#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wwq n ARG 2 N 0.00 0.00 -0.19 1.43 5.12 -1.26 -1.03 116.66 120.74 2wwq n ARG 2 Ca 0.00 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.83 2wwq n ARG 2 Cb 0.00 0.00 0.01 0.00 -1.16 0.00 0.00 32.46 31.31 2wwq n ARG 2 CO 0.00 0.00 0.00 -0.39 -1.93 0.00 0.00 177.63 175.31 2wwq h VAL 3 N 0.00 1.25 0.00 1.55 -1.51 -1.97 -2.73 116.25 112.84 2wwq h VAL 3 Ca 0.00 -0.88 0.00 0.00 -1.23 0.00 0.00 66.70 64.59 2wwq h VAL 3 Cb 0.00 0.81 0.00 0.00 -2.13 0.00 0.00 31.29 29.97 2wwq h VAL 3 CO 0.00 0.32 0.00 0.00 -1.23 0.00 0.00 177.57 176.66 2wwq n ALA 4 N -2.40 2.01 -1.16 5.19 0.00 -0.19 -1.56 120.51 122.40 2wwq n ALA 4 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2wwq n ALA 4 Cb 0.24 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.62 2wwq n ALA 4 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2wwq n LYS 5 N -0.63 0.00 -2.82 0.00 4.76 -1.18 -4.80 118.16 113.48 2wwq n LYS 5 Ca 0.03 -0.06 -0.40 0.00 -2.87 0.00 0.00 58.31 55.01 2wwq n LYS 5 Cb 0.01 -0.42 -0.05 0.00 -1.84 0.00 0.00 35.03 32.73 2wwq n LYS 5 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2wwq s ALA 6 N 0.00 3.32 0.16 7.82 0.00 -0.60 -5.04 121.76 127.42 2wwq s ALA 6 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 51.96 52.45 2wwq s ALA 6 Cb 0.00 -3.16 0.00 0.00 0.00 0.00 0.00 23.12 19.96 2wwq s ALA 6 CO 0.00 0.08 0.00 -0.35 0.00 0.00 0.00 175.76 175.49 2wwq n PRO 7 N 2.39 3.78 0.00 0.00 -0.04 -1.26 -4.96 135.00 134.91 2wwq n PRO 7 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 2wwq n PRO 7 Cb 0.49 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.95 2wwq n PRO 7 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2wwq n VAL 9 N 0.00 0.00 -4.11 0.52 0.31 -1.26 -5.12 118.33 108.67 2wwq n VAL 9 Ca 0.00 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.07 2wwq n VAL 9 Cb 0.00 0.00 -0.17 0.00 -0.91 0.00 0.00 33.84 32.76 2wwq n VAL 9 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2wwq s VAL 10 N 0.00 1.07 0.62 2.52 1.01 -0.73 -4.86 120.40 120.03 2wwq s VAL 10 Ca 0.00 -0.35 -0.11 0.00 0.00 0.00 0.00 61.98 61.52 2wwq s VAL 10 Cb 0.00 -1.05 0.15 0.00 0.00 0.00 0.00 36.38 35.48 2wwq s VAL 10 CO 0.00 0.37 0.72 -0.81 0.00 0.00 0.00 175.10 175.38 2wwq n PRO 11 N 4.60 -1.32 -0.30 2.72 -0.04 -1.26 -4.38 135.00 135.02 2wwq n PRO 11 Ca -0.16 -1.13 0.11 0.00 -0.04 0.00 0.00 63.50 62.28 2wwq n PRO 11 Cb 0.50 -0.86 0.28 0.00 -0.04 0.00 0.00 33.50 33.39 2wwq n PRO 11 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wwq n ALA 12 N -3.72 2.40 0.45 0.55 0.00 -1.26 -3.77 120.51 115.16 2wwq n ALA 12 Ca -0.12 -1.10 0.12 0.00 0.00 0.00 0.00 53.44 52.34 2wwq n ALA 12 Cb 0.34 -0.94 0.46 0.00 0.00 0.00 0.00 19.45 19.31 2wwq n ALA 12 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wwq n GLY 13 N 1.52 -1.31 0.00 0.00 0.00 -1.26 -4.88 105.19 99.27 2wwq n GLY 13 Ca 0.21 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2wwq n GLY 13 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2wwq n VAL 14 N -2.15 0.00 -3.78 1.61 0.24 -1.25 -5.02 118.33 107.98 2wwq n VAL 14 Ca 0.03 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.23 2wwq n VAL 14 Cb 0.25 0.00 -0.04 0.00 -1.47 0.00 0.00 33.84 32.58 2wwq n VAL 14 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2wwq s ASP 15 N -0.06 -0.19 0.06 -1.34 2.15 -1.15 -4.99 116.67 111.14 2wwq s ASP 15 Ca 0.00 -0.56 0.00 0.00 0.43 0.00 0.00 52.55 52.42 2wwq s ASP 15 Cb 0.00 0.54 -0.03 0.00 -0.30 0.00 0.00 42.92 43.13 2wwq s ASP 15 CO 0.00 -1.01 -0.04 0.68 -0.17 0.00 0.00 175.17 174.63 2wwq s VAL 16 N -3.89 0.35 -0.42 1.11 -7.23 -1.26 -0.58 120.40 108.48 2wwq s VAL 16 Ca 0.11 -1.59 0.02 0.00 -1.81 0.00 0.00 61.98 58.70 2wwq s VAL 16 Cb 0.00 -1.22 0.14 0.00 0.56 0.00 0.00 36.38 35.86 2wwq s VAL 16 CO -0.03 -0.81 0.23 -0.75 -0.31 0.00 0.00 175.10 173.44 2wwq s LYS 17 N -3.17 1.12 0.33 4.82 2.20 -0.33 -4.83 119.74 119.87 2wwq s LYS 17 Ca 0.02 -1.86 -0.28 0.00 -0.36 0.00 0.00 55.97 53.49 2wwq s LYS 17 Cb 0.02 -2.09 -0.10 0.00 -1.51 0.00 0.00 37.83 34.15 2wwq s LYS 17 CO -0.06 -1.18 1.25 0.42 -0.36 0.00 0.00 175.35 175.43 2wwq s ILE 18 N 0.51 2.90 0.17 5.43 1.01 -1.26 -3.22 121.20 126.73 2wwq s ILE 18 Ca 0.18 0.89 -0.10 0.00 0.00 0.00 0.00 60.65 61.62 2wwq s ILE 18 Cb -0.23 -3.56 -0.00 0.00 0.01 0.00 0.00 42.46 38.67 2wwq s ILE 18 CO 0.00 0.20 0.32 0.20 0.00 0.00 0.00 174.94 175.66 2wwq s ASN 19 N -0.62 -0.00 0.00 3.58 -0.87 -1.19 -4.96 114.94 110.86 2wwq s ASN 19 Ca 0.49 -0.81 0.19 0.00 -1.57 0.00 0.00 52.86 51.15 2wwq s ASN 19 Cb -0.37 0.46 0.63 0.00 -0.02 0.00 0.00 41.25 41.94 2wwq s ASN 19 CO 0.49 -0.92 1.47 0.61 -2.57 0.00 0.00 177.10 176.19 2wwq n GLY 20 N -0.23 0.54 0.00 0.66 0.00 -1.26 -4.06 105.19 100.84 2wwq n GLY 20 Ca -0.08 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2wwq n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wwq n GLN 21 N 0.51 0.00 -4.31 1.61 0.00 -1.26 -4.84 117.38 109.09 2wwq n GLN 21 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 57.00 56.95 2wwq n GLN 21 Cb 0.36 -0.01 -0.11 0.00 0.00 0.00 0.00 30.24 30.47 2wwq n GLN 21 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 2wwq s VAL 22 N 0.00 1.71 -0.50 -0.39 1.01 -1.26 -2.06 120.40 118.91 2wwq s VAL 22 Ca 0.00 -1.84 -0.13 0.00 0.00 0.00 0.00 61.98 60.01 2wwq s VAL 22 Cb 0.00 -1.75 0.12 0.00 0.00 0.00 0.00 36.38 34.75 2wwq s VAL 22 CO 0.00 -0.31 0.42 0.27 0.00 0.00 0.00 175.10 175.48 2wwq s ILE 23 N -1.99 4.76 -0.19 2.22 -4.36 -1.26 -3.20 121.20 117.18 2wwq s ILE 23 Ca 0.13 -1.59 -0.08 0.00 -0.26 0.00 0.00 60.65 58.85 2wwq s ILE 23 Cb -0.06 -4.06 -0.04 0.00 1.25 0.00 0.00 42.46 39.54 2wwq s ILE 23 CO 0.06 -0.80 0.08 -0.89 0.24 0.00 0.00 174.94 173.63 2wwq s THR 24 N 1.50 4.99 0.23 8.37 2.01 -1.20 -4.75 115.64 126.79 2wwq s THR 24 Ca 0.04 0.04 0.06 0.00 0.31 0.00 0.00 61.69 62.14 