#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wbi s GLN 23 N 0.00 4.08 0.55 5.55 0.74 -1.26 -4.90 119.66 124.43 2wbi s GLN 23 Ca 0.00 1.08 -0.07 0.00 0.05 0.00 0.00 55.36 56.42 2wbi s GLN 23 Cb 0.00 -2.16 -0.02 0.00 1.10 0.00 0.00 33.01 31.93 2wbi s GLN 23 CO 0.00 -0.16 0.89 0.95 -0.55 0.00 0.00 175.29 176.42 2wbi s THR 24 N -2.32 4.44 0.14 -0.34 -4.23 -1.26 -4.95 115.64 107.12 2wbi s THR 24 Ca 0.61 0.30 -0.15 0.00 -1.18 0.00 0.00 61.69 61.27 2wbi s THR 24 Cb -0.10 -3.73 0.01 0.00 1.34 0.00 0.00 72.50 70.02 2wbi s THR 24 CO 0.20 -0.80 1.70 0.08 -0.54 0.00 0.00 174.62 175.27 2wbi h ARG 25 N -0.05 0.64 -0.24 3.99 -0.00 -1.99 -0.55 114.38 116.18 2wbi h ARG 25 Ca -0.46 -0.11 0.02 0.00 -0.00 0.00 0.00 59.98 59.44 2wbi h ARG 25 Cb 1.22 -0.11 -0.02 0.00 -0.00 0.00 0.00 29.97 31.06 2wbi h ARG 25 CO 0.62 0.57 0.09 -0.22 -0.00 0.00 0.00 179.97 181.03 2wbi h LYS 26 N 0.55 0.20 -0.83 0.08 3.64 -1.95 -1.65 116.57 116.61 2wbi h LYS 26 Ca 0.15 -0.01 0.18 0.00 -1.27 0.00 0.00 60.65 59.69 2wbi h LYS 26 Cb 0.17 -0.05 -0.11 0.00 -0.41 0.00 0.00 32.23 31.83 2wbi h LYS 26 CO -0.01 0.13 0.34 0.78 -2.27 0.00 0.00 179.45 178.42 2wbi h GLY 27 N 0.21 1.32 1.04 5.01 0.00 -1.80 0.54 103.07 109.38 2wbi h GLY 27 Ca 0.10 -0.15 -0.10 0.00 0.00 0.00 0.00 47.33 47.18 2wbi h GLY 27 CO -0.10 -0.18 -0.12 -1.61 0.00 0.00 0.00 176.54 174.54 2wbi h GLN 28 N 0.42 0.90 -0.08 4.80 4.15 -0.62 -2.16 115.11 122.52 2wbi h GLN 28 Ca 0.48 -0.35 -0.01 0.00 0.77 0.00 0.00 58.65 59.54 2wbi h GLN 28 Cb 0.83 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.47 2wbi h GLN 28 CO -0.47 1.00 0.01 0.93 -1.93 0.00 0.00 178.83 178.36 2wbi h GLU 29 N 0.74 0.13 -0.87 1.69 5.08 -0.33 -2.03 114.58 118.98 2wbi h GLU 29 Ca 0.12 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 2wbi h GLU 29 Cb 0.67 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.86 2wbi h GLU 29 CO 0.05 0.38 0.49 0.28 -1.00 0.00 0.00 179.01 179.21 2wbi h VAL 30 N -0.13 1.25 -0.30 3.13 2.07 -0.98 -0.70 116.25 120.59 2wbi h VAL 30 Ca 0.02 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 66.94 2wbi h VAL 30 Cb 0.32 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 2wbi h VAL 30 CO 0.00 0.28 0.20 0.25 0.02 0.00 0.00 177.57 178.31 2wbi h LEU 31 N 1.22 0.34 -0.62 2.57 5.85 -1.28 -0.48 115.31 122.92 2wbi h LEU 31 Ca 0.31 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 59.08 2wbi h LEU 31 Cb 0.01 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 2wbi h LEU 31 CO -0.05 0.25 0.32 0.40 -0.34 0.00 0.00 178.44 179.02 2wbi h ILE 32 N 0.40 0.94 -0.75 4.05 2.04 -0.56 -0.81 117.51 122.82 2wbi h ILE 32 Ca 0.11 -0.20 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 2wbi h ILE 32 Cb -0.04 0.29 -0.04 0.00 -0.74 0.00 0.00 36.82 36.29 2wbi h ILE 32 CO -0.02 0.11 0.40 0.11 0.00 0.00 0.00 178.15 178.74 2wbi h LYS 33 N 0.60 1.06 -0.27 2.37 1.57 -0.75 -2.25 116.57 118.90 2wbi h LYS 33 Ca 0.28 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.90 2wbi h LYS 33 Cb 0.20 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2wbi h LYS 33 CO -0.19 0.80 0.07 0.28 -0.57 0.00 0.00 179.45 179.84 2wbi h VAL 34 N 1.05 1.21 -0.40 0.50 2.07 -0.43 -1.39 116.25 118.86 2wbi h VAL 34 Ca 0.26 -0.70 0.07 0.00 0.82 0.00 0.00 66.70 67.15 2wbi h VAL 34 Cb 0.06 1.16 -0.06 0.00 -1.52 0.00 0.00 31.29 30.93 2wbi h VAL 34 CO -0.04 0.23 0.04 0.11 0.02 0.00 0.00 177.57 177.93 2wbi h LYS 35 N 0.27 0.15 0.55 1.57 1.57 -1.09 0.16 116.57 119.75 2wbi h LYS 35 Ca 0.09 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 2wbi h LYS 35 Cb 0.28 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.55 2wbi h LYS 35 CO 0.00 0.10 -0.34 1.25 -0.57 0.00 0.00 179.45 179.89 2wbi h HIS 36 N 0.15 -0.89 -0.78 -1.35 2.76 -1.25 -0.69 115.15 113.11 2wbi h HIS 36 Ca 0.20 -0.01 0.16 0.00 -2.20 0.00 0.00 60.37 58.51 2wbi h HIS 36 Cb 0.26 0.32 -0.10 0.00 1.55 0.00 0.00 27.41 29.43 2wbi h HIS 36 CO -0.24 -0.52 0.30 0.35 -1.30 0.00 0.00 177.93 176.53 2wbi h PHE 37 N -0.84 0.51 0.52 5.26 3.57 -1.04 0.14 116.94 125.05 2wbi h PHE 37 Ca -0.07 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.45 2wbi h PHE 37 Cb 0.68 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.31 2wbi h PHE 37 CO -0.10 0.03 -0.31 1.98 -2.23 0.00 0.00 178.31 177.68 2wbi h MET 38 N 0.42 -0.76 -0.30 1.11 4.05 -0.38 0.52 114.93 119.60 2wbi h MET 38 Ca 0.44 0.05 -0.04 0.00 -0.28 0.00 0.00 59.70 59.87 2wbi h MET 38 Cb 0.70 0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 31.66 2wbi h MET 38 CO -0.43 -0.51 -0.00 0.87 0.23 0.00 0.00 176.91 177.07 2wbi h LYS 39 N -0.79 0.46 0.00 0.39 1.79 -0.02 -0.61 116.57 117.79 2wbi h LYS 39 Ca -0.06 -0.09 -0.28 0.00 -2.18 0.00 0.00 60.65 58.04 2wbi h LYS 39 Cb 0.64 -0.07 -0.05 0.00 -1.58 0.00 0.00 32.23 31.17 2wbi h LYS 39 CO 0.06 0.49 -2.13 1.04 -1.08 0.00 0.00 179.45 177.84 2wbi n GLN 40 N -4.30 0.67 0.05 3.15 1.13 0.37 -4.45 117.38 113.99 2wbi n GLN 40 Ca 0.01 0.03 0.00 0.00 -1.94 0.00 0.00 57.00 55.10 2wbi n GLN 40 Cb 0.23 -1.59 0.00 0.00 0.11 0.00 0.00 30.24 28.99 2wbi n GLN 40 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2wbi n HIS 41 N -2.73 -0.22 0.31 1.08 8.25 0.14 -4.76 115.22 117.28 2wbi n HIS 41 Ca -0.24 0.04 -0.12 0.00 -0.26 0.00 0.00 57.72 57.14 2wbi n HIS 41 Cb 1.02 0.07 -0.06 0.00 1.12 0.00 0.00 29.99 32.14 2wbi n HIS 41 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2wbi h ILE 42 N 0.00 0.00 -0.49 1.59 2.04 -1.36 -3.04 117.51 116.25 2wbi h ILE 42 Ca 0.00 -0.04 0.07 0.00 1.00 0.00 0.00 64.86 65.89 2wbi h ILE 42 Cb 0.23 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.25 2wbi h ILE 42 CO 0.00 0.00 0.15 -0.07 0.00 0.00 0.00 178.15 178.23 2wbi h LEU 43 N -0.83 0.12 -1.77 1.44 3.38 -1.37 0.27 115.31 116.54 2wbi h LEU 43 Ca -0.08 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2wbi h LEU 43 Cb 0.61 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2wbi h LEU 43 CO 0.13 0.09 0.10 -0.65 0.09 0.00 0.00 178.44 178.20 2wbi h PRO 44 N 0.31 0.00 0.00 1.13 0.11 -1.78 -0.96 132.00 130.81 2wbi h PRO 44 Ca 0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.35 2wbi h PRO 44 Cb 0.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.38 2wbi h PRO 44 CO -0.27 0.00 -0.82 0.00 -0.21 0.00 0.00 178.00 176.71 2wbi n ALA 45 N -1.82 3.41 -0.08 -0.75 0.00 0.93 -4.41 120.51 117.79 2wbi n ALA 45 Ca -0.02 -0.37 -0.06 0.00 0.00 0.00 0.00 53.44 52.99 2wbi n ALA 45 Cb 0.14 -1.04 -0.00 0.00 0.00 0.00 0.00 19.45 18.55 2wbi n ALA 45 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2wbi h GLU 46 N 0.00 -0.11 -0.38 0.00 4.81 -0.87 -1.33 114.58 116.70 2wbi h GLU 46 Ca 0.00 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.29 2wbi h GLU 46 Cb 0.67 0.03 -0.08 0.00 0.63 0.00 0.00 28.75 29.99 2wbi h GLU 46 CO 0.00 -0.07 -0.51 0.87 -0.73 0.00 0.00 179.01 178.57 2wbi h LYS 47 N -0.11 -0.38 0.12 1.92 1.57 -1.77 -0.38 116.57 117.55 2wbi h LYS 47 Ca 0.16 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 2wbi h LYS 47 Cb 0.36 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2wbi h LYS 47 CO -0.39 -0.25 -0.06 1.49 -0.57 0.00 0.00 179.45 179.67 2wbi h GLU 48 N -0.39 -0.16 -0.72 3.15 4.81 -1.80 -0.59 114.58 118.87 2wbi h GLU 48 Ca 0.09 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.41 2wbi h GLU 48 Cb 0.60 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.96 2wbi h GLU 48 CO -0.58 -0.05 0.40 0.28 -0.73 0.00 0.00 179.01 178.33 2wbi h VAL 49 N -0.23 0.93 0.22 0.32 2.07 -0.88 -1.53 116.25 117.15 2wbi h VAL 49 Ca -0.02 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 2wbi h VAL 49 Cb 0.19 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.12 2wbi h VAL 49 CO 0.03 0.13 -0.11 0.00 0.02 0.00 0.00 177.57 177.64 2wbi h THR 50 N 0.70 0.82 -0.76 2.57 1.03 -0.98 -3.50 112.91 112.78 2wbi h THR 50 Ca 0.34 -0.17 -0.73 0.00 -0.01 0.00 0.00 66.41 65.84 2wbi h THR 50 Cb 0.27 0.92 -0.10 0.00 -1.07 0.00 0.00 68.15 68.17 2wbi h THR 50 CO -0.22 0.04 2.52 -0.62 -0.01 0.00 0.00 175.52 177.23 2wbi n GLU 51 N -5.18 3.26 -0.19 0.00 1.02 -0.24 -5.11 120.64 114.20 2wbi n GLU 51 Ca -0.09 -3.11 0.00 0.00 -0.02 0.00 0.00 57.16 53.94 2wbi n GLU 51 Cb 0.17 -3.11 0.00 0.00 -0.02 0.00 0.00 31.44 28.48 2wbi n GLU 51 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2wbi n LYS 62 N 5.02 0.00 -0.11 3.49 2.85 -1.26 -5.00 118.16 123.15 2wbi n LYS 62 Ca 0.45 0.06 0.04 0.00 -1.05 0.00 0.00 58.31 57.81 2wbi n LYS 62 Cb 0.38 -0.12 0.10 0.00 -0.65 0.00 0.00 35.03 34.73 2wbi n LYS 62 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 177.40 178.26 2wbi n TRP 63 N 0.62 0.30 -2.83 5.58 7.02 -1.26 -4.75 117.44 122.12 2wbi n TRP 63 Ca 0.00 -0.50 0.00 0.00 -1.02 0.00 0.00 57.50 55.98 2wbi n TRP 63 Cb 0.00 -0.03 0.00 0.00 -2.42 0.00 0.00 31.31 28.86 2wbi n TRP 63 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2wbi n GLY 64 N 0.16 4.71 3.31 6.99 0.00 -1.26 -3.85 105.19 115.26 2wbi n GLY 64 Ca 0.08 -2.07 -0.29 0.00 0.00 0.00 0.00 46.02 43.73 2wbi n GLY 64 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wbi s LYS 65 N 0.84 1.76 0.88 1.61 1.02 -1.26 -4.74 119.74 119.85 2wbi s LYS 65 Ca 0.00 -1.03 -0.10 0.00 0.02 0.00 0.00 55.97 54.86 2wbi s LYS 65 Cb 0.00 -1.88 0.12 0.00 -0.52 0.00 0.00 37.83 35.56 2wbi s LYS 65 CO 0.00 0.49 1.12 -1.25 -0.92 0.00 0.00 175.35 174.79 2wbi s PRO 66 N -1.09 1.31 0.33 -1.68 0.04 -1.26 -4.91 135.00 127.74 2wbi s PRO 66 Ca 0.10 1.37 0.03 0.00 0.04 0.00 0.00 61.00 62.54 2wbi s PRO 66 Cb -0.10 -1.77 0.61 0.00 0.04 0.00 0.00 34.50 33.28 2wbi s PRO 66 CO 0.01 -2.37 1.94 -0.07 0.04 0.00 0.00 177.00 176.56 2wbi h LEU 67 N -1.67 0.80 -0.88 -3.56 3.38 -2.01 -1.81 115.31 109.56 2wbi h LEU 67 Ca -0.44 0.00 0.22 0.00 0.09 0.00 0.00 57.88 57.75 2wbi h LEU 67 Cb 1.26 -0.17 -0.13 0.00 0.09 0.00 0.00 40.66 41.71 2wbi h LEU 67 CO 0.46 0.53 0.36 -0.37 0.09 0.00 0.00 178.44 179.50 2wbi h VAL 68 N 0.92 0.45 -0.80 1.22 -1.51 -1.99 0.20 116.25 114.74 2wbi h VAL 68 Ca 0.34 -0.12 0.10 0.00 -1.23 0.00 0.00 66.70 65.78 2wbi h VAL 68 Cb 0.18 0.06 -0.07 0.00 -2.13 0.00 0.00 31.29 29.32 2wbi h VAL 68 CO -0.12 0.07 0.45 0.40 -1.23 0.00 0.00 177.57 177.14 2wbi h ILE 69 N 0.36 0.88 -0.26 7.19 1.08 -1.68 0.17 117.51 125.26 2wbi h ILE 69 Ca 0.55 -0.25 -0.04 0.00 -0.39 0.00 0.00 64.86 64.73 2wbi h ILE 69 Cb 1.06 0.08 -0.01 0.00 -3.07 0.00 0.00 36.82 34.87 2wbi h ILE 69 CO -0.55 0.14 0.02 0.44 -0.69 0.00 0.00 178.15 177.51 2wbi h ASP 70 N 0.74 0.43 -0.81 1.72 5.19 -0.74 -0.06 116.42 122.89 2wbi h ASP 70 Ca 0.39 -0.29 -0.02 0.00 -0.62 0.00 0.00 57.03 56.50 2wbi h ASP 70 Cb 0.38 -0.12 -0.04 0.00 0.18 0.00 0.00 39.33 39.74 2wbi h ASP 70 CO -0.26 0.61 0.43 0.11 -3.12 0.00 0.00 179.24 177.01 2wbi h LYS 71 N 0.24 1.15 -0.26 3.56 6.56 -0.64 -1.58 116.57 125.60 2wbi h LYS 71 Ca 0.08 -0.15 -0.00 0.00 -1.06 0.00 0.00 60.65 59.52 2wbi h LYS 71 Cb 0.38 -0.22 -0.01 0.00 -0.57 0.00 0.00 32.23 31.81 2wbi h LYS 71 CO 0.01 0.86 0.14 -0.07 -2.06 0.00 0.00 179.45 178.33 2wbi h LEU 72 N 1.14 0.32 -0.26 2.94 4.07 -0.59 -1.81 115.31 121.12 2wbi h LEU 72 Ca 0.28 -0.08 0.06 0.00 0.08 0.00 0.00 57.88 58.22 2wbi h LEU 72 Cb 0.06 -0.08 -0.06 0.00 1.08 0.00 0.00 40.66 41.66 2wbi h LEU 72 CO -0.04 0.31 -0.11 0.11 -1.08 0.00 0.00 178.44 177.63 2wbi h LYS 73 N 0.31 -0.07 -0.30 1.13 1.57 -0.66 -1.92 116.57 116.63 2wbi h LYS 73 Ca 0.09 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.93 2wbi h LYS 73 Cb 0.06 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.34 2wbi h LYS 73 CO -0.01 -0.05 -0.02 0.93 -0.57 0.00 0.00 179.45 179.73 2wbi h GLU 74 N -0.07 0.07 -0.56 3.15 5.08 -1.09 -1.20 114.58 119.95 2wbi h GLU 74 Ca 0.13 -0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.58 2wbi h GLU 74 Cb 0.28 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.44 2wbi h GLU 74 CO -0.31 0.04 0.17 0.52 -1.00 0.00 0.00 179.01 178.43 2wbi h MET 75 N 0.07 0.31 -0.86 2.33 2.86 -1.09 -2.10 114.93 116.44 2wbi h MET 75 Ca 0.15 -0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.79 2wbi h MET 75 Cb 0.20 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.74 2wbi h MET 75 CO -0.26 0.21 0.56 0.00 1.06 0.00 0.00 176.91 178.48 2wbi h ALA 76 N 1.41 1.12 -0.16 6.32 0.00 -0.68 -2.48 119.26 124.79 2wbi h ALA 76 Ca 0.29 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.18 2wbi h ALA 76 Cb 0.37 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2wbi h ALA 76 CO -0.33 0.44 -0.01 0.87 0.00 0.00 0.00 179.25 180.22 2wbi h LYS 77 N 1.12 0.03 -0.54 0.00 1.57 -0.60 0.18 116.57 118.34 2wbi h LYS 77 Ca 0.33 -0.00 0.05 0.00 -1.87 0.00 0.00 60.65 59.16 2wbi h LYS 77 Cb -0.05 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.21 2wbi h LYS 77 CO -0.10 0.02 0.28 0.28 -0.57 0.00 0.00 179.45 179.36 2wbi h VAL 78 N 0.04 0.96 -0.04 0.50 2.07 -1.05 0.75 116.25 119.47 2wbi h VAL 78 Ca 0.08 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.41 2wbi h VAL 78 Cb 0.10 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 2wbi h VAL 78 CO -0.14 0.10 0.00 -0.62 0.02 0.00 0.00 177.57 176.93 2wbi n GLU 79 N -4.86 1.11 -0.94 1.57 1.02 -0.97 -4.88 120.64 112.68 2wbi n GLU 79 Ca 0.05 -0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.02 2wbi n GLU 79 Cb 0.14 -1.19 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 2wbi n GLU 79 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wbi n GLY 80 N 0.72 0.53 3.52 0.62 0.00 0.25 -4.96 105.19 105.88 2wbi n GLY 80 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 