#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n6h n ASN 16 N 0.00 3.53 -4.75 1.61 0.23 -1.26 -4.78 115.26 109.84 1n6h n ASN 16 Ca 0.00 -2.26 -0.38 0.00 -0.53 0.00 0.00 54.58 51.41 1n6h n ASN 16 Cb 0.00 -0.38 -0.06 0.00 -2.08 0.00 0.00 39.78 37.27 1n6h n ASN 16 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 1n6h s LYS 17 N -1.47 4.31 -0.09 -3.83 2.20 -1.25 -4.97 119.74 114.64 1n6h s LYS 17 Ca 0.34 0.62 0.04 0.00 -0.36 0.00 0.00 55.97 56.61 1n6h s LYS 17 Cb 0.21 -3.38 0.00 0.00 -1.51 0.00 0.00 37.83 33.16 1n6h s LYS 17 CO 0.18 0.28 -0.21 0.96 -0.36 0.00 0.00 175.35 176.20 1n6h s ILE 18 N 0.14 1.84 0.10 5.43 -4.36 -1.26 0.51 121.20 123.60 1n6h s ILE 18 Ca 0.29 -0.90 0.08 0.00 -0.26 0.00 0.00 60.65 59.87 1n6h s ILE 18 Cb -0.17 -1.60 -0.03 0.00 1.25 0.00 0.00 42.46 41.91 1n6h s ILE 18 CO 0.15 0.51 -0.20 0.00 0.24 0.00 0.00 174.94 175.64 1n6h s GLN 20 N -1.93 0.47 0.07 0.00 0.74 -1.26 -0.31 119.66 117.43 1n6h s GLN 20 Ca 0.05 -0.33 -0.14 0.00 0.05 0.00 0.00 55.36 55.00 1n6h s GLN 20 Cb -0.10 -0.40 0.02 0.00 1.10 0.00 0.00 33.01 33.63 1n6h s GLN 20 CO 0.04 0.10 0.32 -0.59 -0.55 0.00 0.00 175.29 174.61 1n6h s PHE 21 N -0.42 -0.11 -0.19 1.67 -0.12 -0.73 -4.96 117.98 113.12 1n6h s PHE 21 Ca -0.01 -0.10 -0.13 0.00 -0.05 0.00 0.00 56.93 56.64 1n6h s PHE 21 Cb -0.04 0.12 -0.05 0.00 -0.63 0.00 0.00 43.02 42.43 1n6h s PHE 21 CO -0.00 -0.56 0.27 0.21 -0.05 0.00 0.00 175.22 175.09 1n6h s LYS 22 N -2.99 4.19 -0.01 1.99 2.20 -1.26 -1.50 119.74 122.36 1n6h s LYS 22 Ca -0.02 0.01 0.06 0.00 -0.36 0.00 0.00 55.97 55.66 1n6h s LYS 22 Cb 0.01 -3.47 -0.02 0.00 -1.51 0.00 0.00 37.83 32.84 1n6h s LYS 22 CO -0.06 0.14 -0.20 -1.17 -0.36 0.00 0.00 175.35 173.70 1n6h s LEU 23 N 0.77 2.04 0.00 5.43 0.20 0.27 -0.69 118.68 126.71 1n6h s LEU 23 Ca 0.14 -0.37 0.07 0.00 0.69 0.00 0.00 54.13 54.66 1n6h s LEU 23 Cb -0.13 -1.03 -0.02 0.00 -0.43 0.00 0.00 46.19 44.58 1n6h s LEU 23 CO 0.04 0.24 -0.20 0.54 -0.29 0.00 0.00 176.35 176.68 1n6h s VAL 24 N -0.48 1.62 -0.13 1.68 0.11 -0.64 -1.00 120.40 121.57 1n6h s VAL 24 Ca 0.08 -0.97 -0.02 0.00 -2.93 0.00 0.00 61.98 58.14 1n6h s VAL 24 Cb -0.08 -1.37 -0.03 0.00 -1.53 0.00 0.00 36.38 33.38 1n6h s VAL 24 CO -0.01 0.38 -0.05 -0.76 -3.33 0.00 0.00 175.10 171.33 1n6h s LEU 25 N -0.68 3.20 0.08 2.54 1.02 -0.10 -0.65 118.68 124.10 1n6h s LEU 25 Ca 0.08 -0.11 0.04 0.00 0.02 0.00 0.00 54.13 54.16 1n6h s LEU 25 Cb -0.08 -1.75 -0.03 0.00 0.02 0.00 0.00 46.19 44.35 1n6h s LEU 25 CO -0.00 0.21 -0.12 -0.76 0.02 0.00 0.00 176.35 175.70 1n6h s LEU 26 N 0.09 2.33 0.00 1.79 1.43 -0.50 -2.76 118.68 121.07 1n6h s LEU 26 Ca -0.01 -0.69 0.00 0.00 -1.03 0.00 0.00 54.13 52.39 1n6h s LEU 26 Cb -0.14 -0.40 0.00 0.00 0.03 0.00 0.00 46.19 45.68 1n6h s LEU 26 CO 0.03 -0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.06 1n6h n GLY 27 N 0.98 3.41 3.61 -3.19 0.00 -1.26 -0.57 105.19 108.16 1n6h n GLY 27 Ca -0.19 -1.03 -0.39 0.00 0.00 0.00 0.00 46.02 44.41 1n6h n GLY 27 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1n6h n GLU 28 N -1.22 1.10 -1.72 1.61 2.13 -1.26 -4.16 120.64 117.12 1n6h n GLU 28 Ca 0.00 0.41 -0.42 0.00 0.66 0.00 0.00 57.16 57.81 1n6h n GLU 28 Cb 0.00 -2.11 -0.00 0.00 0.27 0.00 0.00 31.44 29.60 1n6h n GLU 28 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1n6h n SER 29 N -0.16 3.03 0.00 4.31 2.88 -1.23 -2.74 113.62 119.70 1n6h n SER 29 Ca 0.11 1.21 0.00 0.00 -1.33 0.00 0.00 58.87 58.86 1n6h n SER 29 Cb 0.44 -1.52 0.00 0.00 -0.75 0.00 0.00 64.21 62.38 1n6h n SER 29 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1n6h n ALA 30 N 0.33 0.00 0.33 -1.46 0.00 -1.26 -4.92 120.51 113.53 1n6h n ALA 30 Ca 0.04 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.62 1n6h n ALA 30 Cb 0.37 0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.24 1n6h n ALA 30 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1n6h h VAL 31 N 0.00 0.00 0.00 0.00 -1.51 -1.88 -3.47 116.25 109.39 1n6h h VAL 31 Ca 0.00 -0.65 0.00 0.00 -1.23 0.00 0.00 66.70 64.82 1n6h h VAL 31 Cb 0.00 1.62 0.00 0.00 -2.13 0.00 0.00 31.29 30.78 1n6h h VAL 31 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.95 1n6h n GLY 32 N 0.63 1.67 0.20 5.19 0.00 -1.26 -4.60 105.19 107.02 1n6h n GLY 32 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 1n6h n GLY 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n6h h LYS 33 N 0.00 -0.29 -0.43 1.61 1.57 -1.91 0.88 116.57 118.01 1n6h h LYS 33 Ca 0.00 0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 1n6h h LYS 33 Cb 0.00 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1n6h h LYS 33 CO 0.00 -0.19 0.08 0.77 -0.57 0.00 0.00 179.45 179.53 1n6h h SER 34 N -0.30 0.61 -0.51 0.86 0.02 -1.95 -1.85 113.55 110.43 1n6h h SER 34 Ca 0.03 -0.10 -0.11 0.00 -0.84 0.00 0.00 61.79 60.76 1n6h h SER 34 Cb 0.32 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.69 1n6h h SER 34 CO -0.10 0.63 -0.10 0.28 -1.14 0.00 0.00 176.83 176.41 1n6h h SER 35 N 0.63 0.99 -0.36 3.07 0.02 -1.88 0.01 113.55 116.04 1n6h h SER 35 Ca 0.14 -0.32 -0.01 0.00 -0.84 0.00 0.00 61.79 60.76 1n6h h SER 35 Cb 0.29 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 1n6h h SER 35 CO 0.00 1.10 0.18 -0.07 -1.14 0.00 0.00 176.83 176.89 1n6h h LEU 36 N 0.89 0.47 -0.42 5.07 3.38 -0.32 -0.44 115.31 123.94 1n6h h LEU 36 Ca 0.14 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 1n6h h LEU 36 Cb 0.65 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1n6h h LEU 36 CO 0.05 0.46 -0.11 -0.37 0.09 0.00 0.00 178.44 178.56 1n6h h VAL 37 N 0.45 1.27 -0.97 1.22 -1.51 -1.21 -1.92 116.25 113.59 1n6h h VAL 37 Ca 0.12 -1.21 0.00 0.00 -1.23 0.00 0.00 66.70 64.38 1n6h h VAL 37 Cb 0.11 1.18 -0.05 0.00 -2.13 0.00 