#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wmq s ASP 8 N 0.00 6.45 0.66 4.31 1.01 -1.26 -4.98 116.67 122.85 2wmq s ASP 8 Ca 0.00 -2.61 -0.16 0.00 0.71 0.00 0.00 52.55 50.49 2wmq s ASP 8 Cb 0.00 -2.15 0.00 0.00 1.01 0.00 0.00 42.92 41.78 2wmq s ASP 8 CO 0.00 -0.57 1.18 0.26 0.21 0.00 0.00 175.17 176.25 2wmq s TRP 9 N 0.30 2.32 0.04 4.23 0.52 -1.26 -3.26 118.94 121.82 2wmq s TRP 9 Ca 0.16 1.56 0.05 0.00 0.02 0.00 0.00 56.10 57.90 2wmq s TRP 9 Cb -0.14 -3.39 -0.03 0.00 -1.15 0.00 0.00 33.47 28.76 2wmq s TRP 9 CO -0.07 -2.21 -0.11 -0.51 0.02 0.00 0.00 176.95 174.07 2wmq s ASP 10 N -2.04 4.28 -0.71 2.95 -0.00 -0.48 -4.91 116.67 115.76 2wmq s ASP 10 Ca 0.73 -0.30 -0.19 0.00 -0.00 0.00 0.00 52.55 52.80 2wmq s ASP 10 Cb -0.27 -0.86 0.12 0.00 -0.00 0.00 0.00 42.92 41.91 2wmq s ASP 10 CO 0.40 0.25 0.85 -0.76 -0.00 0.00 0.00 175.17 175.90 2wmq s LEU 11 N -1.60 5.37 0.02 1.23 1.43 -1.26 -1.76 118.68 122.10 2wmq s LEU 11 Ca 0.17 -1.69 -0.21 0.00 -1.03 0.00 0.00 54.13 51.37 2wmq s LEU 11 Cb -0.11 -2.33 -0.17 0.00 0.03 0.00 0.00 46.19 43.61 2wmq s LEU 11 CO 0.08 -1.07 1.25 0.58 0.23 0.00 0.00 176.35 177.42 2wmq h VAL 12 N 5.76 1.40 -2.72 -1.59 2.07 -1.33 -3.48 116.25 116.35 2wmq h VAL 12 Ca -0.13 -1.53 0.04 0.00 0.82 0.00 0.00 66.70 65.90 2wmq h VAL 12 Cb 1.06 2.15 -0.12 0.00 -1.52 0.00 0.00 31.29 32.86 2wmq h VAL 12 CO 1.07 0.44 0.32 0.00 0.02 0.00 0.00 177.57 179.42 2wmq s GLN 13 N -3.93 1.16 -0.10 1.57 -2.07 -1.25 -4.99 119.66 110.05 2wmq s GLN 13 Ca -0.14 -0.47 -0.30 0.00 -1.82 0.00 0.00 55.36 52.63 2wmq s GLN 13 Cb 0.04 0.51 -0.02 0.00 -1.09 0.00 0.00 33.01 32.45 2wmq s GLN 13 CO 0.76 -0.51 1.12 0.99 -1.32 0.00 0.00 175.29 176.32 2wmq s THR 14 N -3.53 4.49 -0.18 3.63 2.01 -1.26 0.13 115.64 120.94 2wmq s THR 14 Ca 0.04 1.79 -0.10 0.00 0.31 0.00 0.00 61.69 63.74 2wmq s THR 14 Cb -0.01 -4.15 -0.22 0.00 0.01 0.00 0.00 72.50 68.12 2wmq s THR 14 CO -0.09 -0.03 0.17 0.18 -0.69 0.00 0.00 174.62 174.16 2wmq n LEU 15 N 5.37 2.45 -4.07 4.42 4.77 0.09 -4.89 117.00 125.14 2wmq n LEU 15 Ca 0.10 0.22 -0.07 0.00 -0.03 0.00 0.00 56.01 56.23 2wmq n LEU 15 Cb 0.47 -1.03 -0.10 0.00 -2.33 0.00 0.00 43.42 40.44 2wmq n LEU 15 CO 0.54 0.71 -0.34 -0.83 -1.33 0.00 0.00 177.39 176.13 2wmq s GLY 16 N -5.55 0.43 0.06 -0.72 0.00 -1.04 -5.01 107.32 95.50 2wmq s GLY 16 Ca -0.27 -1.15 -0.01 0.00 0.00 0.00 0.00 44.72 43.29 2wmq s GLY 16 CO 0.68 -1.26 -0.03 -0.54 0.00 0.00 0.00 173.10 171.95 2wmq s GLU 17 N -3.85 0.67 0.00 2.90 0.41 -1.26 -0.92 118.70 116.66 2wmq s GLU 17 Ca 0.06 -1.26 0.00 0.00 -0.41 0.00 0.00 54.97 53.37 2wmq s GLU 17 Cb 0.07 0.15 0.00 0.00 -1.78 0.00 0.00 34.13 32.57 2wmq s GLU 17 CO -0.10 -0.11 0.00 0.41 -0.49 0.00 0.00 175.26 174.97 2wmq n GLY 18 N 0.07 2.36 1.76 -1.39 0.00 -1.24 -4.94 105.19 101.80 2wmq n GLY 18 Ca -0.13 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.03 2wmq n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wmq n ALA 19 N 1.64 -0.05 -2.08 4.61 0.00 -1.26 -4.63 120.51 118.74 2wmq n ALA 19 Ca 0.00 0.01 -0.42 0.00 0.00 0.00 0.00 53.44 53.03 2wmq n ALA 19 Cb 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 19.45 19.40 2wmq n ALA 19 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2wmq s TYR 20 N -0.77 3.18 0.01 0.00 -0.00 -1.26 -4.73 117.35 113.78 2wmq s TYR 20 Ca 0.00 0.84 0.00 0.00 -0.00 0.00 0.00 57.07 57.91 2wmq s TYR 20 Cb 0.00 -3.77 0.00 0.00 -0.00 0.00 0.00 41.96 38.19 2wmq s TYR 20 CO 0.00 -2.76 0.00 0.41 -0.00 0.00 0.00 175.55 173.20 2wmq n GLY 21 N 3.56 -2.20 3.16 5.49 0.00 -1.19 -4.56 105.19 109.44 2wmq n GLY 21 Ca 0.12 -1.50 -0.09 0.00 0.00 0.00 0.00 46.02 44.56 2wmq n GLY 21 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wmq s GLU 22 N -0.72 0.70 -0.12 1.61 -1.05 -0.98 -3.67 118.70 114.47 2wmq s GLU 22 Ca 0.00 -0.85 -0.07 0.00 -0.15 0.00 0.00 54.97 53.90 2wmq s GLU 22 Cb 0.00 0.28 -0.04 0.00 -0.44 0.00 0.00 34.13 33.93 2wmq s GLU 22 CO 0.00 -0.19 0.12 0.08 0.95 0.00 0.00 175.26 176.22 2wmq s VAL 23 N -3.19 5.36 0.16 1.83 1.01 -0.09 -1.56 120.40 123.92 2wmq s VAL 23 Ca -0.00 0.15 0.06 0.00 0.00 0.00 0.00 61.98 62.20 2wmq s VAL 23 Cb 0.02 -3.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 2wmq s VAL 23 CO -0.07 0.61 -0.13 -1.10 0.00 0.00 0.00 175.10 174.40 2wmq s GLN 24 N -0.95 1.15 -0.10 2.72 -0.21 0.93 -0.73 119.66 122.47 2wmq s GLN 24 Ca 0.14 -1.42 -0.23 0.00 0.02 0.00 0.00 55.36 53.88 2wmq s GLN 24 Cb -0.12 -0.93 -0.03 0.00 1.00 0.00 0.00 33.01 32.93 2wmq s GLN 24 CO 0.04 0.16 0.68 -1.17 -2.12 0.00 0.00 175.29 172.87 2wmq s LEU 25 N -2.93 4.27 -0.19 2.90 2.96 0.12 0.71 118.68 126.53 2wmq s LEU 25 Ca 0.16 1.10 0.01 0.00 -0.22 0.00 0.00 54.13 55.17 2wmq s LEU 25 Cb -0.02 -3.03 0.03 0.00 0.50 0.00 0.00 46.19 43.68 2wmq s LEU 25 CO 0.04 -0.16 -0.13 0.00 -1.32 0.00 0.00 176.35 174.78 2wmq s ALA 26 N 1.08 2.09 -0.19 5.97 0.00 0.15 -0.73 121.76 130.12 2wmq s ALA 26 Ca 0.35 -1.19 -0.08 0.00 0.00 0.00 0.00 51.96 51.05 2wmq s ALA 26 Cb -0.17 -1.23 -0.04 0.00 0.00 0.00 0.00 23.12 21.67 2wmq s ALA 26 CO 0.16 -0.65 0.07 0.08 0.00 0.00 0.00 175.76 175.42 2wmq s VAL 27 N 1.37 4.85 0.28 0.00 1.01 -0.72 -0.36 120.40 126.82 2wmq s VAL 27 Ca 0.01 -0.01 -0.30 0.00 0.00 0.00 0.00 61.98 61.68 2wmq s VAL 27 Cb -0.15 -3.20 -0.11 0.00 0.00 0.00 0.00 36.38 32.93 2wmq s VAL 27 CO -0.09 0.44 1.47 0.21 0.00 0.00 0.00 175.10 177.13 2wmq s ASN 28 N 0.49 6.56 0.17 3.32 3.84 0.38 -1.38 114.94 128.31 2wmq s ASN 28 Ca 0.04 2.79 -0.12 0.00 0.21 0.00 0.00 52.86 55.78 2wmq s ASN 28 Cb -0.12 -2.63 0.08 0.00 -0.55 0.00 0.00 41.25 38.02 2wmq s ASN 28 CO 0.01 -0.76 1.74 -0.09 -2.79 0.00 0.00 177.10 175.20 2wmq h ARG 29 N 4.56 0.89 0.00 0.43 2.43 -1.90 -1.92 114.38 118.87 2wmq h ARG 29 Ca -0.47 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 58.54 2wmq h ARG 29 Cb 1.22 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 2wmq h ARG 29 CO 0.75 0.75 0.00 0.28 -1.51 0.00 0.00 179.97 180.24 2wmq n VAL 30 N -4.48 0.00 -0.20 0.20 0.31 -1.26 -4.49 118.33 108.41 2wmq n VAL 30 Ca 0.04 0.31 -0.02 0.00 -0.01 0.00 0.00 64.34 64.66 2wmq n VAL 30 Cb 0.16 -1.12 0.19 0.00 -0.91 0.00 0.00 33.84 32.16 2wmq n VAL 30 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2wmq h THR 31 N 0.00 1.22 0.00 2.52 1.35 -2.00 -3.46 112.91 112.54 2wmq h THR 31 Ca 0.00 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 65.26 2wmq h THR 31 Cb 0.00 0.33 0.00 0.00 -1.73 0.00 0.00 68.15 66.75 2wmq h THR 31 CO 0.00 0.26 0.00 1.21 -0.25 0.00 0.00 175.52 176.74 2wmq n GLU 32 N -4.34 0.00 -1.80 4.72 2.13 -0.72 -4.98 120.64 115.64 2wmq n GLU 32 Ca 0.07 0.25 -0.41 0.00 0.66 0.00 0.00 57.16 57.72 2wmq n GLU 32 Cb 0.13 -3.39 -0.01 0.00 0.27 0.00 0.00 31.44 28.43 2wmq n GLU 32 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2wmq s GLU 33 N -1.03 4.13 -0.06 5.31 2.02 -1.26 -4.33 118.70 123.48 2wmq s GLU 33 Ca 0.00 2.56 -0.15 0.00 0.02 0.00 0.00 54.97 57.39 2wmq s GLU 33 Cb 0.00 -3.01 -0.05 0.00 0.10 0.00 0.00 34.13 31.17 2wmq s GLU 33 CO 0.00 -0.59 0.40 0.00 0.02 0.00 0.00 175.26 175.10 2wmq s ALA 34 N -0.33 3.62 0.30 5.21 0.00 -1.26 -0.47 121.76 128.83 2wmq s ALA 34 Ca 0.60 -0.25 -0.00 0.00 0.00 0.00 0.00 51.96 52.30 2wmq s ALA 34 Cb -0.47 -2.45 -0.02 0.00 0.00 0.00 0.00 23.12 20.18 2wmq s ALA 34 CO 0.52 0.29 0.34 0.14 0.00 0.00 0.00 175.76 177.05 2wmq s VAL 35 N -0.37 0.00 -0.00 0.00 -7.23 0.51 -4.45 120.40 108.86 2wmq s VAL 35 Ca 0.23 -1.79 0.08 0.00 -1.81 0.00 0.00 61.98 58.69 2wmq s VAL 35 Cb -0.16 -2.52 -0.02 0.00 0.56 0.00 0.00 36.38 34.24 2wmq s VAL 35 CO 0.11 0.00 -0.25 0.00 -0.31 0.00 0.00 175.10 174.64 2wmq s ALA 36 N -3.54 2.22 -0.18 1.32 0.00 -0.40 0.31 121.76 121.49 2wmq s ALA 36 Ca 0.35 -1.16 0.01 0.00 0.00 0.00 0.00 51.96 51.16 2wmq s ALA 36 Cb 0.02 -0.55 0.02 0.00 0.00 0.00 0.00 23.12 22.61 2wmq s ALA 36 CO 0.19 0.53 -0.20 0.08 0.00 0.00 0.00 175.76 176.37 2wmq s VAL 37 N -0.68 2.05 -0.19 0.00 1.01 0.22 -0.95 120.40 121.86 2wmq s VAL 37 Ca 0.11 -0.93 -0.17 0.00 0.00 0.00 0.00 61.98 60.98 2wmq s VAL 37 Cb -0.10 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 2wmq s VAL 37 CO 0.00 0.54 0.47 -0.75 0.00 0.00 0.00 175.10 175.36 2wmq s LYS 38 N 1.29 4.21 -0.40 2.72 2.20 -0.46 -0.05 119.74 129.26 2wmq s LYS 38 Ca 0.05 0.34 -0.05 0.00 -0.36 0.00 0.00 55.97 55.95 2wmq s LYS 38 Cb -0.13 -3.53 0.09 0.00 -1.51 0.00 0.00 37.83 