 1p1d s SER 144 Cb -0.07 -2.46 0.18 0.00 0.10 0.00 0.00 66.02 63.77 1p1d s SER 144 CO -0.18 -0.70 0.47 -0.81 0.98 0.00 0.00 173.24 173.01 1p1d n PRO 145 N 6.42 -3.05 -0.58 4.02 -0.04 -1.26 -4.97 135.00 135.55 1p1d n PRO 145 Ca 0.07 -0.78 -0.30 0.00 -0.04 0.00 0.00 63.50 62.45 1p1d n PRO 145 Cb 0.48 -0.92 0.21 0.00 -0.04 0.00 0.00 33.50 33.23 1p1d n PRO 145 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1p1d n SER 146 N -4.29 -1.08 -3.96 3.54 3.41 -1.26 -4.94 113.62 105.04 1p1d n SER 146 Ca 0.07 0.08 -0.39 0.00 -0.26 0.00 0.00 58.87 58.37 1p1d n SER 146 Cb 0.30 -1.31 -0.02 0.00 -0.26 0.00 0.00 64.21 62.92 1p1d n SER 146 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1p1d n SER 147 N -4.23 5.41 -2.31 4.04 3.41 -1.26 -4.81 113.62 113.87 1p1d n SER 147 Ca 0.06 -3.32 -0.26 0.00 -0.26 0.00 0.00 58.87 55.10 1p1d n SER 147 Cb 0.54 -1.13 0.01 0.00 -0.26 0.00 0.00 64.21 63.36 1p1d n SER 147 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1p1d n ARG 148 N 1.60 3.49 -3.64 4.33 1.74 -1.26 -5.02 116.66 117.90 1p1d n ARG 148 Ca 0.26 -4.36 -0.03 0.00 -0.77 0.00 0.00 57.85 52.95 1p1d n ARG 148 Cb 0.36 -2.26 -0.03 0.00 -1.02 0.00 0.00 32.46 29.51 1p1d n ARG 148 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 1p1d s LYS 149 N -3.57 0.10 -1.14 5.56 0.00 -1.26 -5.07 119.74 114.36 1p1d s LYS 149 Ca 0.49 -0.01 -0.20 0.00 0.00 0.00 0.00 55.97 56.26 1p1d s LYS 149 Cb 0.40 0.05 -0.05 0.00 0.00 0.00 0.00 37.83 38.23 1p1d s LYS 149 CO -0.10 -0.04 1.94 -0.35 0.00 0.00 0.00 175.35 176.80 1p1d n PRO 150 N 0.26 2.17 0.01 1.78 -0.04 -1.26 -3.71 135.00 134.21 1p1d n PRO 150 Ca 0.02 -2.50 0.00 0.00 -0.04 0.00 0.00 63.50 60.98 1p1d n PRO 150 Cb 0.58 -3.36 0.00 0.00 -0.04 0.00 0.00 33.50 30.68 1p1d n PRO 150 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1p1d n GLY 151 N 5.02 -1.44 2.86 0.55 0.00 -1.26 -5.05 105.19 105.87 1p1d n GLY 151 Ca 0.49 0.61 -0.00 0.00 0.00 0.00 0.00 46.02 47.12 1p1d n GLY 151 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1p1d n ASP 152 N -3.01 -7.10 -2.62 1.61 -0.08 -1.24 -3.87 116.55 100.23 1p1d n ASP 152 Ca 0.00 -0.05 0.00 0.00 -1.51 0.00 0.00 54.79 53.23 1p1d n ASP 152 Cb 0.00 -4.79 0.00 0.00 2.34 0.00 0.00 41.12 38.67 1p1d n ASP 152 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1p1d n PRO 153 N -1.64 0.98 -4.36 -0.67 -0.04 -1.26 -4.13 135.00 123.89 1p1d n PRO 153 Ca 0.00 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.27 1p1d n PRO 153 Cb 0.50 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.86 1p1d n PRO 153 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 1p1d s LEU 