0.00 31.29 30.41 1n6h h VAL 37 CO -0.02 0.41 0.62 -0.07 -1.23 0.00 0.00 177.57 177.28 1n6h h LEU 38 N 0.64 1.13 -0.39 4.19 3.38 -0.85 0.17 115.31 123.58 1n6h h LEU 38 Ca 0.11 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1n6h h LEU 38 Cb 0.64 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1n6h h LEU 38 CO 0.04 0.84 0.14 -0.09 0.09 0.00 0.00 178.44 179.46 1n6h h ARG 39 N 1.32 0.60 -0.27 1.13 9.65 -0.70 0.58 114.38 126.68 1n6h h ARG 39 Ca 0.35 -0.12 -0.07 0.00 -1.10 0.00 0.00 59.98 59.04 1n6h h ARG 39 Cb -0.12 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.37 1n6h h ARG 39 CO -0.07 0.59 -0.11 0.35 2.80 0.00 0.00 179.97 183.53 1n6h h PHE 40 N 0.49 0.63 0.19 2.20 3.57 -0.93 -1.14 116.94 121.96 1n6h h PHE 40 Ca 0.13 -0.15 -0.29 0.00 3.53 0.00 0.00 57.97 61.19 1n6h h PHE 40 Cb 0.23 -0.15 0.02 0.00 2.79 0.00 0.00 35.95 38.85 1n6h h PHE 40 CO 0.01 0.79 -1.32 0.28 -2.23 0.00 0.00 178.31 175.84 1n6h h VAL 41 N 0.29 1.26 -0.01 1.41 2.07 -0.65 -3.40 116.25 117.22 1n6h h VAL 41 Ca 0.06 -2.57 0.00 0.00 0.82 0.00 0.00 66.70 65.01 1n6h h VAL 41 Cb 0.62 3.00 0.00 0.00 -1.52 0.00 0.00 31.29 33.39 1n6h h VAL 41 CO 0.04 0.77 -0.07 0.29 0.02 0.00 0.00 177.57 178.62 1n6h n LYS 42 N -3.85 1.30 -2.03 1.57 5.02 0.14 -4.99 118.16 115.31 1n6h n LYS 42 Ca -0.19 -0.63 -0.17 0.00 -2.02 0.00 0.00 58.31 55.31 1n6h n LYS 42 Cb 0.99 -1.02 -0.03 0.00 -0.02 0.00 0.00 35.03 34.95 1n6h n LYS 42 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n6h n GLY 43 N 0.55 0.35 3.58 0.72 0.00 -0.43 -4.97 105.19 104.99 1n6h n GLY 43 Ca 0.03 -0.20 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 1n6h n GLY 43 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n6h s GLN 44 N -4.35 2.03 -0.09 1.61 -0.21 -1.14 -4.93 119.66 112.57 1n6h s GLN 44 Ca 0.00 -1.63 -0.04 0.00 0.02 0.00 0.00 55.36 53.71 1n6h s GLN 44 Cb 0.00 -1.96 0.05 0.00 1.00 0.00 0.00 33.01 32.09 1n6h s GLN 44 CO 0.00 0.29 0.21 0.12 -2.12 0.00 0.00 175.29 173.78 1n6h s PHE 45 N -2.44 -0.27 -0.25 0.91 5.36 -1.26 -2.39 117.98 117.64 1n6h s PHE 45 Ca 0.32 0.69 -0.00 0.00 -0.96 0.00 0.00 56.93 56.97 1n6h s PHE 45 Cb -0.04 -0.03 0.04 0.00 -0.34 0.00 0.00 43.02 42.64 1n6h s PHE 45 CO 0.18 -0.23 -0.08 -1.01 -1.46 0.00 0.00 175.22 172.62 1n6h s HIS 46 N 1.44 3.09 0.57 10.12 3.76 -1.26 -4.97 115.29 128.05 1n6h s HIS 46 Ca -0.07 -1.77 0.26 0.00 -0.15 0.00 0.00 55.06 53.33 1n6h s HIS 46 Cb -0.11 -2.02 1.67 0.00 1.11 0.00 0.00 32.58 33.23 1n6h s HIS 46 CO -0.07 -0.78 2.22 1.49 -0.85 0.00 0.00 174.74 176.75 1n6h h GLU 47 N 7.95 0.00 -3.25 1.40 4.57 -2.02 -3.13 114.58 120.10 1n6h h GLU 47 Ca -0.30 0.00 -0.65 0.00 -1.18 0.00 0.00 59.36 57.23 1n6h h GLU 47 Cb 1.09 0.00 -0.40 0.00 -0.16 0.00 0.00 28.75 29.29 1n6h h GLU 47 CO 0.55 0.00 -0.46 -0.06 -1.18 0.00 0.00 179.01 177.87 1n6h s PHE 48 N -4.75 3.55 -0.18 0.92 0.40 -1.26 -5.03 117.98 111.62 1n6h s PHE 48 Ca -0.05 -3.17 -0.06 0.00 -0.60 0.00 0.00 56.93 53.05 1n6h s PHE 48 Cb 0.16 -2.91 -0.03 0.00 0.51 0.00 0.00 43.02 40.75 1n6h s PHE 48 CO 0.58 -0.66 0.03 -1.14 0.70 0.00 0.00 175.22 174.73 1n6h s GLN 49 N -1.04 3.83 0.40 0.44 2.00 -1.18 -5.09 119.66 119.00 1n6h s GLN 49 Ca 0.23 -0.42 -0.23 0.00 -2.00 0.00 0.00 55.36 52.93 1n6h s GLN 49 Cb -0.11 -3.13 -0.10 0.00 0.80 0.00 0.00 33.01 30.47 1n6h s GLN 49 CO -0.11 0.19 0.98 -2.00 -0.50 0.00 0.00 175.29 173.86 1n6h s GLU 50 N 0.55 4.27 0.35 1.67 2.12 -1.26 -5.00 118.70 121.41 1n6h s GLU 50 Ca 0.01 1.31 -0.29 0.00 0.36 0.00 0.00 54.97 56.36 1n6h s GLU 50 Cb -0.13 -2.45 -0.11 0.00 0.26 0.00 0.00 34.13 31.69 1n6h s GLU 50 CO 0.02 -0.01 1.49 0.45 -0.54 0.00 0.00 175.26 176.67 1n6h n SER 51 N -0.17 3.66 -4.77 -1.70 2.88 -1.26 -4.94 113.62 107.32 1n6h n SER 51 Ca 0.05 1.20 -0.38 0.00 -1.33 0.00 0.00 58.87 58.42 1n6h n SER 51 Cb 0.52 -1.59 -0.04 0.00 -0.75 0.00 0.00 64.21 62.34 1n6h n SER 51 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1n6h s THR 52 N -0.81 3.71 -0.37 2.46 2.01 -1.26 -5.03 115.64 116.35 1n6h s THR 52 Ca 0.57 1.47 -0.09 0.00 0.31 0.00 0.00 61.69 63.95 1n6h s THR 52 Cb -0.50 -3.84 0.04 0.00 0.01 0.00 0.00 72.50 68.21 1n6h s THR 52 CO 0.59 0.17 0.18 -0.63 -0.69 0.00 0.00 174.62 174.24 1n6h s ILE 53 N -1.46 4.21 0.00 1.82 1.01 -1.26 -4.68 121.20 120.84 1n6h s ILE 53 Ca 0.52 -1.06 0.00 0.00 0.00 0.00 0.00 60.65 60.11 1n6h s ILE 53 Cb -0.25 -3.40 0.00 0.00 0.01 0.00 0.00 42.46 38.82 1n6h s ILE 53 CO 0.32 -0.26 0.00 0.61 0.00 0.00 0.00 174.94 175.61 1n6h n GLY 54 N 4.91 2.08 3.55 6.18 0.00 -1.26 -4.77 105.19 115.88 1n6h n GLY 54 Ca -0.12 0.06 -0.07 0.00 0.00 0.00 0.00 46.02 45.90 1n6h n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n6h s ALA 55 N -1.00 -1.83 0.10 4.61 0.00 -1.26 -1.16 121.76 121.21 1n6h s ALA 55 Ca 0.00 0.94 0.06 0.00 0.00 0.00 0.00 51.96 52.96 1n6h s ALA 55 Cb 0.00 0.40 -0.03 0.00 0.00 0.00 0.00 23.12 23.48 1n6h s ALA 55 CO 0.00 -0.74 -0.15 0.00 0.00 0.00 0.00 175.76 174.88 1n6h s ALA 56 N -3.06 1.38 -0.06 0.00 0.00 -0.36 -4.96 121.76 114.69 1n6h s ALA 56 Ca 0.07 -1.16 0.06 0.00 0.00 0.00 0.00 51.96 50.92 1n6h s ALA 56 Cb -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.01 1n6h s ALA 56 CO -0.07 0.15 -0.24 0.12 0.00 0.00 0.00 175.76 175.72 1n6h s PHE 57 N -1.70 2.33 0.06 0.00 5.36 -1.26 -0.68 117.98 122.08 1n6h s PHE 57 Ca 0.04 -0.72 -0.06 0.00 -0.96 0.00 0.00 56.93 55.24 1n6h s PHE 57 Cb -0.07 -1.53 -0.01 0.00 -0.34 0.00 0.00 43.02 41.06 1n6h s PHE 57 CO 0.03 -0.23 0.10 -0.51 -1.46 0.00 0.00 175.22 173.15 1n6h s LEU 58 N -0.08 1.83 0.08 6.12 1.02 -0.46 -5.01 118.68 122.17 1n6h s LEU 58 Ca -0.05 -0.68 0.03 0.00 0.02 0.00 0.00 54.13 53.45 1n6h s LEU 58 Cb -0.14 0.66 -0.03 0.00 0.02 0.00 0.00 46.19 46.70 1n6h s LEU 