32.75 2wmq s LYS 38 CO -0.13 -0.06 0.20 0.42 -0.36 0.00 0.00 175.35 175.42 2wmq s ILE 39 N 1.35 3.59 -0.08 5.43 -1.09 -0.60 0.29 121.20 130.09 2wmq s ILE 39 Ca 0.22 -1.73 0.03 0.00 -2.23 0.00 0.00 60.65 56.94 2wmq s ILE 39 Cb -0.15 -3.31 0.01 0.00 -1.58 0.00 0.00 42.46 37.43 2wmq s ILE 39 CO 0.09 -0.55 -0.16 -0.69 -1.23 0.00 0.00 174.94 172.40 2wmq s VAL 40 N 1.26 1.42 -0.73 2.92 1.01 -1.26 -2.32 120.40 122.69 2wmq s VAL 40 Ca 0.04 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.40 2wmq s VAL 40 Cb -0.23 -1.27 0.35 0.00 0.00 0.00 0.00 36.38 35.24 2wmq s VAL 40 CO -0.02 0.42 1.43 -0.90 0.00 0.00 0.00 175.10 176.03 2wmq n ASP 41 N 3.75 5.91 0.00 3.32 5.68 -1.26 -5.00 116.55 128.95 2wmq n ASP 41 Ca -0.22 -3.72 0.00 0.00 -0.50 0.00 0.00 54.79 50.35 2wmq n ASP 41 Cb 0.52 -0.81 0.00 0.00 -1.14 0.00 0.00 41.12 39.69 2wmq n ASP 41 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2wmq n ASN 51 N -0.29 0.00 0.14 -1.12 4.13 -1.26 -5.03 115.26 111.84 2wmq n ASN 51 Ca 0.41 0.00 -0.00 0.00 1.68 0.00 0.00 54.58 56.67 2wmq n ASN 51 Cb 0.38 0.00 0.17 0.00 -1.54 0.00 0.00 39.78 38.79 2wmq n ASN 51 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 2wmq h ILE 52 N 0.00 1.36 -0.19 2.41 6.09 -2.00 -3.03 117.51 122.15 2wmq h ILE 52 Ca 0.00 -2.12 -0.13 0.00 -1.37 0.00 0.00 64.86 61.24 2wmq h ILE 52 Cb 0.00 2.16 -0.01 0.00 0.47 0.00 0.00 36.82 39.44 2wmq h ILE 52 CO 0.00 0.59 -0.45 0.11 -3.07 0.00 0.00 178.15 175.33 2wmq h LYS 53 N 0.00 0.46 -0.01 2.19 1.57 -2.02 -2.84 116.57 115.93 2wmq h LYS 53 Ca -0.01 -0.25 -0.24 0.00 -1.87 0.00 0.00 60.65 58.29 2wmq h LYS 53 Cb 1.12 0.01 0.02 0.00 0.08 0.00 0.00 32.23 33.46 2wmq h LYS 53 CO 0.08 0.82 -0.93 -0.22 -0.57 0.00 0.00 179.45 178.63 2wmq h LYS 54 N 0.38 0.65 -0.43 3.15 3.64 -1.98 -1.83 116.57 120.15 2wmq h LYS 54 Ca 0.03 -0.68 0.07 0.00 -1.27 0.00 0.00 60.65 58.79 2wmq h LYS 54 Cb 0.93 0.19 -0.06 0.00 -0.41 0.00 0.00 32.23 32.89 2wmq h LYS 54 CO 0.08 1.28 0.09 1.49 -2.27 0.00 0.00 179.45 180.12 2wmq h GLU 55 N 0.30 0.22 -0.61 1.90 4.81 -1.52 0.66 114.58 120.35 2wmq h GLU 55 Ca -0.11 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.07 2wmq h GLU 55 Cb 1.59 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.89 2wmq h GLU 55 CO 0.18 0.14 0.24 0.82 -0.73 0.00 0.00 179.01 179.66 2wmq h ILE 56 N 0.22 1.23 0.34 2.32 2.04 -1.56 0.12 117.51 122.23 2wmq h ILE 56 Ca 0.21 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.33 2wmq h ILE 56 Cb 0.25 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2wmq h ILE 56 CO -0.27 0.28 -0.24 0.00 0.00 0.00 0.00 178.15 177.93 2wmq h ILE 58 N -0.57 1.13 -0.90 0.00 2.04 0.39 -2.24 117.51 117.37 2wmq h ILE 58 Ca -0.03 -0.33 0.19 0.00 1.00 0.00 0.00 64.86 65.70 2wmq h ILE 58 Cb 0.49 0.68 -0.07 0.00 -0.74 0.00 0.00 36.82 37.18 2wmq h ILE 58 CO 0.01 0.13 0.59 0.78 0.00 0.00 0.00 178.15 179.66 2wmq h ASN 59 N 0.48 0.46 0.23 1.72 2.35 -0.68 -0.71 115.58 119.43 2wmq h ASN 59 Ca 0.13 0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.91 2wmq h ASN 59 Cb 0.03 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.35 2wmq h ASN 59 CO -0.02 0.19 -0.10 0.11 -1.65 0.00 0.00 177.43 175.96 2wmq h LYS 60 N 0.46 0.00 0.00 0.81 1.79 -0.83 -1.83 116.57 116.98 2wmq h LYS 60 Ca 0.47 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.94 2wmq h LYS 60 Cb 1.07 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.72 2wmq h LYS 60 CO -0.19 0.10 0.00 0.52 -1.08 0.00 0.00 179.45 178.80 2wmq h MET 61 N 0.00 0.00 -5.80 3.15 2.86 -1.16 -3.46 114.93 110.51 2wmq h MET 61 Ca -0.00 0.00 -0.60 0.00 -2.06 0.00 0.00 59.70 57.04 2wmq h MET 61 Cb 0.24 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 31.80 2wmq h MET 61 CO 0.01 0.00 0.42 -0.51 1.06 0.00 0.00 176.91 177.90 2wmq s LEU 62 N -5.88 4.08 -0.32 1.22 1.43 -0.69 -5.00 118.68 113.52 2wmq s LEU 62 Ca 0.08 0.72 -0.02 0.00 -1.03 0.00 0.00 54.13 53.88 2wmq s LEU 62 Cb 0.06 -3.11 0.12 0.00 0.03 0.00 0.00 46.19 43.30 2wmq s LEU 62 CO 0.65 -0.62 0.17 0.21 0.23 0.00 0.00 176.35 177.00 2wmq s ASN 63 N 1.59 3.29 -0.06 2.29 2.47 -1.26 -4.63 114.94 118.63 2wmq s ASN 63 Ca 0.33 -1.78 -0.28 0.00 0.42 0.00 0.00 52.86 51.56 2wmq s ASN 63 Cb -0.14 -0.42 0.06 0.00 -1.45 0.00 0.00 41.25 39.30 2wmq s ASN 63 CO 0.12 -0.37 0.61 -2.28 -3.72 0.00 0.00 177.10 171.46 2wmq s HIS 64 N 1.53 -0.58 -1.25 0.43 2.46 -1.26 -5.04 115.29 111.58 2wmq s HIS 64 Ca 0.14 1.02 0.17 0.00 0.47 0.00 0.00 55.06 56.86 2wmq s HIS 64 Cb -0.20 0.34 0.82 0.00 -0.13 0.00 0.00 32.58 33.41 2wmq s HIS 64 CO -0.17 -0.55 1.53 -0.85 -2.47 0.00 0.00 174.74 172.23 2wmq n GLU 65 N 1.10 0.14 -0.36 2.88 0.00 -1.26 -1.98 120.64 121.15 2wmq n GLU 65 Ca -0.19 0.16 0.07 0.00 0.00 0.00 0.00 57.16 57.20 2wmq n GLU 65 Cb 0.57 -1.50 0.19 0.00 0.00 0.00 0.00 31.44 30.69 2wmq n GLU 65 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2wmq n ASN 66 N -1.38 2.50 -3.94 -1.84 5.03 -1.26 -4.83 115.26 109.54 2wmq n ASN 66 Ca 0.07 -3.36 -0.19 0.00 0.87 0.00 0.00 54.58 51.96 2wmq n ASN 66 Cb 0.16 -0.50 -0.16 0.00 -1.02 0.00 0.00 39.78 38.26 2wmq n ASN 66 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2wmq s VAL 67 N -3.01 0.60 -0.06 2.41 1.01 -0.84 -1.32 120.40 119.19 2wmq s VAL 67 Ca 0.37 -0.23 -0.32 0.00 0.00 0.00 0.00 61.98 61.80 2wmq s VAL 67 Cb 0.33 -0.56 -0.10 0.00 0.00 0.00 0.00 36.38 36.04 2wmq s VAL 67 CO 0.01 0.21 1.95 0.52 0.00 0.00 0.00 175.10 177.79 2wmq n VAL 68 N 3.55 0.63 -2.14 2.92 0.31 -0.47 -4.60 118.33 118.52 2wmq n VAL 68 Ca -0.20 -0.14 -0.41 0.00 -0.01 0.00 0.00 64.34 63.58 2wmq n VAL 68 Cb 0.53 -2.07 -0.02 0.00 -0.91 0.00 0.00 33.84 31.37 2wmq n VAL 68 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2wmq s LYS 69 N 4.42 4.37 -0.25 5.55 1.02 -1.26 -4.78 119.74 128.81 2wmq s LYS 69 Ca 0.92 2.17 -0.12 0.00 0.02 0.00 0.00 55.97 58.97 2wmq s LYS 69 Cb -0.59 -3.10 -0.05 0.00 -0.52 0.00 0.00 37.83 33.57 2wmq s LYS 69 CO 0.47 -0.20 0.21 0.12 -0.92 0.00 0.00 175.35 175.03 2wmq s PHE 70 N -0.79 3.29 -0.19 3.18 5.36 -1.26 0.14 117.98 127.72 2wmq s PHE 70 Ca 0.51 0.26 -0.15 0.00 -0.96 0.00 0.00 56.93 56.59 2wmq s PHE 70 Cb -0.39 -2.35 -0.07 0.00 -0.34 0.00 0.00 43.02 39.87 2wmq s PHE 70 CO 0.48 -0.02 -0.24 0.66 -1.46 0.00 0.00 175.22 174.65 2wmq n TYR 71 N 4.57 0.40 -2.92 10.12 4.01 0.13 -4.99 117.16 128.48 2wmq n TYR 71 Ca -0.14 0.17 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 2wmq n TYR 71 Cb 0.52 -0.73 0.00 0.00 -0.31 0.00 0.00 39.34 38.82 2wmq n TYR 71 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wmq n GLY 72 N 1.47 1.85 3.39 2.72 0.00 -1.19 -5.01 105.19 108.43 2wmq n GLY 72 Ca -0.20 -0.87 -0.14 0.00 0.00 0.00 0.00 46.02 44.81 2wmq n GLY 72 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2wmq s HIS 73 N -5.60 -0.51 0.05 1.61 -3.43 -1.26 -1.04 115.29 105.11 2wmq s HIS 73 Ca 0.00 1.17 0.06 0.00 -0.80 0.00 0.00 55.06 55.49 2wmq s HIS 73 Cb 0.00 0.20 -0.04 0.00 -1.43 0.00 0.00 32.58 31.31 2wmq s HIS 73 CO 0.00 -0.32 -0.11 -0.51 -2.00 0.00 0.00 174.74 171.80 2wmq s LEU 82 N -0.12 2.96 -0.36 5.38 1.02 0.15 -5.27 118.68 122.44 2wmq s LEU 82 Ca -0.03 -0.31 -0.12 0.00 0.02 0.00 0.00 54.13 53.69 2wmq s LEU 82 Cb -0.03 -1.73 0.01 0.00 0.02 0.00 0.00 46.19 44.46 2wmq s LEU 82 CO 0.02 0.24 0.21 -0.36 0.02 0.00 0.00 176.35 176.49 2wmq s PHE 83 N -1.05 3.23 0.10 0.29 0.08 -0.21 -1.35 117.98 119.07 2wmq s PHE 83 Ca 0.18 -0.75 0.08 0.00 0.12 0.00 0.00 56.93 56.56 2wmq s PHE 83 Cb -0.11 -2.45 -0.03 0.00 -0.57 0.00 0.00 43.02 39.86 2wmq s PHE 83 CO 0.09 -0.57 -0.20 -0.51 -0.10 0.00 0.00 175.22 173.93 2wmq s LEU 84 N 1.60 2.29 0.23 -0.37 1.43 -0.13 0.19 118.68 123.93 2wmq s LEU 84 Ca 0.03 -0.67 -0.30 0.00 -1.03 0.00 0.00 54.13 52.17 2wmq s LEU 84 Cb -0.19 -0.81 -0.15 0.00 0.03 0.00 0.00 46.19 45.07 2wmq s LEU 84 CO 0.07 0.03 0.94 1.21 0.23 0.00 0.00 176.35 178.84 2wmq n GLU 85 N 1.14 0.96 -3.24 1.70 2.13 0.12 -1.28 120.64 122.17 2wmq n GLU 85 Ca -0.20 0.34 -0.39 0.00 0.66 0.00 0.00 57.16 57.57 2wmq n GLU 85 Cb 0.54 -1.66 -0.06 0.00 0.27 0.00 0.00 31.44 30.52 2wmq n GLU 85 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 2wmq s TYR 86 N -0.79 3.45 -0.61 4.31 5.04 -1.26 -4.52 117.35 122.97 2wmq s TYR 86 Ca 0.64 0.89 -0.03 0.00 -2.44 0.00 0.00 57.07 56.13 2wmq s TYR 86 Cb -0.81 -2.65 0.16 0.00 0.35 0.00 0.00 41.96 39.01 2wmq s TYR 86 CO 0.57 0.02 0.43 0.00 -1.34 