154 N 0.00 1.74 0.00 1.53 2.34 -1.26 -4.00 118.68 119.03 1p1d s LEU 154 Ca 0.00 -1.53 -0.07 0.00 0.06 0.00 0.00 54.13 52.59 1p1d s LEU 154 Cb 0.00 0.09 0.03 0.00 -0.56 0.00 0.00 46.19 45.75 1p1d s LEU 154 CO 0.00 -0.85 0.47 1.33 -1.06 0.00 0.00 176.35 176.25 1p1d n VAL 155 N -0.61 0.00 -2.19 1.48 0.24 -0.05 -1.46 118.33 115.74 1p1d n VAL 155 Ca -0.00 -0.85 -0.33 0.00 -2.04 0.00 0.00 64.34 61.12 1p1d n VAL 155 Cb 0.65 0.70 -0.01 0.00 -1.47 0.00 0.00 33.84 33.72 1p1d n VAL 155 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1p1d s ILE 156 N -2.49 4.04 0.00 1.34 -1.09 -1.26 -0.11 121.20 121.63 1p1d s ILE 156 Ca 0.14 0.99 0.00 0.00 -2.23 0.00 0.00 60.65 59.55 1p1d s ILE 156 Cb -0.03 -3.49 0.00 0.00 -1.58 0.00 0.00 42.46 37.36 1p1d s ILE 156 CO 0.10 -0.55 0.01 -0.24 -1.23 0.00 0.00 174.94 173.04 1p1d n SER 157 N -1.81 0.02 0.00 3.58 2.88 0.28 -4.48 113.62 114.08 1p1d n SER 157 Ca 0.08 -0.18 0.00 0.00 -1.33 0.00 0.00 58.87 57.44 1p1d n SER 157 Cb 0.53 0.20 0.00 0.00 -0.75 0.00 0.00 64.21 64.19 1p1d n SER 157 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1p1d n ASP 158 N -0.20 0.00 -4.17 -3.46 8.00 -1.23 -4.93 116.55 110.56 1p1d n ASP 158 Ca 0.00 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.32 1p1d n ASP 158 Cb 0.02 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.00 1p1d n ASP 158 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1p1d s ILE 159 N -1.74 1.11 -0.06 0.53 1.01 -1.25 -1.31 121.20 119.49 1p1d s ILE 159 Ca 0.00 -1.32 0.05 0.00 0.00 0.00 0.00 60.65 59.38 1p1d s ILE 159 Cb 0.00 -1.09 -0.01 0.00 0.01 0.00 0.00 42.46 41.37 1p1d s ILE 159 CO 0.00 -0.24 -0.23 -1.59 0.00 0.00 0.00 174.94 172.89 1p1d s LYS 160 N -1.79 2.38 -1.12 2.79 0.00 -0.45 -4.99 119.74 116.55 1p1d s LYS 160 Ca -0.02 -0.81 -0.21 0.00 0.00 0.00 0.00 55.97 54.93 1p1d s LYS 160 Cb -0.10 -2.00 0.06 0.00 0.00 0.00 0.00 37.83 35.79 1p1d s LYS 160 CO 0.02 0.32 1.55 0.15 0.00 0.00 0.00 175.35 177.39 1p1d s LYS 161 N -0.05 3.74 0.00 1.78 -0.14 -1.26 -3.63 119.74 120.18 1p1d s LYS 161 Ca -0.05 -1.45 0.00 0.00 -1.36 0.00 0.00 55.97 53.11 1p1d s LYS 161 Cb -0.14 -5.42 0.00 0.00 -1.68 0.00 0.00 37.83 30.59 1p1d s LYS 161 CO 0.04 -2.22 0.00 0.41 -0.76 0.00 0.00 175.35 172.81 1p1d n GLY 162 N 6.33 0.01 3.92 -3.33 0.00 -1.26 -4.49 105.19 106.37 1p1d n GLY 162 Ca 0.39 -0.01 -0.20 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.35 5.29 0.65 1.61 0.15 -1.24 -4.03 113.70 115.78 1p1d s SER 163 Ca 0.00 -0.61 0.39 0.00 0.70 0.00 0.00 55.95 56.43 1p1d s SER 163 Cb 0.00 -0.64 2.16 0.00 -1.71 0.00 0.00 66.02 65.83 1p1d s SER 163 CO 0.00 -0.67 