#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wwq s ILE 2 N 0.00 0.66 0.20 2.02 -0.00 -1.26 -4.83 121.20 118.00 2wwq s ILE 2 Ca 0.00 -1.99 -0.04 0.00 -0.00 0.00 0.00 60.65 58.62 2wwq s ILE 2 Cb 0.00 -2.27 -0.05 0.00 -0.00 0.00 0.00 42.46 40.14 2wwq s ILE 2 CO 0.00 -0.34 0.44 -0.83 -0.00 0.00 0.00 174.94 174.21 2wwq s GLY 3 N -3.22 2.01 0.22 6.27 0.00 -1.26 -4.72 107.32 106.63 2wwq s GLY 3 Ca 0.28 -0.62 0.10 0.00 0.00 0.00 0.00 44.72 44.48 2wwq s GLY 3 CO 0.07 -0.53 -0.18 1.08 0.00 0.00 0.00 173.10 173.53 2wwq s LEU 4 N -3.10 2.52 -0.47 0.66 1.43 -1.26 -4.62 118.68 113.85 2wwq s LEU 4 Ca 0.42 -0.97 -0.20 0.00 -1.03 0.00 0.00 54.13 52.34 2wwq s LEU 4 Cb -0.11 -0.90 0.04 0.00 0.03 0.00 0.00 46.19 45.24 2wwq s LEU 4 CO 0.27 -0.04 0.66 -0.69 0.23 0.00 0.00 176.35 176.79 2wwq s VAL 5 N -2.45 4.80 0.00 -1.59 1.01 -1.26 -3.05 120.40 117.86 2wwq s VAL 5 Ca 0.23 -0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.12 2wwq s VAL 5 Cb -0.04 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 32.07 2wwq s VAL 5 CO 0.10 -0.72 0.00 0.61 0.00 0.00 0.00 175.10 175.09 2wwq n GLY 6 N 5.09 2.34 3.32 4.51 0.00 -0.91 -4.87 105.19 114.68 2wwq n GLY 6 Ca -0.03 -1.84 -0.14 0.00 0.00 0.00 0.00 46.02 44.01 2wwq n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wwq s LYS 7 N 4.11 0.64 0.22 1.61 1.02 -0.97 -2.90 119.74 123.48 2wwq s LYS 7 Ca 0.00 0.27 -0.16 0.00 0.02 0.00 0.00 55.97 56.10 2wwq s LYS 7 Cb 0.00 0.30 -0.08 0.00 -0.52 0.00 0.00 37.83 37.53 2wwq s LYS 7 CO 0.00 -0.14 0.64 0.21 -0.92 0.00 0.00 175.35 175.14 2wwq s LYS 8 N -0.53 4.05 0.00 1.68 2.20 -1.19 -0.37 119.74 125.58 2wwq s LYS 8 Ca -0.06 0.62 0.00 0.00 -0.36 0.00 0.00 55.97 56.17 2wwq s LYS 8 Cb -0.03 -2.77 0.00 0.00 -1.51 0.00 0.00 37.83 33.51 2wwq s LYS 8 CO 0.03 0.36 0.28 1.33 -0.36 0.00 0.00 175.35 177.00 2wwq n VAL 9 N 0.41 0.00 -2.18 4.02 0.24 -1.17 -2.29 118.33 117.37 2wwq n VAL 9 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 2wwq n VAL 9 Cb 0.52 0.40 0.00 0.00 -1.47 0.00 0.00 33.84 33.29 2wwq n VAL 9 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wwq n GLY 10 N 0.00 -1.98 3.22 7.63 0.00 -1.25 -5.01 105.19 107.81 2wwq n GLY 10 Ca 0.00 -1.23 -0.13 0.00 0.00 0.00 0.00 46.02 44.66 2wwq n GLY 10 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2wwq s MET 11 N -1.87 0.44 0.00 1.61 1.75 -1.26 -2.47 119.30 117.50 2wwq s MET 11 Ca 0.00 0.33 0.00 0.00 -1.25 0.00 0.00 55.69 54.77 2wwq s MET 11 Cb 0.00 0.21 0.00 0.00 2.84 0.00 0.00 34.83 37.88 2wwq s MET 11 CO 0.00 -0.07 0.00 0.25 -0.65 0.00 0.00 175.02 174.55 2wwq n THR 12 N 2.58 0.00 -3.71 10.11 -2.24 -1.16 -4.98 114.28 114.89 2wwq n THR 12 Ca -0.15 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.51 2wwq n THR 12 Cb 0.57 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.71 2wwq n THR 12 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wwq s ARG 13 N -1.45 0.52 -0.13 -0.78 1.70 -1.26 -2.59 118.95 114.96 2wwq s ARG 13 Ca 0.00 0.68 0.01 0.00 -0.47 0.00 0.00 55.73 55.95 2wwq s ARG 13 Cb 0.00 0.22 0.02 0.00 -0.57 0.00 0.00 34.95 34.62 2wwq s ARG 13 CO 0.00 -0.08 -0.16 0.42 -1.08 0.00 0.00 175.30 174.40 2wwq s ILE 14 N 0.45 1.64 0.63 4.99 -1.09 -1.03 -4.94 121.20 121.84 2wwq s ILE 14 Ca -0.02 -0.70 -0.19 0.00 -2.23 0.00 0.00 60.65 57.52 2wwq s ILE 14 Cb -0.04 -1.50 -0.02 0.00 -1.58 0.00 0.00 42.46 39.32 2wwq s ILE 14 CO -0.02 0.47 1.26 0.49 -1.23 0.00 0.00 174.94 175.91 2wwq n PHE 15 N 4.45 1.82 -4.19 3.97 3.01 -1.26 -3.11 117.46 122.15 2wwq n PHE 15 Ca -0.18 0.42 -0.11 0.00 1.01 0.00 0.00 57.45 58.59 2wwq n PHE 15 Cb 0.51 -2.26 -0.10 0.00 -0.01 0.00 0.00 39.48 37.61 2wwq n PHE 15 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 2wwq s THR 16 N -1.39 0.39 0.24 4.37 -4.23 -0.93 -4.96 115.64 109.13 2wwq s THR 16 Ca 0.81 -1.94 0.30 0.00 -1.18 0.00 0.00 61.69 59.67 2wwq s THR 16 Cb -0.39 -2.05 0.32 0.00 1.34 0.00 0.00 72.50 71.72 2wwq s THR 16 CO 0.42 -0.50 1.98 1.05 -0.54 0.00 0.00 174.62 177.03 2wwq h GLU 17 N 2.80 0.00 -0.13 3.99 9.09 -1.99 -2.75 114.58 125.58 2wwq h GLU 17 Ca -0.36 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.05 2wwq h GLU 17 Cb 1.20 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.30 2wwq h GLU 17 CO 0.61 0.11 0.00 -0.40 0.05 0.00 0.00 179.01 179.38 2wwq n ASP 18 N -3.33 0.79 0.00 3.06 5.68 -1.26 -4.91 116.55 116.58 2wwq n ASP 18 Ca -0.00 -1.88 0.00 0.00 -0.50 0.00 0.00 54.79 52.41 2wwq n ASP 18 Cb 0.31 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.21 2wwq n ASP 18 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wwq n GLY 19 N 0.80 0.70 3.81 6.12 0.00 -1.04 -5.05 105.19 110.53 2wwq n GLY 19 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 2wwq n GLY 19 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wwq s VAL 20 N -2.53 5.24 -0.35 1.61 1.01 -1.26 -4.93 120.40 119.18 2wwq s VAL 20 Ca 0.00 0.60 0.03 0.00 0.00 0.00 0.00 61.98 62.61 2wwq s VAL 20 Cb 0.00 -3.61 0.10 0.00 0.00 0.00 0.00 36.38 32.87 2wwq s VAL 20 CO 0.00 0.52 0.08 -0.55 0.00 0.00 0.00 175.10 175.15 2wwq s SER 21 N -0.53 4.57 0.35 3.32 0.15 -1.26 -2.18 113.70 118.12 2wwq s SER 21 Ca 0.19 -2.16 -0.26 0.00 0.70 0.00 0.00 55.95 54.42 2wwq s SER 21 Cb -0.14 -1.49 -0.09 0.00 -1.71 0.00 0.00 66.02 62.59 2wwq s SER 21 CO 0.08 -0.37 1.02 0.27 1.20 0.00 0.00 173.24 175.44 2wwq s ILE 22 N 0.90 3.84 0.54 6.45 -4.36 -1.18 -4.79 121.20 122.60 2wwq s ILE 22 Ca 0.12 1.54 -0.18 0.00 -0.26 0.00 0.00 60.65 61.86 2wwq s ILE 22 Cb -0.19 -3.86 -0.11 0.00 1.25 0.00 0.00 42.46 39.55 2wwq s ILE 22 CO -0.10 0.13 0.34 -0.81 0.24 0.00 0.00 174.94 174.75 2wwq n PRO 23 N 0.42 0.37 -3.86 0.37 -0.04 -1.26 -2.47 135.00 128.53 2wwq n PRO 23 Ca 0.03 0.14 -0.09 0.00 -0.04 0.00 0.00 63.50 63.54 2wwq n PRO 23 Cb 0.49 -1.49 -0.08 0.00 -0.04 0.00 0.00 33.50 32.38 2wwq n PRO 23 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2wwq s VAL 24 N -1.78 0.13 -0.06 0.52 1.01 -1.07 -2.78 120.40 116.37 2wwq s VAL 24 Ca 0.65 -1.10 -0.03 0.00 0.00 0.00 0.00 61.98 61.51 2wwq s VAL 24 Cb -0.47 -1.19 0.04 0.00 0.00 0.00 0.00 36.38 34.76 2wwq s VAL 24 CO 0.58 -0.61 0.13 -0.89 0.00 0.00 0.00 175.10 174.31 2wwq s THR 25 N -3.40 -0.13 -0.77 3.92 2.01 -1.25 -2.96 115.64 113.06 2wwq s THR 25 Ca 0.01 0.27 -0.17 0.00 0.31 0.00 0.00 61.69 62.12 2wwq s THR 25 Cb 0.03 -0.23 0.15 0.00 0.01 0.00 0.00 72.50 72.46 2wwq s THR 25 CO -0.08 0.11 0.83 -0.69 -0.69 0.00 0.00 174.62 174.10 2wwq s VAL 26 N 1.65 5.10 0.11 3.82 1.01 -1.03 -3.02 120.40 128.04 2wwq s VAL 26 Ca -0.03 -1.71 -0.23 0.00 0.00 0.00 0.00 61.98 60.00 2wwq s VAL 26 Cb -0.12 -4.55 -0.07 0.00 0.00 0.00 0.00 36.38 31.64 2wwq s VAL 26 CO -0.05 -1.18 0.71 -0.63 0.00 0.00 0.00 175.10 173.95 2wwq s ILE 27 N 1.72 4.56 -0.22 2.22 1.01 -0.91 -3.05 121.20 126.52 2wwq s ILE 27 Ca 0.19 1.54 0.01 0.00 0.00 0.00 0.00 60.65 62.39 2wwq s ILE 27 Cb -0.14 -4.06 0.04 0.00 0.01 0.00 0.00 42.46 38.30 2wwq s ILE 27 CO -0.04 0.50 -0.14 -0.70 0.00 0.00 0.00 174.94 174.56 2wwq s GLU 28 N -0.89 2.68 0.59 2.79 2.12 0.50 -1.74 