2wwq s THR 24 Cb -0.28 -3.26 -0.03 0.00 0.01 0.00 0.00 72.50 68.94 2wwq s THR 24 CO 0.02 0.46 0.26 0.27 -0.69 0.00 0.00 174.62 174.93 2wwq s ILE 25 N 0.35 4.81 0.14 1.82 -0.00 -1.26 -1.18 121.20 125.87 2wwq s ILE 25 Ca 0.05 -1.17 -0.13 0.00 -0.00 0.00 0.00 60.65 59.40 2wwq s ILE 25 Cb -0.12 -3.58 0.01 0.00 -0.00 0.00 0.00 42.46 38.77 2wwq s ILE 25 CO -0.01 -0.30 0.34 -1.59 -0.00 0.00 0.00 174.94 173.38 2wwq s LYS 26 N -3.77 1.09 0.00 0.37 -2.85 0.26 -2.98 119.74 111.85 2wwq s LYS 26 Ca 0.33 -0.92 0.00 0.00 -1.00 0.00 0.00 55.97 54.38 2wwq s LYS 26 Cb -0.09 0.42 0.00 0.00 -2.06 0.00 0.00 37.83 36.10 2wwq s LYS 26 CO 0.26 -0.41 0.00 0.41 0.10 0.00 0.00 175.35 175.72 2wwq n GLY 27 N -0.20 -0.17 3.36 0.59 0.00 -1.26 -2.92 105.19 104.58 2wwq n GLY 27 Ca -0.13 -1.13 -0.27 0.00 0.00 0.00 0.00 46.02 44.50 2wwq n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wwq s LYS 28 N -2.00 1.32 0.00 1.61 -2.85 -1.26 -4.52 119.74 112.04 2wwq s LYS 28 Ca 0.00 -1.31 0.00 0.00 -1.00 0.00 0.00 55.97 53.66 2wwq s LYS 28 Cb 0.00 -1.69 0.00 0.00 -2.06 0.00 0.00 37.83 34.08 2wwq s LYS 28 CO 0.00 0.39 0.00 0.09 0.10 0.00 0.00 175.35 175.93 2wwq n ASN 29 N 0.85 -0.26 0.00 0.03 3.02 -1.26 -4.77 115.26 112.87 2wwq n ASN 29 Ca -0.18 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.37 2wwq n ASN 29 Cb 0.54 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 2wwq n ASN 29 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wwq n GLY 30 N -2.09 1.55 0.00 7.41 0.00 -1.26 -4.37 105.19 106.43 2wwq n GLY 30 Ca 0.00 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 43.87 2wwq n GLY 30 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2wwq n GLU 31 N -0.10 -3.02 0.00 1.61 0.28 -1.26 -4.42 120.64 113.73 2wwq n GLU 31 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2wwq n GLU 31 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 2wwq n GLU 31 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 2wwq n LEU 32 N 0.00 -0.73 -4.01 -1.84 7.94 -1.16 -5.01 117.00 112.20 2wwq n LEU 32 Ca 0.00 0.00 -0.24 0.00 -1.11 0.00 0.00 56.01 54.66 2wwq n LEU 32 Cb 0.00 0.68 -0.16 0.00 0.53 0.00 0.00 43.42 44.46 2wwq n LEU 32 CO 0.00 0.00 -0.46 -0.89 -1.11 0.00 0.00 177.39 174.93 2wwq s THR 33 N -1.60 1.06 -0.39 1.96 2.01 -1.26 -4.86 115.64 112.55 2wwq s THR 33 Ca 0.00 -0.44 0.03 0.00 0.31 0.00 0.00 61.69 61.60 2wwq s THR 33 Cb 0.00 -0.97 0.04 0.00 0.01 0.00 0.00 72.50 71.58 2wwq s THR 33 CO 0.00 0.34 0.71 0.54 -0.69 0.00 0.00 174.62 175.51 2wwq n ARG 34 N 3.81 0.20 -3.65 4.92 3.00 -1.26 -4.87 116.66 118.81 2wwq n ARG 34 Ca -0.23 -0.90 -0.36 0.00 -0.01 0.00 0.00 57.85 56.35 2wwq n ARG 34 Cb 0.52 -1.07 -0.06 0.00 0.00 0.00 0.00 32.46 31.85 2wwq n ARG 34 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 2wwq s THR 35 N -0.43 5.19 0.16 0.55 -4.23 -1.26 -5.09 115.64 110.53 2wwq s THR 35 Ca 0.05 0.43 0.00 0.00 -1.18 0.00 0.00 61.69 60.99 2wwq s THR 35 Cb 0.03 -3.61 -0.04 0.00 1.34 0.00 0.00 72.50 70.22 2wwq s THR 35 CO 0.04 0.43 0.05 -1.48 -0.54 0.00 0.00 174.62 173.12 2wwq s LEU 36 N -1.55 1.79 0.69 4.79 2.34 -1.26 -4.42 118.68 121.06 2wwq s LEU 36 Ca 0.27 -1.24 -0.16 0.00 0.06 0.00 0.00 54.13 53.06 2wwq s LEU 36 Cb -0.14 0.18 0.01 0.00 -0.56 0.00 0.00 46.19 45.68 2wwq s LEU 36 CO 0.15 -0.70 1.21 0.20 -1.06 0.00 0.00 176.35 176.15 2wwq s ASN 37 N -3.12 4.52 0.00 1.48 0.02 -0.87 -4.92 114.94 112.05 2wwq s ASN 37 Ca 0.27 2.38 0.00 0.00 -1.02 0.00 0.00 52.86 54.49 2wwq s ASN 37 Cb 0.07 -2.59 0.00 0.00 0.02 0.00 0.00 41.25 38.75 2wwq s ASN 37 CO 0.05 -2.04 0.00 -0.90 0.02 0.00 0.00 177.10 174.22 2wwq n ASP 38 N -2.35 0.00 -0.02 -1.22 5.68 -1.26 -4.95 116.55 112.43 2wwq n ASP 38 Ca 0.14 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.43 2wwq n ASP 38 Cb 0.50 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.48 2wwq n ASP 38 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2wwq n ALA 39 N 0.00 0.24 -3.09 2.12 0.00 -1.26 -5.05 120.51 113.46 2wwq n ALA 39 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 2wwq n ALA 39 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 2wwq n ALA 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2wwq s VAL 40 N 0.00 0.02 1.35 0.00 -7.23 -1.26 -1.64 120.40 111.64 2wwq s VAL 40 Ca 0.00 -0.20 -0.21 0.00 -1.81 0.00 0.00 61.98 59.76 2wwq s VAL 40 Cb 0.00 -0.34 0.34 0.00 0.56 0.00 0.00 36.38 36.94 2wwq s VAL 40 CO 0.00 -0.11 0.99 -1.61 -0.31 0.00 0.00 175.10 174.06 2wwq s GLU 41 N -0.34 -2.35 -0.16 4.82 2.02 -0.90 -4.58 118.70 117.21 2wwq s GLU 41 Ca -0.04 0.09 -0.01 0.00 0.02 0.00 0.00 54.97 55.02 2wwq s GLU 41 Cb -0.03 -1.45 0.05 0.00 0.10 0.00 0.00 34.13 32.80 2wwq s GLU 41 CO 0.01 -4.49 -0.01 0.08 0.02 0.00 0.00 175.26 170.87 2wwq s VAL 42 N -2.52 0.80 0.40 2.63 1.01 -1.26 -4.60 120.40 116.86 2wwq s VAL 42 Ca 0.69 -0.50 0.08 0.00 0.00 0.00 0.00 61.98 62.25 2wwq s VAL 42 Cb -0.12 -1.09 -0.06 0.00 0.00 0.00 0.00 36.38 35.11 2wwq s VAL 42 CO 0.58 0.03 0.10 -0.54 0.00 0.00 0.00 175.10 175.26 2wwq s LYS 43 N 1.76 2.12 0.18 2.72 -0.14 -0.93 -5.00 119.74 120.45 2wwq s LYS 43 Ca 0.01 -1.90 0.03 0.00 -1.36 0.00 0.00 55.97 52.75 2wwq s LYS 43 Cb -0.15 -1.87 -0.05 0.00 -1.68 0.00 0.00 37.83 34.07 2wwq s LYS 43 CO -0.07 -0.04 -0.05 -1.58 -0.76 0.00 0.00 175.35 172.85 2wwq s HIS 44 N -2.61 1.33 0.23 3.18 2.46 -1.26 -1.76 115.29 116.86 2wwq s HIS 44 Ca 0.38 -0.87 -0.07 0.00 0.47 0.00 0.00 55.06 54.97 2wwq s HIS 44 Cb 0.05 -0.73 -0.02 0.00 -0.13 0.00 0.00 32.58 31.74 2wwq s HIS 44 CO 0.21 -0.03 0.32 0.00 -2.47 0.00 0.00 174.74 172.76 2wwq s ALA 45 N -3.44 0.48 0.24 1.58 0.00 0.10 -4.75 121.76 115.96 2wwq s ALA 45 Ca 0.22 -1.30 -0.07 0.00 0.00 0.00 0.00 51.96 50.81 2wwq s ALA 45 Cb 0.04 1.23 0.24 0.00 0.00 0.00 0.00 23.12 24.63 2wwq s ALA 45 CO 0.04 -0.73 1.90 0.22 0.00 0.00 0.00 175.76 177.19 2wwq h ASP 46 N 2.41 1.03 0.00 0.00 3.58 -2.02 -3.29 116.42 