58 CO 0.04 -0.60 -0.09 -0.89 0.02 0.00 0.00 176.35 174.82 1n6h s THR 59 N -3.32 0.80 -0.13 5.49 2.01 -1.26 -0.19 115.64 119.03 1n6h s THR 59 Ca 0.01 -1.46 -0.17 0.00 0.31 0.00 0.00 61.69 60.38 1n6h s THR 59 Cb 0.03 -1.12 0.04 0.00 0.01 0.00 0.00 72.50 71.46 1n6h s THR 59 CO -0.08 -0.50 0.45 -1.58 -0.69 0.00 0.00 174.62 172.22 1n6h s GLN 60 N -2.41 0.63 -0.09 4.92 2.00 -0.99 -4.92 119.66 118.79 1n6h s GLN 60 Ca 0.00 0.42 0.03 0.00 -2.00 0.00 0.00 55.36 53.82 1n6h s GLN 60 Cb -0.05 0.30 0.00 0.00 0.80 0.00 0.00 33.01 34.06 1n6h s GLN 60 CO -0.00 -0.12 -0.21 0.99 -0.50 0.00 0.00 175.29 175.45 1n6h s THR 61 N -0.26 1.81 0.32 -0.34 2.01 -1.26 0.07 115.64 118.00 1n6h s THR 61 Ca -0.04 -0.87 0.03 0.00 0.31 0.00 0.00 61.69 61.12 1n6h s THR 61 Cb -0.03 -1.58 -0.05 0.00 0.01 0.00 0.00 72.50 70.84 1n6h s THR 61 CO 0.02 0.50 0.08 0.68 -0.69 0.00 0.00 174.62 175.22 1n6h s VAL 62 N 0.45 0.90 -0.27 3.82 -7.23 0.08 -4.97 120.40 113.18 1n6h s VAL 62 Ca -0.17 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 57.91 1n6h s VAL 62 Cb -0.17 -2.67 -0.03 0.00 0.56 0.00 0.00 36.38 34.07 1n6h s VAL 62 CO 0.07 0.00 0.12 0.00 -0.31 0.00 0.00 175.10 174.98 1n6h s LEU 64 N 1.66 4.41 -0.08 0.00 2.96 0.18 -4.95 118.68 122.86 1n6h s LEU 64 Ca 0.06 -2.22 -0.07 0.00 -0.22 0.00 0.00 54.13 51.68 1n6h s LEU 64 Cb -0.16 -1.54 0.01 0.00 0.50 0.00 0.00 46.19 45.00 1n6h s LEU 64 CO 0.06 -0.36 0.12 -0.90 -1.32 0.00 0.00 176.35 173.95 1n6h n ASP 65 N 4.16 -1.18 0.00 3.68 5.75 -1.26 -0.41 116.55 127.29 1n6h n ASP 65 Ca 0.04 -0.02 0.00 0.00 -0.01 0.00 0.00 54.79 54.80 1n6h n ASP 65 Cb 0.41 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 1n6h n ASP 65 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1n6h n ASP 66 N 0.84 -1.23 -4.01 -1.12 3.85 -1.26 -5.02 116.55 108.60 1n6h n ASP 66 Ca -0.02 0.00 -0.19 0.00 -0.71 0.00 0.00 54.79 53.87 1n6h n ASP 66 Cb 0.14 -0.58 -0.15 0.00 -1.35 0.00 0.00 41.12 39.18 1n6h n ASP 66 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 1n6h s THR 67 N -2.94 0.72 -0.32 2.12 2.01 0.45 -3.89 115.64 113.80 1n6h s THR 67 Ca 0.00 -0.36 -0.19 0.00 0.31 0.00 0.00 61.69 61.45 1n6h s THR 67 Cb 0.00 -0.63 -0.01 0.00 0.01 0.00 0.00 72.50 71.87 1n6h s THR 67 CO 0.00 0.22 0.57 -0.89 -0.69 0.00 0.00 174.62 173.82 1n6h s THR 68 N 0.01 4.99 -0.20 -0.82 2.01 0.18 0.52 115.64 122.33 1n6h s THR 68 Ca 0.00 0.65 -0.04 0.00 0.31 0.00 0.00 61.69 62.61 1n6h s THR 68 Cb -0.06 -3.96 -0.02 0.00 0.01 0.00 0.00 72.50 68.47 1n6h s THR 68 CO 0.00 -0.14 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.07 1n6h s VAL 69 N 2.49 3.63 -0.23 3.82 1.01 -0.15 0.02 120.40 130.98 1n6h s VAL 69 Ca 0.22 -0.42 -0.08 0.00 0.00 0.00 0.00 61.98 61.70 1n6h s VAL 69 Cb -0.15 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 1n6h s VAL 69 CO 0.12 0.44 0.09 -0.75 0.00 0.00 0.00 175.10 175.00 1n6h s LYS 70 N 1.07 3.83 -0.19 2.72 2.20 0.57 -0.74 119.74 129.20 1n6h s LYS 70 Ca 0.01 -0.40 -0.14 0.00 -0.36 0.00 0.00 55.97 55.09 1n6h s LYS 70 Cb -0.15 -3.35 -0.05 0.00 -1.51 0.00 0.00 37.83 32.78 1n6h s LYS 70 CO 0.00 -0.02 0.29 -0.06 -0.36 0.00 0.00 175.35 175.21 1n6h s PHE 71 N 1.20 3.41 -0.33 4.03 0.08 0.11 -1.78 117.98 124.70 1n6h s PHE 71 Ca 0.05 0.53 -0.07 0.00 0.12 0.00 0.00 56.93 57.56 1n6h s PHE 71 Cb -0.14 -2.37 0.02 0.00 -0.57 0.00 0.00 43.02 39.96 1n6h s PHE 71 CO 0.04 0.15 0.11 -1.21 -0.10 0.00 0.00 175.22 174.21 1n6h s GLU 72 N 0.77 2.86 -0.20 0.44 2.02 -0.56 -2.36 118.70 121.68 1n6h s GLU 72 Ca 0.15 -1.02 -0.02 0.00 0.02 0.00 0.00 54.97 54.10 1n6h s GLU 72 Cb -0.13 -3.48 -0.00 0.00 0.10 0.00 0.00 34.13 30.62 1n6h s GLU 72 CO 0.05 -0.58 -0.09 0.42 0.02 0.00 0.00 175.26 175.08 1n6h s ILE 73 N 1.47 3.03 -0.36 -1.63 1.01 0.73 -0.56 121.20 124.89 1n6h s ILE 73 Ca 0.01 -0.62 -0.14 0.00 0.00 0.00 0.00 60.65 59.90 1n6h s ILE 73 Cb -0.18 -2.35 -0.01 0.00 0.01 0.00 0.00 42.46 39.93 1n6h s ILE 73 CO 0.03 0.46 0.31 0.26 0.00 0.00 0.00 174.94 176.00 1n6h s TRP 74 N 1.29 3.22 -0.62 3.97 0.52 -0.17 -1.35 118.94 125.80 1n6h s TRP 74 Ca 0.03 -0.21 -0.17 0.00 0.02 0.00 0.00 56.10 55.78 1n6h s TRP 74 Cb -0.14 -2.59 0.14 0.00 -1.15 0.00 0.00 33.47 29.72 1n6h s TRP 74 CO -0.04 -0.44 0.63 0.34 0.02 0.00 0.00 176.95 177.45 1n6h s ASP 75 N 1.73 6.30 0.51 2.95 2.15 0.14 -0.92 116.67 129.53 1n6h s ASP 75 Ca 0.08 -1.86 -0.18 0.00 0.43 0.00 0.00 52.55 51.03 1n6h s ASP 75 Cb -0.17 -2.24 -0.08 0.00 -0.30 0.00 0.00 42.92 40.13 1n6h s ASP 75 CO 0.11 -0.89 1.00 0.42 -0.17 0.00 0.00 175.17 175.64 1n6h s THR 76 N 1.69 4.25 -0.04 1.71 -4.23 -1.11 -1.22 115.64 116.69 1n6h s THR 76 Ca 0.09 1.19 -0.30 0.00 -1.18 0.00 0.00 61.69 61.49 1n6h s THR 76 Cb -0.24 -3.59 -0.03 0.00 1.34 0.00 0.00 72.50 69.98 1n6h s THR 76 CO 0.01 -0.51 1.04 0.00 -0.54 0.00 0.00 174.62 174.62 1n6h s ALA 77 N -2.40 3.31 -1.14 3.99 0.00 -0.31 -4.91 121.76 120.30 1n6h s ALA 77 Ca 0.62 0.51 0.27 0.00 0.00 0.00 0.00 51.96 53.36 1n6h s ALA 77 Cb -0.12 -3.41 0.86 0.00 0.00 0.00 0.00 23.12 20.46 1n6h s ALA 77 CO 0.27 -0.45 1.65 0.41 0.00 0.00 0.00 175.76 177.64 1n6h n GLY 78 N 3.05 -1.25 3.78 0.00 0.00 -1.26 -4.79 105.19 104.73 1n6h n GLY 78 Ca 0.08 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 1n6h n GLY 78 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n6h s GLN 79 N -2.89 4.04 0.48 1.61 -0.21 -1.26 -3.52 119.66 117.90 1n6h s GLN 79 Ca 0.15 2.58 0.25 0.00 0.02 0.00 0.00 55.36 58.37 1n6h s GLN 79 Cb 0.18 -2.92 1.30 0.00 1.00 0.00 0.00 33.01 32.57 1n6h s GLN 79 CO 0.60 -0.59 1.85 1.49 -2.12 0.00 0.00 175.29 176.52 1n6h h GLU 80 N 2.89 0.19 0.00 2.91 4.57 -1.97 -0.57 114.58 122.60 1n6h h GLU 80 Ca -0.51 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.66 1n6h h GLU 80 