#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 0.85 -0.13 1.43 1.03 -1.26 -4.90 118.70 115.71 1wbq s GLU 2 Ca 0.00 -1.23 -0.19 0.00 0.03 0.00 0.00 54.97 53.58 1wbq s GLU 2 Cb 0.00 0.27 -0.04 0.00 -0.80 0.00 0.00 34.13 33.57 1wbq s GLU 2 CO 0.00 -0.24 0.51 0.42 -1.33 0.00 0.00 175.26 174.62 1wbq s ILE 3 N -3.96 5.15 0.72 1.83 -1.09 -1.26 -4.98 121.20 117.61 1wbq s ILE 3 Ca 0.14 1.01 -0.11 0.00 -2.23 0.00 0.00 60.65 59.45 1wbq s ILE 3 Cb 0.06 -3.85 0.02 0.00 -1.58 0.00 0.00 42.46 37.12 1wbq s ILE 3 CO -0.05 0.28 1.09 -0.94 -1.23 0.00 0.00 174.94 174.09 1wbq s SER 4 N 0.76 5.32 0.21 3.58 1.04 -1.26 -4.97 113.70 118.37 1wbq s SER 4 Ca 0.27 1.23 -0.10 0.00 0.48 0.00 0.00 55.95 57.83 1wbq s SER 4 Cb -0.15 -2.04 0.20 0.00 0.10 0.00 0.00 66.02 64.12 1wbq s SER 4 CO 0.11 -1.44 1.84 0.03 0.98 0.00 0.00 173.24 174.77 1wbq h ARG 5 N -0.72 0.82 -0.58 4.02 3.08 -1.97 -2.90 114.38 116.13 1wbq h ARG 5 Ca -0.45 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 59.51 1wbq h ARG 5 Cb 1.25 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 31.08 1wbq h ARG 5 CO 0.62 0.54 0.21 1.96 -1.07 0.00 0.00 179.97 182.23 1wbq h GLN 6 N 0.85 0.86 -0.11 0.04 7.50 -1.99 -2.06 115.11 120.20 1wbq h GLN 6 Ca 0.29 -0.15 -0.01 0.00 0.50 0.00 0.00 58.65 59.28 1wbq h GLN 6 Cb 0.04 -0.14 -0.01 0.00 0.05 0.00 0.00 27.48 27.42 1wbq h GLN 6 CO -0.12 0.73 0.05 1.49 -1.50 0.00 0.00 178.83 179.48 1wbq h GLU 7 N 0.84 0.17 -0.95 1.46 4.57 -1.90 0.39 114.58 119.17 1wbq h GLU 7 Ca 0.20 -0.03 0.06 0.00 -1.18 0.00 0.00 59.36 58.40 1wbq h GLU 7 Cb 0.21 -0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 28.71 1wbq h GLU 7 CO -0.01 0.25 0.62 0.74 -1.18 0.00 0.00 179.01 179.43 1wbq h PHE 8 N 0.05 1.13 -0.26 0.92 0.04 -1.34 -0.97 116.94 116.51 1wbq h PHE 8 Ca 0.04 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.82 1wbq h PHE 8 Cb 0.14 -0.37 -0.01 0.00 2.20 0.00 0.00 35.95 37.91 1wbq h PHE 8 CO -0.02 0.61 0.08 0.37 -0.60 0.00 0.00 178.31 178.75 1wbq h GLN 9 N 1.13 0.40 -0.80 1.51 5.75 -1.08 -2.31 115.11 119.72 1wbq h GLN 9 Ca 0.40 -0.09 0.08 0.00 -0.15 0.00 0.00 58.65 58.89 1wbq h GLN 9 Cb 0.13 -0.06 -0.07 0.00 1.07 0.00 0.00 27.48 28.55 1wbq h GLN 9 CO -0.14 0.48 0.46 0.00 -2.65 0.00 0.00 178.83 176.98 1wbq h ARG 10 N 0.25 0.78 -0.28 1.69 3.08 -0.31 -1.36 114.38 118.22 1wbq h ARG 10 Ca 0.08 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 1wbq h ARG 10 Cb 0.24 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1wbq h ARG 10 CO -0.00 0.51 0.08 0.00 -1.07 0.00 0.00 179.97 179.50 1wbq h ARG 11 N 0.80 0.43 -0.51 0.04 3.08 -1.09 0.11 114.38 117.24 1wbq h ARG 11 Ca 0.38 -0.09 0.02 0.00 0.07 0.00 0.00 59.98 60.36 1wbq h ARG 11 Cb 0.31 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 1wbq h ARG 11 CO -0.23 0.50 0.30 0.00 -1.07 0.00 0.00 179.97 179.47 1wbq h ARG 12 N 0.28 0.59 -0.22 0.04 3.08 -1.11 -1.91 114.38 115.13 1wbq h ARG 12 Ca 0.09 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.03 1wbq h ARG 12 Cb 0.25 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1wbq h ARG 12 CO -0.00 0.39 -0.19 1.96 -1.07 0.00 0.00 179.97 181.05 1wbq h GLN 13 N 0.61 0.38 -0.26 0.04 1.08 -1.07 -1.52 115.11 114.35 1wbq h GLN 13 Ca 0.20 -0.12 -0.11 0.00 -1.45 0.00 0.00 58.65 57.18 1wbq h GLN 13 Cb 0.02 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.40 1wbq h GLN 13 CO -0.09 0.56 -0.29 0.00 -0.95 0.00 0.00 178.83 178.06 1wbq h ALA 14 N 1.46 1.01 -0.07 3.87 0.00 -0.54 -0.09 119.26 124.89 1wbq h ALA 14 Ca 0.06 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1wbq h ALA 14 Cb 0.54 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1wbq h ALA 14 CO 0.04 0.59 -0.02 1.25 0.00 0.00 0.00 179.25 181.11 1wbq h LEU 15 N 0.46 0.13 -0.99 0.00 5.85 -1.11 -3.21 115.31 116.44 1wbq h LEU 15 Ca 0.06 -0.37 0.06 0.00 0.84 0.00 0.00 57.88 58.48 1wbq h LEU 15 Cb 0.74 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.67 1wbq h LEU 15 CO 0.06 0.47 0.64 0.58 -0.34 0.00 0.00 178.44 179.85 1wbq h VAL 16 N -0.21 1.09 -0.85 1.05 2.07 -1.15 -0.99 116.25 117.26 1wbq h VAL 16 Ca 0.02 -0.40 0.10 0.00 0.82 0.00 0.00 66.70 67.24 1wbq h VAL 16 Cb 0.41 -0.18 -0.06 0.00 -1.52 0.00 0.00 31.29 29.94 1wbq h VAL 16 CO 0.01 0.21 0.55 -0.08 0.02 0.00 0.00 177.57 178.28 1wbq h GLU 17 N 1.17 0.77 -0.00 1.57 4.22 -1.05 -1.49 114.58 119.77 1wbq h GLU 17 Ca 0.43 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.82 1wbq h GLU 17 Cb 0.15 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.23 1wbq h GLU 17 CO -0.17 0.51 -0.15 1.04 -2.18 0.00 0.00 179.01 178.06 1wbq n GLN 18 N -4.52 0.36 -2.99 1.92 6.02 -0.41 -4.89 117.38 112.87 1wbq n GLN 18 Ca 0.15 -0.12 -0.33 0.00 -0.01 0.00 0.00 57.00 56.69 1wbq n GLN 18 Cb 0.34 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 30.03 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 -2.71 4.14 0.61 -1.09 -1.94 -0.56 -5.06 119.30 112.69 1wbq s MET 19 Ca 0.22 0.89 -0.18 0.00 -1.71 0.00 0.00 55.69 54.91 1wbq s MET 19 Cb 0.19 -2.39 -0.03 0.00 2.01 0.00 0.00 34.83 34.61 1wbq s MET 19 CO 0.53 0.11 1.18 -0.65 -0.01 0.00 0.00 175.02 176.18 1wbq s GLN 20 N -2.92 2.93 0.61 2.03 -0.21 -1.26 -5.01 119.66 115.82 1wbq s GLN 20 Ca 0.56 1.72 -0.18 0.00 0.02 0.00 0.00 55.36 57.48 1wbq s GLN 20 Cb -0.11 -1.94 -0.03 0.00 1.00 0.00 0.00 33.01 31.94 1wbq s GLN 20 CO 0.16 -1.21 1.21 -1.25 -2.12 0.00 0.00 175.29 172.08 1wbq s PRO 21 N -3.49 2.87 -0.80 2.91 0.04 -1.26 -3.63 135.00 131.63 1wbq s PRO 21 Ca 0.75 1.82 -0.00 0.00 0.04 0.00 0.00 61.00 63.61 1wbq s PRO 21 Cb -0.28 -1.92 -0.00 0.00 0.04 0.00 0.00 34.50 32.35 1wbq s PRO 21 CO 0.34 -1.29 0.67 0.41 0.04 0.00 0.00 177.00 177.17 1wbq n GLY 22 N 0.49 -0.11 3.19 0.56 0.00 0.58 -4.80 105.19 105.10 1wbq n GLY 22 Ca 0.14 -0.08 -0.09 0.00 0.00 0.00 0.00 46.02 45.99 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 -3.90 0.26 -0.00 1.61 1.04 -0.54 -0.69 113.70 111.48 1wbq s SER 23 Ca 0.01 -0.98 0.01 0.00 0.48 0.00 0.00 55.95 55.47 1wbq s SER 23 Cb -0.00 0.31 -0.00 0.00 0.10 0.00 0.00 66.02 66.43 1wbq s SER 23 CO 0.49 -0.73 -0.04 0.00 0.98 0.00 0.00 173.24 173.94 1wbq s ALA 24 N -3.96 0.33 -0.15 5.32 0.00 -0.85 -0.55 121.76 121.90 1wbq s ALA 24 Ca 0.15 -0.16 -0.04 0.00 0.00 0.00 0.00 51.96 51.90 1wbq s ALA 24 Cb 0.06 -0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.06 1wbq s ALA 24 CO -0.04 0.08 -0.01 0.00 0.00 0.00 0.00 175.76 175.79 1wbq s ALA 25 N -0.06 3.12 -0.21 0.00 0.00 0.34 0.21 121.76 125.17 1wbq s ALA 25 Ca 0.01 -0.80 -0.02 0.00 0.00 0.00 0.00 51.96 51.15 1wbq s ALA 25 Cb -0.02 -1.62 0.00 0.00 0.00 0.00 0.00 23.12 21.49 1wbq s ALA 25 CO -0.00 0.26 -0.10 -0.51 0.00 0.00 0.00 175.76 175.41 1wbq s LEU 26 N 0.17 2.63 -0.18 0.00 1.43 -0.14 -1.30 118.68 121.29 1wbq s LEU 26 Ca -0.00 -0.52 0.01 0.00 -1.03 0.00 0.00 54.13 52.58 1wbq s LEU 26 Cb -0.13 -1.64 0.03 0.00 0.03 0.00 0.00 46.19 44.49 1wbq s LEU 26 CO 0.02 -0.02 -0.12 -0.63 0.23 0.00 0.00 176.35 175.83 1wbq s ILE 27 N 1.40 1.62 -0.08 -0.59 1.01 -0.30 -4.49 121.20 119.77 1wbq s ILE 27 Ca 0.05 -0.86 -0.05 0.00 0.00 0.00 0.00 60.65 59.79 1wbq s ILE 27 Cb -0.14 -1.62 -0.04 0.00 0.01 0.00 0.00 42.46 40.67 1wbq s ILE 27 CO -0.07 0.29 0.13 -0.36 0.00 0.00 0.00 174.94 174.93 1wbq s PHE 28 N 1.43 3.51 0.74 3.97 0.40 -1.26 -0.32 117.98 126.44 1wbq s PHE 28 Ca 0.01 0.43 -0.12 0.00 -0.60 0.00 0.00 56.93 56.65 1wbq s PHE 28 Cb -0.15 -1.88 0.04 0.00 0.51 0.00 0.00 43.02 41.54 1wbq s PHE 28 CO -0.09 0.67 1.10 0.00 0.70 0.00 0.00 175.22 177.60 1wbq s ALA 29 N -1.09 2.32 0.44 5.36 0.00 -0.23 -4.65 121.76 123.90 1wbq s ALA 29 Ca 0.18 0.36 -0.23 0.00 0.00 0.00 0.00 51.96 52.26 1wbq s ALA 29 Cb -0.12 -3.29 -0.08 0.00 0.00 0.00 0.00 23.12 19.63 1wbq s ALA 29 CO 0.08 -1.61 1.14 0.00 0.00 0.00 0.00 175.76 175.37 1wbq s ALA 30 N -2.72 3.02 0.68 0.00 0.00 -1.26 -4.80 121.76 116.68 1wbq s ALA 30 Ca 0.63 0.89 -0.13 0.00 0.00 0.00 0.00 51.96 53.34 1wbq s ALA 30 Cb -0.18 -3.36 0.01 0.00 0.00 0.00 0.00 23.12 19.59 1wbq s ALA 30 CO 0.51 -0.54 1.08 -1.25 0.00 0.00 0.00 175.76 175.57 1wbq s PRO 31 N -2.60 2.79 0.69 0.00 0.04 -1.26 -4.42 135.00 130.24 1wbq s PRO 31 Ca 0.61 1.22 -0.15 0.00 0.04 0.00 0.00 61.00 62.72 1wbq s PRO 31 Cb -0.27 -1.96 0.02 0.00 0.04 0.00 0.00 34.50 32.32 1wbq s PRO 31 CO 0.34 -1.23 1.16 -1.21 0.04 0.00 0.00 177.00 176.09 1wbq s GLU 32 N -4.47 2.50 -0.10 4.56 2.02 -1.26 -4.92 118.70 117.04 1wbq s GLU 32 Ca 0.63 1.59 -0.01 0.00 0.02 0.00 0.00 54.97 57.20 1wbq s GLU 32 Cb -0.17 -1.89 0.03 0.00 0.10 0.00 0.00 34.13 32.19 1wbq s GLU 32 CO 0.47 -1.52 -0.05 0.08 0.02 0.00 0.00 175.26 174.25 1wbq s VAL 33 N -2.13 0.83 0.27 2.63 1.01 -1.26 -5.09 120.40 116.65 1wbq s VAL 33 Ca 0.71 -0.17 -0.29 0.00 0.00 0.00 0.00 61.98 62.22 1wbq s VAL 33 Cb -0.25 -0.88 -0.10 0.00 0.00 0.00 0.00 36.38 35.15 1wbq s VAL 33 CO 0.43 0.33 1.30 -0.89 0.00 0.00 0.00 175.10 176.27 1wbq s THR 34 N 1.72 2.97 -0.24 3.92 2.01 -1.26 -1.23 115.64 123.53 1wbq s THR 34 Ca 0.04 0.88 -0.16 0.00 0.31 0.00 0.00 61.69 62.77 1wbq s THR 34 Cb -0.13 -3.56 -0.11 0.00 0.01 0.00 0.00 72.50 68.71 1wbq s THR 34 CO -0.07 0.17 -0.27 -1.14 -0.69 0.00 0.00 174.62 172.62 1wbq n ARG 35 N 1.68 0.57 -3.65 4.92 0.63 -0.22 -4.66 116.66 115.93 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 0.42 -1.52 -0.07 0.00 0.45 0.00 0.00 32.46 31.74 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 -6.99 -0.91 1.25 6.15 0.15 -1.09 -5.03 113.70 107.23 1wbq s SER 36 Ca -0.34 1.43 0.00 0.00 0.70 0.00 0.00 55.95 57.74 1wbq s SER 36 Cb 0.11 1.47 0.00 0.00 -1.71 0.00 0.00 66.02 65.89 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 4.54 0.00 1.36 5.45 0.00 -1.26 -1.27 120.51 129.33 1wbq n ALA 37 Ca -0.19 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 0.47 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 6.52 1.03 -4.84 0.00 5.75 -1.26 -4.88 116.55 118.87 1wbq n ASP 38 Ca 0.00 -1.00 -0.36 0.00 -0.01 0.00 0.00 54.79 53.42 1wbq n ASP 38 Cb 0.00 0.06 -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 -2.35 6.84 0.15 -1.12 1.04 -0.40 -5.02 113.70 112.84 1wbq s SER 39 Ca 0.29 1.07 0.10 0.00 0.48 0.00 0.00 55.95 57.90 1wbq s SER 39 Cb 0.20 -2.29 -0.04 0.00 0.10 0.00 0.00 66.02 63.99 1wbq s SER 39 CO 0.46 0.15 -0.20 -1.61 0.98 0.00 0.00 173.24 173.02 1wbq s GLU 40 N -1.77 1.68 0.78 4.02 2.02 -1.26 -1.06 118.70 123.10 1wbq s GLU 40 Ca 0.35 -1.30 -0.13 0.00 0.02 0.00 0.00 54.97 53.91 1wbq s GLU 40 Cb -0.16 -2.02 0.06 0.00 0.10 0.00 0.00 34.13 32.12 1wbq s GLU 40 CO 0.19 0.45 1.15 0.71 0.02 0.00 0.00 175.26 177.77 1wbq s TYR 41 N -1.32 2.16 0.15 1.61 2.02 -0.36 -4.71 117.35 116.90 1wbq s TYR 41 Ca 0.19 1.63 -0.34 0.00 -0.37 0.00 0.00 57.07 58.18 1wbq s TYR 41 Cb -0.10 -3.28 -0.14 0.00 -0.40 0.00 0.00 41.96 38.04 1wbq s TYR 41 CO 0.10 -2.30 1.53 -2.30 -1.57 0.00 0.00 175.55 171.01 1wbq n PRO 42 N -3.26 1.97 -1.93 -1.71 -0.02 -1.26 -4.76 135.00 124.03 1wbq n PRO 42 Ca 0.11 0.71 -0.41 0.00 -2.02 0.00 0.00 63.50 61.89 1wbq n PRO 42 Cb 0.52 -2.46 -0.02 0.00 -0.02 0.00 0.00 33.50 31.52 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 0.81 2.90 -0.20 6.00 5.04 -1.26 -5.00 117.35 125.65 1wbq s TYR 43 Ca 0.79 1.00 0.01 0.00 -2.44 0.00 0.00 57.07 56.43 1wbq s TYR 43 Cb -0.73 -3.90 0.05 0.00 0.35 0.00 0.00 41.96 37.73 1wbq s TYR 43 CO 0.40 -2.90 -0.08 0.50 -1.34 0.00 0.00 175.55 172.12 1wbq s ARG 44 N -0.67 1.81 0.46 4.97 6.06 -1.26 -5.12 118.95 125.19 1wbq s ARG 44 Ca 0.59 -0.81 -0.23 0.00 -2.50 0.00 0.00 55.73 52.77 1wbq s ARG 44 Cb -0.44 -2.38 -0.07 0.00 0.06 0.00 0.00 34.95 32.12 1wbq s ARG 44 CO 0.47 -0.47 1.23 -1.14 -2.50 0.00 0.00 175.30 172.89 1wbq s GLN 45 N 1.44 3.71 0.20 5.12 2.00 -1.26 -4.77 119.66 126.10 1wbq s GLN 45 Ca -0.02 1.94 -0.33 0.00 -2.00 0.00 0.00 55.36 54.95 1wbq s GLN 45 Cb -0.17 -2.47 -0.13 0.00 0.80 0.00 0.00 33.01 31.04 1wbq s GLN 45 CO -0.08 -0.64 1.53 -1.71 -0.50 0.00 0.00 175.29 173.90 1wbq n ASN 46 N -0.42 3.10 -0.32 6.67 2.85 -1.26 -4.87 115.26 121.02 1wbq n ASN 46 Ca 0.07 1.11 -0.04 0.00 -0.11 0.00 0.00 54.58 55.60 1wbq n ASN 46 Cb 0.46 -1.45 0.09 0.00 1.24 0.00 0.00 39.78 40.13 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 5.32 1.11 -0.36 1.20 0.02 -1.93 0.71 113.55 119.63 1wbq h SER 47 Ca -0.45 -0.11 -0.10 0.00 -0.84 0.00 0.00 61.79 60.29 1wbq h SER 47 Cb 1.26 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.50 1wbq h SER 47 CO 0.84 0.91 -0.15 0.44 -1.14 0.00 0.00 176.83 177.73 1wbq h ASP 48 N 1.22 0.75 -0.54 3.07 3.32 -1.96 0.87 116.42 123.15 1wbq h ASP 48 Ca 0.30 -0.40 -0.03 0.00 0.02 0.00 0.00 57.03 56.92 1wbq h ASP 48 Cb 0.07 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 1wbq h ASP 48 CO -0.04 0.98 0.21 0.15 -1.72 0.00 0.00 179.24 178.81 1wbq h PHE 49 N 0.52 0.84 -0.49 4.55 3.57 -1.73 -2.85 116.94 121.35 1wbq h PHE 49 Ca 0.08 -0.07 0.02 0.00 3.53 0.00 0.00 57.97 61.53 1wbq h PHE 49 Cb 0.68 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.15 1wbq h PHE 49 CO 0.06 0.69 0.30 2.35 -2.23 0.00 0.00 178.31 179.47 1wbq h TRP 50 N 0.74 0.56 -1.00 0.41 2.91 -0.74 -2.49 115.95 116.34 1wbq h TRP 50 Ca 0.18 0.02 0.21 0.00 1.13 0.00 0.00 58.89 60.43 1wbq h TRP 50 Cb 0.21 -0.18 -0.11 0.00 -0.51 0.00 0.00 29.16 28.57 1wbq h TRP 50 CO 0.01 0.33 0.60 -0.92 -1.03 0.00 0.00 178.44 177.43 1wbq h TYR 51 N 0.60 1.04 0.00 2.65 3.20 -0.59 0.19 116.97 124.06 1wbq h TYR 51 Ca 0.19 0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.10 1wbq h TYR 51 Cb -0.01 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 37.96 1wbq h TYR 51 CO -0.06 0.16 -0.68 1.19 -1.64 0.00 0.00 178.16 177.13 1wbq n PHE 52 N -4.82 0.01 0.00 -3.82 3.72 -1.07 -4.69 117.46 106.78 1wbq n PHE 52 Ca 0.25 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.65 1wbq n PHE 52 Cb 0.64 -0.17 0.00 0.00 -0.94 0.00 0.00 39.48 39.01 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 -1.51 0.00 -1.72 4.37 -2.24 -0.78 -4.81 114.28 107.59 1wbq n THR 53 Ca 0.05 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.68 1wbq n THR 53 Cb 0.34 -0.20 -0.05 0.00 -2.10 0.00 0.00 70.33 68.32 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 2.19 0.94 3.46 3.38 0.00 0.60 -4.97 105.19 110.78 1wbq n GLY 54 Ca 0.00 -0.30 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.62 3.07 -0.49 1.61 5.36 -1.26 -5.02 117.98 118.63 1wbq s PHE 55 Ca 0.00 -0.41 0.03 0.00 -0.96 0.00 0.00 56.93 55.59 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 -0.26 1.80 -1.71 -1.46 0.00 0.00 175.22 173.60 1wbq n ASN 56 N 4.44 5.26 -4.59 6.13 5.15 -1.26 -4.78 115.26 125.61 1wbq n ASN 56 Ca -0.17 -3.73 -0.31 0.00 -0.60 0.00 0.00 