0.00 0.00 175.55 175.23 2wmq n SER 88 N 3.60 0.00 0.10 0.00 3.41 -1.22 -2.27 113.62 117.25 2wmq n SER 88 Ca 0.07 0.25 -0.04 0.00 -0.26 0.00 0.00 58.87 58.89 2wmq n SER 88 Cb 0.38 -0.37 0.04 0.00 -0.26 0.00 0.00 64.21 64.01 2wmq n SER 88 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2wmq h GLY 89 N 2.06 0.02 0.00 5.00 0.00 -0.12 -3.47 103.07 106.56 2wmq h GLY 89 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.30 2wmq h GLY 89 CO 0.00 0.03 0.00 0.61 0.00 0.00 0.00 176.54 177.18 2wmq n GLY 90 N 0.73 -1.77 3.83 4.60 0.00 -0.96 -4.73 105.19 106.88 2wmq n GLY 90 Ca -0.01 -1.82 -0.38 0.00 0.00 0.00 0.00 46.02 43.81 2wmq n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wmq s GLU 91 N 0.00 4.06 0.46 1.61 2.02 -1.26 -0.87 118.70 124.72 2wmq s GLU 91 Ca 0.00 0.58 0.18 0.00 0.02 0.00 0.00 54.97 55.75 2wmq s GLU 91 Cb 0.00 -3.18 1.15 0.00 0.10 0.00 0.00 34.13 32.20 2wmq s GLU 91 CO 0.00 0.63 1.95 1.25 0.02 0.00 0.00 175.26 179.11 2wmq h LEU 92 N 4.42 0.27 -1.63 1.80 5.85 -0.43 -0.21 115.31 125.39 2wmq h LEU 92 Ca -0.50 0.01 0.20 0.00 0.84 0.00 0.00 57.88 58.43 2wmq h LEU 92 Cb 1.21 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 42.14 2wmq h LEU 92 CO 0.63 0.15 0.58 0.15 -0.34 0.00 0.00 178.44 179.61 2wmq h PHE 93 N 0.29 0.41 -0.21 1.25 3.04 -1.72 0.16 116.94 120.17 2wmq h PHE 93 Ca 0.32 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.28 2wmq h PHE 93 Cb 0.85 -0.13 0.00 0.00 2.56 0.00 0.00 35.95 39.23 2wmq h PHE 93 CO -0.00 0.12 0.00 -0.25 -2.02 0.00 0.00 178.31 176.15 2wmq n ASP 94 N -4.46 1.46 -0.77 0.41 10.43 -0.09 -2.62 116.55 120.91 2wmq n ASP 94 Ca 0.18 -1.82 0.07 0.00 2.57 0.00 0.00 54.79 55.79 2wmq n ASP 94 Cb 0.71 -0.14 0.16 0.00 1.84 0.00 0.00 41.12 43.69 2wmq n ASP 94 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2wmq n ARG 95 N 0.23 2.24 -3.58 -1.24 5.12 0.55 -4.88 116.66 115.10 2wmq n ARG 95 Ca 0.13 -1.95 -0.41 0.00 -1.93 0.00 0.00 57.85 53.69 2wmq n ARG 95 Cb 0.26 -1.34 -0.09 0.00 -1.16 0.00 0.00 32.46 30.14 2wmq n ARG 95 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2wmq s ILE 96 N -1.08 4.25 0.12 0.55 1.01 -1.08 -4.67 121.20 120.30 2wmq s ILE 96 Ca 0.26 -1.52 -0.31 0.00 0.00 0.00 0.00 60.65 59.08 2wmq s ILE 96 Cb 0.15 -3.67 -0.09 0.00 0.01 0.00 0.00 42.46 38.86 2wmq s ILE 96 CO 0.20 -0.60 1.49 -0.70 0.00 0.00 0.00 174.94 175.33 2wmq s GLU 97 N 1.41 4.26 0.20 2.79 2.12 -0.46 -4.84 118.70 124.19 2wmq s GLU 97 Ca 0.04 2.21 -0.32 0.00 0.36 0.00 0.00 54.97 57.26 2wmq s GLU 97 Cb -0.24 -3.27 -0.11 0.00 0.26 0.00 0.00 34.13 30.77 2wmq s GLU 97 CO 0.01 -0.54 1.65 -2.14 -0.54 0.00 0.00 175.26 173.70 2wmq s PRO 98 N 1.37 4.16 0.00 4.30 0.02 -1.26 -0.00 135.00 143.59 2wmq s PRO 98 Ca 0.68 2.51 0.00 0.00 0.02 0.00 0.00 61.00 64.20 2wmq s PRO 98 Cb -0.39 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.02 2wmq s PRO 98 CO 0.31 -0.68 0.00 -3.47 -0.33 0.00 0.00 177.00 172.82 2wmq n ASP 99 N 3.82 0.00 -0.00 2.53 2.03 -0.35 -4.68 116.55 119.90 2wmq n ASP 99 Ca 0.14 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.45 2wmq n ASP 99 Cb 0.37 -0.18 -0.00 0.00 -0.72 0.00 0.00 41.12 40.58 2wmq n ASP 99 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2wmq n ILE 100 N -2.00 0.01 0.00 5.18 5.41 -0.83 -4.64 119.36 122.48 2wmq n ILE 100 Ca 0.00 -0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2wmq n ILE 100 Cb 0.00 -1.27 0.00 0.00 -0.71 0.00 0.00 39.64 37.66 2wmq n ILE 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2wmq n GLY 101 N 3.11 0.99 3.55 7.39 0.00 1.00 -3.86 105.19 117.37 2wmq n GLY 101 Ca -0.00 -1.19 -0.09 0.00 0.00 0.00 0.00 46.02 44.73 2wmq n GLY 101 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2wmq s MET 102 N 0.00 1.44 0.30 1.61 0.23 -0.13 -1.35 119.30 121.40 2wmq s MET 102 Ca 0.00 -1.04 -0.29 0.00 -1.03 0.00 0.00 55.69 53.33 2wmq s MET 102 Cb 0.00 0.50 -0.13 0.00 -1.53 0.00 0.00 34.83 33.67 2wmq s MET 102 CO 0.00 -0.61 1.36 -2.30 -2.03 0.00 0.00 175.02 171.45 2wmq n PRO 103 N -0.35 2.15 -0.27 3.16 -0.02 -1.26 -4.77 135.00 133.64 2wmq n PRO 103 Ca -0.06 0.76 0.03 0.00 -2.02 0.00 0.00 63.50 62.20 2wmq n PRO 103 Cb 0.62 -2.39 0.16 0.00 -0.02 0.00 0.00 33.50 31.87 2wmq n PRO 103 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2wmq h GLU 104 N 3.37 0.66 -0.79 -0.52 4.81 -1.99 -1.62 114.58 118.49 2wmq h GLU 104 Ca -0.46 -0.04 0.07 0.00 -0.13 0.00 0.00 59.36 58.81 2wmq h GLU 104 Cb 1.27 -0.15 -0.06 0.00 0.63 0.00 0.00 28.75 30.44 2wmq h GLU 104 CO 0.69 0.43 0.46 -1.35 -0.73 0.00 0.00 179.01 178.52 2wmq h PRO 105 N 0.68 0.80 -0.57 0.92 0.11 -1.90 -0.90 132.00 131.13 2wmq h PRO 105 Ca 0.38 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.41 2wmq h PRO 105 Cb 0.39 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.30 2wmq h PRO 105 CO -0.27 0.53 0.25 -0.44 -0.21 0.00 0.00 178.00 177.86 2wmq h ASP 106 N 0.82 0.77 -0.56 -2.05 3.45 -1.68 -2.12 116.42 115.06 2wmq h ASP 106 Ca 0.36 -0.15 0.07 0.00 0.43 0.00 0.00 57.03 57.74 2wmq h ASP 106 Cb 0.25 -0.20 -0.06 0.00 -0.56 0.00 0.00 39.33 38.76 2wmq h ASP 106 CO -0.20 0.71 0.24 0.00 -1.57 0.00 0.00 179.24 178.42 2wmq h ALA 107 N 1.09 0.71 -0.28 3.45 0.00 -0.90 -1.12 119.26 122.21 2wmq h ALA 107 Ca 0.19 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 2wmq h ALA 107 Cb 0.16 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2wmq h ALA 107 CO -0.02 -0.14 0.02 0.37 0.00 0.00 0.00 179.25 179.49 2wmq h GLN 108 N 0.46 0.48 -0.73 0.00 4.15 -0.91 0.31 115.11 118.87 2wmq h GLN 108 Ca 0.26 -0.14 0.00 0.00 0.77 0.00 0.00 58.65 59.54 2wmq h GLN 108 Cb 0.25 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 27.85 2wmq h GLN 108 CO -0.23 0.61 0.46 -0.09 -1.93 0.00 0.00 178.83 177.66 2wmq h ARG 109 N 0.28 0.99 -0.34 1.69 2.43 -1.20 0.23 114.38 118.46 2wmq h ARG 109 Ca 0.08 -0.08 -0.08 0.00 -0.81 0.00 0.00 59.98 59.09 2wmq h ARG 109 Cb 0.38 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 2wmq h ARG 109 CO 0.01 0.68 -0.14 0.74 -1.51 0.00 0.00 179.97 179.75 2wmq h PHE 110 N 1.00 0.65 -0.19 2.20 0.04 -0.96 -2.40 116.94 117.29 2wmq h PHE 110 Ca 0.27 -0.11 -0.20 0.00 2.80 0.00 0.00 57.97 60.72 2wmq h PHE 110 Cb -0.07 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 37.92 2wmq h PHE 110 CO -0.01 0.71 -0.67 0.35 -0.60 0.00 0.00 178.31 178.09 2wmq h PHE 111 N 0.54 0.97 -0.39 -0.55 3.57 -0.38 0.11 116.94 120.81 2wmq h PHE 111 Ca 0.09 -0.39 0.05 0.00 3.53 0.00 0.00 57.97 61.26 2wmq h PHE 111 Cb 0.56 -0.16 -0.05 0.00 2.79 0.00 0.00 35.95 39.09 2wmq h PHE 111 CO 0.02 1.20 0.12 0.45 -2.23 0.00 0.00 178.31 177.87 2wmq h HIS 112 N 0.53 0.20 -0.18 0.41 3.86 -0.38 -0.41 115.15 119.18 2wmq h HIS 112 Ca -0.02 0.02 -0.16 0.00 -1.16 0.00 0.00 60.37 59.05 2wmq h HIS 112 Cb 1.28 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.71 2wmq h HIS 112 CO 0.07 0.07 -0.56 1.96 0.86 0.00 0.00 177.93 180.33 2wmq h GLN 113 N 0.26 0.56 -0.84 2.45 4.20 -1.36 -0.88 115.11 119.50 2wmq h GLN 113 Ca 0.18 -0.36 0.02 0.00 0.06 0.00 0.00 58.65 58.55 2wmq h GLN 113 Cb 0.19 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.97 2wmq h GLN 113 CO -0.21 0.97 0.55 1.25 -0.67 0.00 0.00 178.83 180.73 2wmq h LEU 114 N 0.43 0.93 -0.18 1.46 5.85 -0.66 -1.38 115.31 121.76 2wmq h LEU 114 Ca 0.01 -0.02 -0.19 0.00 0.84 0.00 0.00 57.88 58.51 2wmq h LEU 114 Cb 1.11 -0.23 0.01 0.00 0.37 0.00 0.00 40.66 41.92 2wmq h LEU 114 CO 0.11 0.66 -0.64 0.24 -0.34 0.00 0.00 178.44 178.47 2wmq h MET 115 N 1.09 0.75 -0.68 1.25 2.86 -0.72 -1.97 114.93 117.51 2wmq h MET 115 Ca 0.32 -0.57 0.03 0.00 -2.06 0.00 0.00 59.70 57.42 2wmq h MET 115 Cb -0.06 0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.66 2wmq h MET 115 CO -0.08 1.19 0.42 0.00 1.06 0.00 0.00 176.91 179.50 2wmq h ALA 116 N 0.57 0.89 -0.58 6.32 0.00 -0.83 0.33 119.26 125.96 2wmq h ALA 116 Ca -0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2wmq h ALA 116 Cb 1.27 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 2wmq h ALA 116 CO 0.14 0.19 0.26 0.78 0.00 0.00 0.00 179.25 180.61 2wmq h GLY 117 N 0.83 0.91 0.83 0.00 0.00 -1.21 -2.37 103.07 102.05 2wmq h GLY 117 Ca 0.28 -0.47 -0.13 0.00 0.00 0.00 0.00 47.33 47.01 2wmq h GLY 117 CO -0.11 0.45 -0.43 -2.08 0.00 0.00 0.00 176.54 174.37 2wmq h VAL 118 N 0.79 1.38 -0.88 4.60 2.07 -1.01 -1.96 116.25 121.24 2wmq h VAL 118 Ca 0.20 -1.76 0.19 0.00 0.82 0.00 