#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wbq s GLU 2 N 0.00 1.86 -0.14 1.43 -1.05 -1.26 -4.84 118.70 114.70 1wbq s GLU 2 Ca 0.00 -1.48 -0.16 0.00 -0.15 0.00 0.00 54.97 53.18 1wbq s GLU 2 Cb 0.00 0.50 -0.04 0.00 -0.44 0.00 0.00 34.13 34.15 1wbq s GLU 2 CO 0.00 -0.80 0.39 0.42 0.95 0.00 0.00 175.26 176.22 1wbq s ILE 3 N -3.25 5.24 0.56 1.83 -1.09 -1.26 -4.91 121.20 118.32 1wbq s ILE 3 Ca 0.24 0.76 -0.12 0.00 -2.23 0.00 0.00 60.65 59.30 1wbq s ILE 3 Cb -0.02 -3.73 -0.05 0.00 -1.58 0.00 0.00 42.46 37.08 1wbq s ILE 3 CO 0.14 0.35 0.98 -0.94 -1.23 0.00 0.00 174.94 174.24 1wbq s SER 4 N 0.57 6.36 0.30 3.58 1.04 -1.26 -4.95 113.70 119.34 1wbq s SER 4 Ca 0.21 1.40 0.04 0.00 0.48 0.00 0.00 55.95 58.08 1wbq s SER 4 Cb -0.14 -2.45 0.64 0.00 0.10 0.00 0.00 66.02 64.17 1wbq s SER 4 CO 0.07 -0.73 1.83 0.03 0.98 0.00 0.00 173.24 175.41 1wbq h ARG 5 N 0.18 0.87 -0.29 4.02 3.08 -1.97 -1.20 114.38 119.06 1wbq h ARG 5 Ca -0.45 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 59.44 1wbq h ARG 5 Cb 1.19 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 31.03 1wbq h ARG 5 CO 0.62 0.57 -0.25 1.96 -1.07 0.00 0.00 179.97 181.81 1wbq h GLN 6 N 0.89 0.57 -0.27 0.04 7.50 -1.99 -2.20 115.11 119.65 1wbq h GLN 6 Ca 0.51 -0.22 -0.03 0.00 0.50 0.00 0.00 58.65 59.41 1wbq h GLN 6 Cb 0.63 -0.03 -0.01 0.00 0.05 0.00 0.00 27.48 28.12 1wbq h GLN 6 CO -0.28 0.77 0.04 1.49 -1.50 0.00 0.00 178.83 179.34 1wbq h GLU 7 N 0.50 0.46 -0.96 1.46 4.81 -1.61 0.65 114.58 119.89 1wbq h GLU 7 Ca 0.07 -0.13 0.04 0.00 -0.13 0.00 0.00 59.36 59.22 1wbq h GLU 7 Cb 0.69 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.96 1wbq h GLU 7 CO 0.05 0.58 0.63 0.74 -0.73 0.00 0.00 179.01 180.28 1wbq h PHE 8 N 0.27 1.16 -0.21 0.92 0.04 -1.31 -0.92 116.94 116.88 1wbq h PHE 8 Ca 0.08 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.86 1wbq h PHE 8 Cb 0.35 -0.39 -0.01 0.00 2.20 0.00 0.00 35.95 38.11 1wbq h PHE 8 CO 0.02 0.65 0.07 0.37 -0.60 0.00 0.00 178.31 178.82 1wbq h GLN 9 N 1.18 0.33 -0.88 1.51 5.75 -1.18 -2.32 115.11 119.51 1wbq h GLN 9 Ca 0.39 -0.07 0.09 0.00 -0.15 0.00 0.00 58.65 58.91 1wbq h GLN 9 Cb 0.05 -0.05 -0.07 0.00 1.07 0.00 0.00 27.48 28.48 1wbq h GLN 9 CO -0.13 0.42 0.52 0.00 -2.65 0.00 0.00 178.83 177.00 1wbq h ARG 10 N 0.17 0.86 -0.25 1.69 3.08 -0.25 -1.51 114.38 118.17 1wbq h ARG 10 Ca 0.07 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 1wbq h ARG 10 Cb 0.23 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1wbq h ARG 10 CO -0.00 0.57 0.08 0.00 -1.07 0.00 0.00 179.97 179.55 1wbq h ARG 11 N 0.88 0.38 -0.56 0.04 3.08 -1.04 0.24 114.38 117.41 1wbq h ARG 11 Ca 0.42 -0.08 0.02 0.00 0.07 0.00 0.00 59.98 60.40 1wbq h ARG 11 Cb 0.35 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 1wbq h ARG 11 CO -0.23 0.45 0.35 0.00 -1.07 0.00 0.00 179.97 179.46 1wbq h ARG 12 N 0.23 0.68 -0.30 0.04 3.08 -1.08 -1.83 114.38 115.19 1wbq h ARG 12 Ca 0.08 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.02 1wbq h ARG 12 Cb 0.23 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 1wbq h ARG 12 CO -0.00 0.45 -0.11 1.96 -1.07 0.00 0.00 179.97 181.19 1wbq h GLN 13 N 0.70 0.50 -0.51 0.04 1.08 -1.12 -1.17 115.11 114.63 1wbq h GLN 13 Ca 0.22 -0.14 -0.08 0.00 -1.45 0.00 0.00 58.65 57.19 1wbq h GLN 13 Cb -0.01 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.34 1wbq h GLN 13 CO -0.08 0.61 -0.02 0.00 -0.95 0.00 0.00 178.83 178.39 1wbq h ALA 14 N 1.42 1.01 -0.12 3.87 0.00 -0.37 0.25 119.26 125.32 1wbq h ALA 14 Ca 0.09 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1wbq h ALA 14 Cb 0.48 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1wbq h ALA 14 CO 0.03 0.61 0.01 1.25 0.00 0.00 0.00 179.25 181.15 1wbq h LEU 15 N 0.80 0.20 -1.11 0.00 5.85 -1.05 -3.10 115.31 116.89 1wbq h LEU 15 Ca 0.15 -0.28 0.03 0.00 0.84 0.00 0.00 57.88 58.62 1wbq h LEU 15 Cb 0.51 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 1wbq h LEU 15 CO 0.03 0.43 0.60 0.58 -0.34 0.00 0.00 178.44 179.74 1wbq h VAL 16 N -0.04 1.17 -0.87 1.05 2.07 -1.03 -1.25 116.25 117.35 1wbq h VAL 16 Ca 0.04 -0.40 0.09 0.00 0.82 0.00 0.00 66.70 67.25 1wbq h VAL 16 Cb 0.32 -0.10 -0.06 0.00 -1.52 0.00 0.00 31.29 29.93 1wbq h VAL 16 CO 0.00 0.21 0.57 -0.08 0.02 0.00 0.00 177.57 178.29 1wbq h GLU 17 N 1.17 0.84 -0.00 1.57 4.22 -0.93 -1.46 114.58 119.98 1wbq h GLU 17 Ca 0.36 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.75 1wbq h GLU 17 Cb -0.01 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.05 1wbq h GLU 17 CO -0.10 0.56 -0.12 1.04 -2.18 0.00 0.00 179.01 178.21 1wbq n GLN 18 N -4.52 0.21 -2.99 1.92 6.02 -0.51 -4.89 117.38 112.62 1wbq n GLN 18 Ca 0.15 -0.05 -0.33 0.00 -0.01 0.00 0.00 57.00 56.76 1wbq n GLN 18 Cb 0.30 -1.50 -0.07 0.00 1.02 0.00 0.00 30.24 30.00 1wbq n GLN 18 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1wbq s MET 19 N -2.83 4.12 0.58 -1.09 -1.94 -0.55 -5.05 119.30 112.54 1wbq s MET 19 Ca 0.19 0.88 -0.18 0.00 -1.71 0.00 0.00 55.69 54.87 1wbq s MET 19 Cb 0.19 -2.34 -0.04 0.00 2.01 0.00 0.00 34.83 34.65 1wbq s MET 19 CO 0.54 0.08 1.16 -0.65 -0.01 0.00 0.00 175.02 176.14 1wbq s GLN 20 N -3.02 3.10 0.57 2.03 -0.21 -1.26 -5.02 119.66 115.85 1wbq s GLN 20 Ca 0.57 1.67 -0.19 0.00 0.02 0.00 0.00 55.36 57.43 1wbq s GLN 20 Cb -0.10 -1.96 -0.04 0.00 1.00 0.00 0.00 33.01 31.90 1wbq s GLN 20 CO 0.16 -1.07 1.20 -1.25 -2.12 0.00 0.00 175.29 172.21 1wbq s PRO 21 N -3.42 3.12 -0.73 2.91 0.04 -1.26 -3.59 135.00 132.07 1wbq s PRO 21 Ca 0.74 1.82 -0.00 0.00 0.04 0.00 0.00 61.00 63.59 1wbq s PRO 21 Cb -0.26 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.27 1wbq s PRO 21 CO 0.32 -1.08 0.61 0.41 0.04 0.00 0.00 177.00 177.29 1wbq n GLY 22 N 0.47 -0.03 3.20 0.56 0.00 0.67 -4.80 105.19 105.25 1wbq n GLY 22 Ca 0.12 -0.13 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 1wbq n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wbq s SER 23 N -3.77 0.25 -0.01 1.61 1.04 -0.53 -0.46 113.70 111.84 1wbq s SER 23 Ca 0.03 -1.05 0.01 0.00 0.48 0.00 0.00 55.95 55.42 1wbq s SER 23 Cb -0.01 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.43 1wbq s SER 23 CO 0.44 -0.75 -0.02 0.00 0.98 0.00 0.00 173.24 173.89 1wbq s ALA 24 N -3.99 0.19 -0.13 5.32 0.00 -0.83 -0.56 121.76 121.76 1wbq s ALA 24 Ca 0.18 -0.05 -0.03 0.00 0.00 0.00 0.00 51.96 52.07 1wbq s ALA 24 Cb 0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 23.12 23.07 1wbq s ALA 24 CO -0.01 0.03 -0.02 0.00 0.00 0.00 0.00 175.76 175.75 1wbq s ALA 25 N 0.12 3.13 -0.19 0.00 0.00 0.29 0.10 121.76 125.20 1wbq s ALA 25 Ca -0.01 -0.81 -0.01 0.00 0.00 0.00 0.00 51.96 51.13 1wbq s ALA 25 Cb -0.03 -1.54 0.01 0.00 0.00 0.00 0.00 23.12 21.55 1wbq s ALA 25 CO -0.00 0.36 -0.13 -0.51 0.00 0.00 0.00 175.76 175.47 1wbq s LEU 26 N -0.12 2.46 -0.18 0.00 1.43 -0.28 -1.18 118.68 120.81 1wbq s LEU 26 Ca 0.03 -0.53 0.00 0.00 -1.03 0.00 0.00 54.13 52.60 1wbq s LEU 26 Cb -0.13 -1.59 0.04 0.00 0.03 0.00 0.00 46.19 44.55 1wbq s LEU 26 CO 0.02 -0.00 -0.08 -0.63 0.23 0.00 0.00 176.35 175.89 1wbq s ILE 27 N 1.32 1.40 -0.07 -0.59 1.01 -0.29 -4.50 121.20 119.48 1wbq s ILE 27 Ca 0.04 -0.82 -0.05 0.00 0.00 0.00 0.00 60.65 59.82 1wbq s ILE 27 Cb -0.14 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.78 1wbq s ILE 27 CO -0.08 0.16 0.14 -0.36 0.00 0.00 0.00 174.94 174.80 1wbq s PHE 28 N 1.51 3.55 0.76 3.97 0.40 -1.26 -0.48 117.98 126.42 1wbq s PHE 28 Ca -0.00 0.44 -0.11 0.00 -0.60 0.00 0.00 56.93 56.66 1wbq s PHE 28 Cb -0.16 -1.88 0.05 0.00 0.51 0.00 0.00 43.02 41.54 1wbq s PHE 28 CO -0.08 0.69 1.09 0.00 0.70 0.00 0.00 175.22 177.61 1wbq s ALA 29 N -1.13 2.32 0.46 5.36 0.00 -0.16 -4.65 121.76 123.95 1wbq s ALA 29 Ca 0.19 0.27 -0.23 0.00 0.00 0.00 0.00 51.96 52.20 1wbq s ALA 29 Cb -0.12 -3.27 -0.08 0.00 0.00 0.00 0.00 23.12 19.66 1wbq s ALA 29 CO 0.09 -1.67 1.12 0.00 0.00 0.00 0.00 175.76 175.30 1wbq s ALA 30 N -2.88 2.96 0.65 0.00 0.00 -1.26 -4.80 121.76 116.43 1wbq s ALA 30 Ca 0.61 0.84 -0.13 0.00 0.00 0.00 0.00 51.96 53.28 1wbq s ALA 30 Cb -0.17 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.59 1wbq s ALA 30 CO 0.55 -0.54 1.06 -1.25 0.00 0.00 0.00 175.76 175.58 1wbq s PRO 31 N -2.76 3.09 0.70 0.00 0.04 -1.26 -4.41 135.00 130.41 1wbq s PRO 31 Ca 0.64 1.08 -0.15 0.00 0.04 0.00 0.00 61.00 62.61 1wbq s PRO 31 Cb -0.26 -2.01 0.02 0.00 0.04 0.00 0.00 34.50 32.30 1wbq s PRO 31 CO 0.31 -0.98 1.16 -1.21 0.04 0.00 0.00 177.00 176.32 1wbq s GLU 32 N -4.57 2.41 -0.09 4.56 2.02 -1.26 -4.92 118.70 116.86 1wbq s GLU 32 Ca 0.61 1.58 -0.00 0.00 0.02 0.00 0.00 54.97 57.18 1wbq s GLU 32 Cb -0.15 -1.89 0.02 0.00 0.10 0.00 0.00 34.13 32.22 1wbq s GLU 32 CO 0.46 -1.59 -0.06 0.08 0.02 0.00 0.00 175.26 174.18 1wbq s VAL 33 N -2.17 0.80 0.26 2.63 1.01 -1.26 -5.09 120.40 116.58 1wbq s VAL 33 Ca 0.71 -0.18 -0.30 0.00 0.00 0.00 0.00 61.98 62.21 1wbq s VAL 33 Cb -0.25 -0.84 -0.09 0.00 0.00 0.00 0.00 36.38 35.19 1wbq s VAL 33 CO 0.44 0.32 1.27 -0.89 0.00 0.00 0.00 175.10 176.23 1wbq s THR 34 N 1.53 3.10 -0.25 3.92 2.01 -1.26 -1.31 115.64 123.38 1wbq s THR 34 Ca 0.00 1.01 -0.16 0.00 0.31 0.00 0.00 61.69 62.85 1wbq s THR 34 Cb -0.13 -3.64 -0.11 0.00 0.01 0.00 0.00 72.50 68.62 1wbq s THR 34 CO -0.05 0.20 -0.28 -1.14 -0.69 0.00 0.00 174.62 172.66 1wbq n ARG 35 N 1.73 0.57 -3.64 4.92 0.63 -0.05 -4.65 116.66 116.17 1wbq n ARG 35 Ca 0.03 0.30 -0.06 0.00 -0.92 0.00 0.00 57.85 57.20 1wbq n ARG 35 Cb 0.43 -1.52 -0.07 0.00 0.45 0.00 0.00 32.46 31.75 1wbq n ARG 35 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1wbq s SER 36 N -7.03 -0.96 1.21 6.15 0.15 -1.07 -5.03 113.70 107.12 1wbq s SER 36 Ca -0.35 1.50 0.00 0.00 0.70 0.00 0.00 55.95 57.80 1wbq s SER 36 Cb 0.11 1.54 0.00 0.00 -1.71 0.00 0.00 66.02 65.97 1wbq s SER 36 CO 0.48 -0.23 0.00 0.00 1.20 0.00 0.00 173.24 174.69 1wbq n ALA 37 N 4.55 0.00 1.39 5.45 0.00 -1.26 -1.31 120.51 129.33 1wbq n ALA 37 Ca -0.18 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.39 1wbq n ALA 37 Cb 0.57 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.49 1wbq n ALA 37 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1wbq n ASP 38 N 6.47 1.16 -4.84 0.00 5.75 -1.26 -4.88 116.55 118.96 1wbq n ASP 38 Ca 0.00 -1.13 -0.36 0.00 -0.01 0.00 0.00 54.79 53.28 1wbq n ASP 38 Cb 0.00 0.05 -0.06 0.00 -1.03 0.00 0.00 41.12 40.09 1wbq n ASP 38 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1wbq s SER 39 N -2.27 6.83 0.12 -1.12 1.04 -0.43 -5.02 113.70 112.85 1wbq s SER 39 Ca 0.31 1.03 0.10 0.00 0.48 0.00 0.00 55.95 57.87 1wbq s SER 39 Cb 0.20 -2.27 -0.04 0.00 0.10 0.00 0.00 66.02 64.01 1wbq s SER 39 CO 0.43 0.19 -0.21 -1.61 0.98 0.00 0.00 173.24 173.03 1wbq s GLU 40 N -1.61 1.67 0.74 4.02 2.02 -1.26 -0.87 118.70 123.40 1wbq s GLU 40 Ca 0.32 -1.24 -0.14 0.00 0.02 0.00 0.00 54.97 53.93 1wbq s GLU 40 Cb -0.16 -2.05 0.05 0.00 0.10 0.00 0.00 34.13 32.07 1wbq s GLU 40 CO 0.18 0.47 1.17 0.71 0.02 0.00 0.00 175.26 177.80 1wbq s TYR 41 N -1.14 2.16 0.20 1.61 2.02 -0.43 -4.72 117.35 117.06 1wbq s TYR 41 Ca 0.17 1.61 -0.33 0.00 -0.37 0.00 0.00 57.07 58.15 1wbq s TYR 41 Cb -0.10 -3.36 -0.14 0.00 -0.40 0.00 0.00 41.96 37.96 1wbq s TYR 41 CO 0.09 -2.37 1.42 -2.30 -1.57 0.00 0.00 175.55 170.82 1wbq n PRO 42 N -2.90 1.89 -1.91 -1.71 -0.02 -1.26 -4.75 135.00 124.33 1wbq n PRO 42 Ca 0.12 0.68 -0.41 0.00 -2.02 0.00 0.00 63.50 61.86 1wbq n PRO 42 Cb 0.51 -2.34 -0.02 0.00 -0.02 0.00 0.00 33.50 31.63 1wbq n PRO 42 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1wbq s TYR 43 N 0.25 2.89 -0.20 6.00 5.04 -1.26 -5.00 117.35 125.08 1wbq s TYR 43 Ca 0.73 0.95 0.00 0.00 -2.44 0.00 0.00 57.07 56.32 1wbq s TYR 43 Cb -0.71 -3.92 0.05 0.00 0.35 0.00 0.00 41.96 37.73 1wbq s TYR 43 CO 0.46 -3.01 -0.06 0.50 -1.34 0.00 0.00 175.55 172.10 1wbq s ARG 44 N -0.56 1.65 0.44 4.97 6.06 -1.26 -5.12 118.95 125.11 1wbq s ARG 44 Ca 0.60 -0.76 -0.25 0.00 -2.50 0.00 0.00 55.73 52.83 1wbq s ARG 44 Cb -0.44 -2.32 -0.08 0.00 0.06 0.00 0.00 34.95 32.17 1wbq s ARG 44 CO 0.46 -0.49 1.26 -1.14 -2.50 0.00 0.00 175.30 172.89 1wbq s GLN 45 N 1.50 3.82 0.19 5.12 2.00 -1.26 -4.77 119.66 126.25 1wbq s GLN 45 Ca -0.02 2.03 -0.33 0.00 -2.00 0.00 0.00 55.36 55.04 1wbq s GLN 45 Cb -0.17 -2.59 -0.14 0.00 0.80 0.00 0.00 33.01 30.91 1wbq s GLN 45 CO -0.07 -0.57 1.46 -1.71 -0.50 0.00 0.00 175.29 173.89 1wbq n ASN 46 N -0.18 2.72 -0.26 6.67 2.85 -1.26 -4.85 115.26 120.94 1wbq n ASN 46 Ca 0.06 1.12 -0.05 0.00 -0.11 0.00 0.00 54.58 55.59 1wbq n ASN 46 Cb 0.45 -1.39 0.10 0.00 1.24 0.00 0.00 39.78 40.17 1wbq n ASN 46 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 1wbq h SER 47 N 4.90 1.04 -0.37 1.20 0.02 -1.93 0.14 113.55 118.56 1wbq h SER 47 Ca -0.45 -0.16 -0.14 0.00 -0.84 0.00 0.00 61.79 60.20 1wbq h SER 47 Cb 1.28 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.54 1wbq h SER 47 CO 0.81 0.93 -0.31 0.44 -1.14 0.00 0.00 176.83 177.56 1wbq h ASP 48 N 1.10 0.91 -0.50 3.07 3.32 -1.96 0.43 116.42 122.80 1wbq h ASP 48 Ca 0.25 -0.45 -0.05 0.00 0.02 0.00 0.00 57.03 56.80 1wbq h ASP 48 Cb 0.22 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 1wbq h ASP 48 CO -0.02 1.17 0.11 0.15 -1.72 0.00 0.00 179.24 178.93 1wbq h PHE 49 N 0.66 0.85 -0.46 4.55 3.57 -1.75 -2.93 116.94 121.43 1wbq h PHE 49 Ca 0.07 -0.11 0.03 0.00 3.53 0.00 0.00 57.97 61.49 1wbq h PHE 49 Cb 0.89 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.35 1wbq h PHE 49 CO 0.06 0.76 0.25 2.35 -2.23 0.00 0.00 178.31 179.51 1wbq h TRP 50 N 0.69 0.46 -0.98 0.41 2.91 -0.63 -2.77 115.95 116.04 1wbq h TRP 50 Ca 0.16 0.02 0.15 0.00 1.13 0.00 0.00 58.89 60.34 1wbq h TRP 50 Cb 0.35 -0.14 -0.09 0.00 -0.51 0.00 0.00 29.16 28.77 1wbq h TRP 50 CO 0.02 0.25 0.62 -0.92 -1.03 0.00 0.00 178.44 177.38 1wbq h TYR 51 N 0.50 1.04 -0.01 2.65 3.20 -0.73 0.19 116.97 123.81 1wbq h TYR 51 Ca 0.19 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.09 1wbq h TYR 51 Cb 0.07 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.02 1wbq h TYR 51 CO -0.09 0.35 -0.26 1.19 -1.64 0.00 0.00 178.16 177.71 1wbq n PHE 52 N -4.64 0.00 0.00 -3.82 3.72 -1.12 -4.70 117.46 106.90 1wbq n PHE 52 Ca 0.20 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.60 1wbq n PHE 52 Cb 0.45 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.90 1wbq n PHE 52 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1wbq n THR 53 N -0.46 0.00 -2.35 4.37 -2.24 -0.73 -4.81 114.28 108.07 1wbq n THR 53 Ca 0.12 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.70 1wbq n THR 53 Cb 0.37 -0.05 -0.01 0.00 -2.10 0.00 0.00 70.33 68.53 1wbq n THR 53 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wbq n GLY 54 N 1.23 -0.34 3.41 3.38 0.00 0.61 -4.97 105.19 108.51 1wbq n GLY 54 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1wbq n GLY 54 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1wbq s PHE 55 N -2.99 3.03 -0.51 1.61 5.36 -1.26 -5.03 117.98 118.18 1wbq s PHE 55 Ca 0.00 -0.56 0.02 0.00 -0.96 0.00 0.00 56.93 55.43 1wbq s PHE 55 Cb 0.00 -2.14 0.53 0.00 -0.34 0.00 0.00 43.02 41.07 1wbq s PHE 55 CO 0.00 -0.35 1.85 -1.71 -1.46 0.00 0.00 175.22 173.55 1wbq n ASN 56 N 4.58 5.50 -4.57 6.13 5.15 -1.26 -4.78 115.26 126.01 