2wbi n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wbi s LEU 81 N 0.00 4.26 -0.28 0.99 1.43 0.57 -4.87 118.68 120.79 2wbi s LEU 81 Ca 0.00 -2.21 -0.20 0.00 -1.03 0.00 0.00 54.13 50.70 2wbi s LEU 81 Cb 0.00 -2.50 0.10 0.00 0.03 0.00 0.00 46.19 43.82 2wbi s LEU 81 CO 0.00 -1.15 0.80 0.86 0.23 0.00 0.00 176.35 177.09 2wbi s TRP 82 N 3.54 -0.82 -1.49 0.29 -0.11 -1.26 -4.37 118.94 114.72 2wbi s TRP 82 Ca 0.45 1.76 0.00 0.00 1.22 0.00 0.00 56.10 59.53 2wbi s TRP 82 Cb -0.00 0.45 0.00 0.00 -1.50 0.00 0.00 33.47 32.42 2wbi s TRP 82 CO -0.02 -0.40 0.00 0.09 -4.62 0.00 0.00 176.95 171.99 2wbi n ASN 83 N 3.48 -4.88 0.20 5.86 3.02 -0.76 -4.85 115.26 117.33 2wbi n ASN 83 Ca -0.17 0.13 0.18 0.00 -0.03 0.00 0.00 54.58 54.69 2wbi n ASN 83 Cb 0.57 -4.14 0.82 0.00 -0.61 0.00 0.00 39.78 36.42 2wbi n ASN 83 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2wbi h LEU 84 N 0.00 0.00 -0.71 3.41 3.38 -1.86 -1.40 115.31 118.13 2wbi h LEU 84 Ca -0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.58 2wbi h LEU 84 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 2wbi h LEU 84 CO 0.48 0.00 0.00 2.19 0.09 0.00 0.00 178.44 181.20 2wbi h PHE 85 N 0.00 0.00 -3.33 1.13 -5.15 -1.90 -3.42 116.94 104.27 2wbi h PHE 85 Ca 0.10 0.00 -0.72 0.00 -0.20 0.00 0.00 57.97 57.14 2wbi h PHE 85 Cb 0.71 0.00 -0.29 0.00 0.22 0.00 0.00 35.95 36.59 2wbi h PHE 85 CO 0.00 0.00 -0.41 -1.17 -2.00 0.00 0.00 178.31 174.73 2wbi s LEU 86 N -5.04 5.57 0.19 2.10 0.20 -0.53 -4.99 118.68 116.18 2wbi s LEU 86 Ca 0.05 -1.79 -0.21 0.00 0.69 0.00 0.00 54.13 52.86 2wbi s LEU 86 Cb 0.09 -2.01 0.12 0.00 -0.43 0.00 0.00 46.19 43.96 2wbi s LEU 86 CO 0.49 -0.66 1.58 -0.65 -0.29 0.00 0.00 176.35 176.82 2wbi h PRO 87 N 8.46 -0.15 0.00 0.98 0.11 -1.82 0.45 132.00 140.03 2wbi h PRO 87 Ca -0.22 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.90 2wbi h PRO 87 Cb 1.08 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2wbi h PRO 87 CO 0.84 -0.10 0.15 0.00 -0.21 0.00 0.00 178.00 178.68 2wbi n ALA 88 N -3.17 0.80 -0.04 -0.75 0.00 -1.26 0.45 120.51 116.55 2wbi n ALA 88 Ca 0.04 0.11 -0.06 0.00 0.00 0.00 0.00 53.44 53.53 2wbi n ALA 88 Cb 0.36 -0.95 -0.03 0.00 0.00 0.00 0.00 19.45 18.83 2wbi n ALA 88 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wbi n VAL 89 N -1.92 0.41 0.16 0.00 0.31 0.14 -4.74 118.33 112.71 2wbi n VAL 89 Ca -0.01 -0.13 0.05 0.00 -0.01 0.00 0.00 64.34 64.23 2wbi n VAL 89 Cb 0.17 -1.14 0.13 0.00 -0.91 0.00 0.00 33.84 32.09 2wbi n VAL 89 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2wbi h SER 90 N -0.12 0.00 -1.37 4.52 4.64 0.11 -3.47 113.55 117.85 2wbi h SER 90 Ca -0.18 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 60.84 2wbi h SER 90 Cb 1.21 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.23 2wbi h SER 90 CO -0.07 0.42 -0.33 0.61 -0.87 0.00 0.00 176.83 176.59 2wbi n GLY 91 N 0.97 0.69 3.75 -0.77 0.00 0.17 -5.02 105.19 104.99 2wbi n GLY 91 Ca 0.02 -0.29 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 2wbi n GLY 91 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wbi s LEU 92 N -3.80 3.81 0.72 0.99 1.43 -1.25 -4.91 118.68 115.67 2wbi s LEU 92 Ca 0.00 0.17 -0.11 0.00 -1.03 0.00 0.00 54.13 53.16 2wbi s LEU 92 Cb 0.00 -2.06 0.02 0.00 0.03 0.00 0.00 46.19 44.19 2wbi s LEU 92 CO 0.00 0.33 1.08 -0.94 0.23 0.00 0.00 176.35 177.05 2wbi s SER 93 N -1.32 5.20 0.29 2.29 1.04 -1.26 -4.18 113.70 115.76 2wbi s SER 93 Ca 0.18 1.38 -0.01 0.00 0.48 0.00 0.00 55.95 57.98 2wbi s SER 93 Cb -0.12 -2.21 0.42 0.00 0.10 0.00 0.00 66.02 64.22 2wbi s SER 93 CO 0.08 -1.53 1.84 0.45 0.98 0.00 0.00 173.24 175.07 2wbi h HIS 94 N -0.78 0.84 -0.05 5.02 -0.00 -1.97 -0.18 115.15 118.03 2wbi h HIS 94 Ca -0.45 -0.07 0.03 0.00 -0.00 0.00 0.00 60.37 59.88 2wbi h HIS 94 Cb 1.24 -0.25 -0.04 0.00 -0.00 0.00 0.00 27.41 28.36 2wbi h HIS 94 CO 0.55 0.69 -0.14 0.28 -0.00 0.00 0.00 177.93 179.31 2wbi h VAL 95 N 0.80 0.63 -0.67 2.45 2.07 -1.91 -1.23 116.25 118.40 2wbi h VAL 95 Ca 0.18 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.82 2wbi h VAL 95 Cb 0.26 0.63 -0.09 0.00 -1.52 0.00 0.00 31.29 30.58 2wbi h VAL 95 CO -0.01 0.00 0.21 0.44 0.02 0.00 0.00 177.57 178.24 2wbi h ASP 96 N -0.22 0.15 0.08 0.57 3.32 -1.61 -2.55 116.42 116.15 2wbi h ASP 96 Ca 0.06 0.11 -0.14 0.00 0.02 0.00 0.00 57.03 57.08 2wbi h ASP 96 Cb 0.30 0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 2wbi h ASP 96 CO -0.18 0.07 -0.50 0.22 -1.72 0.00 0.00 179.24 177.13 2wbi h TYR 97 N 0.36 0.59 -0.53 4.55 3.20 -0.80 -3.19 116.97 121.15 2wbi h TYR 97 Ca 0.35 -0.19 0.11 0.00 3.14 0.00 0.00 58.73 62.14 2wbi h TYR 97 Cb 0.52 -0.12 -0.09 0.00 1.54 0.00 0.00 36.73 38.58 2wbi h TYR 97 CO -0.20 0.88 -0.01 0.00 -1.64 0.00 0.00 178.16 177.19 2wbi h ALA 98 N 1.09 0.50 -0.33 1.82 0.00 -0.79 1.07 119.26 122.62 2wbi h ALA 98 Ca 0.02 0.16 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 2wbi h ALA 98 Cb 1.01 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 2wbi h ALA 98 CO 0.09 -0.39 -0.14 -0.07 0.00 0.00 0.00 179.25 178.74 2wbi h LEU 99 N 0.11 0.56 -0.17 0.00 3.38 -1.60 -0.19 115.31 117.40 2wbi h LEU 99 Ca 0.27 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 2wbi h LEU 99 Cb 0.42 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 2wbi h LEU 99 CO -0.46 0.73 -0.18 0.40 0.09 0.00 0.00 178.44 179.02 2wbi h ILE 100 N 0.52 1.34 -0.43 1.22 2.04 -0.83 -3.00 117.51 118.38 2wbi h ILE 100 Ca 0.09 -1.36 -0.04 0.00 1.00 0.00 0.00 64.86 64.55 2wbi h ILE 100 Cb 0.55 1.86 -0.02 0.00 -0.74 0.00 0.00 36.82 38.46 2wbi h ILE 100 CO 0.03 0.41 0.09 0.00 0.00 0.00 0.00 178.15 178.68 2wbi h ALA 101 N 0.61 1.35 -0.67 1.87 0.00 0.12 -1.40 119.26 121.15 2wbi h ALA 101 Ca 0.02 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 54.84 2wbi h ALA 101 Cb 0.73 -0.18 -0.07 0.00 0.00 0.00 0.00 17.79 18.27 2wbi h ALA 101 CO 0.04 0.46 0.32 1.49 0.00 0.00 0.00 179.25 181.57 2wbi h GLU 102 N 0.63 0.55 -0.58 0.00 4.81 -1.01 -1.69 114.58 117.28 2wbi h GLU 102 Ca 0.14 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.29 2wbi h GLU 102 Cb 0.27 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 2wbi h GLU 102 CO -0.00 0.37 0.19 1.49 -0.73 0.00 0.00 179.01 180.33 2wbi h GLU 103 N 0.57 0.90 -0.33 1.92 4.57 -1.13 -2.81 114.58 118.28 2wbi h GLU 103 Ca 0.32 -0.19 -0.02 0.00 -1.18 0.00 0.00 59.36 58.30 2wbi h GLU 103 Cb 0.32 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.76 2wbi h GLU 103 CO -0.25 0.80 0.13 1.79 -1.18 0.00 0.00 179.01 180.30 2wbi h THR 104 N 0.82 1.13 0.00 0.32 1.35 -0.94 -2.69 112.91 112.90 2wbi h THR 104 Ca 0.19 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.66 2wbi h THR 104 Cb 0.27 0.74 0.00 0.00 -1.73 0.00 0.00 68.15 67.43 2wbi h THR 104 CO -0.01 0.15 0.02 1.23 -0.25 0.00 0.00 175.52 176.67 2wbi h GLY 105 N 0.60 0.00 1.44 5.82 0.00 -1.04 -2.63 103.07 107.27 2wbi h GLY 105 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 2wbi h GLY 105 CO -0.01 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.81 2wbi n LYS 106 N -2.52 0.50 -3.74 4.80 5.02 -1.01 -3.08 118.16 118.12 2wbi n LYS 106 Ca -0.02 0.02 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 2wbi n LYS 106 Cb 0.07 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.45 2wbi n LYS 106 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wbi h PHE 108 N 6.93 0.00 -0.16 0.00 -0.00 -1.86 -2.16 116.94 119.70 2wbi h PHE 108 Ca -0.38 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.59 2wbi h PHE 108 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.11 2wbi h PHE 108 CO 0.37 0.14 0.00 1.97 -0.00 0.00 0.00 178.31 180.79 2wbi n PHE 109 N -3.62 0.19 0.18 6.09 -1.74 -1.26 -4.66 117.46 112.63 2wbi n PHE 109 Ca -0.02 -0.13 -0.14 0.00 -0.56 0.00 0.00 57.45 56.60 2wbi n PHE 109 Cb 0.27 -0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.19 2wbi n PHE 109 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2wbi h ALA 110 N 3.42 -0.38 -0.92 1.98 0.00 -1.60 -3.01 119.26 118.74 2wbi h ALA 110 Ca 0.00 -0.08 0.19 0.00 0.00 0.00 0.00 54.91 55.02 2wbi h ALA 110 Cb 0.77 0.16 -0.08 0.00 0.00 0.00 0.00 17.79 18.65 2wbi h ALA 110 CO 0.00 -0.72 0.60 -1.35 0.00 0.00 0.00 179.25 177.78 2wbi h PRO 111 N -0.39 0.51 -0.60 0.00 0.11 -1.77 -1.68 132.00 128.18 2wbi h PRO 111 Ca -0.04 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.98 2wbi h PRO 111 Cb 0.30 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.27 2wbi h PRO 111 CO 0.06 0.33 0.13 -0.44 -0.21 0.00 0.00 178.00 177.87 2wbi h ASP 112 N 0.52 0.92 -0.71 -2.05 3.32 -1.86 0.69 116.42 117.26 2wbi h ASP 112 Ca 0.49 -0.24 0.06 0.00 0.02 0.00 0.00 57.03 57.36 2wbi h ASP 112 Cb 1.06 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 40.32 2wbi h ASP 112 CO -0.22 0.93 0.46 0.58 -1.72 0.00 0.00 179.24 179.27 2wbi h VAL 113 N 0.88 1.02 -0.60 -1.35 2.07 -1.21 0.31 116.25 117.36 2wbi h VAL 113 Ca 0.19 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.46 2wbi h VAL 113 Cb 0.37 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 2wbi h VAL 113 CO 0.00 0.13 0.00 0.49 0.02 0.00 0.00 177.57 178.22 2wbi n PHE 114 N -4.48 0.85 -3.59 1.57 3.72 -1.09 -4.43 117.46 110.02 2wbi n PHE 114 Ca 0.10 -0.41 -0.20 0.00 -0.05 0.00 0.00 57.45 56.89 2wbi n PHE 114 Cb 0.22 -0.02 0.06 0.00 -0.94 0.00 0.00 39.48 38.80 2wbi n PHE 114 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2wbi n ASN 115 N 1.25 -1.61 -0.07 4.37 5.15 0.10 -1.83 115.26 122.62 2wbi n ASN 115 Ca 0.20 -0.73 0.03 0.00 -0.60 0.00 0.00 54.58 53.48 2wbi n ASN 115 Cb 0.53 -4.52 0.04 0.00 -0.53 0.00 0.00 39.78 35.30 2wbi n ASN 115 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2wbi s GLN 117 N -1.32 4.11 0.44 0.00 0.00 -1.22 -4.81 119.66 116.86 2wbi s GLN 117 Ca 0.09 0.75 -0.19 0.00 -0.00 0.00 0.00 55.36 56.01 2wbi s GLN 117 Cb 0.08 -2.66 -0.10 0.00 0.00 0.00 0.00 33.01 30.34 2wbi s GLN 117 CO 0.01 0.28 0.93 0.00 0.00 0.00 0.00 175.29 176.51 2wbi s ALA 118 N -1.75 3.09 -2.09 2.60 0.00 -1.26 -1.72 121.76 120.63 2wbi s ALA 118 Ca 0.48 0.29 0.13 0.00 0.00 0.00 0.00 51.96 52.86 2wbi s ALA 118 Cb -0.13 -3.09 0.49 0.00 0.00 0.00 0.00 23.12 20.39 2wbi s ALA 118 CO 0.19 0.06 1.36 -0.35 0.00 0.00 0.00 175.76 177.02 2wbi n PRO 119 N -0.87 1.60 0.11 0.00 -0.04 -1.26 -4.90 135.00 129.64 2wbi n PRO 119 Ca 0.06 -0.92 -0.03 0.00 -0.04 0.00 0.00 63.50 62.58 2wbi n PRO 119 Cb 0.54 -1.28 0.06 0.00 -0.04 0.00 0.00 33.50 32.79 2wbi n PRO 119 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2wbi h ASP 120 N 1.63 0.00 -0.48 3.54 3.32 -1.73 -2.67 116.42 120.03 2wbi h ASP 120 Ca 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 2wbi h ASP 120 Cb 0.37 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.90 2wbi h ASP 120 CO 0.00 0.73 -0.00 0.71 -1.72 0.00 0.00 179.24 178.96 2wbi h THR 121 N 0.00 1.26 -0.38 0.35 1.35 -1.65 -0.25 112.91 113.59 2wbi h THR 121 Ca -0.01 -1.07 -0.08 0.00 -0.55 0.00 0.00 66.41 64.70 2wbi h THR 121 Cb 1.36 1.00 -0.01 0.00 -1.73 0.00 0.00 68.15 68.76 2wbi h THR 121 CO 0.10 0.37 -0.06 1.23 -0.25 0.00 0.00 175.52 176.91 2wbi h GLY 122 N 0.71 0.78 1.21 5.82 0.00 -1.85 -1.44 103.07 108.30 2wbi h GLY 122 Ca 0.14 -0.62 -0.05 0.00 0.00 0.00 0.00 47.33 46.80 2wbi h GLY 122 CO 0.03 0.57 0.23 3.43 0.00 0.00 0.00 176.54 180.80 2wbi h ASN 123 N 0.53 0.92 0.25 0.19 2.35 -1.37 -0.77 115.58 117.68 2wbi h ASN 123 Ca 0.10 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 2wbi h ASN 123 Cb 0.57 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.70 2wbi h ASN 123 CO 0.03 0.84 -0.12 0.24 -1.65 0.00 0.00 177.43 176.78 2wbi h MET 124 N 0.97 -0.33 -0.87 0.81 2.86 -0.87 -2.75 114.93 114.76 2wbi h MET 124 Ca 0.22 0.02 0.18 0.00 -2.06 0.00 0.00 59.70 58.06 2wbi h MET 124 Cb 0.24 0.07 -0.11 0.00 0.06 0.00 0.00 31.60 31.86 2wbi h MET 124 CO -0.01 -0.16 0.42 1.49 1.06 0.00 0.00 176.91 179.71 2wbi h GLU 125 N -0.42 0.50 -0.12 1.72 4.57 -0.98 0.14 114.58 119.99 2wbi h GLU 125 Ca -0.03 -0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.12 2wbi h GLU 125 Cb 0.32 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 2wbi h GLU 125 CO 0.06 0.33 0.06 0.28 -1.18 0.00 0.00 179.01 178.56 2wbi h VAL 126 N 0.52 1.01 -0.67 0.32 2.07 -0.96 -1.06 116.25 117.47 2wbi h VAL 126 Ca 0.51 -0.05 -0.05 0.00 0.82 0.00 0.00 66.70 67.93 2wbi h VAL 126 Cb 0.85 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2wbi h VAL 126 CO -0.44 0.02 0.21 -0.07 0.02 0.00 0.00 177.57 177.31 2wbi h LEU 127 N 0.13 0.98 -0.47 2.57 3.38 -1.15 0.02 115.31 120.77 2wbi h LEU 127 Ca 0.05 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.83 2wbi h LEU 127 Cb 0.00 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 2wbi h LEU 127 CO -0.03 0.93 0.28 -0.74 0.09 0.00 0.00 178.44 178.97 2wbi h HIS 128 N 0.98 0.53 0.11 1.13 2.76 -0.27 0.23 115.15 120.62 2wbi h HIS 128 Ca 0.22 0.02 -0.29 0.00 -2.20 0.00 0.00 60.37 58.11 2wbi h HIS 128 Cb 0.30 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 29.08 2wbi h HIS 128 CO 0.02 0.30 -1.41 -0.07 -1.30 0.00 0.00 177.93 175.47 2wbi h LEU 129 N 0.56 0.36 0.00 0.26 3.38 -1.19 -3.41 115.31 115.27 2wbi h LEU 129 Ca 0.19 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2wbi h LEU 129 Cb 0.01 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.65 2wbi h LEU 129 CO -0.09 1.37 -0.24 -1.22 0.09 0.00 0.00 178.44 178.35 2wbi n TYR 130 N -3.45 0.00 -1.96 1.13 4.01 -0.01 -5.06 117.16 111.82 2wbi n