0.00 66.70 66.14 2wmq h VAL 118 Cb 0.16 2.19 -0.11 0.00 -1.52 0.00 0.00 31.29 32.00 2wmq h VAL 118 CO -0.02 0.52 0.43 0.58 0.02 0.00 0.00 177.57 179.10 2wmq h VAL 119 N 0.06 0.61 0.14 2.57 2.07 -0.94 0.84 116.25 121.60 2wmq h VAL 119 Ca -0.02 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 2wmq h VAL 119 Cb 1.07 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 2wmq h VAL 119 CO 0.09 0.10 -0.07 0.22 0.02 0.00 0.00 177.57 177.93 2wmq h TYR 120 N 0.53 -0.17 -0.19 1.57 3.20 -1.20 0.34 116.97 121.05 2wmq h TYR 120 Ca 0.52 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.41 2wmq h TYR 120 Cb 0.87 0.06 -0.03 0.00 1.54 0.00 0.00 36.73 39.17 2wmq h TYR 120 CO -0.10 0.06 0.02 -0.07 -1.64 0.00 0.00 178.16 176.43 2wmq h LEU 121 N -0.39 -0.02 -1.47 2.82 3.38 -0.68 -1.93 115.31 117.02 2wmq h LEU 121 Ca -0.02 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2wmq h LEU 121 Cb 0.31 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 2wmq h LEU 121 CO 0.03 0.02 0.17 0.45 0.09 0.00 0.00 178.44 179.20 2wmq h HIS 122 N 0.10 0.51 -0.38 1.13 3.86 -0.79 0.16 115.15 119.73 2wmq h HIS 122 Ca 0.09 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.27 2wmq h HIS 122 Cb 0.09 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.38 2wmq h HIS 122 CO -0.15 0.39 0.17 0.78 0.86 0.00 0.00 177.93 179.98 2wmq h GLY 123 N 0.65 0.57 -3.01 2.45 0.00 -0.15 -1.09 103.07 102.49 2wmq h GLY 123 Ca 0.13 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.21 2wmq h GLY 123 CO -0.02 0.25 0.00 0.29 0.00 0.00 0.00 176.54 177.06 2wmq n ILE 124 N -4.40 2.36 -1.41 2.60 -5.35 -0.81 -4.93 119.36 107.42 2wmq n ILE 124 Ca 0.03 -1.42 -0.06 0.00 -0.27 0.00 0.00 62.75 61.03 2wmq n ILE 124 Cb 0.13 -0.13 -0.02 0.00 -1.74 0.00 0.00 39.64 37.88 2wmq n ILE 124 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wmq n GLY 125 N 0.58 0.64 3.58 3.28 0.00 -0.41 -4.91 105.19 107.95 2wmq n GLY 125 Ca 0.26 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 45.17 2wmq n GLY 125 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wmq s ILE 126 N -2.23 4.20 -0.10 -0.61 1.01 0.47 -0.77 121.20 123.17 2wmq s ILE 126 Ca 0.00 -0.26 0.01 0.00 0.00 0.00 0.00 60.65 60.40 2wmq s ILE 126 Cb 0.00 -2.83 -0.02 0.00 0.01 0.00 0.00 42.46 39.63 2wmq s ILE 126 CO 0.00 0.52 -0.14 0.28 0.00 0.00 0.00 174.94 175.61 2wmq s THR 127 N -0.04 3.02 -0.03 2.92 -1.32 -0.64 -3.11 115.64 116.43 2wmq s THR 127 Ca 0.03 -0.69 -0.24 0.00 -1.21 0.00 0.00 61.69 59.57 2wmq s THR 127 Cb -0.13 -2.24 -0.21 0.00 -1.51 0.00 0.00 72.50 68.41 2wmq s THR 127 CO 0.02 0.55 1.12 -0.74 -2.21 0.00 0.00 174.62 173.36 2wmq h HIS 128 N 6.29 0.21 0.00 9.09 2.76 -1.91 -1.44 115.15 130.16 2wmq h HIS 128 Ca -0.32 -0.09 0.00 0.00 -2.20 0.00 0.00 60.37 57.76 2wmq h HIS 128 Cb 1.20 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 30.12 2wmq h HIS 128 CO 0.50 0.81 0.00 0.54 -1.30 0.00 0.00 177.93 178.48 2wmq n ARG 129 N -4.60 0.00 -2.68 5.26 1.74 -1.26 -2.83 116.66 112.29 2wmq n ARG 129 Ca -0.09 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 56.91 2wmq n ARG 129 Cb 0.42 -2.04 0.04 0.00 -1.02 0.00 0.00 32.46 29.86 2wmq n ARG 129 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2wmq n ASP 130 N 0.00 1.08 -4.67 0.55 4.64 -1.26 -4.14 116.55 112.75 2wmq n ASP 130 Ca 0.00 -2.63 -0.43 0.00 -1.38 0.00 0.00 54.79 50.36 2wmq n ASP 130 Cb 0.00 -0.36 -0.02 0.00 -1.04 0.00 0.00 41.12 39.70 2wmq n ASP 130 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2wmq s ILE 131 N -2.80 4.23 0.12 5.18 1.01 -1.26 -4.80 121.20 122.87 2wmq s ILE 131 Ca 0.26 1.50 -0.25 0.00 0.00 0.00 0.00 60.65 62.17 2wmq s ILE 131 Cb 0.44 -3.97 0.07 0.00 0.01 0.00 0.00 42.46 39.02 2wmq s ILE 131 CO 0.02 -0.10 0.77 -1.59 0.00 0.00 0.00 174.94 174.04 2wmq s LYS 132 N 3.19 1.17 0.61 2.79 -2.85 -1.26 -4.77 119.74 118.63 2wmq s LYS 132 Ca 0.56 -0.51 0.40 0.00 -1.00 0.00 0.00 55.97 55.43 2wmq s LYS 132 Cb -0.23 0.49 2.07 0.00 -2.06 0.00 0.00 37.83 38.10 2wmq s LYS 132 CO 0.17 -0.52 2.23 -1.35 0.10 0.00 0.00 175.35 175.98 2wmq h PRO 133 N 2.00 0.00 0.00 1.78 0.11 -1.93 0.52 132.00 134.48 2wmq h PRO 133 Ca -0.26 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.78 2wmq h PRO 133 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 2wmq h PRO 133 CO 0.32 0.00 -0.30 0.93 -0.21 0.00 0.00 178.00 178.74 2wmq h GLU 134 N 0.00 0.00 -0.61 1.05 3.07 -1.95 -2.67 114.58 113.47 2wmq h GLU 134 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2wmq h GLU 134 Cb 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 2wmq h GLU 134 CO 0.00 0.30 0.00 0.09 -1.40 0.00 0.00 179.01 178.00 2wmq n ASN 135 N -3.59 4.06 -4.14 1.42 3.02 0.16 -4.82 115.26 111.37 2wmq n ASN 135 Ca -0.01 -2.21 -0.35 0.00 -0.03 0.00 0.00 54.58 51.98 2wmq n ASN 135 Cb 0.43 -0.48 -0.13 0.00 -0.61 0.00 0.00 39.78 38.99 2wmq n ASN 135 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2wmq s LEU 136 N -1.40 4.31 0.28 3.41 1.43 -1.11 -0.98 118.68 124.62 2wmq s LEU 136 Ca 0.45 -1.56 0.05 0.00 -1.03 0.00 0.00 54.13 52.04 2wmq s LEU 136 Cb 0.26 -1.73 -0.02 0.00 0.03 0.00 0.00 46.19 44.73 2wmq s LEU 136 CO 0.26 -0.34 0.41 -0.76 0.23 0.00 0.00 176.35 176.15 2wmq s LEU 137 N 1.18 4.17 -0.04 1.79 1.43 0.25 -0.06 118.68 127.40 2wmq s LEU 137 Ca -0.00 -0.01 0.06 0.00 -1.03 0.00 0.00 54.13 53.14 2wmq s LEU 137 Cb -0.20 -2.84 -0.01 0.00 0.03 0.00 0.00 46.19 43.17 2wmq s LEU 137 CO -0.03 -0.22 -0.21 -0.76 0.23 0.00 0.00 176.35 175.36 2wmq s LEU 138 N -4.07 2.01 0.00 1.79 1.43 -0.05 0.72 118.68 120.51 2wmq s LEU 138 Ca 0.39 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 2wmq s LEU 138 Cb -0.09 -1.16 0.00 0.00 0.03 0.00 0.00 46.19 44.97 2wmq s LEU 138 CO 0.30 0.22 0.00 -0.90 0.23 0.00 0.00 176.35 176.20 2wmq n ASP 139 N 2.90 0.00 0.04 2.29 3.85 -0.17 0.39 116.55 125.85 2wmq n ASP 139 Ca -0.17 -0.24 -0.03 0.00 -0.71 0.00 0.00 54.79 53.63 2wmq n ASP 139 Cb 0.52 0.00 0.21 0.00 -1.35 0.00 0.00 41.12 40.50 2wmq n ASP 139 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 2wmq h GLU 140 N 0.00 0.40 -0.84 0.11 9.09 -1.90 -2.34 114.58 119.10 2wmq h GLU 140 Ca 0.00 -0.17 -0.13 0.00 0.05 0.00 0.00 59.36 59.11 2wmq h GLU 140 Cb 0.00 -0.02 -0.08 0.00 -1.65 0.00 0.00 28.75 27.00 2wmq h GLU 140 CO 0.00 0.68 0.17 0.54 0.05 0.00 0.00 179.01 180.44 2wmq n ARG 141 N -4.09 2.79 -1.97 1.06 1.74 -1.26 -4.87 116.66 110.06 2wmq n ARG 141 Ca -0.01 -1.95 -0.21 0.00 -0.77 0.00 0.00 57.85 54.91 2wmq n ARG 141 Cb 0.43 -1.89 -0.05 0.00 -1.02 0.00 0.00 32.46 29.93 2wmq n ARG 141 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2wmq n ASP 142 N 0.02 -5.66 -4.74 0.55 8.00 -0.88 -4.96 116.55 108.88 2wmq n ASP 142 Ca 0.26 0.27 -0.41 0.00 0.71 0.00 0.00 54.79 55.62 2wmq n ASP 142 Cb 1.01 -4.87 -0.04 0.00 -0.02 0.00 0.00 41.12 37.20 2wmq n ASP 142 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2wmq s ASN 143 N -2.44 7.28 0.19 -2.24 0.01 -1.26 -4.75 114.94 111.74 2wmq s ASN 143 Ca 0.00 2.07 -0.25 0.00 -0.71 0.00 0.00 52.86 53.98 2wmq s ASN 143 Cb 0.00 -2.60 -0.08 0.00 0.41 0.00 0.00 41.25 38.97 2wmq s ASN 143 CO 0.00 -0.21 0.80 -0.22 -1.51 0.00 0.00 177.10 175.95 2wmq s LEU 144 N -0.34 4.54 -0.07 0.60 0.20 -1.26 -1.00 118.68 121.34 2wmq s LEU 144 Ca 0.49 1.65 -0.01 0.00 0.69 0.00 0.00 54.13 56.95 2wmq s LEU 144 Cb -0.29 -3.43 0.03 0.00 -0.43 0.00 0.00 46.19 42.07 2wmq s LEU 144 CO 0.35 0.15 -0.02 -0.54 -0.29 0.00 0.00 176.35 176.00 2wmq s LYS 145 N -1.37 0.78 -0.01 1.98 -0.14 0.22 -4.38 119.74 116.82 2wmq s LYS 145 Ca 0.39 0.03 -0.30 0.00 -1.36 0.00 0.00 55.97 54.72 2wmq s LYS 145 Cb -0.22 -1.05 -0.05 0.00 -1.68 0.00 0.00 37.83 34.83 2wmq s LYS 145 CO 0.26 -0.27 1.36 0.42 -0.76 0.00 0.00 175.35 176.36 2wmq s ILE 146 N 1.80 3.83 0.04 2.17 1.01 -0.43 -0.58 121.20 129.04 2wmq s ILE 146 Ca 0.03 1.20 0.05 0.00 0.00 0.00 0.00 60.65 61.93 2wmq s ILE 146 Cb -0.13 -3.77 -0.02 0.00 0.01 0.00 0.00 42.46 38.55 2wmq s ILE 146 CO -0.05 -0.00 -0.15 -0.55 0.00 0.00 0.00 174.94 174.18 2wmq s SER 147 N 1.81 1.82 0.00 3.58 0.15 -0.15 -1.36 113.70 119.54 2wmq s SER 147 Ca 0.62 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.79 2wmq s SER 147 Cb -0.30 -0.12 0.00 0.00 -1.71 0.00 0.00 66.02 63.89 2wmq s SER 147 CO 0.25 0.05 0.00 -0.67 1.20 0.00 0.00 173.24 174.08 2wmq n ASP 148 N 1.86 -1.41 -1.48 5.45 4.64 -1.26 -4.76 116.55 119.60 2wmq