1wbq n ASN 56 Ca -0.17 -3.73 -0.30 0.00 -0.60 0.00 0.00 54.58 49.78 1wbq n ASN 56 Cb 0.51 -0.83 -0.10 0.00 -0.53 0.00 0.00 39.78 38.83 1wbq n ASN 56 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1wbq s GLU 57 N -3.56 2.15 0.93 1.20 2.02 -1.26 -4.93 118.70 115.25 1wbq s GLU 57 Ca 0.59 -1.00 -0.15 0.00 0.02 0.00 0.00 54.97 54.43 1wbq s GLU 57 Cb 0.48 -2.31 0.18 0.00 0.10 0.00 0.00 34.13 32.58 1wbq s GLU 57 CO 0.03 0.52 1.29 -1.25 0.02 0.00 0.00 175.26 175.87 1wbq s PRO 58 N -2.10 0.86 -1.25 0.39 0.04 -1.26 -4.51 135.00 127.17 1wbq s PRO 58 Ca 0.21 -0.36 -0.04 0.00 0.04 0.00 0.00 61.00 60.85 1wbq s PRO 58 Cb -0.11 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.54 1wbq s PRO 58 CO 0.13 -2.27 0.75 0.39 0.04 0.00 0.00 177.00 176.04 1wbq n GLU 59 N -3.67 -4.19 -3.96 4.56 1.02 -1.26 -4.71 120.64 108.42 1wbq n GLU 59 Ca 0.14 0.63 -0.09 0.00 -0.02 0.00 0.00 57.16 57.82 1wbq n GLU 59 Cb 0.60 -5.13 -0.11 0.00 -0.02 0.00 0.00 31.44 26.78 1wbq n GLU 59 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wbq s ALA 60 N -3.60 0.07 -0.06 0.62 0.00 -1.26 -3.48 121.76 114.04 1wbq s ALA 60 Ca 0.11 -0.51 -0.03 0.00 0.00 0.00 0.00 51.96 51.54 1wbq s ALA 60 Cb -0.03 0.14 0.04 0.00 0.00 0.00 0.00 23.12 23.27 1wbq s ALA 60 CO 0.81 -0.16 0.12 0.08 0.00 0.00 0.00 175.76 176.62 1wbq s VAL 61 N -1.37 -0.14 -0.18 0.00 1.01 0.20 -0.99 120.40 118.94 1wbq s VAL 61 Ca -0.15 0.28 -0.16 0.00 0.00 0.00 0.00 61.98 61.96 1wbq s VAL 61 Cb -0.09 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 36.02 1wbq s VAL 61 CO -0.01 0.12 0.38 -0.22 0.00 0.00 0.00 175.10 175.37 1wbq s LEU 62 N 1.70 4.20 -0.23 3.92 2.96 0.37 -0.70 118.68 130.90 1wbq s LEU 62 Ca -0.03 0.55 0.02 0.00 -0.22 0.00 0.00 54.13 54.45 1wbq s LEU 62 Cb -0.12 -2.50 0.04 0.00 0.50 0.00 0.00 46.19 44.11 1wbq s LEU 62 CO -0.05 -0.02 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.13 1wbq s VAL 63 N 0.97 2.17 -0.28 1.68 1.01 0.89 -1.14 120.40 125.71 1wbq s VAL 63 Ca 0.19 -1.30 -0.10 0.00 0.00 0.00 0.00 61.98 60.78 1wbq s VAL 63 Cb -0.14 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 1wbq s VAL 63 CO 0.07 0.23 0.14 -0.76 0.00 0.00 0.00 175.10 174.78 1wbq s LEU 64 N 1.20 3.86 -0.19 3.92 1.43 -0.32 -0.60 118.68 127.97 1wbq s LEU 64 Ca -0.02 -0.20 -0.03 0.00 -1.03 0.00 0.00 54.13 52.85 1wbq s LEU 64 Cb -0.17 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.01 1wbq s LEU 64 CO -0.08 -0.08 -0.05 -0.63 0.23 0.00 0.00 176.35 175.74 1wbq s ILE 65 N 1.68 3.50 -0.38 -0.59 1.01 0.48 -0.55 121.20 126.35 1wbq s ILE 65 Ca 0.06 -0.47 -0.06 0.00 0.00 0.00 0.00 60.65 60.19 1wbq s ILE 65 Cb -0.16 -2.57 0.08 0.00 0.01 0.00 0.00 42.46 39.82 1wbq s ILE 65 CO 0.08 0.45 0.18 -0.75 0.00 0.00 0.00 174.94 174.89 1wbq s LYS 66 N 1.06 2.42 -0.00 2.79 2.20 0.28 -0.86 119.74 127.63 1wbq s LYS 66 Ca 0.01 -1.48 -0.23 0.00 -0.36 0.00 0.00 55.97 53.92 1wbq s LYS 66 Cb -0.15 -3.58 -0.19 0.00 -1.51 0.00 0.00 37.83 32.41 1wbq s LYS 66 CO 0.00 -0.88 1.23 0.77 -0.36 0.00 0.00 175.35 176.10 1wbq h SER 67 N 8.22 0.25 -0.98 1.43 0.02 -1.54 0.22 113.55 121.17 1wbq h SER 67 Ca -0.20 -0.58 0.00 0.00 -0.84 0.00 0.00 61.79 60.17 1wbq h SER 67 Cb 1.07 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.54 1wbq h SER 67 CO 0.68 0.78 0.00 -0.90 -1.14 0.00 0.00 176.83 176.25 1wbq n ASP 68 N -4.61 0.00 0.18 3.07 5.68 -1.04 -1.96 116.55 117.87 1wbq n ASP 68 Ca -0.08 -0.82 0.14 0.00 -0.50 0.00 0.00 54.79 53.53 1wbq n ASP 68 Cb 0.38 0.00 0.58 0.00 -1.14 0.00 0.00 41.12 40.94 1wbq n ASP 68 CO 0.00 0.00 0.00 -0.78 -1.33 0.00 0.00 177.20 175.09 1wbq h ASP 69 N 0.00 0.00 0.00 -1.12 3.58 -1.97 -3.19 116.42 113.72 1wbq h ASP 69 Ca 0.00 0.00 -0.19 0.00 0.42 0.00 0.00 57.03 57.26 1wbq h ASP 69 Cb 0.00 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.01 1wbq h ASP 69 CO 0.00 0.00 -1.72 0.35 -2.88 0.00 0.00 179.24 174.99 1wbq n THR 70 N -2.51 0.73 -3.72 2.25 -2.24 -1.26 -5.01 114.28 102.52 1wbq n THR 70 Ca 0.01 -0.39 -0.37 0.00 -2.27 0.00 0.00 64.05 61.04 1wbq n THR 70 Cb 0.23 -0.81 -0.11 0.00 -2.10 0.00 0.00 70.33 67.54 1wbq n THR 70 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1wbq s HIS 71 N -2.26 3.20 0.07 4.78 3.76 -1.21 -5.07 115.29 118.57 1wbq s HIS 71 Ca -0.10 -0.03 -0.11 0.00 -0.15 0.00 0.00 55.06 54.67 1wbq s HIS 71 Cb 0.04 -2.27 0.01 0.00 1.11 0.00 0.00 32.58 31.46 1wbq s HIS 71 CO 0.38 -0.13 0.25 0.54 -0.85 0.00 0.00 174.74 174.93 1wbq s ASN 72 N 1.38 -0.00 0.25 1.40 2.20 -1.26 -1.53 114.94 117.37 1wbq s ASN 72 Ca 0.06 -0.44 -0.15 0.00 -0.94 0.00 0.00 52.86 51.39 1wbq s ASN 72 Cb -0.15 0.35 0.00 0.00 -2.00 0.00 0.00 41.25 39.46 1wbq s ASN 72 CO 0.06 -0.68 0.54 -1.38 -2.94 0.00 0.00 177.10 172.70 1wbq s HIS 73 N -3.28 0.18 0.00 1.54 -3.43 -0.04 -5.00 115.29 105.25 1wbq s HIS 73 Ca 0.00 -0.56 0.07 0.00 -0.80 0.00 0.00 55.06 53.77 1wbq s HIS 73 Cb 0.02 0.34 -0.02 0.00 -1.43 0.00 0.00 32.58 31.49 1wbq s HIS 73 CO -0.08 -1.05 -0.21 -1.54 -2.00 0.00 0.00 174.74 169.86 1wbq s SER 74 N -2.98 2.46 -0.07 7.38 1.04 -1.26 -0.39 113.70 119.89 1wbq s SER 74 Ca 0.18 -0.42 0.02 0.00 0.48 0.00 0.00 55.95 56.21 1wbq s SER 74 Cb -0.02 -0.25 0.01 0.00 0.10 0.00 0.00 66.02 65.86 1wbq s SER 74 CO 0.07 0.23 -0.13 -0.69 0.98 0.00 0.00 173.24 173.70 1wbq s VAL 75 N -0.59 1.21 -0.17 5.02 1.01 0.23 -2.49 120.40 124.62 1wbq s VAL 75 Ca 0.08 -0.52 -0.05 0.00 0.00 0.00 0.00 61.98 61.48 1wbq s VAL 75 Cb -0.08 -1.10 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 1wbq s VAL 75 CO 0.00 0.37 0.00 -0.22 0.00 0.00 0.00 175.10 175.25 1wbq s LEU 76 N 0.63 3.44 -0.20 3.92 2.96 0.28 -0.08 118.68 129.63 1wbq s LEU 76 Ca -0.15 -0.07 -0.14 0.00 -0.22 0.00 0.00 54.13 53.55 1wbq s LEU 76 Cb -0.16 -1.85 -0.04 0.00 0.50 0.00 0.00 46.19 44.64 1wbq s LEU 76 CO 0.04 0.15 0.29 -0.36 -1.32 0.00 0.00 176.35 175.16 1wbq s PHE 77 N 0.47 3.39 0.21 5.38 0.08 0.12 0.16 117.98 127.78 1wbq s PHE 77 Ca -0.01 0.49 -0.14 0.00 0.12 0.00 0.00 56.93 57.39 1wbq s PHE 77 Cb -0.14 -2.38 0.01 0.00 -0.57 0.00 0.00 43.02 39.94 1wbq s PHE 77 CO 0.02 0.10 0.46 0.54 -0.10 0.00 0.00 175.22 176.24 1wbq s ASN 78 N 0.83 -0.13 0.31 1.36 4.22 -0.34 -0.62 114.94 120.57 1wbq s ASN 78 Ca 0.15 -0.73 -0.29 0.00 -2.14 0.00 0.00 52.86 49.84 1wbq s ASN 78 Cb -0.14 0.56 -0.10 0.00 1.28 0.00 0.00 41.25 42.85 1wbq s ASN 78 CO 0.05 -1.06 1.30 -0.13 -2.04 0.00 0.00 177.10 175.22 1wbq s ARG 79 N -3.95 4.38 0.66 3.55 0.52 -1.23 -0.73 118.95 122.16 1wbq s ARG 79 Ca 0.16 2.17 -0.15 0.00 -0.52 0.00 0.00 55.73 57.39 1wbq s ARG 79 Cb -0.00 -3.09 0.00 0.00 0.52 0.00 0.00 34.95 32.38 1wbq s ARG 79 CO 0.02 -0.17 1.11 0.54 0.02 0.00 0.00 175.30 176.82 1wbq s VAL 80 N -0.96 3.25 0.09 3.52 0.11 -1.26 -3.62 120.40 121.52 1wbq s VAL 80 Ca 0.50 0.57 -0.31 0.00 -2.93 0.00 0.00 61.98 59.81 1wbq s VAL 80 Cb -0.39 -3.09 -0.07 0.00 -1.53 0.00 0.00 36.38 31.30 1wbq s VAL 80 CO 0.50 -0.37 1.38 -0.13 -3.33 0.00 0.00 175.10 173.15 1wbq s ARG 81 N -4.13 4.32 -0.04 1.54 0.52 -1.26 -4.80 118.95 115.09 1wbq s ARG 81 Ca 0.67 2.03 -0.02 0.00 -0.52 0.00 0.00 55.73 57.89 1wbq s ARG 81 Cb -0.20 -3.32 0.03 0.00 0.52 0.00 0.00 34.95 31.97 1wbq s ARG 81 CO 0.42 -0.45 0.04 0.34 0.02 0.00 0.00 175.30 175.68 1wbq s ASP 82 N 1.26 1.06 0.09 0.23 3.68 -1.26 -5.06 116.67 116.68 1wbq s ASP 82 Ca 0.64 0.04 -0.33 0.00 2.13 0.00 0.00 52.55 55.03 1wbq s ASP 82 Cb -0.35 -0.19 -0.14 0.00 -1.45 0.00 0.00 42.92 40.78 1wbq s ASP 82 CO 0.30 -0.22 1.59 0.25 0.13 0.00 0.00 175.17 177.22 1wbq h LEU 83 N 8.23 -1.16 0.47 -1.34 5.85 -2.00 -2.13 115.31 123.23 1wbq h LEU 83 Ca -0.19 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.61 1wbq h LEU 83 Cb 1.12 0.39 0.00 0.00 0.37 0.00 0.00 40.66 42.55 1wbq h LEU 83 CO 0.22 -0.57 -0.23 0.74 -0.34 0.00 0.00 178.44 178.27 1wbq h THR 84 N -0.84 0.52 -0.21 1.05 2.02 -2.00 -2.19 112.91 111.26 1wbq h THR 84 Ca -0.03 -0.22 0.06 0.00 0.77 0.00 0.00 66.41 66.99 1wbq h THR 84 Cb 0.75 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 1wbq h THR 84 CO -0.08 0.04 0.23 0.00 0.37 0.00 0.00 175.52 176.07 1wbq h ALA 85 N -0.29 1.87 0.11 6.16 0.00 -1.97 -2.31 119.26 122.84 1wbq h ALA 85 Ca -0.06 -0.01 -0.34 0.00 0.00 0.00 0.00 54.91 54.50 1wbq h ALA 85 Cb 0.55 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1wbq h ALA 85 CO 0.11 -0.34 -1.81 0.93 0.00 0.00 0.00 179.25 178.14 1wbq h GLU 86 N 0.00 0.24 -0.87 0.00 5.08 -1.31 0.16 114.58 117.88 1wbq h GLU 86 Ca 0.10 -0.41 0.23 0.00 -1.00 0.00 0.00 59.36 58.28 1wbq h GLU 86 Cb 0.55 0.15 -0.14 0.00 0.50 0.00 0.00 28.75 29.82 1wbq h GLU 86 CO -0.00 1.20 0.22 0.82 -1.00 0.00 0.00 179.01 180.25 1wbq h ILE 87 N -0.12 0.32 0.00 3.13 2.04 -1.01 0.31 117.51 122.18 1wbq h ILE 87 Ca -0.39 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.40 1wbq h ILE 87 Cb 1.91 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 1wbq h ILE 87 CO 0.05 0.04 0.00 0.79 0.00 0.00 0.00 178.15 179.03 1wbq n TRP 88 N -5.23 0.00 -0.06 1.37 7.02 -0.90 -4.58 117.44 115.05 1wbq n TRP 88 Ca 0.21 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.58 1wbq n TRP 88 Cb 0.67 0.00 0.07 0.00 -2.42 0.00 0.00 31.31 29.63 1wbq n TRP 88 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1wbq n PHE 89 N -0.47 1.26 -0.05 -5.99 3.72 0.55 -4.97 117.46 111.53 1wbq n PHE 89 Ca 0.00 -1.18 0.00 0.00 -0.05 0.00 0.00 57.45 56.22 1wbq n PHE 89 Cb 0.00 -0.59 -0.00 0.00 -0.94 0.00 0.00 39.48 37.94 1wbq n PHE 89 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wbq n GLY 90 N -0.06 -2.67 3.75 1.37 0.00 0.09 -4.87 105.19 102.81 1wbq n GLY 90 Ca 0.25 -1.42 -0.37 0.00 0.00 0.00 0.00 46.02 44.47 1wbq n GLY 90 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wbq s ARG 91 N -3.16 3.08 0.01 1.61 0.52 -1.26 -4.37 118.95 115.38 1wbq s ARG 91 Ca 0.00 2.05 0.07 0.00 -0.52 0.00 0.00 55.73 57.33 1wbq s ARG 91 Cb 0.00 -2.13 -0.02 0.00 0.52 0.00 0.00 34.95 33.32 1wbq s ARG 91 CO 0.00 -1.18 -0.21 1.03 0.02 0.00 0.00 175.30 174.96 1wbq s ARG 92 N -3.06 1.60 0.11 3.54 0.52 -1.26 -5.05 118.95 115.34 1wbq s ARG 92 Ca 0.74 -0.85 -0.24 0.00 -0.52 0.00 0.00 55.73 54.86 1wbq s ARG 92 Cb -0.36 -1.62 -0.09 0.00 0.52 0.00 0.00 34.95 33.40 1wbq s ARG 92 CO 0.41 0.43 1.69 1.25 0.02 0.00 0.00 175.30 179.10 1wbq h LEU 93 N 5.29 -0.36 0.00 2.53 5.85 -1.94 -3.46 115.31 123.22 1wbq h LEU 93 Ca -0.41 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.39 1wbq h LEU 93 Cb 1.15 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 1wbq h LEU 93 CO 0.46 -0.19 -0.04 0.61 -0.34 0.00 0.00 178.44 178.94 1wbq n GLY 94 N -1.26 -2.19 0.07 3.75 0.00 -1.24 -4.36 105.19 99.97 1wbq n GLY 94 Ca -0.06 -1.48 -0.09 0.00 0.00 0.00 0.00 46.02 44.39 1wbq n GLY 94 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1wbq h GLN 95 N 0.00 0.04 -0.15 1.61 7.50 -1.90 -3.20 115.11 119.00 1wbq h GLN 95 Ca 0.00 -0.07 -0.08 0.00 0.50 0.00 0.00 58.65 59.00 1wbq h GLN 95 Cb 0.10 0.03 -0.00 0.00 0.05 0.00 0.00 27.48 27.66 1wbq h GLN 95 CO 0.00 0.88 -0.20 -0.44 -1.50 0.00 0.00 178.83 177.57 1wbq h ASP 96 N 0.01 0.44 1.50 1.46 3.32 -1.92 -3.27 116.42 117.95 1wbq h ASP 96 Ca -0.12 -0.51 0.00 0.00 0.02 0.00 0.00 57.03 56.42 1wbq h ASP 96 Cb 1.88 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 41.30 1wbq h ASP 96 CO 0.12 0.86 -0.20 0.00 -1.72 0.00 0.00 179.24 178.31 1wbq h ALA 97 N 0.59 0.88 -0.29 3.45 0.00 -1.76 -3.40 119.26 118.73 1wbq h ALA 97 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1wbq h ALA 97 Cb 0.76 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1wbq h ALA 97 CO 0.05 0.00 0.10 0.00 0.00 0.00 0.00 179.25 179.39 1wbq h ALA 98 N 2.30 0.38 -0.54 0.00 0.00 -1.60 -1.41 119.26 118.39 1wbq h ALA 98 Ca 0.00 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 54.87 1wbq h ALA 98 Cb 0.85 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.44 1wbq h ALA 98 CO 0.00 0.01 0.04 -1.35 0.00 0.00 0.00 179.25 177.95 1wbq h PRO 99 N 0.31 0.15 -0.06 0.00 0.11 -1.76 0.18 132.00 130.93 1wbq h PRO 99 Ca 0.09 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 66.07 1wbq h PRO 99 Cb 0.23 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 31.32 1wbq h PRO 99 CO -0.00 0.10 -0.44 1.49 -0.21 0.00 0.00 178.00 178.94 1wbq h GLU 100 N 0.16 0.41 0.11 1.05 4.22 -1.79 0.53 114.58 119.27 1wbq h GLU 100 Ca 0.28 -0.36 -0.01 0.00 0.08 0.00 0.00 59.36 59.35 1wbq h GLU 100 Cb 0.42 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1wbq h GLU 100 CO -0.42 1.00 -0.05 -0.22 -2.18 0.00 0.00 179.01 177.14 1wbq h LYS 101 N -0.07 -0.15 -0.12 1.92 1.63 -1.00 -3.26 116.57 115.53 1wbq h LYS 101 Ca -0.04 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 1wbq h LYS 101 Cb 1.11 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.77 1wbq h LYS 101 CO 0.09 0.02 0.00 1.28 -3.45 0.00 0.00 179.45 177.39 1wbq n LEU 102 N -5.09 3.02 -2.87 5.20 4.77 0.60 -4.99 117.00 117.64 1wbq n LEU 102 Ca -0.08 -1.14 -0.18 0.00 -0.03 0.00 0.00 56.01 54.58 1wbq n LEU 102 Cb 0.14 -0.07 0.06 0.00 -2.33 0.00 0.00 43.42 41.22 1wbq n LEU 102 CO 0.33 0.55 0.18 0.61 -1.33 0.00 0.00 177.39 177.74 1wbq n GLY 103 N 1.31 -0.19 3.69 -0.72 0.00 0.11 -4.99 105.19 104.40 1wbq n GLY 103 Ca 0.15 0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1wbq n GLY 103 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1wbq s VAL 104 N -3.25 3.97 0.12 1.61 -7.23 -0.81 -5.02 120.40 109.80 1wbq s VAL 104 Ca 0.42 -1.11 0.15 0.00 -1.81 0.00 0.00 61.98 59.63 1wbq s VAL 104 Cb -0.19 -2.93 0.04 0.00 0.56 0.00 0.00 36.38 33.87 1wbq s VAL 104 CO 0.56 0.05 1.59 0.44 -0.31 0.00 0.00 175.10 177.43 1wbq h ASP 105 N 3.18 0.00 -3.91 4.85 3.32 -1.82 -3.38 116.42 118.65 1wbq h ASP 105 Ca -0.48 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.48 1wbq h ASP 105 Cb 1.18 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.50 1wbq h ASP 105 CO 0.59 0.53 -0.13 -0.60 -1.72 0.00 0.00 179.24 177.92 1wbq s ARG 106 N -3.36 0.59 -0.05 3.56 3.52 -1.04 -4.99 118.95 117.17 1wbq s ARG 106 Ca 0.01 0.70 0.02 0.00 -0.13 0.00 0.00 55.73 56.33 1wbq s ARG 106 Cb 0.10 0.28 0.01 0.00 -1.56 0.00 0.00 34.95 33.79 1wbq s ARG 106 CO 0.73 -0.07 -0.11 0.00 -0.81 0.00 0.00 175.30 175.04 1wbq s ALA 107 N 0.28 1.14 0.17 6.12 0.00 -1.26 -0.56 121.76 127.65 1wbq s ALA 107 Ca -0.00 -0.38 0.08 0.00 0.00 0.00 0.00 51.96 51.66 1wbq s ALA 107 Cb -0.04 -0.49 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 1wbq s ALA 107 CO 0.01 0.12 -0.18 -0.51 0.00 0.00 0.00 175.76 175.20 1wbq s LEU 108 N 0.54 2.46 0.22 0.00 1.43 0.12 -4.89 118.68 118.56 1wbq s LEU 108 Ca -0.11 -0.89 -0.30 0.00 -1.03 0.00 0.00 54.13 51.80 1wbq s LEU 108 Cb -0.14 -0.81 -0.09 0.00 0.03 0.00 0.00 46.19 45.18 1wbq s LEU 108 CO 0.03 -0.06 1.34 0.00 0.23 0.00 0.00 176.35 177.89 1wbq s ALA 109 N -2.21 3.55 0.42 4.21 0.00 -1.26 -1.19 121.76 125.28 1wbq s ALA 109 Ca 0.17 1.17 0.10 0.00 0.00 0.00 0.00 51.96 53.40 1wbq s ALA 109 Cb -0.05 -3.50 0.90 0.00 0.00 0.00 0.00 23.12 20.47 1wbq s ALA 109 CO 0.07 -0.59 2.01 0.35 0.00 0.00 0.00 175.76 177.60 1wbq h PHE 110 N 5.23 0.30 -0.01 0.00 3.57 -1.23 -1.06 116.94 123.74 1wbq h PHE 110 Ca -0.45 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.04 1wbq h PHE 110 Cb 1.22 -0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.86 1wbq h PHE 110 CO 0.61 0.29 0.09 0.66 -2.23 0.00 0.00 178.31 177.73 1wbq h SER 111 N 0.30 0.00 -0.49 0.41 4.64 -1.91 -1.97 113.55 114.52 1wbq h SER 111 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1wbq h SER 111 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1wbq h SER 111 CO -0.00 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.34 1wbq n GLU 112 N -3.07 2.52 -0.33 4.77 -0.58 -0.40 -4.68 120.64 118.87 1wbq n GLU 112 Ca -0.03 -2.32 -0.02 0.00 -0.42 0.00 0.00 57.16 54.37 1wbq n GLU 112 Cb 0.16 -1.52 0.14 0.00 -0.57 0.00 0.00 31.44 29.65 1wbq n GLU 112 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 1wbq h ILE 113 N 4.26 1.24 0.00 -3.67 2.10 -1.43 -1.34 117.51 118.67 1wbq h ILE 113 Ca 0.00 -0.48 -0.06 0.00 1.08 0.00 0.00 64.86 65.40 1wbq h ILE 113 Cb 0.95 -0.10 -0.01 0.00 -1.09 0.00 0.00 36.82 36.57 1wbq h ILE 113 CO 0.00 0.24 -0.30 0.78 -1.08 0.00 0.00 178.15 177.79 1wbq h ASN 114 N 1.26 0.00 1.48 2.19 2.35 -1.83 0.33 115.58 121.37 1wbq h ASN 114 Ca 0.34 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.09 1wbq h ASN 114 Cb -0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.26 1wbq h ASN 114 CO -0.07 0.30 -0.32 1.56 -1.65 0.00 0.00 177.43 177.25 1wbq h GLN 115 N 0.00 0.00 0.00 0.81 7.50 -1.63 -3.40 115.11 118.38 1wbq h GLN 115 Ca -0.00 0.00 -0.10 0.00 0.50 0.00 0.00 58.65 59.04 1wbq h GLN 115 Cb 0.78 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.29 1wbq h GLN 115 CO 0.04 0.00 -1.40 1.04 -1.50 0.00 0.00 178.83 177.01 1wbq n GLN 116 N -2.66 1.48 -0.12 1.46 1.13 -0.60 -4.71 117.38 113.35 1wbq n GLN 116 Ca 0.03 0.02 -0.08 0.00 -1.94 0.00 0.00 57.00 55.04 1wbq n GLN 116 Cb 0.50 -1.14 0.00 0.00 0.11 0.00 0.00 30.24 29.71 1wbq n GLN 116 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1wbq h LEU 117 N 0.00 0.43 -1.79 1.08 5.85 -0.57 -2.00 115.31 118.32 1wbq h LEU 117 Ca -0.16 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.57 1wbq h LEU 117 Cb 1.29 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 1wbq h LEU 117 CO -0.01 0.31 0.16 0.10 -0.34 0.00 0.00 178.44 178.66 1wbq h TYR 118 N 0.52 0.27 -0.37 1.25 -0.00 -1.81 -0.99 116.97 115.85 1wbq h TYR 118 Ca 0.15 0.01 -0.11 0.00 -0.00 0.00 0.00 58.73 58.78 1wbq h TYR 118 Cb -0.05 -0.09 -0.01 0.00 -0.00 0.00 0.00 36.73 36.58 1wbq h TYR 118 CO -0.05 0.17 -0.21 1.96 -0.00 0.00 0.00 178.16 180.02 1wbq h GLN 119 N 0.29 0.71 -0.13 0.10 4.20 -1.65 0.34 115.11 118.96 1wbq h GLN 119 Ca 0.09 -0.27 -0.10 0.00 0.06 0.00 0.00 58.65 58.43 1wbq h GLN 119 Cb 0.01 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 1wbq h GLN 119 CO -0.02 0.86 -0.35 -0.07 -0.67 0.00 0.00 178.83 178.58 1wbq h LEU 120 N 0.62 0.27 0.00 1.46 3.38 -0.89 -3.20 115.31 116.95 1wbq h LEU 120 Ca 0.09 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1wbq h LEU 120 Cb 0.69 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1wbq h LEU 120 CO 0.05 0.61 -0.85 -0.07 0.09 0.00 0.00 178.44 178.27 1wbq h LEU 121 N 0.23 0.00 -9.28 1.67 3.38 -1.01 -3.46 115.31 106.83 1wbq h LEU 121 Ca 0.03 -0.12 -0.66 0.00 0.09 0.00 0.00 57.88 57.22 1wbq h LEU 121 Cb 0.73 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.51 1wbq h LEU 121 CO 0.06 0.06 0.87 -3.20 0.09 0.00 0.00 178.44 176.31 1wbq n ASN 122 N -2.40 2.75 0.00 -0.43 5.15 0.08 -2.01 115.26 118.41 1wbq n ASN 122 Ca 0.01 1.05 0.00 0.00 -0.60 0.00 0.00 54.58 55.04 1wbq n ASN 122 Cb 0.50 -1.28 0.00 0.00 -0.53 0.00 0.00 39.78 38.46 1wbq n ASN 122 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1wbq n GLY 123 N 3.81 1.57 3.85 8.20 0.00 -0.75 -4.95 105.19 116.92 1wbq n GLY 123 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 1wbq n GLY 123 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wbq s LEU 124 N 0.00 3.34 -0.07 0.99 1.43 -0.85 -4.98 118.68 118.54 1wbq s LEU 124 Ca 0.00 1.52 0.11 0.00 -1.03 0.00 0.00 54.13 54.73 1wbq s LEU 124 Cb 0.00 -4.49 -0.24 0.00 0.03 0.00 0.00 46.19 41.49 1wbq s LEU 124 CO 0.00 -0.92 0.55 0.47 0.23 0.00 0.00 176.35 176.68 1wbq n ASP 125 N -2.45 0.96 -3.95 2.29 8.00 0.39 -3.26 116.55 118.52 1wbq n ASP 125 Ca 0.07 0.34 -0.17 0.00 0.71 0.00 0.00 54.79 55.74 1wbq n ASP 125 Cb 0.54 -0.05 -0.15 0.00 -0.02 0.00 0.00 41.12 41.44 1wbq n ASP 125 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1wbq s VAL 126 N -2.58 0.44 -0.11 2.53 1.01 -1.07 -3.11 120.40 117.51 1wbq s VAL 126 Ca -0.08 -0.22 0.03 0.00 0.00 0.00 0.00 61.98 61.71 1wbq s VAL 126 Cb 0.08 -0.39 0.00 0.00 0.00 0.00 0.00 36.38 36.06 1wbq s VAL 126 CO 0.81 0.14 -0.22 0.54 0.00 0.00 0.00 175.10 176.37 1wbq s VAL 127 N 0.02 2.19 -0.23 2.92 0.11 -0.43 -1.96 120.40 123.01 1wbq s VAL 127 Ca 0.00 -0.96 -0.15 0.00 -2.93 0.00 0.00 61.98 57.94 1wbq s VAL 127 Cb -0.04 -1.86 -0.04 0.00 -1.53 0.00 0.00 36.38 32.92 1wbq s VAL 127 CO -0.00 0.55 0.38 -0.31 -3.33 0.00 0.00 175.10 172.39 1wbq s TYR 128 N 0.45 3.32 -0.17 1.54 1.51 0.11 -1.12 117.35 122.99 1wbq s TYR 128 Ca -0.15 0.52 -0.10 0.00 -1.01 0.00 0.00 57.07 56.32 1wbq s TYR 128 Cb -0.17 -2.54 0.06 0.00 -0.11 0.00 0.00 41.96 39.20 1wbq s TYR 128 CO 0.06 -0.10 0.42 -1.58 -1.11 0.00 0.00 175.55 173.25 1wbq s HIS 129 N 1.63 -0.61 -1.30 2.71 2.46 0.03 -1.12 115.29 119.09 1wbq s HIS 129 Ca 0.17 1.31 -0.16 0.00 0.47 0.00 0.00 55.06 56.84 1wbq s HIS 129 Cb -0.15 0.27 0.10 0.00 -0.13 0.00 0.00 32.58 32.66 1wbq s HIS 129 CO 0.08 -0.34 1.73 0.00 -2.47 0.00 0.00 174.74 173.75 1wbq n ALA 130 N 4.09 3.96 -1.87 1.58 0.00 -1.26 -3.91 120.51 123.10 1wbq n ALA 130 Ca -0.22 -3.97 -0.42 0.00 0.00 0.00 0.00 53.44 48.83 1wbq n ALA 130 Cb 0.56 -3.44 -0.03 0.00 0.00 0.00 0.00 19.45 16.54 1wbq n ALA 130 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1wbq s GLN 131 N 3.27 4.20 0.00 0.00 0.74 -1.26 -2.29 119.66 124.31 1wbq s GLN 131 Ca 0.50 2.42 0.00 0.00 0.05 0.00 0.00 55.36 58.33 1wbq s GLN 131 Cb 0.04 -3.11 0.00 0.00 1.10 0.00 0.00 33.01 31.03 1wbq s GLN 131 CO 0.04 -0.60 0.00 0.41 -0.55 0.00 0.00 175.29 174.59 1wbq n GLY 132 N 3.27 1.03 0.18 2.59 0.00 -1.26 -4.95 105.19 106.05 1wbq n GLY 132 Ca 0.12 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.00 1wbq n GLY 132 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1wbq h GLU 133 N 3.46 -0.37 -4.39 1.61 4.57 -1.89 -3.44 114.58 114.13 1wbq h GLU 133 Ca 0.00 0.02 -0.38 0.00 -1.18 0.00 0.00 59.36 57.82 1wbq h GLU 133 Cb 0.00 0.08 -0.30 0.00 -0.16 0.00 0.00 28.75 28.37 1wbq h GLU 133 CO 0.00 -0.11 -0.77 0.71 -1.18 0.00 0.00 179.01 177.66 1wbq s TYR 134 N -5.24 0.72 0.22 0.92 2.02 -1.26 -5.05 117.35 109.68 1wbq s TYR 134 Ca -0.15 -0.16 -0.07 0.00 -0.37 0.00 0.00 57.07 56.32 1wbq s TYR 134 Cb 0.03 -0.53 0.19 0.00 -0.40 0.00 0.00 41.96 41.25 1wbq s TYR 134 CO 0.60 -0.08 1.76 0.00 -1.57 0.00 0.00 175.55 176.26 1wbq h ALA 135 N 6.38 1.03 -0.40 3.71 0.00 -1.99 -2.30 119.26 125.68 1wbq h ALA 135 Ca -0.33 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.31 1wbq h ALA 135 Cb 1.17 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1wbq h ALA 135 CO 0.49 0.65 0.03 0.10 0.00 0.00 0.00 179.25 180.52 1wbq h TYR 136 N 1.05 0.65 -0.23 0.00 -0.00 -2.00 -1.82 116.97 114.61 1wbq h TYR 136 Ca 0.23 -0.06 -0.13 0.00 -0.00 0.00 0.00 58.73 58.76 1wbq h TYR 136 Cb 0.31 -0.19 -0.00 0.00 -0.00 0.00 0.00 36.73 36.86 1wbq h TYR 136 CO 0.02 0.60 -0.37 0.00 -0.00 0.00 0.00 178.16 178.42 1wbq h ALA 137 N 1.44 0.36 -0.89 0.10 0.00 -1.91 -2.66 119.26 115.71 1wbq h ALA 137 Ca 0.13 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1wbq h ALA 137 Cb 0.33 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 1wbq h ALA 137 CO 0.01 0.43 0.56 -0.44 0.00 0.00 0.00 179.25 179.81 1wbq h ASP 138 N 0.36 1.04 -0.03 0.00 3.32 -1.24 -1.21 116.42 118.66 1wbq h ASP 138 Ca 0.02 -0.05 0.01 0.00 0.02 0.00 0.00 57.03 57.03 1wbq h ASP 138 Cb 0.96 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.23 1wbq h ASP 138 CO 0.08 0.78 -0.03 0.58 -1.72 0.00 0.00 179.24 178.93 1wbq h VAL 139 N 1.21 0.90 -0.29 -1.35 2.07 -1.28 -0.14 116.25 117.38 1wbq h VAL 139 Ca 0.32 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.86 1wbq h VAL 139 Cb -0.09 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 1wbq h VAL 139 CO -0.06 0.00 0.14 0.40 0.02 0.00 0.00 177.57 178.06 1wbq h ILE 140 N -0.05 0.98 -0.18 4.57 2.04 -1.20 -0.96 117.51 122.71 1wbq h ILE 140 Ca 0.03 -0.10 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 1wbq h ILE 140 Cb 0.08 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 1wbq h ILE 140 CO -0.06 0.05 -0.03 0.58 0.00 0.00 0.00 178.15 178.69 1wbq h VAL 141 N 0.29 1.28 -0.65 1.67 2.07 -1.15 -2.31 116.25 117.44 1wbq h VAL 141 Ca 0.12 -0.97 -0.02 0.00 0.82 0.00 0.00 66.70 66.66 1wbq h VAL 141 Cb 0.05 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 1wbq h VAL 141 CO -0.09 0.29 0.34 0.78 0.02 0.00 0.00 177.57 178.91 1wbq h ASN 142 N 0.07 0.82 -0.28 0.57 2.35 -0.92 -1.27 115.58 116.91 1wbq h ASN 142 Ca 0.05 -0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.70 1wbq h ASN 142 Cb 0.45 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 1wbq h ASN 142 CO 0.02 0.67 0.06 0.28 -1.65 0.00 0.00 177.43 176.81 1wbq h SER 143 N 0.92 0.43 -0.24 5.81 0.02 -1.09 -0.68 113.55 118.71 1wbq h SER 143 Ca 0.23 -0.24 0.03 0.00 -0.84 0.00 0.00 61.79 60.97 1wbq h SER 143 Cb 0.05 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.45 1wbq h SER 143 CO -0.03 0.56 0.04 0.00 -1.14 0.00 0.00 176.83 176.26 1wbq h ALA 144 N 0.88 0.25 -0.66 3.77 0.00 -1.05 -1.12 119.26 121.33 1wbq h ALA 144 Ca 0.09 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 1wbq h ALA 144 Cb 0.31 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1wbq h ALA 144 CO 0.00 -0.38 0.12 -0.07 0.00 0.00 0.00 179.25 178.93 1wbq h LEU 145 N 0.13 1.03 -0.65 0.00 3.38 -1.16 -2.09 115.31 115.95 1wbq h LEU 145 Ca 0.11 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1wbq h LEU 145 Cb 0.12 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1wbq h LEU 145 CO -0.15 1.02 0.42 -0.08 0.09 0.00 0.00 178.44 179.74 1wbq h GLU 146 N 1.00 0.87 -0.76 1.13 4.81 -0.96 0.07 114.58 120.73 1wbq h GLU 146 Ca 0.20 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.39 1wbq h GLU 146 Cb 0.42 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.56 1wbq h GLU 146 CO 0.01 0.58 0.49 0.87 -0.73 0.00 0.00 179.01 180.24 1wbq h LYS 147 N 0.89 0.96 -0.03 1.92 1.57 -0.92 -1.92 116.57 119.03 1wbq h LYS 147 Ca 0.24 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1wbq h LYS 147 Cb -0.08 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.01 1wbq h LYS 147 CO -0.05 0.63 -0.01 -0.07 -0.57 0.00 0.00 179.45 179.39 1wbq h LEU 148 N 0.99 0.06 -0.42 2.94 3.38 -1.05 -1.95 115.31 119.26 1wbq h LEU 148 Ca 0.29 -0.37 0.07 0.00 0.09 0.00 0.00 57.88 57.96 1wbq h LEU 148 Cb -0.06 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.61 1wbq h LEU 148 CO -0.08 0.42 0.05 0.03 0.09 0.00 0.00 178.44 178.94 1wbq h ARG 149 N -0.30 0.16 -0.02 1.13 3.08 -0.94 -2.14 114.38 115.35 1wbq h ARG 149 Ca 0.01 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1wbq h ARG 149 Cb 0.39 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1wbq h ARG 149 CO 0.00 0.11 0.00 1.63 -1.07 0.00 0.00 179.97 180.64 1wbq n LYS 150 N -5.14 1.20 -1.02 0.04 5.02 -0.73 -4.21 118.16 113.32 1wbq n LYS 150 Ca 0.03 -0.30 -0.13 0.00 -2.02 0.00 0.00 58.31 55.90 1wbq n LYS 150 Cb 0.21 -1.41 0.21 0.00 -0.02 0.00 0.00 35.03 34.02 1wbq n LYS 150 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wbq n GLY 151 N 0.97 4.46 0.31 0.72 0.00 -0.73 -4.66 105.19 106.26 1wbq n GLY 151 Ca 0.19 -1.12 0.03 0.00 0.00 0.00 0.00 46.02 45.12 1wbq n GLY 151 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1wbq h SER 152 N 1.33 0.53 0.40 1.61 4.64 -1.73 0.20 113.55 120.54 1wbq h SER 152 Ca 0.41 -0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 61.68 1wbq h SER 152 Cb 2.33 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 64.28 1wbq h SER 152 CO 0.77 0.40 -0.13 0.03 -0.87 0.00 0.00 176.83 177.04 1wbq h ARG 153 N 0.62 0.00 -0.64 4.77 3.08 -1.90 -1.26 114.38 119.05 1wbq h ARG 153 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1wbq h ARG 153 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.01 1wbq h ARG 153 CO -0.03 0.13 0.00 1.04 -1.07 0.00 0.00 179.97 180.03 1wbq n GLN 154 N -3.64 3.25 -3.09 0.04 3.00 -0.06 -4.94 117.38 111.95 1wbq n GLN 154 Ca -0.02 -2.49 -0.22 0.00 -0.01 0.00 0.00 57.00 54.26 1wbq n GLN 154 Cb 0.25 -1.77 0.04 0.00 0.00 0.00 0.00 30.24 28.77 1wbq n GLN 154 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1wbq n ASN 155 N 1.06 -6.08 -4.90 1.08 3.02 -0.48 -5.01 115.26 103.96 1wbq n ASN 155 Ca 0.23 -0.32 -0.34 0.00 -0.03 0.00 0.00 54.58 54.12 1wbq n ASN 155 Cb 0.76 -4.86 -0.05 0.00 -0.61 0.00 0.00 39.78 35.01 1wbq n ASN 155 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1wbq s LEU 156 N -6.61 4.37 0.01 3.41 1.43 -0.51 -4.98 118.68 115.79 1wbq s LEU 156 Ca 0.34 0.43 0.00 0.00 -1.03 0.00 0.00 54.13 53.87 1wbq s LEU 156 Cb -0.15 -2.65 -0.01 0.00 0.03 0.00 0.00 46.19 43.42 1wbq s LEU 156 CO 0.42 0.26 -0.02 0.42 0.23 0.00 0.00 176.35 177.65 1wbq s THR 157 N -1.32 0.13 0.04 5.49 -4.23 -1.26 -3.90 115.64 110.60 1wbq s THR 157 Ca 0.28 -0.33 -0.10 0.00 -1.18 0.00 0.00 61.69 60.35 1wbq s THR 157 Cb -0.13 -0.17 -0.06 0.00 1.34 0.00 0.00 72.50 73.49 1wbq s THR 157 CO 0.18 -0.13 0.37 0.00 -0.54 0.00 0.00 174.62 174.50 1wbq s ALA 158 N -0.47 3.74 0.16 3.99 0.00 -1.26 -1.81 121.76 126.11 1wbq s ALA 158 Ca -0.04 -0.38 -0.32 0.00 0.00 0.00 0.00 51.96 51.22 1wbq s ALA 158 Cb -0.03 -2.25 -0.10 0.00 0.00 0.00 0.00 23.12 20.73 1wbq s ALA 158 CO -0.00 0.56 1.57 -1.25 0.00 0.00 0.00 175.76 176.64 1wbq s PRO 159 N -1.68 4.22 0.21 0.00 0.04 -1.20 -4.89 135.00 131.69 1wbq s PRO 159 Ca 0.29 2.36 0.25 0.00 0.04 0.00 0.00 61.00 63.95 1wbq s PRO 159 Cb -0.14 -3.17 0.67 0.00 0.04 0.00 0.00 34.50 31.90 1wbq s PRO 159 CO 0.16 -0.61 1.66 0.00 0.04 0.00 0.00 177.00 178.26 1wbq h ALA 160 N 6.84 0.91 -3.20 8.56 0.00 -1.81 -3.45 119.26 127.12 1wbq h ALA 160 Ca -0.43 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 53.84 1wbq h ALA 160 Cb 1.20 0.00 -0.24 0.00 0.00 0.00 0.00 17.79 18.76 1wbq h ALA 160 CO 0.91 0.00 -0.69 0.99 0.00 0.00 0.00 179.25 180.47 1wbq s THR 161 N -3.13 3.72 -0.12 0.00 2.01 -1.18 -5.08 115.64 111.87 1wbq s THR 161 Ca 0.09 -0.40 0.03 0.00 0.31 0.00 0.00 61.69 61.72 1wbq s THR 161 Cb 0.12 -2.65 0.00 0.00 0.01 0.00 0.00 72.50 69.98 1wbq s THR 161 CO 0.63 0.46 -0.22 -0.32 -0.69 0.00 0.00 174.62 174.48 1wbq s MET 162 N 0.74 3.07 -0.07 4.92 1.75 -1.26 -1.32 119.30 127.13 1wbq s MET 162 Ca -0.02 -0.85 0.04 0.00 -1.25 0.00 0.00 55.69 53.61 1wbq s MET 162 Cb -0.14 -2.38 0.00 0.00 2.84 0.00 0.00 34.83 35.15 1wbq s MET 162 CO 0.02 0.11 -0.18 0.42 -0.65 0.00 0.00 175.02 174.74 1wbq s ILE 163 N 0.52 1.58 -0.20 10.11 1.01 -0.27 -4.99 121.20 128.97 1wbq s ILE 163 Ca -0.14 -0.76 -0.29 0.00 0.00 0.00 0.00 60.65 59.46 1wbq s ILE 163 Cb -0.17 -1.38 -0.02 0.00 0.01 0.00 0.00 42.46 40.90 1wbq s ILE 163 CO 0.05 0.45 1.39 -0.62 0.00 0.00 0.00 174.94 176.21 1wbq s ASP 164 N 0.32 6.73 0.01 3.58 