TYR 130 Ca -0.13 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.21 2wbi n TYR 130 Cb 1.03 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 40.06 2wbi n TYR 130 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2wbi s GLY 131 N -1.22 2.94 0.92 2.72 0.00 0.82 -4.07 107.32 109.42 2wbi s GLY 131 Ca 0.00 1.35 -0.12 0.00 0.00 0.00 0.00 44.72 45.95 2wbi s GLY 131 CO 0.00 1.97 1.10 -1.35 0.00 0.00 0.00 173.10 174.82 2wbi s SER 132 N -0.55 3.36 0.20 1.64 1.04 -1.26 -4.81 113.70 113.32 2wbi s SER 132 Ca 0.56 1.28 -0.11 0.00 0.48 0.00 0.00 55.95 58.17 2wbi s SER 132 Cb -0.41 -1.95 0.17 0.00 0.10 0.00 0.00 66.02 63.93 2wbi s SER 132 CO 0.54 -2.68 1.84 -0.33 0.98 0.00 0.00 173.24 173.58 2wbi h GLU 133 N -1.58 0.77 -0.21 4.02 4.39 -1.98 -0.94 114.58 119.05 2wbi h GLU 133 Ca -0.51 -0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.15 2wbi h GLU 133 Cb 1.30 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.77 2wbi h GLU 133 CO 0.57 0.51 0.13 0.93 -1.16 0.00 0.00 179.01 179.99 2wbi h GLU 134 N 0.80 0.25 -0.73 2.33 3.07 -1.99 -1.54 114.58 116.77 2wbi h GLU 134 Ca 0.27 -0.02 0.05 0.00 -0.50 0.00 0.00 59.36 59.16 2wbi h GLU 134 Cb 0.03 -0.06 -0.05 0.00 -0.84 0.00 0.00 28.75 27.83 2wbi h GLU 134 CO -0.11 0.17 0.44 1.96 -1.40 0.00 0.00 179.01 180.07 2wbi h GLN 135 N 0.26 0.79 -0.26 2.33 4.20 -1.78 -1.47 115.11 119.17 2wbi h GLN 135 Ca 0.08 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 2wbi h GLN 135 Cb -0.01 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 2wbi h GLN 135 CO -0.04 0.52 0.05 0.87 -0.67 0.00 0.00 178.83 179.57 2wbi h LYS 136 N 0.82 0.43 0.00 1.46 1.57 -1.06 -1.63 116.57 118.16 2wbi h LYS 136 Ca 0.32 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2wbi h LYS 136 Cb 0.14 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 2wbi h LYS 136 CO -0.16 0.54 -0.02 0.87 -0.57 0.00 0.00 179.45 180.11 2wbi h LYS 137 N 0.25 0.00 0.10 3.15 1.57 -0.90 -1.66 116.57 119.07 2wbi h LYS 137 Ca 0.08 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.52 2wbi h LYS 137 Cb 0.31 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 2wbi h LYS 137 CO 0.00 0.02 -1.86 0.37 -0.57 0.00 0.00 179.45 177.42 2wbi h GLN 138 N 0.00 0.21 0.00 3.15 4.15 -1.18 -3.42 115.11 118.02 2wbi h GLN 138 Ca -0.00 -0.36 0.00 0.00 0.77 0.00 0.00 58.65 59.06 2wbi h GLN 138 Cb 0.04 0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.86 2wbi h GLN 138 CO 0.00 1.04 -0.90 0.91 -1.93 0.00 0.00 178.83 177.95 2wbi n TRP 139 N -3.38 0.00 -0.30 3.99 7.02 -0.62 -4.56 117.44 119.58 2wbi n TRP 139 Ca -0.26 0.00 0.01 0.00 -1.02 0.00 0.00 57.50 56.23 2wbi n TRP 139 Cb 1.05 0.05 0.14 0.00 -2.42 0.00 0.00 31.31 30.13 2wbi n TRP 139 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 2wbi h LEU 140 N 0.00 0.80 0.26 -0.99 5.85 -1.40 -2.34 115.31 117.49 2wbi h LEU 140 Ca 0.00 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2wbi h LEU 140 Cb 0.90 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.78 2wbi h LEU 140 CO 0.00 0.51 -0.12 -0.33 -0.34 0.00 0.00 178.44 178.15 2wbi h GLU 141 N 0.93 -0.34 -0.99 1.25 3.07 -1.61 -1.26 114.58 115.63 2wbi h GLU 141 Ca 0.37 0.02 0.07 0.00 -0.50 0.00 0.00 59.36 59.32 2wbi h GLU 141 Cb 0.19 0.08 -0.07 0.00 -0.84 0.00 0.00 28.75 28.11 2wbi h GLU 141 CO -0.18 -0.12 0.64 -1.35 -1.40 0.00 0.00 179.01 176.60 2wbi h PRO 142 N -0.49 1.11 -0.24 2.33 0.11 -1.77 -2.60 132.00 130.45 2wbi h PRO 142 Ca -0.04 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 65.98 2wbi h PRO 142 Cb 0.37 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.22 2wbi h PRO 142 CO 0.06 0.74 0.06 -0.07 -0.21 0.00 0.00 178.00 178.57 2wbi h LEU 143 N 1.15 0.37 -2.41 2.35 3.38 -1.23 -1.66 115.31 117.26 2wbi h LEU 143 Ca 0.43 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 58.18 2wbi h LEU 143 Cb 0.19 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2wbi h LEU 143 CO -0.17 0.51 0.19 -0.07 0.09 0.00 0.00 178.44 178.98 2wbi h LEU 144 N 0.22 0.00 0.00 1.67 3.38 -0.92 -1.02 115.31 118.64 2wbi h LEU 144 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2wbi h LEU 144 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2wbi h LEU 144 CO 0.00 0.00 -1.30 1.67 0.09 0.00 0.00 178.44 178.90 2wbi n GLN 145 N -3.13 0.55 -1.31 1.13 -0.06 -0.70 -4.92 117.38 108.95 2wbi n GLN 145 Ca -0.02 -0.00 -0.03 0.00 -2.00 0.00 0.00 57.00 54.95 2wbi n GLN 145 Cb 0.26 -1.69 -0.01 0.00 -4.06 0.00 0.00 30.24 24.74 2wbi n GLN 145 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2wbi n GLY 146 N 1.24 0.52 0.15 1.69 0.00 -0.39 -4.97 105.19 103.44 2wbi n GLY 146 Ca -0.01 -0.90 -0.25 0.00 0.00 0.00 0.00 46.02 44.86 2wbi n GLY 146 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2wbi h ASN 147 N 0.00 0.83 -2.47 1.61 2.35 -1.59 -3.47 115.58 112.84 2wbi h ASN 147 Ca -0.06 -0.92 -0.55 0.00 -0.55 0.00 0.00 56.30 54.22 2wbi h ASN 147 Cb 0.39 -0.27 -0.14 0.00 0.05 0.00 0.00 38.32 38.35 2wbi h ASN 147 CO 0.09 1.70 -0.65 0.27 -1.65 0.00 0.00 177.43 177.18 2wbi s ILE 148 N -2.59 1.79 0.47 2.81 -4.36 -1.25 -4.97 121.20 113.10 2wbi s ILE 148 Ca -0.09 -2.10 0.02 0.00 -0.26 0.00 0.00 60.65 58.22 2wbi s ILE 148 Cb 0.04 -2.67 -0.02 0.00 1.25 0.00 0.00 42.46 41.05 2wbi s ILE 148 CO 0.94 -0.16 0.05 0.42 0.24 0.00 0.00 174.94 176.43 2wbi s THR 149 N -2.90 0.97 0.17 8.37 -4.23 0.08 -4.58 115.64 113.52 2wbi s THR 149 Ca 0.33 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.76 2wbi s THR 149 Cb 0.06 -2.27 -0.01 0.00 1.34 0.00 0.00 72.50 71.61 2wbi s THR 149 CO 0.15 0.00 0.26 -0.94 -0.54 0.00 0.00 174.62 173.55 2wbi s SER 150 N -3.76 0.08 0.03 3.99 1.04 -1.26 -1.80 113.70 112.01 2wbi s SER 150 Ca 0.14 -0.95 0.01 0.00 0.48 0.00 0.00 55.95 55.63 2wbi s SER 150 Cb 0.02 0.42 -0.02 0.00 0.10 0.00 0.00 66.02 66.54 2wbi s SER 150 CO 0.08 -0.88 -0.05 0.00 0.98 0.00 0.00 173.24 173.37 2wbi s PHE 152 N -1.43 3.34 -0.38 0.00 5.36 -1.26 -1.76 117.98 121.84 2wbi s PHE 152 Ca -0.13 0.23 0.04 0.00 -0.96 0.00 0.00 56.93 56.10 2wbi s PHE 152 Cb -0.10 -2.15 0.11 0.00 -0.34 0.00 0.00 43.02 40.53 2wbi s PHE 152 CO -0.00 0.21 0.10 0.00 -1.46 0.00 0.00 175.22 174.06 2wbi n MET 154 N 3.98 0.00 -1.90 0.00 0.00 -1.26 -1.65 117.12 116.29 2wbi n MET 154 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 57.70 57.32 2wbi n MET 154 Cb 0.40 -0.48 -0.02 0.00 0.00 0.00 0.00 33.22 33.11 2wbi n MET 154 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 2wbi s THR 155 N -2.00 2.45 -0.06 1.12 2.01 -1.26 -4.90 115.64 112.99 2wbi s THR 155 Ca 0.00 0.35 0.05 0.00 0.31 0.00 0.00 61.69 62.40 2wbi s THR 155 Cb 0.00 -3.22 -0.02 0.00 0.01 0.00 0.00 72.50 69.27 2wbi s THR 155 CO 0.00 0.04 -0.21 -1.61 -0.69 0.00 0.00 174.62 172.15 2wbi s GLU 156 N 0.37 2.58 0.25 4.92 2.02 -1.26 -1.06 118.70 126.52 2wbi s GLU 156 Ca 0.66 -0.83 -0.05 0.00 0.02 0.00 0.00 54.97 54.77 2wbi s GLU 156 Cb -0.45 -2.26 0.27 0.00 0.10 0.00 0.00 34.13 31.80 2wbi s GLU 156 CO 0.38 0.45 1.88 -1.00 0.02 0.00 0.00 175.26 176.99 2wbi h PRO 157 N 5.88 1.21 -0.00 0.39 0.13 -1.90 -3.22 132.00 134.49 2wbi h PRO 157 Ca -0.36 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2wbi h PRO 157 Cb 1.17 -0.24 0.00 0.00 0.13 0.00 0.00 31.00 32.05 2wbi h PRO 157 CO 0.49 0.87 -0.05 -0.25 -0.23 0.00 0.00 178.00 178.84 2wbi n ASP 158 N -4.34 0.18 -4.07 1.44 8.00 -1.26 -4.81 116.55 111.69 2wbi n ASP 158 Ca 0.09 -0.36 -0.13 0.00 0.71 0.00 0.00 54.79 55.10 2wbi n ASP 158 Cb 0.09 -0.18 -0.11 0.00 -0.02 0.00 0.00 41.12 40.89 2wbi n ASP 158 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2wbi s VAL 159 N -2.50 0.53 -0.51 2.53 -7.23 -1.22 -5.09 120.40 106.92 2wbi s VAL 159 Ca 0.30 -1.13 -0.27 0.00 -1.81 0.00 0.00 61.98 59.07 2wbi s VAL 159 Cb 0.20 -0.67 -0.04 0.00 0.56 0.00 0.00 36.38 36.44 2wbi s VAL 159 CO 0.46 -0.42 2.02 0.00 -0.31 0.00 0.00 175.10 176.86 2wbi s ALA 160 N -1.54 2.16 -1.53 1.32 0.00 -1.26 -4.64 121.76 116.27 2wbi s ALA 160 Ca -0.09 -0.24 0.28 0.00 0.00 0.00 0.00 51.96 51.92 2wbi s ALA 160 Cb -0.09 -4.26 1.17 0.00 0.00 0.00 0.00 23.12 19.95 2wbi s ALA 160 CO -0.00 -3.80 1.83 0.43 0.00 0.00 0.00 175.76 174.23 2wbi n SER 161 N 13.20 0.42 0.27 0.00 7.64 -1.26 -3.11 113.62 130.77 2wbi n SER 161 Ca 0.26 -0.43 0.15 0.00 1.01 0.00 0.00 58.87 59.86 2wbi n SER 161 Cb 0.52 -0.09 0.68 0.00 -1.01 0.00 0.00 64.21 64.31 2wbi n SER 161 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2wbi h SER 162 N 0.45 0.00 -3.22 6.43 4.64 -1.98 -3.33 113.55 116.55 2wbi h SER 162 Ca 0.00 0.00 -0.74 0.00 -0.47 0.00 0.00 61.79 60.58 2wbi h SER 162 Cb 0.38 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 62.21 2wbi h SER 162 CO 0.00 0.07 -0.32 -0.62 -0.87 0.00 0.00 176.83 175.10 2wbi s ASP 163 N -5.83 5.94 0.58 4.97 2.15 -1.18 -4.97 116.67 118.33 2wbi s ASP 163 Ca -0.00 -1.79 0.38 0.00 0.43 0.00 0.00 52.55 51.57 2wbi s ASP 163 Cb 0.10 -2.11 2.00 0.00 -0.30 0.00 0.00 42.92 42.61 2wbi s ASP 163 CO 0.56 -0.75 2.17 0.00 -0.17 0.00 0.00 175.17 176.97 2wbi h ALA 164 N 8.66 1.00 0.00 3.66 0.00 -1.85 -1.09 119.26 129.65 2wbi h ALA 164 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2wbi h ALA 164 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2wbi h ALA 164 CO 0.93 0.00 0.00 1.79 0.00 0.00 0.00 179.25 181.97 2wbi h THR 165 N 0.00 0.00 0.00 0.00 1.35 -1.92 -2.79 112.91 109.55 2wbi h THR 165 Ca 0.00 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 2wbi h THR 165 Cb 0.10 0.96 0.00 0.00 -1.73 0.00 0.00 68.15 67.48 2wbi h THR 165 CO 0.00 0.00 0.00 0.59 -0.25 0.00 0.00 175.52 175.86 2wbi n ASN 166 N -2.32 0.78 -4.68 5.36 3.02 -0.41 -4.86 115.26 112.15 2wbi n ASN 166 Ca 0.02 0.61 -0.42 0.00 -0.03 0.00 0.00 54.58 54.76 2wbi n ASN 166 Cb 0.21 -0.81 -0.03 0.00 -0.61 0.00 0.00 39.78 38.55 2wbi n ASN 166 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2wbi s ILE 167 N -3.19 2.63 -0.96 2.41 1.09 -1.06 -4.89 121.20 117.24 2wbi s ILE 167 Ca 0.08 0.03 0.08 0.00 -1.10 0.00 0.00 60.65 59.74 2wbi s ILE 167 Cb 0.11 -3.02 0.05 0.00 -1.06 0.00 0.00 42.46 38.54 2wbi s ILE 167 CO 0.52 -0.00 0.72 -1.84 -0.10 0.00 0.00 174.94 174.25 2wbi n GLU 168 N 6.11 0.40 -1.49 2.79 0.28 -1.26 -4.58 120.64 122.88 2wbi n GLU 168 Ca 0.18 -0.92 -0.49 0.00 -0.16 0.00 0.00 57.16 55.77 2wbi n GLU 168 Cb 0.39 -1.13 -0.06 0.00 1.43 0.00 0.00 31.44 32.06 2wbi n GLU 168 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2wbi s SER 170 N 7.22 7.24 -0.17 0.00 0.15 0.65 -0.45 113.70 128.34 2wbi s SER 170 Ca 1.07 2.11 -0.00 0.00 0.70 0.00 0.00 55.95 59.82 2wbi s SER 170 Cb -0.76 -2.60 0.04 0.00 -1.71 0.00 0.00 66.02 60.99 2wbi s SER 170 CO 0.47 -0.24 -0.06 -0.63 1.20 0.00 0.00 173.24 173.98 2wbi s ILE 171 N -0.20 1.17 0.19 6.45 1.01 -0.25 -1.48 121.20 128.09 2wbi s ILE 171 Ca 0.50 -0.65 0.11 0.00 0.00 0.00 0.00 60.65 60.61 2wbi s ILE 171 Cb -0.30 -1.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.81 2wbi s ILE 171 CO 0.35 0.15 -0.24 -1.10 0.00 0.00 0.00 174.94 174.10 2wbi s GLN 172 N 1.61 1.52 -0.24 2.79 -0.21 -0.31 -4.42 119.66 120.40 2wbi s GLN 172 Ca 0.01 -1.53 -0.00 0.00 0.02 0.00 0.00 55.36 53.86 2wbi s GLN 172 Cb -0.15 -1.83 0.03 0.00 1.00 0.00 0.00 33.01 32.06 2wbi s GLN 172 CO -0.08 0.40 -0.10 0.50 -2.12 0.00 0.00 175.29 173.89 2wbi s ARG 173 N -2.69 2.72 -0.20 2.91 6.06 -1.26 -0.39 118.95 126.10 2wbi s ARG 173 Ca 0.21 -1.04 -0.04 0.00 -2.50 0.00 0.00 55.73 52.36 2wbi s ARG 173 Cb -0.08 -2.89 -0.01 0.00 0.06 0.00 0.00 34.95 32.03 2wbi s ARG 173 CO 0.10 -0.41 -0.05 0.16 -2.50 0.00 0.00 175.30 172.60 2wbi s ASP 174 N 1.26 4.42 0.00 -2.12 -4.77 -0.70 -5.02 116.67 109.75 2wbi s ASP 174 Ca -0.01 -0.31 0.00 0.00 -3.30 0.00 0.00 52.55 48.93 2wbi s ASP 174 Cb -0.17 -1.74 0.00 0.00 -1.09 0.00 0.00 42.92 39.92 2wbi s ASP 174 CO -0.06 0.05 0.00 1.21 0.70 0.00 0.00 175.17 177.06 2wbi n GLU 175 N 4.35 0.00 0.04 2.11 2.13 -1.26 0.04 120.64 128.05 2wbi n GLU 175 Ca -0.18 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.54 2wbi n GLU 175 Cb 0.51 0.00 -0.13 0.00 0.27 0.00 0.00 31.44 32.09 2wbi n GLU 175 CO 0.00 0.00 0.00 0.38 -0.41 0.00 0.00 177.13 177.10 2wbi h ASP 176 N 0.00 0.13 -5.39 4.31 2.03 -1.98 -3.48 116.42 112.04 2wbi h ASP 176 Ca 0.00 -0.18 -0.15 0.00 -0.73 0.00 0.00 57.03 55.97 2wbi h ASP 176 Cb 0.00 -0.04 -0.10 0.00 -0.83 0.00 0.00 39.33 38.36 2wbi h ASP 176 CO 0.00 1.15 -0.25 -0.94 -1.03 0.00 0.00 179.24 178.17 2wbi s SER 177 N -6.65 0.21 -0.05 4.15 1.04 0.11 -2.03 113.70 110.48 2wbi s SER 177 Ca -0.04 -1.17 0.04 0.00 0.48 0.00 0.00 55.95 55.26 2wbi s SER 177 Cb 0.08 0.56 -0.03 0.00 0.10 0.00 0.00 66.02 66.74 2wbi s SER 177 CO 0.83 -1.12 -0.15 -0.31 0.98 0.00 0.00 173.24 173.48 2wbi s TYR 178 N -3.80 2.68 -0.17 5.02 2.02 0.42 -1.71 117.35 121.81 2wbi s TYR 178 Ca 0.28 -0.19 -0.04 0.00 -0.37 0.00 0.00 57.07 56.75 2wbi s TYR 178 Cb 0.01 -1.62 -0.03 0.00 -0.40 0.00 0.00 41.96 39.92 2wbi s TYR 178 CO 0.13 0.16 -0.02 0.08 -1.57 0.00 0.00 175.55 174.32 2wbi s VAL 179 N -0.70 3.95 -0.12 0.71 1.01 0.48 -1.53 120.40 124.20 2wbi s VAL 179 Ca 0.11 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.77 2wbi s VAL 179 Cb -0.11 -2.74 -0.01 0.00 0.00 0.00 0.00 36.38 33.52 2wbi s VAL 179 CO 0.00 0.48 -0.16 -0.63 0.00 0.00 0.00 175.10 174.79 2wbi s ILE 180 N 0.49 2.78 -0.05 2.22 1.01 -0.05 -1.17 121.20 126.44 2wbi s ILE 180 Ca -0.03 -0.76 -0.00 0.00 0.00 0.00 0.00 60.65 59.86 2wbi s ILE 180 Cb -0.14 -2.14 0.03 0.00 0.01 0.00 0.00 42.46 40.22 2wbi s ILE 180 CO 0.03 0.54 -0.00 0.20 0.00 0.00 0.00 174.94 175.70 2wbi s ASN 181 N 0.27 0.99 0.00 3.58 0.01 -0.55 -1.67 114.94 117.57 2wbi s ASN 181 Ca -0.11 -0.06 0.00 0.00 -0.71 0.00 0.00 52.86 51.98 2wbi s ASN 181 Cb -0.16 -0.34 0.00 0.00 0.41 0.00 0.00 41.25 41.16 2wbi s ASN 181 CO 0.06 -0.13 0.00 0.61 -1.51 0.00 0.00 177.10 176.13 2wbi n GLY 182 N 4.55 -2.07 3.46 0.66 0.00 -0.33 -0.25 105.19 111.21 2wbi n GLY 182 Ca -0.18 -1.18 -0.33 0.00 0.00 0.00 0.00 46.02 44.34 2wbi n GLY 182 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wbi s LYS 183 N -1.98 2.78 0.07 1.61 1.02 -1.26 -0.11 119.74 121.87 2wbi s LYS 183 Ca 0.00 -0.67 0.05 0.00 0.02 0.00 0.00 55.97 55.37 2wbi s LYS 183 Cb 0.00 -2.48 -0.03 0.00 -0.52 0.00 0.00 37.83 34.80 2wbi s LYS 183 CO 0.00 0.51 -0.15 0.15 -0.92 0.00 0.00 175.35 174.95 2wbi s LYS 184 N -0.43 0.86 0.21 1.68 -0.14 0.10 -4.58 119.74 117.43 2wbi s LYS 184 Ca 0.05 -0.93 -0.06 0.00 -1.36 0.00 0.00 55.97 53.68 2wbi s LYS 184 Cb -0.12 -0.88 -0.03 0.00 -1.68 0.00 0.00 37.83 35.12 2wbi s LYS 184 CO 0.02 0.20 0.26 1.67 -0.76 0.00 0.00 175.35 176.74 2wbi s TRP 185 N -1.19 0.80 -1.41 3.18 1.48 -0.22 -0.62 118.94 120.96 2wbi s TRP 185 Ca -0.01 -1.09 0.00 0.00 -1.06 0.00 0.00 56.10 53.94 2wbi s TRP 185 Cb -0.10 -0.25 0.00 0.00 -1.16 0.00 0.00 33.47 31.96 2wbi s TRP 185 CO 0.02 -0.76 0.00 0.91 -4.06 0.00 0.00 176.95 173.06 2wbi n TRP 186 N -0.29 -0.48 -2.32 1.66 7.02 -1.09 -4.38 117.44 117.55 2wbi n TRP 186 Ca -0.00 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.06 2wbi n TRP 186 Cb 0.64 -3.02 -0.02 0.00 -2.42 0.00 0.00 31.31 26.49 2wbi n TRP 186 CO 0.00 0.00 0.00 -1.12 -2.02 0.00 0.00 177.69 174.55 2wbi s SER 187 N -2.49 6.14 -0.02 -0.99 0.01 -0.93 -4.69 113.70 110.74 2wbi s SER 187 Ca 0.00 0.59 -0.30 0.00 1.31 0.00 0.00 55.95 57.55 2wbi s SER 187 Cb 0.00 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.66 2wbi s SER 187 CO 0.00 -1.64 1.10 -0.44 0.41 0.00 0.00 173.24 172.67 2wbi s SER 188 N 4.58 7.19 0.00 2.44 0.01 -1.26 -1.45 113.70 125.21 2wbi s SER 188 Ca 0.59 1.76 0.00 0.00 1.31 0.00 0.00 55.95 59.61 2wbi s SER 188 Cb -0.13 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.53 2wbi s SER 188 CO 0.29 -0.43 0.00 0.61 0.41 0.00 0.00 173.24 174.12 2wbi n GLY 189 N 3.13 0.19 0.34 3.44 0.00 -0.26 -4.59 105.19 107.44 2wbi n GLY 189 Ca 0.09 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.28 2wbi n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wbi h ALA 190 N 0.00 1.64 0.00 4.61 0.00 -1.69 -1.85 119.26 121.96 2wbi h ALA 190 Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2wbi h ALA 190 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2wbi h ALA 190 CO 0.00 -0.31 -0.21 0.78 0.00 0.00 0.00 179.25 179.51 2wbi h GLY 191 N 0.00 0.00 -5.58 0.00 0.00 -1.86 -3.45 103.07 92.18 2wbi h GLY 191 Ca 0.07 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.86 2wbi h GLY 191 CO -0.00 0.00 1.21 0.21 0.00 0.00 0.00 176.54 177.96 2wbi s ASN 192 N -6.18 6.40 0.59 0.19 3.84 -0.70 -4.69 114.94 114.39 2wbi s ASN 192 Ca 0.03 2.35 0.29 0.00 0.21 0.00 0.00 52.86 55.73 2wbi s ASN 192 Cb 0.08 -2.53 1.56 0.00 -0.55 0.00 0.00 41.25 39.81 2wbi s ASN 192 CO 0.65 -1.14 1.99 -0.65 -2.79 0.00 0.00 177.10 175.16 2wbi h PRO 193 N 10.79 0.00 0.00 0.43 0.11 -1.86 0.26 132.00 141.73 2wbi h PRO 193 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2wbi h PRO 193 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2wbi h PRO 193 CO 0.95 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 180.37 2wbi n LYS 194 N -3.74 0.13 -2.18 1.05 5.02 -1.26 -4.70 118.16 112.48 2wbi n LYS 194 Ca 0.05 0.24 -0.33 0.00 -2.02 0.00 0.00 58.31 56.25 2wbi n LYS 194 Cb 0.51 -1.70 -0.04 0.00 -0.02 0.00 0.00 35.03 33.78 2wbi n LYS 194 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wbi n LYS 196 N 8.96 0.16 -3.89 0.00 4.76 -0.75 -4.75 118.16 122.66 2wbi n LYS 196 Ca 0.32 -0.13 -0.14 0.00 -2.87 0.00 0.00 58.31 55.49 2wbi n LYS 196 Cb 0.49 -1.50 -0.15 0.00 -1.84 0.00 0.00 35.03 32.03 2wbi n LYS 196 CO 0.00 0.00 0.00 -1.50 -1.37 0.00 0.00 177.40 174.53 2wbi s ILE 197 N -2.93 0.07 -0.07 -0.18 1.10 -1.21 -0.68 121.20 117.29 2wbi s ILE 197 Ca 0.10 0.05 0.05 0.00 -0.51 0.00 0.00 60.65 60.34 2wbi s ILE 197 Cb 0.17 -0.12 -0.01 0.00 0.15 0.00 0.00 42.46 42.64 2wbi s ILE 197 CO 0.81 0.07 -0.23 0.00 -2.11 0.00 0.00 174.94 173.47 2wbi s ALA 198 N 0.49 2.24 -0.26 1.50 0.00 0.78 -1.77 121.76 124.74 2wbi s ALA 198 Ca -0.04 -1.02 -0.10 0.00 0.00 0.00 0.00 51.96 50.80 2wbi s ALA 198 Cb -0.07 -0.76 -0.04 0.00 0.00 0.00 0.00 23.12 22.25 2wbi s ALA 198 CO -0.01 0.39 0.14 0.42 0.00 0.00 0.00 175.76 176.70 2wbi s ILE 199 N -0.07 4.96 -0.05 0.00 1.01 -0.72 0.01 121.20 126.33 2wbi s ILE 199 Ca -0.06 0.05 0.05 0.00 0.00 0.00 0.00 60.65 60.69 2wbi s ILE 199 Cb -0.14 -3.34 -0.00 0.00 0.01 0.00 0.00 42.46 38.98 2wbi s ILE 199 CO 0.05 0.29 -0.19 -0.69 0.00 0.00 0.00 174.94 174.40 2wbi s VAL 200 N 1.61 1.63 -0.26 2.92 1.01 -0.29 -0.23 120.40 126.80 2wbi s VAL 200 Ca 0.07 -0.82 -0.08 0.00 0.00 0.00 0.00 61.98 61.15 2wbi s VAL 200 Cb -0.15 -1.40 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 2wbi s VAL 200 CO 0.08 0.46 0.10 -0.22 0.00 0.00 0.00 175.10 175.52 2wbi s LEU 201 N 0.07 3.60 0.32 3.92 2.96 -0.66 -1.10 118.68 127.79 2wbi s LEU 201 Ca -0.06 -0.15 0.04 0.00 -0.22 0.00 0.00 54.13 53.74 2wbi s LEU 201 Cb -0.13 -1.98 -0.03 0.00 0.50 0.00 0.00 46.19 44.55 2wbi s LEU 201 CO 0.03 -0.04 0.18 -0.83 -1.32 0.00 0.00 176.35 174.38 2wbi s GLY 202 N 1.65 2.19 -0.20 7.98 0.00 -0.05 -4.83 107.32 114.05 2wbi s GLY 202 Ca 0.07 -1.74 -0.19 0.00 0.00 0.00 0.00 44.72 42.85 2wbi s GLY 202 CO 0.06 -1.59 0.53 -1.60 0.00 0.00 0.00 173.10 170.50 2wbi s ARG 203 N -3.73 4.19 -0.81 2.90 3.52 0.40 -0.96 118.95 124.47 2wbi s ARG 203 Ca 0.35 0.43 -0.08 0.00 -0.13 0.00 0.00 55.73 56.30 2wbi s ARG 203 Cb 0.04 -3.56 0.21 0.00 -1.56 0.00 0.00 34.95 30.08 2wbi s ARG 203 CO 0.19 -0.16 0.71 0.95 -0.81 0.00 0.00 175.30 176.18 2wbi s THR 204 N 1.67 4.87 0.05 4.11 -4.23 0.17 -1.09 115.64 121.18 2wbi s THR 204 Ca 0.24 -2.97 -0.30 0.00 -1.18 0.00 0.00 61.69 57.48 2wbi s THR 204 Cb -0.15 -4.04 -0.09 0.00 1.34 0.00 0.00 72.50 69.56 2wbi s THR 204 CO 0.10 -1.01 1.93 -1.58 -0.54 0.00 0.00 174.62 173.51 2wbi s GLN 205 N -0.33 4.14 -0.18 3.99 0.74 -1.26 -4.57 119.66 122.19 2wbi s GLN 205 Ca 0.21 2.59 -0.05 0.00 0.05 0.00 0.00 55.36 58.16 2wbi s GLN 205 Cb -0.13 -4.05 0.09 0.00 1.10 0.00 0.00 33.01 30.02 2wbi s GLN 205 CO -0.08 -0.93 0.32 1.21 -0.55 0.00 0.00 175.29 175.26 2wbi s ASN 206 N 4.07 0.29 0.47 6.67 3.84 -1.26 -5.04 114.94 123.99 2wbi s ASN 206 Ca 0.86 0.54 0.28 0.00 0.21 0.00 0.00 52.86 54.75 2wbi s ASN 206 Cb -0.43 0.91 0.87 0.00 -0.55 0.00 0.00 41.25 42.05 2wbi s ASN 206 CO 0.40 -0.26 1.80 0.74 -2.79 0.00 0.00 177.10 176.99 2wbi h THR 207 N 6.24 0.00 -0.01 -5.21 2.02 -2.00 -2.60 112.91 111.35 2wbi h THR 207 Ca -0.16 -0.72 0.00 0.00 0.77 0.00 0.00 66.41 66.30 2wbi h THR 207 Cb 1.12 1.71 0.00 0.00 -1.74 0.00 0.00 68.15 69.24 2wbi h THR 207 CO 0.17 0.00 -0.23 -1.54 0.37 0.00 0.00 175.52 174.30 2wbi n SER 208 N -3.02 1.29 -4.81 4.18 3.41 -1.26 -4.87 113.62 108.54 2wbi n SER 208 Ca 0.02 -1.11 -0.22 0.00 -0.26 0.00 0.00 58.87 57.31 2wbi n SER 208 Cb 0.41 0.14 -0.05 0.00 -0.26 0.00 0.00 64.21 64.46 2wbi n SER 208 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2wbi s LEU 209 N -2.39 3.42 0.64 1.04 1.43 -0.98 -5.13 118.68 116.71 2wbi s LEU 209 Ca 0.26 -0.67 -0.03 0.00 -1.03 0.00 0.00 54.13 52.67 2wbi s LEU 209 Cb 0.19 -1.98 0.06 0.00 0.03 0.00 0.00 46.19 44.49 2wbi s LEU 209 CO 0.48 -0.39 0.91 -0.94 0.23 0.00 0.00 176.35 176.64 2wbi s SER 210 N -3.96 4.95 0.43 2.29 1.04 -1.26 -4.93 113.70 112.27 2wbi s SER 210 Ca 0.41 0.19 0.25 0.00 0.48 0.00 0.00 55.95 57.28 2wbi s SER 210 Cb -0.04 -0.91 1.26 0.00 0.10 0.00 0.00 66.02 66.43 2wbi s SER 210 CO 0.25 -1.44 1.74 -0.09 0.98 0.00 0.00 173.24 174.68 2wbi h ARG 211 N -0.32 0.24 -0.02 4.02 2.43 -1.99 -0.24 114.38 118.50 2wbi h ARG 211 Ca -0.43 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 2wbi h ARG 211 Cb 1.30 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 2wbi h ARG 211 CO 0.55 0.16 -0.01 0.72 -1.51 0.00 0.00 179.97 179.88 2wbi n HIS 212 N -4.56 0.00 -1.93 2.20 8.25 -1.26 -4.05 115.22 113.87 2wbi n HIS 212 Ca 0.29 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.49 2wbi n HIS 212 Cb 1.09 -0.00 0.03 0.00 1.12 0.00 0.00 29.99 32.22 2wbi n HIS 212 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2wbi n LYS 213 N 0.26 3.46 -0.13 -0.41 4.76 -0.10 -4.74 118.16 121.25 2wbi n LYS 213 Ca 0.18 -4.04 0.07 0.00 -2.87 0.00 0.00 58.31 51.65 2wbi n LYS 213 Cb 0.38 -2.28 0.13 0.00 -1.84 0.00 0.00 35.03 31.42 2wbi n LYS 213 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2wbi n GLN 214 N -0.73 2.04 -4.21 1.97 1.13 -1.25 -4.40 117.38 111.93 2wbi n GLN 214 Ca 0.47 -1.82 -0.20 0.00 -1.94 0.00 0.00 57.00 53.51 2wbi n GLN 214 Cb 0.90 -1.30 -0.12 0.00 0.11 0.00 0.00 30.24 29.83 2wbi n GLN 214 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 2wbi s HIS 215 N -1.05 1.39 0.08 1.08 3.76 -1.26 0.42 115.29 119.70 2wbi s HIS 215 Ca 0.23 -0.45 0.00 0.00 -0.15 0.00 0.00 55.06 54.70 2wbi s HIS 215 Cb 0.13 -0.77 -0.04 0.00 1.11 0.00 0.00 32.58 33.01 2wbi s HIS 215 CO 0.18 0.10 -0.03 -1.12 -0.85 0.00 0.00 174.74 173.02 2wbi s SER 216 N -1.78 0.72 -0.07 1.40 0.01 -0.13 0.02 113.70 113.88 2wbi s SER 216 Ca 0.01 -1.04 0.04 0.00 1.31 0.00 0.00 55.95 56.26 2wbi s SER 216 Cb -0.10 0.17 -0.02 0.00 0.21 0.00 0.00 66.02 66.28 2wbi s SER 216 CO 0.03 -0.57 -0.17 -0.32 0.41 0.00 0.00 173.24 172.62 2wbi s MET 217 N -3.91 2.70 -0.07 12.44 1.75 -1.26 -0.87 119.30 130.08 2wbi s MET 217 Ca 0.12 -0.75 -0.07 0.00 -1.25 0.00 0.00 55.69 53.73 2wbi s MET 217 Cb 0.07 -2.37 0.02 0.00 2.84 0.00 0.00 34.83 35.39 2wbi s MET 217 CO -0.06 0.47 0.19 -1.50 -0.65 0.00 0.00 175.02 173.47 2wbi s ILE 218 N -0.34 0.00 0.06 10.11 2.07 -0.26 -1.38 121.20 131.46 2wbi s ILE 218 Ca 0.03 -0.03 -0.29 0.00 -1.41 0.00 0.00 60.65 58.95 2wbi s ILE 218 Cb -0.12 -0.29 -0.05 0.00 0.13 0.00 0.00 42.46 42.13 2wbi s ILE 218 CO 0.02 -0.02 0.92 -0.76 -1.91 0.00 0.00 174.94 173.20 2wbi s LEU 219 N 0.04 4.44 -0.16 8.50 1.43 -0.30 -1.13 118.68 131.50 2wbi s LEU 219 Ca -0.01 1.67 -0.03 0.00 -1.03 0.00 0.00 54.13 54.73 2wbi s LEU 219 Cb -0.02 -3.50 0.05 0.00 0.03 0.00 0.00 46.19 42.76 2wbi s LEU 219 CO 0.00 -0.11 0.05 -0.69 0.23 0.00 0.00 176.35 175.83 2wbi s VAL 220 N 0.32 0.29 0.28 -1.59 1.01 0.10 -4.85 120.40 115.97 2wbi s VAL 220 Ca 0.47 -0.31 -0.29 0.00 0.00 0.00 0.00 61.98 61.84 2wbi s VAL 220 Cb -0.22 -0.79 -0.10 0.00 0.00 0.00 0.00 36.38 35.27 2wbi s VAL 220 CO 0.28 -0.15 1.35 -2.84 0.00 0.00 0.00 175.10 173.73 2wbi s PRO 221 N 1.97 4.33 0.55 2.72 0.02 -1.26 -0.15 135.00 143.18 2wbi s PRO 221 Ca 0.01 2.22 0.23 0.00 0.02 0.00 0.00 61.00 63.47 2wbi s PRO 221 Cb -0.16 -3.10 1.46 0.00 0.02 0.00 0.00 34.50 32.72 2wbi s PRO 221 CO -0.08 -0.27 2.13 0.52 -0.33 0.00 0.00 177.00 178.97 2wbi h MET 222 N 4.25 0.00 -0.47 5.54 2.86 -1.20 -2.25 114.93 123.66 2wbi h MET 222 Ca -0.47 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.17 2wbi h MET 222 Cb 1.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.88 2wbi h MET 222 CO 0.71 0.00 0.00 0.27 1.06 0.00 0.00 176.91 178.95 2wbi n ASN 223 N -4.25 2.22 -4.71 1.22 6.94 -1.26 -4.82 115.26 110.59 2wbi n ASN 223 Ca 0.00 -2.11 -0.42 0.00 -0.02 0.00 0.00 54.58 52.03 2wbi n ASN 223 Cb 0.24 -0.33 -0.03 0.00 -2.36 0.00 0.00 39.78 37.31 2wbi n ASN 223 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2wbi s THR 224 N -1.61 3.83 0.09 5.53 2.01 -0.85 -4.96 115.64 119.68 2wbi s THR 224 Ca 0.24 1.31 -0.37 0.00 0.31 0.00 0.00 61.69 63.18 2wbi s THR 224 Cb 0.14 -3.84 -0.17 0.00 0.01 0.00 0.00 72.50 68.65 2wbi s THR 224 CO 0.14 0.09 1.35 -2.65 -0.69 0.00 0.00 174.62 172.85 2wbi n PRO 225 N 4.07 1.18 0.00 4.92 -0.02 -1.26 -1.98 135.00 141.91 2wbi n PRO 225 Ca 0.10 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 2wbi n PRO 225 Cb 0.45 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 2wbi n PRO 225 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wbi n GLY 226 N 2.54 1.80 3.61 -1.23 0.00 -1.26 -4.44 105.19 106.22 2wbi n GLY 226 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2wbi n GLY 226 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wbi s VAL 227 N -2.39 4.71 -0.13 1.61 1.01 -0.84 -0.86 120.40 123.52 2wbi s VAL 227 Ca 0.00 1.27 0.00 0.00 0.00 0.00 0.00 61.98 63.25 2wbi s VAL 227 Cb 0.00 -4.22 0.02 0.00 0.00 0.00 0.00 36.38 32.18 2wbi s VAL 227 CO 0.00 -0.34 -0.11 -0.75 0.00 0.00 0.00 175.10 173.90 2wbi s LYS 228 N 3.15 1.94 -0.23 2.72 2.47 -0.83 -4.92 119.74 124.04 2wbi s LYS 228 Ca 0.35 -0.42 -0.28 0.00 -1.56 0.00 0.00 55.97 54.06 2wbi s LYS 228 Cb -0.13 -1.84 0.01 0.00 -1.46 0.00 0.00 37.83 34.40 2wbi s LYS 228 CO 0.14 -0.23 0.99 0.42 0.16 0.00 0.00 175.35 176.83 2wbi s ILE 229 N 1.52 4.72 -0.17 5.43 1.01 -1.26 -0.43 121.20 132.02 2wbi s ILE 229 Ca 0.04 1.92 -0.15 0.00 0.00 0.00 0.00 60.65 62.46 2wbi s ILE 229 Cb -0.13 -4.27 -0.11 0.00 0.01 0.00 0.00 42.46 37.97 2wbi s ILE 229 CO -0.09 -0.15 0.01 0.40 0.00 0.00 0.00 174.94 175.11 2wbi h ILE 230 N 5.43 0.43 -1.92 2.92 1.08 -0.82 -3.49 117.51 121.15 2wbi h ILE 230 Ca -0.20 -1.56 0.01 0.00 -0.39 0.00 0.00 64.86 62.71 2wbi h ILE 230 Cb 1.07 1.05 -0.20 0.00 -3.07 0.00 0.00 36.82 35.68 