Cb 1.24 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.79 1n6h h GLU 80 CO 0.64 0.13 0.00 2.89 -1.18 0.00 0.00 179.01 181.48 1n6h n ARG 81 N -4.40 0.08 -0.11 1.92 1.85 -1.26 -1.18 116.66 113.56 1n6h n ARG 81 Ca 0.21 0.48 0.10 0.00 -1.00 0.00 0.00 57.85 57.64 1n6h n ARG 81 Cb 0.89 -1.71 0.15 0.00 -1.05 0.00 0.00 32.46 30.75 1n6h n ARG 81 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1n6h n TYR 82 N -1.87 0.28 -0.27 2.89 4.02 -0.22 -4.59 117.16 117.40 1n6h n TYR 82 Ca 0.01 -0.16 0.04 0.00 -0.01 0.00 0.00 57.90 57.78 1n6h n TYR 82 Cb 0.08 -0.00 0.18 0.00 -0.02 0.00 0.00 39.34 39.58 1n6h n TYR 82 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 1n6h h HIS 83 N 4.00 0.65 0.00 -0.72 2.76 -1.25 -1.23 115.15 119.37 1n6h h HIS 83 Ca 0.00 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 1n6h h HIS 83 Cb 0.89 -0.17 0.00 0.00 1.55 0.00 0.00 27.41 29.68 1n6h h HIS 83 CO 0.14 0.17 0.00 0.66 -1.30 0.00 0.00 177.93 177.60 1n6h h SER 84 N 0.57 0.00 0.89 3.26 4.64 -1.81 -1.73 113.55 119.37 1n6h h SER 84 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1n6h h SER 84 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1n6h h SER 84 CO -0.34 0.00 -0.66 -0.07 -0.87 0.00 0.00 176.83 174.89 1n6h h LEU 85 N 0.00 0.00 -0.73 5.97 3.38 -1.56 -3.40 115.31 118.96 1n6h h LEU 85 Ca 0.00 -0.19 0.16 0.00 0.09 0.00 0.00 57.88 57.94 1n6h h LEU 85 Cb 0.14 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.78 1n6h h LEU 85 CO 0.00 0.10 0.15 0.00 0.09 0.00 0.00 178.44 178.78 1n6h h ALA 86 N 2.45 0.93 -0.15 1.53 0.00 -1.34 -1.01 119.26 121.68 1n6h h ALA 86 Ca 0.00 0.18 0.04 0.00 0.00 0.00 0.00 54.91 55.13 1n6h h ALA 86 Cb 0.77 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1n6h h ALA 86 CO 0.00 -0.36 0.12 -1.35 0.00 0.00 0.00 179.25 177.67 1n6h h PRO 87 N 0.24 0.00 0.00 0.00 0.11 -1.80 0.58 132.00 131.13 1n6h h PRO 87 Ca 0.41 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.50 1n6h h PRO 87 Cb 0.71 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.82 1n6h h PRO 87 CO -0.53 0.00 -0.10 0.52 -0.21 0.00 0.00 178.00 177.68 1n6h h MET 88 N 0.00 0.00 0.00 1.05 2.86 -1.49 -0.15 114.93 117.21 1n6h h MET 88 Ca 0.07 0.00 -0.33 0.00 -2.06 0.00 0.00 59.70 57.38 1n6h h MET 88 Cb 0.32 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 31.92 1n6h h MET 88 CO -0.00 0.10 -2.01 0.66 1.06 0.00 0.00 176.91 176.72 1n6h n TYR 89 N -4.40 0.59 0.46 -0.22 4.02 0.07 -4.47 117.16 113.21 1n6h n TYR 89 Ca -0.03 0.21 0.11 0.00 -0.01 0.00 0.00 57.90 58.18 1n6h n TYR 89 Cb 0.18 -1.11 -0.05 0.00 -0.02 0.00 0.00 39.34 38.34 1n6h n TYR 89 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 176.86 178.33 1n6h n TYR 90 N -2.95 0.19 -0.18 -0.72 0.18 -0.46 -4.45 117.16 108.77 1n6h n TYR 90 Ca -0.25 0.06 -0.03 0.00 1.88 0.00 0.00 57.90 59.56 1n6h n TYR 90 Cb 1.09 -0.41 0.03 0.00 -0.38 0.00 0.00 39.34 39.68 1n6h n TYR 90 CO 0.00 0.00 0.00 -0.09 -2.08 0.00 0.00 176.86 174.69 1n6h h ARG 91 N 0.00 -0.09 -0.59 -3.48 2.43 -1.24 -1.63 114.38 109.79 1n6h h ARG 91 Ca 0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1n6h h ARG 91 Cb 0.78 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 1n6h h ARG 91 CO 0.00 -0.06 0.00 0.41 -1.51 0.00 0.00 179.97 178.81 1n6h n GLY 92 N -1.42 2.97 3.75 2.80 0.00 -1.26 -4.35 105.19 107.67 1n6h n GLY 92 Ca 0.05 -0.91 -0.40 0.00 0.00 0.00 0.00 46.02 44.76 1n6h n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n6h s ALA 93 N -2.48 3.37 -0.35 4.61 0.00 -0.61 -4.77 121.76 121.52 1n6h s ALA 93 Ca 0.53 0.76 0.23 0.00 0.00 0.00 0.00 51.96 53.48 1n6h s ALA 93 Cb 0.39 -3.28 0.08 0.00 0.00 0.00 0.00 23.12 20.31 1n6h s ALA 93 CO 0.19 -0.00 1.11 1.96 0.00 0.00 0.00 175.76 179.01 1n6h h GLN 94 N 4.18 0.00 -3.30 0.00 4.20 -1.24 -3.44 115.11 115.51 1n6h h GLN 94 Ca -0.46 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.18 1n6h h GLN 94 Cb 1.21 0.00 -0.16 0.00 0.30 0.00 0.00 27.48 28.83 1n6h h GLN 94 CO 0.68 0.00 -0.19 0.00 -0.67 0.00 0.00 178.83 178.65 1n6h s ALA 95 N -3.31 -0.77 0.03 3.87 0.00 -0.92 -1.53 121.76 119.13 1n6h s ALA 95 Ca 0.01 0.01 0.01 0.00 0.00 0.00 0.00 51.96 51.99 1n6h s ALA 95 Cb 0.11 0.42 -0.02 0.00 0.00 0.00 0.00 23.12 23.63 1n6h s ALA 95 CO 0.78 -0.48 -0.05 0.00 0.00 0.00 0.00 175.76 176.01 1n6h s ALA 96 N -2.93 0.29 -0.22 0.00 0.00 -0.03 -1.62 121.76 117.26 1n6h s ALA 96 Ca -0.02 -0.62 0.02 0.00 0.00 0.00 0.00 51.96 51.33 1n6h s ALA 96 Cb 0.00 0.10 0.04 0.00 0.00 0.00 0.00 23.12 23.26 1n6h s ALA 96 CO -0.06 -0.09 -0.15 0.42 0.00 0.00 0.00 175.76 175.88 1n6h s ILE 97 N -1.34 2.02 -0.23 0.00 1.01 0.17 -0.52 121.20 122.32 1n6h s ILE 97 Ca -0.13 -1.23 -0.16 0.00 0.00 0.00 0.00 60.65 59.13 1n6h s ILE 97 Cb -0.09 -2.00 -0.04 0.00 0.01 0.00 0.00 42.46 40.34 1n6h s ILE 97 CO -0.00 0.24 0.41 -0.69 0.00 0.00 0.00 174.94 174.90 1n6h s VAL 98 N 1.23 5.17 -0.10 2.92 1.01 -0.07 -1.41 120.40 129.16 1n6h s VAL 98 Ca -0.02 0.71 -0.01 0.00 0.00 0.00 0.00 61.98 62.66 1n6h s VAL 98 Cb -0.16 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 1n6h s VAL 98 CO -0.09 0.20 -0.06 -0.69 0.00 0.00 0.00 175.10 174.46 1n6h s VAL 99 N 1.65 3.77 0.36 2.92 1.01 0.26 -0.92 120.40 129.46 1n6h s VAL 99 Ca 0.19 -0.44 0.03 0.00 0.00 0.00 0.00 61.98 61.76 1n6h s VAL 99 Cb -0.15 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.61 1n6h s VAL 99 CO 0.09 0.57 0.09 -0.72 0.00 0.00 0.00 175.10 175.12 1n6h s TYR 100 N -0.46 1.86 -0.23 5.22 -0.85 -0.15 -4.13 117.35 118.61 1n6h s TYR 100 Ca 0.07 -1.11 -0.05 0.00 -0.52 0.00 0.00 57.07 55.46 1n6h s TYR 100 Cb -0.12 -1.22 -0.01 0.00 0.38 0.00 0.00 41.96 40.99 1n6h s TYR 100 CO 0.02 -0.14 -0.01 0.34 -1.52 0.00 0.00 175.55 174.25 1n6h s ASP 101 N -3.54 