2.28 -0.37 1.20 0.00 0.00 173.24 175.68 1p1d h VAL 164 N 0.91 0.14 0.00 4.45 -1.51 -1.89 -3.27 116.25 115.08 1p1d h VAL 164 Ca -0.41 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.06 1p1d h VAL 164 Cb 1.27 0.95 0.00 0.00 -2.13 0.00 0.00 31.29 31.38 1p1d h VAL 164 CO 0.53 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.87 1p1d n ALA 165 N -2.13 -0.08 0.29 5.19 0.00 -1.26 -0.93 120.51 121.60 1p1d n ALA 165 Ca -0.02 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.56 1p1d n ALA 165 Cb 0.13 0.38 0.86 0.00 0.00 0.00 0.00 19.45 20.83 1p1d n ALA 165 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1p1d h HIS 166 N 0.00 0.00 -0.85 0.00 6.17 -1.77 -2.24 115.15 116.46 1p1d h HIS 166 Ca 0.00 0.00 0.03 0.00 0.71 0.00 0.00 60.37 61.11 1p1d h HIS 166 Cb 0.00 0.00 -0.05 0.00 2.52 0.00 0.00 27.41 29.88 1p1d h HIS 166 CO -0.62 0.04 0.56 0.00 0.71 0.00 0.00 177.93 178.62 1p1d h ARG 167 N 0.00 1.03 -0.27 5.26 2.47 -1.13 -0.18 114.38 121.55 1p1d h ARG 167 Ca -0.00 -0.06 0.07 0.00 -1.26 0.00 0.00 59.98 58.72 1p1d h ARG 167 Cb 0.11 -0.23 -0.01 0.00 -1.65 0.00 0.00 29.97 28.19 1p1d h ARG 167 CO 0.01 0.68 0.19 0.00 0.56 0.00 0.00 179.97 181.41 1p1d h THR 168 N 1.06 0.89 0.00 2.04 1.03 -0.68 1.09 112.91 118.34 1p1d h THR 168 Ca 0.34 -0.02 0.00 0.00 -0.01 0.00 0.00 66.41 66.72 1p1d h THR 168 Cb 0.03 0.83 0.00 0.00 -1.07 0.00 0.00 68.15 67.94 1p1d h THR 168 CO -0.10 0.01 0.00 0.61 -0.01 0.00 0.00 175.52 176.03 1p1d n GLY 169 N -1.58 2.21 0.65 2.99 0.00 -0.08 -4.57 105.19 104.81 1p1d n GLY 169 Ca 0.03 -0.11 0.46 0.00 0.00 0.00 0.00 46.02 46.40 1p1d n GLY 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p1d h THR 170 N 0.00 0.12 -0.27 2.61 1.03 -1.89 -3.35 112.91 111.16 1p1d h THR 170 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 66.41 66.39 1p1d h THR 170 Cb 0.00 0.12 -0.00 0.00 -1.07 0.00 0.00 68.15 67.20 1p1d h THR 170 CO 0.00 0.00 0.02 -0.76 -0.01 0.00 0.00 175.52 174.77 1p1d s LEU 171 N -7.88 2.68 0.26 0.00 1.43 -1.26 -4.88 118.68 109.03 1p1d s LEU 171 Ca -0.05 -0.29 0.11 0.00 -1.03 0.00 0.00 54.13 52.88 1p1d s LEU 171 Cb 0.25 -2.57 -0.05 0.00 0.03 0.00 0.00 46.19 43.85 1p1d s LEU 171 CO 0.84 -4.21 -0.16 -0.70 0.23 0.00 0.00 176.35 172.34 1p1d s GLU 172 N 8.78 1.79 -0.73 1.70 2.12 -1.26 -4.93 118.70 126.17 1p1d s GLU 172 Ca 0.89 -1.64 -0.24 0.00 0.36 0.00 0.00 54.97 54.35 1p1d s GLU 172 Cb -0.10 -1.88 -0.19 0.00 0.26 0.00 0.00 34.13 32.22 1p1d s GLU 172 CO 0.11 0.35 1.88 1.28 -0.54 0.00 0.00 175.26 178.35 1p1d n LEU 173 N -0.49 3.31 0.00 2.70 4.77 -1.26 -3.20 117.00 122.82 1p1d n LEU 173 Ca -0.07 -2.70 0.00 0.00 -0.03 0.00 0.00 56.01 53.21 1p1d n LEU 173 Cb 0.59 -1.15 0.00 0.00 -2.33 0.00 0.00 43.42 40.53 1p1d n LEU 173 CO 0.37 -1.