118.13 2wwq h ASP 46 Ca -0.31 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.12 2wwq h ASP 46 Cb 1.25 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 42.05 2wwq h ASP 46 CO 0.44 0.73 -0.01 0.59 -2.88 0.00 0.00 179.24 178.11 2wwq n ASN 47 N -4.47 1.45 -3.75 2.28 4.13 -1.26 -4.97 115.26 108.68 2wwq n ASN 47 Ca 0.11 -1.79 -0.13 0.00 1.68 0.00 0.00 54.58 54.44 2wwq n ASN 47 Cb 0.03 -0.03 -0.10 0.00 -1.54 0.00 0.00 39.78 38.14 2wwq n ASN 47 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2wwq s THR 48 N -0.82 0.01 -0.62 3.41 2.01 -1.24 -1.78 115.64 116.60 2wwq s THR 48 Ca 0.02 -0.05 -0.18 0.00 0.31 0.00 0.00 61.69 61.79 2wwq s THR 48 Cb 0.01 -0.52 0.12 0.00 0.01 0.00 0.00 72.50 72.13 2wwq s THR 48 CO 0.00 -0.03 0.70 -0.22 -0.69 0.00 0.00 174.62 174.38 2wwq s LEU 49 N 0.03 5.65 0.38 4.42 2.96 -1.26 -0.72 118.68 130.14 2wwq s LEU 49 Ca -0.01 -1.66 -0.01 0.00 -0.22 0.00 0.00 54.13 52.23 2wwq s LEU 49 Cb -0.03 -2.28 -0.03 0.00 0.50 0.00 0.00 46.19 44.35 2wwq s LEU 49 CO 0.01 -1.02 0.61 -0.89 -1.32 0.00 0.00 176.35 173.74 2wwq s THR 50 N 2.25 5.05 -0.30 3.68 2.01 -0.72 -4.89 115.64 122.72 2wwq s THR 50 Ca 0.12 -0.29 -0.16 0.00 0.31 0.00 0.00 61.69 61.66 2wwq s THR 50 Cb -0.23 -3.86 0.17 0.00 0.01 0.00 0.00 72.50 68.59 2wwq s THR 50 CO 0.03 -0.64 1.06 0.72 -0.69 0.00 0.00 174.62 175.11 2wwq s PHE 51 N -2.43 -0.48 0.38 4.92 -0.71 -1.26 -2.19 117.98 116.21 2wwq s PHE 51 Ca 0.42 0.88 0.06 0.00 -1.04 0.00 0.00 56.93 57.25 2wwq s PHE 51 Cb -0.10 0.29 0.06 0.00 -1.21 0.00 0.00 43.02 42.05 2wwq s PHE 51 CO 0.38 -0.24 0.46 0.41 -1.34 0.00 0.00 175.22 174.89 2wwq n GLY 52 N 4.20 2.20 3.74 1.99 0.00 -1.26 -4.93 105.19 111.13 2wwq n GLY 52 Ca -0.13 -2.21 -0.41 0.00 0.00 0.00 0.00 46.02 43.27 2wwq n GLY 52 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wwq s PRO 53 N -3.67 4.69 0.31 1.61 0.04 -1.26 -2.12 135.00 134.61 2wwq s PRO 53 Ca 0.35 1.57 -0.29 0.00 0.04 0.00 0.00 61.00 62.66 2wwq s PRO 53 Cb -0.03 -3.31 -0.12 0.00 0.04 0.00 0.00 34.50 31.08 2wwq s PRO 53 CO 0.22 0.23 1.46 -2.13 0.04 0.00 0.00 177.00 176.82 2wwq n ARG 54 N 2.28 2.41 -3.58 4.56 0.63 -0.65 -4.56 116.66 117.75 2wwq n ARG 54 Ca 0.01 0.85 -0.32 0.00 -0.92 0.00 0.00 57.85 57.47 2wwq n ARG 54 Cb 0.47 -2.55 -0.05 0.00 0.45 0.00 0.00 32.46 30.79 2wwq n ARG 54 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2wwq s ASP 55 N 0.13 6.55 0.00 6.15 1.11 -1.26 -3.99 116.67 125.36 2wwq s ASP 55 Ca 0.61 0.72 0.00 0.00 0.18 0.00 0.00 52.55 54.06 2wwq s ASP 55 Cb -0.54 -2.14 0.00 0.00 1.07 0.00 0.00 42.92 41.30 2wwq s ASP 55 CO 0.55 0.02 0.00 0.61 1.18 0.00 0.00 175.17 177.53 2wwq n GLY 56 N 0.09 0.91 3.04 0.21 0.00 -1.26 -5.04 105.19 103.14 2wwq n GLY 56 Ca -0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 2wwq n GLY 56 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wwq s TYR 57 N -2.00 -0.31 -1.79 1.61 1.51 -1.26 -5.04 117.35 110.07 2wwq s TYR 57 Ca 0.00 0.75 0.15 0.00 -1.01 0.00 0.00 57.07 56.97 2wwq s TYR 57 Cb 0.00 0.04 0.09 0.00 -0.11 0.00 0.00 41.96 41.98 2wwq s TYR 57 CO 0.00 -0.23 0.94 0.00 -1.11 0.00 0.00 175.55 175.16 2wwq n ALA 58 N 4.21 2.64 -0.08 3.71 0.00 -1.26 -4.40 120.51 125.33 2wwq n ALA 58 Ca -0.25 -0.59 0.10 0.00 0.00 0.00 0.00 53.44 52.69 2wwq n ALA 58 Cb 0.53 -0.52 0.24 0.00 0.00 0.00 0.00 19.45 19.69 2wwq n ALA 58 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2wwq n ASP 59 N 0.61 3.46 0.00 0.00 9.92 -1.26 -4.69 116.55 124.59 2wwq n ASP 59 Ca 0.08 -1.97 0.14 0.00 -0.53 0.00 0.00 54.79 52.51 2wwq n ASP 59 Cb 0.37 -0.33 0.75 0.00 -0.64 0.00 0.00 41.12 41.27 2wwq n ASP 59 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2wwq n GLY 60 N 1.29 -1.03 0.04 0.44 0.00 -1.26 -2.45 105.19 102.21 2wwq n GLY 60 Ca 0.19 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.18 2wwq n GLY 60 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2wwq n TRP 61 N -1.15 0.33 -0.19 1.61 7.02 -1.26 -2.51 117.44 121.30 2wwq n TRP 61 Ca 0.17 0.10 -0.06 0.00 -1.02 0.00 0.00 57.50 56.68 2wwq n TRP 61 Cb 0.16 -0.49 0.04 0.00 -2.42 0.00 0.00 31.31 28.59 2wwq n TRP 61 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2wwq h ALA 62 N 2.66 0.70 0.00 6.99 0.00 -1.86 -2.94 119.26 124.81 2wwq h ALA 62 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2wwq h ALA 62 Cb 0.67 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2wwq h ALA 62 CO 0.00 0.09 0.00 1.04 0.00 0.00 0.00 179.25 180.38 2wwq n GLN 63 N -4.74 0.20 -0.10 0.00 3.00 -1.21 -3.66 117.38 110.87 2wwq n GLN 63 Ca 0.04 0.36 -0.16 0.00 -0.01 0.00 0.00 57.00 57.23 2wwq n GLN 63 Cb 0.05 -1.84 -0.07 0.00 0.00 0.00 0.00 30.24 28.37 2wwq n GLN 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2wwq n ALA 64 N -1.77 0.75 -0.24 -1.58 0.00 -1.04 -1.72 120.51 114.91 2wwq n ALA 64 Ca 0.03 -0.59 0.15 0.00 0.00 0.00 0.00 53.44 53.03 2wwq n ALA 64 Cb 0.28 -0.21 0.45 0.00 0.00 0.00 0.00 19.45 19.96 2wwq n ALA 64 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2wwq h GLY 65 N -1.00 1.02 0.00 0.00 0.00 -1.68 -0.25 103.07 101.15 2wwq h GLY 65 Ca -0.26 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.83 2wwq h GLY 65 CO -0.16 0.04 0.00 2.41 0.00 0.00 0.00 176.54 178.84 2wwq n THR 66 N -4.54 0.00 -0.37 4.70 -1.04 -1.24 -3.43 114.28 108.36 2wwq n THR 66 Ca 0.18 1.48 0.29 0.00 -2.04 0.00 0.00 64.05 63.96 2wwq n THR 66 Cb 0.57 -2.47 0.56 0.00 -1.82 0.00 0.00 70.33 67.17 2wwq n THR 66 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wwq h ALA 67 N -1.97 2.41 -0.68 2.41 0.00 -0.74 -2.61 119.26 118.08 2wwq h ALA 67 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2wwq h ALA 67 Cb 0.00 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2wwq h ALA 67 CO 0.00 -0.94 0.00 -2.13 0.00 0.00 0.00 179.25 176.18 2wwq n ARG 68 N -4.70 0.00 0.27 0.00 0.63 -0.16 -2.29 116.66 110.40 2wwq n ARG 68 Ca 0.31 0.53 0.11 0.00 -0.92 0.00 0.00 