118.70 124.76 2wwq s GLU 28 Ca 0.34 -1.05 -0.02 0.00 0.36 0.00 0.00 54.97 54.60 2wwq s GLU 28 Cb -0.21 -2.78 0.04 0.00 0.26 0.00 0.00 34.13 31.44 2wwq s GLU 28 CO 0.23 -0.38 0.85 0.08 -0.54 0.00 0.00 175.26 175.50 2wwq s VAL 29 N 1.23 2.69 0.00 3.70 1.01 -0.31 -2.28 120.40 126.44 2wwq s VAL 29 Ca -0.01 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.47 2wwq s VAL 29 Cb -0.16 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.16 2wwq s VAL 29 CO -0.08 -0.05 0.00 -1.84 0.00 0.00 0.00 175.10 173.13 2wwq n GLU 30 N -2.52 0.00 0.00 2.72 -0.00 -1.26 -4.71 120.64 114.87 2wwq n GLU 30 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.23 2wwq n GLU 30 Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 32.04 2wwq n GLU 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2wwq n ALA 31 N 0.00 0.00 -3.75 -1.84 0.00 -1.26 -5.07 120.51 108.59 2wwq n ALA 31 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 2wwq n ALA 31 Cb 0.20 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.51 2wwq n ALA 31 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2wwq s ASN 32 N 0.00 3.84 -0.03 0.00 -0.87 -1.13 -4.48 114.94 112.27 2wwq s ASN 32 Ca 0.00 -2.45 -0.13 0.00 -1.57 0.00 0.00 52.86 48.72 2wwq s ASN 32 Cb 0.00 -1.09 -0.05 0.00 -0.02 0.00 0.00 41.25 40.09 2wwq s ASN 32 CO 0.00 -0.30 0.34 0.00 -2.57 0.00 0.00 177.10 174.57 2wwq s ARG 33 N 0.57 3.80 -0.17 -0.60 3.03 -1.26 -2.86 118.95 121.45 2wwq s ARG 33 Ca 0.16 0.27 -0.29 0.00 2.03 0.00 0.00 55.73 57.90 2wwq s ARG 33 Cb -0.23 -3.21 -0.01 0.00 -1.03 0.00 0.00 34.95 30.46 2wwq s ARG 33 CO -0.05 0.71 1.26 0.08 -1.13 0.00 0.00 175.30 176.18 2wwq s VAL 34 N -1.06 4.29 0.00 4.99 1.01 -1.26 -3.34 120.40 125.03 2wwq s VAL 34 Ca 0.21 1.55 0.00 0.00 0.00 0.00 0.00 61.98 63.75 2wwq s VAL 34 Cb -0.15 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.22 2wwq s VAL 34 CO 0.11 -0.14 0.00 0.35 0.00 0.00 0.00 175.10 175.42 2wwq n THR 35 N 5.39 0.00 -2.00 3.92 -2.24 -0.26 -2.21 114.28 116.88 2wwq n THR 35 Ca 0.14 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.57 2wwq n THR 35 Cb 0.45 -0.03 0.03 0.00 -2.10 0.00 0.00 70.33 68.68 2wwq n THR 35 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2wwq s GLN 36 N 0.85 3.02 0.14 -0.78 -1.52 -1.24 -4.76 119.66 115.38 2wwq s GLN 36 Ca 0.00 1.61 0.04 0.00 -1.95 0.00 0.00 55.36 55.06 2wwq s GLN 36 Cb 0.00 -1.96 -0.04 0.00 -0.22 0.00 0.00 33.01 30.79 2wwq s GLN 36 CO 0.00 -1.11 -0.10 0.54 -0.25 0.00 0.00 175.29 174.37 2wwq s VAL 37 N -1.91 1.15 -0.05 1.09 0.11 -1.26 -2.22 120.40 117.31 2wwq s VAL 37 Ca 0.72 -2.03 -0.02 0.00 -2.93 0.00 0.00 61.98 57.72 2wwq s VAL 37 Cb -0.25 -1.81 0.04 0.00 -1.53 0.00 0.00 36.38 32.83 2wwq s VAL 37 CO 0.34 -0.73 0.10 -0.54 -3.33 0.00 0.00 175.10 170.93 2wwq s LYS 38 N -3.68 0.02 0.26 1.54 1.02 -1.03 -4.99 119.74 112.88 2wwq s LYS 38 Ca 0.16 0.34 0.01 0.00 0.02 0.00 0.00 55.97 56.51 2wwq s LYS 38 Cb 0.02 -0.25 -0.04 0.00 -0.52 0.00 0.00 37.83 37.03 2wwq s LYS 38 CO 0.00 -0.21 0.13 -0.51 -0.92 0.00 0.00 175.35 173.84 2wwq s ASP 39 N 1.42 1.10 0.03 2.83 1.01 -1.26 -1.80 116.67 120.01 2wwq s ASP 39 Ca -0.06 -1.45 0.25 0.00 0.71 0.00 0.00 52.55 52.00 2wwq s ASP 39 Cb -0.12 0.28 0.45 0.00 1.01 0.00 0.00 42.92 44.54 2wwq s ASP 39 CO -0.05 -0.81 1.38 0.18 0.21 0.00 0.00 175.17 176.08 2wwq n LEU 40 N -0.47 0.54 0.20 1.23 4.77 -1.21 -1.30 117.00 120.76 2wwq n LEU 40 Ca 0.01 0.05 0.14 0.00 -0.03 0.00 0.00 56.01 56.18 2wwq n LEU 40 Cb 0.66 -0.23 0.63 0.00 -2.33 0.00 0.00 43.42 42.15 2wwq n LEU 40 CO 0.36 0.08 0.92 0.00 -1.33 0.00 0.00 177.39 177.42 2wwq h ALA 41 N 2.87 1.00 0.00 -1.18 0.00 -1.97 -3.02 119.26 116.96 2wwq h ALA 41 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2wwq h ALA 41 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2wwq h ALA 41 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 2wwq n ASN 42 N -2.55 1.31 -0.43 0.00 4.13 -0.43 -5.11 115.26 112.18 2wwq n ASN 42 Ca 0.01 -1.41 0.00 0.00 1.68 0.00 0.00 54.58 54.86 2wwq n ASN 42 Cb 0.20 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.44 2wwq n ASN 42 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2wwq n ASP 43 N -0.20 -2.64 0.00 6.41 10.43 -0.42 -4.90 116.55 125.23 2wwq n ASP 43 Ca 0.00 0.43 0.00 0.00 2.57 0.00 0.00 54.79 57.79 2wwq n ASP 43 Cb 0.14 -0.62 0.00 0.00 1.84 0.00 0.00 41.12 42.48 2wwq n ASP 43 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2wwq n GLY 44 N -1.42 2.07 3.50 0.44 0.00 -1.26 -4.88 105.19 103.63 2wwq n GLY 44 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2wwq n GLY 44 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2wwq s TYR 45 N -2.44 -0.42 -0.44 1.61 -0.85 -1.26 -5.04 117.35 108.51 2wwq s TYR 45 Ca 0.00 0.15 0.05 0.00 -0.52 0.00 0.00 57.07 56.75 2wwq s TYR 45 Cb 0.00 0.55 0.29 0.00 0.38 0.00 0.00 41.96 43.18 2wwq s TYR 45 CO 0.00 -0.91 1.08 -2.13 -1.52 0.00 0.00 175.55 172.07 2wwq n ARG 46 N -0.38 0.75 -2.53 -3.49 3.00 -1.25 -3.34 116.66 109.42 2wwq n ARG 46 Ca -0.14 -1.60 -0.16 0.00 -0.00 0.00 0.00 57.85 55.95 2wwq n ARG 46 Cb 0.64 -1.01 0.06 0.00 0.00 0.00 0.00 32.46 32.14 2wwq n ARG 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2wwq n ALA 47 N 0.94 0.91 -2.96 5.13 0.00 -0.75 -0.98 120.51 122.81 2wwq n ALA 47 Ca 0.05 -1.65 -0.11 0.00 0.00 0.00 0.00 53.44 51.73 2wwq n ALA 47 Cb 0.68 0.44 -0.08 0.00 0.00 0.00 0.00 19.45 20.49 2wwq n ALA 47 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2wwq s ILE 48 N -1.90 0.09 0.03 0.00 -4.36 -1.13 -2.48 121.20 111.45 2wwq s ILE 48 Ca 0.49 -0.76 -0.04 0.00 -0.26 0.00 0.00 60.65 60.07 2wwq s ILE 48 Cb -0.04 -0.89 -0.01 0.00 1.25 0.00 0.00 42.46 42.77 2wwq s ILE 48 CO 0.31 -0.42 0.06 -1.10 0.24 0.00 0.00 174.94 174.03 2wwq s GLN 49 N -2.45 0.50 0.38 0.37 1.11 -0.94 -1.32 119.66 117.32 2wwq s GLN 49 Ca -0.06 -0.69 -0.07 0.00 0.01 0.00 0.00 55.36 54.56 2wwq s GLN 49 Cb -0.01 0.19 0.03 0.00 -1.01 0.00 0.00 33.01 32.21 2wwq s GLN 49 CO -0.03 -0.11 0.62 0.14 0.01 0.00 0.00 175.29 175.91 2wwq s VAL 50 N -2.20 0.00 0.25 1.09 -7.23 -1.26 -1.10 120.40 109.94 2wwq s VAL 50 Ca -0.09 -1.36 0.02 0.00 -1.81 0.00 0.00 61.98 58.74 2wwq s VAL 50 Cb -0.04 -2.82 -0.04 0.00 0.56 0.00 0.00 36.38 34.05 2wwq s VAL 50 CO -0.03 0.00 0.18 0.42 -0.31 0.00 0.00 175.10 175.36 2wwq s THR 51 N -2.56 0.01 0.00 5.32 -4.23 -1.21 -3.59 115.64 109.37 2wwq s THR 51 Ca 0.25 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.76 2wwq s THR 51 Cb -0.02 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.31 2wwq s THR 51 CO 0.18 0.00 0.00 0.41 -0.54 0.00 0.00 174.62 174.67 2wwq n THR 52 N -0.39 0.00 -3.61 3.99 -1.04 -1.26 -4.27 114.28 107.70 2wwq n THR 52 Ca 0.04 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 62.06 2wwq n THR 52 Cb 0.65 0.89 -0.00 0.00 -1.82 0.00 0.00 70.33 70.05 2wwq n THR 52 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2wwq n GLY 53 N 0.00 -1.79 3.54 3.41 0.00 -1.26 -4.93 105.19 104.15 2wwq n GLY 53 Ca 0.00 -1.31 -0.11 0.00 0.00 0.00 0.00 46.02 44.61 2wwq