2.15 -1.25 -0.79 116.67 127.42 1wbq s ASP 164 Ca -0.12 1.61 0.29 0.00 0.43 0.00 0.00 52.55 54.76 1wbq s ASP 164 Cb -0.15 -2.54 1.21 0.00 -0.30 0.00 0.00 42.92 41.14 1wbq s ASP 164 CO 0.05 -0.96 1.92 -2.67 -0.17 0.00 0.00 175.17 173.34 1wbq n TRP 165 N 7.29 0.06 -0.22 -5.34 4.27 -1.26 -4.32 117.44 117.91 1wbq n TRP 165 Ca 0.15 0.02 -0.03 0.00 -3.89 0.00 0.00 57.50 53.75 1wbq n TRP 165 Cb 0.45 -0.53 0.07 0.00 -1.36 0.00 0.00 31.31 29.95 1wbq n TRP 165 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1wbq h ARG 166 N 0.00 0.73 -0.62 -2.67 3.08 -1.91 -0.75 114.38 112.23 1wbq h ARG 166 Ca 0.00 -0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.06 1wbq h ARG 166 Cb 0.51 -0.16 -0.05 0.00 0.08 0.00 0.00 29.97 30.35 1wbq h ARG 166 CO 0.00 0.48 0.34 -1.35 -1.07 0.00 0.00 179.97 178.37 1wbq h PRO 167 N 0.75 0.63 -0.27 0.04 0.11 -1.99 0.22 132.00 131.48 1wbq h PRO 167 Ca 0.27 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.31 1wbq h PRO 167 Cb 0.07 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 1wbq h PRO 167 CO -0.13 0.42 0.07 0.28 -0.21 0.00 0.00 178.00 178.43 1wbq h VAL 168 N 0.65 1.21 -0.32 3.15 2.07 -1.69 -1.97 116.25 119.36 1wbq h VAL 168 Ca 0.27 -0.68 -0.15 0.00 0.82 0.00 0.00 66.70 66.96 1wbq h VAL 168 Cb 0.15 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1wbq h VAL 168 CO -0.16 0.22 -0.41 0.58 0.02 0.00 0.00 177.57 177.82 1wbq h VAL 169 N 0.27 1.29 -0.08 2.57 2.07 -0.97 -2.04 116.25 119.35 1wbq h VAL 169 Ca 0.09 -1.59 -0.13 0.00 0.82 0.00 0.00 66.70 65.89 1wbq h VAL 169 Cb 0.27 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 1wbq h VAL 169 CO -0.00 0.52 -0.52 0.45 0.02 0.00 0.00 177.57 178.04 1wbq h HIS 170 N 0.63 0.27 -0.49 1.57 3.86 -0.57 0.19 115.15 120.61 1wbq h HIS 170 Ca 0.05 -0.09 -0.07 0.00 -1.16 0.00 0.00 60.37 59.10 1wbq h HIS 170 Cb 0.97 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 29.36 1wbq h HIS 170 CO 0.05 0.69 0.04 1.49 0.86 0.00 0.00 177.93 181.06 1wbq h GLU 171 N 0.17 0.79 0.04 2.45 4.57 -1.22 -1.39 114.58 119.99 1wbq h GLU 171 Ca 0.00 -0.19 -0.00 0.00 -1.18 0.00 0.00 59.36 57.99 1wbq h GLU 171 Cb 0.98 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.46 1wbq h GLU 171 CO 0.08 0.77 -0.02 0.52 -1.18 0.00 0.00 179.01 179.18 1wbq h MET 172 N 0.75 -0.05 0.00 1.92 2.86 -0.70 -3.15 114.93 116.56 1wbq h MET 172 Ca 0.15 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.79 1wbq h MET 172 Cb 0.40 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.07 1wbq h MET 172 CO 0.01 0.13 -0.01 0.00 1.06 0.00 0.00 176.91 178.10 1wbq h ARG 173 N -0.22 0.00 0.00 1.72 3.08 -0.75 -2.38 114.38 115.83 1wbq h ARG 173 Ca -0.01 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 1wbq h ARG 173 Cb 0.20 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 1wbq h ARG 173 CO 0.01 0.01 -0.13 1.25 -1.07 0.00 0.00 179.97 180.04 1wbq h LEU 174 N 0.00 0.00 -8.29 3.04 5.85 -1.21 -3.39 115.31 111.31 1wbq h LEU 174 Ca -0.00 0.00 -0.69 0.00 0.84 0.00 0.00 57.88 58.03 1wbq h LEU 174 Cb 0.02 0.00 -0.27 0.00 0.37 0.00 0.00 40.66 40.78 1wbq h LEU 174 CO 0.00 0.13 -0.60 -0.36 -0.34 0.00 0.00 178.44 177.27 1wbq s PHE 175 N -4.65 3.22 0.22 1.25 0.40 -0.90 -4.05 117.98 113.47 1wbq s PHE 175 Ca -0.04 -1.20 -0.28 0.00 -0.60 0.00 0.00 56.93 54.81 1wbq s PHE 175 Cb 0.16 -2.30 -0.09 0.00 0.51 0.00 0.00 43.02 41.30 1wbq s PHE 175 CO 0.66 -0.66 0.89 0.15 0.70 0.00 0.00 175.22 176.96 1wbq s LYS 176 N 1.46 4.76 0.77 0.44 3.01 -0.22 -4.97 119.74 124.99 1wbq s LYS 176 Ca 0.00 1.38 -0.12 0.00 -1.01 0.00 0.00 55.97 56.23 1wbq s LYS 176 Cb -0.19 -3.25 0.05 0.00 -1.01 0.00 0.00 37.83 33.44 1wbq s LYS 176 CO 0.03 0.52 1.13 -1.54 0.51 0.00 0.00 175.35 176.00 1wbq s SER 177 N -1.20 4.84 0.26 2.83 1.04 -1.26 -4.78 113.70 115.43 1wbq s SER 177 Ca 0.40 1.02 -0.02 0.00 0.48 0.00 0.00 55.95 57.83 1wbq s SER 177 Cb -0.25 -1.69 0.47 0.00 0.10 0.00 0.00 66.02 64.66 1wbq s SER 177 CO 0.30 -1.71 1.82 -0.65 0.98 0.00 0.00 173.24 173.97 1wbq h PRO 178 N -0.92 0.86 -0.65 4.02 0.11 -1.99 -1.32 132.00 132.10 1wbq h PRO 178 Ca -0.46 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.64 1wbq h PRO 178 Cb 1.29 -0.19 -0.05 0.00 0.11 0.00 0.00 31.00 32.16 1wbq h PRO 178 CO 0.64 0.57 0.39 0.93 -0.21 0.00 0.00 178.00 180.31 1wbq h GLU 179 N 0.88 0.72 -0.58 1.05 5.08 -1.93 -1.19 114.58 118.60 1wbq h GLU 179 Ca 0.45 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.66 1wbq h GLU 179 Cb 0.43 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1wbq h GLU 179 CO -0.26 0.48 -0.02 0.93 -1.00 0.00 0.00 179.01 179.13 1wbq h GLU 180 N 0.74 1.04 -0.61 2.33 5.08 -1.78 -2.14 114.58 119.23 1wbq h GLU 180 Ca 0.28 -0.34 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 1wbq h GLU 180 Cb 0.09 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 1wbq h GLU 180 CO -0.14 1.04 0.18 0.82 -1.00 0.00 0.00 179.01 179.90 1wbq h ILE 181 N 0.93 1.24 -0.47 3.13 2.04 -1.02 -0.13 117.51 123.23 1wbq h ILE 181 Ca 0.16 -0.83 -0.09 0.00 1.00 0.00 0.00 64.86 65.10 1wbq h ILE 181 Cb 0.58 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 1wbq h ILE 181 CO 0.03 0.32 -0.07 0.00 0.00 0.00 0.00 178.15 178.43 1wbq h ALA 182 N 1.28 0.99 -0.25 1.87 0.00 -0.97 0.64 119.26 122.83 1wbq h ALA 182 Ca 0.20 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1wbq h ALA 182 Cb 0.28 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1wbq h ALA 182 CO -0.01 0.61 -0.03 0.28 0.00 0.00 0.00 179.25 180.10 1wbq h VAL 183 N 0.75 1.27 -0.20 0.00 2.07 -1.05 -2.32 116.25 116.78 1wbq h VAL 183 Ca 0.13 -0.98 -0.05 0.00 0.82 0.00 0.00 66.70 66.63 1wbq h VAL 183 Cb 0.56 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1wbq h VAL 183 CO 0.03 0.31 -0.08 -0.07 0.02 0.00 0.00 177.57 177.78 1wbq h LEU 184 N 0.22 0.29 -0.53 2.57 3.38 -0.87 -0.19 115.31 120.19 1wbq h LEU 184 Ca 0.07 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1wbq h LEU 184 Cb 0.46 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1wbq h LEU 184 CO 0.02 0.41 0.33 -0.09 0.09 0.00 0.00 178.44 179.20 1wbq h ARG 185 N 0.30 0.71 -0.46 1.13 2.43 -0.71 0.51 114.38 118.28 1wbq h ARG 185 Ca 0.06 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.06 1wbq h ARG 185 Cb 0.33 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 1wbq h ARG 185 CO 0.02 0.50 -0.17 -0.09 -1.51 0.00 0.00 179.97 178.71 1wbq h ARG 186 N 0.71 0.93 -0.83 0.20 9.65 -0.80 -2.11 114.38 122.13 1wbq h ARG 186 Ca 0.19 -0.39 -0.00 0.00 -1.10 0.00 0.00 59.98 58.68 1wbq h ARG 186 Cb -0.04 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 28.46 1wbq h ARG 186 CO -0.04 1.05 0.52 0.00 2.80 0.00 0.00 179.97 184.29 1wbq h ALA 187 N 0.86 1.06 -0.72 2.80 0.00 -0.73 -0.15 119.26 122.38 1wbq h ALA 187 Ca 0.11 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1wbq h ALA 187 Cb 0.74 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1wbq h ALA 187 CO 0.06 0.51 0.26 0.78 0.00 0.00 0.00 179.25 180.85 1wbq h GLY 188 N 1.14 1.16 0.67 0.00 0.00 -0.81 -1.05 103.07 104.18 1wbq h GLY 188 Ca 0.30 -0.65 -0.03 0.00 0.00 0.00 0.00 47.33 46.96 1wbq h GLY 188 CO -0.06 0.61 -0.05 -2.09 0.00 0.00 0.00 176.54 174.95 1wbq h GLU 189 N 1.05 0.18 -0.55 4.80 4.81 -0.95 0.64 114.58 124.56 1wbq h GLU 189 Ca 0.24 -0.08 0.02 0.00 -0.13 0.00 0.00 59.36 59.41 1wbq h GLU 189 Cb 0.25 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1wbq h GLU 189 CO -0.01 0.56 0.34 0.82 -0.73 0.00 0.00 179.01 179.98 1wbq h ILE 190 N -0.20 1.08 -0.57 2.32 2.04 -0.99 -0.80 117.51 120.38 1wbq h ILE 190 Ca 0.02 -0.23 -0.06 0.00 1.00 0.00 0.00 64.86 65.58 1wbq h ILE 190 Cb 0.51 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1wbq h ILE 190 CO 0.01 0.12 0.12 0.74 0.00 0.00 0.00 178.15 179.14 1wbq h THR 191 N 0.68 1.25 -0.60 -0.27 2.02 -1.14 -2.35 112.91 112.49 1wbq h THR 191 Ca 0.22 -0.93 -0.00 0.00 0.77 0.00 0.00 66.41 66.47 1wbq h THR 191 Cb 0.00 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 1wbq h THR 191 CO -0.09 0.34 0.37 0.00 0.37 0.00 0.00 175.52 176.52 1wbq h ALA 192 N 1.01 0.77 -0.92 6.16 0.00 -0.51 -1.90 119.26 123.87 1wbq h ALA 192 Ca 0.18 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1wbq h ALA 192 Cb 0.38 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 1wbq h ALA 192 CO 0.01 0.24 0.61 0.52 0.00 0.00 0.00 179.25 180.62 1wbq h MET 193 N 0.82 1.14 -0.57 0.00 2.07 -1.00 -0.86 114.93 116.52 1wbq h MET 193 Ca 0.22 -0.07 -0.06 0.00 -2.07 0.00 0.00 59.70 57.72 1wbq h MET 193 Cb -0.04 -0.26 -0.02 0.00 -1.87 0.00 0.00 31.60 29.42 1wbq h MET 193 CO -0.04 0.75 0.13 0.00 1.07 0.00 0.00 176.91 178.82 1wbq h ALA 194 N 1.46 0.75 -0.41 6.32 0.00 -0.90 -1.47 119.26 125.01 1wbq h ALA 194 Ca 0.36 -0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 1wbq h ALA 194 Cb -0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1wbq h ALA 194 CO -0.11 0.46 -0.31 0.45 0.00 0.00 0.00 179.25 179.74 1wbq h HIS 195 N 0.82 1.08 -0.27 0.00 3.86 -0.89 -1.59 115.15 118.15 1wbq h HIS 195 Ca 0.18 -0.29 0.02 0.00 -1.16 0.00 0.00 60.37 59.12 1wbq h HIS 195 Cb 0.36 -0.24 -0.03 0.00 1.06 0.00 0.00 27.41 28.56 1wbq h HIS 195 CO 0.03 1.10 0.11 1.15 0.86 0.00 0.00 177.93 181.18 1wbq h THR 196 N 0.77 0.96 -0.54 2.45 2.02 -1.10 -2.07 112.91 115.39 1wbq h THR 196 Ca 0.08 -0.09 0.04 0.00 0.77 0.00 0.00 66.41 67.22 1wbq h THR 196 Cb 0.89 0.69 -0.04 0.00 -1.74 0.00 0.00 68.15 67.95 1wbq h THR 196 CO 0.08 0.05 0.30 -0.09 0.37 0.00 0.00 175.52 176.22 1wbq h ARG 197 N 0.25 0.56 -0.53 6.66 2.43 -1.11 -1.40 114.38 121.23 1wbq h ARG 197 Ca 0.11 -0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.28 1wbq h ARG 197 Cb 0.06 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.45 1wbq h ARG 197 CO -0.10 0.37 0.31 0.00 -1.51 0.00 0.00 179.97 179.04 1wbq h ALA 198 N 1.28 0.69 -0.88 2.80 0.00 -1.08 0.49 119.26 122.56 1wbq h ALA 198 Ca 0.23 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1wbq h ALA 198 Cb 0.11 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1wbq h ALA 198 CO -0.14 0.01 0.57 0.52 0.00 0.00 0.00 179.25 180.21 1wbq h MET 199 N 0.61 1.16 -0.05 0.00 2.86 -1.03 -1.45 114.93 117.04 1wbq h MET 199 Ca 0.22 -0.08 -0.14 0.00 -2.06 0.00 0.00 59.70 57.64 1wbq h MET 199 Cb 0.05 -0.26 -0.01 0.00 0.06 0.00 0.00 31.60 31.43 1wbq h MET 199 CO -0.11 0.78 -0.59 0.93 1.06 0.00 0.00 176.91 178.98 1wbq h GLU 200 N 1.19 0.16 0.00 1.72 5.08 -0.58 -3.25 114.58 118.90 1wbq h GLU 200 Ca 0.32 -0.11 -0.20 0.00 -1.00 0.00 0.00 59.36 58.37 1wbq h GLU 200 Cb -0.12 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 1wbq h GLU 200 CO -0.07 0.71 -1.18 0.87 -1.00 0.00 0.00 179.01 178.34 1wbq h LYS 201 N 0.12 0.00 -6.33 2.33 1.79 -0.76 -3.44 116.57 110.28 1wbq h LYS 201 Ca -0.01 0.00 -0.64 0.00 -2.18 0.00 0.00 60.65 57.83 1wbq h LYS 201 Cb 1.08 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 31.77 1wbq h LYS 201 CO 0.09 0.61 0.81 0.00 -1.08 0.00 0.00 179.45 179.88 1wbq s ARG 203 N 2.07 0.45 0.35 0.00 1.81 -1.26 -4.96 118.95 117.40 1wbq s ARG 203 Ca 0.87 -0.51 -0.28 0.00 -1.72 0.00 0.00 55.73 54.09 1wbq s ARG 203 Cb -0.81 -0.29 -0.12 0.00 -0.45 0.00 0.00 34.95 33.28 1wbq s ARG 203 CO 0.48 0.06 1.32 -2.30 -0.68 0.00 0.00 175.30 174.18 1wbq n PRO 204 N 2.08 2.21 0.00 3.54 -0.02 -1.26 -2.69 135.00 138.86 1wbq n PRO 204 Ca -0.19 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1wbq n PRO 204 Cb 0.56 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 1wbq n PRO 204 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wbq n GLY 205 N 0.74 3.22 3.77 -1.23 0.00 -0.26 -5.00 105.19 106.42 1wbq n GLY 205 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 1wbq n GLY 205 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1wbq s MET 206 N -0.65 2.64 0.43 1.61 -1.94 -1.10 -4.73 119.30 115.56 1wbq s MET 206 Ca 0.00 1.37 -0.12 0.00 -1.71 0.00 0.00 55.69 55.23 1wbq s MET 206 Cb 0.00 -1.93 -0.07 0.00 2.01 0.00 0.00 34.83 34.84 1wbq s MET 206 CO 0.00 -1.37 0.82 -0.06 -0.01 0.00 0.00 175.02 174.40 1wbq s PHE 207 N -2.44 3.47 0.27 -0.03 0.40 -1.26 0.16 117.98 118.55 1wbq s PHE 207 Ca 0.66 1.14 0.01 0.00 -0.60 0.00 0.00 56.93 58.13 1wbq s PHE 207 Cb -0.20 -2.52 0.60 0.00 0.51 0.00 0.00 43.02 41.41 1wbq s PHE 207 CO 0.45 -0.16 1.74 0.93 0.70 0.00 0.00 175.22 178.88 1wbq h GLU 208 N 1.19 0.54 0.00 0.44 5.08 -1.89 -1.87 114.58 118.07 1wbq h GLU 208 Ca -0.47 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 57.84 1wbq h GLU 208 Cb 1.19 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 1wbq h GLU 208 CO 0.63 0.36 -0.06 0.10 -1.00 0.00 0.00 179.01 179.04 1wbq h TYR 209 N 0.56 0.00 -0.94 4.33 -0.00 -1.62 -2.24 116.97 117.06 1wbq h TYR 209 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.23 1wbq h TYR 209 Cb 0.79 0.00 -0.05 0.00 0.00 0.00 0.00 36.73 37.47 1wbq h TYR 209 CO -0.10 0.06 0.59 0.45 -0.00 0.00 0.00 178.16 179.16 1wbq h HIS 210 N 0.00 1.21 -0.18 0.10 3.86 -1.65 -0.45 115.15 118.05 1wbq h HIS 210 Ca -0.00 0.01 -0.14 0.00 -1.16 0.00 0.00 60.37 59.08 1wbq h HIS 210 Cb 0.30 -0.40 -0.01 0.00 1.06 0.00 0.00 27.41 28.36 1wbq h HIS 210 CO 0.00 0.79 -0.46 -0.07 0.86 0.00 0.00 177.93 179.05 1wbq h LEU 211 N 1.29 0.49 -0.77 2.43 3.38 -1.51 -1.69 115.31 118.93 1wbq h LEU 211 Ca 0.34 -0.23 0.05 0.00 0.09 0.00 0.00 57.88 58.13 1wbq h LEU 211 Cb -0.10 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.46 1wbq h LEU 211 CO -0.07 0.88 0.47 -0.08 0.09 0.00 0.00 178.44 179.74 1wbq h GLU 212 N 0.37 0.86 -0.50 1.13 4.81 -1.41 -1.59 114.58 118.25 1wbq h GLU 212 Ca 0.02 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1wbq h GLU 212 Cb 0.95 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.12 1wbq h GLU 212 CO 0.08 0.57 0.27 0.78 -0.73 0.00 0.00 179.01 179.98 1wbq h GLY 213 N 0.88 0.75 1.00 1.92 0.00 -0.54 -0.97 103.07 106.10 1wbq h GLY 213 Ca 0.33 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1wbq h GLY 213 CO -0.15 0.33 0.30 0.83 0.00 0.00 0.00 176.54 177.85 1wbq h GLU 214 N 0.66 0.64 -0.19 4.80 4.39 -1.13 -1.86 114.58 121.88 1wbq h GLU 214 Ca 0.18 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.82 1wbq h GLU 214 Cb 0.05 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.55 1wbq h GLU 214 CO -0.03 0.45 0.09 0.82 -1.16 0.00 0.00 179.01 179.18 1wbq h ILE 215 N 0.64 1.13 -0.31 3.13 2.04 -1.04 -1.80 117.51 121.30 1wbq h ILE 215 Ca 0.17 -0.37 -0.08 0.00 1.00 0.00 0.00 64.86 65.58 1wbq h ILE 215 Cb -0.04 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1wbq h ILE 215 CO -0.04 0.12 -0.16 0.45 0.00 0.00 0.00 178.15 178.53 1wbq h HIS 216 N 0.18 0.60 -0.65 1.37 3.86 -1.11 -1.20 115.15 118.20 1wbq h HIS 216 Ca 0.07 -0.11 -0.05 0.00 -1.16 0.00 0.00 60.37 59.12 1wbq h HIS 216 Cb 0.11 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 28.40 1wbq h HIS 216 CO -0.03 0.68 0.20 1.25 0.86 0.00 0.00 177.93 180.90 1wbq h HIS 217 N 0.50 1.05 -0.30 2.45 -0.00 -1.11 -1.11 115.15 116.64 1wbq h HIS 217 Ca 0.09 -0.11 -0.03 0.00 -0.00 0.00 0.00 60.37 60.32 1wbq h HIS 217 Cb 0.57 -0.30 -0.01 0.00 -0.00 0.00 0.00 27.41 27.66 1wbq h HIS 217 CO 0.02 0.85 0.06 1.49 -0.00 0.00 0.00 177.93 180.35 1wbq h GLU 218 N 0.94 0.49 -0.24 5.26 4.57 -0.92 -1.52 114.58 