n ASP 148 Ca -0.18 0.00 0.08 0.00 -1.38 0.00 0.00 54.79 53.31 2wmq n ASP 148 Cb 0.54 -0.70 0.32 0.00 -1.04 0.00 0.00 41.12 40.24 2wmq n ASP 148 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 2wmq n PHE 149 N -0.18 1.39 0.30 -0.67 3.01 -1.26 -4.43 117.46 115.62 2wmq n PHE 149 Ca 0.00 -0.54 0.19 0.00 1.01 0.00 0.00 57.45 58.11 2wmq n PHE 149 Cb 0.00 -0.26 1.02 0.00 -0.01 0.00 0.00 39.48 40.24 2wmq n PHE 149 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2wmq h GLY 150 N 4.36 0.00 -0.93 1.37 0.00 -1.92 0.50 103.07 106.45 2wmq h GLY 150 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2wmq h GLY 150 CO 0.24 0.00 -0.12 1.04 0.00 0.00 0.00 176.54 177.70 2wmq n LEU 151 N -3.40 1.89 -4.77 3.11 4.77 -1.26 -4.90 117.00 112.44 2wmq n LEU 151 Ca -0.02 -0.90 -0.34 0.00 -0.03 0.00 0.00 56.01 54.72 2wmq n LEU 151 Cb 0.16 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.27 2wmq n LEU 151 CO 0.23 0.35 0.77 0.00 -1.33 0.00 0.00 177.39 177.41 2wmq s ALA 152 N -1.42 2.61 0.14 -1.18 0.00 0.17 -4.71 121.76 117.38 2wmq s ALA 152 Ca 0.15 0.75 -0.10 0.00 0.00 0.00 0.00 51.96 52.75 2wmq s ALA 152 Cb 0.12 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.88 2wmq s ALA 152 CO 0.25 -0.96 0.29 -0.08 0.00 0.00 0.00 175.76 175.26 2wmq s THR 153 N -1.94 0.08 -0.05 0.00 -1.32 -0.54 -4.94 115.64 106.93 2wmq s THR 153 Ca 0.71 -1.21 -0.26 0.00 -1.21 0.00 0.00 61.69 59.73 2wmq s THR 153 Cb -0.23 -1.62 -0.03 0.00 -1.51 0.00 0.00 72.50 69.10 2wmq s THR 153 CO 0.32 -0.38 0.79 -0.69 -2.21 0.00 0.00 174.62 172.45 2wmq s VAL 154 N -3.92 4.99 0.00 5.08 1.01 -1.26 -1.62 120.40 124.68 2wmq s VAL 154 Ca 0.12 1.64 0.00 0.00 0.00 0.00 0.00 61.98 63.74 2wmq s VAL 154 Cb 0.03 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.28 2wmq s VAL 154 CO -0.04 0.22 0.02 2.22 0.00 0.00 0.00 175.10 177.51 2wmq n PHE 155 N 3.84 0.00 -3.89 5.22 -1.74 0.05 -4.91 117.46 116.02 2wmq n PHE 155 Ca 0.01 0.00 -0.16 0.00 -0.56 0.00 0.00 57.45 56.74 2wmq n PHE 155 Cb 0.51 0.00 -0.16 0.00 1.52 0.00 0.00 39.48 41.35 2wmq n PHE 155 CO 0.00 0.00 0.00 0.50 -0.56 0.00 0.00 176.76 176.70 2wmq s ARG 156 N -0.96 0.21 -0.07 3.97 3.52 -1.15 -1.02 118.95 123.45 2wmq s ARG 156 Ca 0.00 0.10 -0.05 0.00 -0.13 0.00 0.00 55.73 55.65 2wmq s ARG 156 Cb 0.00 -0.41 0.03 0.00 -1.56 0.00 0.00 34.95 33.01 2wmq s ARG 156 CO 0.00 -0.14 0.18 -0.47 -0.81 0.00 0.00 175.30 174.06 2wmq s TYR 157 N 0.99 -0.21 -1.40 5.12 5.04 -0.68 -4.60 117.35 121.60 2wmq s TYR 157 Ca -0.09 0.52 -0.01 0.00 -2.44 0.00 0.00 57.07 55.04 2wmq s TYR 157 Cb -0.13 0.02 0.01 0.00 0.35 0.00 0.00 41.96 42.21 2wmq s TYR 157 CO -0.02 -0.14 0.51 0.09 -1.34 0.00 0.00 175.55 174.65 2wmq n ASN 158 N 3.53 -0.74 -1.85 4.32 3.02 -1.26 -1.26 115.26 121.01 2wmq n ASN 158 Ca -0.18 -0.96 -0.18 0.00 -0.03 0.00 0.00 54.58 53.22 2wmq n ASN 158 Cb 0.56 -3.26 -0.05 0.00 -0.61 0.00 0.00 39.78 36.42 2wmq n ASN 158 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2wmq n ASN 159 N -2.98 -4.85 -4.05 6.41 5.15 -1.26 -4.95 115.26 108.72 2wmq n ASN 159 Ca -0.28 0.30 -0.31 0.00 -0.60 0.00 0.00 54.58 53.69 2wmq n ASN 159 Cb 0.67 -4.24 -0.16 0.00 -0.53 0.00 0.00 39.78 35.51 2wmq n ASN 159 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 2wmq s ARG 160 N -4.08 2.48 0.13 1.20 6.06 -0.39 -5.11 118.95 119.23 2wmq s ARG 160 Ca 0.00 -0.63 -0.26 0.00 -2.50 0.00 0.00 55.73 52.34 2wmq s ARG 160 Cb 0.00 -2.20 -0.07 0.00 0.06 0.00 0.00 34.95 32.74 2wmq s ARG 160 CO 0.00 -0.20 0.80 -2.00 -2.50 0.00 0.00 175.30 171.41 2wmq s GLU 161 N 1.34 4.58 -0.19 5.12 2.12 -1.26 -1.69 118.70 128.72 2wmq s GLU 161 Ca 0.03 1.18 -0.01 0.00 0.36 0.00 0.00 54.97 56.53 2wmq s GLU 161 Cb -0.13 -3.30 0.00 0.00 0.26 0.00 0.00 34.13 30.96 2wmq s GLU 161 CO -0.10 0.45 -0.12 1.03 -0.54 0.00 0.00 175.26 175.98 2wmq s ARG 162 N -0.72 3.20 0.61 4.30 0.52 -0.19 -5.00 118.95 121.67 2wmq s ARG 162 Ca 0.38 -0.72 -0.18 0.00 -0.52 0.00 0.00 55.73 54.68 2wmq s ARG 162 Cb -0.23 -2.78 -0.03 0.00 0.52 0.00 0.00 34.95 32.44 2wmq s ARG 162 CO 0.26 -0.17 1.21 -0.51 0.02 0.00 0.00 175.30 176.12 2wmq s LEU 163 N 1.29 3.63 0.34 2.53 1.43 -1.26 -4.76 118.68 121.88 2wmq s LEU 163 Ca 0.04 2.39 -0.03 0.00 -1.03 0.00 0.00 54.13 55.50 2wmq s LEU 163 Cb -0.14 -4.60 -0.04 0.00 0.03 0.00 0.00 46.19 41.44 2wmq s LEU 163 CO -0.07 -1.67 0.59 -0.76 0.23 0.00 0.00 176.35 174.67 2wmq s LEU 164 N -4.18 3.98 0.00 1.79 1.43 0.32 -4.86 118.68 117.15 2wmq s LEU 164 Ca 0.77 0.65 0.00 0.00 -1.03 0.00 0.00 54.13 54.53 2wmq s LEU 164 Cb -0.31 -3.51 0.00 0.00 0.03 0.00 0.00 46.19 42.41 2wmq s LEU 164 CO 0.34 -0.29 0.00 -0.46 0.23 0.00 0.00 176.35 176.18 2wmq n ASN 165 N -1.43 0.00 -4.70 2.29 0.23 -1.26 -1.82 115.26 108.57 2wmq n ASN 165 Ca -0.02 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.60 2wmq n ASN 165 Cb 0.55 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.22 2wmq n ASN 165 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 2wmq s LYS 166 N 0.00 4.52 0.07 -3.83 1.02 -1.26 -4.87 119.74 115.38 2wmq s LYS 166 Ca 0.00 1.45 -0.30 0.00 0.02 0.00 0.00 55.97 57.14 2wmq s LYS 166 Cb 0.00 -3.47 -0.06 0.00 -0.52 0.00 0.00 37.83 33.78 2wmq s LYS 166 CO 0.00 -0.13 1.17 -1.64 -0.92 0.00 0.00 175.35 173.82 2wmq s MET 167 N 1.26 4.46 -0.06 1.68 -1.94 -1.26 -5.01 119.30 118.42 2wmq s MET 167 Ca 0.52 1.73 -0.16 0.00 -1.71 0.00 0.00 55.69 56.08 2wmq s MET 167 Cb -0.21 -3.35 0.03 0.00 2.01 0.00 0.00 34.83 33.31 2wmq s MET 167 CO 0.26 -0.20 0.37 0.00 -0.01 0.00 0.00 175.02 175.44 2wmq n GLY 169 N 1.78 0.02 2.65 0.00 0.00 -1.26 -4.94 105.19 103.44 2wmq n GLY 169 Ca -0.19 -1.82 -0.23 0.00 0.00 0.00 0.00 46.02 43.79 2wmq n GLY 169 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wmq s THR 170 N -0.16 -0.12 0.27 2.61 2.01 -1.26 -5.06 115.64 113.93 2wmq s THR 170 Ca 0.00 0.10 -0.04 0.00 0.31 0.00 0.00 61.69 62.06 2wmq s THR 170 Cb 0.00 -0.40 0.42 0.00 0.01 0.00 0.00 72.50 72.53 2wmq s THR 170 CO 0.00 -0.08 1.47 0.18 -0.69 0.00 0.00 174.62 175.51 2wmq n LEU 171 N 5.29 -0.25 0.27 4.42 4.77 -1.26 -0.42 117.00 129.81 2wmq n LEU 171 Ca -0.05 1.62 0.14 0.00 -0.03 0.00 0.00 56.01 57.68 2wmq n LEU 171 Cb 0.49 -0.53 0.73 0.00 -2.33 0.00 0.00 43.42 41.79 2wmq n LEU 171 CO 0.08 -1.58 0.97 -0.65 -1.33 0.00 0.00 177.39 174.88 2wmq h PRO 172 N 0.00 0.00 -0.01 3.23 0.11 -1.74 -2.90 132.00 130.69 2wmq h PRO 172 Ca 0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.61 2wmq h PRO 172 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2wmq h PRO 172 CO -0.94 0.10 -0.72 0.66 -0.21 0.00 0.00 178.00 176.89 2wmq n TYR 173 N -3.43 0.00 -2.80 0.65 4.01 0.44 -4.82 117.16 111.21 2wmq n TYR 173 Ca -0.01 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.36 2wmq n TYR 173 Cb 0.27 -0.04 -0.06 0.00 -0.31 0.00 0.00 39.34 39.19 2wmq n TYR 173 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2wmq s VAL 174 N -2.81 4.22 0.60 -0.72 0.11 -1.00 -3.74 120.40 117.06 2wmq s VAL 174 Ca 0.13 1.82 -0.15 0.00 -2.93 0.00 0.00 61.98 60.85 2wmq s VAL 174 Cb 0.17 -4.04 -0.03 0.00 -1.53 0.00 0.00 36.38 30.95 2wmq s VAL 174 CO 0.73 0.19 1.05 0.00 -3.33 0.00 0.00 175.10 173.75 2wmq s ALA 175 N -1.55 2.75 0.27 1.54 0.00 -1.26 -4.50 121.76 119.02 2wmq s ALA 175 Ca 0.48 0.33 -0.00 0.00 0.00 0.00 0.00 51.96 52.77 2wmq s ALA 175 Cb -0.19 -3.22 0.39 0.00 0.00 0.00 0.00 23.12 20.10 2wmq s ALA 175 CO 0.25 -0.83 1.77 -1.00 0.00 0.00 0.00 175.76 175.95 2wmq h PRO 176 N 0.30 0.71 -0.16 0.00 0.13 -1.87 -2.95 132.00 128.17 2wmq h PRO 176 Ca -0.46 -0.19 -0.03 0.00 -0.87 0.00 0.00 66.00 64.45 2wmq h PRO 176 Cb 1.22 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 2wmq h PRO 176 CO 0.58 0.75 -0.02 1.05 -0.23 0.00 0.00 178.00 180.12 2wmq h GLU 177 N 0.67 0.23 0.00 0.86 9.09 -1.92 -1.50 114.58 122.01 2wmq h GLU 177 Ca 0.13 -0.03 -0.00 0.00 0.05 0.00 0.00 59.36 59.50 2wmq h GLU 177 Cb 0.45 -0.04 -0.00 0.00 -1.65 0.00 0.00 28.75 27.51 2wmq h GLU 177 CO 0.02 0.27 -0.01 1.25 0.05 0.00 0.00 179.01 180.59 2wmq h LEU 178 N 0.23 0.00 0.00 3.06 6.46 -1.83 -1.23 115.31 122.00 2wmq h LEU 178 Ca 0.05 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.81 2wmq h LEU 178 Cb 0.20 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.13 2wmq h LEU 178 CO 0.01 0.01 -1.29 0.18 -0.62 0.00 0.00 178.44 176.73 2wmq n LEU 179 N -3.40 0.59 0.00 2.25 4.77 -0.57 -4.58 117.00 116.05 2wmq