54.58 49.77 1wbq n ASN 56 Cb 0.52 -0.80 -0.10 0.00 -0.53 0.00 0.00 39.78 38.86 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 -3.54 2.39 0.97 1.20 2.02 -1.26 -4.93 118.70 115.54 1wbq s GLU 57 Ca 0.57 -0.85 -0.16 0.00 0.02 0.00 0.00 54.97 54.56 1wbq s GLU 57 Cb 0.47 -2.42 0.19 0.00 0.10 0.00 0.00 34.13 32.47 1wbq s GLU 57 CO 0.03 0.56 1.27 -1.25 0.02 0.00 0.00 175.26 175.90 1wbq s PRO 58 N -1.76 0.62 -1.22 0.39 0.04 -1.26 -4.47 135.00 127.33 1wbq s PRO 58 Ca 0.19 -0.28 -0.05 0.00 0.04 0.00 0.00 61.00 60.90 1wbq s PRO 58 Cb -0.11 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 1wbq s PRO 58 CO 0.10 -2.45 0.77 0.39 0.04 0.00 0.00 177.00 175.86 1wbq n GLU 59 N -3.82 -3.80 -3.95 4.56 1.02 -1.26 -4.70 120.64 108.69 1wbq n GLU 59 Ca 0.14 0.64 -0.10 0.00 -0.02 0.00 0.00 57.16 57.82 1wbq n GLU 59 Cb 0.60 -5.11 -0.11 0.00 -0.02 0.00 0.00 31.44 26.80 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 -3.57 0.01 -0.05 0.62 0.00 -1.26 -3.46 121.76 114.05 1wbq s ALA 60 Ca 0.17 -0.43 -0.02 0.00 0.00 0.00 0.00 51.96 51.68 1wbq s ALA 60 Cb -0.04 0.12 0.04 0.00 0.00 0.00 0.00 23.12 23.24 1wbq s ALA 60 CO 0.81 -0.16 0.11 0.08 0.00 0.00 0.00 175.76 176.59 1wbq s VAL 61 N -1.32 -0.12 -0.17 0.00 1.01 0.08 -1.07 120.40 118.81 1wbq s VAL 61 Ca -0.14 0.29 -0.17 0.00 0.00 0.00 0.00 61.98 61.95 1wbq s VAL 61 Cb -0.09 -0.20 -0.04 0.00 0.00 0.00 0.00 36.38 36.06 1wbq s VAL 61 CO -0.00 0.12 0.45 -0.22 0.00 0.00 0.00 175.10 175.45 1wbq s LEU 62 N 1.67 4.20 -0.23 3.92 2.96 0.56 -0.88 118.68 130.88 1wbq s LEU 62 Ca -0.03 0.67 0.02 0.00 -0.22 0.00 0.00 54.13 54.56 1wbq s LEU 62 Cb -0.12 -2.62 0.04 0.00 0.50 0.00 0.00 46.19 43.99 1wbq s LEU 62 CO -0.05 -0.07 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.09 1wbq s VAL 63 N 1.09 2.22 -0.27 1.68 1.01 0.92 -1.15 120.40 125.91 1wbq s VAL 63 Ca 0.23 -1.27 -0.09 0.00 0.00 0.00 0.00 61.98 60.85 1wbq s VAL 63 Cb -0.15 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.07 1wbq s VAL 63 CO 0.09 0.23 0.12 -0.76 0.00 0.00 0.00 175.10 174.78 1wbq s LEU 64 N 1.21 3.74 -0.21 3.92 1.43 -0.42 -0.38 118.68 127.97 1wbq s LEU 64 Ca -0.02 -0.24 -0.05 0.00 -1.03 0.00 0.00 54.13 52.79 1wbq s LEU 64 Cb -0.17 -1.99 -0.02 0.00 0.03 0.00 0.00 46.19 44.05 1wbq s LEU 64 CO -0.08 -0.08 -0.01 -0.63 0.23 0.00 0.00 176.35 175.78 1wbq s ILE 65 N 1.65 3.74 -0.39 -0.59 1.01 0.40 -0.50 121.20 126.52 1wbq s ILE 65 Ca 0.06 -0.38 -0.06 0.00 0.00 0.00 0.00 60.65 60.27 1wbq s ILE 65 Cb -0.16 -2.70 0.08 0.00 0.01 0.00 0.00 42.46 39.69 1wbq s ILE 65 CO 0.06 0.42 0.19 -0.75 0.00 0.00 0.00 174.94 174.86 1wbq s LYS 66 N 1.22 2.41 0.00 2.79 2.20 0.29 -1.02 119.74 127.64 1wbq s LYS 66 Ca 0.03 -1.50 -0.22 0.00 -0.36 0.00 0.00 55.97 53.93 1wbq s LYS 66 Cb -0.15 -3.60 -0.19 0.00 -1.51 0.00 0.00 37.83 32.39 1wbq s LYS 66 CO 0.00 -0.90 1.20 0.77 -0.36 0.00 0.00 175.35 176.06 1wbq h SER 67 N 8.22 0.35 -0.94 1.43 0.02 -1.53 0.20 113.55 121.30 1wbq h SER 67 Ca -0.20 -0.62 0.00 0.00 -0.84 0.00 0.00 61.79 60.13 1wbq h SER 67 Cb 1.07 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.51 1wbq h SER 67 CO 0.69 0.92 0.00 -0.90 -1.14 0.00 0.00 176.83 176.39 1wbq n ASP 68 N -4.48 0.00 0.26 3.07 5.68 -1.05 -2.18 116.55 117.84 1wbq n ASP 68 Ca -0.08 -0.79 0.17 0.00 -0.50 0.00 0.00 54.79 53.60 1wbq n ASP 68 Cb 0.46 0.00 0.76 0.00 -1.14 0.00 0.00 41.12 41.20 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 -1.96 -3.18 116.42 113.73 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 -1.71 0.35 -2.88 0.00 0.00 179.24 175.00 1wbq n THR 70 N -2.86 0.71 -3.75 2.25 -2.24 -1.26 -5.00 114.28 102.12 1wbq n THR 70 Ca -0.00 -0.40 -0.36 0.00 -2.27 0.00 0.00 64.05 61.01 1wbq n THR 70 Cb 0.22 -0.77 -0.11 0.00 -2.10 0.00 0.00 70.33 67.57 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 -2.25 3.22 0.07 4.78 3.76 -1.20 -5.07 115.29 118.60 1wbq s HIS 71 Ca -0.08 0.01 -0.12 0.00 -0.15 0.00 0.00 55.06 54.72 1wbq s HIS 71 Cb 0.03 -2.24 0.01 0.00 1.11 0.00 0.00 32.58 31.49 1wbq s HIS 71 CO 0.40 -0.07 0.28 0.54 -0.85 0.00 0.00 174.74 175.03 1wbq s ASN 72 N 1.20 -0.05 0.25 1.40 2.20 -1.26 -1.50 114.94 117.17 1wbq s ASN 72 Ca 0.06 -0.37 -0.16 0.00 -0.94 0.00 0.00 52.86 51.45 1wbq s ASN 72 Cb -0.14 0.37 0.01 0.00 -2.00 0.00 0.00 41.25 39.48 1wbq s ASN 72 CO 0.05 -0.69 0.56 -1.38 -2.94 0.00 0.00 177.10 172.70 1wbq s HIS 73 N -3.18 0.12 0.00 1.54 -3.43 -0.19 -5.01 115.29 105.16 1wbq s HIS 73 Ca -0.01 -0.51 0.06 0.00 -0.80 0.00 0.00 55.06 53.81 1wbq s HIS 73 Cb 0.01 0.38 -0.02 0.00 -1.43 0.00 0.00 32.58 31.52 1wbq s HIS 73 CO -0.07 -1.06 -0.20 -1.54 -2.00 0.00 0.00 174.74 169.87 1wbq s SER 74 N -2.97 2.37 -0.08 7.38 1.04 -1.26 -0.45 113.70 119.73 1wbq s SER 74 Ca 0.17 -0.41 0.03 0.00 0.48 0.00 0.00 55.95 56.21 1wbq s SER 74 Cb -0.02 -0.24 0.01 0.00 0.10 0.00 0.00 66.02 65.87 1wbq s SER 74 CO 0.07 0.21 -0.15 -0.69 0.98 0.00 0.00 173.24 173.66 1wbq s VAL 75 N -0.58 1.38 -0.17 5.02 1.01 0.49 -2.51 120.40 125.04 1wbq s VAL 75 Ca 0.07 -0.61 -0.05 0.00 0.00 0.00 0.00 61.98 61.39 1wbq s VAL 75 Cb -0.08 -1.24 -0.03 0.00 0.00 0.00 0.00 36.38 35.03 1wbq s VAL 75 CO 0.00 0.41 0.00 -0.22 0.00 0.00 0.00 175.10 175.30 1wbq s LEU 76 N 0.64 3.47 -0.19 3.92 2.96 0.05 -0.05 118.68 129.47 1wbq s LEU 76 Ca -0.14 -0.06 -0.13 0.00 -0.22 0.00 0.00 54.13 53.58 1wbq s LEU 76 Cb -0.16 -1.86 -0.05 0.00 0.50 0.00 0.00 46.19 44.63 1wbq s LEU 76 CO 0.04 0.16 0.26 -0.36 -1.32 0.00 0.00 176.35 175.14 1wbq s PHE 77 N 0.43 3.40 0.21 5.38 0.08 -0.06 0.30 117.98 127.72 1wbq s PHE 77 Ca -0.01 0.48 -0.15 0.00 0.12 0.00 0.00 56.93 57.38 1wbq s PHE 77 Cb -0.14 -2.34 0.01 0.00 -0.57 0.00 0.00 43.02 39.98 1wbq s PHE 77 CO 0.02 0.15 0.47 0.54 -0.10 0.00 0.00 175.22 176.30 1wbq s ASN 78 N 0.71 -0.15 0.27 1.36 4.22 -0.38 -0.74 114.94 120.23 1wbq s ASN 78 Ca 0.14 -0.70 -0.29 0.00 -2.14 0.00 0.00 52.86 49.87 1wbq s ASN 78 Cb -0.13 0.56 -0.10 0.00 1.28 0.00 0.00 41.25 42.86 1wbq s ASN 78 CO 0.04 -1.06 1.32 -0.13 -2.04 0.00 0.00 177.10 175.23 1wbq s ARG 79 N -3.94 4.36 0.63 3.55 0.52 -1.22 -0.76 118.95 122.09 1wbq s ARG 79 Ca 0.15 2.16 -0.16 0.00 -0.52 0.00 0.00 55.73 57.36 1wbq s ARG 79 Cb -0.00 -3.12 -0.01 0.00 0.52 0.00 0.00 34.95 32.33 1wbq s ARG 79 CO 0.02 -0.23 1.12 0.54 0.02 0.00 0.00 175.30 176.77 1wbq s VAL 80 N -0.56 3.19 0.11 3.52 0.11 -1.26 -3.61 120.40 121.89 1wbq s VAL 80 Ca 0.53 0.60 -0.31 0.00 -2.93 0.00 0.00 61.98 59.87 1wbq s VAL 80 Cb -0.39 -3.13 -0.08 0.00 -1.53 0.00 0.00 36.38 31.25 1wbq s VAL 80 CO 0.46 -0.30 1.38 -0.13 -3.33 0.00 0.00 175.10 173.19 1wbq s ARG 81 N -3.88 4.32 -0.04 1.54 0.52 -1.26 -4.81 118.95 115.33 1wbq s ARG 81 Ca 0.69 2.06 -0.02 0.00 -0.52 0.00 0.00 55.73 57.94 1wbq s ARG 81 Cb -0.22 -3.27 0.03 0.00 0.52 0.00 0.00 34.95 32.01 1wbq s ARG 81 CO 0.38 -0.44 0.05 0.34 0.02 0.00 0.00 175.30 175.66 1wbq s ASP 82 N 1.15 1.16 0.09 0.23 -1.08 -1.26 -5.06 116.67 111.90 1wbq s ASP 82 Ca 0.64 0.06 -0.34 0.00 -0.52 0.00 0.00 52.55 52.39 1wbq s ASP 82 Cb -0.36 -0.17 -0.15 0.00 -1.46 0.00 0.00 42.92 40.78 1wbq s ASP 82 CO 0.30 -0.24 1.58 0.25 0.52 0.00 0.00 175.17 177.58 1wbq h LEU 83 N 8.39 -1.24 0.50 -1.34 5.85 -2.00 -2.05 115.31 123.42 1wbq h LEU 83 Ca -0.14 0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1wbq h LEU 83 Cb 1.12 0.42 0.00 0.00 0.37 0.00 0.00 40.66 42.58 1wbq h LEU 83 CO 0.17 -0.59 -0.24 0.74 -0.34 0.00 0.00 178.44 178.18 1wbq h THR 84 N -0.87 0.48 -0.15 1.05 2.02 -2.00 -2.18 112.91 111.26 1wbq h THR 84 Ca -0.04 -0.19 0.04 0.00 0.77 0.00 0.00 66.41 67.00 1wbq h THR 84 Cb 0.78 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 1wbq h THR 84 CO -0.10 0.03 0.18 0.00 0.37 0.00 0.00 175.52 176.00 1wbq h ALA 85 N -0.35 1.72 0.11 6.16 0.00 -1.97 -2.29 119.26 122.64 1wbq h ALA 85 Ca -0.07 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.52 1wbq h ALA 85 Cb 0.57 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1wbq h ALA 85 CO 0.11 -0.25 -1.71 0.93 0.00 0.00 0.00 179.25 178.33 1wbq h GLU 86 N 0.00 0.23 -0.86 0.00 5.08 -1.30 0.13 114.58 117.87 1wbq h GLU 86 Ca 0.07 -0.39 0.22 0.00 -1.00 0.00 0.00 59.36 58.26 1wbq h GLU 86 Cb 0.42 0.14 -0.14 0.00 0.50 0.00 0.00 28.75 29.68 1wbq h GLU 86 CO -0.00 1.19 0.15 0.82 -1.00 0.00 0.00 179.01 180.17 1wbq h ILE 87 N -0.20 0.29 0.00 3.13 2.04 -1.00 0.22 117.51 121.99 1wbq h ILE 87 Ca -0.38 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1wbq h ILE 87 Cb 1.85 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 1wbq h ILE 87 CO 0.04 0.03 0.00 0.79 0.00 0.00 0.00 178.15 179.01 1wbq n TRP 88 N -5.29 0.00 -0.08 1.37 7.02 -0.90 -4.57 117.44 114.99 1wbq n TRP 88 Ca 0.19 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.57 1wbq n TRP 88 Cb 0.63 0.00 0.07 0.00 -2.42 0.00 0.00 31.31 29.59 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 1.30 0.00 -5.99 3.72 0.46 -4.97 117.46 111.51 1wbq n PHE 89 Ca 0.00 -1.20 0.00 0.00 -0.05 0.00 0.00 57.45 56.20 1wbq n PHE 89 Cb 0.00 -0.60 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 -0.08 -2.61 3.75 1.37 0.00 0.06 -4.87 105.19 102.81 1wbq n GLY 90 Ca 0.25 -1.44 -0.37 0.00 0.00 0.00 0.00 46.02 44.46 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 -3.10 3.20 0.00 1.61 0.52 -1.26 -4.36 118.95 115.56 1wbq s ARG 91 Ca 0.00 2.02 0.07 0.00 -0.52 0.00 0.00 55.73 57.30 1wbq s ARG 91 Cb 0.00 -2.18 -0.02 0.00 0.52 0.00 0.00 34.95 33.27 1wbq s ARG 91 CO 0.00 -1.08 -0.21 1.03 0.02 0.00 0.00 175.30 175.07 1wbq s ARG 92 N -2.99 1.59 0.11 3.54 0.52 -1.26 -5.05 118.95 115.41 1wbq s ARG 92 Ca 0.72 -0.81 -0.24 0.00 -0.52 0.00 0.00 55.73 54.89 1wbq s ARG 92 Cb -0.35 -1.59 -0.08 0.00 0.52 0.00 0.00 34.95 33.45 1wbq s ARG 92 CO 0.41 0.43 1.69 1.25 0.02 0.00 0.00 175.30 179.09 1wbq h LEU 93 N 5.38 -0.34 0.00 2.53 5.85 -1.95 -3.46 115.31 123.32 1wbq h LEU 93 Ca -0.40 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.41 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 0.47 -0.17 -0.05 0.61 -0.34 0.00 0.00 178.44 178.95 1wbq n GLY 94 N -1.25 -2.10 0.08 3.75 0.00 -1.24 -4.36 105.19 100.07 1wbq n GLY 94 Ca -0.05 -1.43 -0.11 0.00 0.00 0.00 0.00 46.02 44.42 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 0.09 -0.20 1.61 7.50 -1.90 -3.22 115.11 118.99 1wbq h GLN 95 Ca 0.00 -0.15 -0.09 0.00 0.50 0.00 0.00 58.65 58.91 1wbq h GLN 95 Cb 0.13 0.06 -0.00 0.00 0.05 0.00 0.00 27.48 27.72 1wbq h GLN 95 CO 0.00 0.90 -0.22 -0.44 -1.50 0.00 0.00 178.83 177.58 1wbq h ASP 96 N 0.02 0.53 1.66 1.46 5.19 -1.92 -3.26 116.42 120.11 1wbq h ASP 96 Ca -0.17 -0.49 0.00 0.00 -0.62 0.00 0.00 57.03 55.75 1wbq h ASP 96 Cb 1.93 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 41.29 1wbq h ASP 96 CO 0.13 0.91 -0.20 0.00 -3.12 0.00 0.00 179.24 176.96 1wbq h ALA 97 N 0.64 0.89 -0.24 3.45 0.00 -1.76 -3.40 119.26 118.84 1wbq h ALA 97 Ca 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1wbq h ALA 97 Cb 0.77 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1wbq h ALA 97 CO 0.05 0.00 0.10 0.00 0.00 0.00 0.00 179.25 179.41 1wbq h ALA 98 N 2.14 0.31 -0.57 0.00 0.00 -1.59 -1.37 119.26 118.19 1wbq h ALA 98 Ca 0.00 -0.11 0.11 0.00 0.00 0.00 0.00 54.91 54.92 1wbq h ALA 98 Cb 0.93 -0.09 -0.09 0.00 0.00 0.00 0.00 17.79 18.54 1wbq h ALA 98 CO 0.00 -0.11 0.05 -1.35 0.00 0.00 0.00 179.25 177.85 1wbq h PRO 99 N 0.25 0.17 -0.07 0.00 0.11 -1.75 0.20 132.00 130.90 1wbq h PRO 99 Ca 0.08 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 66.05 1wbq h PRO 99 Cb 0.16 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 31.24 1wbq h PRO 99 CO -0.01 0.11 -0.45 1.49 -0.21 0.00 0.00 178.00 178.93 1wbq h GLU 100 N 0.17 0.43 0.19 1.05 4.22 -1.79 0.29 114.58 119.14 1wbq h GLU 100 Ca 0.29 -0.37 -0.01 0.00 0.08 0.00 0.00 59.36 59.35 1wbq h GLU 100 Cb 0.45 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1wbq h GLU 100 CO -0.44 1.01 -0.09 -0.22 -2.18 0.00 0.00 179.01 177.09 1wbq h LYS 101 N -0.03 -0.25 -0.15 1.92 1.63 -0.90 -3.27 116.57 115.52 1wbq h LYS 101 Ca -0.04 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1wbq h LYS 101 Cb 1.12 0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.80 1wbq h LYS 101 CO 0.09 -0.10 0.00 1.28 -3.45 0.00 0.00 179.45 177.27 1wbq n LEU 102 N -5.17 3.02 -3.10 5.20 4.77 0.68 -4.99 117.00 117.41 1wbq n LEU 102 Ca -0.09 -1.19 -0.20 0.00 -0.03 0.00 0.00 56.01 54.50 1wbq n LEU 102 Cb 0.15 -0.09 0.07 0.00 -2.33 0.00 0.00 43.42 41.23 1wbq n LEU 102 CO 0.34 0.57 0.20 0.61 -1.33 0.00 0.00 177.39 177.78 1wbq n GLY 103 N 1.28 -0.30 3.70 -0.72 0.00 0.03 -4.99 105.19 104.20 1wbq n GLY 103 Ca 0.15 0.10 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 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 -3.27 4.04 0.14 1.61 -7.23 -0.84 -5.01 120.40 109.84 1wbq s VAL 104 Ca 0.44 -1.07 0.14 0.00 -1.81 0.00 0.00 61.98 59.68 1wbq s VAL 104 Cb -0.19 -2.96 0.02 0.00 0.56 0.00 0.00 36.38 33.80 1wbq s VAL 104 CO 0.61 0.05 1.58 0.44 -0.31 0.00 0.00 175.10 177.47 1wbq h ASP 105 N 3.18 0.00 -4.09 4.85 3.32 -1.81 -3.38 116.42 118.49 1wbq h ASP 105 Ca -0.47 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.46 1wbq h ASP 105 Cb 1.18 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.49 1wbq h ASP 105 CO 0.60 0.57 -0.19 -0.60 -1.72 0.00 0.00 179.24 177.90 1wbq s ARG 106 N -3.36 0.56 -0.05 3.56 3.52 -1.04 -4.99 118.95 117.15 1wbq s ARG 106 Ca 0.00 0.49 0.02 0.00 -0.13 0.00 0.00 55.73 56.11 1wbq s ARG 106 Cb 0.11 0.27 0.01 0.00 -1.56 0.00 0.00 34.95 33.78 1wbq s ARG 106 CO 0.74 -0.09 -0.09 0.00 -0.81 0.00 0.00 175.30 175.05 1wbq s ALA 107 N -0.04 0.99 0.17 6.12 0.00 -1.26 -0.77 121.76 126.97 1wbq s ALA 107 Ca -0.02 -0.27 0.08 0.00 0.00 0.00 0.00 51.96 51.75 1wbq s ALA 107 Cb -0.03 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.57 1wbq s ALA 107 CO 0.02 0.08 -0.17 -0.51 0.00 0.00 0.00 175.76 175.17 1wbq s LEU 108 N 0.67 2.46 0.21 0.00 1.43 0.15 -4.89 118.68 118.69 1wbq s LEU 108 Ca -0.12 -0.89 -0.30 0.00 -1.03 0.00 0.00 54.13 51.79 1wbq s LEU 108 Cb -0.14 -0.80 -0.09 0.00 0.03 0.00 0.00 46.19 45.19 1wbq s LEU 108 CO 0.02 -0.06 1.31 0.00 0.23 0.00 0.00 176.35 177.85 1wbq s ALA 109 N -2.21 3.52 0.43 4.21 0.00 -1.26 -1.25 121.76 125.21 1wbq s ALA 109 Ca 0.17 1.11 0.10 0.00 0.00 0.00 0.00 51.96 53.34 1wbq s ALA 109 Cb -0.05 -3.48 0.95 0.00 0.00 0.00 0.00 23.12 20.54 1wbq s ALA 109 CO 0.07 -0.54 2.06 0.35 0.00 0.00 0.00 175.76 177.70 1wbq h PHE 110 N 5.27 0.35 -0.00 0.00 3.57 -1.25 -1.02 116.94 123.86 1wbq h PHE 110 Ca -0.45 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.05 1wbq h PHE 110 Cb 1.21 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.84 1wbq h PHE 