123.17 1wbq h GLU 218 Ca 0.21 -0.13 0.06 0.00 -1.18 0.00 0.00 59.36 58.32 1wbq h GLU 218 Cb 0.30 -0.06 -0.07 0.00 -0.16 0.00 0.00 28.75 28.76 1wbq h GLU 218 CO -0.01 0.59 -0.24 0.74 -1.18 0.00 0.00 179.01 178.91 1wbq h PHE 219 N 0.32 -0.64 -0.82 0.92 0.04 -1.03 -2.93 116.94 112.80 1wbq h PHE 219 Ca 0.09 0.04 -0.00 0.00 2.80 0.00 0.00 57.97 60.90 1wbq h PHE 219 Cb 0.33 0.32 -0.04 0.00 2.20 0.00 0.00 35.95 38.75 1wbq h PHE 219 CO 0.02 -0.32 0.51 -0.97 -0.60 0.00 0.00 178.31 176.95 1wbq h ASN 220 N -0.25 0.97 1.26 2.17 -0.73 -0.89 -1.78 115.58 116.34 1wbq h ASN 220 Ca 0.13 -0.05 0.00 0.00 1.87 0.00 0.00 56.30 58.26 1wbq h ASN 220 Cb 0.46 -0.24 0.00 0.00 0.27 0.00 0.00 38.32 38.80 1wbq h ASN 220 CO -0.38 0.73 0.00 0.08 -0.37 0.00 0.00 177.43 177.49 1wbq h ARG 221 N 1.12 0.00 -0.24 6.67 0.11 -1.10 -1.05 114.38 119.90 1wbq h ARG 221 Ca 0.30 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.38 1wbq h ARG 221 Cb -0.07 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.01 1wbq h ARG 221 CO -0.06 0.00 0.00 0.72 0.10 0.00 0.00 179.97 180.73 1wbq n HIS 222 N -2.95 0.31 -0.55 4.08 8.25 -0.94 -4.93 115.22 118.49 1wbq n HIS 222 Ca 0.02 -0.15 0.00 0.00 -0.26 0.00 0.00 57.72 57.33 1wbq n HIS 222 Cb 0.36 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.47 1wbq n HIS 222 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wbq n GLY 223 N 1.20 0.73 3.34 -1.41 0.00 -0.40 -5.02 105.19 103.63 1wbq n GLY 223 Ca 0.16 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.72 1wbq n GLY 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wbq s ALA 224 N -2.08 3.98 0.31 4.61 0.00 -0.71 -4.91 121.76 122.96 1wbq s ALA 224 Ca 0.00 -3.22 0.06 0.00 0.00 0.00 0.00 51.96 48.80 1wbq s ALA 224 Cb 0.00 -3.56 0.51 0.00 0.00 0.00 0.00 23.12 20.06 1wbq s ALA 224 CO 0.00 -2.34 1.75 0.00 0.00 0.00 0.00 175.76 175.17 1wbq h ARG 225 N 7.96 0.30 -6.54 0.00 3.08 -1.80 -2.99 114.38 114.39 1wbq h ARG 225 Ca 0.09 -0.12 -0.66 0.00 0.07 0.00 0.00 59.98 59.36 1wbq h ARG 225 Cb 1.04 -0.02 -0.26 0.00 0.08 0.00 0.00 29.97 30.82 1wbq h ARG 225 CO 0.81 0.59 -0.87 0.71 -1.07 0.00 0.00 179.97 180.14 1wbq s TYR 226 N -4.35 2.16 0.71 3.04 2.02 -1.26 -4.77 117.35 114.90 1wbq s TYR 226 Ca -0.05 -0.40 -0.14 0.00 -0.37 0.00 0.00 57.07 56.10 1wbq s TYR 226 Cb 0.14 -1.28 0.03 0.00 -0.40 0.00 0.00 41.96 40.45 1wbq s TYR 226 CO 0.77 0.13 1.15 -2.14 -1.57 0.00 0.00 175.55 173.89 1wbq s PRO 227 N -1.27 2.36 0.20 -1.71 0.02 -1.26 -1.18 135.00 132.16 1wbq s PRO 227 Ca 0.10 1.54 0.26 0.00 0.02 0.00 0.00 61.00 62.92 1wbq s PRO 227 Cb -0.10 -1.88 0.81 0.00 0.02 0.00 0.00 34.50 33.36 1wbq s PRO 227 CO 0.02 -1.62 1.77 -1.13 -0.33 0.00 0.00 177.00 175.71 1wbq n SER 228 N -2.75 0.77 -3.73 2.53 3.41 -0.28 -4.51 113.62 109.07 1wbq n SER 228 Ca 0.12 0.55 -0.07 0.00 -0.26 0.00 0.00 58.87 59.21 1wbq n SER 228 Cb 0.51 -0.74 -0.02 0.00 -0.26 0.00 0.00 64.21 63.70 1wbq n SER 228 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1wbq s TYR 229 N -3.10 -0.23 0.04 7.33 1.13 -1.26 -4.70 117.35 116.55 1wbq s TYR 229 Ca 0.11 -0.11 -0.30 0.00 -1.41 0.00 0.00 57.07 55.35 1wbq s TYR 229 Cb 0.13 0.65 -0.07 0.00 -1.10 0.00 0.00 41.96 41.57 1wbq s TYR 229 CO 0.60 -0.98 1.49 -0.80 -2.51 0.00 0.00 175.55 173.34 1wbq s ASN 230 N -2.86 6.76 0.21 -0.18 0.01 -1.26 -4.74 114.94 112.87 1wbq s ASN 230 Ca 0.09 2.27 -0.30 0.00 -0.71 0.00 0.00 52.86 54.21 1wbq s ASN 230 Cb -0.03 -2.56 -0.09 0.00 0.41 0.00 0.00 41.25 38.97 1wbq s ASN 230 CO 0.01 -0.77 1.38 -0.89 -1.51 0.00 0.00 177.10 175.31 1wbq s THR 231 N 2.34 2.99 -0.21 1.60 2.01 -1.26 -4.95 115.64 118.14 1wbq s THR 231 Ca 0.67 0.80 -0.07 0.00 0.31 0.00 0.00 61.69 63.41 1wbq s THR 231 Cb -0.35 -3.51 -0.03 0.00 0.01 0.00 0.00 72.50 68.62 1wbq s THR 231 CO 0.29 0.12 0.04 -0.63 -0.69 0.00 0.00 174.62 173.75 1wbq s ILE 232 N 0.20 4.31 -0.46 1.82 1.01 -0.46 -4.64 121.20 122.98 1wbq s ILE 232 Ca 0.59 -0.19 0.03 0.00 0.00 0.00 0.00 60.65 61.08 1wbq s ILE 232 Cb -0.39 -2.97 0.14 0.00 0.01 0.00 0.00 42.46 39.25 1wbq s ILE 232 CO 0.39 0.40 0.28 -0.69 0.00 0.00 0.00 174.94 175.32 1wbq s VAL 233 N 1.08 1.35 -0.43 2.92 1.01 -1.25 -1.16 120.40 123.91 1wbq s VAL 233 Ca 0.03 -2.70 -0.09 0.00 0.00 0.00 0.00 61.98 59.22 1wbq s VAL 233 Cb -0.14 -1.94 0.09 0.00 0.00 0.00 0.00 36.38 34.39 1wbq s VAL 233 CO 0.03 -0.96 0.29 -0.83 0.00 0.00 0.00 175.10 173.63 1wbq s GLY 234 N 0.16 1.99 0.06 4.51 0.00 0.06 -4.54 107.32 109.56 1wbq s GLY 234 Ca 0.20 -2.26 -0.03 0.00 0.00 0.00 0.00 44.72 42.63 1wbq s GLY 234 CO -0.04 1.01 0.26 -1.35 0.00 0.00 0.00 173.10 172.99 1wbq s SER 235 N 2.29 6.43 1.94 1.64 1.04 -1.26 -0.69 113.70 125.08 1wbq s SER 235 Ca 0.04 0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.90 1wbq s SER 235 Cb -0.24 -2.03 0.00 0.00 0.10 0.00 0.00 66.02 63.85 1wbq s SER 235 CO 0.01 0.17 0.00 0.61 0.98 0.00 0.00 173.24 175.01 1wbq n GLY 236 N 0.52 3.70 0.16 7.32 0.00 0.24 -1.93 105.19 115.21 1wbq n GLY 236 Ca -0.07 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.03 1wbq n GLY 236 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1wbq h GLU 237 N 0.00 0.00 0.00 1.61 5.08 -1.92 -2.38 114.58 116.97 1wbq h GLU 237 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1wbq h GLU 237 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1wbq h GLU 237 CO 0.00 0.00 -0.10 -0.91 -1.00 0.00 0.00 179.01 177.00 1wbq h ASN 238 N 0.00 0.00 0.25 1.42 2.35 -1.68 -2.84 115.58 115.08 1wbq h ASN 238 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1wbq h ASN 238 Cb 0.43 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.80 1wbq h ASN 238 CO 0.00 0.10 -0.07 1.23 -1.65 0.00 0.00 177.43 177.05 1wbq h GLY 239 N 1.20 0.00 1.80 2.83 0.00 -1.44 -2.30 103.07 105.16 1wbq h GLY 239 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1wbq h GLY 239 CO 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 176.54 176.55 1wbq s ILE 241 N -2.82 5.06 0.16 0.00 1.01 -0.87 -4.99 121.20 118.76 1wbq s ILE 241 Ca 0.20 -0.10 -0.15 0.00 0.00 0.00 0.00 60.65 60.60 1wbq s ILE 241 Cb 0.20 -4.00 0.04 0.00 0.01 0.00 0.00 42.46 38.70 1wbq s ILE 241 CO 0.50 -0.34 1.79 -0.07 0.00 0.00 0.00 174.94 176.83 1wbq h LEU 242 N 9.07 0.57 -5.29 2.97 3.38 -1.85 -2.91 115.31 121.26 1wbq h LEU 242 Ca -0.27 -0.06 -0.69 0.00 0.09 0.00 0.00 57.88 56.95 1wbq h LEU 242 Cb 1.12 -0.14 -0.34 0.00 0.09 0.00 0.00 40.66 41.38 1wbq h LEU 242 CO 0.78 0.46 0.19 1.41 0.09 0.00 0.00 178.44 181.37 1wbq n HIS 243 N -4.71 3.31 -2.62 1.13 8.25 -1.26 -4.98 115.22 114.34 1wbq n HIS 243 Ca 0.02 -3.01 -0.43 0.00 -0.26 0.00 0.00 57.72 54.04 1wbq n HIS 243 Cb 0.05 -0.75 -0.02 0.00 1.12 0.00 0.00 29.99 30.39 1wbq n HIS 243 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1wbq s TYR 244 N -3.86 2.85 0.00 4.41 5.04 -1.10 -4.85 117.35 119.84 1wbq s TYR 244 Ca 0.47 0.73 0.00 0.00 -2.44 0.00 0.00 57.07 55.83 1wbq s TYR 244 Cb 0.32 -4.34 0.00 0.00 0.35 0.00 0.00 41.96 38.30 1wbq s TYR 244 CO -0.22 -1.22 0.63 0.25 -1.34 0.00 0.00 175.55 173.66 1wbq n THR 245 N 6.73 0.35 -0.21 4.34 -2.24 -1.26 -4.06 114.28 117.93 1wbq n THR 245 Ca 0.12 -0.61 -0.06 0.00 -2.27 0.00 0.00 64.05 61.22 1wbq n THR 245 Cb 0.49 0.90 0.09 0.00 -2.10 0.00 0.00 70.33 69.71 1wbq n THR 245 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1wbq h GLU 246 N 0.00 1.03 -6.73 -0.78 3.07 -1.88 -3.47 114.58 105.82 1wbq h GLU 246 Ca 0.00 -0.25 -0.55 0.00 -0.50 0.00 0.00 59.36 58.06 1wbq h GLU 246 Cb 0.26 -0.13 -0.17 0.00 -0.84 0.00 0.00 28.75 27.87 1wbq h GLU 246 CO 0.00 0.93 -0.87 0.09 -1.40 0.00 0.00 179.01 177.76 1wbq n ASN 247 N -4.23 -1.76 -2.81 1.42 3.02 -1.26 -4.91 115.26 104.72 1wbq n ASN 247 Ca 0.04 -1.05 -0.34 0.00 -0.03 0.00 0.00 54.58 53.20 1wbq n ASN 247 Cb 0.27 -2.66 0.02 0.00 -0.61 0.00 0.00 39.78 36.80 1wbq n ASN 247 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1wbq n GLU 248 N -4.40 3.27 -4.74 3.52 0.28 -1.26 -1.55 120.64 115.77 1wbq n GLU 248 Ca -0.10 -4.08 -0.33 0.00 -0.16 0.00 0.00 57.16 52.49 1wbq n GLU 248 Cb 0.58 -2.28 -0.14 0.00 1.43 0.00 0.00 31.44 31.03 1wbq n GLU 248 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 1wbq s GLU 250 N -3.86 3.37 -0.13 3.44 2.12 -1.26 -4.86 118.70 117.52 1wbq s GLU 250 Ca 0.49 -0.66 -0.29 0.00 0.36 0.00 0.00 54.97 54.87 1wbq s GLU 250 Cb 0.39 -2.65 -0.01 0.00 0.26 0.00 0.00 34.13 32.12 1wbq s GLU 250 CO -0.29 0.25 0.99 -1.64 -0.54 0.00 0.00 175.26 174.03 1wbq s MET 251 N 0.27 4.39 -0.02 4.30 -1.94 0.12 -4.90 119.30 121.53 1wbq s MET 251 Ca -0.09 1.35 -0.10 0.00 -1.71 0.00 0.00 55.69 55.14 1wbq s MET 251 Cb -0.15 -3.56 -0.05 0.00 2.01 0.00 0.00 34.83 33.08 1wbq s MET 251 CO 0.05 -0.36 0.31 1.03 -0.01 0.00 0.00 175.02 176.04 1wbq s ARG 252 N 2.19 3.70 0.11 2.03 1.81 -1.26 -1.10 118.95 126.43 1wbq s ARG 252 Ca 0.47 0.13 -0.31 0.00 -1.72 0.00 0.00 55.73 54.29 1wbq s ARG 252 Cb -0.18 -3.15 -0.11 0.00 -0.45 0.00 0.00 34.95 31.07 1wbq s ARG 252 CO 0.16 0.69 1.83 -3.47 -0.68 0.00 0.00 175.30 173.83 1wbq n ASP 253 N 1.58 3.98 0.00 0.23 -0.08 -1.26 -2.08 116.55 118.91 1wbq n ASP 253 Ca -0.14 0.99 0.00 0.00 -1.51 0.00 0.00 54.79 54.13 1wbq n ASP 253 Cb 0.53 -1.53 0.00 0.00 2.34 0.00 0.00 41.12 42.46 1wbq n ASP 253 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1wbq n GLY 254 N 4.21 0.37 3.94 0.27 0.00 -1.26 -5.04 105.19 107.68 1wbq n GLY 254 Ca 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 1wbq n GLY 254 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wbq s ASP 255 N -1.97 6.35 0.43 1.61 1.01 -0.88 -4.99 116.67 118.23 1wbq s ASP 255 Ca 0.00 0.35 -0.07 0.00 0.71 0.00 0.00 52.55 53.54 1wbq s ASP 255 Cb 0.00 -1.99 -0.05 0.00 1.01 0.00 0.00 42.92 41.90 1wbq s ASP 255 CO 0.00 -0.11 0.75 -0.76 0.21 0.00 0.00 175.17 175.27 1wbq s LEU 256 N -3.67 3.74 -0.07 1.23 1.43 -1.26 -1.33 118.68 118.76 1wbq s LEU 256 Ca 0.38 0.96 0.03 0.00 -1.03 0.00 0.00 54.13 54.47 1wbq s LEU 256 Cb -0.10 -3.88 0.01 0.00 0.03 0.00 0.00 46.19 42.25 1wbq s LEU 256 CO 0.31 -0.48 -0.14 0.54 0.23 0.00 0.00 176.35 176.81 1wbq s VAL 257 N -2.55 1.24 -0.26 -1.59 0.11 0.19 -0.59 120.40 116.96 1wbq s VAL 257 Ca 0.48 -0.55 -0.09 0.00 -2.93 0.00 0.00 61.98 58.89 1wbq s VAL 257 Cb -0.10 -1.12 -0.04 0.00 -1.53 0.00 0.00 36.38 33.59 1wbq s VAL 257 CO 0.39 0.38 0.12 -0.22 -3.33 0.00 0.00 175.10 172.43 1wbq s LEU 258 N 0.56 3.67 -0.23 2.54 0.20 0.13 -1.73 118.68 123.81 1wbq s LEU 258 Ca -0.14 -0.13 -0.00 0.00 0.69 0.00 0.00 54.13 54.56 1wbq s LEU 258 Cb -0.15 -2.00 0.03 0.00 -0.43 0.00 0.00 46.19 43.63 1wbq s LEU 258 CO 0.04 -0.04 -0.10 -0.63 -0.29 0.00 0.00 176.35 175.33 1wbq s ILE 259 N 1.66 2.58 -0.30 6.68 1.01 0.50 -0.76 121.20 132.57 1wbq s ILE 259 Ca 0.07 -1.10 -0.03 0.00 0.00 0.00 0.00 60.65 59.59 1wbq s ILE 259 Cb -0.15 -2.30 0.04 0.00 0.01 0.00 0.00 42.46 40.06 1wbq s ILE 259 CO 0.06 0.24 0.01 -0.62 0.00 0.00 0.00 174.94 174.63 1wbq s ASP 260 N 1.28 4.86 -0.07 3.58 -1.08 -0.31 -1.11 116.67 123.83 1wbq s ASP 260 Ca -0.00 -1.14 -0.15 0.00 -0.52 0.00 0.00 52.55 50.73 1wbq s ASP 260 Cb -0.16 -1.74 0.03 0.00 -1.46 0.00 0.00 42.92 39.59 1wbq s ASP 260 CO -0.06 -0.24 0.36 0.00 0.52 0.00 0.00 175.17 175.75 1wbq s ALA 261 N 1.30 -0.91 -0.13 3.66 0.00 0.00 -1.36 121.76 124.34 1wbq s ALA 261 Ca -0.03 0.68 -0.17 0.00 0.00 0.00 0.00 51.96 52.43 1wbq s ALA 261 Cb -0.19 -0.20 0.04 0.00 0.00 0.00 0.00 23.12 22.77 1wbq s ALA 261 CO -0.01 -0.24 0.44 0.20 0.00 0.00 0.00 175.76 176.16 1wbq s GLY 262 N -0.73 -0.32 0.51 0.00 0.00 -1.26 -2.16 107.32 103.37 1wbq s GLY 262 Ca -0.08 1.08 -0.03 0.00 0.00 0.00 0.00 44.72 45.68 1wbq s GLY 262 CO 0.03 0.88 0.79 0.00 0.00 0.00 0.00 173.10 174.80 1wbq s GLU 264 N -4.77 3.02 -0.17 0.00 2.12 -0.33 -0.83 118.70 117.74 1wbq s GLU 264 Ca 0.50 -0.86 0.01 0.00 0.36 0.00 0.00 54.97 54.98 1wbq s GLU 264 Cb -0.10 -3.04 0.03 0.00 0.26 0.00 0.00 34.13 31.28 1wbq s GLU 264 CO 0.42 -0.35 -0.13 -0.47 -0.54 0.00 0.00 175.26 174.19 1wbq s TYR 265 N 1.39 2.31 -1.38 5.30 5.04 0.01 -4.37 117.35 125.65 1wbq s TYR 265 Ca 0.02 -1.41 -0.10 0.00 -2.44 0.00 0.00 57.07 53.14 1wbq s TYR 265 Cb -0.16 -1.63 0.07 0.00 0.35 0.00 0.00 41.96 40.59 1wbq s TYR 265 CO -0.03 -0.71 0.59 1.63 -1.34 0.00 0.00 175.55 175.69 1wbq n LYS 266 N 4.72 -3.85 0.00 4.97 4.76 -1.26 -1.08 118.16 126.42 1wbq n LYS 266 Ca -0.16 0.54 0.00 0.00 -2.87 0.00 0.00 58.31 55.82 1wbq n LYS 266 Cb 0.48 -5.29 0.00 0.00 -1.84 0.00 0.00 35.03 28.38 1wbq n LYS 266 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wbq n GLY 267 N -1.30 2.34 3.88 0.72 0.00 -1.26 -5.01 105.19 104.56 1wbq n GLY 267 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 1wbq n GLY 267 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wbq s TYR 268 N -2.27 3.59 -0.13 1.61 1.51 -0.24 -4.35 117.35 117.07 1wbq s TYR 268 Ca 0.00 0.58 -0.16 0.00 -1.01 0.00 0.00 57.07 56.48 1wbq s TYR 268 Cb 0.00 -1.99 -0.04 0.00 -0.11 0.00 0.00 41.96 39.81 1wbq s TYR 268 CO 0.00 0.65 0.39 0.00 -1.11 0.00 0.00 175.55 175.47 1wbq s ALA 269 N -1.22 3.55 0.40 3.71 0.00 -0.12 -0.81 121.76 127.26 1wbq s ALA 269 Ca 0.24 -0.31 -0.06 0.00 0.00 0.00 0.00 51.96 51.83 1wbq s ALA 269 Cb -0.13 -2.51 -0.05 0.00 0.00 0.00 0.00 23.12 20.43 1wbq s ALA 269 CO 0.13 0.08 0.70 0.20 0.00 0.00 0.00 175.76 176.87 1wbq s GLY 270 N 0.41 1.68 -0.39 0.00 0.00 -0.01 -4.70 107.32 104.30 1wbq s GLY 270 Ca 0.21 -0.49 0.07 0.00 0.00 0.00 0.00 44.72 44.51 1wbq s GLY 270 CO 0.08 -0.34 0.58 -0.35 0.00 0.00 0.00 173.10 173.06 1wbq s ASP 271 N -3.62 -1.03 -0.02 1.64 2.15 -1.26 -3.96 116.67 110.57 1wbq s ASP 271 Ca 0.47 -0.86 0.07 0.00 0.43 0.00 0.00 52.55 52.65 1wbq s ASP 271 Cb -0.10 1.71 -0.02 0.00 -0.30 0.00 0.00 42.92 44.20 1wbq s ASP 271 CO 0.37 -0.20 -0.23 -0.63 -0.17 0.00 0.00 175.17 174.31 1wbq s ILE 272 N 1.84 2.37 -0.08 4.11 1.01 -0.92 -4.48 121.20 125.06 1wbq s ILE 272 Ca 0.16 -1.04 0.04 0.00 0.00 0.00 0.00 60.65 59.80 1wbq s ILE 272 Cb -0.07 -1.87 0.00 0.00 0.01 0.00 0.00 42.46 40.53 1wbq s ILE 272 CO -0.08 0.55 -0.21 -0.89 0.00 0.00 0.00 174.94 174.31 1wbq s THR 273 N -0.68 1.76 0.00 2.92 2.01 -1.10 -0.82 115.64 119.73 1wbq s THR 273 Ca 0.11 -0.86 0.04 0.00 0.31 0.00 0.00 61.69 61.29 1wbq s THR 273 Cb -0.10 -1.52 -0.01 0.00 0.01 0.00 0.00 72.50 70.87 1wbq s THR 273 CO 0.00 0.49 -0.13 -0.13 -0.69 0.00 0.00 174.62 174.16 1wbq s ARG 274 N 0.27 1.00 -0.05 4.92 1.81 -0.27 -1.42 118.95 125.21 1wbq s ARG 274 Ca -0.13 -0.53 0.06 0.00 -1.72 0.00 0.00 55.73 53.41 1wbq s ARG 274 Cb -0.16 -0.98 -0.01 0.00 -0.45 0.00 0.00 34.95 33.36 1wbq s ARG 274 CO 0.06 0.26 -0.23 0.99 -0.68 0.00 0.00 175.30 175.70 1wbq s THR 275 N -0.44 1.90 0.13 0.02 2.01 -1.23 -0.37 115.64 117.66 1wbq s THR 275 Ca 0.04 -0.98 -0.19 0.00 0.31 0.00 0.00 61.69 60.86 1wbq s THR 275 Cb -0.06 -1.61 0.05 0.00 0.01 0.00 0.00 72.50 70.89 1wbq s THR 275 CO -0.00 0.53 0.49 0.72 -0.69 0.00 0.00 174.62 175.67 1wbq s PHE 276 N -0.10 -0.36 0.10 4.92 -0.71 -0.70 -4.97 117.98 116.14 1wbq s PHE 276 Ca -0.04 0.12 -0.30 0.00 -1.04 0.00 0.00 56.93 55.67 1wbq s PHE 276 Cb -0.13 0.39 -0.06 0.00 -1.21 0.00 0.00 43.02 42.00 1wbq s PHE 276 CO 0.03 -0.76 1.19 -1.25 -1.34 0.00 0.00 175.22 173.10 1wbq s PRO 277 N -3.65 4.46 0.40 1.99 0.04 -1.26 -0.63 135.00 136.35 1wbq s PRO 277 Ca 0.01 1.79 0.11 0.00 0.04 0.00 0.00 61.00 62.95 1wbq s PRO 277 Cb 0.00 -3.32 0.92 0.00 0.04 0.00 0.00 34.50 32.15 1wbq s PRO 277 CO -0.11 -0.19 1.96 0.28 0.04 0.00 0.00 177.00 178.97 1wbq h VAL 278 N 4.28 0.93 -0.52 -0.36 2.07 -1.51 -1.45 116.25 119.69 1wbq h VAL 278 Ca -0.42 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1wbq h VAL 278 Cb 1.21 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 1wbq h VAL 278 CO 0.79 0.10 0.00 -0.46 0.02 0.00 0.00 177.57 178.02 1wbq n ASN 279 N -4.48 3.85 0.00 0.57 0.23 -1.26 -4.05 115.26 110.11 1wbq n ASN 279 Ca 0.11 -2.33 0.00 0.00 -0.53 0.00 0.00 54.58 51.82 1wbq n ASN 279 Cb 0.34 -0.51 0.00 0.00 -2.08 0.00 0.00 39.78 37.53 1wbq n ASN 279 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1wbq n GLY 280 N 1.00 0.56 2.64 4.83 0.00 -0.55 -4.97 105.19 108.70 1wbq n GLY 280 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.95 1wbq n GLY 280 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wbq s LYS 281 N -0.41 0.35 0.32 1.61 1.02 -1.26 -4.58 119.74 116.78 1wbq s LYS 281 Ca 0.00 -0.41 -0.29 0.00 0.02 0.00 0.00 55.97 55.29 1wbq s LYS 281 Cb 0.00 -1.77 -0.11 0.00 -0.52 0.00 0.00 37.83 35.43 1wbq s LYS 281 CO 0.00 -0.79 1.57 -0.06 -0.92 0.00 0.00 175.35 175.15 1wbq s PHE 282 N 1.98 2.70 0.79 3.18 0.08 -1.26 -4.88 117.98 120.57 1wbq s PHE 282 Ca 0.04 0.89 -0.12 0.00 0.12 0.00 0.00 56.93 57.86 1wbq s PHE 282 Cb -0.16 -4.06 0.07 0.00 -0.57 0.00 0.00 43.02 38.29 1wbq s PHE 282 CO -0.18 -3.44 1.15 0.95 -0.10 0.00 0.00 175.22 173.60 1wbq s THR 283 N -0.33 2.48 0.16 0.64 -4.23 -1.26 -4.86 115.64 108.24 1wbq s THR 283 Ca 0.60 0.16 -0.16 0.00 -1.18 0.00 0.00 61.69 61.11 1wbq s THR 283 Cb -0.48 -3.11 0.03 0.00 1.34 0.00 0.00 72.50 70.28 1wbq s THR 283 CO 0.52 -0.20 1.74 -0.61 -0.54 0.00 0.00 174.62 175.53 1wbq h GLN 284 N -1.00 0.24 -0.58 3.99 4.15 -1.98 0.72 115.11 120.65 1wbq h GLN 284 Ca -0.46 -0.01 -0.04 0.00 0.77 0.00 0.00 58.65 58.90 1wbq h GLN 284 Cb 1.30 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.92 1wbq h GLN 284 CO 0.65 0.16 0.19 0.00 -1.93 0.00 0.00 178.83 177.89 1wbq h ALA 285 N 1.24 0.76 -0.54 3.38 0.00 -1.94 0.36 119.26 122.52 1wbq h ALA 285 Ca 0.16 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1wbq h ALA 285 Cb 0.16 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1wbq h ALA 285 CO -0.18 0.42 0.10 1.96 0.00 0.00 0.00 179.25 181.55 1wbq h GLN 286 N 0.81 0.88 -0.85 0.00 4.20 -1.84 -2.85 115.11 115.47 1wbq h GLN 286 Ca 0.19 -0.23 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 1wbq h GLN 286 Cb 0.27 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.91 1wbq h GLN 286 CO -0.01 0.85 0.42 -0.09 -0.67 0.00 0.00 178.83 179.33 1wbq h ARG 287 N 0.77 1.22 -0.72 1.46 9.65 -0.49 0.00 114.38 126.26 1wbq h ARG 287 Ca 0.17 -0.17 -0.03 0.00 -1.10 0.00 0.00 59.98 58.84 1wbq h ARG 287 Cb 0.38 -0.22 -0.03 0.00 -1.39 0.00 0.00 29.97 28.71 1wbq h ARG 287 CO 0.01 0.93 0.32 0.93 2.80 0.00 0.00 179.97 184.95 1wbq h GLU 288 N 1.21 1.06 -0.12 0.20 5.08 -0.74 -0.32 114.58 120.95 1wbq h GLU 288 Ca 0.29 -0.17 -0.16 0.00 -1.00 0.00 0.00 59.36 58.32 1wbq h GLU 288 Cb 0.10 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 29.18 1wbq h GLU 288 CO -0.04 0.85 -0.55 0.82 -1.00 0.00 0.00 179.01 179.09 1wbq h ILE 289 N 1.02 1.35 -0.55 3.13 1.08 -1.39 -3.30 117.51 118.86 1wbq h ILE 289 Ca 0.24 -1.85 0.06 0.00 -0.39 0.00 0.00 64.86 62.92 1wbq h ILE 289 Cb 0.16 2.14 -0.05 0.00 -3.07 0.00 0.00 36.82 36.00 1wbq h ILE 289 CO -0.03 0.56 0.27 0.22 -0.69 0.00 0.00 178.15 178.48 1wbq h TYR 290 N 0.21 0.48 -0.67 1.37 3.20 -0.61 -2.22 116.97 118.74 1wbq h TYR 290 Ca -0.04 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.91 1wbq h TYR 290 Cb 1.19 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 39.29 1wbq h TYR 290 CO 0.11 0.22 0.44 -0.44 -1.64 0.00 0.00 178.16 176.85 1wbq h ASP 291 N 0.51 0.64 -0.36 -2.11 3.32 -1.16 0.45 116.42 117.70 1wbq h ASP 291 Ca 0.25 -0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.22 1wbq h ASP 291 Cb 0.19 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1wbq h ASP 291 CO -0.19 0.43 -0.07 0.40 -1.72 0.00 0.00 179.24 178.08 1wbq h ILE 292 N 0.73 1.27 -0.53 0.35 2.04 -1.48 -1.01 117.51 118.88 1wbq h ILE 292 Ca 0.28 -1.13 -0.12 0.00 1.00 0.00 0.00 64.86 64.89 1wbq h ILE 292 Cb 0.18 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1wbq h ILE 292 CO -0.08 0.37 -0.12 0.58 0.00 0.00 0.00 178.15 178.90 1wbq h VAL 293 N 0.49 1.27 -0.29 1.67 2.07 -1.21 -2.27 116.25 117.98 1wbq h VAL 293 Ca 0.09 -1.28 -0.05 0.00 0.82 0.00 0.00 66.70 66.28 1wbq h VAL 293 Cb 0.58 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1wbq h VAL 293 CO 0.03 0.45 -0.03 0.25 0.02 0.00 0.00 177.57 178.30 1wbq h LEU 294 N 0.90 0.52 -0.84 2.57 5.85 -0.85 -1.49 115.31 121.97 1wbq h LEU 294 Ca 0.14 -0.33 0.04 0.00 0.84 0.00 0.00 57.88 58.56 1wbq h LEU 294 Cb 0.69 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.53 1wbq h LEU 294 CO 0.05 0.73 0.54 -0.08 -0.34 0.00 0.00 178.44 179.34 1wbq h GLU 295 N 0.30 1.01 -0.39 1.25 4.81 -1.19 0.13 114.58 120.50 1wbq h GLU 295 Ca 0.08 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1wbq h GLU 295 Cb 0.48 -0.23 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 1wbq h GLU 295 CO 0.02 0.67 0.18 0.77 -0.73 0.00 0.00 179.01 179.92 1wbq h SER 296 N 1.04 0.24 -0.08 1.04 0.02 -1.14 -0.16 113.55 114.50 1wbq h SER 296 Ca 0.34 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.30 1wbq h SER 296 Cb 0.02 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 1wbq h SER 296 CO -0.12 0.18 0.01 0.25 -1.14 0.00 0.00 176.83 176.01 1wbq h LEU 297 N 0.36 0.13 -0.72 5.07 5.85 -0.63 -1.69 115.31 123.68 1wbq h LEU 297 Ca 0.17 -0.26 -0.04 0.00 0.84 0.00 0.00 57.88 58.59 1wbq h LEU 297 Cb 0.10 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 1wbq h LEU 297 CO -0.13 0.36 0.29 -0.33 -0.34 0.00 0.00 178.44 178.28 1wbq h GLU 298 N -0.09 1.08 -0.32 1.25 5.08 -0.63 0.43 114.58 121.37 1wbq h GLU 298 Ca 0.03 -0.20 -0.04 0.00 -1.00 0.00 0.00 59.36 58.15 1wbq h GLU 298 Cb 0.28 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1wbq h GLU 298 CO 0.00 0.89 0.05 1.15 -1.00 0.00 0.00 179.01 180.10 1wbq h THR 299 N 1.04 1.24 -1.00 1.13 2.02 -1.05 -2.27 112.91 114.01 1wbq h THR 299 Ca 0.24 -0.83 0.03 0.00 0.77 0.00 0.00 66.41 66.62 1wbq h THR 299 Cb 0.21 1.16 -0.06 0.00 -1.74 0.00 0.00 68.15 67.73 1wbq h THR 299 CO -0.02 0.28 0.65 0.28 0.37 0.00 0.00 175.52 177.08 1wbq h SER 300 N 0.36 1.11 -0.33 4.18 0.02 -0.81 -1.18 113.55 116.89 1wbq h SER 300 Ca 0.10 -0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 60.96 1wbq h SER 300 Cb 0.36 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 1wbq h SER 300 CO 0.01 0.77 -0.02 -0.07 -1.14 0.00 0.00 176.83 176.38 1wbq h LEU 301 N 1.29 0.68 -0.43 5.07 3.38 -0.80 -0.53 115.31 123.97 1wbq h LEU 301 Ca 0.39 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 58.14 1wbq h LEU 301 Cb -0.05 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 1wbq h LEU 301 CO -0.11 0.76 0.06 0.03 0.09 0.00 0.00 178.44 179.27 1wbq h ARG 302 N 0.66 0.72 -0.05 1.13 3.08 -0.95 -3.34 114.38 115.63 1wbq h ARG 302 Ca 0.13 -0.20 -0.24 0.00 0.07 0.00 0.00 59.98 59.74 1wbq h ARG 302 Cb 0.45 -0.08 0.01 0.00 0.08 0.00 0.00 29.97 30.43 1wbq h ARG 302 CO 0.02 0.76 -0.94 -0.07 -1.07 0.00 0.00 179.97 178.67 1wbq h LEU 303 N 0.57 0.85 -9.59 3.04 3.38 -0.87 -3.46 115.31 109.23 1wbq h LEU 303 Ca 0.13 -0.64 -0.52 0.00 0.09 0.00 0.00 57.88 56.94 1wbq h LEU 303 Cb 0.40 -0.26 0.05 0.00 0.09 0.00 0.00 40.66 40.94 1wbq h LEU 303 CO 0.01 1.43 1.04 -0.31 0.09 0.00 0.00 178.44 180.70 1wbq s TYR 304 N -3.46 2.61 -0.08 1.13 2.02 -0.24 -4.91 117.35 114.42 1wbq s TYR 304 Ca -0.09 0.23 -0.32 0.00 -0.37 0.00 0.00 57.07 56.51 1wbq s TYR 304 Cb 0.08 -4.13 0.13 0.00 -0.40 0.00 0.00 41.96 37.64 1wbq s TYR 304 CO 0.91 -4.43 1.33 -0.98 -1.57 0.00 0.00 175.55 170.81 1wbq s ARG 305 N 1.84 0.25 0.38 -0.62 1.70 -1.26 -3.64 118.95 117.60 1wbq s ARG 305 Ca 0.77 -0.13 -0.28 0.00 -0.47 0.00 0.00 55.73 55.62 1wbq s ARG 305 Cb -0.47 0.09 -0.11 0.00 -0.57 0.00 0.00 34.95 33.89 1wbq s ARG 305 CO 0.34 -0.11 1.48 -2.14 -1.08 0.00 0.00 175.30 173.79 1wbq s PRO 306 N -2.28 4.08 0.00 3.89 0.02 -1.26 -3.40 135.00 136.06 1wbq s PRO 306 Ca 0.14 2.56 0.00 0.00 0.02 0.00 0.00 61.00 63.72 1wbq s PRO 306 Cb 0.05 -2.95 0.00 0.00 0.02 0.00 0.00 34.50 31.62 1wbq s PRO 306 CO -0.05 -0.55 0.00 0.41 -0.33 0.00 0.00 177.00 176.48 1wbq n GLY 307 N 0.46 3.16 0.84 0.52 0.00 -0.70 -4.96 105.19 104.51 1wbq n GLY 307 Ca 0.01 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.99 1wbq n GLY 307 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1wbq n THR 308 N -1.39 0.00 -4.08 2.61 5.66 -1.22 -4.77 114.28 111.09 1wbq n THR 308 Ca 0.00 -0.38 -0.10 0.00 -3.05 0.00 0.00 64.05 60.52 1wbq n THR 308 Cb 0.00 -1.10 -0.08 0.00 -1.55 0.00 0.00 70.33 67.60 1wbq n THR 308 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1wbq s SER 309 N -1.83 0.07 0.22 1.09 1.04 -1.26 -0.95 113.70 112.08 1wbq s SER 309 Ca 0.14 -1.11 -0.08 0.00 0.48 0.00 0.00 55.95 55.38 1wbq s SER 309 Cb -0.01 0.44 0.17 0.00 0.10 0.00 0.00 66.02 66.72 1wbq s SER 309 CO 0.09 -0.92 1.80 0.40 0.98 0.00 0.00 173.24 175.59 1wbq h ILE 310 N 2.53 1.26 -0.15 -1.02 2.04 -1.76 -1.80 117.51 118.61 1wbq h ILE 310 Ca -0.32 -0.75 0.03 0.00 1.00 0.00 0.00 64.86 64.83 1wbq h ILE 310 Cb 1.24 0.24 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 1wbq h ILE 310 CO 0.48 0.31 -0.07 0.25 0.00 0.00 0.00 178.15 179.12 1wbq h LEU 311 N 1.17 -0.23 -0.23 1.44 5.85 -1.50 0.18 115.31 121.98 1wbq h LEU 311 Ca 0.28 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 59.04 1wbq h LEU 311 Cb 0.14 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1wbq h LEU 311 CO -0.03 -0.09 0.10 -0.08 -0.34 0.00 0.00 178.44 177.99 1wbq h GLU 312 N -0.05 0.35 -0.52 1.25 4.81 -1.80 -2.26 114.58 116.35 1wbq h GLU 312 Ca 0.08 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.17 1wbq h GLU 312 Cb 0.17 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 1wbq h GLU 312 CO -0.18 0.38 -0.01 0.28 -0.73 0.00 0.00 179.01 178.76 1wbq h VAL 313 N 0.23 1.25 -0.91 0.32 2.07 -1.25 -2.58 116.25 115.38 1wbq h VAL 313 Ca 0.08 -1.06 0.10 0.00 0.82 0.00 0.00 66.70 66.63 1wbq h VAL 313 Cb 0.16 0.86 -0.08 0.00 -1.52 0.00 0.00 31.29 30.72 1wbq h VAL 313 CO -0.01 0.38 0.55 0.74 0.02 0.00 0.00 177.57 179.25 1wbq h THR 314 N 0.81 0.95 -0.98 2.57 2.02 -0.73 -2.21 112.91 115.34 1wbq h THR 314 Ca 0.15 -0.32 0.04 0.00 0.77 0.00 0.00 66.41 67.06 1wbq h THR 314 Cb 0.49 -0.06 -0.06 0.00 -1.74 0.00 0.00 68.15 66.79 1wbq h THR 314 CO 0.02 0.17 0.64 1.23 0.37 0.00 0.00 175.52 177.95 1wbq h GLY 315 N 0.92 1.44 1.04 2.16 0.00 -0.99 -0.00 103.07 107.63 1wbq h GLY 315 Ca 0.43 -0.49 -0.07 0.00 0.00 0.00 0.00 47.33 47.21 1wbq h GLY 315 CO -0.24 0.41 0.12 0.83 0.00 0.00 0.00 176.54 177.66 1wbq h GLU 316 N 1.23 1.02 -0.51 4.80 4.39 -1.38 -2.74 114.58 121.39 1wbq h GLU 316 Ca 0.40 -0.26 -0.06 0.00 0.34 0.00 0.00 59.36 59.78 1wbq h GLU 316 Cb 0.03 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.53 1wbq h GLU 316 CO -0.13 0.94 0.09 0.28 -1.16 0.00 0.00 179.01 179.03 1wbq h VAL 317 N 0.93 1.25 -0.60 3.13 2.07 -0.75 -2.21 116.25 120.08 1wbq h VAL 317 Ca 0.19 -0.92 0.06 0.00 0.82 0.00 0.00 66.70 66.86 1wbq h VAL 317 Cb 0.40 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 1wbq h VAL 317 CO 0.01 0.33 0.30 0.58 0.02 0.00 0.00 177.57 178.81 1wbq h VAL 318 N 0.72 0.92 -0.35 2.57 2.07 -0.99 0.75 116.25 121.94 1wbq h VAL 318 Ca 0.16 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.50 1wbq h VAL 318 Cb 0.38 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1wbq h VAL 318 CO 0.01 0.10 0.21 -0.09 0.02 0.00 0.00 177.57 177.82 1wbq h ARG 319 N 0.55 0.42 -0.51 1.57 2.43 -1.29 0.95 114.38 118.50 1wbq h ARG 319 Ca 0.27 -0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.45 1wbq h ARG 319 Cb 0.22 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.64 1wbq h ARG 319 CO -0.20 0.28 0.30 0.82 -1.51 0.00 0.00 179.97 179.65 1wbq h ILE 320 N 0.43 1.04 0.09 1.20 2.04 -0.83 -1.00 117.51 120.47 1wbq h ILE 320 Ca 0.13 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 1wbq h ILE 320 Cb -0.02 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 1wbq h ILE 320 CO -0.05 0.11 -0.04 0.24 0.00 0.00 0.00 178.15 178.40 1wbq h MET 321 N 0.59 -0.12 -0.49 2.37 2.86 -0.46 -1.15 114.93 118.52 1wbq h MET 321 Ca 0.21 0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.88 1wbq h MET 321 Cb 0.04 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.69 1wbq h MET 321 CO -0.10 0.19 0.30 0.28 1.06 0.00 0.00 176.91 178.64 1wbq h VAL 322 N -0.43 1.06 -0.25 -2.22 2.07 -0.77 0.49 116.25 116.21 1wbq h VAL 322 Ca -0.01 -0.21 0.02 0.00 0.82 0.00 0.00 66.70 67.32 1wbq h VAL 322 Cb 0.36 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1wbq h VAL 322 CO 0.02 0.11 0.11 0.28 0.02 0.00 0.00 177.57 178.11 1wbq h SER 323 N 0.60 0.14 -0.52 0.57 0.02 -1.15 -0.93 113.55 112.28 1wbq h SER 323 Ca 0.20 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.15 1wbq h SER 323 Cb 0.00 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 1wbq h SER 323 CO -0.08 0.12 0.27 1.23 -1.14 0.00 0.00 176.83 177.22 1wbq h GLY 324 N 0.23 0.79 1.54 -3.77 0.00 -0.77 -1.85 103.07 99.25 1wbq h GLY 324 Ca 0.11 -0.38 -0.11 0.00 0.00 0.00 0.00 47.33 46.95 1wbq h GLY 324 CO -0.09 0.36 -0.29 1.41 0.00 0.00 0.00 176.54 177.93 1wbq h LEU 325 N 0.70 0.54 -0.55 3.11 3.38 -0.74 -2.51 115.31 119.24 1wbq h LEU 325 Ca 0.18 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1wbq h LEU 325 Cb 0.08 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1wbq h LEU 325 CO -0.03 0.81 0.17 0.58 0.09 0.00 0.00 178.44 180.06 1wbq h VAL 326 N 0.46 1.24 -0.01 1.22 2.07 -0.99 0.53 116.25 120.76 1wbq h VAL 326 Ca 0.06 -0.81 -0.02 0.00 0.82 0.00 0.00 66.70 66.75 1wbq h VAL 326 Cb 0.74 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1wbq h VAL 326 CO 0.06 0.30 -0.11 0.11 0.02 0.00 0.00 177.57 177.95 1wbq h LYS 327 N 0.76 0.02 -0.01 1.57 1.57 -1.00 -2.10 116.57 117.38 1wbq h LYS 327 Ca 0.18 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1wbq h LYS 327 Cb 0.29 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1wbq h LYS 327 CO -0.00 0.13 -0.26 1.28 -0.57 0.00 0.00 179.45 180.03 1wbq n LEU 328 N -4.40 0.83 -0.13 2.94 4.77 -0.98 -4.94 117.00 115.09 1wbq n LEU 328 Ca -0.02 -0.16 -0.02 0.00 -0.03 0.00 0.00 56.01 55.78 1wbq n LEU 328 Cb 0.19 -0.16 -0.01 0.00 -2.33 0.00 0.00 43.42 41.11 1wbq n LEU 328 CO 0.36 0.16 -0.02 0.61 -1.33 0.00 0.00 177.39 177.17 1wbq n GLY 329 N 1.35 0.53 0.13 -0.72 0.00 -0.79 -4.89 105.19 100.80 1wbq n GLY 329 Ca 0.12 -0.50 -0.15 0.00 0.00 0.00 0.00 46.02 45.48 1wbq n GLY 329 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1wbq h ILE 330 N 0.00 1.46 -2.88 -0.61 2.04 -1.15 -3.41 117.51 112.95 1wbq h ILE 330 Ca -0.04 -2.82 -0.62 0.00 1.00 0.00 0.00 64.86 62.39 1wbq h ILE 330 Cb 0.18 2.75 -0.14 0.00 -0.74 0.00 0.00 36.82 38.87 1wbq h ILE 330 CO 