n LEU 179 Ca -0.03 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 2wmq n LEU 179 Cb 0.10 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2wmq n LEU 179 CO 0.24 0.11 0.18 2.29 -1.33 0.00 0.00 177.39 178.88 2wmq n LYS 180 N -1.86 -0.06 -5.06 3.23 2.85 -0.98 -5.05 118.16 111.24 2wmq n LYS 180 Ca 0.01 -0.41 -0.28 0.00 -1.05 0.00 0.00 58.31 56.58 2wmq n LYS 180 Cb 0.43 -0.74 -0.15 0.00 -0.65 0.00 0.00 35.03 33.92 2wmq n LYS 180 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 2wmq s ARG 181 N -0.11 1.79 0.28 -1.58 0.52 -0.50 -5.02 118.95 114.34 2wmq s ARG 181 Ca 0.00 -0.86 -0.01 0.00 -0.52 0.00 0.00 55.73 54.34 2wmq s ARG 181 Cb 0.00 -1.78 0.40 0.00 0.52 0.00 0.00 34.95 34.10 2wmq s ARG 181 CO 0.00 0.48 1.83 -0.09 0.02 0.00 0.00 175.30 177.54 2wmq h ARG 182 N 5.42 0.83 -3.84 3.54 2.43 -1.94 -3.45 114.38 117.37 2wmq h ARG 182 Ca -0.41 -0.17 -0.14 0.00 -0.81 0.00 0.00 59.98 58.45 2wmq h ARG 182 Cb 1.14 -0.13 -0.19 0.00 -0.42 0.00 0.00 29.97 30.37 2wmq h ARG 182 CO 0.47 0.74 -0.58 -1.21 -1.51 0.00 0.00 179.97 177.88 2wmq s GLU 183 N -5.22 0.49 0.22 0.20 2.02 -1.26 -4.50 118.70 110.64 2wmq s GLU 183 Ca -0.10 -0.69 -0.21 0.00 0.02 0.00 0.00 54.97 53.99 2wmq s GLU 183 Cb 0.16 0.19 0.04 0.00 0.10 0.00 0.00 34.13 34.61 2wmq s GLU 183 CO 0.80 -0.11 0.63 -0.59 0.02 0.00 0.00 175.26 176.01 2wmq s PHE 184 N -2.18 -0.30 0.41 1.61 -0.12 -0.75 -4.96 117.98 111.69 2wmq s PHE 184 Ca -0.09 -0.04 -0.22 0.00 -0.05 0.00 0.00 56.93 56.53 2wmq s PHE 184 Cb -0.04 0.57 -0.10 0.00 -0.63 0.00 0.00 43.02 42.82 2wmq s PHE 184 CO -0.03 -1.02 0.97 -1.01 -0.05 0.00 0.00 175.22 174.08 2wmq s HIS 185 N -3.85 3.36 0.07 3.49 3.76 -1.26 -0.52 115.29 120.35 2wmq s HIS 185 Ca 0.07 1.65 -0.11 0.00 -0.15 0.00 0.00 55.06 56.52 2wmq s HIS 185 Cb -0.03 -2.92 -0.24 0.00 1.11 0.00 0.00 32.58 30.49 2wmq s HIS 185 CO -0.03 -0.18 1.16 0.00 -0.85 0.00 0.00 174.74 174.84 2wmq h ALA 186 N 2.23 0.09 0.08 -1.40 0.00 -1.96 -3.37 119.26 114.94 2wmq h ALA 186 Ca -0.48 -0.77 -0.00 0.00 0.00 0.00 0.00 54.91 53.65 2wmq h ALA 186 Cb 1.19 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2wmq h ALA 186 CO 0.62 0.76 -0.04 0.93 0.00 0.00 0.00 179.25 181.52 2wmq h GLU 187 N 0.24 -0.11 -0.23 0.00 5.08 -1.99 -2.76 114.58 114.81 2wmq h GLU 187 Ca -0.16 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.28 2wmq h GLU 187 Cb 1.85 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 31.11 2wmq h GLU 187 CO 0.22 0.23 0.19 -1.35 -1.00 0.00 0.00 179.01 177.30 2wmq h PRO 188 N -0.46 0.00 -0.54 2.33 0.11 -1.92 -0.29 132.00 131.23 2wmq h PRO 188 Ca -0.01 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.00 2wmq h PRO 188 Cb 0.39 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.48 2wmq h PRO 188 CO 0.02 0.00 -0.05 0.28 -0.21 0.00 0.00 178.00 178.04 2wmq h VAL 189 N 0.00 1.26 -0.07 3.15 2.07 -1.65 -0.09 116.25 120.93 2wmq h VAL 189 Ca 0.11 -1.17 -0.15 0.00 0.82 0.00 0.00 66.70 66.31 2wmq h VAL 189 Cb 0.49 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 2wmq h VAL 189 CO -0.00 0.42 -0.61 0.44 0.02 0.00 0.00 177.57 177.84 2wmq h ASP 190 N 0.88 0.27 -0.13 0.57 3.32 -0.92 -2.74 116.42 117.67 2wmq h ASP 190 Ca 0.15 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 2wmq h ASP 190 Cb 0.59 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.05 2wmq h ASP 190 CO 0.04 0.82 -0.00 0.58 -1.72 0.00 0.00 179.24 178.95 2wmq h VAL 191 N 0.18 1.26 -0.28 -1.35 2.07 -0.81 -2.19 116.25 115.13 2wmq h VAL 191 Ca -0.01 -0.84 0.06 0.00 0.82 0.00 0.00 66.70 66.74 2wmq h VAL 191 Cb 1.12 1.56 -0.06 0.00 -1.52 0.00 0.00 31.29 32.39 2wmq h VAL 191 CO 0.09 0.24 -0.14 -0.25 0.02 0.00 0.00 177.57 177.54 2wmq h TRP 192 N -0.04 -0.35 -0.76 1.57 2.91 -0.99 -1.78 115.95 116.51 2wmq h TRP 192 Ca 0.04 0.03 -0.03 0.00 1.13 0.00 0.00 58.89 60.05 2wmq h TRP 192 Cb 0.37 0.20 -0.03 0.00 -0.51 0.00 0.00 29.16 29.19 2wmq h TRP 192 CO 0.04 -0.21 0.34 0.66 -1.03 0.00 0.00 178.44 178.23 2wmq h SER 193 N -0.11 1.00 -0.50 2.65 4.64 -1.44 0.04 113.55 119.82 2wmq h SER 193 Ca 0.15 -0.13 0.04 0.00 -0.47 0.00 0.00 61.79 61.38 2wmq h SER 193 Cb 0.33 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 62.13 2wmq h SER 193 CO -0.35 0.86 0.34 0.00 -0.87 0.00 0.00 176.83 176.81 2wmq h GLY 195 N 0.55 0.66 1.32 0.00 0.00 -0.18 -1.05 103.07 104.36 2wmq h GLY 195 Ca 0.21 -0.48 0.02 0.00 0.00 0.00 0.00 47.33 47.08 2wmq h GLY 195 CO -0.05 0.44 0.43 -2.22 0.00 0.00 0.00 176.54 175.14 2wmq h ILE 196 N 0.42 1.14 -0.28 2.60 1.08 -0.90 0.30 117.51 121.87 2wmq h ILE 196 Ca 0.10 -0.29 -0.04 0.00 -0.39 0.00 0.00 64.86 64.24 2wmq h ILE 196 Cb 0.44 0.22 -0.01 0.00 -3.07 0.00 0.00 36.82 34.40 2wmq h ILE 196 CO 0.02 0.15 0.01 0.58 -0.69 0.00 0.00 178.15 178.22 2wmq h VAL 197 N 0.84 1.25 -0.93 1.67 2.07 -1.01 -1.09 116.25 119.05 2wmq h VAL 197 Ca 0.25 -0.90 0.03 0.00 0.82 0.00 0.00 66.70 66.90 2wmq h VAL 197 Cb -0.03 1.29 -0.05 0.00 -1.52 0.00 0.00 31.29 30.98 2wmq h VAL 197 CO -0.06 0.29 0.61 0.25 0.02 0.00 0.00 177.57 178.67 2wmq h LEU 198 N 0.28 1.01 -0.79 2.57 5.85 -0.51 0.43 115.31 124.16 2wmq h LEU 198 Ca 0.08 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2wmq h LEU 198 Cb 0.41 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 2wmq h LEU 198 CO 0.01 0.70 0.50 0.74 -0.34 0.00 0.00 178.44 180.05 2wmq h THR 199 N 1.18 1.21 -0.52 1.05 2.02 -0.77 -1.87 112.91 115.22 2wmq h THR 199 Ca 0.37 -0.43 -0.09 0.00 0.77 0.00 0.00 66.41 67.03 2wmq h THR 199 Cb -0.02 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.45 2wmq h THR 199 CO -0.11 0.21 -0.02 0.00 0.37 0.00 0.00 175.52 175.97 2wmq h ALA 200 N 1.27 0.98 0.00 6.16 0.00 0.16 -2.16 119.26 125.67 2wmq h ALA 200 Ca 0.29 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2wmq h ALA 200 Cb -0.08 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2wmq h ALA 200 CO -0.06 0.62 -0.39 0.52 0.00 0.00 0.00 179.25 179.94 2wmq h MET 201 N 0.82 0.00 -0.25 0.00 2.07 -0.51 -0.85 114.93 116.21 2wmq h MET 201 Ca 0.15 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.78 2wmq h MET 201 Cb 0.52 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.25 2wmq h MET 201 CO 0.03 0.39 0.00 1.28 1.07 0.00 0.00 176.91 179.67 2wmq n LEU 202 N -3.94 2.83 0.00 1.22 4.77 -0.74 -0.96 117.00 120.18 2wmq n LEU 202 Ca -0.02 -1.48 0.00 0.00 -0.03 0.00 0.00 56.01 54.48 2wmq n LEU 202 Cb 0.44 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 2wmq n LEU 202 CO 0.38 0.62 0.00 0.00 -1.33 0.00 0.00 177.39 177.06 2wmq n ALA 203 N 0.95 0.00 -1.42 -1.18 0.00 -0.84 -4.57 120.51 113.45 2wmq n ALA 203 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.43 2wmq n ALA 203 Cb 0.45 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.84 2wmq n ALA 203 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wmq n GLY 204 N 0.00 1.43 3.25 0.00 0.00 -0.33 -3.21 105.19 106.33 2wmq n GLY 204 Ca 0.00 -0.15 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 2wmq n GLY 204 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wmq s GLU 205 N -3.16 0.80 -0.02 1.61 -1.05 -1.26 -1.21 118.70 114.41 2wmq s GLU 205 Ca 0.00 -0.50 -0.19 0.00 -0.15 0.00 0.00 54.97 54.13 2wmq s GLU 205 Cb 0.00 0.35 -0.05 0.00 -0.44 0.00 0.00 34.13 33.98 2wmq s GLU 205 CO 0.00 -0.26 0.52 -0.51 0.95 0.00 0.00 175.26 175.97 2wmq s LEU 206 N -2.05 4.40 0.41 1.83 1.43 -1.26 -4.16 118.68 119.29 2wmq s LEU 206 Ca -0.05 1.04 0.16 0.00 -1.03 0.00 0.00 54.13 54.25 2wmq s LEU 206 Cb -0.01 -2.79 0.89 0.00 0.03 0.00 0.00 46.19 44.30 2wmq s LEU 206 CO -0.03 0.14 1.89 1.55 0.23 0.00 0.00 176.35 180.13 2wmq h PRO 207 N 5.62 0.00 -2.99 1.29 0.13 -1.92 -3.47 132.00 130.67 2wmq h PRO 207 Ca -0.46 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.68 2wmq h PRO 207 Cb 1.20 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.23 2wmq h PRO 207 CO 0.69 0.29 0.22 1.67 -0.23 0.00 0.00 178.00 180.64 2wmq s TRP 208 N -4.26 -0.43 -0.04 1.56 -2.14 -1.26 -4.69 118.94 107.69 2wmq s TRP 208 Ca -0.03 0.14 0.17 0.00 2.66 0.00 0.00 56.10 59.04 2wmq s TRP 208 Cb 0.14 0.61 0.33 0.00 -3.10 0.00 0.00 33.47 31.45 2wmq s TRP 208 CO 0.70 -0.97 1.57 -0.44 -2.66 0.00 0.00 176.95 175.15 2wmq h ASP 209 N 2.00 0.00 -2.91 -2.66 3.32 -1.92 -3.41 116.42 110.85 2wmq h ASP 209 Ca -0.29 0.00 0.22 0.00 0.02 0.00 0.00 57.03 56.97 2wmq h ASP 209 Cb 1.29 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 