110 CO 0.62 0.25 0.08 0.66 -2.23 0.00 0.00 178.31 177.69 1wbq h SER 111 N 0.37 0.00 -0.55 0.41 4.64 -1.91 -1.99 113.55 114.51 1wbq h SER 111 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1wbq h SER 111 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1wbq h SER 111 CO -0.02 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.32 1wbq n GLU 112 N -3.04 2.60 -0.28 4.77 -0.58 -0.39 -4.69 120.64 119.03 1wbq n GLU 112 Ca -0.03 -2.45 -0.03 0.00 -0.42 0.00 0.00 57.16 54.23 1wbq n GLU 112 Cb 0.15 -1.54 0.13 0.00 -0.57 0.00 0.00 31.44 29.60 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 4.38 1.24 0.00 -3.67 2.10 -1.44 -1.06 117.51 119.07 1wbq h ILE 113 Ca 0.00 -0.65 -0.04 0.00 1.08 0.00 0.00 64.86 65.26 1wbq h ILE 113 Cb 0.98 0.17 -0.01 0.00 -1.09 0.00 0.00 36.82 36.88 1wbq h ILE 113 CO 0.00 0.28 -0.18 0.78 -1.08 0.00 0.00 178.15 177.96 1wbq h ASN 114 N 1.15 0.00 1.15 2.19 2.35 -1.83 0.31 115.58 120.89 1wbq h ASN 114 Ca 0.28 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 1wbq h ASN 114 Cb 0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1wbq h ASN 114 CO -0.04 0.18 -0.46 1.56 -1.65 0.00 0.00 177.43 177.01 1wbq h GLN 115 N 0.00 0.00 0.00 0.81 7.50 -1.62 -3.41 115.11 118.39 1wbq h GLN 115 Ca -0.00 0.00 -0.07 0.00 0.50 0.00 0.00 58.65 59.08 1wbq h GLN 115 Cb 0.69 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.21 1wbq h GLN 115 CO 0.02 0.00 -1.25 1.04 -1.50 0.00 0.00 178.83 177.14 1wbq n GLN 116 N -2.33 1.39 -0.15 1.46 1.13 -0.50 -4.73 117.38 113.64 1wbq n GLN 116 Ca 0.03 0.02 -0.06 0.00 -1.94 0.00 0.00 57.00 55.05 1wbq n GLN 116 Cb 0.46 -1.09 0.03 0.00 0.11 0.00 0.00 30.24 29.76 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 0.40 -1.68 1.08 5.85 -0.63 -1.94 115.31 118.40 1wbq h LEU 117 Ca -0.10 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1wbq h LEU 117 Cb 1.18 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 1wbq h LEU 117 CO -0.01 0.28 0.14 0.10 -0.34 0.00 0.00 178.44 178.61 1wbq h TYR 118 N 0.51 0.34 -0.32 1.25 -0.00 -1.82 -1.29 116.97 115.65 1wbq h TYR 118 Ca 0.20 0.00 -0.11 0.00 -0.00 0.00 0.00 58.73 58.82 1wbq h TYR 118 Cb 0.06 -0.11 -0.01 0.00 -0.00 0.00 0.00 36.73 36.67 1wbq h TYR 118 CO -0.08 0.25 -0.25 1.96 -0.00 0.00 0.00 178.16 180.03 1wbq h GLN 119 N 0.36 0.63 -0.06 0.10 4.20 -1.65 0.72 115.11 119.41 1wbq h GLN 119 Ca 0.09 -0.25 -0.10 0.00 0.06 0.00 0.00 58.65 58.45 1wbq h GLN 119 Cb 0.02 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 1wbq h GLN 119 CO -0.02 0.82 -0.44 -0.07 -0.67 0.00 0.00 178.83 178.45 1wbq h LEU 120 N 0.55 0.14 0.00 1.46 3.38 -0.90 -3.23 115.31 116.71 1wbq h LEU 120 Ca 0.08 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1wbq h LEU 120 Cb 0.72 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1wbq h LEU 120 CO 0.06 0.57 -0.85 -0.07 0.09 0.00 0.00 178.44 178.24 1wbq h LEU 121 N 0.11 0.00 -9.26 1.67 3.38 -0.94 -3.46 115.31 106.81 1wbq h LEU 121 Ca 0.01 -0.09 -0.67 0.00 0.09 0.00 0.00 57.88 57.21 1wbq h LEU 121 Cb 0.83 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.62 1wbq h LEU 121 CO 0.06 0.04 0.77 -3.20 0.09 0.00 0.00 178.44 176.21 1wbq n ASN 122 N -2.48 2.43 0.00 -0.43 5.15 0.21 -1.90 115.26 118.24 1wbq n ASN 122 Ca 0.01 1.07 0.00 0.00 -0.60 0.00 0.00 54.58 55.07 1wbq n ASN 122 Cb 0.51 -1.24 0.00 0.00 -0.53 0.00 0.00 39.78 38.52 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 3.57 1.75 3.85 8.20 0.00 -0.75 -4.95 105.19 116.86 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 3.31 -0.09 0.99 1.43 -0.80 -4.98 118.68 118.55 1wbq s LEU 124 Ca 0.00 1.52 0.05 0.00 -1.03 0.00 0.00 54.13 54.67 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 -0.95 0.49 0.47 0.23 0.00 0.00 176.35 176.59 1wbq n ASP 125 N -2.53 1.34 -3.97 2.29 8.00 0.14 -3.20 116.55 118.62 1wbq n ASP 125 Ca 0.07 0.30 -0.17 0.00 0.71 0.00 0.00 54.79 55.69 1wbq n ASP 125 Cb 0.54 -0.33 -0.15 0.00 -0.02 0.00 0.00 41.12 41.17 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 -2.57 0.51 -0.10 2.53 1.01 -1.07 -3.09 120.40 117.62 1wbq s VAL 126 Ca -0.13 -0.25 0.04 0.00 0.00 0.00 0.00 61.98 61.64 1wbq s VAL 126 Cb 0.07 -0.45 -0.00 0.00 0.00 0.00 0.00 36.38 36.00 1wbq s VAL 126 CO 0.80 0.16 -0.22 0.54 0.00 0.00 0.00 175.10 176.37 1wbq s VAL 127 N 0.00 2.21 -0.24 2.92 0.11 -0.29 -2.02 120.40 123.09 1wbq s VAL 127 Ca 0.00 -0.97 -0.14 0.00 -2.93 0.00 0.00 61.98 57.94 1wbq s VAL 127 Cb -0.04 -1.85 -0.04 0.00 -1.53 0.00 0.00 36.38 32.92 1wbq s VAL 127 CO -0.00 0.56 0.33 -0.31 -3.33 0.00 0.00 175.10 172.35 1wbq s TYR 128 N 0.27 3.30 -0.17 1.54 1.51 0.13 -0.96 117.35 122.97 1wbq s TYR 128 Ca -0.16 0.42 -0.10 0.00 -1.01 0.00 0.00 57.07 56.23 1wbq s TYR 128 Cb -0.17 -2.49 0.06 0.00 -0.11 0.00 0.00 41.96 39.24 1wbq s TYR 128 CO 0.08 -0.10 0.40 -1.58 -1.11 0.00 0.00 175.55 173.24 1wbq s HIS 129 N 1.63 -0.57 -1.31 2.71 2.46 0.10 -0.97 115.29 119.35 1wbq s HIS 129 Ca 0.14 1.24 -0.15 0.00 0.47 0.00 0.00 55.06 56.76 1wbq s HIS 129 Cb -0.15 0.24 0.10 0.00 -0.13 0.00 0.00 32.58 32.64 1wbq s HIS 129 CO 0.08 -0.32 1.78 0.00 -2.47 0.00 0.00 174.74 173.81 1wbq n ALA 130 N 4.06 4.18 -1.85 1.58 0.00 -1.26 -3.85 120.51 123.37 1wbq n ALA 130 Ca -0.22 -3.99 -0.42 0.00 0.00 0.00 0.00 53.44 48.81 1wbq n ALA 130 Cb 0.55 -3.41 -0.03 0.00 0.00 0.00 0.00 19.45 16.56 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 3.07 4.19 0.00 0.00 0.74 -1.26 -2.33 119.66 124.07 1wbq s GLN 131 Ca 0.49 2.44 0.00 0.00 0.05 0.00 0.00 55.36 58.34 1wbq s GLN 131 Cb 0.05 -3.11 0.00 0.00 1.10 0.00 0.00 33.01 31.05 1wbq s GLN 131 CO 0.02 -0.63 0.00 0.41 -0.55 0.00 0.00 175.29 174.55 1wbq n GLY 132 N 3.45 0.87 0.15 2.59 0.00 -1.26 -4.95 105.19 106.05 1wbq n GLY 132 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.01 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 3.54 -0.27 -4.28 1.61 4.57 -1.90 -3.44 114.58 114.41 1wbq h GLU 133 Ca 0.00 0.02 -0.37 0.00 -1.18 0.00 0.00 59.36 57.83 1wbq h GLU 133 Cb 0.00 0.06 -0.31 0.00 -0.16 0.00 0.00 28.75 28.34 1wbq h GLU 133 CO 0.00 -0.01 -0.77 0.71 -1.18 0.00 0.00 179.01 177.77 1wbq s TYR 134 N -5.16 0.65 0.24 0.92 2.02 -1.26 -5.05 117.35 109.70 1wbq s TYR 134 Ca -0.15 -0.14 -0.05 0.00 -0.37 0.00 0.00 57.07 56.36 1wbq s TYR 134 Cb 0.03 -0.49 0.25 0.00 -0.40 0.00 0.00 41.96 41.35 1wbq s TYR 134 CO 0.61 -0.08 1.78 0.00 -1.57 0.00 0.00 175.55 176.29 1wbq h ALA 135 N 6.46 1.08 -0.24 3.71 0.00 -1.99 -2.21 119.26 126.07 1wbq h ALA 135 Ca -0.33 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.29 1wbq h ALA 135 Cb 1.17 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1wbq h ALA 135 CO 0.49 0.62 -0.16 0.10 0.00 0.00 0.00 179.25 180.29 1wbq h TYR 136 N 0.98 0.45 -0.23 0.00 -0.00 -2.00 -1.91 116.97 114.27 1wbq h TYR 136 Ca 0.21 -0.07 -0.14 0.00 -0.00 0.00 0.00 58.73 58.73 1wbq h TYR 136 Cb 0.31 -0.12 0.00 0.00 -0.00 0.00 0.00 36.73 36.92 1wbq h TYR 136 CO 0.02 0.57 -0.41 0.00 -0.00 0.00 0.00 178.16 178.34 1wbq h ALA 137 N 1.45 0.36 -0.76 0.10 0.00 -1.91 -2.74 119.26 115.76 1wbq h ALA 137 Ca 0.07 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1wbq h ALA 137 Cb 0.51 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1wbq h ALA 137 CO 0.03 0.46 0.49 -0.44 0.00 0.00 0.00 179.25 179.80 1wbq h ASP 138 N 0.39 0.89 -0.07 0.00 3.32 -1.23 -1.34 116.42 118.38 1wbq h ASP 138 Ca 0.01 -0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.05 1wbq h ASP 138 Cb 1.01 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.31 1wbq h ASP 138 CO 0.09 0.66 -0.04 0.58 -1.72 0.00 0.00 179.24 178.81 1wbq h VAL 139 N 1.04 0.86 -0.40 -1.35 2.07 -1.32 0.44 116.25 117.60 1wbq h VAL 139 Ca 0.28 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.80 1wbq h VAL 139 Cb -0.09 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1wbq h VAL 139 CO -0.06 0.00 0.26 0.40 0.02 0.00 0.00 177.57 178.19 1wbq h ILE 140 N -0.04 1.09 -0.20 4.57 2.04 -1.26 -1.03 117.51 122.67 1wbq h ILE 140 Ca 0.04 -0.18 -0.05 0.00 1.00 0.00 0.00 64.86 65.68 1wbq h ILE 140 Cb 0.11 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1wbq h ILE 140 CO -0.10 0.10 -0.06 0.58 0.00 0.00 0.00 178.15 178.66 1wbq h VAL 141 N 0.52 1.29 -0.47 1.67 2.07 -1.09 -2.21 116.25 118.04 1wbq h VAL 141 Ca 0.15 -1.07 -0.04 0.00 0.82 0.00 0.00 66.70 66.56 1wbq h VAL 141 Cb -0.05 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1wbq h VAL 141 CO -0.04 0.32 0.14 0.78 0.02 0.00 0.00 177.57 178.80 1wbq h ASN 142 N 0.11 0.64 -0.25 0.57 2.35 -0.84 -1.45 115.58 116.71 1wbq h ASN 142 Ca 0.05 -0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 55.68 1wbq h ASN 142 Cb 0.52 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 1wbq h ASN 142 CO 0.02 0.61 0.04 0.28 -1.65 0.00 0.00 177.43 176.74 1wbq h SER 143 N 0.68 0.40 -0.19 5.81 0.02 -1.10 -0.91 113.55 118.27 1wbq h SER 143 Ca 0.16 -0.25 0.04 0.00 -0.84 0.00 0.00 61.79 60.90 1wbq h SER 143 Cb 0.21 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.60 1wbq h SER 143 CO -0.01 0.55 -0.07 0.00 -1.14 0.00 0.00 176.83 176.16 1wbq h ALA 144 N 0.86 0.09 -0.61 3.77 0.00 -1.05 -0.96 119.26 121.37 1wbq h ALA 144 Ca 0.08 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 1wbq h ALA 144 Cb 0.32 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1wbq h ALA 144 CO 0.00 -0.50 0.07 -0.07 0.00 0.00 0.00 179.25 178.75 1wbq h LEU 145 N -0.04 0.97 -0.27 0.00 3.38 -1.21 -2.11 115.31 116.02 1wbq h LEU 145 Ca 0.10 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1wbq h LEU 145 Cb 0.19 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1wbq h LEU 145 CO -0.22 0.98 0.15 -0.08 0.09 0.00 0.00 178.44 179.36 1wbq h GLU 146 N 0.94 0.38 -0.78 1.13 4.81 -0.94 0.03 114.58 120.15 1wbq h GLU 146 Ca 0.18 -0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.46 1wbq h GLU 146 Cb 0.45 -0.07 -0.07 0.00 0.63 0.00 0.00 28.75 29.68 1wbq h GLU 146 CO 0.02 0.33 0.43 0.87 -0.73 0.00 0.00 179.01 179.93 1wbq h LYS 147 N 0.32 0.70 -0.11 1.92 1.57 -0.91 -1.11 116.57 118.95 1wbq h LYS 147 Ca 0.10 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 1wbq h LYS 147 Cb 0.07 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.22 1wbq h LYS 147 CO -0.02 0.46 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.22 1wbq h LEU 148 N 0.72 0.22 -0.41 2.94 3.38 -1.09 -1.89 115.31 119.17 1wbq h LEU 148 Ca 0.38 -0.38 0.05 0.00 0.09 0.00 0.00 57.88 58.01 1wbq h LEU 148 Cb 0.36 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 1wbq h LEU 148 CO -0.25 0.55 0.15 0.03 0.09 0.00 0.00 178.44 179.01 1wbq h ARG 149 N -0.11 0.30 -0.02 1.13 3.08 -0.73 -2.53 114.38 115.49 1wbq h ARG 149 Ca 0.03 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1wbq h ARG 149 Cb 0.46 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1wbq h ARG 149 CO 0.01 0.20 0.00 1.63 -1.07 0.00 0.00 179.97 180.74 1wbq n LYS 150 N -5.01 1.24 -1.09 0.04 5.02 -0.44 -4.24 118.16 113.68 1wbq n LYS 150 Ca 0.03 -0.36 -0.17 0.00 -2.02 0.00 0.00 58.31 55.79 1wbq n LYS 150 Cb 0.15 -1.45 0.18 0.00 -0.02 0.00 0.00 35.03 33.89 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 1.02 4.72 0.26 0.72 0.00 -0.71 -4.66 105.19 106.54 1wbq n GLY 151 Ca 0.20 -1.20 0.02 0.00 0.00 0.00 0.00 46.02 45.05 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 1.04 0.34 0.46 1.61 4.64 -1.74 -0.35 113.55 119.56 1wbq h SER 152 Ca 0.48 -0.05 -0.03 0.00 -0.47 0.00 0.00 61.79 61.72 1wbq h SER 152 Cb 2.35 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 64.35 1wbq h SER 152 CO 0.86 0.41 -0.13 0.03 -0.87 0.00 0.00 176.83 177.13 1wbq h ARG 153 N 0.36 0.00 -0.63 4.77 3.08 -1.90 -1.22 114.38 118.84 1wbq h ARG 153 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1wbq h ARG 153 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1wbq h ARG 153 CO 0.01 0.13 0.00 1.04 -1.07 0.00 0.00 179.97 180.08 1wbq n GLN 154 N -3.57 3.04 -2.99 0.04 3.00 -0.29 -4.94 117.38 111.67 1wbq n GLN 154 Ca -0.01 -2.36 -0.21 0.00 -0.01 0.00 0.00 57.00 54.40 1wbq n GLN 154 Cb 0.27 -1.70 0.04 0.00 0.00 0.00 0.00 30.24 28.84 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 -5.87 -4.90 1.08 3.02 -0.46 -5.01 115.26 104.18 1wbq n ASN 155 Ca 0.22 -0.28 -0.33 0.00 -0.03 0.00 0.00 54.58 54.16 1wbq n ASN 155 Cb 0.69 -4.68 -0.05 0.00 -0.61 0.00 0.00 39.78 35.14 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 -6.29 4.35 0.01 3.41 1.43 -0.34 -4.99 118.68 116.26 1wbq s LEU 156 Ca 0.30 0.46 0.00 0.00 -1.03 0.00 0.00 54.13 53.86 1wbq s LEU 156 Cb -0.13 -2.81 -0.01 0.00 0.03 0.00 0.00 46.19 43.27 1wbq s LEU 156 CO 0.37 0.21 -0.02 0.42 0.23 0.00 0.00 176.35 177.55 1wbq s THR 157 N -1.40 0.12 0.06 5.49 -4.23 -1.26 -3.91 115.64 110.51 1wbq s THR 157 Ca 0.31 -0.31 -0.13 0.00 -1.18 0.00 0.00 61.69 60.38 1wbq s THR 157 Cb -0.13 -0.16 -0.06 0.00 1.34 0.00 0.00 72.50 73.50 1wbq s THR 157 CO 0.20 -0.12 0.43 0.00 -0.54 0.00 0.00 174.62 174.59 1wbq s ALA 158 N -0.44 3.69 0.17 3.99 0.00 -1.26 -1.80 121.76 126.11 1wbq s ALA 158 Ca -0.04 -0.27 -0.32 0.00 0.00 0.00 0.00 51.96 51.34 1wbq s ALA 158 Cb -0.03 -2.36 -0.10 0.00 0.00 0.00 0.00 23.12 20.62 1wbq s ALA 158 CO -0.00 0.51 1.57 -1.25 0.00 0.00 0.00 175.76 176.59 1wbq s PRO 159 N -1.58 4.21 0.18 0.00 0.04 -1.20 -4.89 135.00 131.77 1wbq s PRO 159 Ca 0.30 2.37 0.25 0.00 0.04 0.00 0.00 61.00 63.97 1wbq s PRO 159 Cb -0.15 -3.15 0.65 0.00 0.04 0.00 0.00 34.50 31.88 1wbq s PRO 159 CO 0.16 -0.61 1.62 0.00 0.04 0.00 0.00 177.00 178.22 1wbq n ALA 160 N 3.94 2.49 -3.29 8.56 0.00 -1.22 -4.78 120.51 126.22 1wbq n ALA 160 Ca 0.14 -0.10 -0.34 0.00 0.00 0.00 0.00 53.44 53.14 1wbq n ALA 160 Cb 0.38 -1.37 -0.14 0.00 0.00 0.00 0.00 19.45 18.33 1wbq n ALA 160 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1wbq s THR 161 N -3.12 3.37 -0.14 0.00 2.01 -1.18 -5.08 115.64 111.51 1wbq s THR 161 Ca 0.09 -0.52 0.01 0.00 0.31 0.00 0.00 61.69 61.59 1wbq s THR 161 Cb 0.13 -2.49 -0.00 0.00 0.01 0.00 0.00 72.50 70.14 1wbq s THR 161 CO 0.64 0.46 -0.17 -0.32 -0.69 0.00 0.00 174.62 174.54 1wbq s MET 162 N 0.97 3.21 -0.07 4.92 1.75 -1.26 -1.14 119.30 127.67 1wbq s MET 162 Ca -0.01 -0.77 0.05 0.00 -1.25 0.00 0.00 55.69 53.72 1wbq s MET 162 Cb -0.15 -2.55 -0.01 0.00 2.84 0.00 0.00 34.83 34.97 1wbq s MET 162 CO 0.00 0.09 -0.23 0.42 -0.65 0.00 0.00 175.02 174.65 1wbq s ILE 163 N 0.62 1.95 -0.31 10.11 1.01 -0.14 -4.98 121.20 129.47 1wbq s ILE 163 Ca -0.09 -0.99 -0.29 0.00 0.00 0.00 0.00 60.65 59.27 1wbq s ILE 163 Cb -0.16 -1.67 -0.00 0.00 0.01 0.00 0.00 42.46 40.64 1wbq s ILE 163 CO 0.03 0.54 1.39 -0.62 0.00 0.00 0.00 174.94 176.28 1wbq s ASP 164 N 0.04 6.53 0.00 3.58 2.15 -1.25 -0.72 116.67 