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.03 1p1d n GLY 174 N 4.88 0.00 3.08 -0.72 0.00 -1.26 -4.98 105.19 106.19 1p1d n GLY 174 Ca 0.48 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.18 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 0.00 3.24 -0.47 1.61 1.01 -1.20 -5.01 116.67 115.86 1p1d s ASP 175 Ca 0.00 -0.74 -0.28 0.00 0.71 0.00 0.00 52.55 52.23 1p1d s ASP 175 Cb 0.00 -1.39 0.01 0.00 1.01 0.00 0.00 42.92 42.55 1p1d s ASP 175 CO 0.00 -0.05 1.39 -0.54 0.21 0.00 0.00 175.17 176.18 1p1d s LYS 176 N 1.32 3.49 0.52 8.23 -0.14 -1.26 -4.20 119.74 127.70 1p1d s LYS 176 Ca 0.02 0.74 -0.18 0.00 -1.36 0.00 0.00 55.97 55.19 1p1d s LYS 176 Cb -0.14 -4.05 -0.07 0.00 -1.68 0.00 0.00 37.83 31.89 1p1d s LYS 176 CO -0.11 -1.68 1.03 -0.51 -0.76 0.00 0.00 175.35 173.32 1p1d s LEU 177 N 5.58 3.71 0.21 3.17 1.43 -0.54 -0.40 118.68 131.84 1p1d s LEU 177 Ca 0.57 1.82 0.00 0.00 -1.03 0.00 0.00 54.13 55.49 1p1d s LEU 177 Cb -0.12 -4.54 0.00 0.00 0.03 0.00 0.00 46.19 41.56 1p1d s LEU 177 CO 0.30 -0.84 0.00 -0.11 0.23 0.00 0.00 176.35 175.93 1p1d n LEU 178 N -1.37 -0.13 -4.69 1.79 0.00 0.56 -4.36 117.00 108.79 1p1d n LEU 178 Ca 0.08 0.36 -0.26 0.00 0.00 0.00 0.00 56.01 56.20 1p1d n LEU 178 Cb 0.53 0.30 -0.07 0.00 0.00 0.00 0.00 43.42 44.18 1p1d n LEU 178 CO 0.43 -0.71 -0.30 0.00 0.00 0.00 0.00 177.39 176.80 1p1d s ALA 179 N -2.00 3.28 -0.16 1.96 0.00 -1.17 -2.99 121.76 120.68 1p1d s ALA 179 Ca 0.00 -1.39 -0.05 0.00 0.00 0.00 0.00 51.96 50.52 1p1d s ALA 179 Cb 0.00 -1.04 0.06 0.00 0.00 0.00 0.00 23.12 22.14 1p1d s ALA 179 CO 0.00 0.43 0.08 0.42 0.00 0.00 0.00 175.76 176.70 1p1d s ILE 180 N -1.86 -0.05 -1.27 0.00 -1.09 0.19 -1.57 121.20 115.55 1p1d s ILE 180 Ca 0.29 -0.13 -0.03 0.00 -2.23 0.00 0.00 60.65 58.55 1p1d s ILE 180 Cb -0.09 -0.56 -0.01 0.00 -1.58 0.00 0.00 42.46 40.22 1p1d s ILE 180 CO 0.20 -0.23 0.72 -0.67 -1.23 0.00 0.00 174.94 173.73 1p1d n ASP 181 N 5.27 -1.96 0.00 3.58 2.03 0.77 -1.43 116.55 124.81 1p1d n ASP 181 Ca -0.07 -0.84 0.00 0.00 0.52 0.00 0.00 54.79 54.40 1p1d n ASP 181 Cb 0.49 -4.03 0.00 0.00 -0.72 0.00 0.00 41.12 36.86 1p1d n ASP 181 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1p1d n ASN 182 N -3.02 0.00 -4.79 1.67 2.85 -1.26 -4.96 115.26 105.74 1p1d n ASN 182 Ca -0.26 0.00 -0.34 0.00 -0.11 0.00 0.00 54.58 53.87 1p1d n ASN 182 Cb 0.67 0.00 -0.01 0.00 1.24 0.00 0.00 39.78 41.67 1p1d n ASN 182 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1p1d s ILE 183 N -0.41 3.65 -0.12 -1.44 -1.09 -0.51 -5.05 121.20 116.23 1p1d s ILE 183 Ca 0.00 0.94 -0.01 0.00 -2.23 0.00 0.00 60.65 59.36 1p1d s ILE 183 Cb 0.00 -3.38 0.03 0.00 -1.58 0.00 0.00 42.46 37.53 1p1d s ILE 183 CO 0.00 -0.30 -0.06 -0.13 -1.23 0.00 0.00 174.94 173.22 1p1d s ARG 184 N -3.52 1.37 0.09 2.79 0.52 -1.26 0.53 118.95 119.47 1p1d s ARG 184 Ca 0.67 -0.25 0.27 0.00 -0.52 0.00 0.00 55.73 55.90 1p1d s ARG 184 Cb -0.18 -1.58 0.89 0.00 0.52 0.00 0.00 34.95 34.60 1p1d s ARG 184 CO 0.27 -0.30 1.74 1.28 0.02 0.00 0.00 175.30 178.31 1p1d n LEU 185 N 4.96 0.44 -3.77 2.53 4.32 -1.16 -4.94 117.00 119.38 1p1d n LEU 185 Ca -0.12 0.44 -0.25 0.00 -0.02 0.00 0.00 56.01 56.07 1p1d n LEU 185 Cb 0.50 -0.37 0.02 0.00 -1.62 0.00 0.00 43.42 41.95 1p1d n LEU 185 CO 0.16 -0.06 -0.13 -0.67 -1.22 0.00 0.00 177.39 175.47 1p1d n ASP 186 N -1.85 -1.97 -2.70 -1.43 -0.08 -1.26 -3.43 116.55 103.83 1p1d n ASP 186 Ca 0.06 -0.93 -0.03 0.00 -1.51 0.00 0.00 54.79 52.38 1p1d n ASP 186 Cb 0.38 -3.58 0.00 0.00 2.34 0.00 0.00 41.12 40.27 1p1d n ASP 186 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1p1d n SER 187 N -2.95 -6.81 -1.65 1.67 7.64 -1.26 -5.00 113.62 105.25 1p1d n SER 187 Ca -0.25 0.17 0.00 0.00 1.01 0.00 0.00 58.87 59.80 1p1d n SER 187 Cb 0.66 -4.57 0.00 0.00 -1.01 0.00 0.00 64.21 59.29 1p1d n SER 187 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p1d n SER 189 N -1.54 0.65 0.05 0.00 7.64 -1.26 -4.09 113.62 115.08 1p1d n SER 189 Ca 0.00 0.61 -0.11 0.00 1.01 0.00 0.00 58.87 60.38 1p1d n SER 189 Cb 0.00 -1.45 0.01 0.00 -1.01 0.00 0.00 64.21 61.75 1p1d n SER 189 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 1p1d h MET 190 N -0.64 0.41 -0.50 1.43 4.05 -1.83 -3.27 114.93 114.57 1p1d h MET 190 Ca -0.47 -0.36 0.10 0.00 -0.28 0.00 0.00 59.70 58.69 1p1d h MET 190 Cb 1.31 0.08 -0.08 0.00 -0.80 0.00 0.00 31.60 32.12 1p1d h MET 190 CO 0.46 1.01 0.00 0.93 0.23 0.00 0.00 176.91 179.54 1p1d h GLU 191 N 0.26 0.12 -0.42 0.39 5.08 -1.99 -1.68 114.58 116.35 1p1d h GLU 191 Ca -0.04 -0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.40 1p1d h GLU 191 Cb 1.38 -0.03 -0.09 0.00 0.50 0.00 0.00 28.75 30.51 1p1d h GLU 191 CO 0.14 0.08 -0.22 -0.44 -1.00 0.00 0.00 179.01 177.56 1p1d h ASP 192 N 0.12 -0.74 -0.89 1.42 5.19 -1.95 0.20 116.42 119.77 1p1d h ASP 192 Ca 0.25 0.16 0.11 0.00 -0.62 0.00 0.00 57.03 56.93 1p1d h ASP 192 Cb 0.38 0.39 -0.07 0.00 0.18 0.00 0.00 39.33 40.21 1p1d h ASP 192 CO -0.41 -0.25 0.57 0.00 -3.12 0.00 0.00 179.24 176.03 1p1d h ALA 193 N 1.11 1.69 -0.07 3.45 0.00 -1.45 0.30 119.26 124.29 1p1d h ALA 193 Ca 0.20 