2wbi h ILE 230 CO 0.95 0.15 0.35 0.00 -0.69 0.00 0.00 178.15 178.90 2wbi s ARG 231 N -2.29 0.88 0.55 2.37 1.70 -1.22 -4.99 118.95 115.95 2wbi s ARG 231 Ca -0.21 0.13 -0.15 0.00 -0.47 0.00 0.00 55.73 55.03 2wbi s ARG 231 Cb 0.04 0.41 -0.06 0.00 -0.57 0.00 0.00 34.95 34.77 2wbi s ARG 231 CO 0.39 -0.29 1.01 -1.25 -1.08 0.00 0.00 175.30 174.08 2wbi s PRO 232 N -1.45 3.75 -0.04 3.89 0.04 -1.26 -1.15 135.00 138.77 2wbi s PRO 232 Ca -0.06 0.95 0.06 0.00 0.04 0.00 0.00 61.00 62.00 2wbi s PRO 232 Cb -0.00 -2.10 -0.01 0.00 0.04 0.00 0.00 34.50 32.42 2wbi s PRO 232 CO 0.04 -0.44 -0.24 -0.51 0.04 0.00 0.00 177.00 175.89 2wbi s LEU 233 N -4.40 2.05 0.29 -3.56 1.43 0.82 -4.90 118.68 110.41 2wbi s LEU 233 Ca 0.59 -0.48 -0.00 0.00 -1.03 0.00 0.00 54.13 53.21 2wbi s LEU 233 Cb -0.11 -1.31 -0.04 0.00 0.03 0.00 0.00 46.19 44.76 2wbi s LEU 233 CO 0.37 0.26 0.49 -0.94 0.23 0.00 0.00 176.35 176.76 2wbi s SER 234 N -0.28 6.34 -0.22 2.29 1.04 -1.26 -4.50 113.70 117.11 2wbi s SER 234 Ca 0.01 0.43 0.02 0.00 0.48 0.00 0.00 55.95 56.89 2wbi s SER 234 Cb -0.12 -2.02 0.04 0.00 0.10 0.00 0.00 66.02 64.02 2wbi s SER 234 CO 0.02 -0.19 -0.14 -0.69 0.98 0.00 0.00 173.24 173.22 2wbi s VAL 235 N -2.14 2.04 -1.40 5.02 1.01 0.25 -4.67 120.40 120.51 2wbi s VAL 235 Ca 0.39 -1.28 -0.08 0.00 0.00 0.00 0.00 61.98 61.02 2wbi s VAL 235 Cb -0.10 -2.03 0.08 0.00 0.00 0.00 0.00 36.38 34.33 2wbi s VAL 235 CO 0.33 0.21 0.20 0.49 0.00 0.00 0.00 175.10 176.33 2wbi n PHE 236 N 4.54 -1.01 -1.71 5.22 3.72 -1.26 -0.33 117.46 126.64 2wbi n PHE 236 Ca -0.17 0.53 -0.16 0.00 -0.05 0.00 0.00 57.45 57.60 2wbi n PHE 236 Cb 0.46 -2.00 -0.05 0.00 -0.94 0.00 0.00 39.48 36.94 2wbi n PHE 236 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wbi n GLY 237 N -1.77 1.11 3.88 1.37 0.00 -1.26 -5.01 105.19 103.51 2wbi n GLY 237 Ca -0.12 -0.22 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 2wbi n GLY 237 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wbi s TYR 238 N -2.67 3.59 -0.46 1.61 2.02 0.56 -5.02 117.35 116.97 2wbi s TYR 238 Ca 0.00 0.60 0.16 0.00 -0.37 0.00 0.00 57.07 57.46 2wbi s TYR 238 Cb 0.00 -2.01 -0.20 0.00 -0.40 0.00 0.00 41.96 39.35 2wbi s TYR 238 CO 0.00 0.63 0.55 0.25 -1.57 0.00 0.00 175.55 175.40 2wbi n THR 239 N 1.26 0.00 -2.78 -0.71 -2.24 -1.26 -0.58 114.28 107.97 2wbi n THR 239 Ca -0.12 -0.22 -0.15 0.00 -2.27 0.00 0.00 64.05 61.29 2wbi n THR 239 Cb 0.53 0.66 0.03 0.00 -2.10 0.00 0.00 70.33 69.45 2wbi n THR 239 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2wbi n ASP 240 N -1.64 -4.54 -0.36 3.42 2.03 -1.26 -4.31 116.55 109.89 2wbi n ASP 240 Ca 0.01 -0.20 0.28 0.00 0.52 0.00 0.00 54.79 55.40 2wbi n ASP 240 Cb 0.31 -3.39 0.54 0.00 -0.72 0.00 0.00 41.12 37.86 2wbi n ASP 240 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 2wbi h ASN 241 N -0.96 0.41 -0.25 1.67 4.21 -1.94 -2.43 115.58 116.29 2wbi h ASN 241 Ca -0.35 0.16 0.01 0.00 1.21 0.00 0.00 56.30 57.33 2wbi h ASN 241 Cb 1.24 0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 38.55 2wbi h ASN 241 CO 0.37 -0.14 0.16 0.15 -1.29 0.00 0.00 177.43 176.68 2wbi h PHE 242 N 0.24 0.30 -0.38 1.19 3.57 -1.85 0.11 116.94 120.12 2wbi h PHE 242 Ca 0.75 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 62.24 2wbi h PHE 242 Cb 1.95 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 40.59 2wbi h PHE 242 CO -0.01 0.18 0.02 0.72 -2.23 0.00 0.00 178.31 177.00 2wbi n HIS 243 N -4.93 1.36 -1.72 0.41 8.25 -1.00 -4.71 115.22 112.87 2wbi n HIS 243 Ca -0.02 -0.50 -0.42 0.00 -0.26 0.00 0.00 57.72 56.52 2wbi n HIS 243 Cb 0.03 -0.38 0.00 0.00 1.12 0.00 0.00 29.99 30.77 2wbi n HIS 243 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wbi n GLY 244 N 0.35 0.70 0.00 -1.41 0.00 0.39 -4.08 105.19 101.13 2wbi n GLY 244 Ca 0.19 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.47 2wbi n GLY 244 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wbi n GLY 245 N 0.72 3.52 2.96 -0.02 0.00 -1.26 -2.58 105.19 108.54 2wbi n GLY 245 Ca 0.05 -0.45 -0.14 0.00 0.00 0.00 0.00 46.02 45.48 2wbi n GLY 245 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2wbi s HIS 246 N 2.37 -0.40 0.07 1.61 3.76 -1.26 -1.10 115.29 120.33 2wbi s HIS 246 Ca 0.00 0.87 0.08 0.00 -0.15 0.00 0.00 55.06 55.85 2wbi s HIS 246 Cb 0.00 -0.09 -0.03 0.00 1.11 0.00 0.00 32.58 33.57 2wbi s HIS 246 CO 0.00 -0.38 -0.21 -0.06 -0.85 0.00 0.00 174.74 173.24 2wbi s PHE 247 N 2.40 1.84 -0.05 1.40 0.08 -0.53 -0.13 117.98 123.00 2wbi s PHE 247 Ca 0.02 -0.39 -0.30 0.00 0.12 0.00 0.00 56.93 56.38 2wbi s PHE 247 Cb -0.12 -1.06 -0.02 0.00 -0.57 0.00 0.00 43.02 41.24 2wbi s PHE 247 CO -0.09 0.14 1.00 -2.00 -0.10 0.00 0.00 175.22 174.17 2wbi s GLU 248 N -1.46 4.49 -0.07 0.44 2.12 -0.30 -2.18 118.70 121.74 2wbi s GLU 248 Ca 0.07 1.41 0.03 0.00 0.36 0.00 0.00 54.97 56.84 2wbi s GLU 248 Cb -0.09 -3.50 0.01 0.00 0.26 0.00 0.00 34.13 30.81 2wbi s GLU 248 CO 0.03 -0.18 -0.15 0.42 -0.54 0.00 0.00 175.26 174.84 2wbi s ILE 249 N 1.51 1.31 0.05 -3.70 1.01 0.21 -0.03 121.20 121.56 2wbi s ILE 249 Ca 0.50 -0.59 0.01 0.00 0.00 0.00 0.00 60.65 60.57 2wbi s ILE 249 Cb -0.20 -1.17 -0.04 0.00 0.01 0.00 0.00 42.46 41.06 2wbi s ILE 249 CO 0.23 0.39 0.12 -1.00 0.00 0.00 0.00 174.94 174.69 2wbi s HIS 250 N 0.50 3.33 -0.29 3.97 3.76 0.43 -0.72 115.29 126.27 2wbi s HIS 250 Ca -0.13 0.18 0.03 0.00 -0.15 0.00 0.00 55.06 54.99 2wbi s HIS 250 Cb -0.15 -1.70 0.08 0.00 1.11 0.00 0.00 32.58 31.91 2wbi s HIS 250 CO 0.04 0.56 -0.04 -0.06 -0.85 0.00 0.00 174.74 174.39 2wbi s PHE 251 N -1.38 3.44 -0.54 1.40 0.08 0.84 -1.97 117.98 119.86 2wbi s PHE 251 Ca 0.29 -2.60 -0.02 0.00 0.12 0.00 0.00 56.93 54.73 2wbi s PHE 251 Cb -0.12 -2.34 0.14 0.00 -0.57 0.00 0.00 43.02 40.13 2wbi s PHE 251 CO 0.22 -0.91 0.34 1.21 -0.10 0.00 0.00 175.22 175.98 2wbi s ASN 252 N 1.03 5.17 -1.35 1.36 2.47 -0.04 -1.18 114.94 122.40 2wbi s ASN 252 Ca -0.00 -2.57 -0.07 0.00 0.42 0.00 0.00 52.86 50.63 2wbi s ASN 252 Cb -0.20 -1.83 0.02 0.00 -1.45 0.00 0.00 41.25 37.80 2wbi s ASN 252 CO -0.06 -0.42 1.09 0.00 -3.72 0.00 0.00 177.10 173.99 2wbi n GLN 253 N 3.86 -7.19 -2.88 0.43 1.13 -1.05 -4.38 117.38 107.30 2wbi n GLN 253 Ca 0.04 0.79 -0.41 0.00 -1.94 0.00 0.00 57.00 55.48 2wbi n GLN 253 Cb 0.39 -5.79 -0.04 0.00 0.11 0.00 0.00 30.24 24.91 2wbi n GLN 253 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 2wbi s VAL 254 N -3.34 4.89 -0.20 5.09 -7.23 -0.67 -4.79 120.40 114.15 2wbi s VAL 254 Ca 0.45 1.77 -0.04 0.00 -1.81 0.00 0.00 61.98 62.34 2wbi s VAL 254 Cb -0.20 -4.19 -0.02 0.00 0.56 0.00 0.00 36.38 32.53 2wbi s VAL 254 CO 0.75 0.24 -0.02 -0.60 -0.31 0.00 0.00 175.10 175.16 2wbi s ARG 255 N 0.69 3.57 0.11 4.82 3.52 -1.26 -0.87 118.95 129.52 2wbi s ARG 255 Ca 0.44 -0.55 0.06 0.00 -0.13 0.00 0.00 55.73 55.55 2wbi s ARG 255 Cb -0.20 -3.02 -0.04 0.00 -1.56 0.00 0.00 34.95 30.13 2wbi s ARG 255 CO 0.24 0.01 -0.14 0.14 -0.81 0.00 0.00 175.30 174.74 2wbi s VAL 256 N 0.98 1.25 0.44 7.11 -7.23 -0.58 -4.97 120.40 117.40 2wbi s VAL 256 Ca 0.01 -1.62 -0.25 0.00 -1.81 0.00 0.00 61.98 58.30 2wbi s VAL 256 Cb -0.14 -1.42 -0.08 0.00 0.56 0.00 0.00 36.38 35.29 2wbi s VAL 256 CO 0.01 -0.39 1.39 -2.84 -0.31 0.00 0.00 175.10 172.97 2wbi s PRO 257 N -2.49 3.76 0.54 4.82 0.02 -1.26 -0.43 135.00 139.95 2wbi s PRO 257 Ca 0.06 2.34 0.29 0.00 0.02 0.00 0.00 61.00 63.72 2wbi s PRO 257 Cb -0.06 -2.68 1.45 0.00 0.02 0.00 0.00 34.50 33.24 2wbi s PRO 257 CO 0.03 -0.73 1.93 0.00 -0.33 0.00 0.00 177.00 177.89 2wbi h ALA 258 N 2.42 2.71 0.00 -1.55 0.00 -1.70 0.96 119.26 122.09 2wbi h ALA 258 Ca -0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2wbi h ALA 258 Cb 1.26 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2wbi h ALA 258 CO 0.61 -0.93 0.00 0.25 0.00 0.00 0.00 179.25 179.18 2wbi n THR 259 N -4.29 0.00 0.70 0.00 -2.24 -1.26 -2.29 114.28 104.90 2wbi n THR 259 Ca 0.15 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.05 2wbi n THR 259 Cb 0.83 -0.57 0.21 0.00 -2.10 0.00 0.00 70.33 68.69 2wbi n THR 259 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2wbi n ASN 260 N -0.87 0.62 -4.77 3.42 4.13 0.33 -4.89 115.26 113.22 2wbi n ASN 260 Ca 0.11 0.03 -0.41 0.00 1.68 0.00 0.00 54.58 55.99 2wbi n ASN 260 Cb 0.05 0.17 -0.01 0.00 -1.54 0.00 0.00 39.78 38.45 2wbi n ASN 260 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2wbi s LEU 261 N -3.84 4.37 -0.27 3.41 2.96 -0.97 -1.14 118.68 123.20 2wbi s LEU 261 Ca 0.08 2.87 -0.15 0.00 -0.22 0.00 0.00 54.13 56.70 2wbi s LEU 261 Cb 0.15 -3.66 -0.04 0.00 0.50 0.00 0.00 46.19 43.14 2wbi s LEU 261 CO 0.71 -0.70 0.39 -0.63 -1.32 0.00 0.00 176.35 174.80 2wbi s ILE 262 N -1.12 5.16 0.00 6.68 1.01 -0.48 -4.79 121.20 127.67 2wbi s ILE 262 Ca 0.51 0.61 0.00 0.00 0.00 0.00 0.00 60.65 61.77 2wbi s ILE 262 Cb -0.43 -3.71 0.00 0.00 0.01 0.00 0.00 42.46 38.33 2wbi s ILE 262 CO 0.58 0.15 0.00 -0.11 0.00 0.00 0.00 174.94 175.56 2wbi n LEU 263 N 5.35 0.00 0.00 2.97 7.94 -1.26 -4.65 117.00 127.36 2wbi n LEU 263 Ca -0.08 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.82 2wbi n LEU 263 Cb 0.51 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.46 2wbi n LEU 263 CO 0.37 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.26 2wbi n GLY 264 N 0.00 1.27 3.74 -3.96 0.00 -1.26 -5.10 105.19 99.88 2wbi n GLY 264 Ca 0.00 -0.56 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 2wbi n GLY 264 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wbi s GLU 265 N -2.00 4.32 0.00 1.61 2.02 -1.26 -2.77 118.70 120.62 2wbi s GLU 265 Ca 0.00 2.18 0.00 0.00 0.02 0.00 0.00 54.97 57.17 2wbi s GLU 265 Cb 0.00 -3.17 0.00 0.00 0.10 0.00 0.00 34.13 31.06 2wbi s GLU 265 CO 0.00 -0.37 0.00 0.41 0.02 0.00 0.00 175.26 175.32 2wbi n GLY 266 N 2.60 0.57 1.19 -1.39 0.00 -1.17 -4.94 105.19 102.04 2wbi n GLY 266 Ca 0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.21 2wbi n GLY 266 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wbi n ARG 267 N -2.00 2.55 -0.28 1.61 5.12 -1.00 -4.56 116.66 118.11 2wbi n ARG 267 Ca 0.00 -2.37 -0.09 0.00 -1.93 0.00 0.00 57.85 53.46 2wbi n ARG 267 Cb 0.00 -1.52 -0.08 0.00 -1.16 0.00 0.00 32.46 29.70 2wbi n ARG 267 CO 0.00 0.00 0.00 0.78 -1.93 0.00 0.00 177.63 176.48 2wbi h GLY 268 N 4.36 -1.23 0.59 -0.13 0.00 -0.65 -2.06 103.07 103.95 2wbi h GLY 268 Ca 0.00 0.85 0.07 0.00 0.00 0.00 0.00 47.33 48.24 2wbi h GLY 268 CO 0.00 -0.19 0.26 0.74 0.00 0.00 0.00 176.54 177.35 2wbi h PHE 269 N -0.08 0.47 -0.51 5.60 0.04 -1.82 -1.53 116.94 119.11 2wbi h PHE 269 Ca 0.11 0.02 0.10 0.00 2.80 0.00 0.00 57.97 61.01 2wbi h PHE 269 Cb 0.36 -0.13 -0.09 0.00 2.20 0.00 0.00 35.95 38.29 2wbi h PHE 269 CO -0.94 0.19 -0.10 1.49 -0.60 0.00 0.00 178.31 178.35 2wbi h GLU 270 N 0.49 0.02 -0.48 1.51 4.81 -1.78 -0.26 114.58 118.89 2wbi h GLU 270 Ca 0.27 -0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.37 2wbi h GLU 270 Cb 0.24 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 2wbi h GLU 270 CO -0.22 0.01 -0.18 0.82 -0.73 0.00 0.00 179.01 178.71 2wbi h ILE 271 N 0.02 1.27 -0.31 2.32 2.04 -0.69 0.44 117.51 122.61 2wbi h ILE 271 Ca 0.25 -1.34 -0.07 0.00 1.00 0.00 0.00 64.86 64.70 2wbi h ILE 271 Cb 0.38 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 2wbi h ILE 271 CO -0.51 0.46 -0.11 0.77 0.00 0.00 0.00 178.15 178.77 2wbi h SER 272 N 0.82 0.50 -0.35 1.72 4.64 -0.91 0.61 113.55 120.58 2wbi h SER 272 Ca 0.11 -0.13 -0.12 0.00 -0.47 0.00 0.00 61.79 61.19 2wbi h SER 272 Cb 0.75 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 2wbi h SER 272 CO 0.06 0.65 -0.24 1.56 -0.87 0.00 0.00 176.83 177.99 2wbi h GLN 273 N 0.48 0.79 -0.72 4.77 7.50 -0.73 0.53 115.11 127.73 2wbi h GLN 273 Ca 0.09 -0.37 0.09 0.00 0.50 0.00 0.00 58.65 58.96 2wbi h GLN 273 Cb 0.48 -0.01 -0.07 0.00 0.05 0.00 0.00 27.48 27.93 2wbi h GLN 273 CO 0.03 1.00 0.37 0.78 -1.50 0.00 0.00 178.83 179.51 2wbi h GLY 274 N 0.57 1.09 1.15 3.46 0.00 -0.21 -2.60 103.07 106.53 2wbi h GLY 274 Ca 0.07 -0.24 -0.33 0.00 0.00 0.00 0.00 47.33 46.83 2wbi h GLY 274 CO 0.06 0.08 -1.58 0.07 0.00 0.00 0.00 176.54 175.17 2wbi h ARG 275 N 0.63 0.38 0.00 4.80 0.11 -0.77 -3.38 114.38 116.16 2wbi h ARG 275 Ca 0.35 -0.65 -0.07 0.00 0.10 0.00 0.00 59.98 59.70 2wbi h ARG 275 Cb 0.35 0.24 -0.01 0.00 1.11 0.00 0.00 29.97 31.66 2wbi h ARG 275 CO -0.26 1.29 -0.35 -0.07 0.10 0.00 0.00 179.97 180.68 2wbi h LEU 276 N 0.10 0.00 0.18 0.08 3.38 -0.84 -2.52 115.31 115.70 2wbi h LEU 276 Ca -0.28 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.70 2wbi h LEU 276 Cb 2.09 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.80 2wbi h LEU 276 CO 0.20 0.35 -0.48 1.23 0.09 0.00 0.00 178.44 179.83 2wbi h GLY 277 N 2.24 -1.18 0.94 0.83 0.00 -1.64 0.96 103.07 105.22 2wbi h GLY 277 Ca -0.00 0.62 0.01 0.00 0.00 0.00 0.00 47.33 47.96 2wbi h GLY 277 CO 0.05 -0.30 0.11 -2.55 0.00 0.00 0.00 176.54 173.84 2wbi h PRO 278 N -0.73 0.22 -0.66 4.80 0.11 -1.78 -2.24 132.00 131.72 2wbi h PRO 278 Ca -0.02 -0.01 0.10 0.00 0.11 0.00 0.00 66.00 66.18 2wbi h PRO 278 Cb 0.71 -0.05 -0.11 0.00 0.11 0.00 0.00 31.00 31.66 2wbi h PRO 278 CO -0.22 0.14 -0.44 0.78 -0.21 0.00 0.00 178.00 178.06 2wbi h GLY 279 N 0.23 -0.41 0.05 -0.55 0.00 -1.10 0.23 103.07 101.51 2wbi h GLY 279 Ca 0.08 0.57 0.08 0.00 0.00 0.00 0.00 47.33 48.06 2wbi h GLY 279 CO -0.04 -0.15 -0.18 3.21 0.00 0.00 0.00 176.54 179.38 2wbi h ARG 280 N -0.18 -0.10 -0.14 4.80 3.08 0.11 -2.61 114.38 119.34 2wbi h ARG 280 Ca 0.20 0.01 -0.15 0.00 0.07 0.00 