127.00 1wbq s ASP 164 Ca -0.09 1.22 0.24 0.00 0.43 0.00 0.00 52.55 54.35 1wbq s ASP 164 Cb -0.15 -2.54 1.05 0.00 -0.30 0.00 0.00 42.92 40.98 1wbq s ASP 164 CO 0.05 -1.20 1.78 -2.67 -0.17 0.00 0.00 175.17 172.97 1wbq n TRP 165 N 8.07 0.00 -0.03 -5.34 4.27 -1.26 -4.26 117.44 118.88 1wbq n TRP 165 Ca 0.16 0.00 -0.09 0.00 -3.89 0.00 0.00 57.50 53.68 1wbq n TRP 165 Cb 0.47 -0.49 -0.03 0.00 -1.36 0.00 0.00 31.31 29.89 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 0.02 -0.73 -2.67 3.08 -1.91 -0.52 114.38 111.64 1wbq h ARG 166 Ca 0.00 -0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.18 1wbq h ARG 166 Cb 0.41 -0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.37 1wbq h ARG 166 CO 0.00 0.01 0.31 -1.35 -1.07 0.00 0.00 179.97 177.87 1wbq h PRO 167 N 0.02 0.46 -0.01 0.04 0.11 -1.99 0.35 132.00 130.98 1wbq h PRO 167 Ca 0.09 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.17 1wbq h PRO 167 Cb 0.13 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.14 1wbq h PRO 167 CO -0.18 0.30 0.00 0.28 -0.21 0.00 0.00 178.00 178.20 1wbq h VAL 168 N 0.47 1.14 -0.41 3.15 2.07 -1.70 -2.03 116.25 118.94 1wbq h VAL 168 Ca 0.39 -0.42 -0.12 0.00 0.82 0.00 0.00 66.70 67.37 1wbq h VAL 168 Cb 0.55 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1wbq h VAL 168 CO -0.37 0.11 -0.23 0.58 0.02 0.00 0.00 177.57 177.68 1wbq h VAL 169 N -0.17 1.27 -0.04 2.57 2.07 -0.78 -1.80 116.25 119.38 1wbq h VAL 169 Ca 0.00 -1.36 -0.14 0.00 0.82 0.00 0.00 66.70 66.03 1wbq h VAL 169 Cb 0.18 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1wbq h VAL 169 CO -0.00 0.46 -0.59 0.45 0.02 0.00 0.00 177.57 177.90 1wbq h HIS 170 N 0.72 0.17 -0.42 1.57 3.86 -0.32 -0.23 115.15 120.49 1wbq h HIS 170 Ca 0.10 -0.06 -0.07 0.00 -1.16 0.00 0.00 60.37 59.17 1wbq h HIS 170 Cb 0.76 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 29.18 1wbq h HIS 170 CO 0.04 0.69 -0.04 1.49 0.86 0.00 0.00 177.93 180.98 1wbq h GLU 171 N 0.10 0.71 0.12 2.45 4.57 -1.17 -1.67 114.58 119.68 1wbq h GLU 171 Ca -0.01 -0.19 -0.01 0.00 -1.18 0.00 0.00 59.36 57.97 1wbq h GLU 171 Cb 1.07 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.59 1wbq h GLU 171 CO 0.09 0.75 -0.06 0.52 -1.18 0.00 0.00 179.01 179.12 1wbq h MET 172 N 0.66 -0.16 -0.03 1.92 2.86 -0.67 -3.16 114.93 116.34 1wbq h MET 172 Ca 0.13 0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.79 1wbq h MET 172 Cb 0.46 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.16 1wbq h MET 172 CO 0.02 0.03 0.03 0.00 1.06 0.00 0.00 176.91 178.06 1wbq h ARG 173 N -0.33 0.00 0.00 1.72 3.08 -0.90 -2.28 114.38 115.67 1wbq h ARG 173 Ca -0.02 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.00 1wbq h ARG 173 Cb 0.27 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1wbq h ARG 173 CO 0.03 0.00 -0.17 1.25 -1.07 0.00 0.00 179.97 180.01 1wbq h LEU 174 N 0.00 0.00 -8.32 3.04 5.85 -1.27 -3.39 115.31 111.22 1wbq h LEU 174 Ca 0.02 0.00 -0.69 0.00 0.84 0.00 0.00 57.88 58.05 1wbq h LEU 174 Cb 0.08 0.00 -0.27 0.00 0.37 0.00 0.00 40.66 40.84 1wbq h LEU 174 CO -0.00 0.17 -0.59 -0.36 -0.34 0.00 0.00 178.44 177.32 1wbq s PHE 175 N -4.54 3.21 0.20 1.25 0.40 -0.86 -4.08 117.98 113.56 1wbq s PHE 175 Ca -0.04 -1.12 -0.28 0.00 -0.60 0.00 0.00 56.93 54.89 1wbq s PHE 175 Cb 0.15 -2.30 -0.08 0.00 0.51 0.00 0.00 43.02 41.30 1wbq s PHE 175 CO 0.67 -0.64 0.86 0.15 0.70 0.00 0.00 175.22 176.96 1wbq s LYS 176 N 1.48 4.71 0.83 0.44 3.01 -0.14 -4.97 119.74 125.11 1wbq s LYS 176 Ca 0.01 1.33 -0.12 0.00 -1.01 0.00 0.00 55.97 56.18 1wbq s LYS 176 Cb -0.18 -3.28 0.09 0.00 -1.01 0.00 0.00 37.83 33.45 1wbq s LYS 176 CO 0.04 0.53 1.15 -1.54 0.51 0.00 0.00 175.35 176.03 1wbq s SER 177 N -1.09 4.26 0.23 2.83 1.04 -1.26 -4.78 113.70 114.92 1wbq s SER 177 Ca 0.39 0.95 -0.07 0.00 0.48 0.00 0.00 55.95 57.69 1wbq s SER 177 Cb -0.24 -1.53 0.29 0.00 0.10 0.00 0.00 66.02 64.63 1wbq s SER 177 CO 0.29 -2.08 1.83 -0.65 0.98 0.00 0.00 173.24 173.61 1wbq h PRO 178 N -1.17 0.81 -0.93 4.02 0.11 -1.99 -1.40 132.00 131.45 1wbq h PRO 178 Ca -0.48 -0.05 0.05 0.00 0.11 0.00 0.00 66.00 65.63 1wbq h PRO 178 Cb 1.31 -0.18 -0.06 0.00 0.11 0.00 0.00 31.00 32.18 1wbq h PRO 178 CO 0.64 0.53 0.60 0.93 -0.21 0.00 0.00 178.00 180.49 1wbq h GLU 179 N 0.83 1.10 -0.34 1.05 5.08 -1.95 -0.94 114.58 119.41 1wbq h GLU 179 Ca 0.34 -0.07 -0.15 0.00 -1.00 0.00 0.00 59.36 58.48 1wbq h GLU 179 Cb 0.18 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1wbq h GLU 179 CO -0.18 0.73 -0.40 0.93 -1.00 0.00 0.00 179.01 179.09 1wbq h GLU 180 N 1.13 0.82 -0.76 2.33 5.08 -1.82 -2.15 114.58 119.21 1wbq h GLU 180 Ca 0.39 -0.43 -0.05 0.00 -1.00 0.00 0.00 59.36 58.26 1wbq h GLU 180 Cb 0.07 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 1wbq h GLU 180 CO -0.14 1.07 0.26 0.82 -1.00 0.00 0.00 179.01 180.02 1wbq h ILE 181 N 0.67 1.26 -0.71 3.13 2.04 -0.88 -0.21 117.51 122.82 1wbq h ILE 181 Ca 0.05 -0.88 -0.05 0.00 1.00 0.00 0.00 64.86 64.98 1wbq h ILE 181 Cb 0.97 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 1wbq h ILE 181 CO 0.09 0.35 0.24 0.00 0.00 0.00 0.00 178.15 178.83 1wbq h ALA 182 N 1.14 1.08 -0.37 1.87 0.00 -1.04 0.25 119.26 122.18 1wbq h ALA 182 Ca 0.25 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1wbq h ALA 182 Cb 0.28 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1wbq h ALA 182 CO -0.01 0.63 -0.02 0.28 0.00 0.00 0.00 179.25 180.13 1wbq h VAL 183 N 1.05 1.26 -0.22 0.00 2.07 -1.04 -2.16 116.25 117.21 1wbq h VAL 183 Ca 0.23 -1.03 -0.08 0.00 0.82 0.00 0.00 66.70 66.64 1wbq h VAL 183 Cb 0.27 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1wbq h VAL 183 CO -0.01 0.34 -0.20 -0.07 0.02 0.00 0.00 177.57 177.66 1wbq h LEU 184 N 0.49 0.37 -0.53 2.57 3.38 -0.77 -0.58 115.31 120.25 1wbq h LEU 184 Ca 0.10 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1wbq h LEU 184 Cb 0.50 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1wbq h LEU 184 CO 0.02 0.59 0.32 -0.09 0.09 0.00 0.00 178.44 179.37 1wbq h ARG 185 N 0.35 0.62 -0.35 1.13 2.43 -0.31 0.25 114.38 118.51 1wbq h ARG 185 Ca 0.06 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 59.04 1wbq h ARG 185 Cb 0.55 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 1wbq h ARG 185 CO 0.04 0.41 -0.37 -0.09 -1.51 0.00 0.00 179.97 178.45 1wbq h ARG 186 N 0.64 0.82 -0.88 0.20 9.65 -0.90 -1.98 114.38 121.94 1wbq h ARG 186 Ca 0.21 -0.42 -0.01 0.00 -1.10 0.00 0.00 59.98 58.66 1wbq h ARG 186 Cb 0.01 0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.56 1wbq h ARG 186 CO -0.09 1.05 0.49 0.00 2.80 0.00 0.00 179.97 184.23 1wbq h ALA 187 N 0.90 1.12 -0.57 2.80 0.00 -0.83 -0.26 119.26 122.42 1wbq h ALA 187 Ca 0.06 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1wbq h ALA 187 Cb 0.93 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1wbq h ALA 187 CO 0.09 0.62 0.08 0.78 0.00 0.00 0.00 179.25 180.81 1wbq h GLY 188 N 1.22 0.99 0.68 0.00 0.00 -0.77 -1.02 103.07 104.17 1wbq h GLY 188 Ca 0.31 -0.63 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 1wbq h GLY 188 CO -0.05 0.58 -0.05 -2.09 0.00 0.00 0.00 176.54 174.93 1wbq h GLU 189 N 0.86 0.20 -0.52 4.80 4.81 -1.05 0.04 114.58 123.73 1wbq h GLU 189 Ca 0.18 -0.09 0.02 0.00 -0.13 0.00 0.00 59.36 59.34 1wbq h GLU 189 Cb 0.40 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.74 1wbq h GLU 189 CO 0.01 0.57 0.32 0.82 -0.73 0.00 0.00 179.01 179.99 1wbq h ILE 190 N -0.17 1.06 -0.56 2.32 2.04 -1.00 -0.81 117.51 120.40 1wbq h ILE 190 Ca 0.02 -0.22 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 1wbq h ILE 190 Cb 0.51 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 1wbq h ILE 190 CO 0.01 0.12 0.22 0.74 0.00 0.00 0.00 178.15 179.24 1wbq h THR 191 N 0.63 1.22 -0.68 -0.27 2.02 -1.14 -2.26 112.91 112.43 1wbq h THR 191 Ca 0.21 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.68 1wbq h THR 191 Cb 0.01 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 1wbq h THR 191 CO -0.09 0.27 0.39 0.00 0.37 0.00 0.00 175.52 176.46 1wbq h ALA 192 N 1.07 0.87 -0.73 6.16 0.00 -0.63 -1.69 119.26 124.30 1wbq h ALA 192 Ca 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1wbq h ALA 192 Cb 0.21 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 1wbq h ALA 192 CO -0.01 0.37 0.47 0.52 0.00 0.00 0.00 179.25 180.59 1wbq h MET 193 N 0.93 0.98 -0.55 0.00 2.07 -0.96 -0.56 114.93 116.84 1wbq h MET 193 Ca 0.24 -0.07 -0.10 0.00 -2.07 0.00 0.00 59.70 57.71 1wbq h MET 193 Cb 0.01 -0.21 -0.02 0.00 -1.87 0.00 0.00 31.60 29.51 1wbq h MET 193 CO -0.04 0.66 -0.03 0.00 1.07 0.00 0.00 176.91 178.57 1wbq h ALA 194 N 1.51 0.74 -0.38 6.32 0.00 -0.79 -1.71 119.26 124.96 1wbq h ALA 194 Ca 0.27 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 1wbq h ALA 194 Cb -0.08 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1wbq h ALA 194 CO -0.05 0.60 -0.34 0.45 0.00 0.00 0.00 179.25 179.90 1wbq h HIS 195 N 0.87 1.04 -0.39 0.00 3.86 -0.94 -1.52 115.15 118.07 1wbq h HIS 195 Ca 0.15 -0.29 0.00 0.00 -1.16 0.00 0.00 60.37 59.07 1wbq h HIS 195 Cb 0.58 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.80 1wbq h HIS 195 CO 0.04 1.10 0.26 1.15 0.86 0.00 0.00 177.93 181.34 1wbq h THR 196 N 0.73 1.10 -0.48 2.45 2.02 -1.08 -2.23 112.91 115.42 1wbq h THR 196 Ca 0.07 -0.19 0.02 0.00 0.77 0.00 0.00 66.41 67.08 1wbq h THR 196 Cb 0.92 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 67.82 1wbq h THR 196 CO 0.08 0.10 0.29 -0.09 0.37 0.00 0.00 175.52 176.27 1wbq h ARG 197 N 0.53 0.56 -0.47 6.66 2.43 -1.17 -1.51 114.38 121.41 1wbq h ARG 197 Ca 0.14 -0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.33 1wbq h ARG 197 Cb -0.06 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.32 1wbq h ARG 197 CO -0.03 0.37 0.22 0.00 -1.51 0.00 0.00 179.97 179.01 1wbq h ALA 198 N 1.21 0.59 -0.75 2.80 0.00 -1.07 0.50 119.26 122.53 1wbq h ALA 198 Ca 0.19 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1wbq h ALA 198 Cb 0.02 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1wbq h ALA 198 CO -0.09 -0.15 0.49 0.52 0.00 0.00 0.00 179.25 180.02 1wbq h MET 199 N 0.43 1.00 -0.07 0.00 2.86 -1.11 -1.07 114.93 116.97 1wbq h MET 199 Ca 0.21 -0.07 -0.12 0.00 -2.06 0.00 0.00 59.70 57.66 1wbq h MET 199 Cb 0.15 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 1wbq h MET 199 CO -0.17 0.68 -0.52 0.93 1.06 0.00 0.00 176.91 178.89 1wbq h GLU 200 N 1.02 0.18 0.00 1.72 5.08 -0.60 -3.24 114.58 118.74 1wbq h GLU 200 Ca 0.27 -0.10 -0.20 0.00 -1.00 0.00 0.00 59.36 58.33 1wbq h GLU 200 Cb -0.09 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 1wbq h GLU 200 CO -0.06 0.66 -1.26 0.87 -1.00 0.00 0.00 179.01 178.22 1wbq h LYS 201 N 0.14 0.00 -6.30 2.33 1.79 -0.73 -3.44 116.57 110.36 1wbq h LYS 201 Ca 0.00 0.00 -0.65 0.00 -2.18 0.00 0.00 60.65 57.82 1wbq h LYS 201 Cb 0.96 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 31.65 1wbq h LYS 201 CO 0.08 0.52 0.79 0.00 -1.08 0.00 0.00 179.45 179.75 1wbq s ARG 203 N 2.09 0.55 0.36 0.00 1.81 -1.26 -4.96 118.95 117.54 1wbq s ARG 203 Ca 0.88 -0.64 -0.28 0.00 -1.72 0.00 0.00 55.73 53.97 1wbq s ARG 203 Cb -0.85 -0.40 -0.12 0.00 -0.45 0.00 0.00 34.95 33.13 1wbq s ARG 203 CO 0.50 0.08 1.42 -2.30 -0.68 0.00 0.00 175.30 174.32 1wbq n PRO 204 N 1.82 2.48 0.00 3.54 -0.02 -1.26 -2.72 135.00 138.84 1wbq n PRO 204 Ca -0.20 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1wbq n PRO 204 Cb 0.55 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 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 0.57 3.13 3.77 -1.23 0.00 -0.23 -5.00 105.19 106.20 1wbq n GLY 205 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.59 2.88 0.43 1.61 -1.94 -1.10 -4.72 119.30 115.87 1wbq s MET 206 Ca 0.00 1.39 -0.10 0.00 -1.71 0.00 0.00 55.69 55.27 1wbq s MET 206 Cb 0.00 -1.96 -0.06 0.00 2.01 0.00 0.00 34.83 34.82 1wbq s MET 206 CO 0.00 -1.18 0.80 -0.06 -0.01 0.00 0.00 175.02 174.57 1wbq s PHE 207 N -2.31 3.49 0.29 -0.03 0.40 -1.26 0.06 117.98 118.62 1wbq s PHE 207 Ca 0.67 1.06 0.03 0.00 -0.60 0.00 0.00 56.93 58.09 1wbq s PHE 207 Cb -0.20 -2.47 0.64 0.00 0.51 0.00 0.00 43.02 41.50 1wbq s PHE 207 CO 0.40 -0.17 1.78 0.93 0.70 0.00 0.00 175.22 178.86 1wbq h GLU 208 N 1.03 0.74 0.00 0.44 5.08 -1.89 -1.93 114.58 118.06 1wbq h GLU 208 Ca -0.47 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 57.83 1wbq h GLU 208 Cb 1.19 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 30.27 1wbq h GLU 208 CO 0.63 0.49 -0.08 0.10 -1.00 0.00 0.00 179.01 179.15 1wbq h TYR 209 N 0.76 0.00 -0.98 4.33 -0.00 -1.57 -2.50 116.97 117.02 1wbq h TYR 209 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.26 1wbq h TYR 209 Cb 0.75 0.00 -0.05 0.00 0.00 0.00 0.00 36.73 37.43 1wbq h TYR 209 CO -0.03 0.08 0.63 0.45 -0.00 0.00 0.00 178.16 179.28 1wbq h HIS 210 N 0.00 1.25 -0.25 0.10 3.86 -1.66 -0.55 115.15 117.90 1wbq h HIS 210 Ca -0.00 0.02 -0.14 0.00 -1.16 0.00 0.00 60.37 59.09 1wbq h HIS 210 Cb 0.34 -0.42 -0.01 0.00 1.06 0.00 0.00 27.41 28.38 1wbq h HIS 210 CO 0.00 0.80 -0.43 -0.07 0.86 0.00 0.00 177.93 179.09 1wbq h LEU 211 N 1.34 0.65 -0.85 2.43 3.38 -1.56 -1.61 115.31 119.08 1wbq h LEU 211 Ca 0.36 -0.30 0.08 0.00 0.09 0.00 0.00 57.88 58.10 1wbq h LEU 211 Cb -0.12 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.38 1wbq h LEU 211 CO -0.07 1.00 0.52 -0.08 0.09 0.00 0.00 178.44 179.89 1wbq h GLU 212 N 0.50 0.89 -0.49 1.13 4.81 -1.41 -1.33 114.58 118.68 1wbq h GLU 212 Ca 0.04 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 1wbq h GLU 212 Cb 0.95 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 30.11 1wbq h GLU 212 CO 0.09 0.59 0.18 0.78 -0.73 0.00 0.00 179.01 179.91 1wbq h GLY 213 N 0.91 0.79 1.00 1.92 0.00 -0.54 -1.15 103.07 106.01 1wbq h GLY 213 Ca 0.39 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1wbq h GLY 213 CO -0.20 0.42 0.28 0.83 0.00 0.00 0.00 176.54 177.87 1wbq h GLU 214 N 0.65 0.57 -0.23 4.80 4.39 -1.04 -1.89 114.58 121.82 1wbq h GLU 214 Ca 0.16 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.82 1wbq h GLU 214 Cb 0.22 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 1wbq h GLU 214 CO -0.01 0.38 0.11 0.82 -1.16 0.00 0.00 179.01 179.14 1wbq h ILE 215 N 0.58 1.15 -0.29 3.13 2.04 -1.07 -1.71 117.51 121.33 1wbq h ILE 215 Ca 0.16 -0.43 -0.08 0.00 1.00 0.00 0.00 64.86 65.51 1wbq h ILE 215 Cb -0.06 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 1wbq h ILE 215 CO -0.03 0.15 -0.17 0.45 0.00 0.00 0.00 178.15 178.54 1wbq h HIS 216 N 0.24 0.57 -0.63 1.37 3.86 -1.15 -1.14 115.15 118.27 1wbq h HIS 216 Ca 0.08 -0.10 -0.07 0.00 -1.16 0.00 0.00 60.37 59.12 1wbq h HIS 216 Cb 0.13 