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1p1d h ALA 193 Cb 0.45 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1p1d h ALA 193 CO -0.51 0.12 -0.10 0.28 0.00 0.00 0.00 179.25 179.05 1p1d h VAL 194 N 0.83 1.11 0.02 0.00 2.07 0.02 0.71 116.25 121.03 1p1d h VAL 194 Ca 0.42 -0.50 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 1p1d h VAL 194 Cb 0.48 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1p1d h VAL 194 CO -0.18 0.15 -0.01 1.56 0.02 0.00 0.00 177.57 179.11 1p1d h GLN 195 N 0.10 -0.03 0.00 1.57 1.08 0.80 -2.14 115.11 116.50 1p1d h GLN 195 Ca 0.02 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.16 1p1d h GLN 195 Cb 0.24 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.67 1p1d h GLN 195 CO 0.01 0.30 -0.32 0.82 -0.95 0.00 0.00 178.83 178.69 1p1d h ILE 196 N -0.36 0.70 -0.81 2.54 5.03 -1.03 0.12 117.51 123.70 1p1d h ILE 196 Ca -0.00 -1.47 -0.05 0.00 -0.12 0.00 0.00 64.86 63.22 1p1d h ILE 196 Cb 0.34 1.96 -0.04 0.00 -3.03 0.00 0.00 36.82 36.05 1p1d h ILE 196 CO 0.01 0.32 0.33 -0.07 -0.68 0.00 0.00 178.15 178.05 1p1d h LEU 197 N 0.00 1.11 0.14 1.44 3.38 0.64 0.19 115.31 122.21 1p1d h LEU 197 Ca -0.00 -0.17 -0.36 0.00 0.09 0.00 0.00 57.88 57.43 1p1d h LEU 197 Cb 0.93 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1p1d h LEU 197 CO 0.04 0.98 -1.95 1.56 0.09 0.00 0.00 178.44 179.16 1p1d h GLN 198 N 1.18 0.29 0.00 1.13 4.20 -1.28 -3.32 115.11 117.30 1p1d h GLN 198 Ca 0.27 -0.49 0.00 0.00 0.06 0.00 0.00 58.65 58.49 1p1d h GLN 198 Cb 0.21 0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.17 1p1d h GLN 198 CO -0.02 1.23 0.00 0.94 -0.67 0.00 0.00 178.83 180.31 1p1d n GLN 199 N -3.51 0.16 -0.80 1.46 0.00 0.40 -2.70 117.38 112.39 1p1d n GLN 199 Ca -0.31 0.56 -0.11 0.00 -0.00 0.00 0.00 57.00 57.15 1p1d n GLN 199 Cb 1.05 -1.92 -0.00 0.00 0.00 0.00 0.00 30.24 29.36 1p1d n GLN 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1p1d n GLU 201 N 1.04 2.04 0.00 0.00 0.28 -1.10 -2.22 120.64 120.69 1p1d n GLU 201 Ca 0.21 -1.61 0.00 0.00 -0.16 0.00 0.00 57.16 55.60 1p1d n GLU 201 Cb 0.58 -2.60 0.00 0.00 1.43 0.00 0.00 31.44 30.85 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 4.98 0.00 0.00 -1.84 8.00 -0.95 -4.43 116.55 122.30 1p1d n ASP 202 Ca 0.47 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.97 1p1d n ASP 202 Cb 0.20 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 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 -0.23 0.00 -4.47 0.64 0.00 -0.94 -2.30 117.00 109.70 1p1d n LEU 203 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 56.01 55.62 1p1d n LEU 203 