4.54 0.29 -0.18 3.68 -1.26 -0.70 116.67 119.50 1n6h s ASP 101 Ca 0.30 -0.36 0.19 0.00 2.13 0.00 0.00 52.55 54.81 1n6h s ASP 101 Cb 0.06 -1.79 1.06 0.00 -1.45 0.00 0.00 42.92 40.80 1n6h s ASP 101 CO 0.14 -0.03 1.60 2.30 0.13 0.00 0.00 175.17 179.31 1n6h n ILE 102 N 4.83 1.13 0.85 4.11 -5.35 -0.33 -1.01 119.36 123.60 1n6h n ILE 102 Ca -0.17 0.72 0.11 0.00 -0.27 0.00 0.00 62.75 63.13 1n6h n ILE 102 Cb 0.51 -1.72 0.30 0.00 -1.74 0.00 0.00 39.64 36.99 1n6h n ILE 102 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1n6h n THR 103 N -2.18 0.32 -3.59 7.28 -2.24 -1.26 -0.32 114.28 112.28 1n6h n THR 103 Ca -0.01 -0.51 -0.29 0.00 -2.27 0.00 0.00 64.05 60.97 1n6h n THR 103 Cb 0.03 0.67 -0.15 0.00 -2.10 0.00 0.00 70.33 68.78 1n6h n THR 103 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1n6h s ASN 104 N -1.56 3.44 0.33 3.42 3.84 -0.18 -4.43 114.94 119.80 1n6h s ASN 104 Ca 0.35 -1.24 0.01 0.00 0.21 0.00 0.00 52.86 52.19 1n6h s ASN 104 Cb 0.20 -0.44 0.56 0.00 -0.55 0.00 0.00 41.25 41.01 1n6h s ASN 104 CO 0.29 -0.42 1.96 -0.08 -2.79 0.00 0.00 177.10 176.05 1n6h h GLU 105 N 8.34 0.85 -0.47 0.43 4.81 -1.83 -1.99 114.58 124.72 1n6h h GLU 105 Ca -0.18 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 58.96 1n6h h GLU 105 Cb 1.04 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.22 1n6h h GLU 105 CO 0.42 0.62 0.26 1.49 -0.73 0.00 0.00 179.01 181.07 1n6h h GLU 106 N 0.86 0.64 -0.01 1.92 4.22 -1.95 -0.63 114.58 119.62 1n6h h GLU 106 Ca 0.22 -0.06 -0.09 0.00 0.08 0.00 0.00 59.36 59.51 1n6h h GLU 106 Cb 0.01 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1n6h h GLU 106 CO -0.04 0.46 -0.41 0.66 -2.18 0.00 0.00 179.01 177.51 1n6h h SER 107 N 0.65 0.03 -0.21 1.04 4.64 -1.69 -0.54 113.55 117.47 1n6h h SER 107 Ca 0.17 -0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.38 1n6h h SER 107 Cb 0.01 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1n6h h SER 107 CO -0.03 0.44 -0.25 0.15 -0.87 0.00 0.00 176.83 176.27 1n6h h PHE 108 N 0.02 0.65 -0.87 4.77 3.57 -1.03 -1.02 116.94 123.04 1n6h h PHE 108 Ca -0.00 -0.21 -0.02 0.00 3.53 0.00 0.00 57.97 61.27 1n6h h PHE 108 Cb 0.74 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.30 1n6h h PHE 108 CO 0.00 0.90 0.47 0.00 -2.23 0.00 0.00 178.31 177.46 1n6h h ALA 109 N 0.64 1.11 -0.75 2.41 0.00 -0.87 -1.90 119.26 119.91 1n6h h ALA 109 Ca 0.03 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1n6h h ALA 109 Cb 0.81 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1n6h h ALA 109 CO 0.06 0.63 0.30 -0.09 0.00 0.00 0.00 179.25 180.15 1n6h h ARG 110 N 1.22 1.10 -0.88 0.00 9.65 -0.94 -2.16 114.38 122.37 1n6h h ARG 110 Ca 0.31 -0.19 0.00 0.00 -1.10 0.00 0.00 59.98 59.00 1n6h h ARG 110 Cb 0.04 -0.18 -0.04 0.00 -1.39 0.00 0.00 29.97 28.39 1n6h h ARG 110 CO -0.05 0.89 0.55 0.00 2.80 0.00 0.00 179.97 184.16 1n6h h ALA 111 N 1.25 1.32 -0.34 2.80 0.00 -0.45 -1.52 119.26 122.31 1n6h h ALA 111 Ca 0.25 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1n6h h ALA 111 Cb 0.19 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1n6h h ALA 111 CO -0.02 0.60 0.01 0.87 0.00 0.00 0.00 179.25 180.71 1n6h h LYS 112 N 1.20 0.53 -0.05 0.00 1.57 -0.74 -0.36 116.57 118.73 1n6h h LYS 112 Ca 0.32 -0.11 -0.15 0.00 -1.87 0.00 0.00 60.65 58.84 1n6h h LYS 112 Cb -0.09 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 1n6h h LYS 112 CO -0.06 0.55 -0.63 -0.91 -0.57 0.00 0.00 179.45 177.83 1n6h h ASN 113 N 0.51 0.21 -0.52 0.86 2.35 -0.95 -1.24 115.58 116.80 1n6h h ASN 113 Ca 0.11 -0.12 -0.08 0.00 -0.55 0.00 0.00 56.30 55.65 1n6h h ASN 113 Cb 0.32 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.61 1n6h h ASN 113 CO 0.01 0.78 -0.01 -0.50 -1.65 0.00 0.00 177.43 176.06 1n6h h TRP 114 N 0.13 1.00 -0.57 1.19 4.06 -0.44 -1.22 115.95 120.11 1n6h h TRP 114 Ca -0.01 -0.18 0.00 0.00 2.06 0.00 0.00 58.89 60.77 1n6h h TRP 114 Cb 1.13 -0.26 -0.03 0.00 -1.00 0.00 0.00 29.16 29.00 1n6h h TRP 114 CO 0.02 0.93 0.36 0.28 -3.56 0.00 0.00 178.44 176.47 1n6h h VAL 115 N 0.79 1.16 -0.56 1.49 2.07 -0.83 -0.58 116.25 119.78 1n6h h VAL 115 Ca 0.15 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.35 1n6h h VAL 115 Cb 0.54 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 1n6h h VAL 115 CO 0.03 0.16 0.36 0.11 0.02 0.00 0.00 177.57 178.25 1n6h h LYS 116 N 0.77 0.75 -0.76 1.57 1.57 -1.04 -0.09 116.57 119.34 1n6h h LYS 116 Ca 0.21 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.92 1n6h h LYS 116 Cb -0.06 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.05 1n6h h LYS 116 CO -0.04 0.51 0.41 1.49 -0.57 0.00 0.00 179.45 181.24 1n6h h GLU 117 N 0.76 1.07 -0.49 3.15 4.81 -0.74 -1.46 114.58 121.68 1n6h h GLU 117 Ca 0.21 -0.13 -0.06 0.00 -0.13 0.00 0.00 59.36 59.24 1n6h h GLU 117 Cb -0.07 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.09 1n6h h GLU 117 CO -0.04 0.80 0.07 -0.07 -0.73 0.00 0.00 179.01 179.04 1n6h h LEU 118 N 1.06 0.78 -1.73 1.64 3.38 -0.72 0.17 115.31 119.89 1n6h h LEU 118 Ca 0.27 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1n6h h LEU 118 Cb 0.05 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 1n6h h LEU 118 CO -0.04 0.85 -0.15 1.56 0.09 0.00 0.00 178.44 180.75 1n6h h GLN 119 N 0.68 0.00 0.00 1.13 4.20 -0.65 -0.84 115.11 119.63 1n6h h GLN 119 Ca 0.15 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.57 1n6h h GLN 119 Cb 0.41 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.14 1n6h h GLN 119 CO 0.01 0.15 -1.95 0.54 -0.67 0.00 0.00 178.83 176.91 1n6h n ARG 120 N -4.29 0.65 -0.00 1.46 1.74 -0.58 -4.70 116.66 110.94 1n6h n ARG 120 Ca -0.02 0.14 0.01 0.00 -0.77 0.00 0.00 57.85 57.21 1n6h n ARG 120 Cb 0.22 -1.68 -0.01 0.00 -1.02 0.00 