57.85 57.89 2wwq n ARG 68 Cb 1.12 -1.39 0.74 0.00 0.45 0.00 0.00 32.46 33.39 2wwq n ARG 68 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2wwq h ALA 69 N -1.77 1.69 0.00 5.13 0.00 -1.52 -2.02 119.26 120.77 2wwq h ALA 69 Ca 0.00 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 2wwq h ALA 69 Cb 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2wwq h ALA 69 CO 0.00 0.05 -0.57 1.25 0.00 0.00 0.00 179.25 179.97 2wwq h LEU 70 N 0.00 0.00 0.00 0.00 5.85 -1.46 -2.93 115.31 116.77 2wwq h LEU 70 Ca -0.00 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 2wwq h LEU 70 Cb 0.08 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 2wwq h LEU 70 CO 0.00 0.57 -0.08 0.25 -0.34 0.00 0.00 178.44 178.85 2wwq h LEU 71 N 0.00 0.00 -1.32 2.25 5.85 -0.94 -3.37 115.31 117.79 2wwq h LEU 71 Ca -0.01 -0.58 0.00 0.00 0.84 0.00 0.00 57.88 58.13 2wwq h LEU 71 Cb 1.02 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.05 2wwq h LEU 71 CO 0.07 0.84 0.16 -0.55 -0.34 0.00 0.00 178.44 178.62 2wwq h ASN 72 N -1.00 0.00 0.43 1.25 -1.07 -1.58 -2.66 115.58 110.96 2wwq h ASN 72 Ca -0.02 0.00 -0.31 0.00 0.07 0.00 0.00 56.30 56.05 2wwq h ASN 72 Cb 0.64 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.85 2wwq h ASN 72 CO -0.01 0.00 -1.72 0.77 0.07 0.00 0.00 177.43 176.54 2wwq h SER 73 N 0.00 0.14 -0.45 6.14 4.64 -1.68 -2.74 113.55 119.61 2wwq h SER 73 Ca 0.00 -0.29 -0.13 0.00 -0.47 0.00 0.00 61.79 60.90 2wwq h SER 73 Cb 0.32 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 2wwq h SER 73 CO 0.00 1.26 -0.23 0.24 -0.87 0.00 0.00 176.83 177.23 2wwq h MET 74 N 0.03 0.94 0.19 4.77 2.86 -1.67 -0.49 114.93 121.56 2wwq h MET 74 Ca -0.30 -0.42 0.00 0.00 -2.06 0.00 0.00 59.70 56.93 2wwq h MET 74 Cb 2.01 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 33.63 2wwq h MET 74 CO 0.09 1.08 -0.18 0.28 1.06 0.00 0.00 176.91 179.25 2wwq h VAL 75 N 0.78 0.61 -0.34 -2.22 2.07 -1.66 -0.79 116.25 114.70 2wwq h VAL 75 Ca 0.10 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.72 2wwq h VAL 75 Cb 0.80 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 2wwq h VAL 75 CO 0.07 0.00 0.27 0.40 0.02 0.00 0.00 177.57 178.33 2wwq h ILE 76 N -0.39 0.72 -0.38 4.57 2.04 -1.28 -2.52 117.51 120.27 2wwq h ILE 76 Ca -0.00 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.72 2wwq h ILE 76 Cb 0.37 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.24 2wwq h ILE 76 CO -0.04 0.00 -0.32 1.23 0.00 0.00 0.00 178.15 179.02 2wwq h GLY 77 N 0.00 0.92 -2.79 5.37 0.00 0.36 0.31 103.07 107.23 2wwq h GLY 77 Ca 0.16 -0.88 -0.14 0.00 0.00 0.00 0.00 47.33 46.47 2wwq h GLY 77 CO -0.00 0.80 0.18 3.33 0.00 0.00 0.00 176.54 180.85 2wwq n VAL 78 N -4.07 1.91 0.00 4.60 0.24 -0.85 -3.95 118.33 116.22 2wwq n VAL 78 Ca -0.01 -0.94 0.00 0.00 -2.04 0.00 0.00 64.34 61.35 2wwq n VAL 78 Cb 0.50 -0.53 0.00 0.00 -1.47 0.00 0.00 33.84 32.34 2wwq n VAL 78 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2wwq n THR 79 N -0.03 0.00 -3.99 3.34 -1.04 -1.15 -4.75 114.28 106.66 2wwq n THR 79 Ca 0.25 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 62.17 2wwq n THR 79 Cb 0.98 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 69.38 2wwq n THR 79 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2wwq s GLU 80 N -1.00 0.36 0.90 -2.82 0.41 0.11 -5.10 118.70 111.56 2wwq s GLU 80 Ca 0.00 -0.69 -0.15 0.00 -0.41 0.00 0.00 54.97 53.72 2wwq s GLU 80 Cb 0.00 0.13 0.22 0.00 -1.78 0.00 0.00 34.13 32.70 2wwq s GLU 80 CO 0.00 -0.06 0.82 0.41 -0.49 0.00 0.00 175.26 175.94 2wwq n GLY 81 N 1.38 -2.61 3.82 -1.39 0.00 -1.26 -3.91 105.19 101.22 2wwq n GLY 81 Ca -0.23 -1.50 -0.06 0.00 0.00 0.00 0.00 46.02 44.24 2wwq n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wwq s PHE 82 N -2.51 -0.10 -1.27 1.61 0.08 -1.02 -4.76 117.98 110.00 2wwq s PHE 82 Ca 0.53 -0.34 -0.01 0.00 0.12 0.00 0.00 56.93 57.24 2wwq s PHE 82 Cb -0.05 0.70 -0.00 0.00 -0.57 0.00 0.00 43.02 43.10 2wwq s PHE 82 CO 0.40 -1.11 0.77 2.41 -0.10 0.00 0.00 175.22 177.59 2wwq n THR 83 N -0.50 -4.94 -0.25 0.64 -1.04 -1.26 -2.25 114.28 104.68 2wwq n THR 83 Ca -0.05 -0.53 -0.06 0.00 -2.04 0.00 0.00 64.05 61.37 2wwq n THR 83 Cb 0.60 -4.12 0.05 0.00 -1.82 0.00 0.00 70.33 65.04 2wwq n THR 83 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 2wwq h LYS 84 N -1.86 0.95 -3.07 -2.82 1.79 -1.95 -3.34 116.57 106.27 2wwq h LYS 84 Ca -0.61 -0.11 0.04 0.00 -2.18 0.00 0.00 60.65 57.79 2wwq h LYS 84 Cb 1.35 -0.19 -0.05 0.00 -1.58 0.00 0.00 32.23 31.77 2wwq h LYS 84 CO 0.55 0.72 0.20 -1.59 -1.08 0.00 0.00 179.45 178.24 2wwq s LYS 85 N -5.84 1.83 -0.36 3.15 -2.85 -1.26 -2.77 119.74 111.64 2wwq s LYS 85 Ca -0.13 -1.08 0.07 0.00 -1.00 0.00 0.00 55.97 53.83 2wwq s LYS 85 Cb 0.14 0.60 0.18 0.00 -2.06 0.00 0.00 37.83 36.69 2wwq s LYS 85 CO 0.79 -0.83 0.58 -1.17 0.10 0.00 0.00 175.35 174.82 2wwq s LEU 86 N -2.95 -1.38 0.00 2.77 2.96 -0.17 -4.01 118.68 115.91 2wwq s LEU 86 Ca 0.13 -0.56 0.00 0.00 -0.22 0.00 0.00 54.13 53.48 2wwq s LEU 86 Cb -0.05 1.80 0.00 0.00 0.50 0.00 0.00 46.19 48.44 2wwq s LEU 86 CO 0.08 -0.23 0.00 0.00 -1.32 0.00 0.00 176.35 174.88 2wwq n GLN 87 N 4.74 0.51 -3.64 1.98 6.02 -0.27 -2.92 117.38 123.80 2wwq n GLN 87 Ca 0.09 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 57.01 2wwq n GLN 87 Cb 0.55 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 31.74 2wwq n GLN 87 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 2wwq s LEU 88 N 0.00 -0.47 0.04 1.08 2.34 -1.23 -2.87 118.68 117.56 2wwq s LEU 88 Ca 0.00 0.85 -0.14 0.00 0.06 0.00 0.00 54.13 54.91 2wwq s LEU 88 Cb 0.00 1.83 -0.06 0.00 -0.56 0.00 0.00 46.19 47.40 2wwq s LEU 88 CO 0.00 -0.14 0.42 -0.69 -1.06 0.00 0.00 176.35 174.88 2wwq s VAL 89 N 0.64 5.02 0.00 1.48 1.01 -1.25 -4.81 120.40 122.50 2wwq s VAL 89 Ca -0.01 0.75 0.00 0.00 0.00 0.00 0.00 61.98 62.72 2wwq s VAL 89 Cb -0.05 