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 28.43 1wbq h HIS 216 CO -0.02 0.67 0.13 1.25 0.86 0.00 0.00 177.93 180.82 1wbq h HIS 217 N 0.48 1.09 -0.24 2.45 -0.00 -1.13 -1.17 115.15 116.63 1wbq h HIS 217 Ca 0.08 -0.14 -0.03 0.00 -0.00 0.00 0.00 60.37 60.28 1wbq h HIS 217 Cb 0.58 -0.30 -0.01 0.00 -0.00 0.00 0.00 27.41 27.67 1wbq h HIS 217 CO 0.02 0.92 0.05 1.49 -0.00 0.00 0.00 177.93 180.41 1wbq h GLU 218 N 0.95 0.39 -0.32 5.26 4.57 -0.92 -1.37 114.58 123.13 1wbq h GLU 218 Ca 0.20 -0.10 0.07 0.00 -1.18 0.00 0.00 59.36 58.35 1wbq h GLU 218 Cb 0.40 -0.05 -0.08 0.00 -0.16 0.00 0.00 28.75 28.86 1wbq h GLU 218 CO 0.01 0.51 -0.26 0.74 -1.18 0.00 0.00 179.01 178.83 1wbq h PHE 219 N 0.21 -0.69 -0.63 0.92 0.04 -1.09 -2.81 116.94 112.90 1wbq h PHE 219 Ca 0.07 0.05 -0.01 0.00 2.80 0.00 0.00 57.97 60.88 1wbq h PHE 219 Cb 0.30 0.35 -0.03 0.00 2.20 0.00 0.00 35.95 38.77 1wbq h PHE 219 CO 0.02 -0.33 0.34 -0.97 -0.60 0.00 0.00 178.31 176.77 1wbq h ASN 220 N -0.23 0.78 1.32 2.17 -0.73 -0.90 -1.79 115.58 116.20 1wbq h ASN 220 Ca 0.16 -0.06 -0.00 0.00 1.87 0.00 0.00 56.30 58.27 1wbq h ASN 220 Cb 0.48 -0.20 -0.00 0.00 0.27 0.00 0.00 38.32 38.87 1wbq h ASN 220 CO -0.45 0.63 -0.01 0.08 -0.37 0.00 0.00 177.43 177.31 1wbq h ARG 221 N 0.88 0.00 -0.47 6.67 0.11 -0.99 -1.66 114.38 118.93 1wbq h ARG 221 Ca 0.22 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.30 1wbq h ARG 221 Cb 0.03 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.11 1wbq h ARG 221 CO -0.04 0.01 0.00 0.72 0.10 0.00 0.00 179.97 180.76 1wbq n HIS 222 N -3.10 0.62 -0.60 4.08 8.25 -0.96 -4.93 115.22 118.58 1wbq n HIS 222 Ca 0.02 -0.31 0.00 0.00 -0.26 0.00 0.00 57.72 57.17 1wbq n HIS 222 Cb 0.38 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.49 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 1.32 0.71 3.35 -1.41 0.00 -0.62 -5.01 105.19 103.51 1wbq n GLY 223 Ca 0.17 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.09 4.05 0.32 4.61 0.00 -0.71 -4.90 121.76 123.03 1wbq s ALA 224 Ca 0.00 -3.30 0.07 0.00 0.00 0.00 0.00 51.96 48.72 1wbq s ALA 224 Cb 0.00 -3.59 0.54 0.00 0.00 0.00 0.00 23.12 20.07 1wbq s ALA 224 CO 0.00 -2.36 1.77 0.00 0.00 0.00 0.00 175.76 175.17 1wbq h ARG 225 N 7.81 0.29 -6.60 0.00 3.08 -1.80 -3.05 114.38 114.11 1wbq h ARG 225 Ca 0.12 -0.11 -0.67 0.00 0.07 0.00 0.00 59.98 59.40 1wbq h ARG 225 Cb 1.02 -0.02 -0.26 0.00 0.08 0.00 0.00 29.97 30.80 1wbq h ARG 225 CO 0.81 0.56 -0.87 0.71 -1.07 0.00 0.00 179.97 180.12 1wbq s TYR 226 N -4.39 2.19 0.72 3.04 2.02 -1.26 -4.77 117.35 114.89 1wbq s TYR 226 Ca -0.05 -0.40 -0.14 0.00 -0.37 0.00 0.00 57.07 56.11 1wbq s TYR 226 Cb 0.14 -1.29 0.03 0.00 -0.40 0.00 0.00 41.96 40.44 1wbq s TYR 226 CO 0.76 0.15 1.14 -2.14 -1.57 0.00 0.00 175.55 173.89 1wbq s PRO 227 N -1.34 2.38 0.17 -1.71 0.02 -1.26 -1.02 135.00 132.23 1wbq s PRO 227 Ca 0.11 1.47 0.26 0.00 0.02 0.00 0.00 61.00 62.86 1wbq s PRO 227 Cb -0.10 -1.89 0.75 0.00 0.02 0.00 0.00 34.50 33.29 1wbq s PRO 227 CO 0.03 -1.59 1.70 -1.13 -0.33 0.00 0.00 177.00 175.67 1wbq n SER 228 N -2.82 0.71 -3.72 2.53 3.41 -0.28 -4.50 113.62 108.94 1wbq n SER 228 Ca 0.11 0.46 -0.08 0.00 -0.26 0.00 0.00 58.87 59.10 1wbq n SER 228 Cb 0.52 -0.56 -0.02 0.00 -0.26 0.00 0.00 64.21 63.88 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 -0.28 0.03 7.33 1.13 -1.26 -4.70 117.35 116.49 1wbq s TYR 229 Ca 0.10 -0.09 -0.30 0.00 -1.41 0.00 0.00 57.07 55.37 1wbq s TYR 229 Cb 0.13 0.66 -0.07 0.00 -1.10 0.00 0.00 41.96 41.59 1wbq s TYR 229 CO 0.62 -1.08 1.53 -0.80 -2.51 0.00 0.00 175.55 173.30 1wbq s ASN 230 N -2.86 6.73 0.20 -0.18 0.01 -1.26 -4.75 114.94 112.82 1wbq s ASN 230 Ca 0.08 2.28 -0.30 0.00 -0.71 0.00 0.00 52.86 54.21 1wbq s ASN 230 Cb -0.04 -2.56 -0.09 0.00 0.41 0.00 0.00 41.25 38.97 1wbq s ASN 230 CO 0.01 -0.81 1.40 -0.89 -1.51 0.00 0.00 177.10 175.30 1wbq s THR 231 N 2.62 2.94 -0.22 1.60 2.01 -1.26 -4.96 115.64 118.37 1wbq s THR 231 Ca 0.69 0.75 -0.08 0.00 0.31 0.00 0.00 61.69 63.36 1wbq s THR 231 Cb -0.35 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.64 1wbq s THR 231 CO 0.29 0.10 0.10 -0.63 -0.69 0.00 0.00 174.62 173.79 1wbq s ILE 232 N 0.32 4.81 -0.45 1.82 1.01 -0.24 -4.66 121.20 123.82 1wbq s ILE 232 Ca 0.60 -0.01 0.02 0.00 0.00 0.00 0.00 60.65 61.26 1wbq s ILE 232 Cb -0.39 -3.22 0.15 0.00 0.01 0.00 0.00 42.46 39.00 1wbq s ILE 232 CO 0.38 0.38 0.28 -0.69 0.00 0.00 0.00 174.94 175.29 1wbq s VAL 233 N 1.00 1.18 -0.45 2.92 1.01 -1.25 -1.48 120.40 123.33 1wbq s VAL 233 Ca 0.05 -2.60 -0.10 0.00 0.00 0.00 0.00 61.98 59.33 1wbq s VAL 233 Cb -0.14 -1.82 0.09 0.00 0.00 0.00 0.00 36.38 34.52 1wbq s VAL 233 CO 0.03 -0.98 0.31 -0.83 0.00 0.00 0.00 175.10 173.64 1wbq s GLY 234 N 0.24 2.00 0.11 4.51 0.00 -0.06 -4.52 107.32 109.60 1wbq s GLY 234 Ca 0.21 -2.29 -0.04 0.00 0.00 0.00 0.00 44.72 42.60 1wbq s GLY 234 CO -0.05 1.03 0.33 -1.35 0.00 0.00 0.00 173.10 173.07 1wbq s SER 235 N 2.40 6.47 1.82 1.64 1.04 -1.26 -0.89 113.70 124.93 1wbq s SER 235 Ca 0.04 0.54 0.00 0.00 0.48 0.00 0.00 55.95 57.01 1wbq s SER 235 Cb -0.24 -2.07 0.00 0.00 0.10 0.00 0.00 66.02 63.81 1wbq s SER 235 CO 0.02 0.11 0.00 0.61 0.98 0.00 0.00 173.24 174.95 1wbq n GLY 236 N 0.29 3.62 0.16 7.32 0.00 0.22 -1.92 105.19 114.88 1wbq n GLY 236 Ca -0.04 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.18 114.58 117.18 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 -0.12 -0.91 -1.00 0.00 0.00 179.01 176.98 1wbq h ASN 238 N 0.00 0.00 0.13 1.42 2.35 -1.68 -2.94 115.58 114.86 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 0.42 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.79 1wbq h ASN 238 CO 0.00 0.12 -0.05 1.23 -1.65 0.00 0.00 177.43 177.07 1wbq h GLY 239 N 1.13 0.00 2.00 2.83 0.00 -1.41 -2.29 103.07 105.34 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 0.02 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.56 1wbq s ILE 241 N -3.01 5.05 0.15 0.00 1.01 -0.86 -4.98 121.20 118.55 1wbq s ILE 241 Ca 0.13 0.07 -0.16 0.00 0.00 0.00 0.00 60.65 60.69 1wbq s ILE 241 Cb 0.18 -3.98 0.01 0.00 0.01 0.00 0.00 42.46 38.67 1wbq s ILE 241 CO 0.52 -0.29 1.78 -0.07 0.00 0.00 0.00 174.94 176.88 1wbq h LEU 242 N 9.07 0.47 -5.33 2.97 3.38 -1.85 -2.95 115.31 121.08 1wbq h LEU 242 Ca -0.28 -0.05 -0.69 0.00 0.09 0.00 0.00 57.88 56.96 1wbq h LEU 242 Cb 1.12 -0.12 -0.35 0.00 0.09 0.00 0.00 40.66 41.40 1wbq h LEU 242 CO 0.77 0.38 0.15 1.41 0.09 0.00 0.00 178.44 181.25 1wbq n HIS 243 N -4.78 3.35 -2.58 1.13 8.25 -1.26 -4.98 115.22 114.35 1wbq n HIS 243 Ca 0.00 -3.07 -0.43 0.00 -0.26 0.00 0.00 57.72 53.97 1wbq n HIS 243 Cb 0.05 -0.74 -0.02 0.00 1.12 0.00 0.00 29.99 30.40 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 -3.85 2.77 0.00 4.41 5.04 -1.12 -4.86 117.35 119.74 1wbq s TYR 244 Ca 0.47 0.69 0.00 0.00 -2.44 0.00 0.00 57.07 55.78 1wbq s TYR 244 Cb 0.31 -4.44 0.00 0.00 0.35 0.00 0.00 41.96 38.18 1wbq s TYR 244 CO -0.21 -1.35 0.59 0.25 -1.34 0.00 0.00 175.55 173.49 1wbq n THR 245 N 6.86 0.25 -0.24 4.34 -2.24 -1.26 -4.06 114.28 117.93 1wbq n THR 245 Ca 0.12 -0.57 -0.06 0.00 -2.27 0.00 0.00 64.05 61.27 1wbq n THR 245 Cb 0.49 0.95 0.08 0.00 -2.10 0.00 0.00 70.33 69.75 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 1.10 -6.71 -0.78 3.07 -1.89 -3.47 114.58 105.91 1wbq h GLU 246 Ca 0.00 -0.25 -0.54 0.00 -0.50 0.00 0.00 59.36 58.07 1wbq h GLU 246 Cb 0.19 -0.15 -0.16 0.00 -0.84 0.00 0.00 28.75 27.78 1wbq h GLU 246 CO 0.00 0.96 -0.86 0.09 -1.40 0.00 0.00 179.01 177.80 1wbq n ASN 247 N -4.24 -2.00 -2.79 1.42 3.02 -1.26 -4.90 115.26 104.50 1wbq n ASN 247 Ca 0.05 -1.04 -0.34 0.00 -0.03 0.00 0.00 54.58 53.22 1wbq n ASN 247 Cb 0.25 -2.74 0.02 0.00 -0.61 0.00 0.00 39.78 36.70 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 3.21 -4.67 3.52 0.28 -1.26 -1.38 120.64 115.93 1wbq n GLU 248 Ca -0.08 -4.05 -0.33 0.00 -0.16 0.00 0.00 57.16 52.54 1wbq n GLU 248 Cb 0.57 -2.27 -0.13 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 -3.85 3.28 -0.12 3.44 2.12 -1.26 -4.86 118.70 117.44 1wbq s GLU 250 Ca 0.49 -0.63 -0.28 0.00 0.36 0.00 0.00 54.97 54.92 1wbq s GLU 250 Cb 0.40 -2.67 -0.01 0.00 0.26 0.00 0.00 34.13 32.11 1wbq s GLU 250 CO -0.30 0.33 0.94 -1.64 -0.54 0.00 0.00 175.26 174.05 1wbq s MET 251 N 0.08 4.39 0.19 4.30 -1.94 0.11 -4.89 119.30 121.53 1wbq s MET 251 Ca -0.04 1.26 -0.03 0.00 -1.71 0.00 0.00 55.69 55.17 1wbq s MET 251 Cb -0.14 -3.55 -0.05 0.00 2.01 0.00 0.00 34.83 33.10 1wbq s MET 251 CO 0.04 -0.30 0.41 1.03 -0.01 0.00 0.00 175.02 176.18 1wbq s ARG 252 N 2.01 3.58 0.12 2.03 1.81 -1.26 -1.07 118.95 126.16 1wbq s ARG 252 Ca 0.45 -0.17 -0.31 0.00 -1.72 0.00 0.00 55.73 53.97 1wbq s ARG 252 Cb -0.18 -2.81 -0.09 0.00 -0.45 0.00 0.00 34.95 31.42 1wbq s ARG 252 CO 0.16 0.40 1.50 0.34 -0.68 0.00 0.00 175.30 177.03 1wbq s ASP 253 N -2.83 6.70 0.00 0.23 3.68 -1.26 -3.01 116.67 120.18 1wbq s ASP 253 Ca 0.40 2.44 0.00 0.00 2.13 0.00 0.00 52.55 57.53 1wbq s ASP 253 Cb -0.11 -2.58 0.00 0.00 -1.45 0.00 0.00 42.92 38.77 1wbq s ASP 253 CO 0.27 -0.76 0.00 0.61 0.13 0.00 0.00 175.17 175.42 1wbq n GLY 254 N 3.69 1.23 3.92 2.66 0.00 -1.26 -5.03 105.19 110.39 1wbq n GLY 254 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.71 6.39 0.41 1.61 1.01 -1.16 -4.97 116.67 118.24 1wbq s ASP 255 Ca 0.00 0.60 -0.06 0.00 0.71 0.00 0.00 52.55 53.80 1wbq s ASP 255 Cb 0.00 -2.10 -0.05 0.00 1.01 0.00 0.00 42.92 41.79 1wbq s ASP 255 CO 0.00 -0.20 0.72 -0.76 0.21 0.00 0.00 175.17 175.13 1wbq s LEU 256 N -3.73 3.80 -0.08 1.23 1.43 -1.26 -1.31 118.68 118.76 1wbq s LEU 256 Ca 0.42 0.91 0.02 0.00 -1.03 0.00 0.00 54.13 54.45 1wbq s LEU 256 Cb -0.10 -3.81 0.01 0.00 0.03 0.00 0.00 46.19 42.32 1wbq s LEU 256 CO 0.32 -0.43 -0.15 0.54 0.23 0.00 0.00 176.35 176.86 1wbq s VAL 257 N -2.47 1.36 -0.26 -1.59 0.11 0.41 -0.61 120.40 117.36 1wbq s VAL 257 Ca 0.47 -0.60 -0.09 0.00 -2.93 0.00 0.00 61.98 58.83 1wbq s VAL 257 Cb -0.10 -1.23 -0.04 0.00 -1.53 0.00 0.00 36.38 33.47 1wbq s VAL 257 CO 0.37 0.41 0.14 -0.22 -3.33 0.00 0.00 175.10 172.47 1wbq s LEU 258 N 0.68 3.77 -0.23 2.54 0.20 -0.07 -1.67 118.68 123.90 1wbq s LEU 258 Ca -0.14 -0.09 -0.01 0.00 0.69 0.00 0.00 54.13 54.59 1wbq s LEU 258 Cb -0.16 -2.03 0.03 0.00 -0.43 0.00 0.00 46.19 43.59 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 1.65 2.64 -0.28 6.68 1.01 0.19 -0.88 121.20 132.20 1wbq s ILE 259 Ca 0.07 -1.05 -0.04 0.00 0.00 0.00 0.00 60.65 59.63 1wbq s ILE 259 Cb -0.15 -2.31 0.03 0.00 0.01 0.00 0.00 42.46 40.03 1wbq s ILE 259 CO 0.08 0.26 0.01 -0.62 0.00 0.00 0.00 174.94 174.66 1wbq s ASP 260 N 1.30 4.78 -0.09 3.58 -1.08 -0.55 -1.18 116.67 123.42 1wbq s ASP 260 Ca 0.00 -0.96 -0.16 0.00 -0.52 0.00 0.00 52.55 50.92 1wbq s ASP 260 Cb -0.16 -1.75 0.04 0.00 -1.46 0.00 0.00 42.92 39.58 1wbq s ASP 260 CO -0.06 -0.20 0.40 0.00 0.52 0.00 0.00 175.17 175.83 1wbq s ALA 261 N 1.36 -1.00 -0.12 3.66 0.00 -0.06 -1.08 121.76 124.52 1wbq s ALA 261 Ca -0.01 0.87 -0.16 0.00 0.00 0.00 0.00 51.96 52.65 1wbq s ALA 261 Cb -0.18 -0.34 0.04 0.00 0.00 0.00 0.00 23.12 22.65 1wbq s ALA 261 CO -0.01 -0.24 0.43 0.20 0.00 0.00 0.00 175.76 176.14 1wbq s GLY 262 N -0.48 -0.31 0.52 0.00 0.00 -1.26 -2.20 107.32 103.59 1wbq s GLY 262 Ca -0.06 1.04 -0.04 0.00 0.00 0.00 0.00 44.72 45.66 1wbq s GLY 262 CO 0.03 0.85 0.79 0.00 0.00 0.00 0.00 173.10 174.77 1wbq s GLU 264 N -4.78 3.06 -0.16 0.00 2.12 -0.19 -0.92 118.70 117.83 1wbq s GLU 264 Ca 0.50 -0.84 0.00 0.00 0.36 0.00 0.00 54.97 55.00 1wbq s GLU 264 Cb -0.10 -3.07 0.03 0.00 0.26 0.00 0.00 34.13 31.24 1wbq s GLU 264 CO 0.42 -0.34 -0.13 -0.47 -0.54 0.00 0.00 175.26 174.20 1wbq s TYR 265 N 1.41 2.19 -1.29 5.30 5.04 0.17 -4.35 117.35 125.82 1wbq s TYR 265 Ca 0.03 -1.27 -0.09 0.00 -2.44 0.00 0.00 57.07 53.30 1wbq s TYR 265 Cb -0.16 -1.60 0.06 0.00 0.35 0.00 0.00 41.96 40.62 1wbq s TYR 265 CO -0.03 -0.68 0.48 1.63 -1.34 0.00 0.00 175.55 175.61 1wbq n LYS 266 N 4.76 -3.46 0.00 4.97 4.76 -1.26 -0.80 118.16 127.13 1wbq n LYS 266 Ca -0.17 0.51 0.00 0.00 -2.87 0.00 0.00 58.31 55.79 1wbq n LYS 266 Cb 0.50 -5.23 0.00 0.00 -1.84 0.00 0.00 35.03 28.46 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 -1.18 2.49 3.86 0.72 0.00 -1.26 -5.00 105.19 104.82 1wbq n GLY 267 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.23 3.64 -0.12 1.61 1.51 0.02 -4.39 117.35 117.39 1wbq s TYR 268 Ca 0.00 0.78 -0.16 0.00 -1.01 0.00 0.00 57.07 56.67 1wbq s TYR 268 Cb 0.00 -2.13 -0.04 0.00 -0.11 0.00 0.00 41.96 39.67 1wbq s TYR 268 CO 0.00 0.63 0.41 0.00 -1.11 0.00 0.00 175.55 175.48 1wbq s ALA 269 N -1.17 3.54 0.39 3.71 0.00 -0.27 -0.66 121.76 127.29 1wbq s ALA 269 Ca 0.24 -0.29 -0.05 0.00 0.00 0.00 0.00 51.96 51.87 1wbq s ALA 269 Cb -0.14 -2.53 -0.05 0.00 0.00 0.00 0.00 23.12 20.40 1wbq s ALA 269 CO 0.13 0.08 0.68 0.20 0.00 0.00 0.00 175.76 176.85 1wbq s GLY 270 N 0.42 1.66 -0.40 0.00 0.00 -0.10 -4.69 107.32 104.21 1wbq s GLY 270 Ca 0.22 -0.52 0.07 0.00 0.00 0.00 0.00 44.72 44.50 1wbq s GLY 270 CO 0.08 -0.38 0.58 -0.35 0.00 0.00 0.00 173.10 173.03 1wbq s ASP 271 N -3.64 -1.04 -0.01 1.64 2.15 -1.26 -3.96 116.67 110.56 1wbq s ASP 271 Ca 0.46 -0.88 0.08 0.00 0.43 0.00 0.00 52.55 52.64 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 -0.19 -0.24 -0.63 -0.17 0.00 0.00 175.17 174.30 1wbq s ILE 272 N 1.83 2.21 -0.08 4.11 1.01 -0.93 -4.50 121.20 124.83 1wbq s ILE 272 Ca 0.16 -1.10 0.04 0.00 0.00 0.00 0.00 60.65 59.75 1wbq s ILE 272 Cb -0.06 -1.79 0.00 0.00 0.01 0.00 0.00 42.46 40.62 1wbq s ILE 272 CO -0.07 0.55 -0.21 -0.89 0.00 0.00 0.00 174.94 174.32 1wbq s THR 273 N -0.66 1.78 -0.00 2.92 2.01 -1.13 -0.88 115.64 119.67 1wbq s THR 273 Ca 0.11 -0.86 0.04 0.00 0.31 0.00 0.00 61.69 61.28 1wbq s THR 273 Cb -0.10 -1.55 -0.01 0.00 0.01 0.00 0.00 72.50 70.85 1wbq s THR 273 CO -0.00 0.50 -0.13 -0.13 -0.69 0.00 0.00 174.62 174.17 1wbq s ARG 274 N 0.35 1.01 -0.07 4.92 1.81 -0.33 -1.31 118.95 125.34 1wbq s ARG 274 Ca -0.15 -0.49 0.05 0.00 -1.72 0.00 0.00 55.73 53.41 1wbq s ARG 274 Cb -0.17 -0.98 -0.01 0.00 -0.45 0.00 0.00 34.95 33.34 1wbq s ARG 274 CO 0.07 0.27 -0.22 0.99 -0.68 0.00 0.00 175.30 175.72 1wbq s THR 275 N -0.37 2.27 0.11 0.02 2.01 -1.23 -0.64 115.64 117.81 1wbq s THR 275 Ca 0.04 -0.98 -0.19 0.00 0.31 0.00 0.00 61.69 60.88 1wbq s THR 275 Cb -0.05 -1.85 0.04 0.00 0.01 0.00 0.00 72.50 70.65 1wbq s THR 275 CO -0.00 0.57 0.46 0.72 -0.69 0.00 0.00 174.62 175.67 1wbq s PHE 276 N -0.09 -0.31 0.13 4.92 -0.71 -0.67 -4.97 117.98 116.29 1wbq s PHE 276 Ca -0.05 0.09 -0.30 0.00 -1.04 0.00 0.00 56.93 55.63 1wbq s PHE 276 Cb -0.14 0.33 -0.07 0.00 -1.21 0.00 0.00 43.02 41.92 1wbq s PHE 276 CO 