n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wwq s ALA 54 N -1.35 -1.86 0.17 4.61 0.00 -1.26 -1.87 121.76 120.19 2wwq s ALA 54 Ca 0.00 1.31 -0.11 0.00 0.00 0.00 0.00 51.96 53.16 2wwq s ALA 54 Cb 0.00 -0.15 0.05 0.00 0.00 0.00 0.00 23.12 23.02 2wwq s ALA 54 CO 0.00 -0.47 1.65 -0.22 0.00 0.00 0.00 175.76 176.72 2wwq h LYS 55 N 2.39 0.94 -5.48 0.00 3.64 -1.98 -3.45 116.57 112.64 2wwq h LYS 55 Ca -0.21 -0.26 -0.50 0.00 -1.27 0.00 0.00 60.65 58.42 2wwq h LYS 55 Cb 1.19 -0.11 -0.14 0.00 -0.41 0.00 0.00 32.23 32.77 2wwq h LYS 55 CO 0.32 0.91 -0.66 0.15 -2.27 0.00 0.00 179.45 177.89 2wwq s LYS 56 N -5.18 1.58 -0.41 1.90 1.02 -1.26 -5.01 119.74 112.37 2wwq s LYS 56 Ca -0.12 -1.81 0.05 0.00 0.02 0.00 0.00 55.97 54.11 2wwq s LYS 56 Cb 0.13 -1.14 0.64 0.00 -0.52 0.00 0.00 37.83 36.94 2wwq s LYS 56 CO 0.82 0.01 1.82 0.00 -0.92 0.00 0.00 175.35 177.08 2wwq n ALA 57 N -0.61 5.27 -0.06 5.17 0.00 -1.26 -4.30 120.51 124.73 2wwq n ALA 57 Ca -0.05 -2.91 0.00 0.00 0.00 0.00 0.00 53.44 50.48 2wwq n ALA 57 Cb 0.64 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2wwq n ALA 57 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2wwq n ASN 58 N -1.07 0.06 -0.94 0.00 3.02 -1.26 -4.65 115.26 110.42 2wwq n ASN 58 Ca 0.53 -0.35 0.12 0.00 -0.03 0.00 0.00 54.58 54.85 2wwq n ASN 58 Cb 1.53 0.46 0.25 0.00 -0.61 0.00 0.00 39.78 41.41 2wwq n ASN 58 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 2wwq n ARG 59 N -0.46 2.25 -4.27 3.52 1.85 -1.26 -4.82 116.66 113.48 2wwq n ARG 59 Ca 0.00 -1.87 -0.15 0.00 -1.00 0.00 0.00 57.85 54.83 2wwq n ARG 59 Cb 0.01 -1.48 -0.10 0.00 -1.05 0.00 0.00 32.46 29.85 2wwq n ARG 59 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 2wwq s VAL 60 N -1.69 1.03 0.62 8.89 -7.23 -1.26 -5.05 120.40 115.70 2wwq s VAL 60 Ca 0.35 -2.03 -0.00 0.00 -1.81 0.00 0.00 61.98 58.48 2wwq s VAL 60 Cb 0.21 -2.02 0.06 0.00 0.56 0.00 0.00 36.38 35.19 2wwq s VAL 60 CO 0.30 -0.59 0.87 0.42 -0.31 0.00 0.00 175.10 175.79 2wwq s THR 61 N -3.42 2.47 0.21 5.32 -4.23 -1.26 -4.93 115.64 109.81 2wwq s THR 61 Ca 0.21 -0.59 -0.09 0.00 -1.18 0.00 0.00 61.69 60.04 2wwq s THR 61 Cb 0.04 -2.88 0.17 0.00 1.34 0.00 0.00 72.50 71.16 2wwq s THR 61 CO 0.03 0.00 1.86 0.11 -0.54 0.00 0.00 174.62 176.08 2wwq h LYS 62 N -0.19 1.07 -0.81 3.99 1.57 -1.99 -0.67 116.57 119.54 2wwq h LYS 62 Ca -0.41 -0.09 0.02 0.00 -1.87 0.00 0.00 60.65 58.30 2wwq h LYS 62 Cb 1.29 -0.23 -0.05 0.00 0.08 0.00 0.00 32.23 33.33 2wwq h LYS 62 CO 0.50 0.75 0.53 -1.00 -0.57 0.00 0.00 179.45 179.66 2wwq h PRO 63 N 1.08 1.02 -2.45 3.15 0.13 -2.02 -3.13 132.00 129.78 2wwq h PRO 63 Ca 0.28 -0.06 -0.50 0.00 -0.87 0.00 0.00 66.00 64.85 2wwq h PRO 63 Cb -0.05 -0.23 -0.06 0.00 0.13 0.00 0.00 31.00 30.79 2wwq h PRO 63 CO -0.05 0.67 1.69 0.39 -0.23 0.00 0.00 178.00 180.47 2wwq n GLU 64 N -4.56 3.12 0.00 0.86 -0.58 -0.27 -3.36 120.64 115.86 2wwq n GLU 64 Ca 0.09 -2.08 0.00 0.00 -0.42 0.00 0.00 57.16 54.75 2wwq n GLU 64 Cb 0.06 -2.41 0.00 0.00 -0.57 0.00 0.00 31.44 28.52 2wwq n GLU 64 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wwq n ALA 65 N 2.45 0.00 0.32 0.62 0.00 -1.16 -4.01 120.51 118.73 2wwq n ALA 65 Ca 0.60 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.91 2wwq n ALA 65 Cb 0.50 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.89 2wwq n ALA 65 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2wwq h GLY 66 N 0.00 -0.87 0.17 0.00 0.00 -1.55 -2.84 103.07 97.99 2wwq h GLY 66 Ca 0.00 0.32 0.19 0.00 0.00 0.00 0.00 47.33 47.84 2wwq h GLY 66 CO 0.00 -0.32 0.61 1.12 0.00 0.00 0.00 176.54 177.96 2wwq h HIS 67 N -0.91 0.98 0.65 5.60 -0.00 -1.89 -2.28 115.15 117.30 2wwq h HIS 67 Ca -0.08 0.03 -0.03 0.00 -0.00 0.00 0.00 60.37 60.28 2wwq h HIS 67 Cb 0.64 -0.30 0.01 0.00 -0.00 0.00 0.00 27.41 27.76 2wwq h HIS 67 CO 0.07 0.23 -0.31 0.74 -0.00 0.00 0.00 177.93 178.65 2wwq h PHE 68 N 0.71 -0.81 -0.60 6.12 0.05 -1.87 -3.25 116.94 117.28 2wwq h PHE 68 Ca 0.56 -0.02 0.18 0.00 3.82 0.00 0.00 57.97 62.50 2wwq h PHE 68 Cb 0.93 0.27 -0.02 0.00 2.00 0.00 0.00 35.95 39.13 2wwq h PHE 68 CO -0.00 -0.51 0.57 0.00 -0.18 0.00 0.00 178.31 178.19 2wwq h ALA 69 N -1.53 2.40 0.00 2.45 0.00 -1.17 -0.45 119.26 120.96 2wwq h ALA 69 Ca -0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2wwq h ALA 69 Cb 0.67 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2wwq h ALA 69 CO 0.15 -0.89 0.00 1.17 0.00 0.00 0.00 179.25 179.68 2wwq n LYS 70 N -3.82 0.91 0.00 0.00 4.81 -0.91 -3.36 118.16 115.80 2wwq n LYS 70 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.56 2wwq n LYS 70 Cb 0.80 -1.04 0.00 0.00 0.02 0.00 0.00 35.03 34.81 2wwq n LYS 70 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2wwq n ALA 71 N 1.31 0.00 0.00 3.14 0.00 -0.18 -5.01 120.51 119.77 2wwq n ALA 71 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2wwq n ALA 71 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 2wwq n ALA 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wwq n GLY 72 N 0.00 -1.68 3.69 0.00 0.00 -1.21 -4.61 105.19 101.38 2wwq n GLY 72 Ca 0.00 -1.54 -0.35 0.00 0.00 0.00 0.00 46.02 44.13 2wwq n GLY 72 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wwq s VAL 73 N -1.90 4.48 0.00 1.61 0.11 -1.26 -3.59 120.40 119.85 2wwq s VAL 73 Ca 0.00 -0.18 0.00 0.00 -2.93 0.00 0.00 61.98 58.87 2wwq s VAL 73 Cb 0.00 -2.91 0.00 0.00 -1.53 0.00 0.00 36.38 31.94 2wwq s VAL 73 CO 0.00 0.59 0.00 -1.84 -3.33 0.00 0.00 175.10 170.52 2wwq n GLU 74 N 2.36 0.00 -0.03 1.54 0.00 -1.26 -5.10 120.64 118.15 2wwq n GLU 74 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 57.16 56.98 2wwq n GLU 74 Cb 0.54 0.00 -0.00 0.00 0.00 0.00 0.00 31.44 31.97 2wwq n GLU 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2wwq n ALA 75 N 0.00 -0.07 0.00 -1.84 0.00 -1.26 -4.07 120.51 113.27 2wwq n ALA 75 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2wwq n ALA 75 Cb 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.49 2wwq n ALA 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wwq n GLY 76 N -0.21 2.35 0.19 0.00 0.00 -1.26 -4.55 105.19 101.71 2wwq n GLY 76 Ca 0.00 0.05 0.07 0.00 0.00 0.00 0.00 46.02 46.14 2wwq n GLY 76 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2wwq n ARG 77 N -0.28 2.16 -3.91 1.61 1.85 -0.78 -4.68 116.66 112.62 2wwq n ARG 77 Ca 0.00 -0.44 -0.01 0.00 -1.00 0.00 0.00 57.85 56.40 2wwq n ARG 77 Cb 0.00 -1.17 0.02 0.00 -1.05 0.00 0.00 32.46 30.25 2wwq n ARG 77 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2wwq s GLY 78 N -1.92 0.01 -0.09 2.89 0.00 -1.26 -5.09 107.32 101.85 2wwq s GLY 78 Ca 0.09 -0.17 -0.05 0.00 0.00 0.00 0.00 44.72 44.59 2wwq s GLY 78 CO 0.43 3.54 0.22 1.08 0.00 0.00 0.00 173.10 178.37 2wwq s LEU 79 N -3.54 0.67 -0.05 0.66 2.01 -1.24 -4.13 118.68 113.07 2wwq s LEU 79 Ca 0.24 0.46 -0.02 0.00 0.01 0.00 0.00 54.13 54.82 2wwq s LEU 79 Cb -0.02 0.68 0.04 0.00 0.01 0.00 0.00 46.19 46.90 2wwq s LEU 79 CO 0.03 -0.14 0.09 0.26 1.01 0.00 0.00 176.35 177.60 2wwq s TRP 80 N 0.93 -0.01 0.48 0.29 0.51 -1.26 -4.93 118.94 