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.63 2wwq s VAL 89 CO -0.10 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.09 2wwq n GLY 90 N 1.49 -1.78 3.17 4.51 0.00 -1.26 -2.69 105.19 108.62 2wwq n GLY 90 Ca -0.12 -1.52 -0.11 0.00 0.00 0.00 0.00 46.02 44.28 2wwq n GLY 90 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2wwq s VAL 91 N -1.88 0.58 -0.03 1.61 -7.23 -1.26 -4.74 120.40 107.45 2wwq s VAL 91 Ca 0.00 -1.93 0.00 0.00 -1.81 0.00 0.00 61.98 58.24 2wwq s VAL 91 Cb 0.00 -1.78 0.00 0.00 0.56 0.00 0.00 36.38 35.16 2wwq s VAL 91 CO 0.00 -0.78 0.00 0.61 -0.31 0.00 0.00 175.10 174.62 2wwq n GLY 92 N -0.07 0.38 1.25 2.32 0.00 -1.26 -4.93 105.19 102.89 2wwq n GLY 92 Ca -0.11 -0.99 0.08 0.00 0.00 0.00 0.00 46.02 45.00 2wwq n GLY 92 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wwq n TYR 93 N -3.44 1.28 0.00 1.61 0.53 -1.26 -4.69 117.16 111.19 2wwq n TYR 93 Ca -0.00 -0.74 0.00 0.00 -1.02 0.00 0.00 57.90 56.14 2wwq n TYR 93 Cb 0.23 -0.32 0.00 0.00 -1.03 0.00 0.00 39.34 38.22 2wwq n TYR 93 CO 0.00 0.00 0.00 2.89 -1.02 0.00 0.00 176.86 178.73 2wwq n ARG 94 N 0.23 0.00 -3.90 -0.72 1.85 -1.24 -2.11 116.66 110.77 2wwq n ARG 94 Ca 0.23 0.00 -0.00 0.00 -1.00 0.00 0.00 57.85 57.07 2wwq n ARG 94 Cb 0.91 0.00 0.01 0.00 -1.05 0.00 0.00 32.46 32.34 2wwq n ARG 94 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2wwq s ALA 95 N -0.95 -2.00 0.16 2.89 0.00 -1.17 -4.54 121.76 116.17 2wwq s ALA 95 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 51.86 2wwq s ALA 95 Cb 0.00 0.78 0.00 0.00 0.00 0.00 0.00 23.12 23.90 2wwq s ALA 95 CO 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 175.76 174.66 2wwq n ALA 96 N -0.76 2.40 -3.12 0.00 0.00 -1.24 -4.49 120.51 113.30 2wwq n ALA 96 Ca -0.01 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.38 2wwq n ALA 96 Cb 0.59 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.07 2wwq n ALA 96 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wwq n VAL 97 N -2.98 -9.83 0.00 0.00 0.31 -1.05 -4.97 118.33 99.81 2wwq n VAL 97 Ca 0.00 -0.62 0.00 0.00 -0.01 0.00 0.00 64.34 63.71 2wwq n VAL 97 Cb 0.00 -6.80 0.00 0.00 -0.91 0.00 0.00 33.84 26.13 2wwq n VAL 97 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2wwq n LYS 98 N -2.26 0.00 0.02 5.55 5.02 -1.03 -4.96 118.16 120.50 2wwq n LYS 98 Ca -0.02 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.38 2wwq n LYS 98 Cb 0.54 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 35.43 2wwq n LYS 98 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wwq n GLY 99 N 4.64 -1.12 0.00 0.72 0.00 -1.26 -4.80 105.19 103.37 2wwq n GLY 99 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.57 2wwq n GLY 99 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2wwq n ASN 100 N -2.33 0.00 -4.87 1.61 0.23 -1.26 -5.00 115.26 103.65 2wwq n ASN 100 Ca -0.03 0.00 -0.32 0.00 -0.53 0.00 0.00 54.58 53.71 2wwq n ASN 100 Cb 0.55 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 38.20 2wwq n ASN 100 CO 0.00 0.00 0.00 0.68 -0.93 0.00 0.00 177.26 177.01 2wwq s VAL 101 N 0.00 5.14 -0.06 3.53 -7.23 -1.25 -1.40 120.40 119.13 2wwq s VAL 101 Ca 0.00 -0.40 -0.02 0.00 -1.81 0.00 0.00 61.98 59.75 2wwq s VAL 101 Cb 0.00 -3.45 0.03 0.00 0.56 0.00 0.00 36.38 33.52 2wwq s VAL 101 CO 0.00 0.22 0.02 -0.63 -0.31 0.00 0.00 175.10 174.40 2wwq s ILE 102 N -1.39 0.19 0.36 -0.62 1.01 -1.26 -2.48 121.20 117.02 2wwq s ILE 102 Ca 0.30 0.24 -0.11 0.00 0.00 0.00 0.00 60.65 61.07 2wwq s ILE 102 Cb -0.13 -0.39 -0.07 0.00 0.01 0.00 0.00 42.46 41.89 2wwq s ILE 102 CO 0.22 0.23 0.73 0.20 0.00 0.00 0.00 174.94 176.32 2wwq s ASN 103 N 2.03 6.59 -0.10 3.58 0.01 -1.25 -4.21 114.94 121.59 2wwq s ASN 103 Ca 0.05 1.13 -0.25 0.00 -0.71 0.00 0.00 52.86 53.08 2wwq s ASN 103 Cb -0.12 -2.32 0.06 0.00 0.41 0.00 0.00 41.25 39.28 2wwq s ASN 103 CO -0.04 -0.31 0.59 -0.76 -1.51 0.00 0.00 177.10 175.06 2wwq s LEU 104 N -3.53 -0.27 0.05 0.60 1.43 -1.26 -3.03 118.68 112.68 2wwq s LEU 104 Ca 0.51 0.77 0.08 0.00 -1.03 0.00 0.00 54.13 54.46 2wwq s LEU 104 Cb -0.10 2.15 -0.03 0.00 0.03 0.00 0.00 46.19 48.24 2wwq s LEU 104 CO 0.27 -0.45 -0.20 -0.55 0.23 0.00 0.00 176.35 175.66 2wwq s SER 105 N -0.71 3.70 -0.30 2.29 0.15 -0.90 -4.65 113.70 113.29 2wwq s SER 105 Ca -0.08 -0.48 0.19 0.00 0.70 0.00 0.00 55.95 56.29 2wwq s SER 105 Cb -0.02 -0.54 0.47 0.00 -1.71 0.00 0.00 66.02 64.22 2wwq s SER 105 CO 0.06 0.24 1.07 0.18 1.20 0.00 0.00 173.24 175.99 2wwq n LEU 106 N 1.47 1.18 -0.31 3.45 4.32 -1.26 -4.42 117.00 121.43 2wwq n LEU 106 Ca -0.16 -3.39 0.00 0.00 -0.02 0.00 0.00 56.01 52.44 2wwq n LEU 106 Cb 0.52 0.41 0.00 0.00 -1.62 0.00 0.00 43.42 42.74 2wwq n LEU 106 CO 0.26 1.37 0.00 0.61 -1.22 0.00 0.00 177.39 178.41 2wwq n GLY 107 N -0.38 0.97 3.55 -0.72 0.00 -1.26 -5.06 105.19 102.29 2wwq n GLY 107 Ca 0.06 -0.42 -0.40 0.00 0.00 0.00 0.00 46.02 45.26 2wwq n GLY 107 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wwq s PHE 108 N -2.62 3.22 0.04 1.61 2.99 -1.26 -4.94 117.98 117.02 2wwq s PHE 108 Ca 0.00 0.02 -0.20 0.00 0.00 0.00 0.00 56.93 56.75 2wwq s PHE 108 Cb 0.00 -2.59 -0.15 0.00 0.00 0.00 0.00 43.02 40.28 2wwq s PHE 108 CO 0.00 -0.36 1.30 0.77 -0.00 0.00 0.00 175.22 176.93 2wwq h SER 109 N 8.42 0.46 -3.80 1.36 0.02 -1.99 -3.44 113.55 114.58 2wwq h SER 109 Ca -0.31 -0.54 -0.48 0.00 -0.84 0.00 0.00 61.79 59.62 2wwq h SER 109 Cb 1.15 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.54 2wwq h SER 109 CO 0.66 0.91 0.32 -1.38 -1.14 0.00 0.00 176.83 176.19 2wwq s HIS 110 N -4.09 3.79 0.71 3.45 0.00 -1.26 -5.06 115.29 112.83 2wwq s HIS 110 Ca -0.14 1.78 -0.15 0.00 -3.00 0.00 0.00 55.06 53.55 2wwq s HIS 110 Cb 0.05 -2.91 0.03 0.00 -4.00 0.00 0.00 32.58 25.76 2wwq s HIS 110 CO 0.78 0.31 1.18 -1.25 -1.00 0.00 0.00 174.74 174.76 2wwq s PRO 111 N -1.75 2.31 -0.08 -0.38 0.04 -1.26 -5.07 135.00 128.82 2wwq s PRO 111 Ca 0.46 1.67 -0.01 0.00 0.04 0.00 0.00 