0.04 -0.71 1.21 -1.25 -1.34 0.00 0.00 175.22 173.18 1wbq s PRO 277 N -3.47 4.46 0.37 1.99 0.04 -1.26 -0.44 135.00 136.69 1wbq s PRO 277 Ca 0.01 1.85 0.07 0.00 0.04 0.00 0.00 61.00 62.97 1wbq s PRO 277 Cb 0.01 -3.28 0.79 0.00 0.04 0.00 0.00 34.50 32.05 1wbq s PRO 277 CO -0.10 -0.17 1.97 0.28 0.04 0.00 0.00 177.00 179.01 1wbq h VAL 278 N 4.07 1.01 -0.49 -0.36 2.07 -1.49 -1.84 116.25 119.22 1wbq h VAL 278 Ca -0.43 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 66.85 1wbq h VAL 278 Cb 1.21 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1wbq h VAL 278 CO 0.78 0.13 0.00 -0.46 0.02 0.00 0.00 177.57 178.04 1wbq n ASN 279 N -4.48 2.96 0.00 0.57 0.23 -1.26 -4.14 115.26 109.14 1wbq n ASN 279 Ca 0.10 -2.10 0.00 0.00 -0.53 0.00 0.00 54.58 52.05 1wbq n ASN 279 Cb 0.24 -0.39 0.00 0.00 -2.08 0.00 0.00 39.78 37.55 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 1.16 0.86 2.68 4.83 0.00 -0.69 -5.00 105.19 109.04 1wbq n GLY 280 Ca 0.17 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.00 1wbq n GLY 280 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1wbq s LYS 281 N -0.06 -0.07 0.31 1.61 2.20 -1.26 -4.54 119.74 117.93 1wbq s LYS 281 Ca 0.00 0.38 -0.29 0.00 -0.36 0.00 0.00 55.97 55.70 1wbq s LYS 281 Cb 0.00 -0.49 -0.11 0.00 -1.51 0.00 0.00 37.83 35.73 1wbq s LYS 281 CO 0.00 -0.32 1.46 -0.06 -0.36 0.00 0.00 175.35 176.06 1wbq s PHE 282 N 2.13 2.85 0.80 4.03 0.08 -1.26 -4.86 117.98 121.75 1wbq s PHE 282 Ca 0.04 1.10 -0.12 0.00 0.12 0.00 0.00 56.93 58.07 1wbq s PHE 282 Cb -0.12 -3.90 0.07 0.00 -0.57 0.00 0.00 43.02 38.50 1wbq s PHE 282 CO -0.03 -2.78 1.14 0.95 -0.10 0.00 0.00 175.22 174.40 1wbq s THR 283 N -0.56 2.46 0.16 0.64 -4.23 -1.26 -4.85 115.64 107.99 1wbq s THR 283 Ca 0.56 0.15 -0.15 0.00 -1.18 0.00 0.00 61.69 61.07 1wbq s THR 283 Cb -0.44 -3.08 0.03 0.00 1.34 0.00 0.00 72.50 70.35 1wbq s THR 283 CO 0.52 -0.19 1.79 -0.61 -0.54 0.00 0.00 174.62 175.59 1wbq h GLN 284 N -1.04 0.45 -0.56 3.99 4.15 -1.98 0.64 115.11 120.76 1wbq h GLN 284 Ca -0.47 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 58.91 1wbq h GLN 284 Cb 1.31 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.87 1wbq h GLN 284 CO 0.64 0.30 0.27 0.00 -1.93 0.00 0.00 178.83 178.10 1wbq h ALA 285 N 1.20 0.72 -0.55 3.38 0.00 -1.94 0.24 119.26 122.30 1wbq h ALA 285 Ca 0.17 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1wbq h ALA 285 Cb 0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1wbq h ALA 285 CO -0.10 0.28 0.16 1.96 0.00 0.00 0.00 179.25 181.55 1wbq h GLN 286 N 0.75 0.86 -0.37 0.00 4.20 -1.83 -2.88 115.11 115.85 1wbq h GLN 286 Ca 0.19 -0.19 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 1wbq h GLN 286 Cb 0.12 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 1wbq h GLN 286 CO -0.02 0.79 -0.01 -0.09 -0.67 0.00 0.00 178.83 178.83 1wbq h ARG 287 N 0.77 0.58 -0.42 1.46 9.65 -0.49 -0.01 114.38 125.92 1wbq h ARG 287 Ca 0.18 -0.13 -0.12 0.00 -1.10 0.00 0.00 59.98 58.81 1wbq h ARG 287 Cb 0.30 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 28.78 1wbq h ARG 287 CO -0.00 0.61 -0.20 0.93 2.80 0.00 0.00 179.97 184.10 1wbq h GLU 288 N 0.55 0.84 0.04 0.20 5.08 -0.76 -1.20 114.58 119.32 1wbq h GLU 288 Ca 0.12 -0.33 -0.22 0.00 -1.00 0.00 0.00 59.36 57.92 1wbq h GLU 288 Cb 0.36 -0.04 0.02 0.00 0.50 0.00 0.00 28.75 29.59 1wbq h GLU 288 CO 0.01 0.96 -0.90 0.82 -1.00 0.00 0.00 179.01 178.91 1wbq h ILE 289 N 0.73 1.35 -0.58 3.13 1.08 -1.38 -3.32 117.51 118.53 1wbq h ILE 289 Ca 0.10 -2.25 0.06 0.00 -0.39 0.00 0.00 64.86 62.38 1wbq h ILE 289 Cb 0.73 2.59 -0.05 0.00 -3.07 0.00 0.00 36.82 37.02 1wbq h ILE 289 CO 0.06 0.67 0.29 0.22 -0.69 0.00 0.00 178.15 178.70 1wbq h TYR 290 N 0.12 0.53 -0.68 1.37 3.20 -0.88 -2.26 116.97 118.38 1wbq h TYR 290 Ca -0.12 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.82 1wbq h TYR 290 Cb 1.59 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 39.67 1wbq h TYR 290 CO 0.13 0.24 0.45 -0.44 -1.64 0.00 0.00 178.16 176.90 1wbq h ASP 291 N 0.55 0.67 -0.34 -2.11 5.19 -1.34 0.15 116.42 119.19 1wbq h ASP 291 Ca 0.27 -0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.61 1wbq h ASP 291 Cb 0.20 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.55 1wbq h ASP 291 CO -0.19 0.45 -0.04 0.40 -3.12 0.00 0.00 179.24 176.74 1wbq h ILE 292 N 0.78 1.27 -0.56 0.35 2.04 -1.50 -0.99 117.51 118.88 1wbq h ILE 292 Ca 0.28 -1.07 -0.10 0.00 1.00 0.00 0.00 64.86 64.97 1wbq h ILE 292 Cb 0.14 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 1wbq h ILE 292 CO -0.08 0.35 -0.05 0.58 0.00 0.00 0.00 178.15 178.94 1wbq h VAL 293 N 0.43 1.27 -0.33 1.67 2.07 -1.18 -2.18 116.25 117.99 1wbq h VAL 293 Ca 0.09 -1.20 -0.10 0.00 0.82 0.00 0.00 66.70 66.31 1wbq h VAL 293 Cb 0.53 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1wbq h VAL 293 CO 0.03 0.43 -0.19 0.25 0.02 0.00 0.00 177.57 178.11 1wbq h LEU 294 N 0.92 0.74 -0.71 2.57 5.85 -0.91 -1.50 115.31 122.27 1wbq h LEU 294 Ca 0.15 -0.42 0.03 0.00 0.84 0.00 0.00 57.88 58.49 1wbq h LEU 294 Cb 0.61 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 1wbq h LEU 294 CO 0.04 1.00 0.44 -0.08 -0.34 0.00 0.00 178.44 179.50 1wbq h GLU 295 N 0.48 0.84 -0.48 1.25 4.81 -1.15 0.11 114.58 120.44 1wbq h GLU 295 Ca 0.07 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1wbq h GLU 295 Cb 0.73 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.89 1wbq h GLU 295 CO 0.05 0.56 0.26 0.77 -0.73 0.00 0.00 179.01 179.92 1wbq h SER 296 N 0.87 0.39 -0.10 1.04 0.02 -1.18 0.64 113.55 115.22 1wbq h SER 296 Ca 0.29 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.24 1wbq h SER 296 Cb 0.03 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.50 1wbq h SER 296 CO -0.11 0.27 -0.00 0.25 -1.14 0.00 0.00 176.83 176.10 1wbq h LEU 297 N 0.51 0.18 -0.87 5.07 5.85 -0.79 -1.61 115.31 123.65 1wbq h LEU 297 Ca 0.20 -0.31 -0.07 0.00 0.84 0.00 0.00 57.88 58.54 1wbq h LEU 297 Cb 0.08 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1wbq h LEU 297 CO -0.12 0.45 0.05 -0.33 -0.34 0.00 0.00 178.44 178.15 1wbq h GLU 298 N -0.09 0.89 -0.30 1.25 5.08 -0.60 0.19 114.58 120.98 1wbq h GLU 298 Ca 0.03 -0.23 -0.05 0.00 -1.00 0.00 0.00 59.36 58.11 1wbq h GLU 298 Cb 0.36 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1wbq h GLU 298 CO 0.01 0.85 -0.00 1.15 -1.00 0.00 0.00 179.01 180.01 1wbq h THR 299 N 0.83 1.26 -0.87 1.13 2.02 -0.91 -2.65 112.91 113.73 1wbq h THR 299 Ca 0.17 -0.95 0.05 0.00 0.77 0.00 0.00 66.41 66.44 1wbq h THR 299 Cb 0.42 1.28 -0.06 0.00 -1.74 0.00 0.00 68.15 68.06 1wbq h THR 299 CO 0.01 0.31 0.55 0.28 0.37 0.00 0.00 175.52 177.04 1wbq h SER 300 N 0.33 0.89 -0.11 4.18 0.02 -0.88 -1.62 113.55 116.37 1wbq h SER 300 Ca 0.09 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.00 1wbq h SER 300 Cb 0.44 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 1wbq h SER 300 CO 0.02 0.59 -0.02 -0.07 -1.14 0.00 0.00 176.83 176.21 1wbq h LEU 301 N 1.04 0.30 -0.31 5.07 3.38 -0.88 -1.29 115.31 122.62 1wbq h LEU 301 Ca 0.36 -0.05 -0.13 0.00 0.09 0.00 0.00 57.88 58.15 1wbq h LEU 301 Cb 0.09 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1wbq h LEU 301 CO -0.14 0.38 -0.33 0.03 0.09 0.00 0.00 178.44 178.47 1wbq h ARG 302 N 0.32 0.76 0.01 1.13 3.08 -1.04 -3.36 114.38 115.28 1wbq h ARG 302 Ca 0.07 -0.41 -0.25 0.00 0.07 0.00 0.00 59.98 59.46 1wbq h ARG 302 Cb 0.26 0.02 0.01 0.00 0.08 0.00 0.00 29.97 30.34 1wbq h ARG 302 CO 0.01 1.04 -1.01 -0.07 -1.07 0.00 0.00 179.97 178.87 1wbq h LEU 303 N 0.52 0.72 -9.47 3.04 3.38 -0.80 -3.45 115.31 109.26 1wbq h LEU 303 Ca 0.05 -0.59 -0.53 0.00 0.09 0.00 0.00 57.88 56.90 1wbq h LEU 303 Cb 0.91 -0.22 0.02 0.00 0.09 0.00 0.00 40.66 41.46 1wbq h LEU 303 CO 0.08 1.39 1.01 -0.31 0.09 0.00 0.00 178.44 180.70 1wbq s TYR 304 N -3.27 2.42 -0.03 1.13 2.02 -0.53 -4.91 117.35 114.17 1wbq s TYR 304 Ca -0.08 0.29 -0.31 0.00 -0.37 0.00 0.00 57.07 56.61 1wbq s TYR 304 Cb 0.08 -3.99 0.11 0.00 -0.40 0.00 0.00 41.96 37.76 1wbq s TYR 304 CO 0.90 -3.98 1.17 -0.98 -1.57 0.00 0.00 175.55 171.09 1wbq s ARG 305 N 2.57 0.55 0.39 -0.62 1.70 -1.26 -3.78 118.95 118.50 1wbq s ARG 305 Ca 0.75 -0.28 -0.27 0.00 -0.47 0.00 0.00 55.73 55.46 1wbq s ARG 305 Cb -0.41 0.21 -0.10 0.00 -0.57 0.00 0.00 34.95 34.08 1wbq s ARG 305 CO 0.33 -0.25 1.43 -2.14 -1.08 0.00 0.00 175.30 173.59 1wbq s PRO 306 N -2.64 4.04 0.00 3.89 0.02 -1.26 -3.11 135.00 135.94 1wbq s PRO 306 Ca 0.12 2.45 0.00 0.00 0.02 0.00 0.00 61.00 63.59 1wbq s PRO 306 Cb 0.02 -2.90 0.00 0.00 0.02 0.00 0.00 34.50 31.64 1wbq s PRO 306 CO -0.03 -0.54 0.00 0.41 -0.33 0.00 0.00 177.00 176.50 1wbq n GLY 307 N 0.55 3.25 0.00 0.52 0.00 -0.82 -4.96 105.19 103.74 1wbq n GLY 307 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.59 0.00 -4.08 2.61 5.66 -1.18 -4.77 114.28 110.92 1wbq n THR 308 Ca 0.00 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 1wbq n THR 308 Cb 0.00 -1.25 -0.08 0.00 -1.55 0.00 0.00 70.33 67.45 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 -1.00 0.04 0.21 1.09 1.04 -1.26 -1.01 113.70 112.80 1wbq s SER 309 Ca 0.00 -1.12 -0.10 0.00 0.48 0.00 0.00 55.95 55.21 1wbq s SER 309 Cb 0.00 0.47 0.16 0.00 0.10 0.00 0.00 66.02 66.75 1wbq s SER 309 CO 0.00 -0.97 1.86 0.40 0.98 0.00 0.00 173.24 175.51 1wbq h ILE 310 N 2.46 1.21 -0.21 -1.02 2.04 -1.76 -1.95 117.51 118.28 1wbq h ILE 310 Ca -0.31 -0.43 0.04 0.00 1.00 0.00 0.00 64.86 65.16 1wbq h ILE 310 Cb 1.25 0.12 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 1wbq h ILE 310 CO 0.45 0.21 -0.03 0.25 0.00 0.00 0.00 178.15 179.03 1wbq h LEU 311 N 1.04 -0.14 -0.16 1.44 5.85 -1.47 0.15 115.31 122.02 1wbq h LEU 311 Ca 0.28 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 59.04 1wbq h LEU 311 Cb -0.07 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 1wbq h LEU 311 CO -0.05 -0.04 0.06 -0.08 -0.34 0.00 0.00 178.44 177.98 1wbq h GLU 312 N 0.03 0.24 -0.70 1.25 4.81 -1.81 -2.37 114.58 116.05 1wbq h GLU 312 Ca 0.10 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.22 1wbq h GLU 312 Cb 0.14 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 1wbq h GLU 312 CO -0.19 0.34 0.21 0.28 -0.73 0.00 0.00 179.01 178.92 1wbq h VAL 313 N 0.10 1.25 -0.92 0.32 2.07 -1.26 -2.40 116.25 115.40 1wbq h VAL 313 Ca 0.05 -0.88 0.11 0.00 0.82 0.00 0.00 66.70 66.80 1wbq h VAL 313 Cb 0.19 0.49 -0.08 0.00 -1.52 0.00 0.00 31.29 30.38 1wbq h VAL 313 CO -0.00 0.34 0.55 0.74 0.02 0.00 0.00 177.57 179.22 1wbq h THR 314 N 1.03 0.91 -0.84 2.57 2.02 -0.77 -2.16 112.91 115.67 1wbq h THR 314 Ca 0.23 -0.31 0.04 0.00 0.77 0.00 0.00 66.41 67.14 1wbq h THR 314 Cb 0.30 -0.06 -0.05 0.00 -1.74 0.00 0.00 68.15 66.60 1wbq h THR 314 CO -0.01 0.16 0.55 1.23 0.37 0.00 0.00 175.52 177.83 1wbq h GLY 315 N 0.90 1.20 1.01 2.16 0.00 -0.90 -0.06 103.07 107.38 1wbq h GLY 315 Ca 0.45 -0.41 -0.11 0.00 0.00 0.00 0.00 47.33 47.26 1wbq h GLY 315 CO -0.26 0.35 -0.21 0.83 0.00 0.00 0.00 176.54 177.25 1wbq h GLU 316 N 1.03 0.79 -0.66 4.80 4.39 -1.37 -2.80 114.58 120.77 1wbq h GLU 316 Ca 0.34 -0.36 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 1wbq h GLU 316 Cb 0.05 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.66 1wbq h GLU 316 CO -0.10 0.99 0.32 0.28 -1.16 0.00 0.00 179.01 179.34 1wbq h VAL 317 N 0.59 1.22 -0.60 3.13 2.07 -0.78 -1.88 116.25 119.99 1wbq h VAL 317 Ca 0.08 -0.60 0.06 0.00 0.82 0.00 0.00 66.70 67.05 1wbq h VAL 317 Cb 0.77 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 1wbq h VAL 317 CO 0.06 0.25 0.32 0.58 0.02 0.00 0.00 177.57 178.80 1wbq h VAL 318 N 0.90 0.95 -0.41 2.57 2.07 -1.03 0.74 116.25 122.05 1wbq h VAL 318 Ca 0.23 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1wbq h VAL 318 Cb 0.10 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.15 1wbq h VAL 318 CO -0.03 0.11 0.25 -0.09 0.02 0.00 0.00 177.57 177.83 1wbq h ARG 319 N 0.60 0.54 -0.58 1.57 2.43 -1.18 0.12 114.38 117.87 1wbq h ARG 319 Ca 0.27 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.42 1wbq h ARG 319 Cb 0.18 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.58 1wbq h ARG 319 CO -0.18 0.39 0.36 0.82 -1.51 0.00 0.00 179.97 179.84 1wbq h ILE 320 N 0.54 1.08 0.09 1.20 2.04 -0.84 -1.13 117.51 120.48 1wbq h ILE 320 Ca 0.15 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.76 1wbq h ILE 320 Cb -0.03 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 36.36 1wbq h ILE 320 CO -0.03 0.13 -0.04 0.24 0.00 0.00 0.00 178.15 178.45 1wbq h MET 321 N 0.71 -0.12 -0.43 2.37 2.86 -0.44 -1.41 114.93 118.47 1wbq h MET 321 Ca 0.23 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 1wbq h MET 321 Cb 0.01 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 1wbq h MET 321 CO -0.09 0.17 0.29 0.28 1.06 0.00 0.00 176.91 178.61 1wbq h VAL 322 N -0.40 1.11 -0.38 -2.22 2.07 -0.74 0.18 116.25 115.87 1wbq h VAL 322 Ca -0.01 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.32 1wbq h VAL 322 Cb 0.34 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1wbq h VAL 322 CO 0.02 0.11 0.22 0.28 0.02 0.00 0.00 177.57 178.22 1wbq h SER 323 N 0.59 0.35 -0.47 0.57 0.02 -1.20 -0.78 113.55 112.63 1wbq h SER 323 Ca 0.16 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.09 1wbq h SER 323 Cb -0.07 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.38 1wbq h SER 323 CO -0.03 0.25 0.22 1.23 -1.14 0.00 0.00 176.83 177.36 1wbq h GLY 324 N 0.44 0.74 1.59 -3.77 0.00 -0.89 -2.04 103.07 99.14 1wbq h GLY 324 Ca 0.15 -0.37 -0.11 0.00 0.00 0.00 0.00 47.33 46.99 1wbq h GLY 324 CO -0.07 0.36 -0.36 1.41 0.00 0.00 0.00 176.54 177.88 1wbq h LEU 325 N 0.62 0.47 -0.42 3.11 3.38 -0.77 -2.54 115.31 119.18 1wbq h LEU 325 Ca 0.16 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1wbq h LEU 325 Cb 0.14 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1wbq h LEU 325 CO -0.02 0.79 0.17 0.58 0.09 0.00 0.00 178.44 180.06 1wbq h VAL 326 N 0.39 1.19 0.00 1.22 2.07 -1.01 0.23 116.25 120.33 1wbq h VAL 326 Ca 0.04 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 1wbq h VAL 326 Cb 0.81 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1wbq h VAL 326 CO 0.07 0.21 -0.07 0.11 0.02 0.00 0.00 177.57 177.91 1wbq h LYS 327 N 0.53 0.00 -0.01 1.57 1.57 -1.08 -1.88 116.57 117.27 1wbq h LYS 327 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1wbq h LYS 327 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1wbq h LYS 327 CO -0.01 0.07 -0.44 1.28 -0.57 0.00 0.00 179.45 179.77 1wbq n LEU 328 N -3.36 0.97 -0.06 2.94 4.77 -0.98 -4.96 117.00 116.32 1wbq n LEU 328 Ca -0.01 -0.26 -0.01 0.00 -0.03 0.00 0.00 56.01 55.70 1wbq n LEU 328 Cb 0.23 -0.14 -0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1wbq n LEU 328 CO 0.27 0.20 -0.01 0.61 -1.33 0.00 0.00 177.39 177.13 1wbq n GLY 329 N 1.42 0.48 0.15 -0.72 0.00 -0.71 -4.88 105.19 100.93 1wbq n GLY 329 Ca 0.09 -0.53 -0.18 0.00 0.00 0.00 0.00 46.02 45.39 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 1.38 -2.88 -0.61 2.04 -1.20 -3.41 117.51 112.83 1wbq h ILE 330 Ca -0.02 -2.65 -0.61 0.00 1.00 0.00 0.00 64.86 62.59 1wbq h ILE 330 Cb 0.09 2.71 -0.13 0.00 -0.74 0.00 0.00 36.82 38.75 1wbq h ILE 330 CO 0.02 0.79 -0.70 -0.76 0.00 0.00 0.00 178.15 177.50 1wbq s LEU 331 N -7.60 3.07 -0.05 1.44 1.43 -0.92 -4.89 118.68 111.17 1wbq s LEU 331 Ca -0.07 -0.55 0.01 0.00 -1.03 0.00 0.00 54.13 52.50 1wbq s LEU 331 Cb 0.07 -1.73 0.02 0.00 0.03 0.00 0.00 46.19 44.58 1wbq s LEU 331 CO 0.90 0.09 -0.05 -0.54 0.23 0.00 0.00 176.35 176.98 1wbq s LYS 332 N -2.95 0.93 0.00 1.70 1.02 -1.26 -4.23 119.74 114.95 1wbq s LYS 332 Ca 0.26 -0.14 0.00 0.00 0.02 0.00 0.00 55.97 56.11 1wbq s LYS 332 Cb -0.09 -0.91 0.00 0.00 -0.52 0.00 0.00 37.83 36.32 1wbq s LYS 332 CO 0.16 -0.07 0.00 0.41 -0.92 0.00 0.00 175.35 174.93 1wbq n GLY 333 N 4.04 0.85 3.72 -3.33 0.00 -1.26 -5.02 105.19 104.18 1wbq n GLY 333 Ca -0.24 -1.99 -0.42 0.00 0.00 0.00 0.00 46.02 43.37 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 7.42 0.16 1.61 2.15 -1.26 -4.97 116.67 117.78 1wbq s ASP 334 Ca 0.00 1.71 -0.16 0.00 0.43 0.00 0.00 52.55 54.53 1wbq s ASP 334 Cb 0.00 -2.58 0.07 0.00 -0.30 0.00 0.00 42.92 40.12 1wbq s ASP 334 CO 0.00 -0.18 1.74 0.58 -0.17 0.00 0.00 175.17 177.14 1wbq h VAL 335 N 4.49 0.86 -0.66 1.11 2.07 -1.97 0.11 116.25 122.27 1wbq h VAL 335 Ca -0.42 -0.08 -0.08 0.00 0.82 0.00 0.00 66.70 66.93 1wbq h VAL 335 Cb 1.22 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 1wbq h VAL 335 CO 0.74 0.04 0.08 0.44 0.02 0.00 0.00 177.57 178.89 1wbq h ASP 336 N 0.25 1.07 -0.33 0.57 3.32 -1.98 1.00 116.42 120.31 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 0.17 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 1wbq h ASP 336 CO -0.19 1.07 -0.03 -0.33 -1.72 0.00 0.00 179.24 178.04 1wbq h GLU 337 N 1.03 0.60 -0.61 3.56 5.08 -1.87 0.85 114.58 123.21 1wbq h GLU 337 Ca 0.20 -0.21 0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1wbq h GLU 337 Cb 0.47 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.64 1wbq h GLU 337 CO 0.02 0.75 0.37 -0.07 -1.00 0.00 0.00 179.01 179.07 1wbq h LEU 338 N 0.39 0.60 -0.29 1.33 3.38 -0.61 -1.03 115.31 119.08 1wbq h LEU 338 Ca 0.09 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1wbq h LEU 338 Cb 0.50 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1wbq h LEU 338 CO 0.02 0.41 0.19 0.40 0.09 0.00 0.00 178.44 179.56 1wbq h ILE 339 N 0.73 1.07 -0.68 1.22 2.04 -0.66 -0.36 117.51 120.87 1wbq h ILE 339 Ca 0.25 -0.14 0.08 0.00 1.00 0.00 0.00 64.86 66.05 1wbq h ILE 339 Cb 0.04 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 36.73 1wbq h ILE 339 CO -0.11 0.07 0.45 0.00 0.00 0.00 0.00 178.15 178.56 1wbq h ALA 340 N 1.10 1.81 -0.54 1.87 0.00 -0.31 -1.10 119.26 122.11 1wbq h ALA 340 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1wbq h ALA 340 Cb -0.04 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1wbq h ALA 340 CO -0.02 0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.29 1wbq n GLN 341 N -4.48 3.98 -4.09 0.00 10.64 -0.44 -4.95 117.38 118.04 1wbq n GLN 341 Ca 0.10 -2.66 -0.28 0.00 -1.83 0.00 0.00 57.00 52.33 1wbq n GLN 341 Cb 0.28 -2.02 -0.04 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 0.74 -0.33 0.13 2.61 3.02 -0.42 -4.85 115.26 116.17 1wbq n ASN 342 Ca 0.24 -1.08 0.12 0.00 -0.03 0.00 0.00 54.58 53.82 1wbq n ASN 342 Cb 0.96 -2.61 0.50 0.00 -0.61 0.00 0.00 39.78 38.02 1wbq n ASN 342 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wbq n ALA 343 N -4.44 1.63 0.28 5.41 0.00 -0.19 -1.74 120.51 121.45 1wbq n ALA 343 Ca -0.27 0.09 0.16 0.00 0.00 0.00 0.00 53.44 53.43 1wbq n ALA 343 Cb 0.66 -1.39 0.55 0.00 0.00 0.00 0.00 19.45 19.28 1wbq n ALA 343 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1wbq h HIS 344 N 0.00 0.00 -0.70 0.00 2.07 -1.89 -3.39 115.15 111.25 1wbq h HIS 344 Ca 0.00 0.00 0.15 0.00 -2.85 0.00 0.00 60.37 57.67 1wbq h HIS 344 Cb 0.35 0.00 -0.12 0.00 2.57 0.00 0.00 27.41 30.21 1wbq h HIS 344 CO 0.00 0.00 0.05 0.00 -3.07 0.00 0.00 177.93 174.91 1wbq h ARG 345 N 0.00 0.14 -0.13 5.12 2.47 -1.53 0.18 114.38 120.63 1wbq h ARG 345 Ca 0.00 -0.01 0.04 0.00 -1.26 0.00 0.00 59.98 58.75 1wbq h ARG 345 Cb 0.62 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.90 1wbq h ARG 345 CO 0.00 0.10 0.29 -1.35 0.56 0.00 0.00 179.97 179.56 1wbq h PRO 346 N 0.15 0.00 0.00 0.04 0.11 -1.83 -2.89 132.00 127.57 1wbq h PRO 346 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 1wbq h PRO 346 Cb 0.65 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.76 1wbq h PRO 346 CO -0.58 0.00 -1.49 1.19 -0.21 0.00 0.00 178.00 176.92 1wbq n PHE 347 N -3.31 0.00 -3.43 0.65 3.72 0.55 -4.84 117.46 110.80 1wbq n PHE 347 Ca 0.01 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.20 1wbq n PHE 347 Cb 0.38 -0.26 -0.11 0.00 -0.94 0.00 0.00 39.48 38.56 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 -2.80 -0.13 -1.36 1.38 5.36 -0.60 -0.78 117.98 119.05 1wbq s PHE 348 Ca -0.04 -0.62 0.12 0.00 -0.96 0.00 0.00 56.93 55.43 1wbq s PHE 348 Cb 0.08 -0.60 0.07 0.00 -0.34 0.00 0.00 43.02 42.23 1wbq s PHE 348 CO 0.51 -0.90 0.82 0.00 -1.46 0.00 0.00 175.22 174.19 1wbq n MET 349 N 4.94 0.99 -4.27 10.12 0.00 -1.22 -4.34 117.12 123.34 1wbq n MET 349 Ca 0.01 -1.06 -0.27 0.00 0.00 0.00 0.00 57.70 56.38 1wbq n MET 349 Cb 0.44 -1.20 -0.07 0.00 0.00 0.00 0.00 33.22 32.39 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 -1.11 2.36 0.61 3.17 -3.43 -1.26 -5.13 115.29 110.50 1wbq s HIS 350 Ca 0.13 -0.69 -0.16 0.00 -0.80 0.00 0.00 55.06 53.54 1wbq s HIS 350 Cb 0.10 -1.88 -0.03 0.00 -1.43 0.00 0.00 32.58 29.34 1wbq s HIS 350 CO 0.18 0.15 1.09 0.20 -2.00 0.00 0.00 174.74 174.36 1wbq s GLY 351 N -3.92 2.23 0.21 -1.38 0.00 -1.26 -4.97 107.32 98.22 1wbq s GLY 351 Ca 0.34 0.52 0.05 0.00 0.00 0.00 0.00 44.72 45.64 1wbq s GLY 351 CO 0.19 0.86 1.48 -2.00 0.00 0.00 0.00 173.10 173.62 1wbq h LEU 352 N 0.45 0.17 -7.46 0.66 5.85 -1.94 -3.46 115.31 109.58 1wbq h LEU 352 Ca -0.47 -0.12 -0.14 0.00 0.84 0.00 0.00 57.88 57.98 1wbq h LEU 352 Cb 1.24 -0.05 -0.24 0.00 0.37 0.00 0.00 40.66 41.98 1wbq h LEU 352 CO 0.56 0.86 -0.35 -0.44 -0.34 0.00 0.00 178.44 178.73 1wbq s SER 353 N -6.88 -0.27 0.12 1.25 0.01 -1.26 -0.60 113.70 106.08 1wbq s SER 353 Ca -0.02 0.46 0.04 0.00 1.31 0.00 0.00 55.95 57.74 1wbq s SER 353 Cb 0.11 0.54 -0.04 0.00 0.21 0.00 0.00 66.02 66.84 1wbq s SER 353 CO 0.80 -0.19 -0.10 -1.38 0.41 0.00 0.00 173.24 172.77 1wbq s HIS 354 N -0.24 1.20 0.72 2.43 -3.43 -1.26 -4.92 115.29 109.78 1wbq s HIS 354 Ca -0.04 -0.70 -0.16 0.00 -0.80 0.00 0.00 55.06 53.36 1wbq s HIS 354 Cb -0.03 -0.63 0.03 0.00 -1.43 0.00 0.00 32.58 30.52 1wbq s HIS 354 CO 0.01 0.05 1.24 -1.58 -2.00 0.00 0.00 174.74 172.46 1wbq s TRP 355 N -2.89 2.00 -0.02 0.38 0.23 -1.26 -0.90 118.94 116.49 1wbq s TRP 355 Ca 0.12 1.58 0.01 0.00 -2.03 0.00 0.00 56.10 55.78 1wbq s TRP 355 Cb -0.00 -3.55 0.01 0.00 0.03 0.00 0.00 33.47 29.95 1wbq s TRP 355 CO 0.00 -2.77 -0.04 -1.17 0.96 0.00 0.00 176.95 173.93 1wbq s LEU 356 N -4.99 1.72 0.00 2.99 2.96 -0.17 -1.43 118.68 119.75 1wbq s LEU 356 Ca 0.77 -0.10 0.00 0.00 -0.22 0.00 0.00 54.13 54.58 1wbq s LEU 356 Cb -0.32 -0.32 0.00 0.00 0.50 0.00 0.00 46.19 46.05 1wbq s LEU 356 CO 0.44 0.01 0.00 0.61 -1.32 0.00 0.00 176.35 176.10 1wbq n GLY 357 N 3.39 0.62 0.28 7.98 0.00 -1.26 -4.61 105.19 111.59 1wbq n GLY 357 Ca -0.18 0.38 0.16 0.00 0.00 0.00 0.00 46.02 46.38 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 -8.87 0.99 3.38 -1.95 -0.71 115.31 108.15 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 0.06 -0.86 -1.81 0.09 0.00 0.00 178.44 175.93 1wbq s ASP 359 N -5.79 3.41 0.11 -0.43 1.01 -1.26 -4.70 116.67 109.01 1wbq s ASP 359 Ca -0.02 -0.61 -0.17 0.00 0.71 0.00 0.00 52.55 52.45 1wbq s ASP 359 Cb 0.12 -0.35 -0.04 0.00 1.01 0.00 0.00 42.92 43.66 1wbq s ASP 359 CO 0.53 0.22 1.61 1.62 0.21 0.00 0.00 175.17 179.37 1wbq h VAL 360 N 3.99 1.21 -3.36 -1.27 3.04 -1.84 -3.07 116.25 114.95 1wbq h VAL 360 Ca -0.49 -0.71 -0.76 0.00 -1.01 0.00 0.00 66.70 63.74 1wbq h VAL 360 Cb 1.16 1.07 -0.23 0.00 -2.01 0.00 0.00 31.29 31.28 1wbq h VAL 360 CO 0.43 0.24 0.33 -1.00 -1.01 0.00 0.00 177.57 176.56 1wbq s HIS 361 N -5.33 3.55 0.65 3.17 3.76 -1.26 -4.36 115.29 115.47 1wbq s HIS 361 Ca -0.13 -1.79 -0.11 0.00 -0.15 0.00 0.00 55.06 52.88 1wbq s HIS 361 Cb 0.09 -3.97 -0.02 0.00 1.11 0.00 0.00 32.58 29.79 1wbq s HIS 361 CO 0.75 -1.15 1.05 0.34 -0.85 0.00 0.00 174.74 174.87 1wbq s ASP 362 N 2.65 5.93 0.83 1.40 2.15 -0.52 -5.00 116.67 124.12 1wbq s ASP 362 Ca 0.22 1.41 -0.11 0.00 0.43 0.00 0.00 52.55 54.50 1wbq s ASP 362 Cb -0.09 -2.38 0.09 0.00 -0.30 0.00 0.00 42.92 40.24 1wbq s ASP 362 CO -0.09 -1.06 1.09 0.68 -0.17 0.00 0.00 175.17 175.63 1wbq s VAL 363 N -3.18 3.00 0.00 1.11 -7.23 -1.26 -4.62 120.40 108.22 1wbq s VAL 363 Ca 0.56 0.33 0.00 0.00 -1.81 0.00 0.00 61.98 61.06 1wbq s VAL 363 Cb -0.12 -2.79 0.00 0.00 0.56 0.00 0.00 36.38 34.03 1wbq s VAL 363 CO 0.54 -0.43 0.00 0.61 -0.31 0.00 0.00 175.10 175.51 1wbq n GLY 364 N -1.11 3.96 3.69 2.32 0.00 -1.26 -4.52 105.19 108.27 1wbq n GLY 364 Ca 0.08 -1.43 -0.42 0.00 0.00 0.00 0.00 46.02 44.25 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 -1.41 3.98 -0.21 1.61 1.01 -1.26 -4.93 120.40 119.19 1wbq s VAL 365 Ca 0.00 1.37 0.19 0.00 0.00 0.00 0.00 61.98 63.53 1wbq s VAL 365 Cb 0.00 -3.88 0.03 0.00 0.00 0.00 0.00 36.38 32.54 1wbq s VAL 365 CO 0.00 0.03 1.19 1.88 0.00 0.00 0.00 175.10 178.20 1wbq h TYR 366 N 7.39 0.00 0.00 5.22 0.05 -1.98 -3.48 116.97 124.18 1wbq h TYR 366 Ca -0.37 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.41 1wbq h TYR 366 Cb 1.18 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.92 1wbq h TYR 366 CO 0.72 0.32 0.00 0.41 -1.05 0.00 0.00 178.16 178.56 1wbq n GLY 367 N 1.25 -2.28 3.70 3.88 0.00 -1.26 -1.70 105.19 108.78 1wbq n GLY 367 Ca -0.02 -1.48 -0.42 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 -2.19 2.75 -2.06 1.61 7.27 -1.26 -1.80 117.38 121.69 1wbq n GLN 368 Ca 0.00 0.99 -0.17 0.00 0.07 0.00 0.00 57.00 57.90 1wbq n GLN 368 Cb 0.00 -2.86 -0.03 0.00 2.41 0.00 0.00 30.24 29.76 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 4.64 -4.75 -3.58 1.69 8.00 -1.26 -1.89 116.55 119.40 1wbq n ASP 369 Ca 0.17 0.21 -0.22 0.00 0.71 0.00 0.00 54.79 55.66 1wbq n ASP 369 Cb 0.35 -4.10 0.07 0.00 -0.02 0.00 0.00 41.12 37.43 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 -2.61 -6.85 0.00 -1.24 1.74 -0.74 -4.25 116.66 102.71 1wbq n ARG 370 Ca -0.19 0.79 0.13 0.00 -0.77 0.00 0.00 57.85 57.82 1wbq n ARG 370 Cb 0.61 -5.76 0.42 0.00 -1.02 0.00 0.00 32.46 26.72 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 1.67 -4.74 0.55 3.41 -0.79 -1.59 113.62 109.08 1wbq n SER 371 Ca -0.14 -1.49 -0.42 0.00 -0.26 0.00 0.00 58.87 56.57 1wbq n SER 371 Cb 0.61 0.03 -0.02 0.00 -0.26 0.00 0.00 64.21 64.58 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 0.22 2.68 -2.16 4.33 0.63 -0.69 -4.83 116.66 116.85 1wbq n ARG 372 Ca 0.17 0.95 -0.42 0.00 -0.92 0.00 0.00 57.85 57.64 1wbq n ARG 372 Cb 0.39 -2.73 -0.03 0.00 0.45 0.00 0.00 32.46 30.54 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 -0.02 3.11 0.37 5.15 -1.09 -1.26 -4.47 121.20 122.99 1wbq s ILE 373 Ca 0.64 0.88 -0.24 0.00 -2.23 0.00 0.00 60.65 59.70 1wbq s ILE 373 Cb -0.50 -3.57 -0.10 0.00 -1.58 0.00 0.00 42.46 36.71 1wbq s ILE 373 CO 0.49 0.12 0.96 -0.76 -1.23 0.00 0.00 174.94 174.51 1wbq s LEU 374 N 0.17 4.18 0.08 2.97 1.43 -0.18 -4.89 118.68 122.43 1wbq s LEU 374 Ca 0.59 1.81 0.01 0.00 -1.03 0.00 0.00 54.13 55.52 1wbq s LEU 374 Cb -0.38 -4.22 -0.04 0.00 0.03 0.00 0.00 46.19 41.58 1wbq s LEU 374 CO 0.37 -0.23 -0.06 -1.61 0.23 0.00 0.00 176.35 175.06 1wbq s GLU 375 N -2.50 0.74 0.34 1.70 2.02 -1.26 -1.95 118.70 117.79 1wbq s GLU 375 Ca 0.55 -1.24 -0.28 0.00 0.02 0.00 0.00 54.97 54.02 1wbq s GLU 375 Cb -0.16 -0.10 -0.12 0.00 0.10 0.00 0.00 34.13 33.85 1wbq s GLU 375 CO 0.21 -0.04 1.30 -2.30 0.02 0.00 0.00 175.26 174.45 1wbq n PRO 376 N 0.17 2.16 0.00 0.39 -0.02 -1.26 -2.76 135.00 133.67 1wbq n PRO 376 Ca -0.14 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1wbq n PRO 376 Cb 0.60 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 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 2.04 3.76 -1.23 0.00 -0.09 -4.90 105.19 105.58 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 -0.98 4.43 -0.09 1.61 -1.94 -1.11 -0.96 119.30 120.26 1wbq s MET 378 Ca 0.00 1.87 0.04 0.00 -1.71 0.00 0.00 55.69 55.89 1wbq s MET 378 Cb 0.00 -3.01 0.00 0.00 2.01 0.00 0.00 34.83 33.83 1wbq s MET 378 CO 0.00 -0.00 -0.21 0.08 -0.01 0.00 0.00 175.02 174.88 1wbq s VAL 379 N -1.25 1.78 0.16 -6.03 1.01 -1.26 -0.60 120.40 114.21 1wbq s VAL 379 Ca 0.49 -0.86 -0.12 0.00 0.00 0.00 0.00 61.98 61.49 1wbq s VAL 379 Cb -0.33 -1.55 0.01 0.00 0.00 0.00 0.00 36.38 34.51 1wbq s VAL 379 CO 0.42 0.50 0.34 -1.48 0.00 0.00 0.00 175.10 174.88 1wbq s LEU 380 N 0.39 0.74 0.41 3.92 2.34 -0.39 -0.99 118.68 125.10 1wbq s LEU 380 Ca -0.16 -0.70 -0.01 0.00 0.06 0.00 0.00 54.13 53.31 1wbq s LEU 380 Cb -0.17 1.47 -0.02 0.00 -0.56 0.00 0.00 46.19 46.91 1wbq s LEU 380 CO 0.07 -0.91 0.64 0.42 -1.06 0.00 0.00 176.35 175.51 1wbq s THR 381 N -3.92 4.74 -0.17 5.48 -4.23 -0.07 -0.64 115.64 116.84 1wbq s THR 381 Ca 0.13 -0.31 -0.03 0.00 -1.18 0.00 0.00 61.69 60.30 1wbq s THR 381 Cb 0.02 -3.76 0.05 0.00 1.34 0.00 0.00 72.50 70.16 1wbq s THR 381 CO -0.03 -0.56 0.03 -0.69 -0.54 0.00 0.00 174.62 172.83 1wbq s VAL 382 N -2.49 0.48 -0.41 2.29 1.01 0.20 -4.09 120.40 117.38 1wbq s VAL 382 Ca 0.44 -0.42 0.08 0.00 0.00 0.00 0.00 61.98 62.09 1wbq s VAL 382 Cb -0.10 -0.92 0.28 0.00 0.00 0.00 0.00 36.38 35.64 1wbq s VAL 382 CO 0.39 -0.12 0.70 -1.84 0.00 0.00 0.00 175.10 174.23 1wbq n GLU 383 N 5.08 0.82 -1.70 2.72 0.28 0.23 -1.45 120.64 126.61 1wbq n GLU 383 Ca -0.09 -2.85 -0.35 0.00 -0.16 0.00 0.00 57.16 53.71 1wbq n GLU 383 Cb 0.48 -1.36 0.06 0.00 1.43 0.00 0.00 31.44 32.05 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 -0.99 2.54 0.13 3.44 0.04 -1.24 -4.77 135.00 134.16 1wbq s PRO 384 Ca 0.34 1.77 -0.17 0.00 0.04 0.00 0.00 61.00 62.98 1wbq s PRO 384 Cb 0.24 -1.88 0.04 0.00 0.04 0.00 0.00 34.50 32.94 1wbq s PRO 384 CO -0.12 -1.53 0.44 0.20 0.04 0.00 0.00 