114.95 2wwq s TRP 80 Ca -0.07 0.36 -0.24 0.00 -2.12 0.00 0.00 56.10 54.04 2wwq s TRP 80 Cb -0.08 -0.41 -0.08 0.00 -0.81 0.00 0.00 33.47 32.09 2wwq s TRP 80 CO -0.06 -0.21 1.31 -0.85 -0.51 0.00 0.00 176.95 176.63 2wwq n GLU 81 N 5.29 1.85 -3.41 4.98 -0.00 -1.25 -4.34 120.64 123.76 2wwq n GLU 81 Ca -0.04 0.67 -0.17 0.00 -0.00 0.00 0.00 57.16 57.62 2wwq n GLU 81 Cb 0.50 -2.48 -0.10 0.00 -0.00 0.00 0.00 31.44 29.36 2wwq n GLU 81 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 2wwq s PHE 82 N -1.25 -0.45 0.44 -1.84 0.08 -0.43 -4.89 117.98 109.65 2wwq s PHE 82 Ca 0.65 -0.06 -0.23 0.00 0.12 0.00 0.00 56.93 57.41 2wwq s PHE 82 Cb -0.46 -0.42 -0.10 0.00 -0.57 0.00 0.00 43.02 41.47 2wwq s PHE 82 CO 0.54 -0.86 0.95 -2.13 -0.10 0.00 0.00 175.22 173.62 2wwq n ARG 83 N 5.31 1.21 -3.47 0.44 3.00 -1.26 -2.86 116.66 119.04 2wwq n ARG 83 Ca -0.03 0.44 -0.10 0.00 -0.00 0.00 0.00 57.85 58.16 2wwq n ARG 83 Cb 0.47 -2.00 -0.02 0.00 0.00 0.00 0.00 32.46 30.91 2wwq n ARG 83 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.63 177.15 2wwq s LEU 84 N -0.45 -0.47 0.00 6.15 0.05 -0.15 -4.95 118.68 118.85 2wwq s LEU 84 Ca 0.65 -0.01 0.00 0.00 0.05 0.00 0.00 54.13 54.81 2wwq s LEU 84 Cb -0.54 2.35 0.00 0.00 -2.05 0.00 0.00 46.19 45.95 2wwq s LEU 84 CO 0.56 -0.83 0.00 0.00 -0.55 0.00 0.00 176.35 175.53 2wwq n ALA 85 N -0.32 1.09 -2.58 1.48 0.00 -1.26 -4.57 120.51 114.34 2wwq n ALA 85 Ca -0.13 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.21 2wwq n ALA 85 Cb 0.63 0.05 -0.08 0.00 0.00 0.00 0.00 19.45 20.05 2wwq n ALA 85 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2wwq s GLU 86 N -1.09 1.19 0.00 0.00 0.41 -1.26 -4.87 118.70 113.09 2wwq s GLU 86 Ca 0.00 -1.33 0.00 0.00 -0.41 0.00 0.00 54.97 53.23 2wwq s GLU 86 Cb 0.00 0.35 0.00 0.00 -1.78 0.00 0.00 34.13 32.70 2wwq s GLU 86 CO 0.00 -0.42 0.00 0.41 -0.49 0.00 0.00 175.26 174.76 2wwq n GLY 87 N -0.23 0.76 3.73 -1.39 0.00 -1.26 -4.86 105.19 101.95 2wwq n GLY 87 Ca -0.04 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 2wwq n GLY 87 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wwq n GLU 88 N -0.37 2.42 -4.29 1.61 -0.58 -1.26 -4.93 120.64 113.24 2wwq n GLU 88 Ca 0.00 0.85 -0.16 0.00 -0.42 0.00 0.00 57.16 57.43 2wwq n GLU 88 Cb 0.26 -2.53 -0.10 0.00 -0.57 0.00 0.00 31.44 28.50 2wwq n GLU 88 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2wwq s GLU 89 N -1.61 1.43 0.12 3.49 0.41 -1.26 -5.17 118.70 116.10 2wwq s GLU 89 Ca 0.57 -1.79 -0.06 0.00 -0.41 0.00 0.00 54.97 53.29 2wwq s GLU 89 Cb -0.53 -0.03 -0.02 0.00 -1.78 0.00 0.00 34.13 31.77 2wwq s GLU 89 CO 0.60 -0.39 0.16 -0.06 -0.49 0.00 0.00 175.26 175.07 2wwq s PHE 90 N -3.81 0.45 -0.17 1.61 0.40 -1.26 -5.08 117.98 110.12 2wwq s PHE 90 Ca 0.38 -0.86 0.16 0.00 -0.60 0.00 0.00 56.93 56.01 2wwq s PHE 90 Cb 0.06 -0.20 0.02 0.00 0.51 0.00 0.00 43.02 43.41 2wwq s PHE 90 CO 0.15 -0.57 1.25 0.00 0.70 0.00 0.00 175.22 176.75 2wwq h THR 91 N 2.77 0.66 -3.73 0.64 1.03 -1.88 -3.43 112.91 108.97 2wwq h THR 91 Ca -0.33 -2.01 -0.52 0.00 -0.01 0.00 0.00 66.41 63.53 2wwq h THR 91 Cb 1.20 2.23 0.06 0.00 -1.07 0.00 0.00 68.15 70.57 2wwq h THR 91 CO 0.56 0.37 0.67 -0.69 -0.01 0.00 0.00 175.52 176.42 2wwq s VAL 92 N -2.99 2.74 0.65 0.00 1.01 -1.26 -4.10 120.40 116.45 2wwq s VAL 92 Ca 0.02 0.71 -0.17 0.00 0.00 0.00 0.00 61.98 62.53 2wwq s VAL 92 Cb 0.08 -3.45 -0.07 0.00 0.00 0.00 0.00 36.38 32.93 2wwq s VAL 92 CO 0.76 0.15 0.41 0.61 0.00 0.00 0.00 175.10 177.03 2wwq n GLY 93 N 1.24 -1.81 0.00 4.51 0.00 -0.94 -4.46 105.19 103.73 2wwq n GLY 93 Ca 0.02 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2wwq n GLY 93 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2wwq n GLN 94 N -0.08 2.78 -3.58 1.61 1.13 -1.26 -4.79 117.38 113.18 2wwq n GLN 94 Ca 0.10 0.00 -0.22 0.00 -1.94 0.00 0.00 57.00 54.94 2wwq n GLN 94 Cb 0.49 -0.54 0.07 0.00 0.11 0.00 0.00 30.24 30.37 2wwq n GLN 94 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2wwq n SER 95 N -0.37 -3.73 -4.87 1.08 2.88 -1.26 -4.98 113.62 102.37 2wwq n SER 95 Ca 0.00 -0.64 -0.31 0.00 -1.33 0.00 0.00 58.87 56.60 2wwq n SER 95 Cb 0.02 -4.80 -0.02 0.00 -0.75 0.00 0.00 64.21 58.66 2wwq n SER 95 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 2wwq s ILE 96 N -3.38 4.71 0.00 2.46 -4.36 -1.14 -4.62 121.20 114.86 2wwq s ILE 96 Ca 0.28 0.80 0.00 0.00 -0.26 0.00 0.00 60.65 61.47 2wwq s ILE 96 Cb -0.13 -3.79 0.00 0.00 1.25 0.00 0.00 42.46 39.79 2wwq s ILE 96 CO 0.75 -0.80 0.00 -1.54 0.24 0.00 0.00 174.94 173.59 2wwq n SER 97 N -1.94 1.15 0.19 4.36 3.41 -1.26 -2.84 113.62 116.68 2wwq n SER 97 Ca 0.04 -0.65 0.12 0.00 -0.26 0.00 0.00 58.87 58.13 2wwq n SER 97 Cb 0.54 0.00 0.40 0.00 -0.26 0.00 0.00 64.21 64.89 2wwq n SER 97 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 2wwq h VAL 98 N 0.65 0.05 -0.45 -3.33 -1.51 -1.94 -3.23 116.25 106.48 2wwq h VAL 98 Ca 0.00 0.00 0.11 0.00 -1.23 0.00 0.00 66.70 65.58 2wwq h VAL 98 Cb 0.00 0.26 -0.02 0.00 -2.13 0.00 0.00 31.29 29.39 2wwq h VAL 98 CO 0.00 0.00 0.32 1.05 -1.23 0.00 0.00 177.57 177.71 2wwq h GLU 99 N 0.00 0.10 -0.79 5.19 4.11 -1.94 0.85 114.58 122.10 2wwq h GLU 99 Ca 0.13 -0.01 0.15 0.00 0.07 0.00 0.00 59.36 59.70 2wwq h GLU 99 Cb 1.74 -0.02 -0.15 0.00 0.50 0.00 0.00 28.75 30.82 2wwq h GLU 99 CO -0.00 0.07 -0.27 -0.07 0.07 0.00 0.00 179.01 178.81 2wwq h LEU 100 N 0.11 -0.97 -2.08 3.06 3.38 -1.96 -3.11 115.31 113.73 2wwq h LEU 100 Ca 0.21 0.25 -0.07 0.00 0.09 0.00 0.00 57.88 58.37 2wwq h LEU 100 Cb 0.71 0.56 -0.04 0.00 0.09 0.00 0.00 40.66 41.98 2wwq h LEU 100 CO -0.02 -0.28 0.08 0.49 0.09 0.00 0.00 178.44 178.80 2wwq n PHE 101 N -5.50 0.62 -0.68 1.13 0.99 0.29 -3.56 117.46 110.76 2wwq n PHE 101 Ca 0.10 -0.52 0.08 0.00 -0.00 0.00 0.00 57.45 57.11 2wwq n PHE 101 Cb 0.40 -0.32 0.31 0.00 -1.00 0.00 0.00 39.48 38.87 2wwq n PHE 101 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2wwq n ALA 102 N 0.13 3.01 -1.62 4.37 0.00 -1.18 -3.63 120.51 121.58 2wwq n ALA 102 Ca 0.11 -1.75 0.00 0.00 0.00 0.00 0.00 53.44 51.80 2wwq n ALA 102 Cb 0.64 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.24 2wwq n ALA 102 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2wwq n ASP 103 N 0.54 0.00 -4.28 0.00 8.00 -1.23 -5.06 116.55 114.52 2wwq n ASP 103 Ca 0.23 -1.09 -0.17 0.00 0.71 0.00 0.00 54.79 54.46 2wwq n ASP 103 Cb 0.85 -0.02 -0.10 0.00 -0.02 0.00 0.00 41.12 41.83 2wwq n ASP 103 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2wwq s VAL 104 N 0.00 1.44 0.00 2.53 1.01 -1.24 -5.09 120.40 119.06 2wwq s VAL 104 Ca 0.00 -1.99 0.00 0.00 0.00 0.00 0.00 61.98 59.99 2wwq s VAL 104 Cb 0.00 -1.81 0.00 0.00 0.00 0.00 0.00 36.38 34.57 2wwq s VAL 104 CO 0.00 -0.56 0.68 2.29 0.00 0.00 0.00 175.10 177.50 2wwq n LYS 105 N 0.01 0.00 0.14 2.72 2.85 -1.26 -4.82 118.16 117.80 2wwq n LYS 105 Ca -0.11 -0.36 0.00 0.00 -1.05 0.00 0.00 58.31 56.79 2wwq n LYS 105 Cb 0.59 0.18 0.00 0.00 -0.65 0.00 0.00 35.03 35.15 2wwq n LYS 105 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 2wwq n