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 43.42 43.31 1p1d n LEU 203 CO 0.00 0.00 -0.19 -0.69 0.00 0.00 0.00 177.39 176.51 1p1d s VAL 204 N 0.00 4.79 -0.36 1.96 1.01 0.52 -4.84 120.40 123.49 1p1d s VAL 204 Ca 0.00 -0.32 -0.07 0.00 0.00 0.00 0.00 61.98 61.58 1p1d s VAL 204 Cb 0.00 -3.43 0.05 0.00 0.00 0.00 0.00 36.38 33.00 1p1d s VAL 204 CO 0.00 0.07 0.15 -0.75 0.00 0.00 0.00 175.10 174.57 1p1d s LYS 205 N 1.65 2.60 -0.31 2.72 2.20 -1.25 -2.17 119.74 125.17 1p1d s LYS 205 Ca 0.05 -1.27 -0.15 0.00 -0.36 0.00 0.00 55.97 54.25 1p1d s LYS 205 Cb -0.17 -3.55 -0.02 0.00 -1.51 0.00 0.00 37.83 32.57 1p1d s LYS 205 CO 0.07 -0.75 0.34 -0.51 -0.36 0.00 0.00 175.35 174.15 1p1d s LEU 206 N 1.40 4.28 -0.55 5.43 1.43 -0.96 -0.16 118.68 129.56 1p1d s LEU 206 Ca 0.00 -0.06 -0.17 0.00 -1.03 0.00 0.00 54.13 52.87 1p1d s LEU 206 Cb -0.20 -2.33 0.11 0.00 0.03 0.00 0.00 46.19 43.79 1p1d s LEU 206 CO 0.03 -0.26 0.56 -0.75 0.23 0.00 0.00 176.35 176.16 1p1d s LYS 207 N 2.00 3.02 0.56 1.70 2.20 -0.61 -1.26 119.74 127.34 1p1d s LYS 207 Ca 0.12 -1.47 0.05 0.00 -0.36 0.00 0.00 55.97 54.31 1p1d s LYS 207 Cb -0.16 -4.25 0.05 0.00 -1.51 0.00 0.00 37.83 31.95 1p1d s LYS 207 CO 0.11 -1.36 0.43 0.96 -0.36 0.00 0.00 175.35 175.14 1p1d s ILE 208 N 2.05 1.59 -0.11 5.43 -0.00 0.15 -0.33 121.20 129.98 1p1d s ILE 208 Ca 0.07 -1.47 -0.02 0.00 -0.00 0.00 0.00 60.65 59.23 1p1d s ILE 208 Cb -0.27 -2.06 -0.03 0.00 -0.00 0.00 0.00 42.46 40.10 1p1d s ILE 208 CO 0.05 0.00 -0.05 -0.13 -0.00 0.00 0.00 174.94 174.82 1p1d s ARG 209 N -4.32 3.21 0.14 0.37 0.52 0.46 -0.17 118.95 119.16 1p1d s ARG 209 Ca 0.34 -0.52 0.04 0.00 -0.52 0.00 0.00 55.73 55.07 1p1d s ARG 209 Cb -0.03 -2.77 -0.04 0.00 0.52 0.00 0.00 34.95 32.64 1p1d s ARG 209 CO 0.21 0.47 -0.10 -1.59 0.02 0.00 0.00 175.30 174.32 1p1d s LYS 210 N -0.27 1.01 0.00 3.54 0.00 -0.85 -3.98 119.74 119.20 1p1d s LYS 210 Ca 0.04 -1.42 0.00 0.00 0.00 0.00 0.00 55.97 54.59 1p1d s LYS 210 Cb -0.13 -0.55 0.00 0.00 0.00 0.00 0.00 37.83 37.16 1p1d s LYS 210 CO 0.02 0.06 0.00 -3.47 0.00 0.00 0.00 175.35 171.96 1p1d n ASP 211 N -0.15 -1.75 -4.61 0.03 -0.08 -1.26 -0.28 116.55 108.45 1p1d n ASP 211 Ca -0.11 0.00 -0.30 0.00 -1.51 0.00 0.00 54.79 52.87 1p1d n ASP 211 Cb 0.61 -0.88 0.20 0.00 2.34 0.00 0.00 41.12 43.39 1p1d n ASP 211 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1p1d s GLU 212 N -0.47 0.32 0.00 -0.67 2.02 -1.26 -4.76 118.70 113.89 1p1d s GLU 212 Ca 0.00 1.31 0.00 0.00 0.02 0.00 0.00 54.97 56.30 1p1d s GLU 212 Cb 0.00 -1.66 0.00 0.00 0.10 0.00 0.00 34.13 32.57 1p1d s GLU 212 CO 0.00 -3.03 0.46 -0.25 0.02 0.00 0.00 175.26 172.46