0.00 32.46 29.97 1n6h n ARG 120 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1n6h n GLN 121 N -2.87 3.80 -1.57 5.56 6.02 0.58 -5.06 117.38 123.86 1n6h n GLN 121 Ca -0.21 -0.01 -0.12 0.00 -0.01 0.00 0.00 57.00 56.65 1n6h n GLN 121 Cb 1.04 -0.77 0.06 0.00 1.02 0.00 0.00 30.24 31.59 1n6h n GLN 121 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1n6h n ALA 122 N -1.25 0.07 -1.75 -1.58 0.00 -0.33 -4.94 120.51 110.73 1n6h n ALA 122 Ca 0.00 -0.97 -0.42 0.00 0.00 0.00 0.00 53.44 52.05 1n6h n ALA 122 Cb 0.03 0.15 -0.01 0.00 0.00 0.00 0.00 19.45 19.63 1n6h n ALA 122 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1n6h n SER 123 N -2.97 3.72 0.21 0.00 7.64 -1.26 -4.85 113.62 116.11 1n6h n SER 123 Ca 0.08 1.18 0.15 0.00 1.01 0.00 0.00 58.87 61.30 1n6h n SER 123 Cb 0.29 -1.59 0.74 0.00 -1.01 0.00 0.00 64.21 62.64 1n6h n SER 123 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1n6h h PRO 124 N 3.85 0.00 -0.58 1.43 0.13 -1.92 -2.19 132.00 132.73 1n6h h PRO 124 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1n6h h PRO 124 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1n6h h PRO 124 CO 0.72 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.58 1n6h n ASN 125 N -2.56 3.59 -4.77 1.44 5.03 -1.26 -5.01 115.26 111.72 1n6h n ASN 125 Ca -0.01 -1.99 -0.40 0.00 0.87 0.00 0.00 54.58 53.05 1n6h n ASN 125 Cb 0.12 -0.38 0.00 0.00 -1.02 0.00 0.00 39.78 38.50 1n6h n ASN 125 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 1n6h s ILE 126 N -1.05 2.21 -0.25 2.41 2.07 -0.83 -4.98 121.20 120.78 1n6h s ILE 126 Ca 0.40 0.19 -0.15 0.00 -1.41 0.00 0.00 60.65 59.69 1n6h s ILE 126 Cb 0.21 -3.12 -0.04 0.00 0.13 0.00 0.00 42.46 39.65 1n6h s ILE 126 CO 0.28 0.03 0.36 -0.69 -1.91 0.00 0.00 174.94 173.02 1n6h s VAL 127 N -1.18 5.20 -0.20 4.00 1.01 -0.58 -4.98 120.40 123.67 1n6h s VAL 127 Ca 0.57 0.58 -0.04 0.00 0.00 0.00 0.00 61.98 63.09 1n6h s VAL 127 Cb -0.43 -3.69 -0.02 0.00 0.00 0.00 0.00 36.38 32.24 1n6h s VAL 127 CO 0.57 0.20 -0.04 -0.63 0.00 0.00 0.00 175.10 175.20 1n6h s ILE 128 N 1.74 3.54 0.16 2.22 1.01 -1.26 -0.85 121.20 127.76 1n6h s ILE 128 Ca 0.16 -0.45 0.06 0.00 0.00 0.00 0.00 60.65 60.41 1n6h s ILE 128 Cb -0.15 -2.59 -0.04 0.00 0.01 0.00 0.00 42.46 39.69 1n6h s ILE 128 CO 0.09 0.44 0.08 0.00 0.00 0.00 0.00 174.94 175.55 1n6h s ALA 129 N 1.13 3.43 -0.13 9.38 0.00 0.32 -1.43 121.76 134.46 1n6h s ALA 129 Ca 0.02 -1.25 0.01 0.00 0.00 0.00 0.00 51.96 50.73 1n6h s ALA 129 Cb -0.15 -1.23 0.02 0.00 0.00 0.00 0.00 23.12 21.76 1n6h s ALA 129 CO -0.00 0.52 -0.13 -1.17 0.00 0.00 0.00 175.76 174.97 1n6h s LEU 130 N -2.98 1.58 -0.23 0.00 2.96 0.69 -0.89 118.68 119.81 1n6h s LEU 130 Ca 0.29 -0.43 -0.06 0.00 -0.22 0.00 0.00 54.13 53.72 1n6h s LEU 130 Cb -0.10 -1.07 -0.02 0.00 0.50 0.00 0.00 46.19 45.49 1n6h s LEU 130 CO 0.21 -0.05 0.04 -0.55 -1.32 0.00 0.00 176.35 174.68 1n6h s SER 131 N 1.38 4.95 -0.86 3.68 0.15 -0.09 -1.93 113.70 120.98 1n6h s SER 131 Ca 0.01 -0.22 -0.16 0.00 0.70 0.00 0.00 55.95 56.28 1n6h s SER 131 Cb -0.13 -1.87 0.18 0.00 -1.71 0.00 0.00 66.02 62.48 1n6h s SER 131 CO -0.07 -0.00 0.92 -0.83 1.20 0.00 0.00 173.24 174.45 1n6h s GLY 132 N 1.40 2.30 0.70 9.45 0.00 -0.62 -0.97 107.32 119.58 1n6h s GLY 132 Ca 0.05 -3.03 -0.06 0.00 0.00 0.00 0.00 44.72 41.68 1n6h s GLY 132 CO 0.02 1.60 1.00 0.21 0.00 0.00 0.00 173.10 175.93 1n6h s ASN 133 N 2.87 4.86 -1.17 1.64 2.47 0.12 -0.76 114.94 124.98 1n6h s ASN 133 Ca 0.24 0.45 -0.03 0.00 0.42 0.00 0.00 52.86 53.94 1n6h s ASN 133 Cb -0.09 -1.13 0.00 0.00 -1.45 0.00 0.00 41.25 38.59 1n6h s ASN 133 CO -0.08 -1.56 0.43 0.29 -3.72 0.00 0.00 177.10 172.46 1n6h n LYS 134 N -2.89 -3.53 0.20 0.43 5.02 -0.76 -1.19 118.16 115.43 1n6h n LYS 134 Ca 0.08 0.68 0.14 0.00 -2.02 0.00 0.00 58.31 57.19 1n6h n LYS 134 Cb 0.60 -5.06 0.70 0.00 -0.02 0.00 0.00 35.03 31.26 1n6h n LYS 134 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n6h h ALA 135 N 0.74 1.00 0.00 7.82 0.00 -1.33 -0.06 119.26 127.43 1n6h h ALA 135 Ca -0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1n6h h ALA 135 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1n6h h ALA 135 CO 0.42 0.00 0.00 0.38 0.00 0.00 0.00 179.25 180.05 1n6h h ASP 136 N 0.00 0.00 -1.00 0.00 2.03 -1.90 -2.72 116.42 112.83 1n6h h ASP 136 Ca 0.00 0.00 -0.60 0.00 -0.73 0.00 0.00 57.03 55.70 1n6h h ASP 136 Cb 0.14 0.00 -0.30 0.00 -0.83 0.00 0.00 39.33 38.34 1n6h h ASP 136 CO 0.00 0.00 0.77 0.18 -1.03 0.00 0.00 179.24 179.16 1n6h n LEU 137 N -2.34 7.22 0.27 0.15 4.77 -0.04 -4.66 117.00 122.37 1n6h n LEU 137 Ca 0.01 -3.94 0.18 0.00 -0.03 0.00 0.00 56.01 52.23 1n6h n LEU 137 Cb 0.22 -0.91 0.94 0.00 -2.33 0.00 0.00 43.42 41.34 1n6h n LEU 137 CO 0.19 1.26 1.04 0.00 -1.33 0.00 0.00 177.39 178.55 1n6h h ALA 138 N 1.49 1.00 0.00 -1.18 0.00 -1.67 -0.30 119.26 118.61 1n6h h ALA 138 Ca 0.62 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.53 1n6h h ALA 138 Cb 1.85 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.64 1n6h h ALA 138 CO 1.35 0.00 0.00 0.27 0.00 0.00 0.00 179.25 180.87 1n6h n ASN 139 N -2.76 0.00 -0.52 0.00 6.94 -1.26 -1.89 115.26 115.76 1n6h n ASN 139 Ca -0.02 0.23 0.06 0.00 -0.02 0.00 0.00 54.58 54.83 1n6h n ASN 139 Cb 0.08 -0.37 0.12 0.00 -2.36 0.00 0.00 39.78 37.25 1n6h n ASN 139 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1n6h n LYS 140 N -1.37 0.97 -1.66 -3.83 5.02 -0.13 -5.09 118.16 112.07 1n6h n LYS 140 Ca 0.06 -2.45 -0.44 0.00 -2.02 0.00 0.00 58.31 53.46 1n6h n LYS 140 Cb 0.14 -1.14 -0.02 0.00 -0.02 0.00 0.00 35.03 33.99 1n6h n LYS 140 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1n6h n ARG 141 N -0.80 1.91 0.00 1.97 0.63 -0.79 -4.42 116.66 115.16 1n6h n ARG 141 