LYS 106 N 0.00 0.00 -0.44 -1.58 3.00 -1.26 -4.29 118.16 113.58 2wwq n LYS 106 Ca -0.10 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.27 2wwq n LYS 106 Cb 0.57 -0.02 -0.02 0.00 0.00 0.00 0.00 35.03 35.56 2wwq n LYS 106 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 2wwq n VAL 107 N -3.44 0.00 0.07 3.15 0.24 -1.26 -2.89 118.33 114.20 2wwq n VAL 107 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 2wwq n VAL 107 Cb 0.00 -0.15 0.00 0.00 -1.47 0.00 0.00 33.84 32.22 2wwq n VAL 107 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2wwq n ASP 108 N -3.84 0.10 -1.45 -1.34 9.92 -0.20 -2.29 116.55 117.46 2wwq n ASP 108 Ca 0.00 0.23 0.00 0.00 -0.53 0.00 0.00 54.79 54.49 2wwq n ASP 108 Cb 0.20 0.12 0.00 0.00 -0.64 0.00 0.00 41.12 40.80 2wwq n ASP 108 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2wwq n VAL 109 N -3.12 -8.63 -3.27 2.53 0.31 -1.26 -3.75 118.33 101.14 2wwq n VAL 109 Ca 0.00 1.94 -0.23 0.00 -0.01 0.00 0.00 64.34 66.04 2wwq n VAL 109 Cb 0.06 -4.15 -0.08 0.00 -0.91 0.00 0.00 33.84 28.77 2wwq n VAL 109 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2wwq n THR 110 N 1.08 -0.98 -0.90 2.52 -1.04 0.02 -4.46 114.28 110.53 2wwq n THR 110 Ca 0.00 -3.16 0.00 0.00 -2.04 0.00 0.00 64.05 58.85 2wwq n THR 110 Cb 0.00 -1.29 0.00 0.00 -1.82 0.00 0.00 70.33 67.22 2wwq n THR 110 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2wwq n GLY 111 N 2.64 1.88 3.18 3.41 0.00 -1.13 -1.15 105.19 114.02 2wwq n GLY 111 Ca 0.27 -1.88 -0.29 0.00 0.00 0.00 0.00 46.02 44.12 2wwq n GLY 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wwq s THR 112 N 3.04 1.78 0.73 2.61 -4.23 -1.24 -2.01 115.64 116.32 2wwq s THR 112 Ca 0.00 -0.89 -0.14 0.00 -1.18 0.00 0.00 61.69 59.49 2wwq s THR 112 Cb 0.00 -1.54 0.04 0.00 1.34 0.00 0.00 72.50 72.34 2wwq s THR 112 CO 0.00 0.50 1.13 -0.94 -0.54 0.00 0.00 174.62 174.77 2wwq s SER 113 N 0.19 4.53 -0.05 3.99 1.04 -0.32 -2.67 113.70 120.41 2wwq s SER 113 Ca -0.11 2.07 -0.18 0.00 0.48 0.00 0.00 55.95 58.21 2wwq s SER 113 Cb -0.15 -2.56 -0.31 0.00 0.10 0.00 0.00 66.02 63.11 2wwq s SER 113 CO 0.05 -2.02 0.79 0.07 0.98 0.00 0.00 173.24 173.10 2wwq h LYS 114 N -0.49 0.33 -1.75 4.02 2.10 -1.89 -2.84 116.57 116.05 2wwq h LYS 114 Ca -0.46 -0.57 0.17 0.00 -2.00 0.00 0.00 60.65 57.79 2wwq h LYS 114 Cb 1.26 0.21 -0.10 0.00 -0.90 0.00 0.00 32.23 32.70 2wwq h LYS 114 CO 0.51 1.27 -0.64 0.41 -2.00 0.00 0.00 179.45 179.00 2wwq n GLY 115 N 1.72 -3.01 0.00 0.07 0.00 -1.26 -3.99 105.19 98.71 2wwq n GLY 115 Ca -0.19 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.58 2wwq n GLY 115 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wwq n LYS 116 N -3.17 2.90 0.00 1.61 5.02 -1.24 -4.89 118.16 118.38 2wwq n LYS 116 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 2wwq n LYS 116 Cb 0.34 -0.93 0.00 0.00 -0.02 0.00 0.00 35.03 34.42 2wwq n LYS 116 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wwq n GLY 117 N 2.56 1.62 0.20 0.72 0.00 -1.25 -4.85 105.19 104.20 2wwq n GLY 117 Ca 0.00 -0.82 0.18 0.00 0.00 0.00 0.00 46.02 45.38 2wwq n GLY 117 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2wwq n PHE 118 N 0.00 0.39 -4.50 1.61 1.16 -1.26 -1.58 117.46 113.28 2wwq n PHE 118 Ca 0.00 0.39 0.00 0.00 -1.87 0.00 0.00 57.45 55.97 2wwq n PHE 118 Cb 0.00 -0.79 0.00 0.00 -1.61 0.00 0.00 39.48 37.08 2wwq n PHE 118 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2wwq n ALA 119 N -2.59 0.00 0.00 1.98 0.00 -1.25 -4.04 120.51 114.60 2wwq n ALA 119 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2wwq n ALA 119 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.15 2wwq n ALA 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wwq n GLY 120 N 0.00 4.76 3.76 0.00 0.00 -1.26 -4.86 105.19 107.59 2wwq n GLY 120 Ca 0.00 -1.14 -0.41 0.00 0.00 0.00 0.00 46.02 44.47 2wwq n GLY 120 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wwq s THR 121 N -1.63 2.76 0.00 2.61 -4.23 -1.26 -0.15 115.64 113.73 2wwq s THR 121 Ca 0.00 0.71 0.00 0.00 -1.18 0.00 0.00 61.69 61.22 2wwq s THR 121 Cb 0.00 -3.45 0.00 0.00 1.34 0.00 0.00 72.50 70.39 2wwq s THR 121 CO 0.00 0.15 0.00 0.52 -0.54 0.00 0.00 174.62 174.75 2wwq n VAL 122 N 1.46 0.00 0.63 2.29 0.31 -1.26 -4.67 118.33 117.09 2wwq n VAL 122 Ca 0.03 0.00 0.13 0.00 -0.01 0.00 0.00 64.34 64.49 2wwq n VAL 122 Cb 0.41 0.00 0.44 0.00 -0.91 0.00 0.00 33.84 33.78 2wwq n VAL 122 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2wwq n LYS 123 N 0.00 0.22 0.00 5.55 5.02 -0.99 -1.96 118.16 126.01 2wwq n LYS 123 Ca 0.00 0.22 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 2wwq n LYS 123 Cb 0.00 -1.78 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 2wwq n LYS 123 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2wwq n ARG 124 N -2.18 1.16 0.00 1.97 3.00 0.78 -4.83 116.66 116.57 2wwq n ARG 124 Ca 0.05 0.00 0.05 0.00 -0.00 0.00 0.00 57.85 57.96 2wwq n ARG 124 Cb 0.39 -0.68 0.01 0.00 0.00 0.00 0.00 32.46 32.18 2wwq n ARG 124 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.63 178.54 2wwq n TRP 125 N -1.23 0.00 -2.79 -0.14 7.02 -1.22 -5.00 117.44 114.09 2wwq n TRP 125 Ca 0.00 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.39 2wwq n TRP 125 Cb 0.18 0.00 0.05 0.00 -2.42 0.00 0.00 31.31 29.12 2wwq n TRP 125 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 2wwq n ASN 126 N -0.01 -2.39 -4.75 -0.99 3.02 -0.83 -4.74 115.26 104.57 2wwq n ASN 126 Ca 0.05 -0.31 -0.23 0.00 -0.03 0.00 0.00 54.58 54.06 2wwq n ASN 126 Cb 0.24 -2.86 0.09 0.00 -0.61 0.00 0.00 39.78 36.64 2wwq n ASN 126 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2wwq s PHE 127 N -3.18 1.95 0.57 3.10 2.99 -1.26 -4.84 117.98 117.32 2wwq s PHE 127 Ca 0.05 -0.16 -0.13 0.00 0.00 0.00 0.00 56.93 56.68 2wwq s PHE 127 Cb -0.02 -2.96 -0.06 0.00 0.00 0.00 0.00 43.02 39.98 2wwq s PHE 127 CO 0.37 -1.52 1.01 1.03 -0.00 0.00 0.00 175.22 176.12 2wwq s ARG 128 N -5.07 3.74 -0.16 0.44 0.52 -1.26 -4.53 118.95 112.63 2wwq s ARG 128 Ca 0.64 0.83 -0.02 0.00 -0.52 0.00 0.00 55.73 56.66 2wwq s ARG 128 Cb -0.07 -2.11 -0.01 0.00 0.52 0.00 0.00 34.95 33.28 2wwq s ARG 128 CO 0.43 -0.44 -0.09 0.99 0.02 0.00 0.00 175.30 176.21 2wwq s THR 129 N -2.94 3.26 0.21 0.02 2.01 -1.26 -4.82 115.64 112.11 2wwq s THR 129 Ca 0.56 -0.57 -0.13 0.00 0.31 0.00 0.00 61.69 61.86 2wwq s THR 129 Cb -0.11 -2.41 0.00 0.00 0.01 0.00 0.00 72.50 70.00 2wwq s THR 129 CO 0.44 0.49 0.43 0.00 -0.69 0.00 0.00 174.62 175.30 2wwq s GLN 130 N 0.65 1.39 -1.26 4.92 0.00 -1.25 -4.87 119.66 119.23 2wwq s GLN 130 Ca -0.05 -1.13 -0.02 0.00 -0.00 0.00 0.00 55.36 54.16 2wwq s GLN 130 Cb -0.15 0.46 0.01 0.00 0.00 0.00 0.00 33.01 33.32 2wwq s GLN 130 CO 0.02 -0.56 0.96 -0.25 0.00 0.00 0.00 175.29 175.46 2wwq n ASP 131 N -0.32 -2.59 0.15 12.60 10.43 -1.26 -3.77 116.55 131.78 2wwq n ASP 131 Ca -0.06 -0.66 -0.14 0.00 2.57 0.00 0.00 54.79 56.51 2wwq n ASP 131 Cb 0.62 -4.80 -0.07 0.00 1.84 0.00 0.00 41.12 38.71 2wwq n ASP 131 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2wwq h