61.00 63.16 2wwq s PRO 111 Cb -0.21 -1.86 0.03 0.00 0.04 0.00 0.00 34.50 32.50 2wwq s PRO 111 CO 0.26 -1.68 -0.01 0.14 0.04 0.00 0.00 177.00 175.75 2wwq s VAL 112 N -2.06 0.46 0.07 -0.36 -7.23 -1.26 -5.10 120.40 104.91 2wwq s VAL 112 Ca 0.72 0.07 -0.10 0.00 -1.81 0.00 0.00 61.98 60.87 2wwq s VAL 112 Cb -0.27 -0.60 0.00 0.00 0.56 0.00 0.00 36.38 36.08 2wwq s VAL 112 CO 0.44 0.27 0.22 -1.81 -0.31 0.00 0.00 175.10 173.91 2wwq s ASP 113 N 1.93 0.05 -0.11 4.85 -0.00 -1.26 -3.75 116.67 118.39 2wwq s ASP 113 Ca 0.05 -0.51 -0.00 0.00 -0.00 0.00 0.00 52.55 52.08 2wwq s ASP 113 Cb -0.12 0.34 0.02 0.00 -0.00 0.00 0.00 42.92 43.16 2wwq s ASP 113 CO -0.06 -0.68 -0.07 -2.28 -0.00 0.00 0.00 175.17 172.08 2wwq s HIS 114 N -3.41 1.40 -0.75 4.23 5.65 -1.26 -4.98 115.29 116.17 2wwq s HIS 114 Ca 0.01 -0.67 -0.26 0.00 0.25 0.00 0.00 55.06 54.39 2wwq s HIS 114 Cb 0.03 -1.18 0.04 0.00 -1.18 0.00 0.00 32.58 30.28 2wwq s HIS 114 CO -0.09 -0.49 1.25 -0.65 -0.65 0.00 0.00 174.74 174.11 2wwq s GLN 115 N 1.71 3.21 0.45 2.88 -0.21 -1.26 -3.81 119.66 122.63 2wwq s GLN 115 Ca 0.05 -0.37 -0.24 0.00 0.02 0.00 0.00 55.36 54.82 2wwq s GLN 115 Cb -0.13 -4.26 -0.07 0.00 1.00 0.00 0.00 33.01 29.55 2wwq s GLN 115 CO -0.08 -2.11 1.19 -0.51 -2.12 0.00 0.00 175.29 171.67 2wwq s LEU 116 N 5.47 4.06 1.49 2.90 1.43 -0.49 -5.00 118.68 128.52 2wwq s LEU 116 Ca 0.34 2.38 -0.24 0.00 -1.03 0.00 0.00 54.13 55.58 2wwq s LEU 116 Cb -0.09 -4.17 0.39 0.00 0.03 0.00 0.00 46.19 42.35 2wwq s LEU 116 CO 0.13 -0.91 0.89 -2.84 0.23 0.00 0.00 176.35 173.84 2wwq s PRO 117 N -2.59 -3.43 0.23 1.29 0.02 -1.26 -4.95 135.00 124.32 2wwq s PRO 117 Ca 0.62 0.11 -0.12 0.00 0.02 0.00 0.00 61.00 61.63 2wwq s PRO 117 Cb -0.31 -1.32 -0.08 0.00 0.02 0.00 0.00 34.50 32.82 2wwq s PRO 117 CO 0.38 -5.19 0.59 0.00 -0.33 0.00 0.00 177.00 172.45 2wwq s ALA 118 N -2.13 3.51 0.00 -1.55 0.00 -1.26 -4.52 121.76 115.82 2wwq s ALA 118 Ca 0.68 -0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.48 2wwq s ALA 118 Cb -0.13 -2.53 0.00 0.00 0.00 0.00 0.00 23.12 20.46 2wwq s ALA 118 CO 0.57 0.46 0.00 0.41 0.00 0.00 0.00 175.76 177.20 2wwq n GLY 119 N 0.05 1.58 3.65 0.00 0.00 -1.26 -5.06 105.19 104.14 2wwq n GLY 119 Ca -0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 46.02 45.88 2wwq n GLY 119 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2wwq s ILE 120 N -2.03 0.00 0.07 -0.61 1.10 -1.26 -3.09 121.20 115.38 2wwq s ILE 120 Ca 0.00 0.00 0.10 0.00 -0.51 0.00 0.00 60.65 60.24 2wwq s ILE 120 Cb 0.00 -1.00 -0.03 0.00 0.15 0.00 0.00 42.46 41.58 2wwq s ILE 120 CO 0.00 0.00 -0.26 0.42 -2.11 0.00 0.00 174.94 172.99 2wwq s THR 121 N 1.15 2.26 0.09 4.00 -4.23 -1.07 -4.95 115.64 112.89 2wwq s THR 121 Ca -0.08 -1.50 0.08 0.00 -1.18 0.00 0.00 61.69 59.01 2wwq s THR 121 Cb -0.03 -1.93 -0.04 0.00 1.34 0.00 0.00 72.50 71.84 2wwq s THR 121 CO -0.12 0.26 -0.15 0.00 -0.54 0.00 0.00 174.62 174.07 2wwq s ALA 122 N -0.91 2.76 -0.10 3.99 0.00 -1.26 -4.09 121.76 122.15 2wwq s ALA 122 Ca 0.13 -1.26 -0.30 0.00 0.00 0.00 0.00 51.96 50.53 2wwq s ALA 122 Cb -0.10 -0.78 0.12 0.00 0.00 0.00 0.00 23.12 22.36 2wwq s ALA 122 CO 0.04 0.60 0.96 -2.00 0.00 0.00 0.00 175.76 175.36 2wwq s GLU 123 N -1.93 0.68 0.20 0.00 -6.30 -1.06 -4.98 118.70 105.29 2wwq s GLU 123 Ca 0.18 -0.04 -0.23 0.00 -2.50 0.00 0.00 54.97 52.38 2wwq s GLU 123 Cb -0.11 0.31 0.05 0.00 0.00 0.00 0.00 34.13 34.39 2wwq s GLU 123 CO 0.10 -0.25 0.82 0.00 0.02 0.00 0.00 175.26 175.94 2wwq n PRO 125 N -0.44 1.19 -4.23 0.00 -0.04 -1.26 -5.02 135.00 125.19 2wwq n PRO 125 Ca -0.06 -0.07 -0.13 0.00 -0.04 0.00 0.00 63.50 63.20 2wwq n PRO 125 Cb 0.60 -1.31 -0.10 0.00 -0.04 0.00 0.00 33.50 32.65 2wwq n PRO 125 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2wwq s THR 126 N -2.79 0.81 -2.06 0.52 -4.23 -1.26 -5.05 115.64 101.58 2wwq s THR 126 Ca 0.01 -1.99 0.12 0.00 -1.18 0.00 0.00 61.69 58.64 2wwq s THR 126 Cb 0.11 -1.99 0.30 0.00 1.34 0.00 0.00 72.50 72.27 2wwq s THR 126 CO 0.67 -0.61 1.34 0.00 -0.54 0.00 0.00 174.62 175.48 2wwq n GLN 127 N -0.20 1.43 -0.54 3.99 6.02 -1.26 -3.83 117.38 122.98 2wwq n GLN 127 Ca -0.08 -0.66 0.06 0.00 -0.01 0.00 0.00 57.00 56.31 2wwq n GLN 127 Cb 0.62 -1.23 0.13 0.00 1.02 0.00 0.00 30.24 30.78 2wwq n GLN 127 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2wwq n THR 128 N -0.03 1.50 -3.60 5.09 -2.24 -1.26 -3.62 114.28 110.11 2wwq n THR 128 Ca 0.10 -2.18 -0.07 0.00 -2.27 0.00 0.00 64.05 59.63 2wwq n THR 128 Cb 0.18 0.04 -0.04 0.00 -2.10 0.00 0.00 70.33 68.40 2wwq n THR 128 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2wwq s GLU 129 N -2.23 0.40 -0.03 -0.78 2.12 -1.25 -3.50 118.70 113.43 2wwq s GLU 129 Ca 0.31 0.07 -0.01 0.00 0.36 0.00 0.00 54.97 55.70 2wwq s GLU 129 Cb 0.30 0.19 0.03 0.00 0.26 0.00 0.00 34.13 34.91 2wwq s GLU 129 CO -0.04 -0.13 0.06 0.42 -0.54 0.00 0.00 175.26 175.03 2wwq s ILE 130 N -1.23 -0.07 -0.28 -3.70 1.01 -1.15 -4.70 121.20 111.08 2wwq s ILE 130 Ca 0.03 0.25 0.01 0.00 0.00 0.00 0.00 60.65 60.94 2wwq s ILE 130 Cb -0.01 -0.12 0.08 0.00 0.01 0.00 0.00 42.46 42.42 2wwq s ILE 130 CO -0.02 0.10 0.02 -0.69 0.00 0.00 0.00 174.94 174.35 2wwq s VAL 131 N 1.30 1.50 -0.06 2.92 1.01 -0.11 -0.99 120.40 125.96 2wwq s VAL 131 Ca -0.07 -1.53 0.03 0.00 0.00 0.00 0.00 61.98 60.42 2wwq s VAL 131 Cb -0.13 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.31 2wwq s VAL 131 CO -0.04 -0.39 -0.15 -0.76 0.00 0.00 0.00 175.10 173.77 2wwq s LEU 132 N 1.35 1.79 -0.08 3.92 1.02 -1.11 -2.56 118.68 123.00 2wwq s LEU 132 Ca 0.03 -0.34 -0.01 0.00 0.02 0.00 0.00 54.13 53.82 2wwq s LEU 132 Cb -0.18 -0.93 -0.03 0.00 0.02 0.00 0.00 46.19 45.07 2wwq s LEU 132 CO -0.12 0.09 -0.01 -1.59 0.02 0.00 0.00 176.35 174.73 2wwq s LYS 133 N 0.41 2.96 0.18 1.70 -2.85 -1.25 -3.78 119.74 117.11 2wwq s LYS 133 Ca -0.11 -0.44 -0.07 0.00 -1.00 0.00 0.00 55.97 54.35 2wwq s LYS 133 Cb -0.14 -2.76 -0.02 0.00 -2.06 0.00 0.00 37.83 32.85 2wwq s LYS 133 CO 0.04 0.68 0.26 0.20 0.10 0.00 0.00 175.35 176.63 2wwq s GLY 134 N -0.84 0.77 -0.03 0.59 0.00 -0.96 -2.59 107.32 104.26 2wwq s GLY 134 Ca 0.13 -1.14 0.02 0.00 0.00 0.00 0.00 44.72 43.73 2wwq s GLY 134 CO 0.02 -0.98 -0.09 0.00 0.00 0.00 0.00 173.10 172.05 2wwq s ALA 135 N -4.03 0.90 0.00 3.20 0.00 -1.18 -2.44 121.76 118.21 2wwq s ALA 135 Ca 0.24 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.87 2wwq s ALA 135 Cb 0.04 -0.35 0.00 0.00 0.00 0.00 0.00 23.12 22.80 2wwq s ALA 135 CO 0.05 0.13 0.00 -0.25 0.00 0.00 0.00 175.76 175.69 2wwq n ASP 136 N 3.39 -1.13 0.05 0.00 8.00 -1.26 -4.67 116.55 120.92 2wwq n ASP 136 Ca -0.19 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.34 2wwq n ASP 136 Cb 0.54 -0.57 0.40 0.00 -0.02 0.00 0.00 41.12 41.47 2wwq n ASP 136 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2wwq h LYS 137 N 0.00 0.41 0.40 -1.24 3.64 -1.93 -2.67 116.57 115.18 2wwq h LYS 137 Ca 0.00 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 2wwq h LYS 137 Cb 0.00 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 2wwq h LYS 137 CO 0.00 0.38 -0.19 0.37 -2.27 0.00 0.00 179.45 177.73 2wwq h GLN 138 N 0.41 -0.52 -0.57 1.90 4.15 -1.95 -2.63 115.11 115.90 2wwq h GLN 138 Ca 0.10 0.04 0.06 0.00 0.77 0.00 0.00 58.65 59.61 2wwq h GLN 138 Cb 0.15 0.12 -0.08 0.00 0.21 0.00 0.00 27.48 27.87 2wwq h GLN 138 CO -0.01 -0.35 -0.49 0.28 -1.93 0.00 0.00 178.83 176.34 2wwq h VAL 139 N -0.77 0.00 -0.29 2.39 2.07 -1.83 -2.92 116.25 114.90 2wwq h VAL 139 Ca -0.06 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.53 2wwq h VAL 139 Cb 0.41 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.12 2wwq h VAL 139 CO 0.09 0.00 -0.14 0.16 0.02 0.00 0.00 177.57 177.70 2wwq h ILE 140 N -0.18 0.57 -0.65 4.57 3.07 -1.62 -2.91 117.51 120.36 2wwq h ILE 140 Ca 0.09 0.00 0.16 0.00 1.55 0.00 0.00 64.86 66.67 2wwq h ILE 140 Cb 0.43 0.57 -0.03 0.00 -0.27 0.00 0.00 36.82 37.52 2wwq h ILE 140 CO -0.64 0.00 0.45 1.23 -1.05 0.00 0.00 178.15 178.14 2wwq h GLY 141 N -0.10 0.24 0.19 0.16 0.00 -1.27 -1.50 103.07 100.80 2wwq h GLY 141 Ca 0.15 -0.06 -0.00 0.00 0.00 0.00 0.00 47.33 47.42 2wwq h GLY 141 CO -0.35 0.02 -0.01 1.46 0.00 0.00 0.00 176.54 177.66 2wwq h GLN 142 N 0.14 -0.03 0.00 4.80 4.20 -1.47 -1.71 115.11 121.04 2wwq h GLN 142 Ca 0.31 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.99 2wwq h GLN 142 Cb 1.03 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.82 2wwq h GLN 142 CO -0.04 0.69 -0.14 -0.39 -0.67 0.00 0.00 178.83 178.28 2wwq h VAL 143 N -0.84 0.92 -0.05 -0.54 -1.51 -1.55 -2.31 116.25 110.38 2wwq h VAL 143 Ca -0.00 -0.50 -0.00 0.00 -1.23 0.00 0.00 66.70 64.96 2wwq h VAL 143 Cb 0.73 1.28 -0.00 0.00 -2.13 0.00 0.00 31.29 31.18 2wwq h VAL 143 CO 0.01 0.13 0.01 0.00 -1.23 0.00 0.00 177.57 176.49 2wwq h ALA 144 N 1.86 0.07 -0.30 5.19 0.00 -1.28 -3.16 119.26 121.64 2wwq h ALA 144 Ca -0.00 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.82 2wwq h ALA 144 Cb 0.27 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2wwq h ALA 144 CO 0.02 -0.32 0.12 0.00 0.00 0.00 0.00 179.25 179.07 2wwq h ALA 145 N 0.81 0.35 -0.67 0.00 0.00 -0.73 -2.95 119.26 116.07 2wwq h ALA 145 Ca 0.02 0.02 0.19 0.00 0.00 0.00 0.00 54.91 55.14 2wwq h ALA 145 Cb 0.22 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2wwq h ALA 145 CO -0.00 -0.27 0.59 0.22 0.00 0.00 0.00 179.25 179.79 2wwq h ASP 146 N 0.27 0.00 0.00 0.00 -0.00 -1.48 -0.76 116.42 114.44 2wwq h ASP 146 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.16 2wwq h ASP 146 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.40 2wwq h ASP 146 CO -0.11 0.00 0.00 0.18 -0.00 0.00 0.00 179.24 179.31 2wwq n LEU 147 N -3.90 0.83 -0.08 2.28 4.77 -1.11 -3.71 117.00 116.08 2wwq n LEU 147 Ca 0.13 0.47 0.26 0.00 -0.03 0.00 0.00 56.01 56.84 2wwq n LEU 147 Cb 0.84 -0.22 0.71 0.00 -2.33 0.00 0.00 43.42 42.42 2wwq n LEU 147 CO 0.32 -0.22 1.23 0.08 -1.33 0.00 0.00 177.39 177.47 2wwq h ARG 148 N 0.00 0.00 0.00 3.23 0.11 -1.55 -1.28 114.38 114.90 2wwq h ARG 148 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2wwq h ARG 148 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 2wwq h ARG 148 CO 0.00 0.00 0.00 0.00 0.10 0.00 0.00 179.97 180.07 2wwq n ALA 149 N -2.50 1.91 0.32 0.08 0.00 -0.33 -3.38 120.51 116.61 2wwq n ALA 149 Ca 0.15 -0.07 -0.17 0.00 0.00 0.00 0.00 53.44 53.35 2wwq n ALA 149 Cb 0.90 -1.18 -0.09 0.00 0.00 0.00 0.00 19.45 19.08 2wwq n ALA 149 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2wwq h TYR 150 N 0.00 -0.76 -3.78 0.00 0.99 -1.34 -3.42 116.97 108.65 2wwq h TYR 150 Ca 0.00 -0.02 -0.39 0.00 2.00 0.00 0.00 58.73 60.32 2wwq h TYR 150 Cb 0.01 0.26 -0.31 0.00 1.00 0.00 0.00 36.73 37.69 2wwq h TYR 150 CO 0.00 -0.47 -0.77 1.03 -0.00 0.00 0.00 178.16 177.95 2wwq s ARG 151 N -6.07 0.75 0.54 4.88 0.52 -1.22 -5.11 118.95 113.24 2wwq s ARG 151 Ca -0.17 -0.22 -0.22 0.00 -0.52 0.00 0.00 55.73 54.60 2wwq s ARG 151 Cb 0.04 -0.73 -0.05 0.00 0.52 0.00 0.00 34.95 34.73 2wwq s ARG 151 CO 0.63 0.08 1.35 1.03 0.02 0.00 0.00 175.30 178.40 2wwq s ARG 152 N 0.23 3.20 0.69 3.54 0.52 -1.26 -2.84 118.95 123.04 2wwq s ARG 152 Ca -0.03 2.20 -0.16 0.00 -0.52 0.00 0.00 55.73 57.22 2wwq s ARG 152 Cb -0.08 -2.28 0.02 0.00 0.52 0.00 0.00 34.95 33.13 2wwq s ARG 152 CO 0.00 -1.13 1.23 -2.14 0.02 0.00 0.00 175.30 173.28 2wwq s PRO 153 N -2.88 2.36 0.08 3.54 0.02 -1.26 -4.44 135.00 132.42 2wwq s PRO 153 Ca 0.71 1.83 0.01 0.00 0.02 0.00 0.00 61.00 63.57 2wwq s PRO 153 Cb -0.40 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.23 2wwq s PRO 153 CO 0.47 -1.68 -0.06 -1.83 -0.33 0.00 0.00 177.00 173.57 2wwq s GLU 154 N -3.71 0.72 0.02 5.54 4.04 -1.15 -4.97 118.70 119.19 2wwq s GLU 154 Ca 0.77 -1.20 0.22 0.00 0.04 0.00 0.00 54.97 54.80 2wwq s GLU 154 Cb -0.31 -0.12 -0.24 0.00 0.02 