Ca 0.13 0.67 0.00 0.00 -0.92 0.00 0.00 57.85 57.73 1n6h n ARG 141 Cb 0.74 -2.24 0.00 0.00 0.45 0.00 0.00 32.46 31.41 1n6h n ARG 141 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1n6h n ALA 142 N 0.93 1.62 -4.08 5.13 0.00 0.57 -4.93 120.51 119.75 1n6h n ALA 142 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.20 1n6h n ALA 142 Cb 0.33 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.63 1n6h n ALA 142 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1n6h s VAL 143 N -1.25 2.07 0.20 0.00 1.01 -0.74 -4.68 120.40 117.01 1n6h s VAL 143 Ca 0.00 -1.27 -0.32 0.00 0.00 0.00 0.00 61.98 60.39 1n6h s VAL 143 Cb 0.00 -2.04 -0.11 0.00 0.00 0.00 0.00 36.38 34.23 1n6h s VAL 143 CO 0.00 0.24 1.65 -0.62 0.00 0.00 0.00 175.10 176.36 1n6h s ASP 144 N 1.21 6.46 0.13 3.32 -1.08 -1.26 -4.93 116.67 120.52 1n6h s ASP 144 Ca -0.02 2.78 -0.22 0.00 -0.52 0.00 0.00 52.55 54.57 1n6h s ASP 144 Cb -0.17 -2.60 -0.04 0.00 -1.46 0.00 0.00 42.92 38.66 1n6h s ASP 144 CO -0.09 -0.91 1.68 0.15 0.52 0.00 0.00 175.17 176.53 1n6h h PHE 145 N 6.57 -0.27 -0.67 -5.34 3.57 -1.99 -1.88 116.94 116.93 1n6h h PHE 145 Ca -0.43 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.07 1n6h h PHE 145 Cb 1.20 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 40.05 1n6h h PHE 145 CO 0.64 -0.16 0.36 1.96 -2.23 0.00 0.00 178.31 178.87 1n6h h GLN 146 N -0.13 0.92 -0.53 1.11 1.08 -1.99 0.92 115.11 116.50 1n6h h GLN 146 Ca 0.08 -0.10 -0.03 0.00 -1.45 0.00 0.00 58.65 57.15 1n6h h GLN 146 Cb 0.25 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.47 1n6h h GLN 146 CO -0.20 0.69 0.21 1.49 -0.95 0.00 0.00 178.83 180.07 1n6h h GLU 147 N 0.93 0.80 -0.50 1.46 4.81 -1.87 -0.26 114.58 119.96 1n6h h GLU 147 Ca 0.24 -0.15 -0.13 0.00 -0.13 0.00 0.00 59.36 59.19 1n6h h GLU 147 Cb 0.04 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 1n6h h GLU 147 CO -0.04 0.70 -0.19 0.00 -0.73 0.00 0.00 179.01 178.75 1n6h h ALA 148 N 1.06 0.71 -0.74 2.92 0.00 -0.79 -1.38 119.26 121.03 1n6h h ALA 148 Ca 0.18 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1n6h h ALA 148 Cb 0.20 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1n6h h ALA 148 CO -0.01 0.68 0.44 0.37 0.00 0.00 0.00 179.25 180.72 1n6h h GLN 149 N 0.87 1.01 -0.47 0.00 5.75 -0.59 0.17 115.11 121.86 1n6h h GLN 149 Ca 0.12 -0.10 -0.05 0.00 -0.15 0.00 0.00 58.65 58.47 1n6h h GLN 149 Cb 0.77 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 29.10 1n6h h GLN 149 CO 0.06 0.72 0.09 0.77 -2.65 0.00 0.00 178.83 177.83 1n6h h SER 150 N 1.02 0.74 -0.49 -0.69 0.02 -0.84 0.63 113.55 113.94 1n6h h SER 150 Ca 0.27 -0.25 0.01 0.00 -0.84 0.00 0.00 61.79 60.98 1n6h h SER 150 Cb -0.02 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.30 1n6h h SER 150 CO -0.05 0.79 0.32 0.22 -1.14 0.00 0.00 176.83 176.97 1n6h h TYR 151 N 0.65 0.60 -0.41 3.45 3.20 -0.93 -0.16 116.97 123.35 1n6h h TYR 151 Ca 0.15 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.00 1n6h h TYR 151 Cb 0.36 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 1n6h h TYR 151 CO 0.02 0.37 0.13 0.00 -1.64 0.00 0.00 178.16 177.05 1n6h h ALA 152 N 1.19 0.54 -0.48 1.82 0.00 -0.67 -2.06 119.26 119.59 1n6h h ALA 152 Ca 0.18 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1n6h h ALA 152 Cb -0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1n6h h ALA 152 CO -0.05 0.18 0.30 -0.44 0.00 0.00 0.00 179.25 179.24 1n6h h ASP 153 N 0.52 0.57 0.47 0.00 3.32 -0.62 0.04 116.42 120.72 1n6h h ASP 153 Ca 0.13 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1n6h h ASP 153 Cb 0.25 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.66 1n6h h ASP 153 CO -0.00 0.44 -0.11 0.44 -1.72 0.00 0.00 179.24 178.29 1n6h h ASP 154 N 0.64 0.00 -0.37 6.45 3.32 -0.88 -2.87 116.42 122.71 1n6h h ASP 154 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1n6h h ASP 154 Cb -0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.52 1n6h h ASP 154 CO -0.03 0.11 0.00 0.59 -1.72 0.00 0.00 179.24 178.18 1n6h n ASN 155 N -3.49 3.72 -3.69 6.45 4.13 -0.79 -4.99 115.26 116.59 1n6h n ASN 155 Ca -0.01 -2.54 -0.21 0.00 1.68 0.00 0.00 54.58 53.50 1n6h n ASN 155 Cb 0.25 -0.44 0.04 0.00 -1.54 0.00 0.00 39.78 38.09 1n6h n ASN 155 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1n6h n SER 156 N 0.18 -1.32 -4.46 6.41 7.64 -0.42 -5.00 113.62 116.64 1n6h n SER 156 Ca 0.19 -0.81 -0.32 0.00 1.01 0.00 0.00 58.87 58.94 1n6h n SER 156 Cb 0.72 -4.12 -0.13 0.00 -1.01 0.00 0.00 64.21 59.68 1n6h n SER 156 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1n6h s LEU 157 N -6.68 2.66 -0.58 -3.43 1.43 -0.13 -4.69 118.68 107.25 1n6h s LEU 157 Ca 0.02 -0.32 -0.25 0.00 -1.03 0.00 0.00 54.13 52.55 1n6h s LEU 157 Cb -0.01 -1.54 0.04 0.00 0.03 0.00 0.00 46.19 44.70 1n6h s LEU 157 CO 0.81 0.30 1.03 -0.22 0.23 0.00 0.00 176.35 178.50 1n6h s LEU 158 N -1.12 3.89 -0.13 1.79 0.20 -0.51 -4.45 118.68 118.35 1n6h s LEU 158 Ca 0.13 -0.29 -0.05 0.00 0.69 0.00 0.00 54.13 54.61 1n6h s LEU 158 Cb -0.11 -2.86 -0.04 0.00 -0.43 0.00 0.00 46.19 42.75 1n6h s LEU 158 CO 0.03 -1.35 0.05 0.12 -0.29 0.00 0.00 176.35 174.91 1n6h s PHE 159 N 4.35 3.29 -0.12 5.38 5.36 -1.26 -0.22 117.98 134.75 1n6h s PHE 159 Ca 0.33 0.21 -0.15 0.00 -0.96 0.00 0.00 56.93 56.36 1n6h s PHE 159 Cb -0.11 -1.93 0.04 0.00 -0.34 0.00 0.00 43.02 40.68 1n6h s PHE 159 CO 0.20 0.41 0.39 -1.64 -1.46 0.00 0.00 175.22 173.12 1n6h s MET 160 N -0.45 0.53 0.17 10.12 -1.94 -0.81 -4.97 119.30 121.95 1n6h s MET 160 Ca 0.09 0.39 -0.23 0.00 -1.71 0.00 0.00 55.69 54.23 1n6h s MET 160 Cb -0.12 0.25 -0.08 0.00 2.01 0.00 0.00 34.83 36.89 1n6h s MET 160 CO 0.02 -0.09 0.74 -1.21 -0.01 0.00 0.00 175.02 174.47 1n6h s GLU 161 N -0.17 4.45 