0.00 59.98 60.11 2wbi h ARG 280 Cb 0.56 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.62 2wbi h ARG 280 CO -0.74 -0.06 -0.55 0.97 -1.07 0.00 0.00 179.97 178.51 2wbi h ILE 281 N -0.10 1.34 -0.72 2.04 2.10 -0.41 -2.80 117.51 118.96 2wbi h ILE 281 Ca 0.20 -1.83 -0.06 0.00 1.08 0.00 0.00 64.86 64.25 2wbi h ILE 281 Cb 0.40 1.83 -0.03 0.00 -1.09 0.00 0.00 36.82 37.94 2wbi h ILE 281 CO -0.47 0.56 0.21 0.45 -1.08 0.00 0.00 178.15 177.82 2wbi h HIS 282 N 0.33 1.17 -0.83 2.19 3.86 -0.45 -0.66 115.15 120.78 2wbi h HIS 282 Ca 0.00 -0.12 -0.02 0.00 -1.16 0.00 0.00 60.37 59.07 2wbi h HIS 282 Cb 1.07 -0.34 -0.04 0.00 1.06 0.00 0.00 27.41 29.17 2wbi h HIS 282 CO 0.04 0.93 0.43 0.45 0.86 0.00 0.00 177.93 180.64 2wbi h HIS 283 N 1.08 1.15 -0.22 2.45 3.86 -1.37 -2.11 115.15 120.00 2wbi h HIS 283 Ca 0.23 -0.04 -0.06 0.00 -1.16 0.00 0.00 60.37 59.34 2wbi h HIS 283 Cb 0.32 -0.36 -0.01 0.00 1.06 0.00 0.00 27.41 28.42 2wbi h HIS 283 CO 0.03 0.81 -0.11 0.00 0.86 0.00 0.00 177.93 179.52 2wbi h MET 285 N 0.16 0.24 -0.67 0.00 2.86 -1.01 -1.40 114.93 115.12 2wbi h MET 285 Ca 0.05 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.66 2wbi h MET 285 Cb 0.61 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 2wbi h MET 285 CO 0.03 0.16 0.36 0.00 1.06 0.00 0.00 176.91 178.53 2wbi h ARG 286 N 0.25 0.92 -0.71 1.72 3.08 -1.28 -2.59 114.38 115.78 2wbi h ARG 286 Ca 0.27 -0.10 0.01 0.00 0.07 0.00 0.00 59.98 60.24 2wbi h ARG 286 Cb 0.38 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 30.21 2wbi h ARG 286 CO -0.35 0.68 0.47 1.15 -1.07 0.00 0.00 179.97 180.85 2wbi h THR 287 N 0.93 1.16 -0.61 2.04 2.02 -0.49 -1.26 112.91 116.69 2wbi h THR 287 Ca 0.24 -0.32 0.03 0.00 0.77 0.00 0.00 66.41 67.13 2wbi h THR 287 Cb 0.03 0.15 -0.04 0.00 -1.74 0.00 0.00 68.15 66.54 2wbi h THR 287 CO -0.04 0.17 0.37 0.58 0.37 0.00 0.00 175.52 176.97 2wbi h VAL 288 N 0.93 1.05 -0.41 3.16 2.07 -1.09 0.63 116.25 122.60 2wbi h VAL 288 Ca 0.27 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 67.50 2wbi h VAL 288 Cb -0.06 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 2wbi h VAL 288 CO -0.06 0.13 0.08 1.23 0.02 0.00 0.00 177.57 178.97 2wbi h GLY 289 N 0.71 0.71 0.06 2.17 0.00 -1.44 -1.48 103.07 103.80 2wbi h GLY 289 Ca 0.25 -0.46 0.11 0.00 0.00 0.00 0.00 47.33 47.23 2wbi h GLY 289 CO -0.12 0.43 -0.03 -2.00 0.00 0.00 0.00 176.54 174.83 2wbi h LEU 290 N 0.52 -0.29 -0.57 3.11 6.46 -0.73 -1.24 115.31 122.57 2wbi h LEU 290 Ca 0.13 0.14 -0.04 0.00 -0.12 0.00 0.00 57.88 57.98 2wbi h LEU 290 Cb 0.34 0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 40.50 2wbi h LEU 290 CO 0.00 -0.11 0.20 0.00 -0.62 0.00 0.00 178.44 177.92 2wbi h ALA 291 N 1.50 0.75 -0.12 1.25 0.00 -0.49 -1.51 119.26 120.64 2wbi h ALA 291 Ca 0.27 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2wbi h ALA 291 Cb 0.42 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2wbi h ALA 291 CO -0.48 0.39 -0.15 1.49 0.00 0.00 0.00 179.25 180.51 2wbi h GLU 292 N 0.80 0.19 -0.14 0.00 4.57 -0.84 -0.98 114.58 118.18 2wbi h GLU 292 Ca 0.19 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.29 2wbi h GLU 292 Cb 0.25 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.81 2wbi h GLU 292 CO -0.01 0.34 -0.03 -0.09 -1.18 0.00 0.00 179.01 178.05 2wbi h ARG 293 N 0.18 0.26 -0.57 1.92 9.65 -0.62 -2.49 114.38 122.71 2wbi h ARG 293 Ca 0.04 -0.10 0.08 0.00 -1.10 0.00 0.00 59.98 58.90 2wbi h ARG 293 Cb 0.38 -0.02 -0.07 0.00 -1.39 0.00 0.00 29.97 28.87 2wbi h ARG 293 CO 0.02 0.54 0.21 0.00 2.80 0.00 0.00 179.97 183.55 2wbi h ALA 294 N 0.71 0.72 -0.21 2.80 0.00 -0.68 -0.07 119.26 122.53 2wbi h ALA 294 Ca 0.04 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 2wbi h ALA 294 Cb 0.44 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2wbi h ALA 294 CO 0.01 -0.19 -0.27 1.25 0.00 0.00 0.00 179.25 180.05 2wbi h LEU 295 N 0.40 0.40 -0.31 0.00 5.85 -1.23 0.11 115.31 120.52 2wbi h LEU 295 Ca 0.28 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 2wbi h LEU 295 Cb 0.32 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 2wbi h LEU 295 CO -0.28 0.66 0.12 -0.61 -0.34 0.00 0.00 178.44 177.99 2wbi h GLN 296 N 0.35 0.47 -0.65 1.25 4.15 -0.93 -1.76 115.11 117.99 2wbi h GLN 296 Ca 0.05 -0.09 -0.07 0.00 0.77 0.00 0.00 58.65 59.31 2wbi h GLN 296 Cb 0.66 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.24 2wbi h GLN 296 CO 0.05 0.49 0.14 0.82 -1.93 0.00 0.00 178.83 178.40 2wbi h ILE 297 N 0.35 1.25 -0.96 2.39 2.04 -0.28 -1.91 117.51 120.40 2wbi h ILE 297 Ca 0.10 -0.95 0.01 0.00 1.00 0.00 0.00 64.86 65.02 2wbi h ILE 297 Cb 0.20 0.60 -0.05 0.00 -0.74 0.00 0.00 36.82 36.84 2wbi h ILE 297 CO -0.01 0.36 0.62 -0.03 0.00 0.00 0.00 178.15 179.10 2wbi h MET 298 N 0.98 1.27 0.21 2.37 4.05 -0.60 -2.00 114.93 121.22 2wbi h MET 298 Ca 0.20 -0.08 -0.32 0.00 -0.28 0.00 0.00 59.70 59.22 2wbi h MET 298 Cb 0.37 -0.28 0.03 0.00 -0.80 0.00 0.00 31.60 30.92 2wbi h MET 298 CO 0.00 0.85 -1.40 0.00 0.23 0.00 0.00 176.91 176.59 2wbi h GLU 300 N 0.15 0.45 -0.10 0.00 5.08 -1.29 -2.84 114.58 116.02 2wbi h GLU 300 Ca -0.22 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.09 2wbi h GLU 300 Cb 2.10 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 31.24 2wbi h GLU 300 CO 0.26 0.30 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.47 2wbi h ARG 301 N 0.46 0.18 0.00 2.33 9.65 -1.38 -2.49 114.38 123.13 2wbi h ARG 301 Ca 0.24 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 59.06 2wbi h ARG 301 Cb 0.19 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.76 2wbi h ARG 301 CO -0.20 0.45 0.00 0.00 2.80 0.00 0.00 179.97 183.02 2wbi n ALA 302 N -2.30 1.24 -0.01 2.80 0.00 -0.50 -1.45 120.51 120.29 2wbi n ALA 302 Ca -0.06 -0.01 0.06 0.00 0.00 0.00 0.00 53.44 53.42 2wbi n ALA 302 Cb 0.21 -1.06 -0.11 0.00 0.00 0.00 0.00 19.45 18.49 2wbi n ALA 302 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2wbi n THR 303 N -1.44 0.07 1.38 0.00 -2.24 -1.08 -1.75 114.28 109.22 2wbi n THR 303 Ca 0.01 -0.34 0.14 0.00 -2.27 0.00 0.00 64.05 61.59 2wbi n THR 303 Cb 0.04 0.11 0.55 0.00 -2.10 0.00 0.00 70.33 68.94 2wbi n THR 303 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wbi n GLN 304 N -2.02 0.79 -4.37 -0.78 6.02 -0.53 -4.88 117.38 111.61 2wbi n GLN 304 Ca -0.04 -0.34 -0.28 0.00 -0.01 0.00 0.00 57.00 56.33 2wbi n GLN 304 Cb 0.41 -1.49 -0.17 0.00 1.02 0.00 0.00 30.24 30.01 2wbi n GLN 304 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2wbi s ARG 305 N -2.44 2.07 -0.30 -1.09 1.81 -1.13 -5.08 118.95 112.79 2wbi s ARG 305 Ca 0.29 -0.50 -0.11 0.00 -1.72 0.00 0.00 55.73 53.68 2wbi s ARG 305 Cb 0.20 -1.81 -0.03 0.00 -0.45 0.00 0.00 34.95 32.86 2wbi s ARG 305 CO 0.48 -0.09 0.19 0.42 -0.68 0.00 0.00 175.30 175.62 2wbi s ILE 306 N 1.07 5.13 -0.04 1.52 1.09 -1.26 -1.50 121.20 127.21 2wbi s ILE 306 Ca -0.05 -0.07 0.03 0.00 -1.10 0.00 0.00 60.65 59.45 2wbi s ILE 306 Cb -0.15 -3.53 0.01 0.00 -1.06 0.00 0.00 42.46 37.73 2wbi s ILE 306 CO -0.02 0.14 -0.11 0.00 -0.10 0.00 0.00 174.94 174.85 2wbi s ALA 307 N 1.72 1.05 -1.48 9.38 0.00 -0.54 -4.81 121.76 127.08 2wbi s ALA 307 Ca 0.06 -0.39 -0.10 0.00 0.00 0.00 0.00 51.96 51.53 2wbi s ALA 307 Cb -0.17 -0.41 0.06 0.00 0.00 0.00 0.00 23.12 22.61 2wbi s ALA 307 CO 0.10 0.15 0.90 1.19 0.00 0.00 0.00 175.76 178.10 2wbi n PHE 308 N 3.43 -2.19 -1.16 0.00 3.72 -1.26 -2.98 117.46 117.02 2wbi n PHE 308 Ca -0.20 0.89 -0.05 0.00 -0.05 0.00 0.00 57.45 58.04 2wbi n PHE 308 Cb 0.53 -4.06 -0.02 0.00 -0.94 0.00 0.00 39.48 34.98 2wbi n PHE 308 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2wbi n LYS 309 N -4.59 -0.55 -3.94 -1.08 5.02 -1.26 -5.01 118.16 106.75 2wbi n LYS 309 Ca -0.05 0.61 -0.10 0.00 -2.02 0.00 0.00 58.31 56.75 2wbi n LYS 309 Cb 0.57 -4.34 -0.11 0.00 -0.02 0.00 0.00 35.03 31.12 2wbi n LYS 309 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2wbi s LYS 310 N -2.13 0.29 0.72 1.97 1.02 -1.16 -5.14 119.74 115.31 2wbi s LYS 310 Ca 0.00 -0.47 -0.15 0.00 0.02 0.00 0.00 55.97 55.37 2wbi s LYS 310 Cb 0.00 0.11 0.03 0.00 -0.52 0.00 0.00 37.83 37.45 2wbi s LYS 310 CO 0.00 -0.05 1.17 0.15 -0.92 0.00 0.00 175.35 175.70 2wbi s LYS 311 N -1.20 2.27 0.42 1.68 1.02 -1.26 -1.46 119.74 121.20 2wbi s LYS 311 Ca -0.13 1.64 0.11 0.00 0.02 0.00 0.00 55.97 57.60 2wbi s LYS 311 Cb -0.08 -1.86 0.92 0.00 -0.52 0.00 0.00 37.83 36.29 2wbi s LYS 311 CO -0.00 -1.71 2.01 -0.07 -0.92 0.00 0.00 175.35 174.65 2wbi h LEU 312 N -0.30 0.22 -0.43 3.17 3.38 -0.90 -1.47 115.31 118.99 2wbi h LEU 312 Ca -0.47 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2wbi h LEU 312 Cb 1.28 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2wbi h LEU 312 CO 0.50 0.28 0.00 0.00 0.09 0.00 0.00 178.44 179.31 2wbi n TYR 313 N -4.38 0.40 1.20 1.13 0.18 -0.72 -1.65 117.16 113.32 2wbi n TYR 313 Ca -0.00 0.17 0.13 0.00 1.88 0.00 0.00 57.90 60.07 2wbi n TYR 313 Cb 0.18 -0.77 0.41 0.00 -0.38 0.00 0.00 39.34 38.78 2wbi n TYR 313 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2wbi n ALA 314 N -1.64 3.09 -2.57 -3.48 0.00 -0.55 -4.14 120.51 111.22 2wbi n ALA 314 Ca 0.02 -0.34 -0.42 0.00 0.00 0.00 0.00 53.44 52.70 2wbi n ALA 314 Cb 0.17 -1.19 -0.05 0.00 0.00 0.00 0.00 19.45 18.37 2wbi n ALA 314 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2wbi s HIS 315 N -2.66 3.07 0.53 0.00 3.76 -0.66 -4.95 115.29 114.38 2wbi s HIS 315 Ca 0.21 0.40 0.24 0.00 -0.15 0.00 0.00 55.06 55.75 2wbi s HIS 315 Cb 0.19 -3.47 1.37 0.00 1.11 0.00 0.00 32.58 31.78 2wbi s HIS 315 CO 0.56 -0.81 2.02 1.49 -0.85 0.00 0.00 174.74 177.15 2wbi h GLU 316 N 8.65 0.00 -0.70 1.40 4.81 -1.85 0.22 114.58 127.12 2wbi h GLU 316 Ca -0.25 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.92 2wbi h GLU 316 Cb 1.09 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.44 2wbi h GLU 316 CO 0.92 0.00 0.19 0.28 -0.73 0.00 0.00 179.01 179.67 2wbi h VAL 317 N 0.00 1.26 -0.30 0.32 2.07 -1.92 0.81 116.25 118.49 2wbi h VAL 317 Ca 0.21 -0.93 -0.13 0.00 0.82 0.00 0.00 66.70 66.68 2wbi h VAL 317 Cb 0.84 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 31.12 2wbi h VAL 317 CO -0.00 0.36 -0.30 0.58 0.02 0.00 0.00 177.57 178.22 2wbi h VAL 318 N 1.05 1.30 -0.55 2.57 2.07 -0.83 -2.35 116.25 119.51 2wbi h VAL 318 Ca 0.22 -1.47 0.11 0.00 0.82 0.00 0.00 66.70 66.38 2wbi h VAL 318 Cb 0.34 1.56 -0.10 0.00 -1.52 0.00 0.00 31.29 31.57 2wbi h VAL 318 CO -0.00 0.47 -0.06 0.00 0.02 0.00 0.00 177.57 178.00 2wbi h ALA 319 N 0.71 0.46 0.00 1.67 0.00 -1.06 -2.10 119.26 118.95 2wbi h ALA 319 Ca 0.05 0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 2wbi h ALA 319 Cb 0.88 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2wbi h ALA 319 CO 0.08 -0.41 -0.30 0.45 0.00 0.00 0.00 179.25 179.06 2wbi h HIS 320 N 0.06 0.00 -0.41 0.00 3.86 -0.59 -1.72 115.15 116.35 2wbi h HIS 320 Ca 0.28 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.44 2wbi h HIS 320 Cb 0.43 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.89 2wbi h HIS 320 CO -0.39 0.30 0.08 -1.49 0.86 0.00 0.00 177.93 177.29 2wbi h TRP 321 N 0.00 0.71 -0.08 2.45 6.55 -0.87 -0.36 115.95 124.35 2wbi h TRP 321 Ca -0.00 -0.09 0.03 0.00 0.95 0.00 0.00 58.89 59.78 2wbi h TRP 321 Cb 0.79 -0.20 -0.04 0.00 -0.86 0.00 0.00 29.16 28.86 2wbi h TRP 321 CO 0.00 0.69 -0.15 0.82 -1.05 0.00 0.00 178.44 178.74 2wbi h ILE 322 N 0.53 0.61 0.33 1.49 2.04 -0.72 -0.83 117.51 120.95 2wbi h ILE 322 Ca 0.13 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.98 2wbi h ILE 322 Cb 0.35 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 2wbi h ILE 322 CO 0.01 0.00 -0.27 0.00 0.00 0.00 0.00 178.15 177.89 2wbi h ALA 323 N 0.80 -0.59 -0.87 1.87 0.00 -1.31 -1.55 119.26 117.60 2wbi h ALA 323 Ca 0.08 -0.10 0.15 0.00 0.00 0.00 0.00 54.91 55.04 2wbi h ALA 323 Cb 0.32 0.36 -0.07 0.00 0.00 0.00 0.00 17.79 18.40 2wbi h ALA 323 CO -0.20 -0.86 0.57 0.93 0.00 0.00 0.00 179.25 179.68 2wbi h GLU 324 N -0.60 0.60 -0.40 0.00 4.39 -0.95 -1.12 114.58 116.50 2wbi h GLU 324 Ca -0.02 -0.04 -0.06 0.00 0.34 0.00 0.00 59.36 59.58 2wbi h GLU 324 Cb 0.53 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 2wbi h GLU 324 CO -0.02 0.40 0.01 0.77 -1.16 0.00 0.00 179.01 179.01 2wbi h SER 325 N 0.62 0.68 -0.04 1.42 0.02 -0.79 -1.14 113.55 114.32 2wbi h SER 325 Ca 0.44 -0.30 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2wbi h SER 325 Cb 0.80 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 2wbi h SER 325 CO -0.19 0.81 0.01 -0.09 -1.14 0.00 0.00 176.83 176.23 2wbi h ARG 326 N 0.53 0.03 -0.54 3.45 9.65 -0.23 -1.60 114.38 125.68 2wbi h ARG 326 Ca 0.12 -0.00 0.10 0.00 -1.10 0.00 0.00 59.98 59.09 2wbi h ARG 326 Cb 0.46 -0.01 -0.08 0.00 -1.39 0.00 0.00 29.97 28.95 2wbi h ARG 326 CO 0.02 0.02 0.11 0.82 2.80 0.00 0.00 179.97 183.74 2wbi h ILE 327 N 0.03 0.69 -0.68 1.20 2.04 -1.20 -2.36 117.51 117.24 2wbi h ILE 327 Ca 0.02 -0.08 -0.05 0.00 1.00 0.00 0.00 64.86 65.75 2wbi h ILE 327 Cb 0.01 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.49 2wbi h ILE 327 CO -0.02 0.04 0.24 0.00 0.00 0.00 0.00 178.15 178.41 2wbi h ALA 328 N 1.42 0.88 0.08 1.87 0.00 -0.79 -2.12 119.26 120.60 2wbi h ALA 328 Ca 0.27 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2wbi h ALA 328 Cb 0.38 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2wbi h ALA 328 CO -0.36 0.54 -0.04 0.82 0.00 0.00 0.00 179.25 180.21 2wbi h ILE 329 N 0.98 0.99 -0.37 0.00 2.04 -0.92 -0.89 117.51 119.32 2wbi h ILE 