177.00 176.03 1wbq s GLY 385 N -1.87 -0.33 -0.04 0.56 0.00 -1.26 -2.66 107.32 101.71 1wbq s GLY 385 Ca 0.75 0.06 0.01 0.00 0.00 0.00 0.00 44.72 45.54 1wbq s GLY 385 CO 0.40 -0.21 -0.03 1.08 0.00 0.00 0.00 173.10 174.34 1wbq s LEU 386 N -2.76 1.23 -0.18 0.66 1.43 0.14 -4.51 118.68 114.69 1wbq s LEU 386 Ca 0.02 -0.11 -0.01 0.00 -1.03 0.00 0.00 54.13 53.00 1wbq s LEU 386 Cb 0.01 -0.41 0.05 0.00 0.03 0.00 0.00 46.19 45.87 1wbq s LEU 386 CO -0.12 -0.08 -0.02 -0.31 0.23 0.00 0.00 176.35 176.06 1wbq s TYR 387 N 1.03 1.46 -0.31 0.29 1.51 0.04 -1.06 117.35 120.31 1wbq s TYR 387 Ca -0.09 -1.01 -0.08 0.00 -1.01 0.00 0.00 57.07 54.88 1wbq s TYR 387 Cb -0.14 -1.20 0.01 0.00 -0.11 0.00 0.00 41.96 40.52 1wbq s TYR 387 CO -0.01 -0.61 0.11 0.42 -1.11 0.00 0.00 175.55 174.35 1wbq s ILE 388 N 1.71 4.10 0.57 2.71 -1.09 0.60 -4.36 121.20 125.44 1wbq s ILE 388 Ca -0.00 -0.72 -0.20 0.00 -2.23 0.00 0.00 60.65 57.49 1wbq s ILE 388 Cb -0.16 -3.16 -0.04 0.00 -1.58 0.00 0.00 42.46 37.52 1wbq s ILE 388 CO -0.07 0.01 1.30 0.00 -1.23 0.00 0.00 174.94 174.95 1wbq s ALA 389 N 1.51 2.68 0.57 9.38 0.00 -1.26 -0.64 121.76 133.99 1wbq s ALA 389 Ca 0.02 1.22 0.28 0.00 0.00 0.00 0.00 51.96 53.48 1wbq s ALA 389 Cb -0.18 -3.53 1.50 0.00 0.00 0.00 0.00 23.12 20.91 1wbq s ALA 389 CO 0.03 -1.33 1.98 -1.35 0.00 0.00 0.00 175.76 175.09 1wbq h PRO 390 N 1.20 0.00 -0.39 0.00 0.11 -1.91 -1.50 132.00 129.51 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 0.56 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.95 1wbq n ASP 391 N -3.97 3.74 -4.77 -2.05 5.75 -1.26 -4.65 116.55 109.35 1wbq n ASP 391 Ca 0.08 -2.49 -0.38 0.00 -0.01 0.00 0.00 54.79 51.98 1wbq n ASP 391 Cb 0.58 -0.43 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 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 -1.89 3.07 -1.23 2.12 0.00 -0.57 -4.92 121.76 118.34 1wbq s ALA 392 Ca 0.37 1.12 -0.16 0.00 0.00 0.00 0.00 51.96 53.29 1wbq s ALA 392 Cb 0.25 -3.45 0.12 0.00 0.00 0.00 0.00 23.12 20.04 1wbq s ALA 392 CO 0.15 -0.84 1.57 -1.21 0.00 0.00 0.00 175.76 175.43 1wbq s GLU 393 N -2.53 4.00 0.23 0.00 0.41 -1.26 -4.90 118.70 114.64 1wbq s GLU 393 Ca 0.62 -2.20 -0.08 0.00 -0.41 0.00 0.00 54.97 52.90 1wbq s GLU 393 Cb -0.34 -5.30 -0.02 0.00 -1.78 0.00 0.00 34.13 26.69 1wbq s GLU 393 CO 0.43 -2.02 0.33 0.14 -0.49 0.00 0.00 175.26 173.65 1wbq s VAL 394 N 3.04 0.00 0.15 2.63 -7.23 -1.26 -5.03 120.40 112.70 1wbq s VAL 394 Ca 0.48 -1.65 -0.34 0.00 -1.81 0.00 0.00 61.98 58.66 1wbq s VAL 394 Cb 0.00 -2.32 -0.15 0.00 0.56 0.00 0.00 36.38 34.47 1wbq s VAL 394 CO 0.03 -0.00 1.37 -2.65 -0.31 0.00 0.00 175.10 173.53 1wbq n PRO 395 N -0.33 1.55 0.20 4.82 -0.02 -1.26 -4.85 135.00 135.11 1wbq n PRO 395 Ca -0.00 0.56 0.15 0.00 -2.02 0.00 0.00 63.50 62.18 1wbq n PRO 395 Cb 0.64 -2.20 0.77 0.00 -0.02 0.00 0.00 33.50 32.69 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 4.53 0.00 0.00 -0.52 4.22 -2.00 -2.39 114.58 118.42 1wbq h GLU 396 Ca -0.45 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 58.98 1wbq h GLU 396 Cb 1.31 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.56 1wbq h GLU 396 CO 0.78 0.00 -0.01 -0.56 -2.18 0.00 0.00 179.01 177.04 1wbq h GLN 397 N 0.00 0.00 -0.01 1.92 -0.00 -2.02 -3.08 115.11 111.93 1wbq h GLN 397 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.73 1wbq h GLN 397 Cb 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.84 1wbq h GLN 397 CO -0.00 0.01 -0.55 0.66 -0.00 0.00 0.00 178.83 178.94 1wbq n TYR 398 N -3.10 0.00 -2.30 0.06 4.01 -0.90 -4.83 117.16 110.09 1wbq n TYR 398 Ca -0.00 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.33 1wbq n TYR 398 Cb 0.26 -0.09 -0.03 0.00 -0.31 0.00 0.00 39.34 39.17 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 -2.74 4.50 -0.56 -0.72 0.52 -1.17 -3.37 118.95 115.42 1wbq s ARG 399 Ca 0.16 2.00 0.00 0.00 -0.52 0.00 0.00 55.73 57.36 1wbq s ARG 399 Cb 0.18 -3.14 0.00 0.00 0.52 0.00 0.00 34.95 32.51 1wbq s ARG 399 CO 0.66 0.01 0.00 0.41 0.02 0.00 0.00 175.30 176.40 1wbq n GLY 400 N 1.10 0.36 3.47 -3.53 0.00 0.18 -4.82 105.19 101.95 1wbq n GLY 400 Ca -0.00 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.28 4.17 -0.16 -0.61 1.01 -1.00 -4.00 121.20 118.33 1wbq s ILE 401 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.42 1wbq s ILE 401 Cb 0.00 -2.90 0.03 0.00 0.01 0.00 0.00 42.46 39.59 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 1.09 1.15 -0.07 6.18 0.00 -1.26 -0.29 107.32 114.12 1wbq s GLY 402 Ca 0.03 -0.98 0.01 0.00 0.00 0.00 0.00 44.72 43.78 1wbq s GLY 402 CO 0.02 0.60 -0.06 -0.42 0.00 0.00 0.00 173.10 173.24 1wbq s ILE 403 N 1.47 0.78 0.01 0.90 1.01 -0.22 -4.71 121.20 120.44 1wbq s ILE 403 Ca 0.03 -0.21 0.02 0.00 0.00 0.00 0.00 60.65 60.49 1wbq s ILE 403 Cb -0.14 -0.79 -0.01 0.00 0.01 0.00 0.00 42.46 41.53 1wbq s ILE 403 CO -0.10 0.30 -0.07 -0.60 0.00 0.00 0.00 174.94 174.47 1wbq s ARG 404 N 1.21 0.53 -0.10 2.79 3.52 -1.26 -0.69 118.95 124.95 1wbq s ARG 404 Ca -0.06 -0.35 0.00 0.00 -0.13 0.00 0.00 55.73 55.20 1wbq s ARG 404 Cb -0.14 -0.47 0.02 0.00 -1.56 0.00 0.00 34.95 32.80 1wbq s ARG 404 CO -0.02 0.12 -0.09 0.42 -0.81 0.00 0.00 175.30 174.93 1wbq s ILE 405 N -0.41 1.04 -0.07 4.11 1.01 -1.09 -3.49 121.20 122.31 1wbq s ILE 405 Ca 0.00 -0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.33 1wbq s ILE 405 Cb -0.04 -1.04 0.02 0.00 0.01 0.00 0.00 42.46 41.41 1wbq s ILE 405 CO -0.00 0.36 -0.07 -0.70 0.00 0.00 0.00 174.94 174.54 1wbq s GLU 406 N 1.45 1.19 0.28 2.79 2.12 -0.43 -3.63 118.70 122.48 1wbq s GLU 406 Ca 0.00 -0.19 0.11 0.00 0.36 0.00 0.00 54.97 55.25 1wbq s GLU 406 Cb -0.13 -1.18 -0.05 0.00 0.26 0.00 0.00 34.13 33.02 1wbq s GLU 406 CO -0.05 -0.13 -0.13 -0.51 -0.54 0.00 0.00 175.26 173.90 1wbq s ASP 407 N 1.18 3.89 -0.13 -1.70 1.01 -0.53 -2.85 116.67 117.54 1wbq s ASP 407 Ca -0.06 -0.94 -0.00 0.00 0.71 0.00 0.00 52.55 52.26 1wbq s ASP 407 Cb -0.14 -0.46 -0.02 0.00 1.01 0.00 0.00 42.92 43.31 1wbq s ASP 407 CO -0.02 -0.01 -0.12 -1.81 0.21 0.00 0.00 175.17 173.43 1wbq s ASP 408 N -3.57 4.10 0.14 0.27 1.01 -1.26 -0.63 116.67 116.73 1wbq s ASP 408 Ca 0.31 -0.29 0.05 0.00 0.71 0.00 0.00 52.55 53.33 1wbq s ASP 408 Cb -0.05 -1.57 -0.04 0.00 1.01 0.00 0.00 42.92 42.28 1wbq s ASP 408 CO 0.17 0.18 -0.12 0.27 0.21 0.00 0.00 175.17 175.88 1wbq s ILE 409 N 0.25 1.27 -0.06 0.77 -4.36 0.19 -0.32 121.20 118.94 1wbq s ILE 409 Ca -0.08 -1.95 0.06 0.00 -0.26 0.00 0.00 60.65 58.42 1wbq s ILE 409 Cb -0.15 -1.74 -0.01 0.00 1.25 0.00 0.00 42.46 41.81 1wbq s ILE 409 CO 0.05 -0.62 -0.24 0.54 0.24 0.00 0.00 174.94 174.91 1wbq s VAL 410 N -2.87 2.17 0.04 8.37 0.11 -0.60 -1.26 120.40 126.37 1wbq s VAL 410 Ca 0.14 -1.03 -0.30 0.00 -2.93 0.00 0.00 61.98 57.86 1wbq s VAL 410 Cb -0.00 -1.79 -0.05 0.00 -1.53 0.00 0.00 36.38 33.01 1wbq s VAL 410 CO 0.02 0.57 1.09 -0.63 -3.33 0.00 0.00 175.10 172.82 1wbq s ILE 411 N -0.17 4.40 0.48 7.04 -1.09 0.23 -0.49 121.20 131.61 1wbq s ILE 411 Ca -0.03 1.74 0.06 0.00 -2.23 0.00 0.00 60.65 60.19 1wbq s ILE 411 Cb -0.14 -4.12 0.00 0.00 -1.58 0.00 0.00 42.46 36.63 1wbq s ILE 411 CO 0.04 0.15 0.35 0.42 -1.23 0.00 0.00 174.94 174.66 1wbq s THR 412 N 0.96 2.07 0.48 2.92 -4.23 0.25 -0.91 115.64 117.18 1wbq s THR 412 Ca 0.55 -1.49 0.26 0.00 -1.18 0.00 0.00 61.69 59.83 1wbq s THR 412 Cb -0.26 -2.56 0.45 0.00 1.34 0.00 0.00 72.50 71.47 1wbq s THR 412 CO 0.29 0.00 1.86 -0.33 -0.54 0.00 0.00 174.62 175.90 1wbq h GLU 413 N 0.97 0.17 0.00 3.99 4.39 -1.96 -2.94 114.58 119.20 1wbq h GLU 413 Ca -0.39 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.30 1wbq h GLU 413 Cb 1.28 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 1wbq h GLU 413 CO 0.60 0.11 0.00 0.25 -1.16 0.00 0.00 179.01 178.81 1wbq n THR 414 N -4.38 0.00 0.00 1.13 -2.24 -1.26 -4.71 114.28 102.82 1wbq n THR 414 Ca 0.20 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 1wbq n THR 414 Cb 0.90 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 70.13 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 0.53 0.81 3.27 3.38 0.00 -1.11 -4.72 105.19 107.35 1wbq n GLY 415 Ca 0.00 0.29 -0.10 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 -0.20 1.61 2.20 -1.25 -0.58 114.94 118.64 1wbq s ASN 416 Ca 0.00 -0.44 -0.02 0.00 -0.94 0.00 0.00 52.86 51.46 1wbq s ASN 416 Cb 0.00 0.41 0.00 0.00 -2.00 0.00 0.00 41.25 39.66 1wbq s ASN 416 CO 0.00 -0.78 -0.11 -0.70 -2.94 0.00 0.00 177.10 172.56 1wbq s GLU 417 N -3.73 3.21 -0.31 3.55 2.12 0.36 -4.85 118.70 119.05 1wbq s GLU 417 Ca 0.03 -0.71 -0.29 0.00 0.36 0.00 0.00 54.97 54.36 1wbq s GLU 417 Cb 0.03 -2.81 0.02 0.00 0.26 0.00 0.00 34.13 31.62 1wbq s GLU 417 CO -0.11 -0.19 1.05 1.21 -0.54 0.00 0.00 175.26 176.68 1wbq s ASN 418 N 1.37 6.93 0.00 -1.70 3.84 -1.26 -1.55 114.94 122.57 1wbq s ASN 418 Ca 0.05 1.06 0.27 0.00 0.21 0.00 0.00 52.86 54.45 1wbq s ASN 418 Cb -0.14 -2.53 0.92 0.00 -0.55 0.00 0.00 41.25 38.95 1wbq s ASN 418 CO -0.07 -0.84 1.68 0.18 -2.79 0.00 0.00 177.10 175.26 1wbq n LEU 419 N 6.77 0.53 -0.24 3.21 4.77 0.56 -4.21 117.00 128.40 1wbq n LEU 419 Ca 0.11 0.02 0.04 0.00 -0.03 0.00 0.00 56.01 56.16 1wbq n LEU 419 Cb 0.47 -0.24 0.06 0.00 -2.33 0.00 0.00 43.42 41.39 1wbq n LEU 419 CO 0.58 0.11 0.41 0.35 -1.33 0.00 0.00 177.39 177.51 1wbq n THR 420 N -1.13 0.90 0.73 -5.08 -2.24 -1.25 -4.00 114.28 102.22 1wbq n THR 420 Ca 0.10 -1.07 0.11 0.00 -2.27 0.00 0.00 64.05 60.92 1wbq n THR 420 Cb 0.32 0.21 0.46 0.00 -2.10 0.00 0.00 70.33 69.22 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 2.00 0.77 6.98 0.00 -1.26 -3.25 120.51 125.08 1wbq n ALA 421 Ca 0.07 -0.07 0.09 0.00 0.00 0.00 0.00 53.44 53.53 1wbq n ALA 421 Cb 0.63 -1.36 0.43 0.00 0.00 0.00 0.00 19.45 19.15 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 -1.55 0.00 -4.64 0.00 3.41 -1.26 -4.48 113.62 105.09 1wbq n SER 422 Ca 0.05 0.23 -0.35 0.00 -0.26 0.00 0.00 58.87 58.54 1wbq n SER 422 Cb 0.26 -0.38 -0.10 0.00 -0.26 0.00 0.00 64.21 63.74 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 -2.75 4.63 0.64 -3.33 0.11 -1.20 -4.90 120.40 113.58 1wbq s VAL 423 Ca 0.14 -0.10 -0.17 0.00 -2.93 0.00 0.00 61.98 58.92 1wbq s VAL 423 Cb 0.12 -3.04 -0.01 0.00 -1.53 0.00 0.00 36.38 31.92 1wbq s VAL 423 CO 0.30 0.51 1.18 0.68 -3.33 0.00 0.00 175.10 174.43 1wbq s VAL 424 N 0.01 2.75 0.00 2.04 -7.23 -1.26 -4.98 120.40 111.73 1wbq s VAL 424 Ca 0.05 0.41 0.00 0.00 -1.81 0.00 0.00 61.98 60.63 1wbq s VAL 424 Cb -0.12 -3.05 0.00 0.00 0.56 0.00 0.00 36.38 33.77 1wbq s VAL 424 CO 0.01 -0.15 0.00 2.29 -0.31 0.00 0.00 175.10 176.94 1wbq n LYS 425 N -2.03 4.95 -2.02 4.82 2.85 -1.26 -4.90 118.16 120.56 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 -0.56 -0.03 0.00 -0.65 0.00 0.00 35.03 34.30 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 -0.31 4.27 0.22 -1.58 1.02 -1.26 -4.89 119.74 117.21 1wbq s LYS 426 Ca 0.00 2.28 -0.09 0.00 0.02 0.00 0.00 55.97 58.18 1wbq s LYS 426 Cb 0.00 -3.14 0.33 0.00 -0.52 0.00 0.00 37.83 34.50 1wbq s LYS 426 CO 0.00 -0.46 1.71 -1.35 -0.92 0.00 0.00 175.35 174.34 1wbq h PRO 427 N 5.66 0.30 -0.78 -1.68 0.11 -1.99 -0.83 132.00 132.79 1wbq h PRO 427 Ca -0.45 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 65.69 1wbq h PRO 427 Cb 1.21 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 32.20 1wbq h PRO 427 CO 0.82 0.20 0.49 0.93 -0.21 0.00 0.00 178.00 180.22 1wbq h GLU 428 N 0.31 0.89 -0.15 1.05 3.07 -2.00 -1.66 114.58 116.10 1wbq h GLU 428 Ca 0.33 -0.05 -0.17 0.00 -0.50 0.00 0.00 59.36 58.97 1wbq h GLU 428 Cb 0.49 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.19 1wbq h GLU 428 CO -0.39 0.59 -0.60 0.93 -1.40 0.00 0.00 179.01 178.14 1wbq h GLU 429 N 0.92 0.50 0.01 2.33 5.08 -1.58 -0.87 114.58 120.97 1wbq h GLU 429 Ca 0.33 -0.34 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1wbq h GLU 429 Cb 0.09 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1wbq h GLU 429 CO -0.14 0.95 -0.01 0.82 -1.00 0.00 0.00 179.01 179.63 1wbq h ILE 430 N 0.38 1.04 -0.60 3.13 2.04 -1.03 -0.98 117.51 121.49 1wbq h ILE 430 Ca -0.00 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.71 1wbq h ILE 430 Cb 1.15 1.14 -0.03 0.00 -0.74 0.00 0.00 36.82 38.33 1wbq h ILE 430 CO 0.11 0.04 0.40 -0.33 0.00 0.00 0.00 178.15 178.36 1wbq h GLU 431 N -0.08 0.79 -0.82 2.37 5.08 -1.11 -1.83 114.58 118.99 1wbq h GLU 431 Ca -0.00 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 1wbq h GLU 431 Cb 0.07 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 1wbq h GLU 431 CO 0.00 0.53 0.36 0.00 -1.00 0.00 0.00 179.01 178.90 1wbq h ALA 432 N 1.22 1.06 -0.45 3.43 0.00 -1.09 -0.08 119.26 123.36 1wbq h ALA 432 Ca 0.22 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1wbq h ALA 432 Cb -0.09 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.35 1wbq h ALA 432 CO -0.05 0.67 0.29 1.25 0.00 0.00 0.00 179.25 181.42 1wbq h LEU 433 N 1.19 0.50 -0.22 0.00 5.85 -0.77 -1.65 115.31 120.21 1wbq h LEU 433 Ca 0.28 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.90 1wbq h LEU 433 Cb 0.18 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.08 1wbq h LEU 433 CO -0.03 0.36 -0.20 0.24 -0.34 0.00 0.00 178.44 178.47 1wbq h MET 434 N 0.60 0.52 -0.48 1.25 2.86 -1.07 -2.25 114.93 116.37 1wbq h MET 434 Ca 0.17 -0.27 0.07 0.00 -2.06 0.00 0.00 59.70 57.61 1wbq h MET 434 Cb -0.06 0.01 -0.06 0.00 0.06 0.00 0.00 31.60 31.55 1wbq h MET 434 CO -0.04 0.85 0.14 0.28 1.06 0.00 0.00 176.91 179.19 1wbq h VAL 435 N 0.21 0.79 -0.71 -2.22 2.07 -0.95 -1.04 116.25 114.40 1wbq h VAL 435 Ca 0.04 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.46 1wbq h VAL 435 Cb 0.75 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 1wbq h VAL 435 CO 0.05 0.05 0.45 0.00 0.02 0.00 0.00 177.57 178.14 1wbq h ALA 436 N 1.34 0.90 -0.20 1.67 0.00 -1.22 -2.26 119.26 119.50 1wbq h ALA 436 Ca 0.23 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 1wbq h ALA 436 Cb 0.28 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1wbq h ALA 436 CO -0.27 0.36 -0.26 0.00 0.00 0.00 0.00 179.25 179.07 1wbq h ALA 437 N 1.24 1.19 0.00 0.00 0.00 -1.01 -2.83 119.26 117.85 1wbq h ALA 437 Ca 0.26 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1wbq h ALA 437 Cb -0.06 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1wbq h ALA 437 CO -0.05 0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.72 1wbq h ARG 438 N 0.33 0.00 0.00 0.00 3.08 -0.77 -3.50 114.38 113.51 1wbq h ARG 438 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1wbq h ARG 438 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.69 1wbq h ARG 438 CO 0.05 0.00 0.00 1.63 -1.07 0.00 0.00 179.97 180.58