0.18 2.03 2.02 -1.26 -1.58 118.70 124.36 1n6h s GLU 161 Ca -0.03 1.04 0.01 0.00 0.02 0.00 0.00 54.97 56.01 1n6h s GLU 161 Cb -0.03 -3.16 -0.05 0.00 0.10 0.00 0.00 34.13 30.99 1n6h s GLU 161 CO 0.02 0.53 0.02 0.95 0.02 0.00 0.00 175.26 176.80 1n6h s THR 162 N -1.24 0.60 -0.21 3.63 -4.23 0.06 -4.65 115.64 109.60 1n6h s THR 162 Ca 0.37 -1.97 -0.04 0.00 -1.18 0.00 0.00 61.69 58.86 1n6h s THR 162 Cb -0.21 -2.16 0.08 0.00 1.34 0.00 0.00 72.50 71.55 1n6h s THR 162 CO 0.24 -0.43 0.14 -0.55 -0.54 0.00 0.00 174.62 173.48 1n6h s SER 163 N -3.17 2.31 0.39 3.99 0.15 -0.41 -1.19 113.70 115.76 1n6h s SER 163 Ca 0.25 -0.65 0.12 0.00 0.70 0.00 0.00 55.95 56.37 1n6h s SER 163 Cb 0.06 -0.08 0.79 0.00 -1.71 0.00 0.00 66.02 65.08 1n6h s SER 163 CO 0.05 -0.36 1.88 0.00 1.20 0.00 0.00 173.24 176.00 1n6h h ALA 164 N 8.39 1.48 -0.47 5.45 0.00 -1.89 0.26 119.26 132.46 1n6h h ALA 164 Ca -0.16 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 1n6h h ALA 164 Cb 1.12 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1n6h h ALA 164 CO 0.32 0.38 0.03 -0.22 0.00 0.00 0.00 179.25 179.77 1n6h h LYS 165 N 0.06 0.81 0.00 0.00 3.64 -1.94 -3.29 116.57 115.86 1n6h h LYS 165 Ca 0.01 -0.24 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1n6h h LYS 165 Cb 0.52 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1n6h h LYS 165 CO 0.04 0.84 -1.62 0.25 -2.27 0.00 0.00 179.45 176.69 1n6h n THR 166 N -4.39 0.03 -0.23 1.00 -2.24 -1.14 -4.97 114.28 102.35 1n6h n THR 166 Ca 0.01 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 1n6h n THR 166 Cb 0.28 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 1n6h n THR 166 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1n6h n SER 167 N -2.05 0.00 -4.68 3.42 3.41 0.87 -5.04 113.62 109.56 1n6h n SER 167 Ca -0.01 0.00 -0.52 0.00 -0.26 0.00 0.00 58.87 58.07 1n6h n SER 167 Cb 0.49 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.39 1n6h n SER 167 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 1n6h n MET 168 N -2.00 1.65 -1.10 4.33 0.00 -1.03 -1.74 117.12 117.24 1n6h n MET 168 Ca 0.00 0.61 -0.05 0.00 0.00 0.00 0.00 57.70 58.26 1n6h n MET 168 Cb 0.00 -2.36 -0.02 0.00 0.00 0.00 0.00 33.22 30.84 1n6h n MET 168 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1n6h n ASN 169 N 5.44 -5.59 0.14 6.12 3.02 -1.26 -1.29 115.26 121.84 1n6h n ASN 169 Ca 0.23 0.12 -0.12 0.00 -0.03 0.00 0.00 54.58 54.78 1n6h n ASN 169 Cb 0.22 -3.65 -0.07 0.00 -0.61 0.00 0.00 39.78 35.66 1n6h n ASN 169 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1n6h h VAL 170 N 0.00 0.61 -0.47 2.41 2.07 -1.64 -0.97 116.25 118.25 1n6h h VAL 170 Ca -0.10 -0.78 -0.05 0.00 0.82 0.00 0.00 66.70 66.60 1n6h h VAL 170 Cb 1.03 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 1n6h h VAL 170 CO 0.14 0.13 0.10 -1.13 0.02 0.00 0.00 177.57 176.83 1n6h h ASN 171 N -0.88 0.67 -0.67 0.57 -1.24 -1.90 -2.99 115.58 109.13 1n6h h ASN 171 Ca -0.04 -0.11 0.01 0.00 0.71 0.00 0.00 56.30 56.87 1n6h h ASN 171 Cb 0.52 -0.17 -0.03 0.00 0.73 0.00 0.00 38.32 39.36 1n6h h ASN 171 CO 0.07 0.67 0.44 -0.33 -1.29 0.00 0.00 177.43 176.99 1n6h h GLU 172 N 0.69 0.88 -0.43 6.67 3.07 -1.90 -0.01 114.58 123.55 1n6h h GLU 172 Ca 0.16 -0.05 -0.13 0.00 -0.50 0.00 0.00 59.36 58.83 1n6h h GLU 172 Cb 0.28 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 27.98 1n6h h GLU 172 CO -0.00 0.58 -0.25 0.97 -1.40 0.00 0.00 179.01 178.91 1n6h h ILE 173 N 0.90 1.27 -0.46 3.13 2.10 -1.04 0.35 117.51 123.76 1n6h h ILE 173 Ca 0.25 -1.40 -0.08 0.00 1.08 0.00 0.00 64.86 64.70 1n6h h ILE 173 Cb -0.10 1.20 -0.02 0.00 -1.09 0.00 0.00 36.82 36.81 1n6h h ILE 173 CO -0.06 0.48 -0.02 -0.26 -1.08 0.00 0.00 178.15 177.21 1n6h h PHE 174 N 0.78 0.91 -0.36 2.19 0.04 -1.39 -2.42 116.94 116.69 1n6h h PHE 174 Ca 0.10 -0.17 -0.11 0.00 2.80 0.00 0.00 57.97 60.59 1n6h h PHE 174 Cb 0.81 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 38.71 1n6h h PHE 174 CO 0.05 0.88 -0.24 0.52 -0.60 0.00 0.00 178.31 178.92 1n6h h MET 175 N 0.68 0.73 -0.48 1.51 2.86 -0.86 -2.10 114.93 117.27 1n6h h MET 175 Ca 0.13 -0.30 -0.05 0.00 -2.06 0.00 0.00 59.70 57.42 1n6h h MET 175 Cb 0.53 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 1n6h h MET 175 CO 0.03 0.90 0.09 0.00 1.06 0.00 0.00 176.91 178.98 1n6h h ALA 176 N 1.10 1.25 -0.08 6.32 0.00 -0.82 -0.82 119.26 126.22 1n6h h ALA 176 Ca 0.09 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1n6h h ALA 176 Cb 0.74 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1n6h h ALA 176 CO 0.06 0.51 0.01 0.82 0.00 0.00 0.00 179.25 180.65 1n6h h ILE 177 N 0.71 1.23 -0.97 0.00 2.04 -1.19 -2.74 117.51 116.59 1n6h h ILE 177 Ca 0.15 -0.72 0.08 0.00 1.00 0.00 0.00 64.86 65.38 1n6h h ILE 177 Cb 0.31 1.56 -0.07 0.00 -0.74 0.00 0.00 36.82 37.88 1n6h h ILE 177 CO 0.00 0.20 0.63 0.00 0.00 0.00 0.00 178.15 178.98 1n6h h ALA 178 N 0.75 1.46 0.00 1.87 0.00 -1.03 -1.09 119.26 121.23 1n6h h ALA 178 Ca 0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1n6h h ALA 178 Cb 0.31 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1n6h h ALA 178 CO 0.00 0.37 -0.16 0.87 0.00 0.00 0.00 179.25 180.33 1n6h h LYS 179 N 1.10 0.00 -0.51 0.00 1.57 -1.01 -2.68 116.57 115.03 1n6h h LYS 179 Ca 0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.21 1n6h h LYS 179 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1n6h h LYS 179 CO -0.18 0.16 0.00 1.63 -0.57 0.00 0.00 179.45 180.49 1n6h n LYS 180 N -4.12 2.20 0.00 3.15 4.76 -0.43 -5.11 118.16 118.61 1n6h n LYS 180 Ca -0.02 -1.87 0.06 0.00 -2.87 0.00 0.00 58.31 53.61 1n6h n LYS 180 Cb 0.24 -1.41 0.05 0.00 -1.84 0.00 0.00 35.03 32.07 1n6h n LYS 180 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31