0.05 0.83 -0.73 -0.76 0.00 0.00 0.00 178.15 177.55 1wbq s LEU 331 N -7.38 2.93 -0.05 1.44 1.43 -0.89 -4.89 118.68 111.26 1wbq s LEU 331 Ca -0.05 -0.64 0.01 0.00 -1.03 0.00 0.00 54.13 52.42 1wbq s LEU 331 Cb 0.08 -1.59 0.02 0.00 0.03 0.00 0.00 46.19 44.73 1wbq s LEU 331 CO 0.88 0.09 -0.05 -0.54 0.23 0.00 0.00 176.35 176.95 1wbq s LYS 332 N -2.95 0.96 0.00 1.70 1.02 -1.26 -4.21 119.74 115.00 1wbq s LYS 332 Ca 0.25 -0.14 0.00 0.00 0.02 0.00 0.00 55.97 56.10 1wbq s LYS 332 Cb -0.08 -0.94 0.00 0.00 -0.52 0.00 0.00 37.83 36.28 1wbq s LYS 332 CO 0.15 -0.08 0.00 0.41 -0.92 0.00 0.00 175.35 174.91 1wbq n GLY 333 N 4.09 0.88 3.72 -3.33 0.00 -1.26 -5.02 105.19 104.27 1wbq n GLY 333 Ca -0.23 -1.97 -0.42 0.00 0.00 0.00 0.00 46.02 43.40 1wbq n GLY 333 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1wbq s ASP 334 N -4.00 7.37 0.16 1.61 2.15 -1.26 -4.96 116.67 117.73 1wbq s ASP 334 Ca 0.00 1.77 -0.16 0.00 0.43 0.00 0.00 52.55 54.59 1wbq s ASP 334 Cb 0.00 -2.58 0.07 0.00 -0.30 0.00 0.00 42.92 40.11 1wbq s ASP 334 CO 0.00 -0.22 1.75 0.58 -0.17 0.00 0.00 175.17 177.11 1wbq h VAL 335 N 4.47 0.89 -0.52 1.11 2.07 -1.97 0.11 116.25 122.41 1wbq h VAL 335 Ca -0.42 -0.10 -0.10 0.00 0.82 0.00 0.00 66.70 66.91 1wbq h VAL 335 Cb 1.22 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 1wbq h VAL 335 CO 0.75 0.05 -0.07 0.44 0.02 0.00 0.00 177.57 178.76 1wbq h ASP 336 N 0.28 0.91 -0.28 0.57 3.32 -1.98 0.79 116.42 120.02 1wbq h ASP 336 Ca 0.17 -0.27 -0.06 0.00 0.02 0.00 0.00 57.03 56.89 1wbq h ASP 336 Cb 0.15 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1wbq h ASP 336 CO -0.18 1.01 -0.07 -0.33 -1.72 0.00 0.00 179.24 177.96 1wbq h GLU 337 N 0.84 0.54 -0.63 3.56 5.08 -1.87 0.33 114.58 122.43 1wbq h GLU 337 Ca 0.14 -0.21 0.04 0.00 -1.00 0.00 0.00 59.36 58.34 1wbq h GLU 337 Cb 0.59 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.76 1wbq h GLU 337 CO 0.04 0.75 0.37 -0.07 -1.00 0.00 0.00 179.01 179.09 1wbq h LEU 338 N 0.30 0.57 -0.37 1.33 3.38 -0.60 -0.97 115.31 118.95 1wbq h LEU 338 Ca 0.07 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1wbq h LEU 338 Cb 0.55 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1wbq h LEU 338 CO 0.03 0.39 0.22 0.40 0.09 0.00 0.00 178.44 179.56 1wbq h ILE 339 N 0.70 1.13 -0.78 1.22 2.04 -0.74 -0.42 117.51 120.66 1wbq h ILE 339 Ca 0.27 -0.31 0.08 0.00 1.00 0.00 0.00 64.86 65.89 1wbq h ILE 339 Cb 0.10 0.66 -0.05 0.00 -0.74 0.00 0.00 36.82 36.79 1wbq h ILE 339 CO -0.14 0.13 0.51 0.00 0.00 0.00 0.00 178.15 178.66 1wbq h ALA 340 N 1.09 1.69 -0.50 1.87 0.00 -0.36 -1.26 119.26 121.78 1wbq h ALA 340 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1wbq h ALA 340 Cb 0.02 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1wbq h ALA 340 CO -0.02 0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.40 1wbq n GLN 341 N -4.49 3.83 -4.09 0.00 10.64 -0.42 -4.95 117.38 117.89 1wbq n GLN 341 Ca 0.12 -2.50 -0.28 0.00 -1.83 0.00 0.00 57.00 52.52 1wbq n GLN 341 Cb 0.26 -1.99 -0.05 0.00 -0.86 0.00 0.00 30.24 27.60 1wbq n GLN 341 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 1wbq n ASN 342 N 0.68 0.04 0.17 2.61 3.02 -0.48 -4.85 115.26 116.45 1wbq n ASN 342 Ca 0.22 -1.10 0.13 0.00 -0.03 0.00 0.00 54.58 53.80 1wbq n ASN 342 Cb 0.92 -2.52 0.56 0.00 -0.61 0.00 0.00 39.78 38.13 1wbq n ASN 342 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wbq h ALA 343 N 0.82 1.00 0.00 5.41 0.00 -1.33 -2.09 119.26 123.08 1wbq h ALA 343 Ca -0.64 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1wbq h ALA 343 Cb 1.38 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1wbq h ALA 343 CO 0.66 0.00 0.00 1.12 0.00 0.00 0.00 179.25 181.03 1wbq h HIS 344 N 0.00 0.00 -0.08 0.00 2.07 -1.89 -3.38 115.15 111.86 1wbq h HIS 344 Ca 0.00 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.48 1wbq h HIS 344 Cb 0.38 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.36 1wbq h HIS 344 CO 0.00 0.00 -0.12 0.00 -3.07 0.00 0.00 177.93 174.74 1wbq h ARG 345 N 0.00 0.13 -0.01 5.12 3.08 -1.57 0.88 114.38 122.01 1wbq h ARG 345 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1wbq h ARG 345 Cb 0.53 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.55 1wbq h ARG 345 CO 0.00 0.25 0.07 -1.35 -1.07 0.00 0.00 179.97 177.87 1wbq h PRO 346 N 0.12 0.00 0.00 0.04 0.11 -1.83 -3.15 132.00 127.30 1wbq h PRO 346 Ca 0.03 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.13 1wbq h PRO 346 Cb 0.29 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.40 1wbq h PRO 346 CO 0.02 0.00 -1.59 1.19 -0.21 0.00 0.00 178.00 177.41 1wbq n PHE 347 N -3.19 0.00 -3.42 0.65 3.72 0.22 -4.85 117.46 110.59 1wbq n PHE 347 Ca -0.02 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.17 1wbq n PHE 347 Cb 0.14 -0.29 -0.10 0.00 -0.94 0.00 0.00 39.48 38.28 1wbq n PHE 347 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 1wbq s PHE 348 N -2.88 -0.19 -1.24 1.38 5.36 -0.70 -0.66 117.98 119.04 1wbq s PHE 348 Ca -0.05 -0.54 0.12 0.00 -0.96 0.00 0.00 56.93 55.50 1wbq s PHE 348 Cb 0.08 -0.57 0.04 0.00 -0.34 0.00 0.00 43.02 42.23 1wbq s PHE 348 CO 0.53 -0.91 0.77 0.00 -1.46 0.00 0.00 175.22 174.15 1wbq n MET 349 N 5.00 1.48 -4.24 10.12 0.00 -1.24 -4.34 117.12 123.91 1wbq n MET 349 Ca 0.01 -0.88 -0.27 0.00 0.00 0.00 0.00 57.70 56.56 1wbq n MET 349 Cb 0.44 -1.17 -0.07 0.00 0.00 0.00 0.00 33.22 32.43 1wbq n MET 349 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 175.97 172.59 1wbq s HIS 350 N -1.31 2.31 0.61 3.17 -3.43 -1.26 -5.12 115.29 110.26 1wbq s HIS 350 Ca 0.11 -0.70 -0.16 0.00 -0.80 0.00 0.00 55.06 53.51 1wbq s HIS 350 Cb 0.10 -1.88 -0.02 0.00 -1.43 0.00 0.00 32.58 29.34 1wbq s HIS 350 CO 0.24 0.10 1.09 0.20 -2.00 0.00 0.00 174.74 174.37 1wbq s GLY 351 N -3.95 2.22 0.19 -1.38 0.00 -1.26 -4.97 107.32 98.17 1wbq s GLY 351 Ca 0.33 0.54 0.07 0.00 0.00 0.00 0.00 44.72 45.66 1wbq s GLY 351 CO 0.19 0.88 1.43 -2.00 0.00 0.00 0.00 173.10 173.59 1wbq h LEU 352 N 0.39 0.05 -7.42 0.66 5.85 -1.94 -3.46 115.31 109.44 1wbq h LEU 352 Ca -0.47 -0.04 -0.15 0.00 0.84 0.00 0.00 57.88 58.05 1wbq h LEU 352 Cb 1.24 -0.02 -0.25 0.00 0.37 0.00 0.00 40.66 42.00 1wbq h LEU 352 CO 0.56 0.85 -0.35 -0.44 -0.34 0.00 0.00 178.44 178.72 1wbq s SER 353 N -6.81 -0.32 0.14 1.25 0.01 -1.26 -0.52 113.70 106.19 1wbq s SER 353 Ca -0.01 0.60 0.05 0.00 1.31 0.00 0.00 55.95 57.91 1wbq s SER 353 Cb 0.11 0.62 -0.04 0.00 0.21 0.00 0.00 66.02 66.92 1wbq s SER 353 CO 0.80 -0.12 -0.12 -1.38 0.41 0.00 0.00 173.24 172.83 1wbq s HIS 354 N 0.11 1.35 0.80 2.43 -3.43 -1.26 -4.92 115.29 110.37 1wbq s HIS 354 Ca -0.00 -0.64 -0.13 0.00 -0.80 0.00 0.00 55.06 53.49 1wbq s HIS 354 Cb -0.02 -0.69 0.08 0.00 -1.43 0.00 0.00 32.58 30.51 1wbq s HIS 354 CO 0.01 0.13 1.18 -1.58 -2.00 0.00 0.00 174.74 172.48 1wbq s TRP 355 N -2.66 1.91 -0.01 0.38 0.23 -1.26 -0.91 118.94 116.62 1wbq s TRP 355 Ca 0.13 1.67 0.00 0.00 -2.03 0.00 0.00 56.10 55.86 1wbq s TRP 355 Cb -0.02 -3.42 0.01 0.00 0.03 0.00 0.00 33.47 30.07 1wbq s TRP 355 CO 0.02 -2.67 0.00 -1.17 0.96 0.00 0.00 176.95 174.10 1wbq s LEU 356 N -5.71 1.74 0.00 2.99 2.96 -0.51 -1.59 118.68 118.57 1wbq s LEU 356 Ca 0.71 0.00 0.00 0.00 -0.22 0.00 0.00 54.13 54.62 1wbq s LEU 356 Cb -0.27 -0.05 0.00 0.00 0.50 0.00 0.00 46.19 46.38 1wbq s LEU 356 CO 0.50 -0.03 0.00 0.61 -1.32 0.00 0.00 176.35 176.11 1wbq n GLY 357 N 3.38 0.43 0.28 7.98 0.00 -1.26 -4.60 105.19 111.40 1wbq n GLY 357 Ca -0.17 0.42 0.17 0.00 0.00 0.00 0.00 46.02 46.44 1wbq n GLY 357 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wbq h LEU 358 N 0.00 0.00 -8.88 0.99 3.38 -1.95 -0.29 115.31 108.57 1wbq h LEU 358 Ca 0.00 0.00 -0.69 0.00 0.09 0.00 0.00 57.88 57.28 1wbq h LEU 358 Cb 0.00 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 40.52 1wbq h LEU 358 CO 0.00 0.04 -0.86 -1.81 0.09 0.00 0.00 178.44 175.90 1wbq s ASP 359 N -5.68 3.39 0.11 -0.43 1.01 -1.26 -4.70 116.67 109.11 1wbq s ASP 359 Ca -0.01 -0.64 -0.18 0.00 0.71 0.00 0.00 52.55 52.44 1wbq s ASP 359 Cb 0.10 -0.32 -0.05 0.00 1.01 0.00 0.00 42.92 43.67 1wbq s ASP 359 CO 0.53 0.21 1.63 1.62 0.21 0.00 0.00 175.17 179.37 1wbq h VAL 360 N 3.96 1.20 -3.32 -1.27 3.04 -1.84 -3.04 116.25 114.98 1wbq h VAL 360 Ca -0.49 -0.64 -0.75 0.00 -1.01 0.00 0.00 66.70 63.80 1wbq h VAL 360 Cb 1.16 1.04 -0.23 0.00 -2.01 0.00 0.00 31.29 31.25 1wbq h VAL 360 CO 0.42 0.22 0.37 -1.00 -1.01 0.00 0.00 177.57 176.57 1wbq s HIS 361 N -5.42 3.55 0.64 3.17 3.76 -1.26 -4.34 115.29 115.39 1wbq s HIS 361 Ca -0.13 -1.80 -0.11 0.00 -0.15 0.00 0.00 55.06 52.87 1wbq s HIS 361 Cb 0.09 -3.98 -0.03 0.00 1.11 0.00 0.00 32.58 29.77 1wbq s HIS 361 CO 0.74 -1.17 1.04 0.34 -0.85 0.00 0.00 174.74 174.84 1wbq s ASP 362 N 2.66 5.96 0.84 1.40 2.15 -0.62 -5.00 116.67 124.07 1wbq s ASP 362 Ca 0.23 1.49 -0.11 0.00 0.43 0.00 0.00 52.55 54.60 1wbq s ASP 362 Cb -0.08 -2.48 0.10 0.00 -0.30 0.00 0.00 42.92 40.16 1wbq s ASP 362 CO -0.09 -1.05 1.09 0.68 -0.17 0.00 0.00 175.17 175.63 1wbq s VAL 363 N -3.12 2.93 0.00 1.11 -7.23 -1.26 -4.63 120.40 108.21 1wbq s VAL 363 Ca 0.56 0.30 0.00 0.00 -1.81 0.00 0.00 61.98 61.03 1wbq s VAL 363 Cb -0.12 -2.74 0.00 0.00 0.56 0.00 0.00 36.38 34.08 1wbq s VAL 363 CO 0.54 -0.39 0.00 0.61 -0.31 0.00 0.00 175.10 175.54 1wbq n GLY 364 N -1.02 3.99 3.70 2.32 0.00 -1.26 -4.52 105.19 108.39 1wbq n GLY 364 Ca 0.08 -1.39 -0.42 0.00 0.00 0.00 0.00 46.02 44.29 1wbq n GLY 364 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wbq s VAL 365 N -1.27 3.65 -0.17 1.61 1.01 -1.26 -4.93 120.40 119.04 1wbq s VAL 365 Ca 0.00 1.08 0.17 0.00 0.00 0.00 0.00 61.98 63.24 1wbq s VAL 365 Cb 0.00 -3.70 -0.01 0.00 0.00 0.00 0.00 36.38 32.67 1wbq s VAL 365 CO 0.00 0.02 1.14 1.88 0.00 0.00 0.00 175.10 178.14 1wbq h TYR 366 N 7.57 0.00 -0.15 5.22 0.05 -1.98 -3.47 116.97 124.21 1wbq h TYR 366 Ca -0.39 0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.40 1wbq h TYR 366 Cb 1.19 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.92 1wbq h TYR 366 CO 0.73 0.44 -0.05 0.41 -1.05 0.00 0.00 178.16 178.63 1wbq n GLY 367 N 1.28 -2.58 3.68 3.88 0.00 -1.26 -1.44 105.19 108.75 1wbq n GLY 367 Ca -0.03 -1.44 -0.45 0.00 0.00 0.00 0.00 46.02 44.10 1wbq n GLY 367 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1wbq n GLN 368 N -2.15 2.36 -2.05 1.61 7.27 -1.26 -1.20 117.38 121.95 1wbq n GLN 368 Ca -0.00 0.85 -0.17 0.00 0.07 0.00 0.00 57.00 57.74 1wbq n GLN 368 Cb 0.03 -2.67 -0.03 0.00 2.41 0.00 0.00 30.24 29.98 1wbq n GLN 368 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1wbq n ASP 369 N 4.31 -4.91 -3.57 1.69 8.00 -1.26 -1.88 116.55 118.95 1wbq n ASP 369 Ca 0.18 0.21 -0.22 0.00 0.71 0.00 0.00 54.79 55.67 1wbq n ASP 369 Cb 0.31 -4.23 0.08 0.00 -0.02 0.00 0.00 41.12 37.26 1wbq n ASP 369 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1wbq n ARG 370 N -2.62 -7.37 0.00 -1.24 1.74 -0.34 -4.25 116.66 102.58 1wbq n ARG 370 Ca -0.19 0.82 0.13 0.00 -0.77 0.00 0.00 57.85 57.84 1wbq n ARG 370 Cb 0.62 -5.84 0.46 0.00 -1.02 0.00 0.00 32.46 26.68 1wbq n ARG 370 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1wbq n SER 371 N -3.05 1.13 -4.69 0.55 3.41 -0.79 -1.70 113.62 108.49 1wbq n SER 371 Ca -0.09 -1.09 -0.44 0.00 -0.26 0.00 0.00 58.87 56.99 1wbq n SER 371 Cb 0.60 0.07 -0.02 0.00 -0.26 0.00 0.00 64.21 64.59 1wbq n SER 371 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1wbq n ARG 372 N -0.38 2.19 -2.21 4.33 0.63 -0.52 -4.82 116.66 115.88 1wbq n ARG 372 Ca 0.15 0.78 -0.42 0.00 -0.92 0.00 0.00 57.85 57.44 1wbq n ARG 372 Cb 0.34 -2.44 -0.03 0.00 0.45 0.00 0.00 32.46 30.78 1wbq n ARG 372 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1wbq s ILE 373 N -0.26 3.24 0.29 5.15 -1.09 -1.26 -4.47 121.20 122.80 1wbq s ILE 373 Ca 0.65 0.98 -0.27 0.00 -2.23 0.00 0.00 60.65 59.78 1wbq s ILE 373 Cb -0.60 -3.63 -0.10 0.00 -1.58 0.00 0.00 42.46 36.56 1wbq s ILE 373 CO 0.52 0.13 0.94 -0.76 -1.23 0.00 0.00 174.94 174.53 1wbq s LEU 374 N 0.21 4.44 0.10 2.97 1.43 -0.12 -4.88 118.68 122.83 1wbq s LEU 374 Ca 0.59 1.86 0.03 0.00 -1.03 0.00 0.00 54.13 55.58 1wbq s LEU 374 Cb -0.37 -3.88 -0.04 0.00 0.03 0.00 0.00 46.19 41.94 1wbq s LEU 374 CO 0.36 0.01 -0.09 -1.61 0.23 0.00 0.00 176.35 175.25 1wbq s GLU 375 N -1.78 0.86 0.35 1.70 2.02 -1.26 -1.72 118.70 118.87 1wbq s GLU 375 Ca 0.47 -1.25 -0.28 0.00 0.02 0.00 0.00 54.97 53.93 1wbq s GLU 375 Cb -0.21 -0.41 -0.12 0.00 0.10 0.00 0.00 34.13 33.49 1wbq s GLU 375 CO 0.26 0.04 1.27 -2.30 0.02 0.00 0.00 175.26 174.55 1wbq n PRO 376 N 0.25 2.06 0.00 0.39 -0.02 -1.26 -2.85 135.00 133.56 1wbq n PRO 376 Ca -0.14 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1wbq n PRO 376 Cb 0.59 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1wbq n PRO 376 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wbq n GLY 377 N 0.80 2.76 3.77 -1.23 0.00 -0.20 -4.90 105.19 106.19 1wbq n GLY 377 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1wbq n GLY 377 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1wbq s MET 378 N -0.94 4.43 -0.08 1.61 -1.94 -1.13 -1.05 119.30 120.19 1wbq s MET 378 Ca 0.00 2.01 0.04 0.00 -1.71 0.00 0.00 55.69 56.03 1wbq s MET 378 Cb 0.00 -3.07 0.00 0.00 2.01 0.00 0.00 34.83 33.77 1wbq s MET 378 CO 0.00 -0.05 -0.20 0.08 -0.01 0.00 0.00 175.02 174.84 1wbq s VAL 379 N -1.18 1.72 0.19 -6.03 1.01 -1.26 -0.70 120.40 114.14 1wbq s VAL 379 Ca 0.48 -0.84 -0.12 0.00 0.00 0.00 0.00 61.98 61.51 1wbq s VAL 379 Cb -0.36 -1.49 0.00 0.00 0.00 0.00 0.00 36.38 34.53 1wbq s VAL 379 CO 0.47 0.48 0.37 -1.48 0.00 0.00 0.00 175.10 174.94 1wbq s LEU 380 N 0.30 0.64 0.35 3.92 2.34 -0.39 -1.42 118.68 124.42 1wbq s LEU 380 Ca -0.13 -0.79 0.01 0.00 0.06 0.00 0.00 54.13 53.28 1wbq s LEU 380 Cb -0.16 1.52 -0.03 0.00 -0.56 0.00 0.00 46.19 46.96 1wbq s LEU 380 CO 0.06 -0.97 0.55 0.42 -1.06 0.00 0.00 176.35 175.34 1wbq s THR 381 N -3.95 4.92 -0.14 5.48 -4.23 -0.09 -0.76 115.64 116.87 1wbq s THR 381 Ca 0.16 -0.54 -0.02 0.00 -1.18 0.00 0.00 61.69 60.12 1wbq s THR 381 Cb 0.02 -3.79 0.04 0.00 1.34 0.00 0.00 72.50 70.11 1wbq s THR 381 CO 0.01 -0.49 0.01 -0.69 -0.54 0.00 0.00 174.62 172.91 1wbq s VAL 382 N -2.32 0.54 -0.42 2.29 1.01 0.07 -4.05 120.40 117.53 1wbq s VAL 382 Ca 0.41 -0.30 0.08 0.00 0.00 0.00 0.00 61.98 62.17 1wbq s VAL 382 Cb -0.10 -0.87 0.27 0.00 0.00 0.00 0.00 36.38 35.68 1wbq s VAL 382 CO 0.35 0.02 0.69 -1.84 0.00 0.00 0.00 175.10 174.33 1wbq n GLU 383 N 5.07 0.79 -1.61 2.72 0.28 0.33 -1.53 120.64 126.68 1wbq n GLU 383 Ca -0.09 -2.76 -0.34 0.00 -0.16 0.00 0.00 57.16 53.81 1wbq n GLU 383 Cb 0.48 -1.34 0.07 0.00 1.43 0.00 0.00 31.44 32.09 1wbq n GLU 383 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 1wbq s PRO 384 N -0.76 2.42 0.10 3.44 0.04 -1.24 -4.76 135.00 134.25 1wbq s PRO 384 Ca 0.34 1.72 -0.18 0.00 0.04 0.00 0.00 61.00 62.92 1wbq s PRO 384 Cb 0.22 -1.87 0.04 0.00 0.04 0.00 0.00 34.50 32.93 1wbq s PRO 384 CO -0.14 -1.61 0.43 0.20 0.04 0.00 0.00 177.00 175.93 1wbq s GLY 385 N -2.02 -0.32 -0.04 0.56 0.00 -1.26 -2.68 107.32 101.56 1wbq s GLY 385 Ca 0.74 0.14 0.01 0.00 0.00 0.00 0.00 44.72 45.61 1wbq s GLY 385 CO 0.42 -0.13 -0.04 1.08 0.00 0.00 0.00 173.10 174.43 1wbq s LEU 386 N -2.54 1.30 -0.16 0.66 1.43 0.30 -4.50 118.68 115.17 1wbq s LEU 386 Ca 0.00 -0.11 -0.01 0.00 -1.03 0.00 0.00 54.13 52.98 1wbq s LEU 386 Cb 0.01 -0.41 0.05 0.00 0.03 0.00 0.00 46.19 45.86 1wbq s LEU 386 CO -0.09 -0.06 -0.02 -0.31 0.23 0.00 0.00 176.35 176.10 1wbq s TYR 387 N 0.94 1.39 -0.32 0.29 1.51 0.17 -1.11 117.35 120.21 1wbq s TYR 387 Ca -0.11 -0.92 -0.06 0.00 -1.01 0.00 0.00 57.07 54.97 1wbq s TYR 387 Cb -0.14 -1.17 0.03 0.00 -0.11 0.00 0.00 41.96 40.57 1wbq s TYR 387 CO -0.00 -0.58 0.09 0.42 -1.11 0.00 0.00 175.55 174.37 1wbq s ILE 388 N 1.74 3.82 0.55 2.71 -1.09 0.48 -4.34 121.20 125.07 1wbq s ILE 388 Ca 0.00 -0.95 -0.21 0.00 -2.23 0.00 0.00 60.65 57.27 1wbq s ILE 388 Cb -0.16 -3.07 -0.05 0.00 -1.58 0.00 0.00 42.46 37.60 1wbq s ILE 388 CO -0.07 -0.06 1.30 0.00 -1.23 0.00 0.00 174.94 174.88 1wbq s ALA 389 N 1.44 2.75 0.57 9.38 0.00 -1.26 -0.53 121.76 134.11 1wbq s ALA 389 Ca 0.00 1.22 0.29 0.00 0.00 0.00 0.00 51.96 53.47 1wbq s ALA 389 Cb -0.18 -3.53 1.47 0.00 0.00 0.00 0.00 23.12 20.88 1wbq s ALA 389 CO 0.02 -1.28 1.92 -1.35 0.00 0.00 0.00 175.76 175.07 1wbq h PRO 390 N 1.35 0.00 -0.34 0.00 0.11 -1.91 -1.22 132.00 129.99 1wbq h PRO 390 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1wbq h PRO 390 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1wbq h PRO 390 CO 0.57 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.96 1wbq n ASP 391 N -3.93 3.50 -4.76 -2.05 5.75 -1.26 -4.66 116.55 109.15 1wbq n ASP 391 Ca 0.10 -2.46 -0.38 0.00 -0.01 0.00 0.00 54.79 52.04 1wbq n ASP 391 Cb 0.71 -0.39 0.01 0.00 -1.03 0.00 0.00 41.12 40.41 1wbq n ASP 391 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1wbq s ALA 392 N -1.83 2.97 -1.22 2.12 0.00 -0.46 -4.92 121.76 118.41 1wbq s ALA 392 Ca 0.34 1.11 -0.12 0.00 0.00 0.00 0.00 51.96 53.29 1wbq s ALA 392 Cb 0.23 -3.46 0.18 0.00 0.00 0.00 0.00 23.12 20.07 1wbq s ALA 392 CO 0.14 -0.91 1.56 0.39 0.00 0.00 0.00 175.76 176.93 1wbq n GLU 393 N -0.56 3.50 -4.04 0.00 -0.58 -1.26 -4.89 120.64 112.81 1wbq n GLU 393 Ca 0.08 -3.81 -0.10 0.00 -0.42 0.00 0.00 57.16 52.91 1wbq n GLU 393 Cb 0.46 -2.96 -0.08 0.00 -0.57 0.00 0.00 31.44 28.30 1wbq n GLU 393 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 1wbq s VAL 394 N 0.88 0.05 0.09 2.62 -7.23 -1.26 -5.05 120.40 110.50 1wbq s VAL 394 Ca 0.41 -1.59 -0.36 0.00 -1.81 0.00 0.00 61.98 58.62 1wbq s VAL 394 Cb 0.01 -2.04 -0.17 0.00 0.56 0.00 0.00 36.38 34.73 1wbq s VAL 394 CO 0.00 -0.24 1.20 -2.65 -0.31 0.00 0.00 175.10 173.10 1wbq n PRO 395 N -0.23 0.80 -0.19 4.82 -0.02 -1.26 -4.79 135.00 134.13 1wbq n PRO 395 Ca -0.05 0.29 0.12 0.00 -2.02 0.00 0.00 63.50 61.84 1wbq n PRO 395 Cb 0.63 -1.83 0.43 0.00 -0.02 0.00 0.00 33.50 32.71 1wbq n PRO 395 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1wbq h GLU 396 N 3.74 0.56 0.00 -0.52 4.22 -1.99 -1.96 114.58 118.63 1wbq h GLU 396 Ca -0.47 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 58.94 1wbq h GLU 396 Cb 1.37 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1wbq h GLU 396 CO 0.72 0.37 0.00 -0.56 -2.18 0.00 0.00 179.01 177.36 1wbq h GLN 397 N 0.58 0.00 -0.01 1.92 -0.00 -2.02 -2.56 115.11 113.03 1wbq h GLN 397 Ca 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.02 1wbq h GLN 397 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.12 1wbq h GLN 397 CO -0.14 0.00 -0.38 0.66 -0.00 0.00 0.00 178.83 178.97 1wbq n TYR 398 N -2.79 0.00 -2.38 0.06 4.01 -0.74 -4.87 117.16 110.45 1wbq n TYR 398 Ca -0.01 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.33 1wbq n TYR 398 Cb 0.16 -0.13 -0.04 0.00 -0.31 0.00 0.00 39.34 39.02 1wbq n TYR 398 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1wbq s ARG 399 N -2.64 4.56 -0.42 -0.72 0.52 -0.97 -3.23 118.95 116.05 1wbq s ARG 399 Ca 0.20 1.90 0.00 0.00 -0.52 0.00 0.00 55.73 57.31 1wbq s ARG 399 Cb 0.18 -3.17 0.00 0.00 0.52 0.00 0.00 34.95 32.48 1wbq s ARG 399 CO 0.59 0.08 0.00 0.41 0.02 0.00 0.00 175.30 176.39 1wbq n GLY 400 N 1.29 0.33 3.48 -3.53 0.00 0.32 -4.81 105.19 102.26 1wbq n GLY 400 Ca 0.00 -0.74 -0.35 0.00 0.00 0.00 0.00 46.02 44.93 1wbq n GLY 400 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wbq s ILE 401 N -2.22 4.16 -0.15 -0.61 1.01 -1.00 -3.96 121.20 118.44 1wbq s ILE 401 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.41 1wbq s ILE 401 Cb 0.00 -2.90 0.02 0.00 0.01 0.00 0.00 42.46 39.60 1wbq s ILE 401 CO 0.00 0.41 -0.13 -0.83 0.00 0.00 0.00 174.94 174.39 1wbq s GLY 402 N 1.03 1.09 -0.06 6.18 0.00 -1.26 -0.39 107.32 113.91 1wbq s GLY 402 Ca 0.03 -0.88 0.01 0.00 0.00 0.00 0.00 44.72 43.88 1wbq s GLY 402 CO 0.02 0.58 -0.06 -0.42 0.00 0.00 0.00 173.10 173.22 1wbq s ILE 403 N 1.51 0.71 0.00 0.90 1.01 -0.27 -4.72 121.20 120.35 1wbq s ILE 403 Ca 0.05 -0.18 0.02 0.00 0.00 0.00 0.00 60.65 60.54 1wbq s ILE 403 Cb -0.13 -0.73 -0.01 0.00 0.01 0.00 0.00 42.46 41.60 1wbq s ILE 403 CO -0.10 0.28 -0.06 -0.60 0.00 0.00 0.00 174.94 174.46 1wbq s ARG 404 N 1.18 0.48 -0.09 2.79 3.52 -1.26 -0.53 118.95 125.03 1wbq s ARG 404 Ca -0.06 -0.31 0.01 0.00 -0.13 0.00 0.00 55.73 55.23 1wbq s ARG 404 Cb -0.14 -0.43 0.02 0.00 -1.56 0.00 0.00 34.95 32.84 1wbq s ARG 404 CO -0.01 0.11 -0.09 0.42 -0.81 0.00 0.00 175.30 174.92 1wbq s ILE 405 N -0.36 1.05 -0.06 4.11 1.01 -1.09 -3.52 121.20 122.33 1wbq s ILE 405 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 60.65 60.30 1wbq s ILE 405 Cb -0.04 -1.03 0.02 0.00 0.01 0.00 0.00 42.46 41.43 1wbq s ILE 405 CO -0.00 0.36 -0.04 -0.70 0.00 0.00 0.00 174.94 174.55 1wbq s GLU 406 N 1.31 0.95 0.29 2.79 2.12 -0.51 -3.59 118.70 122.06 1wbq s GLU 406 Ca -0.03 -0.10 0.10 0.00 0.36 0.00 0.00 54.97 55.31 1wbq s GLU 406 Cb -0.14 -1.04 -0.05 0.00 0.26 0.00 0.00 34.13 33.16 1wbq s GLU 406 CO -0.04 -0.16 -0.03 -0.51 -0.54 0.00 0.00 175.26 173.98 1wbq s ASP 407 N 1.31 4.24 -0.13 -1.70 1.01 -0.58 -2.70 116.67 118.11 1wbq s ASP 407 Ca -0.04 -0.84 -0.01 0.00 0.71 0.00 0.00 52.55 52.37 1wbq s ASP 407 Cb -0.14 -0.63 -0.02 0.00 1.01 0.00 0.00 42.92 43.14 1wbq s ASP 407 CO -0.02 -0.08 -0.09 -1.81 0.21 0.00 0.00 175.17 173.38 1wbq s ASP 408 N -3.66 4.34 0.17 0.27 1.01 -1.26 -0.75 116.67 116.78 1wbq s ASP 408 Ca 0.32 -0.23 0.06 0.00 0.71 0.00 0.00 52.55 53.42 1wbq s ASP 408 Cb -0.04 -1.60 -0.04 0.00 1.01 0.00 0.00 42.92 42.24 1wbq s ASP 408 CO 0.19 0.19 -0.13 0.27 0.21 0.00 0.00 175.17 175.90 1wbq s ILE 409 N 0.21 1.44 -0.06 0.77 -4.36 0.06 -0.15 121.20 119.10 1wbq s ILE 409 Ca -0.06 -2.06 0.05 0.00 -0.26 0.00 0.00 60.65 58.33 1wbq s ILE 409 Cb -0.15 -1.87 -0.01 0.00 1.25 0.00 0.00 42.46 41.69 1wbq s ILE 409 CO 0.04 -0.62 -0.24 0.54 0.24 0.00 0.00 174.94 174.90 1wbq s VAL 410 N -2.95 1.98 0.06 8.37 0.11 -0.66 -1.26 120.40 126.04 1wbq s VAL 410 Ca 0.18 -1.01 -0.30 0.00 -2.93 0.00 0.00 61.98 57.91 1wbq s VAL 410 Cb -0.00 -1.68 -0.05 0.00 -1.53 0.00 0.00 36.38 33.11 1wbq s VAL 410 CO 0.04 0.55 1.15 -0.63 -3.33 0.00 0.00 175.10 172.88 1wbq s ILE 411 N -0.04 4.16 0.45 7.04 -1.09 0.12 -0.70 121.20 131.15 1wbq s ILE 411 Ca -0.07 1.58 0.02 0.00 -2.23 0.00 0.00 60.65 59.95 1wbq s ILE 411 Cb -0.14 -4.01 0.02 0.00 -1.58 0.00 0.00 42.46 36.75 1wbq s ILE 411 CO 0.05 0.14 0.16 0.35 -1.23 0.00 0.00 174.94 174.41 1wbq n THR 412 N 3.76 0.00 -0.35 2.92 -2.24 -0.18 -1.03 114.28 117.17 1wbq n THR 412 Ca 0.08 -1.97 0.04 0.00 -2.27 0.00 0.00 64.05 59.93 1wbq n THR 412 Cb 0.47 0.17 0.20 0.00 -2.10 0.00 0.00 70.33 69.07 1wbq n THR 412 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1wbq h GLU 413 N 0.00 0.98 0.00 -0.78 4.39 -1.97 -3.30 114.58 113.90 1wbq h GLU 413 Ca -0.33 -0.06 -0.07 0.00 0.34 0.00 0.00 59.36 59.24 1wbq h GLU 413 Cb 1.09 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 29.51 1wbq h GLU 413 CO 0.54 0.65 -1.55 0.25 -1.16 0.00 0.00 179.01 177.74 1wbq n THR 414 N -4.61 0.25 0.00 1.13 -2.24 -1.26 -4.75 114.28 102.80 1wbq n THR 414 Ca 0.16 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1wbq n THR 414 Cb 0.27 -0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 1wbq n THR 414 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wbq n GLY 415 N 2.10 1.32 3.29 3.38 0.00 -1.24 -4.81 105.19 109.24 1wbq n GLY 415 Ca -0.07 0.35 -0.09 0.00 0.00 0.00 0.00 46.02 46.21 1wbq n GLY 415 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wbq s ASN 416 N 2.00 0.08 -0.15 1.61 2.20 -1.24 -1.01 114.94 118.43 1wbq s ASN 416 Ca 0.00 -0.84 0.02 0.00 -0.94 0.00 0.00 52.86 51.10 1wbq s ASN 416 Cb 0.00 0.40 0.01 0.00 -2.00 0.00 0.00 41.25 39.66 1wbq s ASN 416 CO 0.00 -0.84 -0.20 -0.70 -2.94 0.00 0.00 177.10 172.43 1wbq s GLU 417 N -3.94 3.08 -0.32 3.55 2.12 0.12 -4.85 118.70 118.45 1wbq s GLU 417 Ca 0.14 -0.82 -0.26 0.00 0.36 0.00 0.00 54.97 54.40 1wbq s GLU 417 Cb 0.04 -2.51 0.01 0.00 0.26 0.00 0.00 34.13 31.93 1wbq s GLU 417 CO -0.03 -0.02 0.91 1.21 -0.54 0.00 0.00 175.26 176.79 1wbq s ASN 418 N 0.84 6.75 0.00 -1.70 3.84 -1.26 -1.66 114.94 121.75 1wbq s ASN 418 Ca -0.06 0.76 0.28 0.00 0.21 0.00 0.00 52.86 54.05 1wbq s ASN 418 Cb -0.15 -2.46 1.07 0.00 -0.55 0.00 0.00 41.25 39.15 1wbq s ASN 418 CO -0.02 -0.75 1.78 0.18 -2.79 0.00 0.00 177.10 175.50 1wbq n LEU 419 N 6.53 0.31 -0.22 3.21 4.77 0.79 -4.17 117.00 128.22 1wbq n LEU 419 Ca 0.07 0.17 0.04 0.00 -0.03 0.00 0.00 56.01 56.27 1wbq n LEU 419 Cb 0.48 -0.30 0.06 0.00 -2.33 0.00 0.00 43.42 41.32 1wbq n LEU 419 CO 0.55 0.07 0.41 0.35 -1.33 0.00 0.00 177.39 177.44 1wbq n THR 420 N -1.27 0.92 0.68 -5.08 -2.24 -1.24 -3.99 114.28 102.05 1wbq n THR 420 Ca 0.10 -1.08 0.10 0.00 -2.27 0.00 0.00 64.05 60.90 1wbq n THR 420 Cb 0.31 0.23 0.44 0.00 -2.10 0.00 0.00 70.33 69.21 1wbq n THR 420 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wbq n ALA 421 N -0.67 1.94 0.63 6.98 0.00 -1.26 -3.17 120.51 124.96 1wbq n ALA 421 Ca 0.07 -0.05 0.08 0.00 0.00 0.00 0.00 53.44 53.53 1wbq n ALA 421 Cb 0.61 -1.35 0.37 0.00 0.00 0.00 0.00 19.45 19.08 1wbq n ALA 421 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1wbq n SER 422 N -1.61 0.00 -4.66 0.00 3.41 -1.26 -4.46 113.62 105.04 1wbq n SER 422 Ca 0.05 0.38 -0.35 0.00 -0.26 0.00 0.00 58.87 58.69 1wbq n SER 422 Cb 0.25 -0.44 -0.09 0.00 -0.26 0.00 0.00 64.21 63.67 1wbq n SER 422 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1wbq s VAL 423 N -2.89 4.87 0.67 -3.33 0.11 -1.19 -4.91 120.40 113.74 1wbq s VAL 423 Ca 0.10 -0.01 -0.16 0.00 -2.93 0.00 0.00 61.98 58.98 1wbq s VAL 423 Cb 0.11 -3.19 0.01 0.00 -1.53 0.00 0.00 36.38 31.78 1wbq s VAL 423 CO 0.29 0.48 1.19 0.68 -3.33 0.00 0.00 175.10 174.41 1wbq s VAL 424 N 0.20 2.58 0.00 2.04 -7.23 -1.26 -4.98 120.40 111.75 1wbq s VAL 424 Ca 0.05 0.31 0.00 0.00 -1.81 0.00 0.00 61.98 60.53 1wbq s VAL 424 Cb -0.12 -2.95 0.00 0.00 0.56 0.00 0.00 36.38 33.87 1wbq s VAL 424 CO 0.00 -0.13 0.00 2.29 -0.31 0.00 0.00 175.10 176.95 1wbq n LYS 425 N -2.26 4.70 -2.02 4.82 2.85 -1.26 -4.90 118.16 120.09 1wbq n LYS 425 Ca 0.13 0.00 -0.42 0.00 -1.05 0.00 0.00 58.31 56.97 1wbq n LYS 425 Cb 0.50 -0.48 -0.03 0.00 -0.65 0.00 0.00 35.03 34.37 1wbq n LYS 425 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1wbq s LYS 426 N -0.20 4.26 0.26 -1.58 1.02 -1.26 -4.88 119.74 117.36 1wbq s LYS 426 Ca 0.00 2.27 -0.02 0.00 0.02 0.00 0.00 55.97 58.24 1wbq s LYS 426 Cb 0.00 -3.17 0.48 0.00 -0.52 0.00 0.00 37.83 34.63 1wbq s LYS 426 CO 0.00 -0.51 1.80 -1.00 -0.92 0.00 0.00 175.35 174.72 1wbq h PRO 427 N 6.31 0.76 -0.13 -1.68 0.13 -1.99 -0.16 132.00 135.24 1wbq h PRO 427 Ca -0.43 -0.05 -0.06 0.00 -0.87 0.00 0.00 66.00 64.59 1wbq h PRO 427 Cb 1.21 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 1wbq h PRO 427 CO 0.86 0.50 -0.19 1.05 -0.23 0.00 0.00 178.00 180.00 1wbq h GLU 428 N 0.78 0.22 -0.02 0.86 9.09 -1.99 -1.47 114.58 122.05 1wbq h GLU 428 Ca 0.45 -0.06 -0.19 0.00 0.05 0.00 0.00 59.36 59.61 1wbq h GLU 428 Cb 0.50 -0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 27.56 1wbq h GLU 428 CO -0.29 0.41 -0.81 0.93 0.05 0.00 0.00 179.01 179.30 1wbq h GLU 429 N 0.21 0.22 -0.14 1.06 5.08 -1.46 -1.30 114.58 118.25 1wbq h GLU 429 Ca 0.04 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.17 1wbq h GLU 429 Cb 0.46 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1wbq h GLU 429 CO 0.03 0.92 0.05 0.82 -1.00 0.00 0.00 179.01 179.82 1wbq h ILE 430 N 0.14 1.17 -0.47 3.13 2.04 -0.95 -1.46 117.51 121.10 1wbq h ILE 430 Ca -0.04 -0.51 -0.00 0.00 1.00 0.00 0.00 64.86 65.31 1wbq h ILE 430 Cb 1.40 1.25 -0.02 0.00 -0.74 0.00 0.00 36.82 38.71 1wbq h ILE 430 CO 0.12 0.16 0.28 -0.33 0.00 0.00 0.00 178.15 178.38 1wbq h GLU 431 N 0.05 0.64 -0.67 2.37 5.08 -1.21 -1.72 114.58 119.13 1wbq h GLU 431 Ca 0.05 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 1wbq h GLU 431 Cb 0.20 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 1wbq h GLU 431 CO -0.00 0.47 0.21 0.00 -1.00 0.00 0.00 179.01 178.69 1wbq h ALA 432 N 1.13 1.10 -0.48 3.43 0.00 -1.23 -0.21 119.26 122.99 1wbq h ALA 432 Ca 0.17 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1wbq h ALA 432 Cb -0.00 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1wbq h ALA 432 CO -0.03 0.62 0.30 1.25 0.00 0.00 0.00 179.25 181.38 1wbq h LEU 433 N 0.99 0.57 -0.23 0.00 5.85 -0.94 -1.87 115.31 119.69 1wbq h LEU 433 Ca 0.22 -0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.83 1wbq h LEU 433 Cb 0.29 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1wbq h LEU 433 CO -0.01 0.45 -0.11 0.24 -0.34 0.00 0.00 178.44 178.67 1wbq h MET 434 N 0.64 0.48 -0.44 1.25 2.86 -1.04 -2.43 114.93 116.25 1wbq h MET 434 Ca 0.17 -0.21 0.08 0.00 -2.06 0.00 0.00 59.70 57.69 1wbq h MET 434 Cb -0.02 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 31.55 1wbq h MET 434 CO -0.03 0.75 -0.02 0.28 1.06 0.00 0.00 176.91 178.95 1wbq h VAL 435 N 0.19 0.64 -0.81 -2.22 2.07 -0.96 -0.96 116.25 114.20 1wbq h VAL 435 Ca 0.05 -0.03 -0.03 0.00 0.82 0.00 0.00 66.70 67.51 1wbq h VAL 435 Cb 0.61 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 1wbq h VAL 435 CO 0.03 0.02 0.40 0.00 0.02 0.00 0.00 177.57 178.04 1wbq h ALA 436 N 1.40 1.04 -0.31 1.67 0.00 -1.29 -2.17 119.26 119.60 1wbq h ALA 436 Ca 0.22 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1wbq h ALA 436 Cb 0.32 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1wbq h ALA 436 CO -0.38 0.60 -0.16 0.00 0.00 0.00 0.00 179.25 179.31 1wbq h ALA 437 N 1.21 1.14 0.00 0.00 0.00 -1.01 -2.94 119.26 117.67 1wbq h ALA 437 Ca 0.28 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1wbq h ALA 437 Cb 0.10 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1wbq h ALA 437 CO -0.04 0.54 0.00 0.00 0.00 0.00 0.00 179.25 179.75 1wbq h ARG 438 N 0.51 0.00 -0.12 0.00 3.08 -0.69 -2.82 114.38 114.34 1wbq h ARG 438 Ca 0.09 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.97 1wbq h ARG 438 Cb 0.57 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 1wbq h ARG 438 CO 0.04 0.00 -0.62 0.87 -1.07 0.00 0.00 179.97 179.18 1wbq h LYS 439 N 0.00 0.42 0.00 0.04 1.57 -1.22 -3.51 116.57 113.87 1wbq h LYS 439 Ca 0.00 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 1wbq h LYS 439 Cb 0.68 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.03 1wbq h LYS 439 CO 0.00 0.91 0.00 1.04 -0.57 0.00 0.00 179.45 180.83