40.55 2wmq h ASP 209 CO 0.33 0.44 0.90 0.00 -1.72 0.00 0.00 179.24 179.19 2wmq s GLN 210 N -3.21 0.10 -0.12 3.56 -2.07 -1.26 -2.64 119.66 114.02 2wmq s GLN 210 Ca 0.03 0.05 -0.05 0.00 -1.82 0.00 0.00 55.36 53.56 2wmq s GLN 210 Cb 0.09 0.05 -0.17 0.00 -1.09 0.00 0.00 33.01 31.88 2wmq s GLN 210 CO 0.72 -0.03 3.33 -0.35 -1.32 0.00 0.00 175.29 177.64 2wmq n PRO 211 N 0.85 2.07 -4.02 9.60 -0.04 -1.26 -4.77 135.00 137.42 2wmq n PRO 211 Ca -0.04 -1.32 -0.23 0.00 -0.04 0.00 0.00 63.50 61.88 2wmq n PRO 211 Cb 0.58 -2.00 -0.03 0.00 -0.04 0.00 0.00 33.50 32.01 2wmq n PRO 211 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2wmq s SER 212 N 1.55 5.98 0.34 3.54 1.04 -1.26 -4.58 113.70 120.31 2wmq s SER 212 Ca 0.62 -0.04 0.05 0.00 0.48 0.00 0.00 55.95 57.06 2wmq s SER 212 Cb 0.32 -1.68 0.62 0.00 0.10 0.00 0.00 66.02 65.39 2wmq s SER 212 CO -0.06 -0.02 1.89 0.44 0.98 0.00 0.00 173.24 176.47 2wmq h ASP 213 N 1.58 0.49 0.00 7.02 5.19 -1.98 -1.80 116.42 126.93 2wmq h ASP 213 Ca -0.50 -0.09 0.00 0.00 -0.62 0.00 0.00 57.03 55.83 2wmq h ASP 213 Cb 1.22 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.61 2wmq h ASP 213 CO 0.62 0.55 0.06 0.77 -3.12 0.00 0.00 179.24 178.12 2wmq h SER 214 N 0.51 0.00 -3.47 6.45 4.64 -1.95 -3.41 113.55 116.31 2wmq h SER 214 Ca 0.11 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.83 2wmq h SER 214 Cb 0.31 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.30 2wmq h SER 214 CO 0.01 0.00 0.48 0.00 -0.87 0.00 0.00 176.83 176.45 2wmq h GLN 216 N 8.34 0.49 -0.24 0.00 5.75 -1.86 -1.89 115.11 125.70 2wmq h GLN 216 Ca -0.24 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.20 2wmq h GLN 216 Cb 1.09 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 29.51 2wmq h GLN 216 CO 0.93 0.32 0.01 0.93 -2.65 0.00 0.00 178.83 178.38 2wmq h GLU 217 N 0.50 0.36 0.02 1.69 3.07 -1.92 0.09 114.58 118.39 2wmq h GLU 217 Ca 0.23 -0.06 -0.21 0.00 -0.50 0.00 0.00 59.36 58.82 2wmq h GLU 217 Cb 0.14 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 27.97 2wmq h GLU 217 CO -0.16 0.38 -0.98 -0.92 -1.40 0.00 0.00 179.01 175.93 2wmq h TYR 218 N 0.35 0.12 -0.34 4.33 3.20 -1.74 -2.94 116.97 119.96 2wmq h TYR 218 Ca 0.08 -0.08 -0.13 0.00 3.14 0.00 0.00 58.73 61.75 2wmq h TYR 218 Cb 0.22 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.47 2wmq h TYR 218 CO 0.01 1.00 -0.30 0.77 -1.64 0.00 0.00 178.16 177.99 2wmq h SER 219 N 0.03 0.74 -0.62 -2.11 0.02 -0.51 -2.27 113.55 108.83 2wmq h SER 219 Ca -0.03 -0.30 -0.04 0.00 -0.84 0.00 0.00 61.79 60.58 2wmq h SER 219 Cb 1.69 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.99 2wmq h SER 219 CO 0.14 1.00 0.24 0.44 -1.14 0.00 0.00 176.83 177.51 2wmq h ASP 220 N 0.61 0.87 -0.61 3.07 3.45 -1.01 -1.78 116.42 121.02 2wmq h ASP 220 Ca 0.07 -0.18 -0.05 0.00 0.43 0.00 0.00 57.03 57.30 2wmq h ASP 220 Cb 0.82 -0.22 -0.03 0.00 -0.56 0.00 0.00 39.33 39.34 2wmq h ASP 220 CO 0.07 0.81 0.17 -0.25 -1.57 0.00 0.00 179.24 178.47 2wmq h TRP 221 N 0.87 0.99 0.00 4.55 2.91 -1.39 -0.89 115.95 123.00 2wmq h TRP 221 Ca 0.21 -0.11 -0.03 0.00 1.13 0.00 0.00 58.89 60.09 2wmq h TRP 221 Cb 0.22 -0.28 -0.00 0.00 -0.51 0.00 0.00 29.16 28.58 2wmq h TRP 221 CO 0.01 0.83 -0.14 0.87 -1.03 0.00 0.00 178.44 178.98 2wmq h LYS 222 N 0.87 0.00 -0.13 2.65 1.57 -1.14 -0.37 116.57 120.03 2wmq h LYS 222 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2wmq h LYS 222 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2wmq h LYS 222 CO -0.00 0.14 0.00 0.39 -0.57 0.00 0.00 179.45 179.41 2wmq n GLU 223 N -4.13 1.77 -1.98 3.15 1.02 -0.60 -4.93 120.64 114.94 2wmq n GLU 223 Ca -0.02 -1.14 -0.10 0.00 -0.02 0.00 0.00 57.16 55.87 2wmq n GLU 223 Cb 0.22 -1.43 -0.01 0.00 -0.02 0.00 0.00 31.44 30.20 2wmq n GLU 223 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2wmq n LYS 224 N 0.37 -0.77 -1.54 3.49 4.76 -0.15 -4.92 118.16 119.41 2wmq n LYS 224 Ca 0.17 0.57 -0.42 0.00 -2.87 0.00 0.00 58.31 55.75 2wmq n LYS 224 Cb 0.36 -4.59 -0.02 0.00 -1.84 0.00 0.00 35.03 28.94 2wmq n LYS 224 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2wmq n LYS 225 N -2.13 2.40 -0.00 1.97 5.02 -0.45 -4.68 118.16 120.27 2wmq n LYS 225 Ca -0.11 -2.35 0.15 0.00 -2.02 0.00 0.00 58.31 53.98 2wmq n LYS 225 Cb 0.53 -3.16 0.78 0.00 -0.02 0.00 0.00 35.03 33.15 2wmq n LYS 225 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2wmq n THR 226 N 5.41 0.01 1.12 -0.18 -2.24 -1.26 -2.88 114.28 114.26 2wmq n THR 226 Ca 0.51 -0.07 0.14 0.00 -2.27 0.00 0.00 64.05 62.36 2wmq n THR 226 Cb 0.39 -0.21 0.65 0.00 -2.10 0.00 0.00 70.33 69.07 2wmq n THR 226 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wmq n TYR 227 N -0.65 0.00 -2.98 4.78 0.18 -1.26 -2.61 117.16 114.63 2wmq n TYR 227 Ca 0.21 0.00 -0.24 0.00 1.88 0.00 0.00 57.90 59.75 2wmq n TYR 227 Cb 0.17 -0.43 0.01 0.00 -0.38 0.00 0.00 39.34 38.70 2wmq n TYR 227 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2wmq s LEU 228 N -2.88 3.70 0.52 -3.48 1.43 -1.14 -4.60 118.68 112.23 2wmq s LEU 228 Ca 0.18 0.47 -0.20 0.00 -1.03 0.00 0.00 54.13 53.55 2wmq s LEU 228 Cb 0.19 -3.35 -0.07 0.00 0.03 0.00 0.00 46.19 43.00 2wmq s LEU 228 CO 0.51 -0.61 1.11 0.20 0.23 0.00 0.00 176.35 177.79 2wmq s ASN 229 N -4.16 5.93 0.00 2.29 0.01 -1.26 -1.11 114.94 116.63 2wmq s ASN 229 Ca 0.47 2.13 0.29 0.00 -0.71 0.00 0.00 52.86 55.04 2wmq s ASN 229 Cb -0.10 -2.58 1.30 0.00 0.41 0.00 0.00 41.25 40.28 2wmq s ASN 229 CO 0.39 -1.07 1.92 -0.81 -1.51 0.00 0.00 177.10 176.02 2wmq n PRO 230 N -1.11 0.47 0.13 -0.60 -0.04 -1.26 -4.86 135.00 127.73 2wmq n PRO 230 Ca 0.11 -0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 2wmq n PRO 230 Cb 0.51 -1.50 0.30 0.00 -0.04 0.00 0.00 33.50 32.77 2wmq n PRO 230 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2wmq h TRP 231 N 0.24 0.17 -0.46 0.54 4.06 -1.62 -1.91 115.95 116.98 2wmq h TRP 231 Ca 0.00 -0.04 0.07 0.00 2.06 0.00 0.00 58.89 60.98 2wmq h TRP 231 Cb 0.35 -0.04 -0.03 0.00 -1.00 0.00 0.00 29.16 28.45 2wmq h TRP 231 CO 0.00 0.49 0.31 -0.22 -3.56 0.00 0.00 178.44 175.46 2wmq h LYS 232 N 0.13 0.34 -0.00 0.49 3.64 -0.86 -1.36 116.57 118.94 2wmq h LYS 232 Ca 0.02 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2wmq h LYS 232 Cb 0.70 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 2wmq h LYS 232 CO 0.05 0.22 -0.02 1.63 -2.27 0.00 0.00 179.45 179.06 2wmq n LYS 233 N -4.47 0.73 -4.16 1.90 5.02 -0.72 -4.84 118.16 111.61 2wmq n LYS 233 Ca 0.06 -0.09 -0.34 0.00 -2.02 0.00 0.00 58.31 55.92 2wmq n LYS 233 Cb 0.27 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.67 2wmq n LYS 233 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2wmq s ILE 234 N -2.33 4.12 0.84 -0.18 1.01 -0.52 -4.86 121.20 119.28 2wmq s ILE 234 Ca 0.36 -0.26 -0.13 0.00 0.00 0.00 0.00 60.65 60.61 2wmq s ILE 234 Cb 0.21 -2.85 0.08 0.00 0.01 0.00 0.00 42.46 39.91 2wmq s ILE 234 CO 0.43 0.45 1.06 -0.67 0.00 0.00 0.00 174.94 176.20 2wmq n ASP 235 N 3.89 0.39 0.03 3.58 -0.08 -1.26 -4.74 116.55 118.36 2wmq n ASP 235 Ca -0.17 0.53 -0.00 0.00 -1.51 0.00 0.00 54.79 53.64 2wmq n ASP 235 Cb 0.52 -1.45 0.30 0.00 2.34 0.00 0.00 41.12 42.84 2wmq n ASP 235 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 2wmq h SER 236 N -1.13 0.42 0.39 1.67 4.64 -1.98 -2.19 113.55 115.36 2wmq h SER 236 Ca -0.45 -0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 60.76 2wmq h SER 236 Cb 1.30 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2wmq h SER 236 CO 0.43 0.55 -0.19 0.00 -0.87 0.00 0.00 176.83 176.75 2wmq h ALA 237 N 1.51 -0.52 -0.68 5.18 0.00 -2.00 -0.98 119.26 121.76 2wmq h ALA 237 Ca 0.09 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.84 2wmq h ALA 237 Cb 0.40 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 2wmq h ALA 237 CO 0.02 -0.68 0.44 -1.35 0.00 0.00 0.00 179.25 177.68 2wmq h PRO 238 N -0.74 0.85 -0.44 0.00 0.11 -1.92 -2.65 132.00 127.20 2wmq h PRO 238 Ca -0.05 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.00 2wmq h PRO 238 Cb 0.51 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.41 2wmq h PRO 238 CO 0.09 0.56 0.24 1.25 -0.21 0.00 0.00 178.00 179.93 2wmq h LEU 239 N 0.87 0.52 -1.51 2.35 5.85 -1.35 -0.52 115.31 121.53 2wmq h LEU 239 Ca 0.26 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 2wmq h LEU 239 Cb -0.03 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 