ALA 132 N 0.91 -0.37 0.00 2.24 0.00 -1.90 -3.36 119.26 116.78 2wwq h ALA 132 Ca -0.59 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2wwq h ALA 132 Cb 1.35 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2wwq h ALA 132 CO 0.53 -0.73 0.00 -2.37 0.00 0.00 0.00 179.25 176.69 2wwq n THR 133 N -5.29 0.00 -2.48 0.00 5.66 -1.26 -4.74 114.28 106.16 2wwq n THR 133 Ca -0.08 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 60.49 2wwq n THR 133 Cb 0.21 0.77 0.00 0.00 -1.55 0.00 0.00 70.33 69.76 2wwq n THR 133 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 175.07 173.59 2wwq n HIS 134 N 0.00 4.48 -2.28 1.09 -0.00 -1.26 -3.93 115.22 113.32 2wwq n HIS 134 Ca 0.00 -2.92 -0.01 0.00 -0.00 0.00 0.00 57.72 54.79 2wwq n HIS 134 Cb 0.08 -2.56 0.01 0.00 -0.00 0.00 0.00 29.99 27.51 2wwq n HIS 134 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2wwq n GLY 135 N 4.98 0.57 3.79 1.57 0.00 -1.26 -4.65 105.19 110.19 2wwq n GLY 135 Ca 0.48 -0.51 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 2wwq n GLY 135 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2wwq s ASN 136 N -3.06 6.74 0.00 1.61 2.47 -1.25 -4.89 114.94 116.55 2wwq s ASN 136 Ca 0.02 2.00 0.00 0.00 0.42 0.00 0.00 52.86 55.29 2wwq s ASN 136 Cb -0.01 -2.58 0.00 0.00 -1.45 0.00 0.00 41.25 37.21 2wwq s ASN 136 CO 0.05 -0.50 0.00 -1.20 -3.72 0.00 0.00 177.10 171.73 2wwq n SER 137 N -0.19 0.00 0.00 -4.21 7.64 -1.26 -4.96 113.62 110.64 2wwq n SER 137 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.94 2wwq n SER 137 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 2wwq n SER 137 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2wwq n LEU 138 N 0.00 0.00 -4.62 -3.43 4.77 -1.26 -4.98 117.00 107.48 2wwq n LEU 138 Ca 0.00 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.55 2wwq n LEU 138 Cb 0.00 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 2wwq n LEU 138 CO 0.00 0.00 1.31 -0.55 -1.33 0.00 0.00 177.39 176.82 2wwq s SER 139 N 0.17 6.33 0.00 -1.43 0.15 -1.26 -4.67 113.70 113.00 2wwq s SER 139 Ca 0.00 1.24 0.00 0.00 0.70 0.00 0.00 55.95 57.89 2wwq s SER 139 Cb 0.00 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 2wwq s SER 139 CO 0.00 -1.36 0.00 1.41 1.20 0.00 0.00 173.24 174.49 2wwq n HIS 140 N 8.74 -0.36 -0.38 3.44 8.25 -1.25 -4.46 115.22 129.20 2wwq n HIS 140 Ca 0.18 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.76 2wwq n HIS 140 Cb 0.47 0.13 0.32 0.00 1.12 0.00 0.00 29.99 32.03 2wwq n HIS 140 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2wwq n ARG 141 N -1.40 2.74 -1.40 -0.41 1.74 -1.26 -3.74 116.66 112.93 2wwq n ARG 141 Ca 0.00 -2.67 -0.36 0.00 -0.77 0.00 0.00 57.85 54.05 2wwq n ARG 141 Cb 0.00 -1.57 0.09 0.00 -1.02 0.00 0.00 32.46 29.96 2wwq n ARG 141 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 2wwq n VAL 142 N 1.65 3.18 1.73 1.55 0.24 -1.26 -4.57 118.33 120.84 2wwq n VAL 142 Ca 0.25 -0.37 0.15 0.00 -2.04 0.00 0.00 64.34 62.33 2wwq n VAL 142 Cb 0.63 -1.22 0.83 0.00 -1.47 0.00 0.00 33.84 32.61 2wwq n VAL 142 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2wwq n PRO 143 N -2.17 0.80 0.00 7.34 -0.04 -1.26 -4.95 135.00 134.73 2wwq n PRO 143 Ca 0.14 -0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 2wwq n PRO 143 Cb 0.49 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 2wwq n PRO 143 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wwq n GLY 144 N 1.13 4.31 3.81 0.55 0.00 -1.26 -4.66 105.19 109.07 2wwq n GLY 144 Ca 0.20 0.15 -0.32 0.00 0.00 0.00 0.00 46.02 46.04 2wwq n GLY 144 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wwq s SER 145 N -4.00 5.51 0.00 1.61 0.15 -1.26 -4.95 113.70 110.75 2wwq s SER 145 Ca 0.00 1.75 0.00 0.00 0.70 0.00 0.00 55.95 58.40 2wwq s SER 145 Cb 0.00 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 2wwq s SER 145 CO 0.00 -1.35 0.00 2.30 1.20 0.00 0.00 173.24 175.39 2wwq n ILE 146 N -2.57 0.00 -1.91 6.45 -5.35 -1.26 -5.12 119.36 109.59 2wwq n ILE 146 Ca 0.08 -0.23 0.00 0.00 -0.27 0.00 0.00 62.75 62.33 2wwq n ILE 146 Cb 0.53 1.01 0.00 0.00 -1.74 0.00 0.00 39.64 39.44 2wwq n ILE 146 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wwq n GLY 147 N 0.46 3.50 0.00 3.28 0.00 -1.26 -4.97 105.19 106.20 2wwq n GLY 147 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.22 2wwq n GLY 147 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2wwq n GLN 148 N 0.00 0.00 0.00 1.61 3.00 -1.26 -5.16 117.38 115.57 2wwq n GLN 148 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2wwq n GLN 148 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 2wwq n GLN 148 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 2wwq n ASN 149 N 0.00 0.21 0.06 1.08 2.85 -1.26 -5.06 115.26 113.14 2wwq n ASN 149 Ca 0.00 0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.59 2wwq n ASN 149 Cb 0.00 0.00 0.25 0.00 1.24 0.00 0.00 39.78 41.27 2wwq n ASN 149 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2wwq n GLN 150 N 0.00 0.25 -0.18 1.20 6.02 -1.26 -2.94 117.38 120.47 2wwq n GLN 150 Ca 0.00 0.10 0.03 0.00 -0.01 0.00 0.00 57.00 57.13 2wwq n GLN 150 Cb 0.00 -1.69 0.12 0.00 1.02 0.00 0.00 30.24 29.69 2wwq n GLN 150 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 2wwq n THR 151 N -2.07 0.52 -0.01 5.09 -1.04 -1.26 -1.92 114.28 113.59 2wwq n THR 151 Ca 0.04 -0.37 -0.01 0.00 -2.04 0.00 0.00 64.05 61.67 2wwq n THR 151 Cb 0.42 -0.04 -0.01 0.00 -1.82 0.00 0.00 70.33 68.89 2wwq n THR 151 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2wwq n PRO 152 N 0.21 3.49 -0.94 -2.82 -0.04 -1.26 -5.02 135.00 128.62 2wwq n PRO 152 Ca 0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 2wwq n PRO 152 Cb 0.33 -1.04 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 2wwq n PRO 152 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wwq n GLY 153 N 2.93 0.54 3.85 0.55 0.00 -0.81 -4.88 105.19 107.37 2wwq n GLY 153 Ca -0.03 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.97 2wwq n GLY 153 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wwq s LYS 154 N -0.41 1.09 -0.12 1.61 -2.85 -1.26 -5.01 119.74 112.78 2wwq s LYS 154 Ca 0.00 -0.68 0.03 0.00 -1.00 0.00 0.00 55.97 54.32 2wwq s LYS 154 Cb 0.00 0.32 0.00 0.00 -2.06 0.00 0.00 37.83 36.09 2wwq s LYS 154 CO 0.00 -0.51 -0.21 0.08 0.10 0.00 0.00 175.35 174.81 2wwq s VAL 155 N -2.36 2.27 0.65 1.79 1.01 -1.26 -4.81 120.40 117.70 2wwq s VAL 155 Ca 0.20 -0.93 -0.17 0.00 0.00 0.00 0.00 61.98 61.09 2wwq s VAL 155 Cb -0.01 -1.90 -0.06 0.00 0.00 0.00 0.00 36.38 34.41 2wwq s VAL 155 CO 0.03 0.55 0.58 0.49 0.00 0.00 0.00 175.10 176.75 2wwq n PHE 156 N 3.73 -0.56 -2.85 5.22 3.72 -1.26 -4.95 117.46 120.51 2wwq n PHE 156 Ca -0.19 0.39 -0.41 0.00 -0.05 0.00 0.00 57.45 57.19 2wwq n PHE 156 Cb 0.52 -1.96 -0.04 0.00 -0.94 0.00 0.00 39.48 37.07 2wwq n PHE 156 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2wwq s LYS 157 N -2.51 4.52 0.00 -1.08 1.02 -1.26 -3.41 119.74 117.02 2wwq s LYS 157 Ca 0.68 1.20 0.00 0.00 0.02 0.00 0.00 55.97 57.88 2wwq s LYS 157 Cb -0.39 -3.44 0.00 0.00 -0.52 0.00 0.00 37.83 33.48 2wwq s LYS 157 CO 0.55 0.05 0.00 0.41 -0.92 0.00 0.00 175.35 175.44 2wwq n GLY 158 N 2.85 0.77 3.66 -3.33 0.00 -1.26 -5.07 105.19 102.81 2wwq n GLY 158 Ca 0.02 -0.66 -0.43 0.00 0.00 0.00 0.00 46.02 44.95 2wwq n GLY 158 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wwq s LYS 159 N -2.53 4.26 0.30 1.61 2.47 -1.22 -5.02 119.74 119.61 2wwq s LYS 159 Ca 0.00 1.34 -0.30 0.00 -1.56 0.00 0.00 55.97 55.45 2wwq s LYS 159 Cb 0.00 -3.64 -0.12 0.00 -1.46 0.00 0.00 37.83 32.61 2wwq s LYS 159 CO 0.00 -0.61 1.48 0.36 0.16 0.00 0.00 175.35 176.73 2wwq n LYS 160 N 6.26 2.41 0.00 4.03 2.85 -1.26 -4.99 118.16 127.46 2wwq n LYS 160 Ca 0.12 0.86 0.00 0.00 -1.05 0.00 0.00 58.31 58.23 2wwq n LYS 160 Cb 0.46 -2.56 0.00 0.00 -0.65 0.00 0.00 35.03 32.28 2wwq n LYS 160 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2wwq n MET 161 N 1.62 0.00 0.00 -1.58 0.00 -1.26 -5.13 117.12 110.77 2wwq n MET 161 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.78 2wwq n MET 161 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.57 2wwq n MET 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2wwq n ALA 162 N -0.82 0.00 0.00 3.17 0.00 -1.26 -4.97 120.51 116.62 2wwq n ALA 162 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2wwq n ALA 162 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2wwq n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wwq n GLY 163 N 0.00 0.72 2.92 0.00 0.00 -1.26 -4.47 105.19 103.11 2wwq n GLY 163 Ca 0.00 -1.13 -0.11 0.00 0.00 0.00 0.00 46.02 44.78 2wwq n GLY 163 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2wwq s GLN 164 N 0.00 0.14 -0.08 1.61 2.00 -1.25 -3.97 119.66 118.11 2wwq s GLN 164 Ca 0.00 -0.23 0.05 0.00 -2.00 0.00 0.00 55.36 53.18 2wwq s GLN 164 Cb 0.00 0.05 -0.01 0.00 0.80 0.00 0.00 33.01 33.85 2wwq s GLN 164 CO 0.00 -0.02 -0.23 1.41 -0.50 0.00 0.00 175.29 175.95 2wwq s MET 165 N -0.57 2.81 2.49 1.67 -2.45 -0.61 -4.85 119.30 117.79 2wwq s MET 165 Ca -0.06 -0.86 0.00 0.00 -1.25 0.00 0.00 55.69 53.51 2wwq s MET 165 Cb -0.04 -2.27 0.00 0.00 1.25 0.00 0.00 34.83 33.77 2wwq s MET 165 CO -0.00 0.30 0.00 0.41 1.05 0.00 0.00 175.02 176.78 2wwq n GLY 166 N 3.18 0.88 2.72 2.11 0.00 -1.26 -3.67 105.19 109.14 2wwq n GLY 166 Ca -0.18 -0.80 -0.11 0.00 0.00 0.00 0.00 46.02 44.93 2wwq n GLY 166 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wwq n ASN 167 N -3.22 -3.86 -3.81 1.61 3.02 -1.07 -4.82 115.26 103.12 2wwq n ASN 167 Ca 0.00 -0.47 -0.06 0.00 -0.03 0.00 0.00 54.58 54.02 2wwq n ASN 167 Cb 0.00 -3.78 -0.02 0.00 -0.61 0.00 0.00 39.78 35.37 2wwq n ASN 167 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 2wwq s GLU 168 N -4.40 1.58 0.37 3.52 -1.05 -1.26 -5.00 118.70 112.46 2wwq s GLU 168 Ca 0.18 -0.86 -0.19 0.00 -0.15 0.00 0.00 54.97 53.95 2wwq s GLU 168 Cb -0.02 0.55 -0.10 0.00 -0.44 0.00 0.00 34.13 34.11 2wwq s GLU 168 CO 0.52 -0.72 0.86 -0.98 0.95 0.00 0.00 175.26 175.88 2wwq s ARG 169 N -3.72 4.19 0.10 -4.83 1.70 -1.26 -1.17 118.95 113.96 2wwq s ARG 169 Ca 0.11 0.97 -0.21 0.00 -0.47 0.00 0.00 55.73 56.13 2wwq s ARG 169 Cb -0.04 -2.38 0.05 0.00 -0.57 0.00 0.00 34.95 32.01 2wwq s ARG 169 CO 0.05 0.10 0.51 0.54 -1.08 0.00 0.00 175.30 175.41 2wwq s VAL 170 N -2.01 0.03 0.05 4.99 0.11 -0.85 -4.78 120.40 117.94 2wwq s VAL 170 Ca 0.57 -0.27 -0.27 0.00 -2.93 0.00 0.00 61.98 59.08 2wwq s VAL 170 Cb -0.11 -1.04 0.08 0.00 -1.53 0.00 0.00 36.38 33.78 2wwq s VAL 170 CO 0.16 -0.15 0.70 0.28 -3.33 0.00 0.00 175.10 172.76 2wwq s THR 171 N -3.17 0.00 -0.10 5.04 -1.32 -1.26 -2.82 115.64 112.00 2wwq s THR 171 Ca -0.01 0.00 0.01 0.00 -1.21 0.00 0.00 61.69 60.48 2wwq s THR 171 Cb -0.00 -1.00 -0.00 0.00 -1.51 0.00 0.00 72.50 69.99 2wwq s THR 171 CO -0.08 0.00 0.23 1.33 -2.21 0.00 0.00 174.62 173.90 2wwq n VAL 172 N 0.11 0.00 -0.03 5.08 0.24 -1.26 -5.10 118.33 117.36 2wwq n VAL 172 Ca -0.16 -0.48 0.00 0.00 -2.04 0.00 0.00 64.34 61.66 2wwq n VAL 172 Cb 0.62 1.01 -0.00 0.00 -1.47 0.00 0.00 33.84 34.00 2wwq n VAL 172 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wwq n GLN 173 N -0.62 -0.07 0.00 7.34 6.02 -1.26 -5.03 117.38 123.75 2wwq n GLN 173 Ca 0.00 0.06 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 2wwq n GLN 173 Cb 0.02 -0.08 0.00 0.00 1.02 0.00 0.00 30.24 31.21 2wwq n GLN 173 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2wwq n SER 174 N -1.66 0.00 -1.38 1.08 2.88 -0.97 -4.86 113.62 108.71 2wwq n SER 174 Ca -0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2wwq n SER 174 Cb 0.01 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 2wwq n SER 174 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2wwq n LEU 175 N 0.00 -1.88 -4.17 2.46 4.77 -1.18 -1.03 117.00 115.98 2wwq n LEU 175 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.63 2wwq n LEU 175 Cb 0.00 -0.47 0.09 0.00 -2.33 0.00 0.00 43.42 40.71 2wwq n LEU 175 CO 0.00 0.00 -1.05 0.47 -1.33 0.00 0.00 177.39 175.48 2wwq n ASP 176 N -1.38 -3.48 -4.69 -1.43 8.00 -1.14 -3.76 116.55 108.68 2wwq n ASP 176 Ca 0.00 0.10 -0.41 0.00 0.71 0.00 0.00 54.79 55.19 2wwq n ASP 176 Cb 0.47 -0.85 -0.04 0.00 -0.02 0.00 0.00 41.12 40.68 2wwq n ASP 176 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2wwq s VAL 177 N -2.15 4.89 0.00 2.53 1.01 -1.26 -1.86 120.40 123.56 2wwq s VAL 177 Ca 0.47 1.73 0.00 0.00 0.00 0.00 0.00 61.98 64.18 2wwq s VAL 177 Cb -0.10 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.10 2wwq s VAL 177 CO 0.71 0.07 0.00 0.52 0.00 0.00 0.00 175.10 176.41 2wwq n VAL 178 N 4.44 0.00 -3.82 2.92 0.31 -1.13 -4.92 118.33 116.12 2wwq n VAL 178 Ca 0.05 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.25 2wwq n VAL 178 Cb 0.49 -1.35 -0.13 0.00 -0.91 0.00 0.00 33.84 31.94 2wwq n VAL 178 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2wwq s ARG 179 N -2.00 0.15 -0.42 5.55 1.81 -1.09 -5.02 118.95 117.93 2wwq s ARG 179 Ca 0.00 0.19 -0.08 0.00 -1.72 0.00 0.00 55.73 54.12 2wwq s ARG 179 Cb 0.00 0.06 0.09 0.00 -0.45 0.00 0.00 34.95 34.65 2wwq s ARG 179 CO 0.00 -0.03 0.25 0.08 -0.68 0.00 0.00 175.30 174.93 2wwq s VAL 180 N 0.13 4.06 -0.36 3.52 1.01 -1.26 -2.68 120.40 124.82 2wwq s VAL 180 Ca -0.01 -1.53 -0.01 0.00 0.00 0.00 0.00 61.98 60.44 2wwq s VAL 180 Cb -0.01 -3.53 0.09 0.00 0.00 0.00 0.00 36.38 32.92 2wwq s VAL 180 CO -0.00 -0.55 0.10 -1.81 0.00 0.00 0.00 175.10 172.85 2wwq s ASP 181 N 2.12 5.03 -0.13 3.32 1.01 -1.00 -4.92 116.67 122.10 2wwq s ASP 181 Ca 0.04 -1.82 0.18 0.00 0.71 0.00 0.00 52.55 51.65 2wwq s ASP 181 Cb -0.23 -1.75 0.72 0.00 1.01 0.00 0.00 42.92 42.67 2wwq s ASP 181 CO 0.01 -0.42 1.63 0.00 0.21 0.00 0.00 175.17 176.60 2wwq n ALA 182 N 4.53 3.14 -1.27 5.23 0.00 -1.26 -1.81 120.51 129.08 2wwq n ALA 182 Ca -0.04 -1.66 0.00 0.00 0.00 0.00 0.00 53.44 51.74 2wwq n ALA 182 Cb 0.42 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.87 2wwq n ALA 182 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2wwq n GLU 183 N 1.00 0.00 0.00 0.00 0.00 -1.26 -4.65 120.64 115.73 2wwq n GLU 183 