0.00 0.00 34.13 33.48 2wwq s GLU 154 CO 0.42 -0.03 0.65 -0.35 -1.84 0.00 0.00 175.26 174.11 2wwq n PRO 155 N 0.27 0.56 -0.01 -4.83 -0.04 -1.26 -2.55 135.00 127.15 2wwq n PRO 155 Ca -0.15 -0.11 0.13 0.00 -0.04 0.00 0.00 63.50 63.33 2wwq n PRO 155 Cb 0.60 -1.57 0.36 0.00 -0.04 0.00 0.00 33.50 32.85 2wwq n PRO 155 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2wwq n TYR 156 N -2.24 0.01 -1.43 0.54 0.18 -1.26 -2.38 117.16 110.59 2wwq n TYR 156 Ca -0.02 -0.01 0.00 0.00 1.88 0.00 0.00 57.90 59.75 2wwq n TYR 156 Cb 0.53 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.49 2wwq n TYR 156 CO 0.00 0.00 0.00 1.17 -2.08 0.00 0.00 176.86 175.95 2wwq n LYS 157 N 0.62 0.00 0.00 -3.48 3.00 -1.26 -4.60 118.16 112.45 2wwq n LYS 157 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.48 2wwq n LYS 157 Cb 0.45 -0.01 0.00 0.00 0.00 0.00 0.00 35.03 35.46 2wwq n LYS 157 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2wwq n GLY 158 N 0.00 2.86 3.64 3.14 0.00 -1.06 -5.00 105.19 108.77 2wwq n GLY 158 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2wwq n GLY 158 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2wwq n LYS 159 N -0.39 0.84 0.00 1.61 2.85 -1.26 -4.22 118.16 117.59 2wwq n LYS 159 Ca 0.00 0.33 0.00 0.00 -1.05 0.00 0.00 58.31 57.59 2wwq n LYS 159 Cb 0.00 -2.25 0.00 0.00 -0.65 0.00 0.00 35.03 32.13 2wwq n LYS 159 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2wwq n GLY 160 N 1.18 3.94 3.64 2.58 0.00 -1.10 -2.92 105.19 112.53 2wwq n GLY 160 Ca 0.14 -1.30 -0.42 0.00 0.00 0.00 0.00 46.02 44.44 2wwq n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wwq s VAL 161 N -0.55 3.36 0.00 1.61 1.01 -1.13 -3.81 120.40 120.90 2wwq s VAL 161 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 61.98 62.41 2wwq s VAL 161 Cb 0.00 -3.33 0.00 0.00 0.00 0.00 0.00 36.38 33.05 2wwq s VAL 161 CO 0.00 -0.09 0.00 -2.11 0.00 0.00 0.00 175.10 172.90 2wwq n ARG 162 N 7.60 3.32 -0.07 2.72 1.85 -1.14 -4.00 116.66 126.94 2wwq n ARG 162 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.05 2wwq n ARG 162 Cb 0.43 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.84 2wwq n ARG 162 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 2wwq n TYR 163 N 0.00 -0.23 -0.09 2.89 4.02 -1.26 -4.36 117.16 118.13 2wwq n TYR 163 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.78 2wwq n TYR 163 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.28 2wwq n TYR 163 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2wwq h ALA 164 N -0.92 0.36 -2.29 -0.72 0.00 -1.88 -0.69 119.26 113.11 2wwq h ALA 164 Ca 0.00 -0.18 -0.50 0.00 0.00 0.00 0.00 54.91 54.23 2wwq h ALA 164 Cb 0.00 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 2wwq h ALA 164 CO 0.00 0.03 -0.49 -0.51 0.00 0.00 0.00 179.25 178.27 2wwq s ASP 165 N -5.84 5.87 -0.31 0.00 1.11 -1.26 -4.71 116.67 111.52 2wwq s ASP 165 Ca -0.14 -0.09 -0.14 0.00 0.18 0.00 0.00 52.55 52.37 2wwq s ASP 165 Cb 0.08 -1.61 -0.03 0.00 1.07 0.00 0.00 42.92 42.43 2wwq s ASP 165 CO 0.74 -0.03 0.29 -0.70 1.18 0.00 0.00 175.17 176.66 2wwq s GLU 166 N -3.73 3.75 -0.07 8.23 2.56 -1.26 -4.86 118.70 123.32 2wwq s GLU 166 Ca 0.33 -0.34 0.22 0.00 0.00 0.00 0.00 54.97 55.17 2wwq s GLU 166 Cb -0.09 -3.74 0.43 0.00 2.00 0.00 0.00 34.13 32.73 2wwq s GLU 166 CO 0.26 -0.37 1.18 1.33 -0.56 0.00 0.00 175.26 177.11 2wwq n VAL 167 N 5.14 0.67 -1.51 3.70 0.24 -1.26 -5.07 118.33 120.24 2wwq n VAL 167 Ca -0.11 -1.69 -0.30 0.00 -2.04 0.00 0.00 64.34 60.19 2wwq n VAL 167 Cb 0.50 0.64 0.08 0.00 -1.47 0.00 0.00 33.84 33.59 2wwq n VAL 167 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 2wwq s VAL 168 N -1.01 3.47 0.11 3.34 -7.23 -1.26 -5.09 120.40 112.73 2wwq s VAL 168 Ca 0.35 0.48 0.03 0.00 -1.81 0.00 0.00 61.98 61.03 2wwq s VAL 168 Cb 0.38 -3.18 -0.04 0.00 0.56 0.00 0.00 36.38 34.11 2wwq s VAL 168 CO -0.14 -0.63 0.14 -0.13 -0.31 0.00 0.00 175.10 174.03 2wwq s ARG 169 N -5.07 3.03 -0.08 4.82 1.81 -1.26 -5.13 118.95 117.07 2wwq s ARG 169 Ca 0.60 -0.69 0.01 0.00 -1.72 0.00 0.00 55.73 53.93 2wwq s ARG 169 Cb -0.15 -2.78 0.02 0.00 -0.45 0.00 0.00 34.95 31.59 2wwq s ARG 169 CO 0.55 0.55 -0.08 0.99 -0.68 0.00 0.00 175.30 176.62 2wwq s THR 170 N -1.54 0.93 -0.09 0.02 2.01 -1.26 -4.46 115.64 111.26 2wwq s THR 170 Ca 0.31 -0.30 0.04 0.00 0.31 0.00 0.00 61.69 62.05 2wwq s THR 170 Cb -0.12 -0.92 0.00 0.00 0.01 0.00 0.00 72.50 71.48 2wwq s THR 170 CO 0.24 0.33 -0.20 -0.54 -0.69 0.00 0.00 174.62 173.75 2wwq s LYS 171 N 1.19 2.59 0.44 4.92 -0.14 -1.00 -5.03 119.74 122.70 2wwq s LYS 171 Ca -0.05 -0.74 -0.25 0.00 -1.36 0.00 0.00 55.97 53.56 2wwq s LYS 171 Cb -0.14 -2.01 -0.08 0.00 -1.68 0.00 0.00 37.83 33.92 2wwq s LYS 171 CO -0.02 0.15 1.39 -1.83 -0.76 0.00 0.00 175.35 174.28 2wwq s GLU 172 N 0.39 3.75 0.73 1.68 -1.05 -1.26 -4.19 118.70 118.75 2wwq s GLU 172 Ca -0.16 2.34 -0.11 0.00 -0.15 0.00 0.00 54.97 56.88 2wwq s GLU 172 Cb -0.17 -2.67 0.03 0.00 -0.44 0.00 0.00 34.13 30.88 2wwq s GLU 172 CO 0.07 -0.73 1.08 0.00 0.95 0.00 0.00 175.26 176.62 2wwq s ALA 173 N -1.22 2.60 0.27 -0.84 0.00 -1.26 -5.02 121.76 116.28 2wwq s ALA 173 Ca 0.60 -0.12 -0.12 0.00 0.00 0.00 0.00 51.96 52.33 2wwq s ALA 173 Cb -0.42 -3.11 -0.00 0.00 0.00 0.00 0.00 23.12 19.59 2wwq s ALA 173 CO 0.54 -1.35 0.49 -1.59 0.00 0.00 0.00 175.76 173.85 2wwq s LYS 174 N -5.16 1.62 0.00 0.00 -2.85 -1.26 -5.01 119.74 107.09 2wwq s LYS 174 Ca 0.59 -1.33 0.00 0.00 -1.00 0.00 0.00 55.97 54.23 2wwq s LYS 174 Cb -0.13 0.47 0.00 0.00 -2.06 0.00 0.00 37.83 36.11 2wwq s LYS 174 CO 0.54 -0.68 0.00 1.63 0.10 0.00 0.00 175.35 176.94 2wwq n LYS 175 N -0.41 0.00 0.00 1.78 5.02 -1.26 -5.31 118.16 117.98 2wwq n LYS 175 Ca -0.02 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.35 2wwq n LYS 175 Cb 0.62 -2.04 0.06 0.00 -0.02 0.00 0.00 35.03 33.65 2wwq n LYS 175 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51