2wmq h LEU 239 CO -0.08 0.42 0.27 0.00 -0.34 0.00 0.00 178.44 178.71 2wmq h ALA 240 N 1.67 1.63 -0.08 1.25 0.00 -0.81 0.47 119.26 123.39 2wmq h ALA 240 Ca 0.16 -0.05 -0.22 0.00 0.00 0.00 0.00 54.91 54.79 2wmq h ALA 240 Cb 0.01 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.62 2wmq h ALA 240 CO -0.03 0.32 -0.84 1.25 0.00 0.00 0.00 179.25 179.96 2wmq h LEU 241 N 0.62 0.74 -1.26 0.00 5.85 -1.07 -2.86 115.31 117.33 2wmq h LEU 241 Ca 0.16 -0.52 -0.07 0.00 0.84 0.00 0.00 57.88 58.29 2wmq h LEU 241 Cb -0.03 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.77 2wmq h LEU 241 CO -0.03 1.30 -0.26 -0.07 -0.34 0.00 0.00 178.44 179.05 2wmq h LEU 242 N 0.39 0.18 -1.18 2.25 3.38 -0.63 0.15 115.31 119.84 2wmq h LEU 242 Ca -0.06 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 2wmq h LEU 242 Cb 1.46 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 42.14 2wmq h LEU 242 CO 0.16 0.44 0.01 0.45 0.09 0.00 0.00 178.44 179.59 2wmq h HIS 243 N 0.17 0.60 0.06 1.13 3.86 -0.85 -0.32 115.15 119.79 2wmq h HIS 243 Ca 0.03 -0.06 -0.24 0.00 -1.16 0.00 0.00 60.37 58.94 2wmq h HIS 243 Cb 0.55 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.83 2wmq h HIS 243 CO 0.01 0.57 -1.09 0.87 0.86 0.00 0.00 177.93 179.15 2wmq h LYS 244 N 0.55 0.16 0.00 2.45 1.57 -0.93 -3.37 116.57 117.00 2wmq h LYS 244 Ca 0.12 -0.25 -0.00 0.00 -1.87 0.00 0.00 60.65 58.65 2wmq h LYS 244 Cb 0.34 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.74 2wmq h LYS 244 CO 0.01 1.09 -0.00 0.82 -0.57 0.00 0.00 179.45 180.80 2wmq h ILE 245 N 0.05 1.80 -0.08 1.86 2.04 -0.66 -2.79 117.51 119.73 2wmq h ILE 245 Ca -0.07 -2.34 -0.22 0.00 1.00 0.00 0.00 64.86 63.22 2wmq h ILE 245 Cb 1.82 3.39 -0.07 0.00 -0.74 0.00 0.00 36.82 41.21 2wmq h ILE 245 CO 0.16 0.61 -0.23 0.18 0.00 0.00 0.00 178.15 178.88 2wmq n LEU 246 N -4.61 5.42 -4.72 1.44 4.77 -0.14 -4.65 117.00 114.51 2wmq n LEU 246 Ca -0.10 -3.27 -0.37 0.00 -0.03 0.00 0.00 56.01 52.23 2wmq n LEU 246 Cb 0.48 -1.41 -0.07 0.00 -2.33 0.00 0.00 43.42 40.09 2wmq n LEU 246 CO 0.34 1.71 0.08 -0.69 -1.33 0.00 0.00 177.39 177.51 2wmq s VAL 247 N 0.80 5.24 0.21 4.08 1.01 -1.26 -4.94 120.40 125.55 2wmq s VAL 247 Ca 0.67 0.75 -0.08 0.00 0.00 0.00 0.00 61.98 63.31 2wmq s VAL 247 Cb 0.32 -3.73 0.16 0.00 0.00 0.00 0.00 36.38 33.13 2wmq s VAL 247 CO -0.02 0.34 1.78 -0.08 0.00 0.00 0.00 175.10 177.12 2wmq h GLU 248 N 6.81 1.19 -6.48 2.72 4.81 -1.95 -3.40 114.58 118.28 2wmq h GLU 248 Ca -0.40 -0.22 -0.57 0.00 -0.13 0.00 0.00 59.36 58.04 2wmq h GLU 248 Cb 1.17 -0.19 -0.06 0.00 0.63 0.00 0.00 28.75 30.29 2wmq h GLU 248 CO 0.75 0.96 0.91 1.21 -0.73 0.00 0.00 179.01 182.11 2wmq s ASN 249 N -6.35 6.74 0.59 1.04 3.84 -1.26 -4.61 114.94 114.94 2wmq s ASN 249 Ca -0.12 0.85 0.32 0.00 0.21 0.00 0.00 52.86 54.11 2wmq s ASN 249 Cb 0.16 -2.55 1.86 0.00 -0.55 0.00 0.00 41.25 40.17 2wmq s ASN 249 CO 0.84 -1.08 2.24 1.55 -2.79 0.00 0.00 177.10 177.86 2wmq h PRO 250 N 8.86 0.00 0.00 0.43 0.13 -1.96 0.17 132.00 139.63 2wmq h PRO 250 Ca -0.23 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.81 2wmq h PRO 250 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 2wmq h PRO 250 CO 1.07 0.02 -0.43 0.77 -0.23 0.00 0.00 178.00 179.21 2wmq h SER 251 N 0.00 0.00 0.68 1.44 0.02 -1.94 -3.16 113.55 110.59 2wmq h SER 251 Ca -0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2wmq h SER 251 Cb 0.07 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.61 2wmq h SER 251 CO 0.00 0.43 -1.33 0.00 -1.14 0.00 0.00 176.83 174.80 2wmq n ALA 252 N -2.37 2.61 -1.73 3.77 0.00 0.41 -4.95 120.51 118.25 2wmq n ALA 252 Ca -0.01 -0.33 -0.39 0.00 0.00 0.00 0.00 53.44 52.71 2wmq n ALA 252 Cb 0.50 -0.99 0.03 0.00 0.00 0.00 0.00 19.45 18.99 2wmq n ALA 252 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2wmq n ARG 253 N -2.54 1.82 -2.03 0.00 0.63 -0.18 -4.93 116.66 109.43 2wmq n ARG 253 Ca -0.01 0.66 -0.39 0.00 -0.92 0.00 0.00 57.85 57.18 2wmq n ARG 253 Cb 0.56 -2.53 -0.00 0.00 0.45 0.00 0.00 32.46 30.93 2wmq n ARG 253 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 2wmq s ILE 254 N -1.26 2.57 0.46 5.15 2.07 -1.05 -5.02 121.20 124.12 2wmq s ILE 254 Ca 0.67 0.51 0.01 0.00 -1.41 0.00 0.00 60.65 60.43 2wmq s ILE 254 Cb -0.44 -3.30 -0.00 0.00 0.13 0.00 0.00 42.46 38.85 2wmq s ILE 254 CO 0.53 0.07 0.67 0.42 -1.91 0.00 0.00 174.94 174.72 2wmq s THR 255 N -1.26 3.87 0.21 4.00 -4.23 -1.26 -4.92 115.64 112.05 2wmq s THR 255 Ca 0.57 -0.53 -0.09 0.00 -1.18 0.00 0.00 61.69 60.47 2wmq s THR 255 Cb -0.38 -3.43 0.16 0.00 1.34 0.00 0.00 72.50 70.19 2wmq s THR 255 CO 0.49 -0.30 1.83 0.40 -0.54 0.00 0.00 174.62 176.51 2wmq h ILE 256 N 0.38 1.24 -0.49 2.99 2.04 -1.98 0.28 117.51 121.97 2wmq h ILE 256 Ca -0.46 -0.58 0.01 0.00 1.00 0.00 0.00 64.86 64.83 2wmq h ILE 256 Cb 1.26 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 2wmq h ILE 256 CO 0.57 0.26 0.33 -0.65 0.00 0.00 0.00 178.15 178.65 2wmq h PRO 257 N 1.10 0.65 0.00 2.37 0.11 -2.00 -1.62 132.00 132.61 2wmq h PRO 257 Ca 0.28 -0.04 -0.16 0.00 0.11 0.00 0.00 66.00 66.19 2wmq h PRO 257 Cb 0.03 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 30.97 2wmq h PRO 257 CO -0.05 0.43 -0.76 -0.44 -0.21 0.00 0.00 178.00 176.97 2wmq h ASP 258 N 0.67 0.00 -0.64 -2.05 3.45 -1.73 -2.96 116.42 113.16 2wmq h ASP 258 Ca 0.18 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.62 2wmq h ASP 258 Cb -0.07 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 38.66 2wmq h ASP 258 CO -0.04 0.76 0.33 0.40 -1.57 0.00 0.00 179.24 179.12 2wmq h ILE 259 N 0.00 1.21 0.00 0.35 2.04 -0.38 -2.40 117.51 118.33 2wmq h ILE 259 Ca -0.01 -0.58 0.00 0.00 1.00 0.00 0.00 64.86 65.28 2wmq h ILE 259 Cb 1.42 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 2wmq h ILE 259 CO 0.10 0.25 0.00 0.11 0.00 0.00 0.00 178.15 178.60 2wmq h LYS 260 N 0.93 0.00 -0.01 2.37 1.57 -1.14 -1.71 116.57 118.58 2wmq h LYS 260 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 2wmq h LYS 260 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 2wmq h LYS 260 CO -0.03 0.00 -0.69 1.63 -0.57 0.00 0.00 179.45 179.78 2wmq n LYS 261 N -2.96 0.63 -1.84 3.15 5.02 -0.92 -4.81 118.16 116.43 2wmq n LYS 261 Ca -0.02 -0.51 -0.40 0.00 -2.02 0.00 0.00 58.31 55.36 2wmq n LYS 261 Cb 0.12 -1.49 0.01 0.00 -0.02 0.00 0.00 35.03 33.65 2wmq n LYS 261 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2wmq s ASP 262 N -2.72 6.03 0.17 4.39 -1.08 -0.65 -4.87 116.67 117.95 2wmq s ASP 262 Ca 0.14 2.91 -0.13 0.00 -0.52 0.00 0.00 52.55 54.95 2wmq s ASP 262 Cb 0.17 -2.65 0.08 0.00 -1.46 0.00 0.00 42.92 39.06 2wmq s ASP 262 CO 0.70 -1.07 1.78 -0.09 0.52 0.00 0.00 175.17 177.01 2wmq h ARG 263 N 2.51 0.82 -0.55 4.34 2.43 -1.94 -1.38 114.38 120.62 2wmq h ARG 263 Ca -0.51 -0.10 -0.08 0.00 -0.81 0.00 0.00 59.98 58.48 2wmq h ARG 263 Cb 1.26 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.63 2wmq h ARG 263 CO 0.62 0.64 0.02 2.35 -1.51 0.00 0.00 179.97 182.09 2wmq h TRP 264 N 0.79 1.04 -0.49 2.20 7.01 -1.92 -0.76 115.95 123.82 2wmq h TRP 264 Ca 0.21 -0.17 0.07 0.00 2.11 0.00 0.00 58.89 61.10 2wmq h TRP 264 Cb 0.06 -0.27 -0.03 0.00 -2.10 0.00 0.00 29.16 26.82 2wmq h TRP 264 CO -0.01 0.94 0.33 -0.92 -2.79 0.00 0.00 178.44 175.99 2wmq h TYR 265 N 0.84 0.39 -0.42 2.65 5.03 -1.77 -2.04 116.97 121.66 2wmq h TYR 265 Ca 0.16 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.48 2wmq h TYR 265 Cb 0.51 -0.13 0.00 0.00 1.55 0.00 0.00 36.73 38.66 2wmq h TYR 265 CO 0.04 0.21 0.00 0.09 -1.32 0.00 0.00 178.16 177.18 2wmq n ASN 266 N -4.47 3.38 -4.68 -2.11 3.02 -0.55 -4.95 115.26 104.89 2wmq n ASN 266 Ca 0.07 -1.95 -0.42 0.00 -0.03 0.00 0.00 54.58 52.24 2wmq n ASN 266 Cb 0.27 -0.27 -0.03 0.00 -0.61 0.00 0.00 39.78 39.14 2wmq n ASN 266 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2wmq s LYS 267 N -1.29 4.31 0.13 3.52 2.20 -0.32 -4.99 119.74 123.30 2wmq s LYS 267 Ca 0.37 1.70 -0.31 0.00 -0.36 0.00 0.00 55.97 57.36 2wmq s LYS 267 Cb 0.21 -3.63 -0.10 0.00 -1.51 0.00 0.00 37.83 32.81 2wmq s LYS 267 CO 0.29 -0.54 1.61 -2.14 -0.36 0.00 0.00 175.35 174.21 2wmq s PRO 268 N 2.65 4.20 0.00 4.03 0.02 -1.26 -5.03 135.00 139.61 2wmq s PRO 268 Ca 0.56 2.37 0.00 0.00 0.02 0.00 0.00 61.00 63.95 2wmq s PRO 268 Cb -0.24 -3.32 0.00 0.00 0.02 0.00 0.00 34.50 30.96 2wmq s PRO 268 CO 0.20 -0.66 0.07 1.28 -0.33 0.00 0.00 177.00 177.56