Ca 0.26 -0.11 0.00 0.00 0.00 0.00 0.00 57.16 57.31 2wwq n GLU 183 Cb 0.92 -0.37 0.00 0.00 0.00 0.00 0.00 31.44 31.99 2wwq n GLU 183 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 2wwq n ARG 184 N 0.00 4.22 -2.96 3.44 1.74 -1.26 -5.03 116.66 116.82 2wwq n ARG 184 Ca 0.00 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.97 2wwq n ARG 184 Cb 0.32 -0.35 0.03 0.00 -1.02 0.00 0.00 32.46 31.45 2wwq n ARG 184 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2wwq n ASN 185 N 0.00 -4.04 -4.90 0.55 4.13 -0.75 -4.95 115.26 105.30 2wwq n ASN 185 Ca 0.00 -0.24 -0.32 0.00 1.68 0.00 0.00 54.58 55.70 2wwq n ASN 185 Cb 0.00 -2.66 -0.05 0.00 -1.54 0.00 0.00 39.78 35.54 2wwq n ASN 185 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2wwq s LEU 186 N -3.91 4.33 -0.12 3.41 1.43 -0.80 -1.16 118.68 121.86 2wwq s LEU 186 Ca 0.26 0.30 -0.02 0.00 -1.03 0.00 0.00 54.13 53.64 2wwq s LEU 186 Cb -0.11 -2.71 0.04 0.00 0.03 0.00 0.00 46.19 43.44 2wwq s LEU 186 CO 0.32 0.23 0.03 -0.22 0.23 0.00 0.00 176.35 176.94 2wwq s LEU 187 N -2.14 0.67 -0.28 1.79 2.96 -0.71 -2.37 118.68 118.61 2wwq s LEU 187 Ca 0.30 -0.36 -0.09 0.00 -0.22 0.00 0.00 54.13 53.76 2wwq s LEU 187 Cb -0.13 -0.42 -0.03 0.00 0.50 0.00 0.00 46.19 46.11 2wwq s LEU 187 CO 0.22 -0.26 0.14 -0.76 -1.32 0.00 0.00 176.35 174.37 2wwq s LEU 188 N 1.99 3.85 0.45 -0.68 1.43 -1.09 -2.15 118.68 122.47 2wwq s LEU 188 Ca 0.03 -0.23 0.08 0.00 -1.03 0.00 0.00 54.13 52.98 2wwq s LEU 188 Cb -0.14 -2.02 0.01 0.00 0.03 0.00 0.00 46.19 44.07 2wwq s LEU 188 CO -0.06 -0.09 0.52 0.68 0.23 0.00 0.00 176.35 177.63 2wwq s VAL 189 N 1.67 2.67 -0.18 -1.59 -7.23 -1.17 -2.65 120.40 111.92 2wwq s VAL 189 Ca 0.06 -1.16 -0.07 0.00 -1.81 0.00 0.00 61.98 59.00 2wwq s VAL 189 Cb -0.16 -2.83 -0.04 0.00 0.56 0.00 0.00 36.38 33.91 2wwq s VAL 189 CO 0.07 0.00 0.05 -0.75 -0.31 0.00 0.00 175.10 174.16 2wwq s LYS 190 N -4.31 3.93 0.32 4.82 2.47 -0.78 -3.86 119.74 122.33 2wwq s LYS 190 Ca 0.52 -0.36 0.00 0.00 -1.56 0.00 0.00 55.97 54.57 2wwq s LYS 190 Cb -0.06 -3.18 0.00 0.00 -1.46 0.00 0.00 37.83 33.13 2wwq s LYS 190 CO 0.31 0.28 0.00 0.41 0.16 0.00 0.00 175.35 176.52 2wwq n GLY 191 N 3.49 -1.74 3.72 5.54 0.00 -1.12 -4.23 105.19 110.85 2wwq n GLY 191 Ca -0.17 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.54 2wwq n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wwq s ALA 192 N -2.45 3.62 0.26 4.61 0.00 -1.26 -4.34 121.76 122.20 2wwq s ALA 192 Ca 0.00 1.15 0.02 0.00 0.00 0.00 0.00 51.96 53.13 2wwq s ALA 192 Cb 0.00 -3.55 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 2wwq s ALA 192 CO 0.00 -0.64 0.42 0.14 0.00 0.00 0.00 175.76 175.69 2wwq s VAL 193 N 1.12 5.20 0.01 0.00 -7.23 -1.26 -5.09 120.40 113.16 2wwq s VAL 193 Ca 0.65 -0.67 -0.10 0.00 -1.81 0.00 0.00 61.98 60.05 2wwq s VAL 193 Cb -0.38 -3.83 -0.05 0.00 0.56 0.00 0.00 36.38 32.68 2wwq s VAL 193 CO 0.30 -0.36 0.24 -2.65 -0.31 0.00 0.00 175.10 172.32 2wwq n PRO 194 N -1.34 0.00 -1.08 4.82 -0.02 -1.26 -4.91 135.00 131.21 2wwq n PRO 194 Ca -0.07 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.55 2wwq n PRO 194 Cb 0.56 -0.36 -0.06 0.00 -0.02 0.00 0.00 33.50 33.63 2wwq n PRO 194 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wwq n GLY 195 N 0.43 -2.64 3.74 -1.23 0.00 -1.09 -4.62 105.19 99.78 2wwq n GLY 195 Ca 0.05 -1.19 -0.29 0.00 0.00 0.00 0.00 46.02 44.59 2wwq n GLY 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wwq s ALA 196 N -3.17 1.56 0.02 4.61 0.00 -1.26 -4.85 121.76 118.66 2wwq s ALA 196 Ca 0.00 -0.34 -0.39 0.00 0.00 0.00 0.00 51.96 51.23 2wwq s ALA 196 Cb 0.00 -3.10 -0.19 0.00 0.00 0.00 0.00 23.12 19.83 2wwq s ALA 196 CO 0.00 -2.37 1.18 0.25 0.00 0.00 0.00 175.76 174.81 2wwq n THR 197 N -3.86 0.00 0.00 0.00 -2.24 -1.26 -3.34 114.28 103.58 2wwq n THR 197 Ca 0.06 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2wwq n THR 197 Cb 0.57 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 2wwq n THR 197 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wwq n GLY 198 N 1.91 0.88 3.75 3.38 0.00 -0.97 -5.01 105.19 109.13 2wwq n GLY 198 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 2wwq n GLY 198 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wwq s SER 199 N -1.95 6.73 0.49 1.61 0.01 -1.21 -4.87 113.70 114.51 2wwq s SER 199 Ca 0.00 2.62 -0.21 0.00 1.31 0.00 0.00 55.95 59.67 2wwq s SER 199 Cb 0.00 -2.63 -0.07 0.00 0.21 0.00 0.00 66.02 63.53 2wwq s SER 199 CO 0.00 -0.63 1.12 -1.81 0.41 0.00 0.00 173.24 172.33 2wwq s ASP 200 N 0.16 6.06 -0.29 2.44 1.01 -1.26 -3.20 116.67 121.60 2wwq s ASP 200 Ca 0.56 2.16 -0.14 0.00 0.71 0.00 0.00 52.55 55.85 2wwq s ASP 200 Cb -0.40 -2.58 0.10 0.00 1.01 0.00 0.00 42.92 41.04 2wwq s ASP 200 CO 0.45 -0.98 0.67 -0.76 0.21 0.00 0.00 175.17 174.76 2wwq s LEU 201 N -3.40 -1.02 0.89 1.23 1.02 -1.14 -3.59 118.68 112.67 2wwq s LEU 201 Ca 0.68 1.54 -0.11 0.00 0.02 0.00 0.00 54.13 56.25 2wwq s LEU 201 Cb -0.24 2.36 0.13 0.00 0.02 0.00 0.00 46.19 48.45 2wwq s LEU 201 CO 0.28 -0.23 1.09 -0.63 0.02 0.00 0.00 176.35 176.88 2wwq s ILE 202 N 2.12 2.68 -0.45 -0.59 1.01 -0.30 -2.13 121.20 123.53 2wwq s ILE 202 Ca -0.08 0.22 0.07 0.00 0.00 0.00 0.00 60.65 60.85 2wwq s ILE 202 Cb -0.08 -2.69 0.24 0.00 0.01 0.00 0.00 42.46 39.94 2wwq s ILE 202 CO -0.20 -0.29 0.74 0.55 0.00 0.00 0.00 174.94 175.74 2wwq n VAL 203 N -3.88 -0.29 -0.85 2.92 3.14 -1.17 -0.80 118.33 117.40 2wwq n VAL 203 Ca 0.07 -2.45 -0.33 0.00 -2.96 0.00 0.00 64.34 58.67 2wwq n VAL 203 Cb 0.55 0.14 0.13 0.00 -1.06 0.00 0.00 33.84 33.59 2wwq n VAL 203 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 2wwq n LYS 204 N 1.63 -0.22 -3.38 1.45 5.02 -1.26 -3.99 118.16 117.42 2wwq n LYS 204 Ca 0.14 -0.01 -0.38 0.00 -2.02 0.00 0.00 58.31 56.05 2wwq n LYS 204 Cb 0.59 -2.06 -0.06 0.00 -0.02 0.00 0.00 35.03 33.48 2wwq n LYS 204 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2wwq s PRO 205 N -3.86 4.24 0.48 1.97 0.04 -1.26 -1.70 135.00 134.91 2wwq s PRO 205 Ca 0.62 0.41 -0.13 0.00 0.04 0.00 0.00 61.00 61.95 2wwq s PRO 205 Cb -0.24 -3.38 -0.07 0.00 0.04 0.00 0.00 34.50 30.85 2wwq s PRO 205 CO 0.62 0.29 0.89 0.00 0.04 0.00 0.00 177.00 178.84 2wwq s ALA 206 N 0.20 3.20 0.00 8.56 0.00 -1.22 -4.88 121.76 127.62 2wwq s ALA 206 Ca 0.24 -0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.17 2wwq s ALA 206 Cb -0.15 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.05 2wwq s ALA 206 CO 0.10 -0.19 0.52 1.33 0.00 0.00 0.00 175.76 177.52 2wwq n VAL 207 N -1.61 0.00 0.67 0.00 0.24 -1.26 -4.71 118.33 111.67 2wwq n VAL 207 Ca 0.04 0.00 0.08 0.00 -2.04 0.00 0.00 64.34 62.42 2wwq n VAL 207 Cb 0.54 0.05 0.07 0.00 -1.47 0.00 0.00 33.84 33.03 2wwq n VAL 207 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2wwq n LYS 208 N 0.00 1.24 0.00 7.34 5.02 -1.26 -5.26 118.16 125.23 2wwq n LYS 208 Ca 0.00 -1.45 0.02 0.00 -2.02 0.00 0.00 58.31 54.87 2wwq n LYS 208 Cb 0.52 -1.31 0.02 0.00 -0.02 0.00 0.00 35.03 34.24 2wwq n LYS 208 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88