329 Ca 0.22 -0.23 0.07 0.00 1.00 0.00 0.00 64.86 65.92 2wbi h ILE 329 Cb 0.26 1.14 -0.06 0.00 -0.74 0.00 0.00 36.82 37.42 2wbi h ILE 329 CO -0.01 0.06 0.02 -0.33 0.00 0.00 0.00 178.15 177.88 2wbi h GLU 330 N -0.21 0.12 -0.43 2.37 4.39 -1.35 0.20 114.58 119.67 2wbi h GLU 330 Ca -0.01 -0.01 0.07 0.00 0.34 0.00 0.00 59.36 59.75 2wbi h GLU 330 Cb 0.18 -0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 28.74 2wbi h GLU 330 CO 0.02 0.08 0.06 0.87 -1.16 0.00 0.00 179.01 178.87 2wbi h LYS 331 N 0.12 0.17 0.07 2.33 1.57 -1.12 -2.02 116.57 117.70 2wbi h LYS 331 Ca 0.18 -0.01 -0.24 0.00 -1.87 0.00 0.00 60.65 58.71 2wbi h LYS 331 Cb 0.25 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 2wbi h LYS 331 CO -0.29 0.11 -1.10 -0.84 -0.57 0.00 0.00 179.45 176.77 2wbi h ILE 332 N 0.18 1.56 -0.28 1.86 3.07 -0.51 -1.64 117.51 121.74 2wbi h ILE 332 Ca 0.21 -3.06 0.04 0.00 1.55 0.00 0.00 64.86 63.60 2wbi h ILE 332 Cb 0.28 2.81 -0.04 0.00 -0.27 0.00 0.00 36.82 39.60 2wbi h ILE 332 CO -0.30 0.89 0.05 -0.09 -1.05 0.00 0.00 178.15 177.65 2wbi h ARG 333 N 0.06 0.15 -0.65 0.16 2.43 -0.56 0.95 114.38 116.93 2wbi h ARG 333 Ca -0.08 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.10 2wbi h ARG 333 Cb 1.81 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 31.29 2wbi h ARG 333 CO 0.17 0.10 0.41 -0.07 -1.51 0.00 0.00 179.97 179.07 2wbi h LEU 334 N 0.15 0.69 -0.79 3.80 3.38 -1.31 0.05 115.31 121.29 2wbi h LEU 334 Ca 0.13 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.97 2wbi h LEU 334 Cb 0.14 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2wbi h LEU 334 CO -0.17 0.49 -0.39 0.25 0.09 0.00 0.00 178.44 178.70 2wbi h LEU 335 N 0.83 0.46 -0.44 1.67 5.85 -0.96 0.71 115.31 123.42 2wbi h LEU 335 Ca 0.25 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2wbi h LEU 335 Cb -0.03 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 2wbi h LEU 335 CO -0.08 0.81 0.28 0.74 -0.34 0.00 0.00 178.44 179.85 2wbi h THR 336 N 0.37 1.13 -0.17 1.05 2.02 -0.38 -1.90 112.91 115.03 2wbi h THR 336 Ca 0.03 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 66.93 2wbi h THR 336 Cb 0.85 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 2wbi h THR 336 CO 0.07 0.13 0.04 -0.07 0.37 0.00 0.00 175.52 176.06 2wbi h LEU 337 N 0.59 0.27 -0.67 2.58 3.38 -0.46 -0.80 115.31 120.19 2wbi h LEU 337 Ca 0.16 -0.24 0.14 0.00 0.09 0.00 0.00 57.88 58.04 2wbi h LEU 337 Cb -0.03 -0.07 -0.11 0.00 0.09 0.00 0.00 40.66 40.54 2wbi h LEU 337 CO -0.03 0.43 0.05 0.50 0.09 0.00 0.00 178.44 179.48 2wbi h LYS 338 N 0.09 0.15 -0.25 1.13 1.63 -0.84 0.64 116.57 119.11 2wbi h LYS 338 Ca 0.05 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.84 2wbi h LYS 338 Cb 0.27 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.86 2wbi h LYS 338 CO 0.00 0.10 0.14 0.00 -3.45 0.00 0.00 179.45 176.24 2wbi h ALA 339 N 1.60 0.33 -0.31 5.00 0.00 -1.03 -1.65 119.26 123.19 2wbi h ALA 339 Ca 0.36 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.22 2wbi h ALA 339 Cb 0.61 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2wbi h ALA 339 CO -0.54 -0.14 0.17 0.00 0.00 0.00 0.00 179.25 178.73 2wbi h ALA 340 N 1.01 0.39 -0.16 0.00 0.00 -0.41 -1.92 119.26 118.17 2wbi h ALA 340 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2wbi h ALA 340 Cb 0.07 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2wbi h ALA 340 CO -0.01 -0.21 0.06 1.25 0.00 0.00 0.00 179.25 180.34 2wbi h HIS 341 N 0.35 0.22 -0.17 0.00 6.17 -0.73 -1.50 115.15 119.48 2wbi h HIS 341 Ca 0.13 -0.00 -0.03 0.00 0.71 0.00 0.00 60.37 61.18 2wbi h HIS 341 Cb 0.03 -0.07 -0.01 0.00 2.52 0.00 0.00 27.41 29.88 2wbi h HIS 341 CO -0.09 0.18 -0.02 0.77 0.71 0.00 0.00 177.93 179.48 2wbi h SER 342 N 0.23 0.31 -0.80 3.26 0.02 -0.61 -2.75 113.55 113.21 2wbi h SER 342 Ca 0.06 -0.34 0.10 0.00 -0.84 0.00 0.00 61.79 60.77 2wbi h SER 342 Cb 0.05 -0.09 -0.07 0.00 0.14 0.00 0.00 62.40 62.43 2wbi h SER 342 CO -0.01 0.58 0.44 0.24 -1.14 0.00 0.00 176.83 176.95 2wbi h MET 343 N 0.04 0.72 -0.91 3.45 2.86 -0.68 0.68 114.93 121.09 2wbi h MET 343 Ca 0.05 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.66 2wbi h MET 343 Cb 0.43 -0.16 -0.05 0.00 0.06 0.00 0.00 31.60 31.88 2wbi h MET 343 CO 0.01 0.48 0.60 -0.44 1.06 0.00 0.00 176.91 178.62 2wbi h ASP 344 N 0.74 1.01 0.00 1.22 3.32 -1.23 0.23 116.42 121.71 2wbi h ASP 344 Ca 0.39 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.42 2wbi h ASP 344 Cb 0.38 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.68 2wbi h ASP 344 CO -0.26 0.72 -1.12 0.35 -1.72 0.00 0.00 179.24 177.21 2wbi n THR 345 N -4.42 0.00 0.00 0.35 -2.24 -0.60 -4.58 114.28 102.79 2wbi n THR 345 Ca 0.11 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 2wbi n THR 345 Cb 0.06 0.73 0.00 0.00 -2.10 0.00 0.00 70.33 69.02 2wbi n THR 345 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2wbi n LEU 346 N -1.62 0.00 0.00 3.22 4.77 0.23 -5.08 117.00 118.52 2wbi n LEU 346 Ca 0.01 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 2wbi n LEU 346 Cb 0.33 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 2wbi n LEU 346 CO 0.36 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 2wbi n GLY 347 N 1.19 -2.08 0.25 -0.72 0.00 0.06 -3.91 105.19 99.99 2wbi n GLY 347 Ca 0.00 -1.50 0.16 0.00 0.00 0.00 0.00 46.02 44.68 2wbi n GLY 347 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2wbi h SER 348 N 0.00 0.00 0.01 1.61 4.64 -1.91 -2.28 113.55 115.62 2wbi h SER 348 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wbi h SER 348 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2wbi h SER 348 CO 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2wbi h ALA 349 N 2.05 -0.01 0.00 5.18 0.00 -1.95 -3.22 119.26 121.31 2wbi h ALA 349 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2wbi h ALA 349 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2wbi h ALA 349 CO 0.00 -0.20 0.00 0.41 0.00 0.00 0.00 179.25 179.46 2wbi n GLY 350 N 0.55 -0.95 1.09 0.00 0.00 -1.00 -1.38 105.19 103.48 2wbi n GLY 350 Ca -0.09 0.01 0.10 0.00 0.00 0.00 0.00 46.02 46.04 2wbi n GLY 350 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wbi n ALA 351 N -1.59 2.32 -0.33 4.61 0.00 -0.89 -4.70 120.51 119.93 2wbi n ALA 351 Ca 0.02 -1.21 -0.07 0.00 0.00 0.00 0.00 53.44 52.18 2wbi n ALA 351 Cb 0.14 -0.75 -0.05 0.00 0.00 0.00 0.00 19.45 18.79 2wbi n ALA 351 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2wbi n LYS 352 N 1.25 -0.31 0.01 0.00 4.81 -0.48 -1.56 118.16 121.87 2wbi n LYS 352 Ca 0.19 1.22 -0.11 0.00 -0.87 0.00 0.00 58.31 58.75 2wbi n LYS 352 Cb 0.55 -1.80 -0.05 0.00 0.02 0.00 0.00 35.03 33.75 2wbi n LYS 352 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 2wbi h LYS 353 N 0.00 0.01 -0.26 1.64 3.64 -1.85 -1.57 116.57 118.17 2wbi h LYS 353 Ca 0.16 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.50 2wbi h LYS 353 Cb 0.37 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 2wbi h LYS 353 CO -0.77 0.00 -0.01 0.93 -2.27 0.00 0.00 179.45 177.34 2wbi h GLU 354 N 0.01 0.40 -0.21 1.90 3.07 -1.71 -1.73 114.58 116.31 2wbi h GLU 354 Ca 0.04 -0.07 -0.09 0.00 -0.50 0.00 0.00 59.36 58.74 2wbi h GLU 354 Cb 0.06 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 27.90 2wbi h GLU 354 CO -0.08 0.43 -0.22 0.82 -1.40 0.00 0.00 179.01 178.56 2wbi h ILE 355 N 0.39 1.33 -0.70 3.13 2.04 -0.75 -2.69 117.51 120.26 2wbi h ILE 355 Ca 0.09 -1.40 0.12 0.00 1.00 0.00 0.00 64.86 64.67 2wbi h ILE 355 Cb 0.27 1.76 -0.08 0.00 -0.74 0.00 0.00 36.82 38.03 2wbi h ILE 355 CO 0.01 0.43 0.27 0.00 0.00 0.00 0.00 178.15 178.86 2wbi h ALA 356 N 0.64 0.94 -0.64 1.87 0.00 -1.10 -0.74 119.26 120.23 2wbi h ALA 356 Ca 0.03 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2wbi h ALA 356 Cb 0.78 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 2wbi h ALA 356 CO 0.05 -0.19 0.33 0.52 0.00 0.00 0.00 179.25 179.97 2wbi h MET 357 N 0.44 0.91 -0.01 0.00 2.86 -1.15 -2.14 114.93 115.84 2wbi h MET 357 Ca 0.37 -0.12 -0.19 0.00 -2.06 0.00 0.00 59.70 57.69 2wbi h MET 357 Cb 0.51 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 2wbi h MET 357 CO -0.36 0.71 -0.85 0.97 1.06 0.00 0.00 176.91 178.43 2wbi h ILE 358 N 0.88 1.47 -0.34 -1.22 6.09 -1.28 -2.06 117.51 121.06 2wbi h ILE 358 Ca 0.22 -2.54 -0.02 0.00 -1.37 0.00 0.00 64.86 61.16 2wbi h ILE 358 Cb 0.08 2.41 -0.02 0.00 0.47 0.00 0.00 36.82 39.76 2wbi h ILE 358 CO -0.03 0.74 0.12 0.50 -3.07 0.00 0.00 178.15 176.41 2wbi h LYS 359 N 0.13 0.48 0.04 2.19 1.63 -0.80 -1.15 116.57 119.09 2wbi h LYS 359 Ca -0.04 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 59.69 2wbi h LYS 359 Cb 1.47 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 33.01 2wbi h LYS 359 CO 0.13 0.41 -0.02 0.28 -3.45 0.00 0.00 179.45 176.81 2wbi h VAL 360 N 0.48 1.25 0.15 2.00 2.07 -1.36 -3.40 116.25 117.44 2wbi h VAL 360 Ca 0.12 -1.72 -0.01 0.00 0.82 0.00 0.00 66.70 65.91 2wbi h VAL 360 Cb 0.12 2.27 0.00 0.00 -1.52 0.00 0.00 31.29 32.17 2wbi h VAL 360 CO -0.01 0.39 -0.07 0.00 0.02 0.00 0.00 177.57 177.90 2wbi h ALA 361 N -0.17 -0.20 0.97 1.67 0.00 -1.19 -3.36 119.26 116.99 2wbi h ALA 361 Ca -0.01 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 2wbi h ALA 361 Cb 0.68 0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.55 2wbi h ALA 361 CO 0.01 -0.57 -0.48 0.00 0.00 0.00 0.00 179.25 178.21 2wbi h ALA 362 N 0.54 -1.35 -0.91 0.00 0.00 -1.43 -2.65 119.26 113.46 2wbi h ALA 362 Ca -0.02 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.62 2wbi h ALA 362 Cb 0.23 0.52 -0.05 0.00 0.00 0.00 0.00 17.79 18.50 2wbi h ALA 362 CO 0.03 -1.26 0.60 -1.35 0.00 0.00 0.00 179.25 177.27 2wbi h PRO 363 N -1.32 1.18 -0.24 0.00 0.11 -1.78 -1.57 132.00 128.39 2wbi h PRO 363 Ca -0.13 -0.07 -0.16 0.00 0.11 0.00 0.00 66.00 65.75 2wbi h PRO 363 Cb 1.02 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 31.86 2wbi h PRO 363 CO 0.21 0.78 -0.50 0.07 -0.21 0.00 0.00 178.00 178.35 2wbi h ARG 364 N 1.21 0.65 -0.13 1.05 0.11 -1.70 0.00 114.38 115.59 2wbi h ARG 364 Ca 0.34 -0.39 -0.01 0.00 0.10 0.00 0.00 59.98 60.02 2wbi h ARG 364 Cb -0.11 0.03 -0.01 0.00 1.11 0.00 0.00 29.97 31.00 2wbi h ARG 364 CO -0.08 1.00 0.03 0.00 0.10 0.00 0.00 179.97 181.02 2wbi h ALA 365 N 0.93 0.17 -0.28 0.08 0.00 -1.14 -2.57 119.26 116.44 2wbi h ALA 365 Ca 0.02 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.65 2wbi h ALA 365 Cb 1.05 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2wbi h ALA 365 CO 0.10 -0.19 -0.38 0.28 0.00 0.00 0.00 179.25 179.06 2wbi h VAL 366 N -0.00 1.29 -0.74 0.00 2.07 -1.27 -2.05 116.25 115.55 2wbi h VAL 366 Ca 0.04 -1.54 0.15 0.00 0.82 0.00 0.00 66.70 66.18 2wbi h VAL 366 Cb 0.27 1.49 -0.10 0.00 -1.52 0.00 0.00 31.29 31.43 2wbi h VAL 366 CO 0.00 0.49 0.22 -1.28 0.02 0.00 0.00 177.57 177.03 2wbi h SER 367 N 0.53 0.11 -0.45 0.57 0.87 -0.96 0.27 113.55 114.49 2wbi h SER 367 Ca 0.05 0.13 -0.08 0.00 -1.23 0.00 0.00 61.79 60.67 2wbi h SER 367 Cb 0.89 0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.99 2wbi h SER 367 CO 0.08 0.01 -0.02 0.50 -0.53 0.00 0.00 176.83 176.87 2wbi h LYS 368 N 0.33 0.81 -0.46 2.24 3.64 -0.98 -1.52 116.57 120.62 2wbi h LYS 368 Ca 0.41 -0.27 0.01 0.00 -1.27 0.00 0.00 60.65 59.53 2wbi h LYS 368 Cb 0.68 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.41 2wbi h LYS 368 CO -0.47 0.88 0.31 0.82 -2.27 0.00 0.00 179.45 178.71 2wbi h ILE 369 N 0.66 1.12 -0.55 2.00 2.04 -0.71 -1.62 117.51 120.44 2wbi h ILE 369 Ca 0.13 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.76 2wbi h ILE 369 Cb 0.52 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 2wbi h ILE 369 CO 0.03 0.11 0.28 0.58 0.00 0.00 0.00 178.15 179.15 2wbi h VAL 370 N 0.63 1.19 -0.33 1.67 2.07 -0.84 -0.99 116.25 119.65 2wbi h VAL 370 Ca 0.17 -0.53 -0.05 0.00 0.82 0.00 0.00 66.70 67.11 2wbi h VAL 370 Cb -0.07 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 2wbi h VAL 370 CO -0.04 0.22 -0.00 -0.78 0.02 0.00 0.00 177.57 176.98 2wbi h ASP 371 N 0.74 0.48 -0.25 0.57 3.58 -0.99 0.10 116.42 120.65 2wbi h ASP 371 Ca 0.19 -0.09 -0.17 0.00 0.42 0.00 0.00 57.03 57.39 2wbi h ASP 371 Cb 0.09 -0.12 -0.00 0.00 1.72 0.00 0.00 39.33 41.01 2wbi h ASP 371 CO -0.03 0.55 -0.46 -0.50 -2.88 0.00 0.00 179.24 175.92 2wbi h TRP 372 N 0.49 1.00 -0.79 0.28 6.55 -1.12 -2.51 115.95 119.86 2wbi h TRP 372 Ca 0.11 -0.32 -0.02 0.00 0.95 0.00 0.00 58.89 59.60 2wbi h TRP 372 Cb 0.33 -0.20 -0.04 0.00 -0.86 0.00 0.00 29.16 28.39 2wbi h TRP 372 CO 0.01 1.12 0.40 0.00 -1.05 0.00 0.00 178.44 178.92 2wbi h ALA 373 N 0.82 1.22 -0.57 1.49 0.00 -0.21 -1.21 119.26 120.80 2wbi h ALA 373 Ca 0.04 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 2wbi h ALA 373 Cb 1.04 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2wbi h ALA 373 CO 0.10 0.61 0.07 0.82 0.00 0.00 0.00 179.25 180.86 2wbi h ILE 374 N 1.11 1.25 -0.27 0.00 2.04 -0.78 -2.17 117.51 118.70 2wbi h ILE 374 Ca 0.27 -0.98 -0.13 0.00 1.00 0.00 0.00 64.86 65.03 2wbi h ILE 374 Cb 0.08 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 2wbi h ILE 374 CO -0.04 0.36 -0.36 -0.61 0.00 0.00 0.00 178.15 177.50 2wbi h GLN 375 N 0.87 0.60 -0.09 2.37 5.75 -0.93 -2.49 115.11 121.19 2wbi h GLN 375 Ca 0.18 -0.29 -0.12 0.00 -0.15 0.00 0.00 58.65 58.27 2wbi h GLN 375 Cb 0.41 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.95 2wbi h GLN 375 CO 0.01 0.87 -0.47 0.28 -2.65 0.00 0.00 178.83 176.87 2wbi h VAL 376 N 0.50 1.34 0.00 2.39 2.07 -0.98 -2.90 116.25 118.66 2wbi h VAL 376 Ca 0.05 -1.67 0.00 0.00 0.82 0.00 0.00 66.70 65.90 2wbi h VAL 376 Cb 0.86 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 32.42 2wbi h VAL 376 CO 0.07 0.49 0.00 0.00 0.02 0.00 0.00 177.57 178.16 2wbi n GLY 378 N 1.09 0.84 0.40 0.00 0.00 -1.10 -2.47 105.19 103.95 2wbi n GLY 378 Ca 0.19 -0.68 0.22 0.00 0.00 0.00 0.00 46.02 45.75 2wbi n GLY 378 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wbi h GLY 379 N 0.00 0.00 2.00 -0.02 0.00 -1.91 -0.78 103.07 102.36 2wbi h GLY 379 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2wbi h GLY 379 CO 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 176.54 176.45 2wbi h ALA 380 N 1.61 1.55 -0.64 3.60 0.00 -1.82 -2.89 119.26 120.67 2wbi h ALA 380 Ca 0.27 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.10 2wbi h ALA 380 Cb 1.18 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2wbi h ALA 380 CO -0.00 0.12 0.42 0.78 0.00 0.00 0.00 179.25 180.57 2wbi h GLY 381 N 0.44 0.90 0.30 0.00 0.00 -1.17 -1.36 103.07 102.18 2wbi h GLY 381 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2wbi h GLY 381 CO 0.01 0.32 -0.15 3.33 0.00 0.00 0.00 176.54 180.05 2wbi n VAL 382 N -4.44 0.00 -2.49 4.60 0.24 -1.09 -3.54 118.33 111.61 2wbi n VAL 382 Ca 0.07 -0.13 -0.24 0.00 -2.04 0.00 0.00 64.34 62.00 2wbi n VAL 382 Cb 0.05 0.25 0.04 0.00 -1.47 0.00 0.00 33.84 32.71 2wbi n VAL 382 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2wbi s SER 383 N -2.37 5.24 0.21 -1.34 1.04 -0.51 -4.83 113.70 111.14 2wbi s SER 383 Ca 0.29 0.32 0.20 0.00 0.48 0.00 0.00 55.95 57.24 2wbi s SER 383 Cb 0.20 -1.19 0.89 0.00 0.10 0.00 0.00 66.02 66.03 2wbi s SER 383 CO 0.46 -1.23 1.60 0.00 0.98 0.00 0.00 173.24 175.05 2wbi n GLN 384 N -2.55 0.13 0.01 4.02 0.00 -1.26 -3.36 117.38 114.37 2wbi n GLN 384 Ca 0.07 0.46 0.11 0.00 0.00 0.00 0.00 57.00 57.63 2wbi n GLN 384 Cb 0.59 -1.81 0.47 0.00 0.00 0.00 0.00 30.24 29.49 2wbi n GLN 384 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2wbi n ASP 385 N -2.07 0.05 -4.22 2.61 8.00 -1.26 -4.77 116.55 114.89 2wbi n ASP 385 Ca 0.01 0.51 -0.13 0.00 0.71 0.00 0.00 54.79 55.89 2wbi n ASP 385 Cb 0.15 -0.52 -0.10 0.00 -0.02 0.00 0.00 41.12 40.63 2wbi n ASP 385 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2wbi s TYR 386 N -3.01 1.14 -2.03 1.24 2.02 -1.21 -5.05 117.35 110.44 2wbi s TYR 386 Ca 0.10 -0.85 0.12 0.00 -0.37 0.00 0.00 57.07 56.08 2wbi s TYR 386 Cb 0.14 -0.61 0.37 0.00 -0.40 0.00 0.00 41.96 41.46 2wbi s TYR 386 CO 0.41 -0.04 1.30 -0.35 -1.57 0.00 0.00 175.55 175.30 2wbi n PRO 387 N -0.16 1.84 -0.17 -1.71 -0.04 -1.26 -4.40 135.00 129.10 2wbi n PRO 387 Ca -0.10 -1.30 -0.08 0.00 -0.04 0.00 0.00 63.50 61.97 2wbi n PRO 387 Cb 0.61 -1.30 0.05 0.00 -0.04 0.00 0.00 33.50 32.83 2wbi n PRO 387 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2wbi h LEU 388 N 2.17 0.96 -0.79 1.53 3.38 -1.88 -1.38 115.31 119.29 2wbi h LEU 388 Ca 0.00 -0.30 -0.09 0.00 0.09 0.00 0.00 57.88 57.59 2wbi h LEU 388 Cb 0.49 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2wbi h LEU 388 CO 0.00 1.06 -0.03 0.00 0.09 0.00 0.00 178.44 179.56 2wbi h ALA 389 N 1.03 0.99 -0.12 1.53 0.00 -1.76 0.25 119.26 121.17 2wbi h ALA 389 Ca 0.15 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2wbi h ALA 389 Cb 0.61 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2wbi h ALA 389 CO 0.04 0.61 0.03 -0.91 0.00 0.00 0.00 179.25 179.02 2wbi h ASN 390 N 0.80 0.18 -0.83 0.00 2.35 -1.83 -2.54 115.58 113.72 2wbi h ASN 390 Ca 0.15 -0.24 0.10 0.00 -0.55 0.00 0.00 56.30 55.76 2wbi h ASN 390 Cb 0.53 -0.05 -0.07 0.00 0.05 0.00 0.00 38.32 38.78 2wbi h ASN 390 CO 0.03 0.37 0.47 0.24 -1.65 0.00 0.00 177.43 176.89 2wbi h MET 391 N -0.01 0.77 -0.49 0.81 2.86 -0.82 -0.61 114.93 117.44 2wbi h MET 391 Ca 0.04 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 2wbi h MET 391 Cb 0.26 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 2wbi h MET 391 CO 0.00 0.51 0.28 -0.92 1.06 0.00 0.00 176.91 177.84 2wbi h TYR 392 N 0.79 0.66 -1.01 -0.22 3.20 -0.39 -2.21 116.97 117.79 2wbi h TYR 392 Ca 0.40 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.32 2wbi h TYR 392 Cb 0.37 -0.21 -0.06 0.00 1.54 0.00 0.00 36.73 38.36 2wbi h TYR 392 CO -0.06 0.47 0.65 0.00 -1.64 0.00 0.00 178.16 177.59 2wbi h ALA 393 N 1.13 1.38 -0.40 1.82 0.00 -0.89 -0.37 119.26 121.94 2wbi h ALA 393 Ca 0.17 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2wbi h ALA 393 Cb 0.02 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 2wbi h ALA 393 CO -0.03 0.49 0.13 0.82 0.00 0.00 0.00 179.25 180.66 2wbi h ILE 394 N 1.22 1.21 -0.04 0.00 2.04 -0.87 -2.55 117.51 118.52 2wbi h ILE 394 Ca 0.42 -0.68 -0.19 0.00 1.00 0.00 0.00 64.86 65.41 2wbi h ILE 394 Cb 0.10 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 2wbi h ILE 394 CO -0.16 0.24 -0.78 0.71 0.00 0.00 0.00 178.15 178.16 2wbi h THR 395 N 0.50 1.42 -0.88 -0.27 1.35 -0.85 -2.60 112.91 111.58 2wbi h THR 395 Ca 0.13 -2.30 -0.02 0.00 -0.55 0.00 0.00 66.41 63.67 2wbi h THR 395 Cb 0.24 2.24 -0.04 0.00 -1.73 0.00 0.00 68.15 68.86 2wbi h THR 395 CO -0.01 0.68 0.48 -0.09 -0.25 0.00 0.00 175.52 176.33 2wbi h ARG 396 N 0.20 1.24 0.00 4.72 9.65 -1.05 -2.69 114.38 126.44 2wbi h ARG 396 Ca -0.04 -0.15 -0.09 0.00 -1.10 0.00 0.00 59.98 58.60 2wbi h ARG 396 Cb 1.37 -0.24 -0.01 0.00 -1.39 0.00 0.00 29.97 29.70 2wbi h ARG 396 CO 0.13 0.91 -0.45 0.28 2.80 0.00 0.00 179.97 183.64 2wbi h VAL 397 N 1.24 1.01 0.00 0.20 2.07 -1.20 -2.96 116.25 116.60 2wbi h VAL 397 Ca 0.31 -1.75 0.00 0.00 0.82 0.00 0.00 66.70 66.08 2wbi h VAL 397 Cb 0.04 2.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.85 2wbi h VAL 397 CO -0.05 0.44 0.00 0.18 0.02 0.00 0.00 177.57 178.16 2wbi n LEU 398 N -3.55 0.41 0.00 2.57 4.77 -1.00 -0.33 117.00 119.87 2wbi n LEU 398 Ca -0.00 0.56 0.10 0.00 -0.03 0.00 0.00 56.01 56.64 2wbi n LEU 398 Cb 0.56 -0.46 0.53 0.00 -2.33 0.00 0.00 43.42 41.73 2wbi n LEU 398 CO 0.38 -0.22 0.84 0.54 -1.33 0.00 0.00 177.39 177.61 2wbi n ARG 399 N -1.90 0.27 0.01 3.23 1.74 -1.12 -4.18 116.66 114.71 2wbi n ARG 399 Ca 0.05 0.09 -0.00 0.00 -0.77 0.00 0.00 57.85 57.22 2wbi n ARG 399 Cb 0.32 -1.50 -0.00 0.00 -1.02 0.00 0.00 32.46 30.26 2wbi n ARG 399 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2wbi n LEU 400 N -1.31 0.30 -4.74 0.55 4.77 -0.26 -2.23 117.00 114.08 2wbi n LEU 400 Ca 0.10 0.04 -0.35 0.00 -0.03 0.00 0.00 56.01 55.76 2wbi n LEU 400 Cb 0.18 -0.09 0.07 0.00 -2.33 0.00 0.00 43.42 41.24 2wbi n LEU 400 CO 0.17 -0.18 0.82 0.00 -1.33 0.00 0.00 177.39 176.87 2wbi s ALA 401 N -2.01 2.32 -1.60 -1.18 0.00 0.55 -2.40 121.76 117.44 2wbi s ALA 401 Ca -0.01 0.94 0.00 0.00 0.00 0.00 0.00 51.96 52.89 2wbi s ALA 401 Cb 0.00 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.66 2wbi s ALA 401 CO 0.01 -1.56 0.00 -0.25 0.00 0.00 0.00 175.76 173.96 2wbi n ASP 402 N -2.22 -4.76 0.00 0.00 8.00 -1.26 -4.60 116.55 111.71 2wbi n ASP 402 Ca 0.14 0.37 0.00 0.00 0.71 0.00 0.00 54.79 56.01 2wbi n ASP 402 Cb 0.50 -4.04 0.00 0.00 -0.02 0.00 0.00 41.12 37.56 2wbi n ASP 402 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wbi n GLY 403 N -0.15 2.90 3.78 0.44 0.00 -1.01 -4.95 105.19 106.21 2wbi n GLY 403 Ca -0.15 -1.30 -0.33 0.00 0.00 0.00 0.00 46.02 44.24 2wbi n GLY 403 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2wbi s PRO 404 N -5.25 2.88 0.14 1.61 0.02 -1.12 -4.51 135.00 128.78 2wbi s PRO 404 Ca 0.00 1.34 -0.27 0.00 0.02 0.00 0.00 61.00 62.09 2wbi s PRO 404 Cb 0.00 -1.96 -0.03 0.00 0.02 0.00 0.00 34.50 32.53 2wbi s PRO 404 CO 0.00 -1.18 1.59 -0.44 -0.33 0.00 0.00 177.00 176.64 2wbi h ASP 405 N 0.05 -1.26 -1.08 2.53 3.32 -1.79 -1.39 116.42 116.81 2wbi h ASP 405 Ca -0.47 0.18 0.30 0.00 0.02 0.00 0.00 57.03 57.06 2wbi h ASP 405 Cb 1.24 0.53 -0.11 0.00 0.22 0.00 0.00 39.33 41.21 2wbi h ASP 405 CO 0.55 -0.39 0.68 -0.33 -1.72 0.00 0.00 179.24 178.02 2wbi h GLU 406 N -0.42 0.35 -0.18 3.56 3.07 -1.92 0.79 114.58 119.84 2wbi h GLU 406 Ca 0.10 -0.02 -0.19 0.00 -0.50 0.00 0.00 59.36 58.75 2wbi h GLU 406 Cb 0.60 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 2wbi h GLU 406 CO -0.44 0.23 -0.66 0.28 -1.40 0.00 0.00 179.01 177.03 2wbi h VAL 407 N 0.36 1.31 -0.23 3.13 2.07 -1.62 -2.43 116.25 118.84 2wbi h VAL 407 Ca 0.65 -1.90 -0.15 0.00 0.82 0.00 0.00 66.70 66.12 2wbi h VAL 407 Cb 1.65 1.87 -0.01 0.00 -1.52 0.00 0.00 31.29 33.28 2wbi h VAL 407 CO -0.37 0.60 -0.47 0.45 0.02 0.00 0.00 177.57 177.79 2wbi h HIS 408 N 0.49 0.73 -0.72 1.57 3.86 -0.73 -2.56 115.15 117.79 2wbi h HIS 408 Ca -0.02 -0.23 -0.05 0.00 -1.16 0.00 0.00 60.37 58.91 2wbi h HIS 408 Cb 1.25 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 29.54 2wbi h HIS 408 CO 0.06 0.96 0.27 -0.07 0.86 0.00 0.00 177.93 180.01 2wbi h LEU 409 N 0.48 1.01 -0.74 2.43 3.38 -0.99 -1.00 115.31 119.88 2wbi h LEU 409 Ca 0.03 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 2wbi h LEU 409 Cb 1.00 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 2wbi h LEU 409 CO 0.09 0.92 0.21 0.28 0.09 0.00 0.00 178.44 180.03 2wbi h SER 410 N 1.05 1.09 -0.25 -0.43 0.02 -1.34 -0.65 113.55 113.04 2wbi h SER 410 Ca 0.24 -0.22 -0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2wbi h SER 410 Cb 0.24 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 2wbi h SER 410 CO -0.02 1.02 0.14 0.00 -1.14 0.00 0.00 176.83 176.84 2wbi h ALA 411 N 1.11 0.32 -0.38 3.77 0.00 -1.05 -1.73 119.26 121.29 2wbi h ALA 411 Ca 0.24 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.13 2wbi h ALA 411 Cb 0.34 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2wbi h ALA 411 CO -0.00 -0.16 0.15 0.82 0.00 0.00 0.00 179.25 180.06 2wbi h ILE 412 N 0.30 0.91 -0.76 0.00 2.04 -1.03 -0.69 117.51 118.28 2wbi h ILE 412 Ca 0.09 -0.11 0.06 0.00 1.00 0.00 0.00 64.86 65.91 2wbi h ILE 412 Cb 0.05 0.57 -0.06 0.00 -0.74 0.00 0.00 36.82 36.63 2wbi h ILE 412 CO -0.02 0.06 0.44 0.00 0.00 0.00 0.00 178.15 178.64 2wbi h ALA 413 N 1.24 1.04 -0.11 1.87 0.00 -0.95 0.25 119.26 122.60 2wbi h ALA 413 Ca 0.17 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 2wbi h ALA 413 Cb 0.14 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2wbi h ALA 413 CO -0.17 0.14 0.06 1.15 0.00 0.00 0.00 179.25 180.43 2wbi h THR 414 N 0.80 1.10 -0.50 0.00 2.02 -0.89 -1.80 112.91 113.65 2wbi h THR 414 Ca 0.34 -0.28 -0.03 0.00 0.77 0.00 0.00 66.41 67.21 2wbi h THR 414 Cb 0.21 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 2wbi h THR 414 CO -0.19 0.09 0.20 0.24 0.37 0.00 0.00 175.52 176.24 2wbi h MET 415 N 0.08 0.75 -0.24 6.66 2.07 -0.76 -2.18 114.93 121.30 2wbi h MET 415 Ca 0.04 -0.13 0.02 0.00 -2.07 0.00 0.00 59.70 57.56 2wbi h MET 415 Cb 0.09 -0.12 -0.03 0.00 -1.87 0.00 0.00 31.60 29.67 2wbi h MET 415 CO -0.01 0.66 0.09 1.49 1.07 0.00 0.00 176.91 180.22 2wbi h GLU 416 N 0.67 0.20 0.00 1.72 4.57 -0.41 -1.16 114.58 120.17 2wbi h GLU 416 Ca 0.17 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.31 2wbi h GLU 416 Cb 0.19 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.73 2wbi h GLU 416 CO -0.01 0.13 -0.11 -0.07 -1.18 0.00 0.00 179.01 177.77 2wbi h LEU 417 N 0.20 0.00 -0.04 1.64 3.38 -1.14 0.32 115.31 119.67 2wbi h LEU 417 Ca 0.11 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.97 2wbi h LEU 417 Cb 0.07 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.83 2wbi h LEU 417 CO -0.11 0.11 -0.40 0.03 0.09 0.00 0.00 178.44 178.16 2wbi h ARG 418 N 0.00 0.34 -0.48 1.13 3.08 -0.83 -2.63 114.38 114.98 2wbi h ARG 418 Ca -0.00 -0.31 -0.10 0.00 0.07 0.00 0.00 59.98 59.64 2wbi h ARG 418 Cb 0.34 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 2wbi h ARG 418 CO 0.01 0.98 -0.08 -0.44 -1.07 0.00 0.00 179.97 179.37 2wbi h ASP 419 N -0.18 0.85 -0.49 7.04 3.32 -0.53 -0.00 116.42 126.43 2wbi h ASP 419 Ca -0.04 -0.25 -0.05 0.00 0.02 0.00 0.00 57.03 56.71 2wbi h ASP 419 Cb 1.09 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.38 2wbi h ASP 419 CO 0.08 0.96 0.13 -0.61 -1.72 0.00 0.00 179.24 178.09 2wbi h GLN 420 N 0.79 0.83 -0.25 3.56 5.75 -0.49 -2.31 115.11 123.00 2wbi h GLN 420 Ca 0.13 -0.17 -0.08 0.00 -0.15 0.00 0.00 58.65 58.38 2wbi h GLN 420 Cb 0.58 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 29.00 2wbi h GLN 420 CO 0.04 0.75 -0.17 0.00 -2.65 0.00 0.00 178.83 176.79 2wbi h ALA 421 N 1.34 0.35 -0.06 3.38 0.00 -1.02 -3.25 119.26 120.01 2wbi h ALA 421 Ca 0.18 -0.34 0.03 0.00 0.00 0.00 0.00 54.91 54.78 2wbi h ALA 421 Cb 0.29 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 2wbi h ALA 421 CO -0.00 0.27 -0.44 0.87 0.00 0.00 0.00 179.25 179.94 2wbi h LYS 422 N 0.27 -0.54 -0.01 0.00 1.57 -0.68 -2.27 116.57 114.90 2wbi h LYS 422 Ca 0.05 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2wbi h LYS 422 Cb 0.71 0.12 -0.00 0.00 0.08 0.00 0.00 32.23 33.14 2wbi h LYS 422 CO 0.05 -0.36 0.20 0.00 -0.57 0.00 0.00 179.45 178.77 2wbi h ARG 423 N -0.56 0.00 0.00 3.15 3.08 -1.48 0.10 114.38 118.67 2wbi h ARG 423 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 2wbi h ARG 423 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.71 2wbi h ARG 423 CO -0.36 0.00 -0.51 1.28 -1.07 0.00 0.00 179.97 179.31 2wbi n LEU 424 N -3.01 0.73 0.00 3.04 4.77 -0.87 -5.13 117.00 116.53 2wbi n LEU 424 Ca -0.02 0.29 0.08 0.00 -0.03 0.00 0.00 56.01 56.33 2wbi n LEU 424 Cb 0.26 -0.20 0.46 0.00 -2.33 0.00 0.00 43.42 41.61 2wbi n LEU 424 CO 0.17 -0.08 0.67 0.35 -1.33 0.00 0.00 177.39 177.16